data_25800
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25800
_Entry.PDB_ID 2N7C
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 25800
_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 0 0 HIS HA H 0 4.590 4.590 4.274 0.316 25800
2 1 1 . 1 1 0 0 HIS C C 0 174.000 174.000 175.101 -1.101 25800
3 1 1 . 1 1 0 0 HIS CA C 0 55.300 55.300 57.038 -1.738 25800
4 1 1 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.290 -0.990 25800
5 1 1 . 1 1 1 1 MET N N 1 122.400 122.400 121.855 0.545 25800
6 1 1 . 1 1 1 1 MET HA H 1 4.340 4.340 4.153 0.187 25800
7 1 1 . 1 1 1 1 MET C C 1 175.600 175.600 176.227 -0.627 25800
8 1 1 . 1 1 1 1 MET CA C 1 55.600 55.600 55.966 -0.366 25800
9 1 1 . 1 1 1 1 MET CB C 1 32.800 32.800 31.812 0.988 25800
10 1 1 . 1 1 1 1 MET H H 1 8.310 8.310 7.187 1.123 25800
11 1 1 . 1 1 2 2 VAL N N 2 123.200 123.200 129.811 -6.611 25800
12 1 1 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.022 -0.062 25800
13 1 1 . 1 1 2 2 VAL C C 2 175.600 175.600 176.238 -0.638 25800
14 1 1 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.960 -0.660 25800
15 1 1 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.601 -0.301 25800
16 1 1 . 1 1 2 2 VAL H H 2 8.180 8.180 8.563 -0.383 25800
17 1 1 . 1 1 3 3 ILE N N 3 126.200 126.200 119.641 6.559 25800
18 1 1 . 1 1 3 3 ILE HA H 3 4.050 4.050 3.784 0.266 25800
19 1 1 . 1 1 3 3 ILE C C 3 175.800 175.800 175.801 -0.001 25800
20 1 1 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.432 -0.732 25800
21 1 1 . 1 1 3 3 ILE CB C 3 38.300 38.300 36.904 1.396 25800
22 1 1 . 1 1 3 3 ILE H H 3 8.230 8.230 8.197 0.033 25800
23 1 1 . 1 1 4 4 ARG N N 4 126.100 126.100 122.845 3.255 25800
24 1 1 . 1 1 4 4 ARG HA H 4 4.180 4.180 3.883 0.297 25800
25 1 1 . 1 1 4 4 ARG C C 4 175.900 175.900 175.600 0.300 25800
26 1 1 . 1 1 4 4 ARG CA C 4 56.000 56.000 57.266 -1.266 25800
27 1 1 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.341 0.359 25800
28 1 1 . 1 1 4 4 ARG H H 4 8.360 8.360 8.278 0.082 25800
29 1 1 . 1 1 5 5 GLU N N 5 122.200 122.200 118.031 4.169 25800
30 1 1 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.088 0.052 25800
31 1 1 . 1 1 5 5 GLU C C 5 176.100 176.100 175.863 0.237 25800
32 1 1 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.299 -0.699 25800
33 1 1 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.769 0.531 25800
34 1 1 . 1 1 5 5 GLU H H 5 8.400 8.400 8.501 -0.101 25800
35 1 1 . 1 1 6 6 SER N N 6 116.200 116.200 112.539 3.661 25800
36 1 1 . 1 1 6 6 SER HA H 6 4.350 4.350 4.131 0.219 25800
37 1 1 . 1 1 6 6 SER C C 6 174.300 174.300 173.141 1.159 25800
38 1 1 . 1 1 6 6 SER CA C 6 58.200 58.200 58.637 -0.437 25800
39 1 1 . 1 1 6 6 SER CB C 6 63.800 63.800 63.361 0.439 25800
40 1 1 . 1 1 6 6 SER H H 6 8.270 8.270 8.224 0.046 25800
41 1 1 . 1 1 7 7 VAL N N 7 119.800 119.800 120.496 -0.696 25800
42 1 1 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.293 0.007 25800
43 1 1 . 1 1 7 7 VAL C C 7 175.500 175.500 174.620 0.880 25800
44 1 1 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.866 -0.166 25800
45 1 1 . 1 1 7 7 VAL CB C 7 32.800 32.800 34.021 -1.221 25800
46 1 1 . 1 1 7 7 VAL H H 7 7.840 7.840 8.151 -0.311 25800
47 1 1 . 1 1 8 8 SER N N 8 117.800 117.800 121.190 -3.390 25800
48 1 1 . 1 1 8 8 SER HA H 8 4.240 4.240 4.634 -0.394 25800
49 1 1 . 1 1 8 8 SER C C 8 172.500 172.500 173.828 -1.328 25800
50 1 1 . 1 1 8 8 SER CA C 8 58.500 58.500 58.609 -0.109 25800
51 1 1 . 1 1 8 8 SER CB C 8 63.600 63.600 64.154 -0.554 25800
52 1 1 . 1 1 8 8 SER H H 8 8.530 8.530 8.661 -0.131 25800
53 1 1 . 1 1 9 9 ARG N N 9 123.000 123.000 122.790 0.210 25800
54 1 1 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.081 0.419 25800
55 1 1 . 1 1 9 9 ARG C C 9 175.000 175.000 174.862 0.138 25800
56 1 1 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.234 0.065 25800
57 1 1 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.746 -0.346 25800
58 1 1 . 1 1 9 9 ARG H H 9 7.350 7.350 8.100 -0.750 25800
59 1 1 . 1 1 10 10 ILE N N 10 114.000 114.000 119.211 -5.211 25800
60 1 1 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.573 0.247 25800
61 1 1 . 1 1 10 10 ILE C C 10 173.000 173.000 174.702 -1.702 25800
62 1 1 . 1 1 10 10 ILE CA C 10 59.400 59.400 58.742 0.658 25800
63 1 1 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.605 1.295 25800
64 1 1 . 1 1 10 10 ILE H H 10 8.830 8.830 8.572 0.258 25800
65 1 1 . 1 1 11 11 TYR N N 11 123.400 123.400 128.667 -5.267 25800
66 1 1 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.318 -0.388 25800
67 1 1 . 1 1 11 11 TYR C C 11 173.000 173.000 173.260 -0.260 25800
68 1 1 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.510 0.490 25800
69 1 1 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.450 -0.550 25800
70 1 1 . 1 1 11 11 TYR H H 11 8.690 8.690 8.402 0.288 25800
71 1 1 . 1 1 12 12 VAL N N 12 126.300 126.300 127.844 -1.544 25800
72 1 1 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.628 -0.068 25800
73 1 1 . 1 1 12 12 VAL C C 12 174.100 174.100 173.489 0.611 25800
74 1 1 . 1 1 12 12 VAL CA C 12 60.200 60.200 58.978 1.222 25800
75 1 1 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.778 -2.378 25800
76 1 1 . 1 1 12 12 VAL H H 12 8.370 8.370 8.406 -0.036 25800
77 1 1 . 1 1 13 13 GLY N N 13 113.000 113.000 113.254 -0.254 25800
78 1 1 . 1 1 13 13 GLY C C 13 173.100 173.100 173.001 0.099 25800
79 1 1 . 1 1 13 13 GLY CA C 13 43.300 43.300 44.095 -0.795 25800
80 1 1 . 1 1 13 13 GLY H H 13 9.350 9.350 8.812 0.538 25800
81 1 1 . 1 1 14 14 ASN N N 14 113.900 113.900 115.235 -1.335 25800
82 1 1 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.263 0.017 25800
83 1 1 . 1 1 14 14 ASN C C 14 175.800 175.800 175.269 0.531 25800
84 1 1 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.077 -0.477 25800
85 1 1 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.793 0.907 25800
86 1 1 . 1 1 14 14 ASN H H 14 8.800 8.800 8.328 0.472 25800
87 1 1 . 1 1 15 15 LEU N N 15 115.800 115.800 116.849 -1.049 25800
88 1 1 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.542 0.448 25800
89 1 1 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.875 1.725 25800
90 1 1 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.129 0.471 25800
91 1 1 . 1 1 15 15 LEU H H 15 7.150 7.150 7.361 -0.211 25800
92 1 1 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.490 -0.420 25800
93 1 1 . 1 1 16 16 PRO C C 16 171.500 171.500 176.999 -5.499 25800
94 1 1 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.318 -0.818 25800
95 1 1 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.715 0.285 25800
96 1 1 . 1 1 17 17 SER N N 17 115.200 115.200 118.647 -3.447 25800
97 1 1 . 1 1 17 17 SER HA H 17 4.300 4.300 4.111 0.189 25800
98 1 1 . 1 1 17 17 SER C C 17 174.200 174.200 173.462 0.738 25800
99 1 1 . 1 1 17 17 SER CA C 17 58.200 58.200 60.447 -2.247 25800
100 1 1 . 1 1 17 17 SER CB C 17 63.900 63.900 62.456 1.444 25800
101 1 1 . 1 1 17 17 SER H H 17 8.470 8.470 8.719 -0.249 25800
102 1 1 . 1 1 18 18 HIS N N 18 120.800 120.800 118.296 2.504 25800
103 1 1 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.918 -0.368 25800
104 1 1 . 1 1 18 18 HIS C C 18 175.100 175.100 173.807 1.293 25800
105 1 1 . 1 1 18 18 HIS CA C 18 55.500 55.500 54.192 1.308 25800
106 1 1 . 1 1 18 18 HIS CB C 18 29.300 29.300 30.668 -1.368 25800
107 1 1 . 1 1 18 18 HIS H H 18 8.540 8.540 7.944 0.596 25800
108 1 1 . 1 1 19 19 VAL N N 19 115.700 115.700 118.966 -3.266 25800
109 1 1 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.281 -0.021 25800
110 1 1 . 1 1 19 19 VAL C C 19 174.000 174.000 175.270 -1.270 25800
111 1 1 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.712 0.188 25800
112 1 1 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.414 0.186 25800
113 1 1 . 1 1 19 19 VAL H H 19 6.650 6.650 7.926 -1.276 25800
114 1 1 . 1 1 20 20 SER N N 20 118.800 118.800 119.586 -0.786 25800
115 1 1 . 1 1 20 20 SER HA H 20 4.710 4.710 4.779 -0.069 25800
116 1 1 . 1 1 20 20 SER C C 20 175.900 175.900 175.620 0.280 25800
117 1 1 . 1 1 20 20 SER CA C 20 55.800 55.800 57.415 -1.615 25800
118 1 1 . 1 1 20 20 SER CB C 20 66.600 66.600 64.464 2.136 25800
119 1 1 . 1 1 20 20 SER H H 20 8.930 8.930 8.552 0.378 25800
120 1 1 . 1 1 21 21 SER N N 21 117.100 117.100 122.214 -5.114 25800
121 1 1 . 1 1 21 21 SER HA H 21 3.880 3.880 4.149 -0.269 25800
122 1 1 . 1 1 21 21 SER C C 21 176.200 176.200 176.405 -0.205 25800
123 1 1 . 1 1 21 21 SER CA C 21 62.300 62.300 61.390 0.910 25800
124 1 1 . 1 1 21 21 SER CB C 21 66.800 66.800 62.940 3.860 25800
125 1 1 . 1 1 21 21 SER H H 21 9.080 9.080 9.147 -0.067 25800
126 1 1 . 1 1 22 22 ARG N N 22 121.200 121.200 120.477 0.723 25800
127 1 1 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.172 -0.182 25800
128 1 1 . 1 1 22 22 ARG C C 22 177.900 177.900 178.489 -0.589 25800
129 1 1 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.047 -0.347 25800
130 1 1 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.744 -0.144 25800
131 1 1 . 1 1 22 22 ARG H H 22 7.940 7.940 8.475 -0.535 25800
132 1 1 . 1 1 23 23 ASP N N 23 118.800 118.800 120.088 -1.288 25800
133 1 1 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.521 -0.132 25800
134 1 1 . 1 1 23 23 ASP C C 23 179.200 179.200 178.430 0.770 25800
135 1 1 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.872 0.428 25800
136 1 1 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.503 0.497 25800
137 1 1 . 1 1 23 23 ASP H H 23 7.480 7.480 7.812 -0.332 25800
138 1 1 . 1 1 24 24 VAL N N 24 119.500 119.500 118.630 0.870 25800
139 1 1 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.792 -0.422 25800
140 1 1 . 1 1 24 24 VAL C C 24 177.500 177.500 177.770 -0.270 25800
141 1 1 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.657 1.243 25800
142 1 1 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.412 -0.012 25800
143 1 1 . 1 1 24 24 VAL H H 24 7.450 7.450 7.489 -0.039 25800
144 1 1 . 1 1 25 25 GLU N N 25 121.400 121.400 121.710 -0.310 25800
145 1 1 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.911 -0.341 25800
146 1 1 . 1 1 25 25 GLU C C 25 178.400 178.400 178.228 0.172 25800
147 1 1 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.245 0.355 25800
148 1 1 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.321 0.279 25800
149 1 1 . 1 1 25 25 GLU H H 25 8.580 8.580 8.244 0.336 25800
150 1 1 . 1 1 26 26 ASN N N 26 114.800 114.800 116.477 -1.677 25800
151 1 1 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.540 -0.220 25800
152 1 1 . 1 1 26 26 ASN C C 26 177.400 177.400 176.847 0.553 25800
153 1 1 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.340 0.560 25800
154 1 1 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.704 -0.804 25800
155 1 1 . 1 1 26 26 ASN H H 26 8.180 8.180 7.750 0.431 25800
156 1 1 . 1 1 27 27 GLU N N 27 118.900 118.900 120.002 -1.102 25800
157 1 1 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.179 -0.039 25800
158 1 1 . 1 1 27 27 GLU C C 27 176.400 176.400 178.728 -2.328 25800
159 1 1 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.696 -1.296 25800
160 1 1 . 1 1 27 27 GLU CB C 27 29.400 29.400 30.065 -0.665 25800
161 1 1 . 1 1 27 27 GLU H H 27 7.340 7.340 7.569 -0.229 25800
162 1 1 . 1 1 28 28 PHE N N 28 114.100 114.100 119.746 -5.646 25800
163 1 1 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.636 -0.086 25800
164 1 1 . 1 1 28 28 PHE C C 28 176.300 176.300 178.007 -1.707 25800
165 1 1 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.181 -1.181 25800
166 1 1 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.970 1.830 25800
167 1 1 . 1 1 28 28 PHE H H 28 7.660 7.660 8.493 -0.833 25800
168 1 1 . 1 1 29 29 ARG N N 29 121.700 121.700 119.387 2.313 25800
169 1 1 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.296 0.114 25800
170 1 1 . 1 1 29 29 ARG C C 29 177.100 177.100 178.577 -1.477 25800
171 1 1 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.959 -0.759 25800
172 1 1 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.653 -0.353 25800
173 1 1 . 1 1 29 29 ARG H H 29 8.120 8.120 8.389 -0.269 25800
174 1 1 . 1 1 30 30 LYS N N 30 117.200 117.200 121.377 -4.177 25800
175 1 1 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.169 -0.339 25800
176 1 1 . 1 1 30 30 LYS C C 30 177.100 177.100 177.800 -0.700 25800
177 1 1 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.400 -0.600 25800
178 1 1 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.588 -0.488 25800
179 1 1 . 1 1 30 30 LYS H H 30 7.630 7.630 7.740 -0.110 25800
180 1 1 . 1 1 31 31 TYR N N 31 117.100 117.100 118.109 -1.009 25800
181 1 1 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.549 -0.399 25800
182 1 1 . 1 1 31 31 TYR C C 31 174.400 174.400 175.938 -1.538 25800
183 1 1 . 1 1 31 31 TYR CA C 31 59.900 59.900 58.598 1.302 25800
184 1 1 . 1 1 31 31 TYR CB C 31 37.900 37.900 38.969 -1.069 25800
185 1 1 . 1 1 31 31 TYR H H 31 7.410 7.410 8.041 -0.631 25800
186 1 1 . 1 1 32 32 GLY N N 32 104.100 104.100 106.873 -2.773 25800
187 1 1 . 1 1 32 32 GLY C C 32 177.000 177.000 172.031 4.969 25800
188 1 1 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.511 -0.012 25800
189 1 1 . 1 1 32 32 GLY H H 32 7.240 7.240 7.531 -0.291 25800
190 1 1 . 1 1 33 33 ASN N N 33 115.300 115.300 117.862 -2.562 25800
191 1 1 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.699 -0.259 25800
192 1 1 . 1 1 33 33 ASN C C 33 175.500 175.500 174.523 0.977 25800
193 1 1 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.538 0.762 25800
194 1 1 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.362 -0.962 25800
195 1 1 . 1 1 33 33 ASN H H 33 8.460 8.460 8.469 -0.009 25800
196 1 1 . 1 1 34 34 ILE N N 34 126.700 126.700 123.009 3.691 25800
197 1 1 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.227 -0.437 25800
198 1 1 . 1 1 34 34 ILE C C 34 175.600 175.600 175.146 0.454 25800
199 1 1 . 1 1 34 34 ILE CA C 34 61.300 61.300 59.978 1.322 25800
200 1 1 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.774 1.226 25800
201 1 1 . 1 1 34 34 ILE H H 34 8.050 8.050 8.302 -0.252 25800
202 1 1 . 1 1 35 35 LEU N N 35 127.400 127.400 127.574 -0.174 25800
203 1 1 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.288 -0.128 25800
204 1 1 . 1 1 35 35 LEU C C 35 177.200 177.200 176.164 1.036 25800
205 1 1 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.585 -0.085 25800
206 1 1 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.178 0.522 25800
207 1 1 . 1 1 35 35 LEU H H 35 8.780 8.780 8.345 0.435 25800
208 1 1 . 1 1 36 36 LYS N N 36 117.000 117.000 116.289 0.711 25800
209 1 1 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.607 -0.367 25800
210 1 1 . 1 1 36 36 LYS C C 36 173.600 173.600 174.320 -0.720 25800
211 1 1 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.527 0.373 25800
212 1 1 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.266 0.334 25800
213 1 1 . 1 1 36 36 LYS H H 36 7.110 7.110 7.590 -0.480 25800
214 1 1 . 1 1 37 37 CYS N N 37 125.400 125.400 118.417 6.983 25800
215 1 1 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.674 -0.974 25800
216 1 1 . 1 1 37 37 CYS C C 37 171.600 171.600 173.031 -1.431 25800
217 1 1 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.367 1.532 25800
218 1 1 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.415 -4.315 25800
219 1 1 . 1 1 37 37 CYS H H 37 8.610 8.610 8.458 0.152 25800
220 1 1 . 1 1 38 38 ASP N N 38 128.200 128.200 120.550 7.650 25800
221 1 1 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.022 -0.072 25800
222 1 1 . 1 1 38 38 ASP C C 38 174.300 174.300 173.865 0.435 25800
223 1 1 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.691 -0.491 25800
224 1 1 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.273 -0.973 25800
225 1 1 . 1 1 38 38 ASP H H 38 8.290 8.290 8.872 -0.582 25800
226 1 1 . 1 1 39 39 VAL N N 39 123.500 123.500 115.299 8.201 25800
227 1 1 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.331 -1.031 25800
228 1 1 . 1 1 39 39 VAL C C 39 175.000 175.000 174.699 0.301 25800
229 1 1 . 1 1 39 39 VAL CA C 39 61.700 61.700 60.397 1.303 25800
230 1 1 . 1 1 39 39 VAL CB C 39 33.100 33.100 35.918 -2.818 25800
231 1 1 . 1 1 39 39 VAL H H 39 8.380 8.380 8.409 -0.029 25800
232 1 1 . 1 1 40 40 LYS N N 40 129.100 129.100 121.829 7.271 25800
233 1 1 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.917 -0.597 25800
234 1 1 . 1 1 40 40 LYS C C 40 173.700 173.700 174.612 -0.912 25800
235 1 1 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.617 -0.717 25800
236 1 1 . 1 1 40 40 LYS CB C 40 35.500 35.500 37.194 -1.694 25800
237 1 1 . 1 1 40 40 LYS H H 40 8.680 8.680 9.256 -0.576 25800
238 1 1 . 1 1 41 41 LYS N N 41 117.300 117.300 120.107 -2.807 25800
239 1 1 . 1 1 41 41 LYS HA H 41 4.980 4.980 4.863 0.117 25800
240 1 1 . 1 1 41 41 LYS C C 41 177.800 177.800 175.266 2.534 25800
241 1 1 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.661 -0.061 25800
242 1 1 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.287 -0.287 25800
243 1 1 . 1 1 41 41 LYS H H 41 7.900 7.900 8.511 -0.611 25800
244 1 1 . 1 1 42 42 THR N N 42 113.200 113.200 114.752 -1.552 25800
245 1 1 . 1 1 42 42 THR HA H 42 4.680 4.680 4.807 -0.127 25800
246 1 1 . 1 1 42 42 THR C C 42 176.900 176.900 176.350 0.550 25800
247 1 1 . 1 1 42 42 THR CA C 42 60.200 60.200 60.048 0.152 25800
248 1 1 . 1 1 42 42 THR CB C 42 71.600 71.600 70.057 1.543 25800
249 1 1 . 1 1 42 42 THR H H 42 8.730 8.730 8.227 0.503 25800
250 1 1 . 1 1 43 43 VAL N N 43 120.000 120.000 124.623 -4.623 25800
251 1 1 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.034 -0.114 25800
252 1 1 . 1 1 43 43 VAL C C 43 177.000 177.000 176.512 0.488 25800
253 1 1 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.380 0.320 25800
254 1 1 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.736 0.064 25800
255 1 1 . 1 1 43 43 VAL H H 43 8.730 8.730 8.546 0.184 25800
256 1 1 . 1 1 44 44 SER N N 44 113.400 113.400 114.825 -1.425 25800
257 1 1 . 1 1 44 44 SER HA H 44 4.360 4.360 4.302 0.058 25800
258 1 1 . 1 1 44 44 SER C C 44 174.800 174.800 175.337 -0.537 25800
259 1 1 . 1 1 44 44 SER CA C 44 58.400 58.400 58.984 -0.584 25800
260 1 1 . 1 1 44 44 SER CB C 44 63.500 63.500 63.352 0.148 25800
261 1 1 . 1 1 44 44 SER H H 44 7.760 7.760 7.934 -0.174 25800
262 1 1 . 1 1 45 45 GLY N N 45 110.200 110.200 107.946 2.254 25800
263 1 1 . 1 1 45 45 GLY C C 45 173.500 173.500 173.921 -0.421 25800
264 1 1 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.672 0.628 25800
265 1 1 . 1 1 45 45 GLY H H 45 7.820 7.820 7.606 0.214 25800
266 1 1 . 1 1 46 46 ALA N N 46 123.900 123.900 122.107 1.793 25800
267 1 1 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.312 0.078 25800
268 1 1 . 1 1 46 46 ALA C C 46 176.100 176.100 175.369 0.731 25800
269 1 1 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.720 0.180 25800
270 1 1 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.277 -0.477 25800
271 1 1 . 1 1 46 46 ALA H H 46 7.440 7.440 7.790 -0.350 25800
272 1 1 . 1 1 47 47 ALA N N 47 123.100 123.100 121.632 1.468 25800
273 1 1 . 1 1 47 47 ALA HA H 47 5.200 5.200 4.752 0.448 25800
274 1 1 . 1 1 47 47 ALA C C 47 176.100 176.100 175.324 0.776 25800
275 1 1 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.216 0.684 25800
276 1 1 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.342 -0.442 25800
277 1 1 . 1 1 47 47 ALA H H 47 8.350 8.350 8.066 0.284 25800
278 1 1 . 1 1 48 48 PHE N N 48 118.700 118.700 117.144 1.556 25800
279 1 1 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.552 -0.522 25800
280 1 1 . 1 1 48 48 PHE C C 48 171.600 171.600 174.145 -2.545 25800
281 1 1 . 1 1 48 48 PHE CA C 48 55.700 55.700 55.986 -0.286 25800
282 1 1 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.856 -2.656 25800
283 1 1 . 1 1 48 48 PHE H H 48 8.550 8.550 8.737 -0.187 25800
284 1 1 . 1 1 49 49 ALA N N 49 120.400 120.400 121.476 -1.076 25800
285 1 1 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.381 -0.051 25800
286 1 1 . 1 1 49 49 ALA C C 49 175.500 175.500 174.674 0.826 25800
287 1 1 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.842 -1.542 25800
288 1 1 . 1 1 49 49 ALA CB C 49 23.700 23.700 22.880 0.821 25800
289 1 1 . 1 1 49 49 ALA H H 49 9.240 9.240 9.038 0.202 25800
290 1 1 . 1 1 50 50 PHE N N 50 115.000 115.000 118.274 -3.274 25800
291 1 1 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.755 -0.155 25800
292 1 1 . 1 1 50 50 PHE C C 50 176.000 176.000 174.352 1.648 25800
293 1 1 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.485 0.015 25800
294 1 1 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.166 -0.966 25800
295 1 1 . 1 1 50 50 PHE H H 50 7.920 7.920 9.079 -1.159 25800
296 1 1 . 1 1 51 51 ILE N N 51 123.000 123.000 121.909 1.091 25800
297 1 1 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.420 0.030 25800
298 1 1 . 1 1 51 51 ILE C C 51 173.700 173.700 174.334 -0.634 25800
299 1 1 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.585 -0.385 25800
300 1 1 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.824 -0.124 25800
301 1 1 . 1 1 51 51 ILE H H 51 8.490 8.490 8.971 -0.481 25800
302 1 1 . 1 1 52 52 GLU N N 52 126.600 126.600 126.592 0.008 25800
303 1 1 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.608 0.162 25800
304 1 1 . 1 1 52 52 GLU C C 52 175.300 175.300 175.155 0.145 25800
305 1 1 . 1 1 52 52 GLU CA C 52 54.700 54.700 56.227 -1.527 25800
306 1 1 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.191 -0.691 25800
307 1 1 . 1 1 52 52 GLU H H 52 8.610 8.610 8.778 -0.168 25800
308 1 1 . 1 1 53 53 PHE N N 53 126.100 126.100 120.857 5.243 25800
309 1 1 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.055 -0.255 25800
310 1 1 . 1 1 53 53 PHE C C 53 175.400 175.400 175.476 -0.076 25800
311 1 1 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.973 1.227 25800
312 1 1 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.150 -2.250 25800
313 1 1 . 1 1 53 53 PHE H H 53 8.800 8.800 8.897 -0.097 25800
314 1 1 . 1 1 54 54 GLU N N 54 120.700 120.700 121.136 -0.436 25800
315 1 1 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.185 -0.255 25800
316 1 1 . 1 1 54 54 GLU C C 54 175.300 175.300 176.240 -0.940 25800
317 1 1 . 1 1 54 54 GLU CA C 54 59.100 59.100 58.223 0.877 25800
318 1 1 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.224 0.576 25800
319 1 1 . 1 1 54 54 GLU H H 54 8.160 8.160 8.631 -0.471 25800
320 1 1 . 1 1 55 55 ASP N N 55 117.900 117.900 116.329 1.571 25800
321 1 1 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.824 0.096 25800
322 1 1 . 1 1 55 55 ASP C C 55 176.400 176.400 175.374 1.026 25800
323 1 1 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.291 -0.891 25800
324 1 1 . 1 1 55 55 ASP CB C 55 44.400 44.400 43.780 0.620 25800
325 1 1 . 1 1 55 55 ASP H H 55 8.740 8.740 7.780 0.960 25800
326 1 1 . 1 1 56 56 ALA N N 56 128.900 128.900 126.345 2.555 25800
327 1 1 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.164 -0.334 25800
328 1 1 . 1 1 56 56 ALA C C 56 179.800 179.800 178.931 0.869 25800
329 1 1 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.821 0.379 25800
330 1 1 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.384 -0.484 25800
331 1 1 . 1 1 56 56 ALA H H 56 8.800 8.800 8.582 0.218 25800
332 1 1 . 1 1 57 57 ARG N N 57 119.200 119.200 117.114 2.086 25800
333 1 1 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.080 -0.190 25800
334 1 1 . 1 1 57 57 ARG C C 57 178.000 178.000 178.094 -0.094 25800
335 1 1 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.853 0.047 25800
336 1 1 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.637 -0.338 25800
337 1 1 . 1 1 57 57 ARG H H 57 8.950 8.950 8.472 0.478 25800
338 1 1 . 1 1 58 58 ASP N N 58 120.900 120.900 117.826 3.074 25800
339 1 1 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.513 -0.423 25800
340 1 1 . 1 1 58 58 ASP C C 58 176.700 176.700 177.810 -1.110 25800
341 1 1 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.519 -0.019 25800
342 1 1 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.613 -0.713 25800
343 1 1 . 1 1 58 58 ASP H H 58 7.020 7.020 8.214 -1.194 25800
344 1 1 . 1 1 59 59 ALA N N 59 119.700 119.700 122.283 -2.583 25800
345 1 1 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.454 -0.374 25800
346 1 1 . 1 1 59 59 ALA C C 59 178.100 178.100 178.544 -0.444 25800
347 1 1 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.158 0.142 25800
348 1 1 . 1 1 59 59 ALA CB C 59 18.400 18.400 17.773 0.626 25800
349 1 1 . 1 1 59 59 ALA H H 59 6.440 6.440 7.242 -0.802 25800
350 1 1 . 1 1 60 60 ALA N N 60 117.600 117.600 120.151 -2.551 25800
351 1 1 . 1 1 60 60 ALA HA H 60 3.830 3.830 3.847 -0.017 25800
352 1 1 . 1 1 60 60 ALA C C 60 180.900 180.900 178.681 2.219 25800
353 1 1 . 1 1 60 60 ALA CA C 60 54.900 54.900 54.817 0.083 25800
354 1 1 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.272 -0.572 25800
355 1 1 . 1 1 60 60 ALA H H 60 7.330 7.330 7.796 -0.466 25800
356 1 1 . 1 1 61 61 ASP N N 61 120.100 120.100 118.451 1.649 25800
357 1 1 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.414 -0.204 25800
358 1 1 . 1 1 61 61 ASP C C 61 176.700 176.700 178.059 -1.359 25800
359 1 1 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.007 0.093 25800
360 1 1 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.480 -0.380 25800
361 1 1 . 1 1 61 61 ASP H H 61 7.590 7.590 7.776 -0.186 25800
362 1 1 . 1 1 62 62 ALA N N 62 122.200 122.200 122.854 -0.654 25800
363 1 1 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.873 -1.453 25800
364 1 1 . 1 1 62 62 ALA C C 62 179.300 179.300 178.986 0.314 25800
365 1 1 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.281 0.319 25800
366 1 1 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.361 0.739 25800
367 1 1 . 1 1 62 62 ALA H H 62 7.440 7.440 7.157 0.283 25800
368 1 1 . 1 1 63 63 ILE N N 63 116.700 116.700 118.649 -1.949 25800
369 1 1 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.739 -0.499 25800
370 1 1 . 1 1 63 63 ILE C C 63 177.800 177.800 177.008 0.792 25800
371 1 1 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.886 1.714 25800
372 1 1 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.791 1.109 25800
373 1 1 . 1 1 63 63 ILE H H 63 7.540 7.540 7.560 -0.020 25800
374 1 1 . 1 1 64 64 LYS N N 64 117.400 117.400 115.947 1.453 25800
375 1 1 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.154 -0.254 25800
376 1 1 . 1 1 64 64 LYS C C 64 178.900 178.900 178.536 0.364 25800
377 1 1 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.146 0.654 25800
378 1 1 . 1 1 64 64 LYS CB C 64 32.600 32.600 32.253 0.347 25800
379 1 1 . 1 1 64 64 LYS H H 64 7.490 7.490 8.050 -0.560 25800
380 1 1 . 1 1 65 65 GLU N N 65 113.800 113.800 119.326 -5.526 25800
381 1 1 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.317 -0.157 25800
382 1 1 . 1 1 65 65 GLU C C 65 178.300 178.300 178.125 0.175 25800
383 1 1 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.249 0.051 25800
384 1 1 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.485 1.216 25800
385 1 1 . 1 1 65 65 GLU H H 65 7.960 7.960 7.696 0.264 25800
386 1 1 . 1 1 66 66 LYS N N 66 114.700 114.700 118.778 -4.078 25800
387 1 1 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.321 0.149 25800
388 1 1 . 1 1 66 66 LYS C C 66 177.500 177.500 176.239 1.261 25800
389 1 1 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.925 -1.525 25800
390 1 1 . 1 1 66 66 LYS CB C 66 33.000 33.000 31.825 1.175 25800
391 1 1 . 1 1 66 66 LYS H H 66 8.050 8.050 8.130 -0.080 25800
392 1 1 . 1 1 67 67 ASP N N 67 118.800 118.800 118.863 -0.063 25800
393 1 1 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.474 -0.254 25800
394 1 1 . 1 1 67 67 ASP C C 67 177.700 177.700 177.628 0.072 25800
395 1 1 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.286 4.114 25800
396 1 1 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.079 0.321 25800
397 1 1 . 1 1 67 67 ASP H H 67 7.620 7.620 7.358 0.262 25800
398 1 1 . 1 1 68 68 GLY N N 68 115.600 115.600 108.372 7.228 25800
399 1 1 . 1 1 68 68 GLY C C 68 173.800 173.800 175.066 -1.266 25800
400 1 1 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.773 1.127 25800
401 1 1 . 1 1 68 68 GLY H H 68 8.470 8.470 8.605 -0.135 25800
402 1 1 . 1 1 69 69 CYS N N 69 119.200 119.200 119.131 0.069 25800
403 1 1 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.722 -0.562 25800
404 1 1 . 1 1 69 69 CYS C C 69 172.600 172.600 174.103 -1.503 25800
405 1 1 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.471 0.529 25800
406 1 1 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.808 -1.108 25800
407 1 1 . 1 1 69 69 CYS H H 69 7.890 7.890 8.311 -0.421 25800
408 1 1 . 1 1 70 70 ASP N N 70 122.200 122.200 121.733 0.467 25800
409 1 1 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.430 0.400 25800
410 1 1 . 1 1 70 70 ASP C C 70 176.400 176.400 174.385 2.015 25800
411 1 1 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.237 1.463 25800
412 1 1 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.552 -1.852 25800
413 1 1 . 1 1 70 70 ASP H H 70 8.360 8.360 8.853 -0.493 25800
414 1 1 . 1 1 71 71 PHE N N 71 127.600 127.600 118.493 9.107 25800
415 1 1 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.006 -0.406 25800
416 1 1 . 1 1 71 71 PHE C C 71 173.600 173.600 175.231 -1.631 25800
417 1 1 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.243 -0.443 25800
418 1 1 . 1 1 71 71 PHE CB C 71 40.700 40.700 40.539 0.161 25800
419 1 1 . 1 1 71 71 PHE H H 71 9.390 9.390 7.589 1.801 25800
420 1 1 . 1 1 72 72 GLU N N 72 123.900 123.900 118.832 5.068 25800
421 1 1 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.200 -0.660 25800
422 1 1 . 1 1 72 72 GLU C C 72 175.500 175.500 175.986 -0.486 25800
423 1 1 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.852 -0.152 25800
424 1 1 . 1 1 72 72 GLU CB C 72 27.300 27.300 29.014 -1.714 25800
425 1 1 . 1 1 72 72 GLU H H 72 8.940 8.940 9.265 -0.325 25800
426 1 1 . 1 1 73 73 GLY N N 73 105.200 105.200 105.004 0.196 25800
427 1 1 . 1 1 73 73 GLY C C 73 174.100 174.100 173.332 0.768 25800
428 1 1 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.110 0.490 25800
429 1 1 . 1 1 73 73 GLY H H 73 8.350 8.350 8.146 0.204 25800
430 1 1 . 1 1 74 74 ASN N N 74 121.000 121.000 117.692 3.308 25800
431 1 1 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.923 -0.163 25800
432 1 1 . 1 1 74 74 ASN C C 74 174.000 174.000 173.037 0.963 25800
433 1 1 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.514 -1.614 25800
434 1 1 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.571 -0.871 25800
435 1 1 . 1 1 74 74 ASN H H 74 7.740 7.740 7.778 -0.038 25800
436 1 1 . 1 1 75 75 LYS N N 75 121.400 121.400 122.732 -1.332 25800
437 1 1 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.589 -0.119 25800
438 1 1 . 1 1 75 75 LYS C C 75 176.900 176.900 174.853 2.047 25800
439 1 1 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.415 -0.115 25800
440 1 1 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.071 -0.171 25800
441 1 1 . 1 1 75 75 LYS H H 75 8.380 8.380 8.464 -0.084 25800
442 1 1 . 1 1 76 76 LEU N N 76 127.400 127.400 123.475 3.925 25800
443 1 1 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.706 -0.276 25800
444 1 1 . 1 1 76 76 LEU C C 76 177.600 177.600 173.986 3.614 25800
445 1 1 . 1 1 76 76 LEU CA C 76 55.300 55.300 54.824 0.476 25800
446 1 1 . 1 1 76 76 LEU CB C 76 43.100 43.100 46.751 -3.651 25800
447 1 1 . 1 1 76 76 LEU H H 76 8.950 8.950 7.867 1.083 25800
448 1 1 . 1 1 77 77 ARG N N 77 121.800 121.800 123.489 -1.689 25800
449 1 1 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.766 0.134 25800
450 1 1 . 1 1 77 77 ARG C C 77 174.700 174.700 173.320 1.380 25800
451 1 1 . 1 1 77 77 ARG CA C 77 54.000 54.000 56.078 -2.079 25800
452 1 1 . 1 1 77 77 ARG CB C 77 32.300 32.300 34.891 -2.591 25800
453 1 1 . 1 1 77 77 ARG H H 77 7.530 7.530 8.780 -1.250 25800
454 1 1 . 1 1 78 78 VAL N N 78 127.000 127.000 124.789 2.211 25800
455 1 1 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.732 0.548 25800
456 1 1 . 1 1 78 78 VAL C C 78 174.200 174.200 174.068 0.132 25800
457 1 1 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.237 -0.037 25800
458 1 1 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.982 -1.582 25800
459 1 1 . 1 1 78 78 VAL H H 78 9.660 9.660 8.491 1.169 25800
460 1 1 . 1 1 79 79 GLU N N 79 121.900 121.900 126.009 -4.109 25800
461 1 1 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.754 -0.044 25800
462 1 1 . 1 1 79 79 GLU C C 79 174.600 174.600 173.797 0.803 25800
463 1 1 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.470 -1.570 25800
464 1 1 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.593 -0.193 25800
465 1 1 . 1 1 79 79 GLU H H 79 8.980 8.980 8.693 0.287 25800
466 1 1 . 1 1 80 80 VAL N N 80 121.300 121.300 123.222 -1.922 25800
467 1 1 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.721 -0.351 25800
468 1 1 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.207 2.793 25800
469 1 1 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.941 -1.841 25800
470 1 1 . 1 1 80 80 VAL H H 80 8.410 8.410 8.562 -0.152 25800
471 1 1 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.203 0.057 25800
472 1 1 . 1 1 81 81 PRO C C 81 176.100 176.100 176.965 -0.865 25800
473 1 1 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.089 -0.989 25800
474 1 1 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.450 0.650 25800
475 1 1 . 1 1 82 82 PHE N N 82 122.200 122.200 117.205 4.995 25800
476 1 1 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.676 -0.386 25800
477 1 1 . 1 1 82 82 PHE C C 82 175.300 175.300 174.847 0.453 25800
478 1 1 . 1 1 82 82 PHE CA C 82 58.100 58.100 53.942 4.158 25800
479 1 1 . 1 1 82 82 PHE CB C 82 39.400 39.400 36.748 2.651 25800
480 1 1 . 1 1 82 82 PHE H H 82 8.150 8.150 6.693 1.457 25800
481 1 1 . 1 1 83 83 ASN N N 83 120.800 120.800 122.556 -1.756 25800
482 1 1 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.693 -0.253 25800
483 1 1 . 1 1 83 83 ASN C C 83 174.100 174.100 174.506 -0.406 25800
484 1 1 . 1 1 83 83 ASN CA C 83 52.700 52.700 51.935 0.764 25800
485 1 1 . 1 1 83 83 ASN CB C 83 38.700 38.700 37.601 1.099 25800
486 1 1 . 1 1 83 83 ASN H H 83 8.110 8.110 7.947 0.163 25800
487 1 1 . 1 1 84 84 ALA N N 84 123.700 123.700 123.995 -0.295 25800
488 1 1 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.326 -0.246 25800
489 1 1 . 1 1 84 84 ALA C C 84 177.100 177.100 177.582 -0.482 25800
490 1 1 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.801 -0.401 25800
491 1 1 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.481 -0.381 25800
492 1 1 . 1 1 84 84 ALA H H 84 8.020 8.020 7.703 0.317 25800
493 1 1 . 1 1 85 85 ARG N N 85 120.200 120.200 117.855 2.345 25800
494 1 1 . 1 1 85 85 ARG HA H 85 4.150 4.150 3.844 0.306 25800
495 1 1 . 1 1 85 85 ARG C C 85 175.200 175.200 176.231 -1.031 25800
496 1 1 . 1 1 85 85 ARG CA C 85 56.000 56.000 57.084 -1.084 25800
497 1 1 . 1 1 85 85 ARG CB C 85 30.800 30.800 27.552 3.248 25800
498 1 1 . 1 1 85 85 ARG H H 85 8.040 8.040 8.874 -0.834 25800
499 1 2 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.763 -0.173 25800
500 1 2 . 1 1 0 0 HIS C C 0 174.000 174.000 174.311 -0.311 25800
501 1 2 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.586 -1.286 25800
502 1 2 . 1 1 0 0 HIS CB C 0 29.300 29.300 29.408 -0.108 25800
503 1 2 . 1 1 1 1 MET N N 1 122.400 122.400 122.165 0.235 25800
504 1 2 . 1 1 1 1 MET HA H 1 4.340 4.340 4.494 -0.154 25800
505 1 2 . 1 1 1 1 MET C C 1 175.600 175.600 174.063 1.537 25800
506 1 2 . 1 1 1 1 MET CA C 1 55.600 55.600 54.353 1.246 25800
507 1 2 . 1 1 1 1 MET CB C 1 32.800 32.800 35.207 -2.407 25800
508 1 2 . 1 1 1 1 MET H H 1 8.310 8.310 7.804 0.506 25800
509 1 2 . 1 1 2 2 VAL N N 2 123.200 123.200 121.916 1.284 25800
510 1 2 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.468 -0.508 25800
511 1 2 . 1 1 2 2 VAL C C 2 175.600 175.600 174.611 0.989 25800
512 1 2 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.254 0.046 25800
513 1 2 . 1 1 2 2 VAL CB C 2 32.300 32.300 33.199 -0.899 25800
514 1 2 . 1 1 2 2 VAL H H 2 8.180 8.180 8.230 -0.050 25800
515 1 2 . 1 1 3 3 ILE N N 3 126.200 126.200 123.632 2.568 25800
516 1 2 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.602 -0.552 25800
517 1 2 . 1 1 3 3 ILE C C 3 175.800 175.800 175.986 -0.186 25800
518 1 2 . 1 1 3 3 ILE CA C 3 60.700 60.700 59.749 0.951 25800
519 1 2 . 1 1 3 3 ILE CB C 3 38.300 38.300 40.331 -2.031 25800
520 1 2 . 1 1 3 3 ILE H H 3 8.230 8.230 8.034 0.196 25800
521 1 2 . 1 1 4 4 ARG N N 4 126.100 126.100 122.676 3.424 25800
522 1 2 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.346 -0.166 25800
523 1 2 . 1 1 4 4 ARG C C 4 175.900 175.900 175.416 0.484 25800
524 1 2 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.493 -0.493 25800
525 1 2 . 1 1 4 4 ARG CB C 4 30.700 30.700 29.457 1.243 25800
526 1 2 . 1 1 4 4 ARG H H 4 8.360 8.360 8.736 -0.376 25800
527 1 2 . 1 1 5 5 GLU N N 5 122.200 122.200 118.353 3.847 25800
528 1 2 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.471 -0.331 25800
529 1 2 . 1 1 5 5 GLU C C 5 176.100 176.100 174.488 1.612 25800
530 1 2 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.477 1.123 25800
531 1 2 . 1 1 5 5 GLU CB C 5 30.300 30.300 30.937 -0.637 25800
532 1 2 . 1 1 5 5 GLU H H 5 8.400 8.400 7.723 0.677 25800
533 1 2 . 1 1 6 6 SER N N 6 116.200 116.200 114.281 1.919 25800
534 1 2 . 1 1 6 6 SER HA H 6 4.350 4.350 4.824 -0.474 25800
535 1 2 . 1 1 6 6 SER C C 6 174.300 174.300 172.888 1.412 25800
536 1 2 . 1 1 6 6 SER CA C 6 58.200 58.200 57.339 0.861 25800
537 1 2 . 1 1 6 6 SER CB C 6 63.800 63.800 64.401 -0.601 25800
538 1 2 . 1 1 6 6 SER H H 6 8.270 8.270 8.248 0.022 25800
539 1 2 . 1 1 7 7 VAL N N 7 119.800 119.800 125.032 -5.232 25800
540 1 2 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.262 0.038 25800
541 1 2 . 1 1 7 7 VAL C C 7 175.500 175.500 175.819 -0.319 25800
542 1 2 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.570 0.130 25800
543 1 2 . 1 1 7 7 VAL CB C 7 32.800 32.800 32.888 -0.088 25800
544 1 2 . 1 1 7 7 VAL H H 7 7.840 7.840 8.450 -0.610 25800
545 1 2 . 1 1 8 8 SER N N 8 117.800 117.800 123.558 -5.758 25800
546 1 2 . 1 1 8 8 SER HA H 8 4.240 4.240 4.353 -0.113 25800
547 1 2 . 1 1 8 8 SER C C 8 172.500 172.500 173.758 -1.258 25800
548 1 2 . 1 1 8 8 SER CA C 8 58.500 58.500 58.136 0.364 25800
549 1 2 . 1 1 8 8 SER CB C 8 63.600 63.600 63.331 0.269 25800
550 1 2 . 1 1 8 8 SER H H 8 8.530 8.530 8.604 -0.074 25800
551 1 2 . 1 1 9 9 ARG N N 9 123.000 123.000 120.794 2.206 25800
552 1 2 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.057 0.443 25800
553 1 2 . 1 1 9 9 ARG C C 9 175.000 175.000 175.401 -0.401 25800
554 1 2 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.802 -0.502 25800
555 1 2 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.279 0.121 25800
556 1 2 . 1 1 9 9 ARG H H 9 7.350 7.350 8.323 -0.973 25800
557 1 2 . 1 1 10 10 ILE N N 10 114.000 114.000 122.789 -8.789 25800
558 1 2 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.203 0.617 25800
559 1 2 . 1 1 10 10 ILE C C 10 173.000 173.000 174.252 -1.252 25800
560 1 2 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.492 -2.092 25800
561 1 2 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.252 1.648 25800
562 1 2 . 1 1 10 10 ILE H H 10 8.830 8.830 8.689 0.141 25800
563 1 2 . 1 1 11 11 TYR N N 11 123.400 123.400 127.654 -4.254 25800
564 1 2 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.164 -0.234 25800
565 1 2 . 1 1 11 11 TYR C C 11 173.000 173.000 173.124 -0.124 25800
566 1 2 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.575 0.425 25800
567 1 2 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.864 -0.964 25800
568 1 2 . 1 1 11 11 TYR H H 11 8.690 8.690 7.981 0.709 25800
569 1 2 . 1 1 12 12 VAL N N 12 126.300 126.300 121.355 4.945 25800
570 1 2 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.509 0.051 25800
571 1 2 . 1 1 12 12 VAL C C 12 174.100 174.100 173.465 0.635 25800
572 1 2 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.007 1.193 25800
573 1 2 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.936 -1.536 25800
574 1 2 . 1 1 12 12 VAL H H 12 8.370 8.370 8.135 0.235 25800
575 1 2 . 1 1 13 13 GLY N N 13 113.000 113.000 109.443 3.557 25800
576 1 2 . 1 1 13 13 GLY C C 13 173.100 173.100 173.113 -0.013 25800
577 1 2 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.237 0.063 25800
578 1 2 . 1 1 13 13 GLY H H 13 9.350 9.350 8.337 1.013 25800
579 1 2 . 1 1 14 14 ASN N N 14 113.900 113.900 115.297 -1.397 25800
580 1 2 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.047 0.233 25800
581 1 2 . 1 1 14 14 ASN C C 14 175.800 175.800 174.787 1.013 25800
582 1 2 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.228 -0.628 25800
583 1 2 . 1 1 14 14 ASN CB C 14 37.700 37.700 37.690 0.010 25800
584 1 2 . 1 1 14 14 ASN H H 14 8.800 8.800 8.135 0.665 25800
585 1 2 . 1 1 15 15 LEU N N 15 115.800 115.800 121.380 -5.580 25800
586 1 2 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.540 0.450 25800
587 1 2 . 1 1 15 15 LEU CA C 15 55.600 55.600 52.604 2.996 25800
588 1 2 . 1 1 15 15 LEU CB C 15 41.600 41.600 42.854 -1.254 25800
589 1 2 . 1 1 15 15 LEU H H 15 7.150 7.150 7.803 -0.653 25800
590 1 2 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.603 -0.533 25800
591 1 2 . 1 1 16 16 PRO C C 16 171.500 171.500 176.330 -4.830 25800
592 1 2 . 1 1 16 16 PRO CA C 16 62.500 62.500 61.832 0.668 25800
593 1 2 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.895 -0.895 25800
594 1 2 . 1 1 17 17 SER N N 17 115.200 115.200 116.149 -0.949 25800
595 1 2 . 1 1 17 17 SER HA H 17 4.300 4.300 4.334 -0.034 25800
596 1 2 . 1 1 17 17 SER C C 17 174.200 174.200 173.949 0.251 25800
597 1 2 . 1 1 17 17 SER CA C 17 58.200 58.200 59.539 -1.339 25800
598 1 2 . 1 1 17 17 SER CB C 17 63.900 63.900 63.135 0.765 25800
599 1 2 . 1 1 17 17 SER H H 17 8.470 8.470 8.440 0.030 25800
600 1 2 . 1 1 18 18 HIS N N 18 120.800 120.800 125.008 -4.208 25800
601 1 2 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.670 -0.120 25800
602 1 2 . 1 1 18 18 HIS C C 18 175.100 175.100 174.367 0.733 25800
603 1 2 . 1 1 18 18 HIS CA C 18 55.500 55.500 56.049 -0.549 25800
604 1 2 . 1 1 18 18 HIS CB C 18 29.300 29.300 31.249 -1.949 25800
605 1 2 . 1 1 18 18 HIS H H 18 8.540 8.540 8.591 -0.051 25800
606 1 2 . 1 1 19 19 VAL N N 19 115.700 115.700 120.556 -4.856 25800
607 1 2 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.308 -0.048 25800
608 1 2 . 1 1 19 19 VAL C C 19 174.000 174.000 175.923 -1.923 25800
609 1 2 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.179 0.721 25800
610 1 2 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.023 0.577 25800
611 1 2 . 1 1 19 19 VAL H H 19 6.650 6.650 7.887 -1.237 25800
612 1 2 . 1 1 20 20 SER N N 20 118.800 118.800 122.031 -3.231 25800
613 1 2 . 1 1 20 20 SER HA H 20 4.710 4.710 4.527 0.183 25800
614 1 2 . 1 1 20 20 SER C C 20 175.900 175.900 175.656 0.244 25800
615 1 2 . 1 1 20 20 SER CA C 20 55.800 55.800 57.429 -1.629 25800
616 1 2 . 1 1 20 20 SER CB C 20 66.600 66.600 64.910 1.690 25800
617 1 2 . 1 1 20 20 SER H H 20 8.930 8.930 8.328 0.602 25800
618 1 2 . 1 1 21 21 SER N N 21 117.100 117.100 117.529 -0.429 25800
619 1 2 . 1 1 21 21 SER HA H 21 3.880 3.880 4.113 -0.233 25800
620 1 2 . 1 1 21 21 SER C C 21 176.200 176.200 176.612 -0.412 25800
621 1 2 . 1 1 21 21 SER CA C 21 62.300 62.300 61.672 0.628 25800
622 1 2 . 1 1 21 21 SER CB C 21 66.800 66.800 63.061 3.739 25800
623 1 2 . 1 1 21 21 SER H H 21 9.080 9.080 8.923 0.157 25800
624 1 2 . 1 1 22 22 ARG N N 22 121.200 121.200 118.891 2.309 25800
625 1 2 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.166 -0.176 25800
626 1 2 . 1 1 22 22 ARG C C 22 177.900 177.900 178.495 -0.595 25800
627 1 2 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.048 -0.348 25800
628 1 2 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.830 -0.230 25800
629 1 2 . 1 1 22 22 ARG H H 22 7.940 7.940 8.272 -0.332 25800
630 1 2 . 1 1 23 23 ASP N N 23 118.800 118.800 119.785 -0.985 25800
631 1 2 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.569 -0.179 25800
632 1 2 . 1 1 23 23 ASP C C 23 179.200 179.200 178.366 0.834 25800
633 1 2 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.671 0.629 25800
634 1 2 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.498 0.502 25800
635 1 2 . 1 1 23 23 ASP H H 23 7.480 7.480 7.567 -0.087 25800
636 1 2 . 1 1 24 24 VAL N N 24 119.500 119.500 120.707 -1.207 25800
637 1 2 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.669 -0.299 25800
638 1 2 . 1 1 24 24 VAL C C 24 177.500 177.500 177.599 -0.099 25800
639 1 2 . 1 1 24 24 VAL CA C 24 66.900 66.900 67.184 -0.284 25800
640 1 2 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.841 -0.441 25800
641 1 2 . 1 1 24 24 VAL H H 24 7.450 7.450 8.461 -1.011 25800
642 1 2 . 1 1 25 25 GLU N N 25 121.400 121.400 119.886 1.514 25800
643 1 2 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.960 -0.390 25800
644 1 2 . 1 1 25 25 GLU C C 25 178.400 178.400 178.793 -0.393 25800
645 1 2 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.072 0.528 25800
646 1 2 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.536 0.064 25800
647 1 2 . 1 1 25 25 GLU H H 25 8.580 8.580 8.352 0.228 25800
648 1 2 . 1 1 26 26 ASN N N 26 114.800 114.800 117.074 -2.274 25800
649 1 2 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.465 -0.145 25800
650 1 2 . 1 1 26 26 ASN C C 26 177.400 177.400 177.727 -0.327 25800
651 1 2 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.871 0.029 25800
652 1 2 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.657 -0.757 25800
653 1 2 . 1 1 26 26 ASN H H 26 8.180 8.180 8.034 0.146 25800
654 1 2 . 1 1 27 27 GLU N N 27 118.900 118.900 119.848 -0.948 25800
655 1 2 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.135 0.005 25800
656 1 2 . 1 1 27 27 GLU C C 27 176.400 176.400 179.096 -2.696 25800
657 1 2 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.852 -1.452 25800
658 1 2 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.605 -0.205 25800
659 1 2 . 1 1 27 27 GLU H H 27 7.340 7.340 8.115 -0.775 25800
660 1 2 . 1 1 28 28 PHE N N 28 114.100 114.100 119.076 -4.976 25800
661 1 2 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.301 0.249 25800
662 1 2 . 1 1 28 28 PHE C C 28 176.300 176.300 177.978 -1.678 25800
663 1 2 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.351 -1.351 25800
664 1 2 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.865 1.935 25800
665 1 2 . 1 1 28 28 PHE H H 28 7.660 7.660 8.426 -0.766 25800
666 1 2 . 1 1 29 29 ARG N N 29 121.700 121.700 118.822 2.878 25800
667 1 2 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.301 0.109 25800
668 1 2 . 1 1 29 29 ARG C C 29 177.100 177.100 177.563 -0.463 25800
669 1 2 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.858 -0.658 25800
670 1 2 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.220 -0.920 25800
671 1 2 . 1 1 29 29 ARG H H 29 8.120 8.120 7.989 0.131 25800
672 1 2 . 1 1 30 30 LYS N N 30 117.200 117.200 117.531 -0.331 25800
673 1 2 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.218 -0.388 25800
674 1 2 . 1 1 30 30 LYS C C 30 177.100 177.100 178.525 -1.425 25800
675 1 2 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.041 -0.241 25800
676 1 2 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.063 -0.963 25800
677 1 2 . 1 1 30 30 LYS H H 30 7.630 7.630 7.652 -0.022 25800
678 1 2 . 1 1 31 31 TYR N N 31 117.100 117.100 119.489 -2.389 25800
679 1 2 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.533 -0.383 25800
680 1 2 . 1 1 31 31 TYR C C 31 174.400 174.400 176.704 -2.304 25800
681 1 2 . 1 1 31 31 TYR CA C 31 59.900 59.900 60.139 -0.239 25800
682 1 2 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.855 -1.955 25800
683 1 2 . 1 1 31 31 TYR H H 31 7.410 7.410 8.152 -0.742 25800
684 1 2 . 1 1 32 32 GLY N N 32 104.100 104.100 103.844 0.256 25800
685 1 2 . 1 1 32 32 GLY C C 32 177.000 177.000 171.700 5.300 25800
686 1 2 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.942 -0.442 25800
687 1 2 . 1 1 32 32 GLY H H 32 7.240 7.240 8.030 -0.790 25800
688 1 2 . 1 1 33 33 ASN N N 33 115.300 115.300 119.318 -4.018 25800
689 1 2 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.673 -0.233 25800
690 1 2 . 1 1 33 33 ASN C C 33 175.500 175.500 174.325 1.175 25800
691 1 2 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.194 1.106 25800
692 1 2 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.824 -0.424 25800
693 1 2 . 1 1 33 33 ASN H H 33 8.460 8.460 8.514 -0.054 25800
694 1 2 . 1 1 34 34 ILE N N 34 126.700 126.700 125.683 1.017 25800
695 1 2 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.292 -0.502 25800
696 1 2 . 1 1 34 34 ILE C C 34 175.600 175.600 175.058 0.542 25800
697 1 2 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.632 0.668 25800
698 1 2 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.639 1.361 25800
699 1 2 . 1 1 34 34 ILE H H 34 8.050 8.050 8.262 -0.212 25800
700 1 2 . 1 1 35 35 LEU N N 35 127.400 127.400 128.624 -1.224 25800
701 1 2 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.512 -0.352 25800
702 1 2 . 1 1 35 35 LEU C C 35 177.200 177.200 176.173 1.027 25800
703 1 2 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.421 0.079 25800
704 1 2 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.716 -0.016 25800
705 1 2 . 1 1 35 35 LEU H H 35 8.780 8.780 8.814 -0.034 25800
706 1 2 . 1 1 36 36 LYS N N 36 117.000 117.000 118.683 -1.683 25800
707 1 2 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.519 -0.279 25800
708 1 2 . 1 1 36 36 LYS C C 36 173.600 173.600 173.855 -0.255 25800
709 1 2 . 1 1 36 36 LYS CA C 36 55.900 55.900 56.377 -0.477 25800
710 1 2 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.366 1.234 25800
711 1 2 . 1 1 36 36 LYS H H 36 7.110 7.110 7.489 -0.379 25800
712 1 2 . 1 1 37 37 CYS N N 37 125.400 125.400 125.602 -0.202 25800
713 1 2 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.447 -0.747 25800
714 1 2 . 1 1 37 37 CYS C C 37 171.600 171.600 172.621 -1.021 25800
715 1 2 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.319 0.581 25800
716 1 2 . 1 1 37 37 CYS CB C 37 27.100 27.100 29.031 -1.931 25800
717 1 2 . 1 1 37 37 CYS H H 37 8.610 8.610 8.781 -0.171 25800
718 1 2 . 1 1 38 38 ASP N N 38 128.200 128.200 128.032 0.168 25800
719 1 2 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.013 -0.063 25800
720 1 2 . 1 1 38 38 ASP C C 38 174.300 174.300 173.982 0.318 25800
721 1 2 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.751 -0.551 25800
722 1 2 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.785 -1.485 25800
723 1 2 . 1 1 38 38 ASP H H 38 8.290 8.290 8.584 -0.294 25800
724 1 2 . 1 1 39 39 VAL N N 39 123.500 123.500 120.506 2.994 25800
725 1 2 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.005 -0.705 25800
726 1 2 . 1 1 39 39 VAL C C 39 175.000 175.000 175.208 -0.208 25800
727 1 2 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.257 0.443 25800
728 1 2 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.003 -0.903 25800
729 1 2 . 1 1 39 39 VAL H H 39 8.380 8.380 8.601 -0.221 25800
730 1 2 . 1 1 40 40 LYS N N 40 129.100 129.100 126.551 2.549 25800
731 1 2 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.980 -0.660 25800
732 1 2 . 1 1 40 40 LYS C C 40 173.700 173.700 174.566 -0.866 25800
733 1 2 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.435 -0.535 25800
734 1 2 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.864 -0.364 25800
735 1 2 . 1 1 40 40 LYS H H 40 8.680 8.680 9.330 -0.650 25800
736 1 2 . 1 1 41 41 LYS N N 41 117.300 117.300 120.863 -3.563 25800
737 1 2 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.299 -0.319 25800
738 1 2 . 1 1 41 41 LYS C C 41 177.800 177.800 175.503 2.297 25800
739 1 2 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.671 -0.071 25800
740 1 2 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.219 -0.219 25800
741 1 2 . 1 1 41 41 LYS H H 41 7.900 7.900 8.387 -0.487 25800
742 1 2 . 1 1 42 42 THR N N 42 113.200 113.200 115.589 -2.389 25800
743 1 2 . 1 1 42 42 THR HA H 42 4.680 4.680 4.708 -0.028 25800
744 1 2 . 1 1 42 42 THR C C 42 176.900 176.900 176.088 0.812 25800
745 1 2 . 1 1 42 42 THR CA C 42 60.200 60.200 60.467 -0.267 25800
746 1 2 . 1 1 42 42 THR CB C 42 71.600 71.600 69.949 1.651 25800
747 1 2 . 1 1 42 42 THR H H 42 8.730 8.730 8.630 0.100 25800
748 1 2 . 1 1 43 43 VAL N N 43 120.000 120.000 127.130 -7.130 25800
749 1 2 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.966 -0.046 25800
750 1 2 . 1 1 43 43 VAL C C 43 177.000 177.000 176.335 0.665 25800
751 1 2 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.295 0.405 25800
752 1 2 . 1 1 43 43 VAL CB C 43 31.800 31.800 32.047 -0.247 25800
753 1 2 . 1 1 43 43 VAL H H 43 8.730 8.730 8.617 0.113 25800
754 1 2 . 1 1 44 44 SER N N 44 113.400 113.400 114.075 -0.675 25800
755 1 2 . 1 1 44 44 SER HA H 44 4.360 4.360 4.359 0.001 25800
756 1 2 . 1 1 44 44 SER C C 44 174.800 174.800 175.237 -0.437 25800
757 1 2 . 1 1 44 44 SER CA C 44 58.400 58.400 58.587 -0.187 25800
758 1 2 . 1 1 44 44 SER CB C 44 63.500 63.500 63.497 0.003 25800
759 1 2 . 1 1 44 44 SER H H 44 7.760 7.760 7.906 -0.146 25800
760 1 2 . 1 1 45 45 GLY N N 45 110.200 110.200 108.767 1.433 25800
761 1 2 . 1 1 45 45 GLY C C 45 173.500 173.500 173.685 -0.185 25800
762 1 2 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.858 0.442 25800
763 1 2 . 1 1 45 45 GLY H H 45 7.820 7.820 7.804 0.016 25800
764 1 2 . 1 1 46 46 ALA N N 46 123.900 123.900 122.088 1.812 25800
765 1 2 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.223 0.167 25800
766 1 2 . 1 1 46 46 ALA C C 46 176.100 176.100 175.224 0.876 25800
767 1 2 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.910 -0.010 25800
768 1 2 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.894 -0.094 25800
769 1 2 . 1 1 46 46 ALA H H 46 7.440 7.440 7.765 -0.325 25800
770 1 2 . 1 1 47 47 ALA N N 47 123.100 123.100 122.089 1.011 25800
771 1 2 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.136 0.064 25800
772 1 2 . 1 1 47 47 ALA C C 47 176.100 176.100 175.000 1.100 25800
773 1 2 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.110 0.790 25800
774 1 2 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.585 -0.685 25800
775 1 2 . 1 1 47 47 ALA H H 47 8.350 8.350 7.920 0.430 25800
776 1 2 . 1 1 48 48 PHE N N 48 118.700 118.700 116.975 1.725 25800
777 1 2 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.215 -0.185 25800
778 1 2 . 1 1 48 48 PHE C C 48 171.600 171.600 173.973 -2.373 25800
779 1 2 . 1 1 48 48 PHE CA C 48 55.700 55.700 57.016 -1.316 25800
780 1 2 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.297 -2.097 25800
781 1 2 . 1 1 48 48 PHE H H 48 8.550 8.550 9.150 -0.600 25800
782 1 2 . 1 1 49 49 ALA N N 49 120.400 120.400 124.778 -4.378 25800
783 1 2 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.364 -0.034 25800
784 1 2 . 1 1 49 49 ALA C C 49 175.500 175.500 175.374 0.126 25800
785 1 2 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.165 -0.865 25800
786 1 2 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.651 2.049 25800
787 1 2 . 1 1 49 49 ALA H H 49 9.240 9.240 8.992 0.248 25800
788 1 2 . 1 1 50 50 PHE N N 50 115.000 115.000 120.922 -5.922 25800
789 1 2 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.616 -0.016 25800
790 1 2 . 1 1 50 50 PHE C C 50 176.000 176.000 174.302 1.698 25800
791 1 2 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.339 0.161 25800
792 1 2 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.273 -1.073 25800
793 1 2 . 1 1 50 50 PHE H H 50 7.920 7.920 9.031 -1.111 25800
794 1 2 . 1 1 51 51 ILE N N 51 123.000 123.000 122.101 0.899 25800
795 1 2 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.800 -0.350 25800
796 1 2 . 1 1 51 51 ILE C C 51 173.700 173.700 174.583 -0.883 25800
797 1 2 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.276 -0.076 25800
798 1 2 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.092 0.609 25800
799 1 2 . 1 1 51 51 ILE H H 51 8.490 8.490 9.129 -0.639 25800
800 1 2 . 1 1 52 52 GLU N N 52 126.600 126.600 127.414 -0.814 25800
801 1 2 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.518 0.252 25800
802 1 2 . 1 1 52 52 GLU C C 52 175.300 175.300 175.042 0.258 25800
803 1 2 . 1 1 52 52 GLU CA C 52 54.700 54.700 56.677 -1.977 25800
804 1 2 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.602 -0.103 25800
805 1 2 . 1 1 52 52 GLU H H 52 8.610 8.610 9.088 -0.478 25800
806 1 2 . 1 1 53 53 PHE N N 53 126.100 126.100 125.494 0.606 25800
807 1 2 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.231 -0.431 25800
808 1 2 . 1 1 53 53 PHE C C 53 175.400 175.400 175.787 -0.387 25800
809 1 2 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.764 1.436 25800
810 1 2 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.049 -2.149 25800
811 1 2 . 1 1 53 53 PHE H H 53 8.800 8.800 9.168 -0.368 25800
812 1 2 . 1 1 54 54 GLU N N 54 120.700 120.700 123.765 -3.065 25800
813 1 2 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.163 -0.233 25800
814 1 2 . 1 1 54 54 GLU C C 54 175.300 175.300 175.720 -0.420 25800
815 1 2 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.728 1.372 25800
816 1 2 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.427 0.373 25800
817 1 2 . 1 1 54 54 GLU H H 54 8.160 8.160 8.343 -0.183 25800
818 1 2 . 1 1 55 55 ASP N N 55 117.900 117.900 119.229 -1.329 25800
819 1 2 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.881 0.039 25800
820 1 2 . 1 1 55 55 ASP C C 55 176.400 176.400 175.535 0.865 25800
821 1 2 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.408 -1.008 25800
822 1 2 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.915 1.485 25800
823 1 2 . 1 1 55 55 ASP H H 55 8.740 8.740 8.276 0.464 25800
824 1 2 . 1 1 56 56 ALA N N 56 128.900 128.900 126.578 2.322 25800
825 1 2 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.067 -0.237 25800
826 1 2 . 1 1 56 56 ALA C C 56 179.800 179.800 179.163 0.637 25800
827 1 2 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.220 -0.020 25800
828 1 2 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.203 -0.303 25800
829 1 2 . 1 1 56 56 ALA H H 56 8.800 8.800 8.645 0.155 25800
830 1 2 . 1 1 57 57 ARG N N 57 119.200 119.200 117.551 1.649 25800
831 1 2 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.084 -0.194 25800
832 1 2 . 1 1 57 57 ARG C C 57 178.000 178.000 177.721 0.279 25800
833 1 2 . 1 1 57 57 ARG CA C 57 58.900 58.900 59.665 -0.765 25800
834 1 2 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.681 -0.381 25800
835 1 2 . 1 1 57 57 ARG H H 57 8.950 8.950 8.512 0.438 25800
836 1 2 . 1 1 58 58 ASP N N 58 120.900 120.900 117.770 3.130 25800
837 1 2 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.529 -0.439 25800
838 1 2 . 1 1 58 58 ASP C C 58 176.700 176.700 177.749 -1.049 25800
839 1 2 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.908 -0.408 25800
840 1 2 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.696 -0.796 25800
841 1 2 . 1 1 58 58 ASP H H 58 7.020 7.020 8.404 -1.384 25800
842 1 2 . 1 1 59 59 ALA N N 59 119.700 119.700 122.165 -2.465 25800
843 1 2 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.603 -1.523 25800
844 1 2 . 1 1 59 59 ALA C C 59 178.100 178.100 179.525 -1.425 25800
845 1 2 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.821 -0.520 25800
846 1 2 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.815 -0.415 25800
847 1 2 . 1 1 59 59 ALA H H 59 6.440 6.440 7.543 -1.103 25800
848 1 2 . 1 1 60 60 ALA N N 60 117.600 117.600 121.258 -3.658 25800
849 1 2 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.030 -0.200 25800
850 1 2 . 1 1 60 60 ALA C C 60 180.900 180.900 179.356 1.544 25800
851 1 2 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.494 -0.594 25800
852 1 2 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.272 -0.572 25800
853 1 2 . 1 1 60 60 ALA H H 60 7.330 7.330 8.530 -1.200 25800
854 1 2 . 1 1 61 61 ASP N N 61 120.100 120.100 117.672 2.428 25800
855 1 2 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.457 -0.247 25800
856 1 2 . 1 1 61 61 ASP C C 61 176.700 176.700 177.939 -1.239 25800
857 1 2 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.020 0.080 25800
858 1 2 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.486 -0.386 25800
859 1 2 . 1 1 61 61 ASP H H 61 7.590 7.590 8.175 -0.585 25800
860 1 2 . 1 1 62 62 ALA N N 62 122.200 122.200 121.709 0.491 25800
861 1 2 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.082 -1.662 25800
862 1 2 . 1 1 62 62 ALA C C 62 179.300 179.300 178.552 0.748 25800
863 1 2 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.726 0.874 25800
864 1 2 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.776 0.324 25800
865 1 2 . 1 1 62 62 ALA H H 62 7.440 7.440 7.433 0.007 25800
866 1 2 . 1 1 63 63 ILE N N 63 116.700 116.700 118.693 -1.993 25800
867 1 2 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.245 -1.005 25800
868 1 2 . 1 1 63 63 ILE C C 63 177.800 177.800 178.315 -0.515 25800
869 1 2 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.053 2.547 25800
870 1 2 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.371 0.529 25800
871 1 2 . 1 1 63 63 ILE H H 63 7.540 7.540 8.397 -0.857 25800
872 1 2 . 1 1 64 64 LYS N N 64 117.400 117.400 119.956 -2.556 25800
873 1 2 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.108 -0.208 25800
874 1 2 . 1 1 64 64 LYS C C 64 178.900 178.900 178.394 0.506 25800
875 1 2 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.942 -0.142 25800
876 1 2 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.541 1.059 25800
877 1 2 . 1 1 64 64 LYS H H 64 7.490 7.490 8.513 -1.023 25800
878 1 2 . 1 1 65 65 GLU N N 65 113.800 113.800 117.984 -4.184 25800
879 1 2 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.277 -0.117 25800
880 1 2 . 1 1 65 65 GLU C C 65 178.300 178.300 177.417 0.883 25800
881 1 2 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.156 0.144 25800
882 1 2 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.721 1.979 25800
883 1 2 . 1 1 65 65 GLU H H 65 7.960 7.960 8.199 -0.239 25800
884 1 2 . 1 1 66 66 LYS N N 66 114.700 114.700 118.434 -3.734 25800
885 1 2 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.559 -0.089 25800
886 1 2 . 1 1 66 66 LYS C C 66 177.500 177.500 176.310 1.190 25800
887 1 2 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.118 -0.718 25800
888 1 2 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.303 0.697 25800
889 1 2 . 1 1 66 66 LYS H H 66 8.050 8.050 7.720 0.330 25800
890 1 2 . 1 1 67 67 ASP N N 67 118.800 118.800 120.226 -1.426 25800
891 1 2 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.480 -0.260 25800
892 1 2 . 1 1 67 67 ASP C C 67 177.700 177.700 177.684 0.016 25800
893 1 2 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.305 4.095 25800
894 1 2 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.293 0.107 25800
895 1 2 . 1 1 67 67 ASP H H 67 7.620 7.620 7.442 0.178 25800
896 1 2 . 1 1 68 68 GLY N N 68 115.600 115.600 107.772 7.828 25800
897 1 2 . 1 1 68 68 GLY C C 68 173.800 173.800 174.601 -0.801 25800
898 1 2 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.773 1.127 25800
899 1 2 . 1 1 68 68 GLY H H 68 8.470 8.470 8.548 -0.078 25800
900 1 2 . 1 1 69 69 CYS N N 69 119.200 119.200 121.152 -1.952 25800
901 1 2 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.766 -0.606 25800
902 1 2 . 1 1 69 69 CYS C C 69 172.600 172.600 174.786 -2.186 25800
903 1 2 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.553 0.447 25800
904 1 2 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.211 -0.511 25800
905 1 2 . 1 1 69 69 CYS H H 69 7.890 7.890 8.087 -0.197 25800
906 1 2 . 1 1 70 70 ASP N N 70 122.200 122.200 124.980 -2.780 25800
907 1 2 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.866 -0.036 25800
908 1 2 . 1 1 70 70 ASP C C 70 176.400 176.400 175.218 1.182 25800
909 1 2 . 1 1 70 70 ASP CA C 70 54.700 54.700 54.358 0.342 25800
910 1 2 . 1 1 70 70 ASP CB C 70 42.700 42.700 41.930 0.770 25800
911 1 2 . 1 1 70 70 ASP H H 70 8.360 8.360 8.708 -0.348 25800
912 1 2 . 1 1 71 71 PHE N N 71 127.600 127.600 121.530 6.070 25800
913 1 2 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.184 -0.584 25800
914 1 2 . 1 1 71 71 PHE C C 71 173.600 173.600 174.399 -0.799 25800
915 1 2 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.211 0.589 25800
916 1 2 . 1 1 71 71 PHE CB C 71 40.700 40.700 42.590 -1.890 25800
917 1 2 . 1 1 71 71 PHE H H 71 9.390 9.390 7.790 1.600 25800
918 1 2 . 1 1 72 72 GLU N N 72 123.900 123.900 122.194 1.706 25800
919 1 2 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.067 -0.527 25800
920 1 2 . 1 1 72 72 GLU C C 72 175.500 175.500 175.913 -0.413 25800
921 1 2 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.497 0.203 25800
922 1 2 . 1 1 72 72 GLU CB C 72 27.300 27.300 29.462 -2.162 25800
923 1 2 . 1 1 72 72 GLU H H 72 8.940 8.940 9.140 -0.200 25800
924 1 2 . 1 1 73 73 GLY N N 73 105.200 105.200 109.554 -4.354 25800
925 1 2 . 1 1 73 73 GLY C C 73 174.100 174.100 173.051 1.049 25800
926 1 2 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.902 0.698 25800
927 1 2 . 1 1 73 73 GLY H H 73 8.350 8.350 8.606 -0.256 25800
928 1 2 . 1 1 74 74 ASN N N 74 121.000 121.000 115.705 5.295 25800
929 1 2 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.892 -0.132 25800
930 1 2 . 1 1 74 74 ASN C C 74 174.000 174.000 173.083 0.917 25800
931 1 2 . 1 1 74 74 ASN CA C 74 50.900 50.900 51.978 -1.078 25800
932 1 2 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.157 -0.457 25800
933 1 2 . 1 1 74 74 ASN H H 74 7.740 7.740 7.872 -0.132 25800
934 1 2 . 1 1 75 75 LYS N N 75 121.400 121.400 120.389 1.011 25800
935 1 2 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.612 -0.142 25800
936 1 2 . 1 1 75 75 LYS C C 75 176.900 176.900 174.979 1.921 25800
937 1 2 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.139 -0.839 25800
938 1 2 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.466 -1.566 25800
939 1 2 . 1 1 75 75 LYS H H 75 8.380 8.380 8.467 -0.087 25800
940 1 2 . 1 1 76 76 LEU N N 76 127.400 127.400 124.291 3.109 25800
941 1 2 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.447 -0.017 25800
942 1 2 . 1 1 76 76 LEU C C 76 177.600 177.600 174.190 3.410 25800
943 1 2 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.304 -0.004 25800
944 1 2 . 1 1 76 76 LEU CB C 76 43.100 43.100 45.510 -2.410 25800
945 1 2 . 1 1 76 76 LEU H H 76 8.950 8.950 8.380 0.570 25800
946 1 2 . 1 1 77 77 ARG N N 77 121.800 121.800 126.141 -4.341 25800
947 1 2 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.787 0.113 25800
948 1 2 . 1 1 77 77 ARG C C 77 174.700 174.700 173.925 0.775 25800
949 1 2 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.543 -1.543 25800
950 1 2 . 1 1 77 77 ARG CB C 77 32.300 32.300 32.313 -0.014 25800
951 1 2 . 1 1 77 77 ARG H H 77 7.530 7.530 8.854 -1.324 25800
952 1 2 . 1 1 78 78 VAL N N 78 127.000 127.000 125.241 1.759 25800
953 1 2 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.282 0.998 25800
954 1 2 . 1 1 78 78 VAL C C 78 174.200 174.200 174.402 -0.202 25800
955 1 2 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.731 -0.531 25800
956 1 2 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.260 -0.860 25800
957 1 2 . 1 1 78 78 VAL H H 78 9.660 9.660 8.601 1.059 25800
958 1 2 . 1 1 79 79 GLU N N 79 121.900 121.900 127.288 -5.388 25800
959 1 2 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.686 0.024 25800
960 1 2 . 1 1 79 79 GLU C C 79 174.600 174.600 174.217 0.383 25800
961 1 2 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.276 -1.376 25800
962 1 2 . 1 1 79 79 GLU CB C 79 34.400 34.400 33.978 0.422 25800
963 1 2 . 1 1 79 79 GLU H H 79 8.980 8.980 8.505 0.475 25800
964 1 2 . 1 1 80 80 VAL N N 80 121.300 121.300 122.401 -1.101 25800
965 1 2 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.336 0.034 25800
966 1 2 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.176 2.824 25800
967 1 2 . 1 1 80 80 VAL CB C 80 32.100 32.100 31.010 1.090 25800
968 1 2 . 1 1 80 80 VAL H H 80 8.410 8.410 8.487 -0.077 25800
969 1 2 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.307 -0.047 25800
970 1 2 . 1 1 81 81 PRO C C 81 176.100 176.100 177.186 -1.086 25800
971 1 2 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.831 -1.731 25800
972 1 2 . 1 1 81 81 PRO CB C 81 32.100 32.100 32.205 -0.105 25800
973 1 2 . 1 1 82 82 PHE N N 82 122.200 122.200 114.336 7.864 25800
974 1 2 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.375 -0.085 25800
975 1 2 . 1 1 82 82 PHE C C 82 175.300 175.300 176.647 -1.347 25800
976 1 2 . 1 1 82 82 PHE CA C 82 58.100 58.100 58.719 -0.619 25800
977 1 2 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.289 1.111 25800
978 1 2 . 1 1 82 82 PHE H H 82 8.150 8.150 7.936 0.214 25800
979 1 2 . 1 1 83 83 ASN N N 83 120.800 120.800 116.095 4.705 25800
980 1 2 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.003 0.437 25800
981 1 2 . 1 1 83 83 ASN C C 83 174.100 174.100 174.634 -0.534 25800
982 1 2 . 1 1 83 83 ASN CA C 83 52.700 52.700 55.571 -2.871 25800
983 1 2 . 1 1 83 83 ASN CB C 83 38.700 38.700 37.717 0.984 25800
984 1 2 . 1 1 83 83 ASN H H 83 8.110 8.110 7.501 0.609 25800
985 1 2 . 1 1 84 84 ALA N N 84 123.700 123.700 122.230 1.470 25800
986 1 2 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.817 -0.737 25800
987 1 2 . 1 1 84 84 ALA C C 84 177.100 177.100 175.500 1.600 25800
988 1 2 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.038 0.363 25800
989 1 2 . 1 1 84 84 ALA CB C 84 19.100 19.100 21.211 -2.111 25800
990 1 2 . 1 1 84 84 ALA H H 84 8.020 8.020 8.222 -0.202 25800
991 1 2 . 1 1 85 85 ARG N N 85 120.200 120.200 119.729 0.471 25800
992 1 2 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.754 -0.604 25800
993 1 2 . 1 1 85 85 ARG C C 85 175.200 175.200 174.743 0.457 25800
994 1 2 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.698 0.302 25800
995 1 2 . 1 1 85 85 ARG CB C 85 30.800 30.800 32.692 -1.892 25800
996 1 2 . 1 1 85 85 ARG H H 85 8.040 8.040 8.627 -0.587 25800
997 1 3 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.821 -0.231 25800
998 1 3 . 1 1 0 0 HIS C C 0 174.000 174.000 174.597 -0.597 25800
999 1 3 . 1 1 0 0 HIS CA C 0 55.300 55.300 55.233 0.068 25800
1000 1 3 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.481 -1.181 25800
1001 1 3 . 1 1 1 1 MET N N 1 122.400 122.400 119.608 2.792 25800
1002 1 3 . 1 1 1 1 MET HA H 1 4.340 4.340 4.421 -0.081 25800
1003 1 3 . 1 1 1 1 MET C C 1 175.600 175.600 174.959 0.641 25800
1004 1 3 . 1 1 1 1 MET CA C 1 55.600 55.600 54.660 0.940 25800
1005 1 3 . 1 1 1 1 MET CB C 1 32.800 32.800 35.371 -2.571 25800
1006 1 3 . 1 1 1 1 MET H H 1 8.310 8.310 8.446 -0.136 25800
1007 1 3 . 1 1 2 2 VAL N N 2 123.200 123.200 122.571 0.629 25800
1008 1 3 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.151 -0.191 25800
1009 1 3 . 1 1 2 2 VAL C C 2 175.600 175.600 175.204 0.396 25800
1010 1 3 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.975 -0.675 25800
1011 1 3 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.712 -0.412 25800
1012 1 3 . 1 1 2 2 VAL H H 2 8.180 8.180 8.296 -0.117 25800
1013 1 3 . 1 1 3 3 ILE N N 3 126.200 126.200 125.770 0.430 25800
1014 1 3 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.212 -0.162 25800
1015 1 3 . 1 1 3 3 ILE C C 3 175.800 175.800 175.299 0.501 25800
1016 1 3 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.231 -0.531 25800
1017 1 3 . 1 1 3 3 ILE CB C 3 38.300 38.300 39.216 -0.916 25800
1018 1 3 . 1 1 3 3 ILE H H 3 8.230 8.230 8.550 -0.320 25800
1019 1 3 . 1 1 4 4 ARG N N 4 126.100 126.100 119.948 6.152 25800
1020 1 3 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.456 -0.276 25800
1021 1 3 . 1 1 4 4 ARG C C 4 175.900 175.900 175.015 0.885 25800
1022 1 3 . 1 1 4 4 ARG CA C 4 56.000 56.000 55.620 0.380 25800
1023 1 3 . 1 1 4 4 ARG CB C 4 30.700 30.700 32.624 -1.925 25800
1024 1 3 . 1 1 4 4 ARG H H 4 8.360 8.360 7.818 0.542 25800
1025 1 3 . 1 1 5 5 GLU N N 5 122.200 122.200 118.529 3.671 25800
1026 1 3 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.051 0.089 25800
1027 1 3 . 1 1 5 5 GLU C C 5 176.100 176.100 175.180 0.920 25800
1028 1 3 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.358 -0.758 25800
1029 1 3 . 1 1 5 5 GLU CB C 5 30.300 30.300 28.975 1.325 25800
1030 1 3 . 1 1 5 5 GLU H H 5 8.400 8.400 8.803 -0.403 25800
1031 1 3 . 1 1 6 6 SER N N 6 116.200 116.200 112.245 3.955 25800
1032 1 3 . 1 1 6 6 SER HA H 6 4.350 4.350 4.187 0.163 25800
1033 1 3 . 1 1 6 6 SER C C 6 174.300 174.300 174.321 -0.021 25800
1034 1 3 . 1 1 6 6 SER CA C 6 58.200 58.200 58.685 -0.485 25800
1035 1 3 . 1 1 6 6 SER CB C 6 63.800 63.800 63.353 0.447 25800
1036 1 3 . 1 1 6 6 SER H H 6 8.270 8.270 7.391 0.879 25800
1037 1 3 . 1 1 7 7 VAL N N 7 119.800 119.800 127.290 -7.490 25800
1038 1 3 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.086 0.214 25800
1039 1 3 . 1 1 7 7 VAL C C 7 175.500 175.500 175.081 0.419 25800
1040 1 3 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.723 -0.023 25800
1041 1 3 . 1 1 7 7 VAL CB C 7 32.800 32.800 30.190 2.610 25800
1042 1 3 . 1 1 7 7 VAL H H 7 7.840 7.840 8.867 -1.027 25800
1043 1 3 . 1 1 8 8 SER N N 8 117.800 117.800 119.288 -1.488 25800
1044 1 3 . 1 1 8 8 SER HA H 8 4.240 4.240 4.085 0.155 25800
1045 1 3 . 1 1 8 8 SER C C 8 172.500 172.500 173.120 -0.620 25800
1046 1 3 . 1 1 8 8 SER CA C 8 58.500 58.500 58.845 -0.345 25800
1047 1 3 . 1 1 8 8 SER CB C 8 63.600 63.600 63.276 0.323 25800
1048 1 3 . 1 1 8 8 SER H H 8 8.530 8.530 8.050 0.480 25800
1049 1 3 . 1 1 9 9 ARG N N 9 123.000 123.000 120.012 2.988 25800
1050 1 3 . 1 1 9 9 ARG HA H 9 5.500 5.500 4.663 0.837 25800
1051 1 3 . 1 1 9 9 ARG C C 9 175.000 175.000 174.643 0.357 25800
1052 1 3 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.542 -0.242 25800
1053 1 3 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.853 0.547 25800
1054 1 3 . 1 1 9 9 ARG H H 9 7.350 7.350 7.353 -0.003 25800
1055 1 3 . 1 1 10 10 ILE N N 10 114.000 114.000 122.360 -8.360 25800
1056 1 3 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.061 0.759 25800
1057 1 3 . 1 1 10 10 ILE C C 10 173.000 173.000 174.639 -1.639 25800
1058 1 3 . 1 1 10 10 ILE CA C 10 59.400 59.400 62.063 -2.663 25800
1059 1 3 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.644 2.256 25800
1060 1 3 . 1 1 10 10 ILE H H 10 8.830 8.830 8.335 0.495 25800
1061 1 3 . 1 1 11 11 TYR N N 11 123.400 123.400 128.086 -4.686 25800
1062 1 3 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.164 -0.234 25800
1063 1 3 . 1 1 11 11 TYR C C 11 173.000 173.000 173.084 -0.084 25800
1064 1 3 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.603 0.397 25800
1065 1 3 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.242 -1.342 25800
1066 1 3 . 1 1 11 11 TYR H H 11 8.690 8.690 8.501 0.189 25800
1067 1 3 . 1 1 12 12 VAL N N 12 126.300 126.300 124.923 1.377 25800
1068 1 3 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.604 -0.044 25800
1069 1 3 . 1 1 12 12 VAL C C 12 174.100 174.100 173.250 0.850 25800
1070 1 3 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.024 1.176 25800
1071 1 3 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.993 -2.593 25800
1072 1 3 . 1 1 12 12 VAL H H 12 8.370 8.370 8.216 0.154 25800
1073 1 3 . 1 1 13 13 GLY N N 13 113.000 113.000 113.087 -0.087 25800
1074 1 3 . 1 1 13 13 GLY C C 13 173.100 173.100 172.544 0.556 25800
1075 1 3 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.524 -0.224 25800
1076 1 3 . 1 1 13 13 GLY H H 13 9.350 9.350 8.590 0.760 25800
1077 1 3 . 1 1 14 14 ASN N N 14 113.900 113.900 116.120 -2.220 25800
1078 1 3 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.121 0.159 25800
1079 1 3 . 1 1 14 14 ASN C C 14 175.800 175.800 175.034 0.766 25800
1080 1 3 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.125 -0.525 25800
1081 1 3 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.973 0.727 25800
1082 1 3 . 1 1 14 14 ASN H H 14 8.800 8.800 7.849 0.951 25800
1083 1 3 . 1 1 15 15 LEU N N 15 115.800 115.800 115.229 0.571 25800
1084 1 3 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.621 0.369 25800
1085 1 3 . 1 1 15 15 LEU CA C 15 55.600 55.600 52.668 2.932 25800
1086 1 3 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.519 0.081 25800
1087 1 3 . 1 1 15 15 LEU H H 15 7.150 7.150 7.209 -0.059 25800
1088 1 3 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.569 -0.499 25800
1089 1 3 . 1 1 16 16 PRO C C 16 171.500 171.500 177.143 -5.643 25800
1090 1 3 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.237 -0.737 25800
1091 1 3 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.900 0.100 25800
1092 1 3 . 1 1 17 17 SER N N 17 115.200 115.200 119.027 -3.827 25800
1093 1 3 . 1 1 17 17 SER HA H 17 4.300 4.300 4.010 0.290 25800
1094 1 3 . 1 1 17 17 SER C C 17 174.200 174.200 173.004 1.196 25800
1095 1 3 . 1 1 17 17 SER CA C 17 58.200 58.200 60.103 -1.903 25800
1096 1 3 . 1 1 17 17 SER CB C 17 63.900 63.900 62.093 1.806 25800
1097 1 3 . 1 1 17 17 SER H H 17 8.470 8.470 8.720 -0.250 25800
1098 1 3 . 1 1 18 18 HIS N N 18 120.800 120.800 117.564 3.236 25800
1099 1 3 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.811 -0.261 25800
1100 1 3 . 1 1 18 18 HIS C C 18 175.100 175.100 174.080 1.020 25800
1101 1 3 . 1 1 18 18 HIS CA C 18 55.500 55.500 54.596 0.904 25800
1102 1 3 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.372 -0.073 25800
1103 1 3 . 1 1 18 18 HIS H H 18 8.540 8.540 7.984 0.556 25800
1104 1 3 . 1 1 19 19 VAL N N 19 115.700 115.700 123.257 -7.557 25800
1105 1 3 . 1 1 19 19 VAL HA H 19 4.260 4.260 3.946 0.314 25800
1106 1 3 . 1 1 19 19 VAL C C 19 174.000 174.000 175.670 -1.670 25800
1107 1 3 . 1 1 19 19 VAL CA C 19 61.900 61.900 62.987 -1.087 25800
1108 1 3 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.936 -0.336 25800
1109 1 3 . 1 1 19 19 VAL H H 19 6.650 6.650 8.025 -1.375 25800
1110 1 3 . 1 1 20 20 SER N N 20 118.800 118.800 124.306 -5.506 25800
1111 1 3 . 1 1 20 20 SER HA H 20 4.710 4.710 4.598 0.112 25800
1112 1 3 . 1 1 20 20 SER C C 20 175.900 175.900 175.761 0.139 25800
1113 1 3 . 1 1 20 20 SER CA C 20 55.800 55.800 58.501 -2.701 25800
1114 1 3 . 1 1 20 20 SER CB C 20 66.600 66.600 63.996 2.604 25800
1115 1 3 . 1 1 20 20 SER H H 20 8.930 8.930 8.494 0.436 25800
1116 1 3 . 1 1 21 21 SER N N 21 117.100 117.100 120.269 -3.169 25800
1117 1 3 . 1 1 21 21 SER HA H 21 3.880 3.880 4.168 -0.288 25800
1118 1 3 . 1 1 21 21 SER C C 21 176.200 176.200 176.566 -0.366 25800
1119 1 3 . 1 1 21 21 SER CA C 21 62.300 62.300 62.112 0.188 25800
1120 1 3 . 1 1 21 21 SER CB C 21 66.800 66.800 63.146 3.654 25800
1121 1 3 . 1 1 21 21 SER H H 21 9.080 9.080 8.976 0.104 25800
1122 1 3 . 1 1 22 22 ARG N N 22 121.200 121.200 119.518 1.682 25800
1123 1 3 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.207 -0.217 25800
1124 1 3 . 1 1 22 22 ARG C C 22 177.900 177.900 178.234 -0.334 25800
1125 1 3 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.774 -0.074 25800
1126 1 3 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.837 -0.236 25800
1127 1 3 . 1 1 22 22 ARG H H 22 7.940 7.940 8.387 -0.447 25800
1128 1 3 . 1 1 23 23 ASP N N 23 118.800 118.800 120.752 -1.952 25800
1129 1 3 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.466 -0.076 25800
1130 1 3 . 1 1 23 23 ASP C C 23 179.200 179.200 178.420 0.780 25800
1131 1 3 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.483 -0.182 25800
1132 1 3 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.972 0.028 25800
1133 1 3 . 1 1 23 23 ASP H H 23 7.480 7.480 7.975 -0.495 25800
1134 1 3 . 1 1 24 24 VAL N N 24 119.500 119.500 116.693 2.807 25800
1135 1 3 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.808 -0.438 25800
1136 1 3 . 1 1 24 24 VAL C C 24 177.500 177.500 177.433 0.067 25800
1137 1 3 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.607 1.293 25800
1138 1 3 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.466 -0.066 25800
1139 1 3 . 1 1 24 24 VAL H H 24 7.450 7.450 7.701 -0.251 25800
1140 1 3 . 1 1 25 25 GLU N N 25 121.400 121.400 120.091 1.309 25800
1141 1 3 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.096 -0.525 25800
1142 1 3 . 1 1 25 25 GLU C C 25 178.400 178.400 178.472 -0.072 25800
1143 1 3 . 1 1 25 25 GLU CA C 25 60.600 60.600 59.865 0.735 25800
1144 1 3 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.288 0.312 25800
1145 1 3 . 1 1 25 25 GLU H H 25 8.580 8.580 8.230 0.350 25800
1146 1 3 . 1 1 26 26 ASN N N 26 114.800 114.800 117.250 -2.450 25800
1147 1 3 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.569 -0.249 25800
1148 1 3 . 1 1 26 26 ASN C C 26 177.400 177.400 178.031 -0.631 25800
1149 1 3 . 1 1 26 26 ASN CA C 26 55.900 55.900 56.026 -0.126 25800
1150 1 3 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.655 -0.755 25800
1151 1 3 . 1 1 26 26 ASN H H 26 8.180 8.180 7.708 0.472 25800
1152 1 3 . 1 1 27 27 GLU N N 27 118.900 118.900 121.943 -3.043 25800
1153 1 3 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.076 0.064 25800
1154 1 3 . 1 1 27 27 GLU C C 27 176.400 176.400 179.198 -2.798 25800
1155 1 3 . 1 1 27 27 GLU CA C 27 57.400 57.400 59.285 -1.885 25800
1156 1 3 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.497 -0.097 25800
1157 1 3 . 1 1 27 27 GLU H H 27 7.340 7.340 7.707 -0.367 25800
1158 1 3 . 1 1 28 28 PHE N N 28 114.100 114.100 117.113 -3.013 25800
1159 1 3 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.653 -0.103 25800
1160 1 3 . 1 1 28 28 PHE C C 28 176.300 176.300 177.867 -1.567 25800
1161 1 3 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.185 -0.185 25800
1162 1 3 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.696 2.104 25800
1163 1 3 . 1 1 28 28 PHE H H 28 7.660 7.660 8.372 -0.712 25800
1164 1 3 . 1 1 29 29 ARG N N 29 121.700 121.700 119.514 2.186 25800
1165 1 3 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.359 0.051 25800
1166 1 3 . 1 1 29 29 ARG C C 29 177.100 177.100 177.304 -0.204 25800
1167 1 3 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.144 0.056 25800
1168 1 3 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.005 -0.705 25800
1169 1 3 . 1 1 29 29 ARG H H 29 8.120 8.120 7.666 0.454 25800
1170 1 3 . 1 1 30 30 LYS N N 30 117.200 117.200 119.069 -1.869 25800
1171 1 3 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.029 -0.199 25800
1172 1 3 . 1 1 30 30 LYS C C 30 177.100 177.100 177.988 -0.888 25800
1173 1 3 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.732 -0.932 25800
1174 1 3 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.344 -1.244 25800
1175 1 3 . 1 1 30 30 LYS H H 30 7.630 7.630 7.697 -0.067 25800
1176 1 3 . 1 1 31 31 TYR N N 31 117.100 117.100 116.362 0.738 25800
1177 1 3 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.654 -0.504 25800
1178 1 3 . 1 1 31 31 TYR C C 31 174.400 174.400 175.805 -1.405 25800
1179 1 3 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.532 0.368 25800
1180 1 3 . 1 1 31 31 TYR CB C 31 37.900 37.900 40.600 -2.700 25800
1181 1 3 . 1 1 31 31 TYR H H 31 7.410 7.410 8.035 -0.625 25800
1182 1 3 . 1 1 32 32 GLY N N 32 104.100 104.100 104.251 -0.151 25800
1183 1 3 . 1 1 32 32 GLY C C 32 177.000 177.000 172.643 4.357 25800
1184 1 3 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.193 -0.693 25800
1185 1 3 . 1 1 32 32 GLY H H 32 7.240 7.240 7.585 -0.345 25800
1186 1 3 . 1 1 33 33 ASN N N 33 115.300 115.300 119.956 -4.656 25800
1187 1 3 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.824 -0.384 25800
1188 1 3 . 1 1 33 33 ASN C C 33 175.500 175.500 175.029 0.471 25800
1189 1 3 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.405 1.895 25800
1190 1 3 . 1 1 33 33 ASN CB C 33 38.400 38.400 37.700 0.700 25800
1191 1 3 . 1 1 33 33 ASN H H 33 8.460 8.460 8.434 0.026 25800
1192 1 3 . 1 1 34 34 ILE N N 34 126.700 126.700 123.529 3.171 25800
1193 1 3 . 1 1 34 34 ILE HA H 34 3.790 3.790 3.962 -0.172 25800
1194 1 3 . 1 1 34 34 ILE C C 34 175.600 175.600 175.066 0.534 25800
1195 1 3 . 1 1 34 34 ILE CA C 34 61.300 61.300 62.534 -1.234 25800
1196 1 3 . 1 1 34 34 ILE CB C 34 40.000 40.000 37.984 2.016 25800
1197 1 3 . 1 1 34 34 ILE H H 34 8.050 8.050 7.813 0.237 25800
1198 1 3 . 1 1 35 35 LEU N N 35 127.400 127.400 127.286 0.114 25800
1199 1 3 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.535 -0.375 25800
1200 1 3 . 1 1 35 35 LEU C C 35 177.200 177.200 177.112 0.088 25800
1201 1 3 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.166 0.334 25800
1202 1 3 . 1 1 35 35 LEU CB C 35 42.700 42.700 43.267 -0.567 25800
1203 1 3 . 1 1 35 35 LEU H H 35 8.780 8.780 8.376 0.404 25800
1204 1 3 . 1 1 36 36 LYS N N 36 117.000 117.000 117.791 -0.791 25800
1205 1 3 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.644 -0.404 25800
1206 1 3 . 1 1 36 36 LYS C C 36 173.600 173.600 174.253 -0.653 25800
1207 1 3 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.477 0.423 25800
1208 1 3 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.912 -0.312 25800
1209 1 3 . 1 1 36 36 LYS H H 36 7.110 7.110 7.760 -0.650 25800
1210 1 3 . 1 1 37 37 CYS N N 37 125.400 125.400 118.367 7.033 25800
1211 1 3 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.611 -0.911 25800
1212 1 3 . 1 1 37 37 CYS C C 37 171.600 171.600 172.971 -1.371 25800
1213 1 3 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.100 0.800 25800
1214 1 3 . 1 1 37 37 CYS CB C 37 27.100 27.100 30.621 -3.521 25800
1215 1 3 . 1 1 37 37 CYS H H 37 8.610 8.610 8.865 -0.255 25800
1216 1 3 . 1 1 38 38 ASP N N 38 128.200 128.200 125.096 3.104 25800
1217 1 3 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.300 -0.350 25800
1218 1 3 . 1 1 38 38 ASP C C 38 174.300 174.300 175.644 -1.344 25800
1219 1 3 . 1 1 38 38 ASP CA C 38 53.200 53.200 54.166 -0.966 25800
1220 1 3 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.385 -1.085 25800
1221 1 3 . 1 1 38 38 ASP H H 38 8.290 8.290 8.790 -0.500 25800
1222 1 3 . 1 1 39 39 VAL N N 39 123.500 123.500 122.168 1.332 25800
1223 1 3 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.757 -0.457 25800
1224 1 3 . 1 1 39 39 VAL C C 39 175.000 175.000 176.605 -1.605 25800
1225 1 3 . 1 1 39 39 VAL CA C 39 61.700 61.700 62.331 -0.631 25800
1226 1 3 . 1 1 39 39 VAL CB C 39 33.100 33.100 32.552 0.548 25800
1227 1 3 . 1 1 39 39 VAL H H 39 8.380 8.380 8.846 -0.466 25800
1228 1 3 . 1 1 40 40 LYS N N 40 129.100 129.100 124.539 4.561 25800
1229 1 3 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.815 -0.495 25800
1230 1 3 . 1 1 40 40 LYS C C 40 173.700 173.700 174.333 -0.633 25800
1231 1 3 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.785 -0.885 25800
1232 1 3 . 1 1 40 40 LYS CB C 40 35.500 35.500 36.595 -1.095 25800
1233 1 3 . 1 1 40 40 LYS H H 40 8.680 8.680 9.213 -0.533 25800
1234 1 3 . 1 1 41 41 LYS N N 41 117.300 117.300 121.818 -4.518 25800
1235 1 3 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.581 -0.601 25800
1236 1 3 . 1 1 41 41 LYS C C 41 177.800 177.800 175.940 1.860 25800
1237 1 3 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.547 0.052 25800
1238 1 3 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.455 -0.455 25800
1239 1 3 . 1 1 41 41 LYS H H 41 7.900 7.900 8.428 -0.528 25800
1240 1 3 . 1 1 42 42 THR N N 42 113.200 113.200 113.730 -0.530 25800
1241 1 3 . 1 1 42 42 THR HA H 42 4.680 4.680 4.739 -0.059 25800
1242 1 3 . 1 1 42 42 THR C C 42 176.900 176.900 176.385 0.515 25800
1243 1 3 . 1 1 42 42 THR CA C 42 60.200 60.200 60.570 -0.370 25800
1244 1 3 . 1 1 42 42 THR CB C 42 71.600 71.600 69.965 1.635 25800
1245 1 3 . 1 1 42 42 THR H H 42 8.730 8.730 8.432 0.298 25800
1246 1 3 . 1 1 43 43 VAL N N 43 120.000 120.000 118.015 1.985 25800
1247 1 3 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.040 -0.120 25800
1248 1 3 . 1 1 43 43 VAL C C 43 177.000 177.000 176.691 0.309 25800
1249 1 3 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.576 0.124 25800
1250 1 3 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.669 0.130 25800
1251 1 3 . 1 1 43 43 VAL H H 43 8.730 8.730 8.510 0.220 25800
1252 1 3 . 1 1 44 44 SER N N 44 113.400 113.400 115.401 -2.001 25800
1253 1 3 . 1 1 44 44 SER HA H 44 4.360 4.360 4.451 -0.091 25800
1254 1 3 . 1 1 44 44 SER C C 44 174.800 174.800 175.442 -0.642 25800
1255 1 3 . 1 1 44 44 SER CA C 44 58.400 58.400 58.494 -0.094 25800
1256 1 3 . 1 1 44 44 SER CB C 44 63.500 63.500 63.612 -0.112 25800
1257 1 3 . 1 1 44 44 SER H H 44 7.760 7.760 8.087 -0.327 25800
1258 1 3 . 1 1 45 45 GLY N N 45 110.200 110.200 108.617 1.583 25800
1259 1 3 . 1 1 45 45 GLY C C 45 173.500 173.500 173.982 -0.482 25800
1260 1 3 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.828 0.471 25800
1261 1 3 . 1 1 45 45 GLY H H 45 7.820 7.820 7.802 0.018 25800
1262 1 3 . 1 1 46 46 ALA N N 46 123.900 123.900 123.749 0.151 25800
1263 1 3 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.210 0.180 25800
1264 1 3 . 1 1 46 46 ALA C C 46 176.100 176.100 175.938 0.162 25800
1265 1 3 . 1 1 46 46 ALA CA C 46 51.900 51.900 52.310 -0.410 25800
1266 1 3 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.859 -0.059 25800
1267 1 3 . 1 1 46 46 ALA H H 46 7.440 7.440 7.665 -0.225 25800
1268 1 3 . 1 1 47 47 ALA N N 47 123.100 123.100 125.850 -2.750 25800
1269 1 3 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.239 -0.039 25800
1270 1 3 . 1 1 47 47 ALA C C 47 176.100 176.100 175.654 0.446 25800
1271 1 3 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.393 0.507 25800
1272 1 3 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.087 0.813 25800
1273 1 3 . 1 1 47 47 ALA H H 47 8.350 8.350 7.934 0.416 25800
1274 1 3 . 1 1 48 48 PHE N N 48 118.700 118.700 119.690 -0.990 25800
1275 1 3 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.345 -0.315 25800
1276 1 3 . 1 1 48 48 PHE C C 48 171.600 171.600 173.737 -2.137 25800
1277 1 3 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.554 -0.854 25800
1278 1 3 . 1 1 48 48 PHE CB C 48 41.200 41.200 44.202 -3.002 25800
1279 1 3 . 1 1 48 48 PHE H H 48 8.550 8.550 8.838 -0.288 25800
1280 1 3 . 1 1 49 49 ALA N N 49 120.400 120.400 120.859 -0.459 25800
1281 1 3 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.444 -0.114 25800
1282 1 3 . 1 1 49 49 ALA C C 49 175.500 175.500 174.866 0.634 25800
1283 1 3 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.811 -1.511 25800
1284 1 3 . 1 1 49 49 ALA CB C 49 23.700 23.700 22.894 0.806 25800
1285 1 3 . 1 1 49 49 ALA H H 49 9.240 9.240 9.000 0.240 25800
1286 1 3 . 1 1 50 50 PHE N N 50 115.000 115.000 117.443 -2.443 25800
1287 1 3 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.539 0.061 25800
1288 1 3 . 1 1 50 50 PHE C C 50 176.000 176.000 174.187 1.813 25800
1289 1 3 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.763 -0.263 25800
1290 1 3 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.698 -1.498 25800
1291 1 3 . 1 1 50 50 PHE H H 50 7.920 7.920 8.596 -0.676 25800
1292 1 3 . 1 1 51 51 ILE N N 51 123.000 123.000 121.692 1.308 25800
1293 1 3 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.854 -0.404 25800
1294 1 3 . 1 1 51 51 ILE C C 51 173.700 173.700 174.328 -0.628 25800
1295 1 3 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.323 -0.123 25800
1296 1 3 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.448 -0.748 25800
1297 1 3 . 1 1 51 51 ILE H H 51 8.490 8.490 9.207 -0.717 25800
1298 1 3 . 1 1 52 52 GLU N N 52 126.600 126.600 126.638 -0.038 25800
1299 1 3 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.676 0.094 25800
1300 1 3 . 1 1 52 52 GLU C C 52 175.300 175.300 175.455 -0.155 25800
1301 1 3 . 1 1 52 52 GLU CA C 52 54.700 54.700 56.175 -1.476 25800
1302 1 3 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.613 -0.113 25800
1303 1 3 . 1 1 52 52 GLU H H 52 8.610 8.610 8.868 -0.258 25800
1304 1 3 . 1 1 53 53 PHE N N 53 126.100 126.100 125.158 0.942 25800
1305 1 3 . 1 1 53 53 PHE HA H 53 4.800 4.800 4.795 0.005 25800
1306 1 3 . 1 1 53 53 PHE C C 53 175.400 175.400 174.354 1.046 25800
1307 1 3 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.998 1.202 25800
1308 1 3 . 1 1 53 53 PHE CB C 53 40.900 40.900 42.105 -1.204 25800
1309 1 3 . 1 1 53 53 PHE H H 53 8.800 8.800 9.055 -0.255 25800
1310 1 3 . 1 1 54 54 GLU N N 54 120.700 120.700 123.278 -2.578 25800
1311 1 3 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.356 -0.426 25800
1312 1 3 . 1 1 54 54 GLU C C 54 175.300 175.300 175.535 -0.235 25800
1313 1 3 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.229 1.871 25800
1314 1 3 . 1 1 54 54 GLU CB C 54 30.800 30.800 31.789 -0.989 25800
1315 1 3 . 1 1 54 54 GLU H H 54 8.160 8.160 8.810 -0.650 25800
1316 1 3 . 1 1 55 55 ASP N N 55 117.900 117.900 119.621 -1.721 25800
1317 1 3 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.889 0.031 25800
1318 1 3 . 1 1 55 55 ASP C C 55 176.400 176.400 176.145 0.255 25800
1319 1 3 . 1 1 55 55 ASP CA C 55 52.400 52.400 52.415 -0.015 25800
1320 1 3 . 1 1 55 55 ASP CB C 55 44.400 44.400 39.982 4.418 25800
1321 1 3 . 1 1 55 55 ASP H H 55 8.740 8.740 8.121 0.619 25800
1322 1 3 . 1 1 56 56 ALA N N 56 128.900 128.900 124.495 4.405 25800
1323 1 3 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.234 -0.404 25800
1324 1 3 . 1 1 56 56 ALA C C 56 179.800 179.800 179.003 0.797 25800
1325 1 3 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.444 -0.244 25800
1326 1 3 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.250 -0.350 25800
1327 1 3 . 1 1 56 56 ALA H H 56 8.800 8.800 8.627 0.173 25800
1328 1 3 . 1 1 57 57 ARG N N 57 119.200 119.200 115.909 3.291 25800
1329 1 3 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.138 -0.248 25800
1330 1 3 . 1 1 57 57 ARG C C 57 178.000 178.000 177.421 0.579 25800
1331 1 3 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.584 0.316 25800
1332 1 3 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.541 -0.241 25800
1333 1 3 . 1 1 57 57 ARG H H 57 8.950 8.950 8.374 0.576 25800
1334 1 3 . 1 1 58 58 ASP N N 58 120.900 120.900 119.720 1.180 25800
1335 1 3 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.614 -0.524 25800
1336 1 3 . 1 1 58 58 ASP C C 58 176.700 176.700 177.774 -1.074 25800
1337 1 3 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.210 0.290 25800
1338 1 3 . 1 1 58 58 ASP CB C 58 39.900 39.900 41.812 -1.913 25800
1339 1 3 . 1 1 58 58 ASP H H 58 7.020 7.020 7.852 -0.832 25800
1340 1 3 . 1 1 59 59 ALA N N 59 119.700 119.700 123.319 -3.619 25800
1341 1 3 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.326 -1.246 25800
1342 1 3 . 1 1 59 59 ALA C C 59 178.100 178.100 179.485 -1.385 25800
1343 1 3 . 1 1 59 59 ALA CA C 59 54.300 54.300 55.029 -0.729 25800
1344 1 3 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.799 -0.400 25800
1345 1 3 . 1 1 59 59 ALA H H 59 6.440 6.440 8.553 -2.113 25800
1346 1 3 . 1 1 60 60 ALA N N 60 117.600 117.600 120.655 -3.055 25800
1347 1 3 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.034 -0.204 25800
1348 1 3 . 1 1 60 60 ALA C C 60 180.900 180.900 179.205 1.695 25800
1349 1 3 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.187 -0.287 25800
1350 1 3 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.247 -0.547 25800
1351 1 3 . 1 1 60 60 ALA H H 60 7.330 7.330 8.298 -0.968 25800
1352 1 3 . 1 1 61 61 ASP N N 61 120.100 120.100 117.941 2.159 25800
1353 1 3 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.477 -0.267 25800
1354 1 3 . 1 1 61 61 ASP C C 61 176.700 176.700 177.928 -1.228 25800
1355 1 3 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.020 0.080 25800
1356 1 3 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.360 -0.260 25800
1357 1 3 . 1 1 61 61 ASP H H 61 7.590 7.590 8.248 -0.658 25800
1358 1 3 . 1 1 62 62 ALA N N 62 122.200 122.200 121.906 0.294 25800
1359 1 3 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.211 -1.791 25800
1360 1 3 . 1 1 62 62 ALA C C 62 179.300 179.300 178.876 0.424 25800
1361 1 3 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.957 0.643 25800
1362 1 3 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.468 0.632 25800
1363 1 3 . 1 1 62 62 ALA H H 62 7.440 7.440 7.507 -0.067 25800
1364 1 3 . 1 1 63 63 ILE N N 63 116.700 116.700 118.961 -2.261 25800
1365 1 3 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.186 -0.946 25800
1366 1 3 . 1 1 63 63 ILE C C 63 177.800 177.800 177.960 -0.160 25800
1367 1 3 . 1 1 63 63 ILE CA C 63 65.600 65.600 62.669 2.932 25800
1368 1 3 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.429 0.471 25800
1369 1 3 . 1 1 63 63 ILE H H 63 7.540 7.540 7.735 -0.195 25800
1370 1 3 . 1 1 64 64 LYS N N 64 117.400 117.400 119.891 -2.491 25800
1371 1 3 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.189 -0.289 25800
1372 1 3 . 1 1 64 64 LYS C C 64 178.900 178.900 177.797 1.103 25800
1373 1 3 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.554 0.246 25800
1374 1 3 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.515 1.085 25800
1375 1 3 . 1 1 64 64 LYS H H 64 7.490 7.490 8.526 -1.036 25800
1376 1 3 . 1 1 65 65 GLU N N 65 113.800 113.800 117.208 -3.408 25800
1377 1 3 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.306 -0.146 25800
1378 1 3 . 1 1 65 65 GLU C C 65 178.300 178.300 177.601 0.699 25800
1379 1 3 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.142 0.158 25800
1380 1 3 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.238 1.462 25800
1381 1 3 . 1 1 65 65 GLU H H 65 7.960 7.960 8.306 -0.346 25800
1382 1 3 . 1 1 66 66 LYS N N 66 114.700 114.700 118.538 -3.838 25800
1383 1 3 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.478 -0.008 25800
1384 1 3 . 1 1 66 66 LYS C C 66 177.500 177.500 177.026 0.474 25800
1385 1 3 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.601 -1.201 25800
1386 1 3 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.815 0.185 25800
1387 1 3 . 1 1 66 66 LYS H H 66 8.050 8.050 7.952 0.098 25800
1388 1 3 . 1 1 67 67 ASP N N 67 118.800 118.800 120.521 -1.721 25800
1389 1 3 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.485 -0.265 25800
1390 1 3 . 1 1 67 67 ASP C C 67 177.700 177.700 177.565 0.135 25800
1391 1 3 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.434 3.966 25800
1392 1 3 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.274 0.126 25800
1393 1 3 . 1 1 67 67 ASP H H 67 7.620 7.620 7.622 -0.002 25800
1394 1 3 . 1 1 68 68 GLY N N 68 115.600 115.600 107.744 7.856 25800
1395 1 3 . 1 1 68 68 GLY C C 68 173.800 173.800 174.810 -1.010 25800
1396 1 3 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.320 1.580 25800
1397 1 3 . 1 1 68 68 GLY H H 68 8.470 8.470 8.574 -0.104 25800
1398 1 3 . 1 1 69 69 CYS N N 69 119.200 119.200 119.504 -0.304 25800
1399 1 3 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.597 -0.437 25800
1400 1 3 . 1 1 69 69 CYS C C 69 172.600 172.600 173.761 -1.161 25800
1401 1 3 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.856 0.144 25800
1402 1 3 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.434 -0.734 25800
1403 1 3 . 1 1 69 69 CYS H H 69 7.890 7.890 8.404 -0.514 25800
1404 1 3 . 1 1 70 70 ASP N N 70 122.200 122.200 124.160 -1.960 25800
1405 1 3 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.332 0.498 25800
1406 1 3 . 1 1 70 70 ASP C C 70 176.400 176.400 174.114 2.286 25800
1407 1 3 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.033 1.667 25800
1408 1 3 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.375 -1.675 25800
1409 1 3 . 1 1 70 70 ASP H H 70 8.360 8.360 8.293 0.067 25800
1410 1 3 . 1 1 71 71 PHE N N 71 127.600 127.600 117.896 9.704 25800
1411 1 3 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.064 -0.464 25800
1412 1 3 . 1 1 71 71 PHE C C 71 173.600 173.600 174.500 -0.900 25800
1413 1 3 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.562 0.238 25800
1414 1 3 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.255 -0.555 25800
1415 1 3 . 1 1 71 71 PHE H H 71 9.390 9.390 7.467 1.923 25800
1416 1 3 . 1 1 72 72 GLU N N 72 123.900 123.900 119.924 3.976 25800
1417 1 3 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.082 -0.542 25800
1418 1 3 . 1 1 72 72 GLU C C 72 175.500 175.500 177.629 -2.129 25800
1419 1 3 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.797 -0.097 25800
1420 1 3 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.326 -1.026 25800
1421 1 3 . 1 1 72 72 GLU H H 72 8.940 8.940 9.235 -0.295 25800
1422 1 3 . 1 1 73 73 GLY N N 73 105.200 105.200 112.205 -7.005 25800
1423 1 3 . 1 1 73 73 GLY C C 73 174.100 174.100 174.267 -0.167 25800
1424 1 3 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.538 0.062 25800
1425 1 3 . 1 1 73 73 GLY H H 73 8.350 8.350 8.730 -0.380 25800
1426 1 3 . 1 1 74 74 ASN N N 74 121.000 121.000 122.709 -1.709 25800
1427 1 3 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.637 0.123 25800
1428 1 3 . 1 1 74 74 ASN C C 74 174.000 174.000 174.236 -0.236 25800
1429 1 3 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.574 -2.674 25800
1430 1 3 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.000 0.700 25800
1431 1 3 . 1 1 74 74 ASN H H 74 7.740 7.740 8.166 -0.426 25800
1432 1 3 . 1 1 75 75 LYS N N 75 121.400 121.400 121.549 -0.149 25800
1433 1 3 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.482 -0.012 25800
1434 1 3 . 1 1 75 75 LYS C C 75 176.900 176.900 175.135 1.765 25800
1435 1 3 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.109 -0.809 25800
1436 1 3 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.562 -0.662 25800
1437 1 3 . 1 1 75 75 LYS H H 75 8.380 8.380 8.535 -0.155 25800
1438 1 3 . 1 1 76 76 LEU N N 76 127.400 127.400 122.253 5.147 25800
1439 1 3 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.463 -0.033 25800
1440 1 3 . 1 1 76 76 LEU C C 76 177.600 177.600 174.812 2.788 25800
1441 1 3 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.034 0.266 25800
1442 1 3 . 1 1 76 76 LEU CB C 76 43.100 43.100 43.673 -0.573 25800
1443 1 3 . 1 1 76 76 LEU H H 76 8.950 8.950 8.835 0.115 25800
1444 1 3 . 1 1 77 77 ARG N N 77 121.800 121.800 123.333 -1.533 25800
1445 1 3 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.464 0.436 25800
1446 1 3 . 1 1 77 77 ARG C C 77 174.700 174.700 174.640 0.060 25800
1447 1 3 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.272 -1.272 25800
1448 1 3 . 1 1 77 77 ARG CB C 77 32.300 32.300 29.917 2.383 25800
1449 1 3 . 1 1 77 77 ARG H H 77 7.530 7.530 7.862 -0.332 25800
1450 1 3 . 1 1 78 78 VAL N N 78 127.000 127.000 126.469 0.531 25800
1451 1 3 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.142 1.138 25800
1452 1 3 . 1 1 78 78 VAL C C 78 174.200 174.200 175.266 -1.066 25800
1453 1 3 . 1 1 78 78 VAL CA C 78 61.200 61.200 63.214 -2.014 25800
1454 1 3 . 1 1 78 78 VAL CB C 78 33.400 33.400 32.388 1.012 25800
1455 1 3 . 1 1 78 78 VAL H H 78 9.660 9.660 7.817 1.843 25800
1456 1 3 . 1 1 79 79 GLU N N 79 121.900 121.900 127.250 -5.350 25800
1457 1 3 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.597 0.113 25800
1458 1 3 . 1 1 79 79 GLU C C 79 174.600 174.600 174.361 0.239 25800
1459 1 3 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.289 -1.389 25800
1460 1 3 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.268 0.132 25800
1461 1 3 . 1 1 79 79 GLU H H 79 8.980 8.980 8.733 0.247 25800
1462 1 3 . 1 1 80 80 VAL N N 80 121.300 121.300 124.780 -3.480 25800
1463 1 3 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.434 -0.064 25800
1464 1 3 . 1 1 80 80 VAL CA C 80 61.000 61.000 59.449 1.552 25800
1465 1 3 . 1 1 80 80 VAL CB C 80 32.100 32.100 32.381 -0.281 25800
1466 1 3 . 1 1 80 80 VAL H H 80 8.410 8.410 8.570 -0.160 25800
1467 1 3 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.476 -0.216 25800
1468 1 3 . 1 1 81 81 PRO C C 81 176.100 176.100 176.775 -0.675 25800
1469 1 3 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.023 -0.923 25800
1470 1 3 . 1 1 81 81 PRO CB C 81 32.100 32.100 32.231 -0.131 25800
1471 1 3 . 1 1 82 82 PHE N N 82 122.200 122.200 116.512 5.688 25800
1472 1 3 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.754 -0.464 25800
1473 1 3 . 1 1 82 82 PHE C C 82 175.300 175.300 175.380 -0.080 25800
1474 1 3 . 1 1 82 82 PHE CA C 82 58.100 58.100 54.177 3.923 25800
1475 1 3 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.384 2.016 25800
1476 1 3 . 1 1 82 82 PHE H H 82 8.150 8.150 8.099 0.051 25800
1477 1 3 . 1 1 83 83 ASN N N 83 120.800 120.800 119.735 1.065 25800
1478 1 3 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.295 0.145 25800
1479 1 3 . 1 1 83 83 ASN C C 83 174.100 174.100 174.249 -0.149 25800
1480 1 3 . 1 1 83 83 ASN CA C 83 52.700 52.700 52.887 -0.187 25800
1481 1 3 . 1 1 83 83 ASN CB C 83 38.700 38.700 36.868 1.831 25800
1482 1 3 . 1 1 83 83 ASN H H 83 8.110 8.110 8.041 0.069 25800
1483 1 3 . 1 1 84 84 ALA N N 84 123.700 123.700 122.113 1.587 25800
1484 1 3 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.833 -0.753 25800
1485 1 3 . 1 1 84 84 ALA C C 84 177.100 177.100 176.114 0.986 25800
1486 1 3 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.165 0.235 25800
1487 1 3 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.396 -1.296 25800
1488 1 3 . 1 1 84 84 ALA H H 84 8.020 8.020 7.560 0.460 25800
1489 1 3 . 1 1 85 85 ARG N N 85 120.200 120.200 120.521 -0.321 25800
1490 1 3 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.446 -0.296 25800
1491 1 3 . 1 1 85 85 ARG C C 85 175.200 175.200 174.869 0.331 25800
1492 1 3 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.012 -0.012 25800
1493 1 3 . 1 1 85 85 ARG CB C 85 30.800 30.800 31.688 -0.888 25800
1494 1 3 . 1 1 85 85 ARG H H 85 8.040 8.040 8.564 -0.524 25800
1495 1 4 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.416 0.174 25800
1496 1 4 . 1 1 0 0 HIS C C 0 174.000 174.000 175.620 -1.620 25800
1497 1 4 . 1 1 0 0 HIS CA C 0 55.300 55.300 57.090 -1.790 25800
1498 1 4 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.038 -0.738 25800
1499 1 4 . 1 1 1 1 MET N N 1 122.400 122.400 120.118 2.282 25800
1500 1 4 . 1 1 1 1 MET HA H 1 4.340 4.340 4.055 0.285 25800
1501 1 4 . 1 1 1 1 MET C C 1 175.600 175.600 175.436 0.164 25800
1502 1 4 . 1 1 1 1 MET CA C 1 55.600 55.600 55.774 -0.174 25800
1503 1 4 . 1 1 1 1 MET CB C 1 32.800 32.800 30.352 2.448 25800
1504 1 4 . 1 1 1 1 MET H H 1 8.310 8.310 8.592 -0.282 25800
1505 1 4 . 1 1 2 2 VAL N N 2 123.200 123.200 117.507 5.693 25800
1506 1 4 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.132 -0.172 25800
1507 1 4 . 1 1 2 2 VAL C C 2 175.600 175.600 176.542 -0.942 25800
1508 1 4 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.309 -0.009 25800
1509 1 4 . 1 1 2 2 VAL CB C 2 32.300 32.300 30.134 2.166 25800
1510 1 4 . 1 1 2 2 VAL H H 2 8.180 8.180 8.178 0.002 25800
1511 1 4 . 1 1 3 3 ILE N N 3 126.200 126.200 123.473 2.727 25800
1512 1 4 . 1 1 3 3 ILE HA H 3 4.050 4.050 3.835 0.215 25800
1513 1 4 . 1 1 3 3 ILE C C 3 175.800 175.800 177.512 -1.712 25800
1514 1 4 . 1 1 3 3 ILE CA C 3 60.700 60.700 64.177 -3.477 25800
1515 1 4 . 1 1 3 3 ILE CB C 3 38.300 38.300 37.702 0.598 25800
1516 1 4 . 1 1 3 3 ILE H H 3 8.230 8.230 7.737 0.493 25800
1517 1 4 . 1 1 4 4 ARG N N 4 126.100 126.100 121.724 4.376 25800
1518 1 4 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.136 0.044 25800
1519 1 4 . 1 1 4 4 ARG C C 4 175.900 175.900 176.549 -0.649 25800
1520 1 4 . 1 1 4 4 ARG CA C 4 56.000 56.000 58.012 -2.012 25800
1521 1 4 . 1 1 4 4 ARG CB C 4 30.700 30.700 29.054 1.646 25800
1522 1 4 . 1 1 4 4 ARG H H 4 8.360 8.360 8.253 0.107 25800
1523 1 4 . 1 1 5 5 GLU N N 5 122.200 122.200 119.716 2.484 25800
1524 1 4 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.459 -0.319 25800
1525 1 4 . 1 1 5 5 GLU C C 5 176.100 176.100 175.732 0.368 25800
1526 1 4 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.448 1.152 25800
1527 1 4 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.741 0.559 25800
1528 1 4 . 1 1 5 5 GLU H H 5 8.400 8.400 7.807 0.593 25800
1529 1 4 . 1 1 6 6 SER N N 6 116.200 116.200 116.292 -0.092 25800
1530 1 4 . 1 1 6 6 SER HA H 6 4.350 4.350 4.348 0.002 25800
1531 1 4 . 1 1 6 6 SER C C 6 174.300 174.300 174.078 0.222 25800
1532 1 4 . 1 1 6 6 SER CA C 6 58.200 58.200 59.766 -1.566 25800
1533 1 4 . 1 1 6 6 SER CB C 6 63.800 63.800 63.840 -0.040 25800
1534 1 4 . 1 1 6 6 SER H H 6 8.270 8.270 7.715 0.555 25800
1535 1 4 . 1 1 7 7 VAL N N 7 119.800 119.800 121.538 -1.738 25800
1536 1 4 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.250 0.050 25800
1537 1 4 . 1 1 7 7 VAL C C 7 175.500 175.500 174.707 0.793 25800
1538 1 4 . 1 1 7 7 VAL CA C 7 61.700 61.700 62.175 -0.475 25800
1539 1 4 . 1 1 7 7 VAL CB C 7 32.800 32.800 33.897 -1.097 25800
1540 1 4 . 1 1 7 7 VAL H H 7 7.840 7.840 8.325 -0.485 25800
1541 1 4 . 1 1 8 8 SER N N 8 117.800 117.800 124.598 -6.798 25800
1542 1 4 . 1 1 8 8 SER HA H 8 4.240 4.240 4.852 -0.612 25800
1543 1 4 . 1 1 8 8 SER C C 8 172.500 172.500 173.403 -0.903 25800
1544 1 4 . 1 1 8 8 SER CA C 8 58.500 58.500 57.925 0.575 25800
1545 1 4 . 1 1 8 8 SER CB C 8 63.600 63.600 63.135 0.466 25800
1546 1 4 . 1 1 8 8 SER H H 8 8.530 8.530 8.764 -0.234 25800
1547 1 4 . 1 1 9 9 ARG N N 9 123.000 123.000 123.714 -0.714 25800
1548 1 4 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.084 0.416 25800
1549 1 4 . 1 1 9 9 ARG C C 9 175.000 175.000 175.121 -0.121 25800
1550 1 4 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.152 0.148 25800
1551 1 4 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.607 0.793 25800
1552 1 4 . 1 1 9 9 ARG H H 9 7.350 7.350 8.017 -0.667 25800
1553 1 4 . 1 1 10 10 ILE N N 10 114.000 114.000 120.777 -6.777 25800
1554 1 4 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.188 0.632 25800
1555 1 4 . 1 1 10 10 ILE C C 10 173.000 173.000 175.041 -2.041 25800
1556 1 4 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.472 -2.072 25800
1557 1 4 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.782 2.118 25800
1558 1 4 . 1 1 10 10 ILE H H 10 8.830 8.830 8.547 0.283 25800
1559 1 4 . 1 1 11 11 TYR N N 11 123.400 123.400 127.735 -4.335 25800
1560 1 4 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.998 -0.068 25800
1561 1 4 . 1 1 11 11 TYR C C 11 173.000 173.000 173.462 -0.462 25800
1562 1 4 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.514 0.486 25800
1563 1 4 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.676 -0.776 25800
1564 1 4 . 1 1 11 11 TYR H H 11 8.690 8.690 8.207 0.483 25800
1565 1 4 . 1 1 12 12 VAL N N 12 126.300 126.300 120.822 5.478 25800
1566 1 4 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.443 0.117 25800
1567 1 4 . 1 1 12 12 VAL C C 12 174.100 174.100 173.598 0.502 25800
1568 1 4 . 1 1 12 12 VAL CA C 12 60.200 60.200 58.758 1.442 25800
1569 1 4 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.410 -2.010 25800
1570 1 4 . 1 1 12 12 VAL H H 12 8.370 8.370 8.106 0.264 25800
1571 1 4 . 1 1 13 13 GLY N N 13 113.000 113.000 109.436 3.564 25800
1572 1 4 . 1 1 13 13 GLY C C 13 173.100 173.100 172.846 0.254 25800
1573 1 4 . 1 1 13 13 GLY CA C 13 43.300 43.300 44.592 -1.292 25800
1574 1 4 . 1 1 13 13 GLY H H 13 9.350 9.350 8.378 0.972 25800
1575 1 4 . 1 1 14 14 ASN N N 14 113.900 113.900 118.570 -4.670 25800
1576 1 4 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.283 -0.003 25800
1577 1 4 . 1 1 14 14 ASN C C 14 175.800 175.800 174.908 0.892 25800
1578 1 4 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.264 -0.664 25800
1579 1 4 . 1 1 14 14 ASN CB C 14 37.700 37.700 38.025 -0.325 25800
1580 1 4 . 1 1 14 14 ASN H H 14 8.800 8.800 8.780 0.020 25800
1581 1 4 . 1 1 15 15 LEU N N 15 115.800 115.800 118.948 -3.148 25800
1582 1 4 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.517 0.473 25800
1583 1 4 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.629 1.972 25800
1584 1 4 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.719 -0.119 25800
1585 1 4 . 1 1 15 15 LEU H H 15 7.150 7.150 7.932 -0.782 25800
1586 1 4 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.580 -0.510 25800
1587 1 4 . 1 1 16 16 PRO C C 16 171.500 171.500 178.394 -6.894 25800
1588 1 4 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.974 -0.474 25800
1589 1 4 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.486 -0.486 25800
1590 1 4 . 1 1 17 17 SER N N 17 115.200 115.200 116.837 -1.637 25800
1591 1 4 . 1 1 17 17 SER HA H 17 4.300 4.300 4.048 0.252 25800
1592 1 4 . 1 1 17 17 SER C C 17 174.200 174.200 174.308 -0.108 25800
1593 1 4 . 1 1 17 17 SER CA C 17 58.200 58.200 59.178 -0.978 25800
1594 1 4 . 1 1 17 17 SER CB C 17 63.900 63.900 63.222 0.678 25800
1595 1 4 . 1 1 17 17 SER H H 17 8.470 8.470 8.685 -0.215 25800
1596 1 4 . 1 1 18 18 HIS N N 18 120.800 120.800 118.757 2.043 25800
1597 1 4 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.234 0.316 25800
1598 1 4 . 1 1 18 18 HIS C C 18 175.100 175.100 173.023 2.077 25800
1599 1 4 . 1 1 18 18 HIS CA C 18 55.500 55.500 57.742 -2.242 25800
1600 1 4 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.845 -0.545 25800
1601 1 4 . 1 1 18 18 HIS H H 18 8.540 8.540 7.867 0.673 25800
1602 1 4 . 1 1 19 19 VAL N N 19 115.700 115.700 117.309 -1.609 25800
1603 1 4 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.419 -0.159 25800
1604 1 4 . 1 1 19 19 VAL C C 19 174.000 174.000 174.577 -0.577 25800
1605 1 4 . 1 1 19 19 VAL CA C 19 61.900 61.900 60.843 1.057 25800
1606 1 4 . 1 1 19 19 VAL CB C 19 32.600 32.600 34.341 -1.741 25800
1607 1 4 . 1 1 19 19 VAL H H 19 6.650 6.650 7.328 -0.678 25800
1608 1 4 . 1 1 20 20 SER N N 20 118.800 118.800 120.506 -1.706 25800
1609 1 4 . 1 1 20 20 SER HA H 20 4.710 4.710 4.635 0.075 25800
1610 1 4 . 1 1 20 20 SER C C 20 175.900 175.900 175.815 0.085 25800
1611 1 4 . 1 1 20 20 SER CA C 20 55.800 55.800 57.364 -1.564 25800
1612 1 4 . 1 1 20 20 SER CB C 20 66.600 66.600 64.844 1.756 25800
1613 1 4 . 1 1 20 20 SER H H 20 8.930 8.930 8.263 0.667 25800
1614 1 4 . 1 1 21 21 SER N N 21 117.100 117.100 118.167 -1.067 25800
1615 1 4 . 1 1 21 21 SER HA H 21 3.880 3.880 4.086 -0.206 25800
1616 1 4 . 1 1 21 21 SER C C 21 176.200 176.200 176.681 -0.481 25800
1617 1 4 . 1 1 21 21 SER CA C 21 62.300 62.300 61.399 0.901 25800
1618 1 4 . 1 1 21 21 SER CB C 21 66.800 66.800 62.696 4.104 25800
1619 1 4 . 1 1 21 21 SER H H 21 9.080 9.080 8.879 0.201 25800
1620 1 4 . 1 1 22 22 ARG N N 22 121.200 121.200 121.522 -0.322 25800
1621 1 4 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.101 -0.111 25800
1622 1 4 . 1 1 22 22 ARG C C 22 177.900 177.900 178.467 -0.567 25800
1623 1 4 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.939 -0.239 25800
1624 1 4 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.835 -0.235 25800
1625 1 4 . 1 1 22 22 ARG H H 22 7.940 7.940 8.402 -0.462 25800
1626 1 4 . 1 1 23 23 ASP N N 23 118.800 118.800 118.958 -0.158 25800
1627 1 4 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.572 -0.182 25800
1628 1 4 . 1 1 23 23 ASP C C 23 179.200 179.200 178.572 0.628 25800
1629 1 4 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.487 -0.187 25800
1630 1 4 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.897 0.103 25800
1631 1 4 . 1 1 23 23 ASP H H 23 7.480 7.480 7.534 -0.054 25800
1632 1 4 . 1 1 24 24 VAL N N 24 119.500 119.500 120.387 -0.887 25800
1633 1 4 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.743 -0.373 25800
1634 1 4 . 1 1 24 24 VAL C C 24 177.500 177.500 177.517 -0.017 25800
1635 1 4 . 1 1 24 24 VAL CA C 24 66.900 66.900 67.263 -0.363 25800
1636 1 4 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.764 -0.364 25800
1637 1 4 . 1 1 24 24 VAL H H 24 7.450 7.450 8.311 -0.861 25800
1638 1 4 . 1 1 25 25 GLU N N 25 121.400 121.400 120.022 1.378 25800
1639 1 4 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.948 -0.378 25800
1640 1 4 . 1 1 25 25 GLU C C 25 178.400 178.400 178.365 0.035 25800
1641 1 4 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.074 0.526 25800
1642 1 4 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.522 0.078 25800
1643 1 4 . 1 1 25 25 GLU H H 25 8.580 8.580 7.838 0.742 25800
1644 1 4 . 1 1 26 26 ASN N N 26 114.800 114.800 117.350 -2.550 25800
1645 1 4 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.495 -0.175 25800
1646 1 4 . 1 1 26 26 ASN C C 26 177.400 177.400 177.502 -0.102 25800
1647 1 4 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.974 -0.074 25800
1648 1 4 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.662 -0.762 25800
1649 1 4 . 1 1 26 26 ASN H H 26 8.180 8.180 7.613 0.567 25800
1650 1 4 . 1 1 27 27 GLU N N 27 118.900 118.900 119.573 -0.673 25800
1651 1 4 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.205 -0.065 25800
1652 1 4 . 1 1 27 27 GLU C C 27 176.400 176.400 178.935 -2.535 25800
1653 1 4 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.859 -1.459 25800
1654 1 4 . 1 1 27 27 GLU CB C 27 29.400 29.400 30.117 -0.717 25800
1655 1 4 . 1 1 27 27 GLU H H 27 7.340 7.340 8.326 -0.986 25800
1656 1 4 . 1 1 28 28 PHE N N 28 114.100 114.100 118.737 -4.637 25800
1657 1 4 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.539 0.011 25800
1658 1 4 . 1 1 28 28 PHE C C 28 176.300 176.300 178.437 -2.137 25800
1659 1 4 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.011 -1.011 25800
1660 1 4 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.050 1.750 25800
1661 1 4 . 1 1 28 28 PHE H H 28 7.660 7.660 8.332 -0.671 25800
1662 1 4 . 1 1 29 29 ARG N N 29 121.700 121.700 119.417 2.283 25800
1663 1 4 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.366 0.044 25800
1664 1 4 . 1 1 29 29 ARG C C 29 177.100 177.100 177.167 -0.067 25800
1665 1 4 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.566 -0.366 25800
1666 1 4 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.295 -0.995 25800
1667 1 4 . 1 1 29 29 ARG H H 29 8.120 8.120 8.147 -0.027 25800
1668 1 4 . 1 1 30 30 LYS N N 30 117.200 117.200 117.378 -0.178 25800
1669 1 4 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.152 -0.322 25800
1670 1 4 . 1 1 30 30 LYS C C 30 177.100 177.100 177.833 -0.733 25800
1671 1 4 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.713 0.087 25800
1672 1 4 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.032 -0.932 25800
1673 1 4 . 1 1 30 30 LYS H H 30 7.630 7.630 7.682 -0.052 25800
1674 1 4 . 1 1 31 31 TYR N N 31 117.100 117.100 117.238 -0.138 25800
1675 1 4 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.557 -0.407 25800
1676 1 4 . 1 1 31 31 TYR C C 31 174.400 174.400 175.258 -0.858 25800
1677 1 4 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.528 0.372 25800
1678 1 4 . 1 1 31 31 TYR CB C 31 37.900 37.900 40.582 -2.682 25800
1679 1 4 . 1 1 31 31 TYR H H 31 7.410 7.410 7.955 -0.545 25800
1680 1 4 . 1 1 32 32 GLY N N 32 104.100 104.100 103.508 0.592 25800
1681 1 4 . 1 1 32 32 GLY C C 32 177.000 177.000 171.767 5.233 25800
1682 1 4 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.061 0.439 25800
1683 1 4 . 1 1 32 32 GLY H H 32 7.240 7.240 7.270 -0.030 25800
1684 1 4 . 1 1 33 33 ASN N N 33 115.300 115.300 119.534 -4.234 25800
1685 1 4 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.684 -0.244 25800
1686 1 4 . 1 1 33 33 ASN C C 33 175.500 175.500 175.272 0.228 25800
1687 1 4 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.984 1.316 25800
1688 1 4 . 1 1 33 33 ASN CB C 33 38.400 38.400 37.997 0.403 25800
1689 1 4 . 1 1 33 33 ASN H H 33 8.460 8.460 8.445 0.015 25800
1690 1 4 . 1 1 34 34 ILE N N 34 126.700 126.700 126.516 0.184 25800
1691 1 4 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.472 -0.682 25800
1692 1 4 . 1 1 34 34 ILE C C 34 175.600 175.600 176.185 -0.585 25800
1693 1 4 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.793 -0.493 25800
1694 1 4 . 1 1 34 34 ILE CB C 34 40.000 40.000 37.633 2.367 25800
1695 1 4 . 1 1 34 34 ILE H H 34 8.050 8.050 8.413 -0.363 25800
1696 1 4 . 1 1 35 35 LEU N N 35 127.400 127.400 128.999 -1.599 25800
1697 1 4 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.392 -0.232 25800
1698 1 4 . 1 1 35 35 LEU C C 35 177.200 177.200 176.640 0.560 25800
1699 1 4 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.854 -0.354 25800
1700 1 4 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.836 -0.136 25800
1701 1 4 . 1 1 35 35 LEU H H 35 8.780 8.780 9.195 -0.415 25800
1702 1 4 . 1 1 36 36 LYS N N 36 117.000 117.000 116.958 0.042 25800
1703 1 4 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.617 -0.377 25800
1704 1 4 . 1 1 36 36 LYS C C 36 173.600 173.600 174.201 -0.601 25800
1705 1 4 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.544 0.356 25800
1706 1 4 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.389 0.211 25800
1707 1 4 . 1 1 36 36 LYS H H 36 7.110 7.110 7.537 -0.427 25800
1708 1 4 . 1 1 37 37 CYS N N 37 125.400 125.400 118.027 7.373 25800
1709 1 4 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.570 -0.870 25800
1710 1 4 . 1 1 37 37 CYS C C 37 171.600 171.600 173.099 -1.499 25800
1711 1 4 . 1 1 37 37 CYS CA C 37 57.900 57.900 55.783 2.117 25800
1712 1 4 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.771 -4.671 25800
1713 1 4 . 1 1 37 37 CYS H H 37 8.610 8.610 8.477 0.133 25800
1714 1 4 . 1 1 38 38 ASP N N 38 128.200 128.200 119.582 8.618 25800
1715 1 4 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.910 0.040 25800
1716 1 4 . 1 1 38 38 ASP C C 38 174.300 174.300 173.683 0.617 25800
1717 1 4 . 1 1 38 38 ASP CA C 38 53.200 53.200 54.363 -1.163 25800
1718 1 4 . 1 1 38 38 ASP CB C 38 44.300 44.300 44.943 -0.643 25800
1719 1 4 . 1 1 38 38 ASP H H 38 8.290 8.290 8.782 -0.492 25800
1720 1 4 . 1 1 39 39 VAL N N 39 123.500 123.500 119.707 3.793 25800
1721 1 4 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.147 -0.847 25800
1722 1 4 . 1 1 39 39 VAL C C 39 175.000 175.000 174.186 0.814 25800
1723 1 4 . 1 1 39 39 VAL CA C 39 61.700 61.700 60.910 0.791 25800
1724 1 4 . 1 1 39 39 VAL CB C 39 33.100 33.100 35.178 -2.078 25800
1725 1 4 . 1 1 39 39 VAL H H 39 8.380 8.380 8.402 -0.022 25800
1726 1 4 . 1 1 40 40 LYS N N 40 129.100 129.100 127.294 1.806 25800
1727 1 4 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.920 -0.600 25800
1728 1 4 . 1 1 40 40 LYS C C 40 173.700 173.700 174.321 -0.621 25800
1729 1 4 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.149 -0.249 25800
1730 1 4 . 1 1 40 40 LYS CB C 40 35.500 35.500 36.551 -1.051 25800
1731 1 4 . 1 1 40 40 LYS H H 40 8.680 8.680 9.369 -0.689 25800
1732 1 4 . 1 1 41 41 LYS N N 41 117.300 117.300 118.905 -1.605 25800
1733 1 4 . 1 1 41 41 LYS HA H 41 4.980 4.980 4.585 0.395 25800
1734 1 4 . 1 1 41 41 LYS C C 41 177.800 177.800 175.230 2.570 25800
1735 1 4 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.583 0.017 25800
1736 1 4 . 1 1 41 41 LYS CB C 41 35.000 35.000 34.626 0.374 25800
1737 1 4 . 1 1 41 41 LYS H H 41 7.900 7.900 8.388 -0.488 25800
1738 1 4 . 1 1 42 42 THR N N 42 113.200 113.200 114.869 -1.669 25800
1739 1 4 . 1 1 42 42 THR HA H 42 4.680 4.680 4.590 0.090 25800
1740 1 4 . 1 1 42 42 THR C C 42 176.900 176.900 176.648 0.252 25800
1741 1 4 . 1 1 42 42 THR CA C 42 60.200 60.200 61.208 -1.008 25800
1742 1 4 . 1 1 42 42 THR CB C 42 71.600 71.600 70.735 0.865 25800
1743 1 4 . 1 1 42 42 THR H H 42 8.730 8.730 8.052 0.678 25800
1744 1 4 . 1 1 43 43 VAL N N 43 120.000 120.000 121.676 -1.676 25800
1745 1 4 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.947 -0.027 25800
1746 1 4 . 1 1 43 43 VAL C C 43 177.000 177.000 176.661 0.339 25800
1747 1 4 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.361 0.339 25800
1748 1 4 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.619 0.181 25800
1749 1 4 . 1 1 43 43 VAL H H 43 8.730 8.730 8.400 0.330 25800
1750 1 4 . 1 1 44 44 SER N N 44 113.400 113.400 115.441 -2.041 25800
1751 1 4 . 1 1 44 44 SER HA H 44 4.360 4.360 4.383 -0.023 25800
1752 1 4 . 1 1 44 44 SER C C 44 174.800 174.800 175.280 -0.480 25800
1753 1 4 . 1 1 44 44 SER CA C 44 58.400 58.400 58.373 0.027 25800
1754 1 4 . 1 1 44 44 SER CB C 44 63.500 63.500 63.204 0.296 25800
1755 1 4 . 1 1 44 44 SER H H 44 7.760 7.760 7.980 -0.220 25800
1756 1 4 . 1 1 45 45 GLY N N 45 110.200 110.200 108.662 1.538 25800
1757 1 4 . 1 1 45 45 GLY C C 45 173.500 173.500 173.685 -0.185 25800
1758 1 4 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.335 -0.035 25800
1759 1 4 . 1 1 45 45 GLY H H 45 7.820 7.820 7.649 0.171 25800
1760 1 4 . 1 1 46 46 ALA N N 46 123.900 123.900 123.683 0.217 25800
1761 1 4 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.233 0.157 25800
1762 1 4 . 1 1 46 46 ALA C C 46 176.100 176.100 176.021 0.079 25800
1763 1 4 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.771 0.129 25800
1764 1 4 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.656 0.144 25800
1765 1 4 . 1 1 46 46 ALA H H 46 7.440 7.440 7.780 -0.340 25800
1766 1 4 . 1 1 47 47 ALA N N 47 123.100 123.100 126.867 -3.767 25800
1767 1 4 . 1 1 47 47 ALA HA H 47 5.200 5.200 4.548 0.652 25800
1768 1 4 . 1 1 47 47 ALA C C 47 176.100 176.100 176.014 0.086 25800
1769 1 4 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.906 -0.006 25800
1770 1 4 . 1 1 47 47 ALA CB C 47 21.900 21.900 20.521 1.379 25800
1771 1 4 . 1 1 47 47 ALA H H 47 8.350 8.350 8.431 -0.081 25800
1772 1 4 . 1 1 48 48 PHE N N 48 118.700 118.700 117.555 1.145 25800
1773 1 4 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.450 -0.420 25800
1774 1 4 . 1 1 48 48 PHE C C 48 171.600 171.600 174.185 -2.585 25800
1775 1 4 . 1 1 48 48 PHE CA C 48 55.700 55.700 55.349 0.351 25800
1776 1 4 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.192 -1.992 25800
1777 1 4 . 1 1 48 48 PHE H H 48 8.550 8.550 8.716 -0.166 25800
1778 1 4 . 1 1 49 49 ALA N N 49 120.400 120.400 122.334 -1.934 25800
1779 1 4 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.326 0.004 25800
1780 1 4 . 1 1 49 49 ALA C C 49 175.500 175.500 174.648 0.852 25800
1781 1 4 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.392 -1.092 25800
1782 1 4 . 1 1 49 49 ALA CB C 49 23.700 23.700 22.652 1.048 25800
1783 1 4 . 1 1 49 49 ALA H H 49 9.240 9.240 8.868 0.372 25800
1784 1 4 . 1 1 50 50 PHE N N 50 115.000 115.000 118.113 -3.113 25800
1785 1 4 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.381 0.219 25800
1786 1 4 . 1 1 50 50 PHE C C 50 176.000 176.000 174.192 1.808 25800
1787 1 4 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.370 0.130 25800
1788 1 4 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.536 -1.336 25800
1789 1 4 . 1 1 50 50 PHE H H 50 7.920 7.920 8.870 -0.950 25800
1790 1 4 . 1 1 51 51 ILE N N 51 123.000 123.000 120.485 2.515 25800
1791 1 4 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.461 -0.011 25800
1792 1 4 . 1 1 51 51 ILE C C 51 173.700 173.700 174.156 -0.456 25800
1793 1 4 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.250 -0.050 25800
1794 1 4 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.404 -0.704 25800
1795 1 4 . 1 1 51 51 ILE H H 51 8.490 8.490 8.214 0.276 25800
1796 1 4 . 1 1 52 52 GLU N N 52 126.600 126.600 126.153 0.447 25800
1797 1 4 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.818 -0.048 25800
1798 1 4 . 1 1 52 52 GLU C C 52 175.300 175.300 174.969 0.331 25800
1799 1 4 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.390 0.310 25800
1800 1 4 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.758 -0.258 25800
1801 1 4 . 1 1 52 52 GLU H H 52 8.610 8.610 8.770 -0.160 25800
1802 1 4 . 1 1 53 53 PHE N N 53 126.100 126.100 124.546 1.554 25800
1803 1 4 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.399 -0.599 25800
1804 1 4 . 1 1 53 53 PHE C C 53 175.400 175.400 177.036 -1.636 25800
1805 1 4 . 1 1 53 53 PHE CA C 53 58.200 58.200 55.230 2.970 25800
1806 1 4 . 1 1 53 53 PHE CB C 53 40.900 40.900 41.726 -0.826 25800
1807 1 4 . 1 1 53 53 PHE H H 53 8.800 8.800 7.764 1.036 25800
1808 1 4 . 1 1 54 54 GLU N N 54 120.700 120.700 122.692 -1.992 25800
1809 1 4 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.076 -0.146 25800
1810 1 4 . 1 1 54 54 GLU C C 54 175.300 175.300 177.524 -2.224 25800
1811 1 4 . 1 1 54 54 GLU CA C 54 59.100 59.100 59.424 -0.324 25800
1812 1 4 . 1 1 54 54 GLU CB C 54 30.800 30.800 29.717 1.083 25800
1813 1 4 . 1 1 54 54 GLU H H 54 8.160 8.160 8.766 -0.606 25800
1814 1 4 . 1 1 55 55 ASP N N 55 117.900 117.900 121.417 -3.517 25800
1815 1 4 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.661 0.259 25800
1816 1 4 . 1 1 55 55 ASP C C 55 176.400 176.400 176.069 0.331 25800
1817 1 4 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.933 -1.533 25800
1818 1 4 . 1 1 55 55 ASP CB C 55 44.400 44.400 39.336 5.064 25800
1819 1 4 . 1 1 55 55 ASP H H 55 8.740 8.740 8.279 0.461 25800
1820 1 4 . 1 1 56 56 ALA N N 56 128.900 128.900 123.960 4.940 25800
1821 1 4 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.684 0.146 25800
1822 1 4 . 1 1 56 56 ALA C C 56 179.800 179.800 178.852 0.948 25800
1823 1 4 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.281 -0.081 25800
1824 1 4 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.233 0.667 25800
1825 1 4 . 1 1 56 56 ALA H H 56 8.800 8.800 8.078 0.722 25800
1826 1 4 . 1 1 57 57 ARG N N 57 119.200 119.200 116.085 3.115 25800
1827 1 4 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.164 -0.274 25800
1828 1 4 . 1 1 57 57 ARG C C 57 178.000 178.000 177.230 0.770 25800
1829 1 4 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.314 0.586 25800
1830 1 4 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.990 0.310 25800
1831 1 4 . 1 1 57 57 ARG H H 57 8.950 8.950 8.462 0.488 25800
1832 1 4 . 1 1 58 58 ASP N N 58 120.900 120.900 120.252 0.648 25800
1833 1 4 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.586 -0.496 25800
1834 1 4 . 1 1 58 58 ASP C C 58 176.700 176.700 178.181 -1.481 25800
1835 1 4 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.478 0.022 25800
1836 1 4 . 1 1 58 58 ASP CB C 58 39.900 39.900 41.383 -1.483 25800
1837 1 4 . 1 1 58 58 ASP H H 58 7.020 7.020 7.711 -0.691 25800
1838 1 4 . 1 1 59 59 ALA N N 59 119.700 119.700 122.151 -2.451 25800
1839 1 4 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.425 -1.345 25800
1840 1 4 . 1 1 59 59 ALA C C 59 178.100 178.100 179.295 -1.195 25800
1841 1 4 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.481 -0.181 25800
1842 1 4 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.643 -0.243 25800
1843 1 4 . 1 1 59 59 ALA H H 59 6.440 6.440 8.214 -1.774 25800
1844 1 4 . 1 1 60 60 ALA N N 60 117.600 117.600 121.544 -3.944 25800
1845 1 4 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.165 -0.335 25800
1846 1 4 . 1 1 60 60 ALA C C 60 180.900 180.900 179.154 1.746 25800
1847 1 4 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.538 -0.638 25800
1848 1 4 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.384 -0.684 25800
1849 1 4 . 1 1 60 60 ALA H H 60 7.330 7.330 8.124 -0.794 25800
1850 1 4 . 1 1 61 61 ASP N N 61 120.100 120.100 118.554 1.546 25800
1851 1 4 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.401 -0.191 25800
1852 1 4 . 1 1 61 61 ASP C C 61 176.700 176.700 177.851 -1.151 25800
1853 1 4 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.154 -0.054 25800
1854 1 4 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.689 -0.589 25800
1855 1 4 . 1 1 61 61 ASP H H 61 7.590 7.590 7.870 -0.280 25800
1856 1 4 . 1 1 62 62 ALA N N 62 122.200 122.200 120.734 1.466 25800
1857 1 4 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.045 -1.625 25800
1858 1 4 . 1 1 62 62 ALA C C 62 179.300 179.300 178.722 0.578 25800
1859 1 4 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.156 0.445 25800
1860 1 4 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.547 0.553 25800
1861 1 4 . 1 1 62 62 ALA H H 62 7.440 7.440 7.731 -0.291 25800
1862 1 4 . 1 1 63 63 ILE N N 63 116.700 116.700 118.572 -1.872 25800
1863 1 4 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.345 -1.105 25800
1864 1 4 . 1 1 63 63 ILE C C 63 177.800 177.800 178.184 -0.384 25800
1865 1 4 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.006 2.594 25800
1866 1 4 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.370 0.530 25800
1867 1 4 . 1 1 63 63 ILE H H 63 7.540 7.540 8.116 -0.576 25800
1868 1 4 . 1 1 64 64 LYS N N 64 117.400 117.400 120.214 -2.814 25800
1869 1 4 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.097 -0.197 25800
1870 1 4 . 1 1 64 64 LYS C C 64 178.900 178.900 178.821 0.079 25800
1871 1 4 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.687 0.113 25800
1872 1 4 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.178 1.422 25800
1873 1 4 . 1 1 64 64 LYS H H 64 7.490 7.490 8.561 -1.071 25800
1874 1 4 . 1 1 65 65 GLU N N 65 113.800 113.800 118.310 -4.510 25800
1875 1 4 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.094 0.066 25800
1876 1 4 . 1 1 65 65 GLU C C 65 178.300 178.300 177.495 0.805 25800
1877 1 4 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.629 -0.329 25800
1878 1 4 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.976 1.724 25800
1879 1 4 . 1 1 65 65 GLU H H 65 7.960 7.960 7.809 0.151 25800
1880 1 4 . 1 1 66 66 LYS N N 66 114.700 114.700 117.158 -2.458 25800
1881 1 4 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.423 0.047 25800
1882 1 4 . 1 1 66 66 LYS C C 66 177.500 177.500 176.687 0.813 25800
1883 1 4 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.705 -1.304 25800
1884 1 4 . 1 1 66 66 LYS CB C 66 33.000 33.000 31.823 1.177 25800
1885 1 4 . 1 1 66 66 LYS H H 66 8.050 8.050 7.912 0.138 25800
1886 1 4 . 1 1 67 67 ASP N N 67 118.800 118.800 120.313 -1.513 25800
1887 1 4 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.485 -0.265 25800
1888 1 4 . 1 1 67 67 ASP C C 67 177.700 177.700 177.714 -0.014 25800
1889 1 4 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.429 3.971 25800
1890 1 4 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.274 0.126 25800
1891 1 4 . 1 1 67 67 ASP H H 67 7.620 7.620 7.557 0.063 25800
1892 1 4 . 1 1 68 68 GLY N N 68 115.600 115.600 107.976 7.624 25800
1893 1 4 . 1 1 68 68 GLY C C 68 173.800 173.800 175.031 -1.231 25800
1894 1 4 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.874 1.026 25800
1895 1 4 . 1 1 68 68 GLY H H 68 8.470 8.470 8.685 -0.215 25800
1896 1 4 . 1 1 69 69 CYS N N 69 119.200 119.200 119.313 -0.113 25800
1897 1 4 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.571 -0.411 25800
1898 1 4 . 1 1 69 69 CYS C C 69 172.600 172.600 174.605 -2.005 25800
1899 1 4 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.966 0.034 25800
1900 1 4 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.542 0.158 25800
1901 1 4 . 1 1 69 69 CYS H H 69 7.890 7.890 8.122 -0.232 25800
1902 1 4 . 1 1 70 70 ASP N N 70 122.200 122.200 123.366 -1.166 25800
1903 1 4 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.142 -0.312 25800
1904 1 4 . 1 1 70 70 ASP C C 70 176.400 176.400 174.461 1.939 25800
1905 1 4 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.669 1.031 25800
1906 1 4 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.333 -1.633 25800
1907 1 4 . 1 1 70 70 ASP H H 70 8.360 8.360 8.909 -0.549 25800
1908 1 4 . 1 1 71 71 PHE N N 71 127.600 127.600 120.174 7.426 25800
1909 1 4 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.117 -0.517 25800
1910 1 4 . 1 1 71 71 PHE C C 71 173.600 173.600 174.483 -0.883 25800
1911 1 4 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.945 -0.145 25800
1912 1 4 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.528 -0.827 25800
1913 1 4 . 1 1 71 71 PHE H H 71 9.390 9.390 8.135 1.255 25800
1914 1 4 . 1 1 72 72 GLU N N 72 123.900 123.900 120.084 3.816 25800
1915 1 4 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.078 -0.538 25800
1916 1 4 . 1 1 72 72 GLU C C 72 175.500 175.500 176.979 -1.479 25800
1917 1 4 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.751 -0.050 25800
1918 1 4 . 1 1 72 72 GLU CB C 72 27.300 27.300 29.620 -2.321 25800
1919 1 4 . 1 1 72 72 GLU H H 72 8.940 8.940 9.163 -0.223 25800
1920 1 4 . 1 1 73 73 GLY N N 73 105.200 105.200 114.776 -9.576 25800
1921 1 4 . 1 1 73 73 GLY C C 73 174.100 174.100 174.607 -0.507 25800
1922 1 4 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.345 0.255 25800
1923 1 4 . 1 1 73 73 GLY H H 73 8.350 8.350 8.820 -0.470 25800
1924 1 4 . 1 1 74 74 ASN N N 74 121.000 121.000 122.568 -1.568 25800
1925 1 4 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.699 0.061 25800
1926 1 4 . 1 1 74 74 ASN C C 74 174.000 174.000 174.297 -0.297 25800
1927 1 4 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.429 -2.529 25800
1928 1 4 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.055 0.645 25800
1929 1 4 . 1 1 74 74 ASN H H 74 7.740 7.740 8.287 -0.547 25800
1930 1 4 . 1 1 75 75 LYS N N 75 121.400 121.400 116.573 4.827 25800
1931 1 4 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.941 -0.471 25800
1932 1 4 . 1 1 75 75 LYS C C 75 176.900 176.900 174.522 2.378 25800
1933 1 4 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.633 -0.333 25800
1934 1 4 . 1 1 75 75 LYS CB C 75 31.900 31.900 34.330 -2.430 25800
1935 1 4 . 1 1 75 75 LYS H H 75 8.380 8.380 8.162 0.218 25800
1936 1 4 . 1 1 76 76 LEU N N 76 127.400 127.400 124.052 3.348 25800
1937 1 4 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.747 -0.317 25800
1938 1 4 . 1 1 76 76 LEU C C 76 177.600 177.600 174.525 3.075 25800
1939 1 4 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.617 -0.317 25800
1940 1 4 . 1 1 76 76 LEU CB C 76 43.100 43.100 46.769 -3.668 25800
1941 1 4 . 1 1 76 76 LEU H H 76 8.950 8.950 9.116 -0.166 25800
1942 1 4 . 1 1 77 77 ARG N N 77 121.800 121.800 122.577 -0.777 25800
1943 1 4 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.804 0.096 25800
1944 1 4 . 1 1 77 77 ARG C C 77 174.700 174.700 173.491 1.209 25800
1945 1 4 . 1 1 77 77 ARG CA C 77 54.000 54.000 54.907 -0.907 25800
1946 1 4 . 1 1 77 77 ARG CB C 77 32.300 32.300 34.354 -2.054 25800
1947 1 4 . 1 1 77 77 ARG H H 77 7.530 7.530 8.894 -1.364 25800
1948 1 4 . 1 1 78 78 VAL N N 78 127.000 127.000 123.341 3.659 25800
1949 1 4 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.552 0.728 25800
1950 1 4 . 1 1 78 78 VAL C C 78 174.200 174.200 174.168 0.032 25800
1951 1 4 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.090 0.111 25800
1952 1 4 . 1 1 78 78 VAL CB C 78 33.400 33.400 35.583 -2.183 25800
1953 1 4 . 1 1 78 78 VAL H H 78 9.660 9.660 8.501 1.159 25800
1954 1 4 . 1 1 79 79 GLU N N 79 121.900 121.900 123.910 -2.010 25800
1955 1 4 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.741 -0.031 25800
1956 1 4 . 1 1 79 79 GLU C C 79 174.600 174.600 174.025 0.575 25800
1957 1 4 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.333 -1.433 25800
1958 1 4 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.613 -0.213 25800
1959 1 4 . 1 1 79 79 GLU H H 79 8.980 8.980 8.532 0.448 25800
1960 1 4 . 1 1 80 80 VAL N N 80 121.300 121.300 122.635 -1.335 25800
1961 1 4 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.375 -0.005 25800
1962 1 4 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.243 2.757 25800
1963 1 4 . 1 1 80 80 VAL CB C 80 32.100 32.100 34.261 -2.162 25800
1964 1 4 . 1 1 80 80 VAL H H 80 8.410 8.410 8.410 0.000 25800
1965 1 4 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.532 -0.272 25800
1966 1 4 . 1 1 81 81 PRO C C 81 176.100 176.100 175.805 0.295 25800
1967 1 4 . 1 1 81 81 PRO CA C 81 63.100 63.100 62.908 0.192 25800
1968 1 4 . 1 1 81 81 PRO CB C 81 32.100 32.100 29.969 2.131 25800
1969 1 4 . 1 1 82 82 PHE N N 82 122.200 122.200 113.609 8.591 25800
1970 1 4 . 1 1 82 82 PHE HA H 82 4.290 4.290 5.103 -0.813 25800
1971 1 4 . 1 1 82 82 PHE C C 82 175.300 175.300 175.191 0.109 25800
1972 1 4 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.607 2.493 25800
1973 1 4 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.367 1.033 25800
1974 1 4 . 1 1 82 82 PHE H H 82 8.150 8.150 7.272 0.878 25800
1975 1 4 . 1 1 83 83 ASN N N 83 120.800 120.800 120.833 -0.033 25800
1976 1 4 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.435 0.005 25800
1977 1 4 . 1 1 83 83 ASN C C 83 174.100 174.100 175.433 -1.333 25800
1978 1 4 . 1 1 83 83 ASN CA C 83 52.700 52.700 54.740 -2.040 25800
1979 1 4 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.130 0.570 25800
1980 1 4 . 1 1 83 83 ASN H H 83 8.110 8.110 8.066 0.044 25800
1981 1 4 . 1 1 84 84 ALA N N 84 123.700 123.700 121.333 2.367 25800
1982 1 4 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.465 -0.385 25800
1983 1 4 . 1 1 84 84 ALA C C 84 177.100 177.100 177.226 -0.126 25800
1984 1 4 . 1 1 84 84 ALA CA C 84 52.400 52.400 50.813 1.587 25800
1985 1 4 . 1 1 84 84 ALA CB C 84 19.100 19.100 21.330 -2.230 25800
1986 1 4 . 1 1 84 84 ALA H H 84 8.020 8.020 7.470 0.550 25800
1987 1 4 . 1 1 85 85 ARG N N 85 120.200 120.200 121.310 -1.110 25800
1988 1 4 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.210 -0.060 25800
1989 1 4 . 1 1 85 85 ARG C C 85 175.200 175.200 176.617 -1.417 25800
1990 1 4 . 1 1 85 85 ARG CA C 85 56.000 56.000 58.268 -2.268 25800
1991 1 4 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.599 0.201 25800
1992 1 4 . 1 1 85 85 ARG H H 85 8.040 8.040 8.715 -0.675 25800
1993 1 5 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.646 -0.056 25800
1994 1 5 . 1 1 0 0 HIS C C 0 174.000 174.000 173.850 0.150 25800
1995 1 5 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.259 -0.959 25800
1996 1 5 . 1 1 0 0 HIS CB C 0 29.300 29.300 31.935 -2.635 25800
1997 1 5 . 1 1 1 1 MET N N 1 122.400 122.400 123.358 -0.958 25800
1998 1 5 . 1 1 1 1 MET HA H 1 4.340 4.340 4.573 -0.233 25800
1999 1 5 . 1 1 1 1 MET C C 1 175.600 175.600 175.051 0.549 25800
2000 1 5 . 1 1 1 1 MET CA C 1 55.600 55.600 55.485 0.115 25800
2001 1 5 . 1 1 1 1 MET CB C 1 32.800 32.800 33.774 -0.974 25800
2002 1 5 . 1 1 1 1 MET H H 1 8.310 8.310 8.498 -0.188 25800
2003 1 5 . 1 1 2 2 VAL N N 2 123.200 123.200 121.338 1.862 25800
2004 1 5 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.407 -0.447 25800
2005 1 5 . 1 1 2 2 VAL C C 2 175.600 175.600 174.517 1.083 25800
2006 1 5 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.670 -0.370 25800
2007 1 5 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.187 0.113 25800
2008 1 5 . 1 1 2 2 VAL H H 2 8.180 8.180 8.105 0.075 25800
2009 1 5 . 1 1 3 3 ILE N N 3 126.200 126.200 123.602 2.598 25800
2010 1 5 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.466 -0.416 25800
2011 1 5 . 1 1 3 3 ILE C C 3 175.800 175.800 176.166 -0.366 25800
2012 1 5 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.449 0.251 25800
2013 1 5 . 1 1 3 3 ILE CB C 3 38.300 38.300 40.956 -2.656 25800
2014 1 5 . 1 1 3 3 ILE H H 3 8.230 8.230 7.611 0.619 25800
2015 1 5 . 1 1 4 4 ARG N N 4 126.100 126.100 123.933 2.167 25800
2016 1 5 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.410 -0.230 25800
2017 1 5 . 1 1 4 4 ARG C C 4 175.900 175.900 175.740 0.160 25800
2018 1 5 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.624 -0.624 25800
2019 1 5 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.183 0.517 25800
2020 1 5 . 1 1 4 4 ARG H H 4 8.360 8.360 8.575 -0.215 25800
2021 1 5 . 1 1 5 5 GLU N N 5 122.200 122.200 117.400 4.800 25800
2022 1 5 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.412 -0.272 25800
2023 1 5 . 1 1 5 5 GLU C C 5 176.100 176.100 174.878 1.222 25800
2024 1 5 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.291 1.309 25800
2025 1 5 . 1 1 5 5 GLU CB C 5 30.300 30.300 31.557 -1.257 25800
2026 1 5 . 1 1 5 5 GLU H H 5 8.400 8.400 7.727 0.673 25800
2027 1 5 . 1 1 6 6 SER N N 6 116.200 116.200 119.439 -3.239 25800
2028 1 5 . 1 1 6 6 SER HA H 6 4.350 4.350 4.137 0.213 25800
2029 1 5 . 1 1 6 6 SER C C 6 174.300 174.300 174.472 -0.172 25800
2030 1 5 . 1 1 6 6 SER CA C 6 58.200 58.200 58.114 0.086 25800
2031 1 5 . 1 1 6 6 SER CB C 6 63.800 63.800 63.642 0.159 25800
2032 1 5 . 1 1 6 6 SER H H 6 8.270 8.270 8.408 -0.138 25800
2033 1 5 . 1 1 7 7 VAL N N 7 119.800 119.800 125.701 -5.901 25800
2034 1 5 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.078 0.222 25800
2035 1 5 . 1 1 7 7 VAL C C 7 175.500 175.500 176.029 -0.529 25800
2036 1 5 . 1 1 7 7 VAL CA C 7 61.700 61.700 62.538 -0.838 25800
2037 1 5 . 1 1 7 7 VAL CB C 7 32.800 32.800 32.388 0.412 25800
2038 1 5 . 1 1 7 7 VAL H H 7 7.840 7.840 8.088 -0.248 25800
2039 1 5 . 1 1 8 8 SER N N 8 117.800 117.800 125.351 -7.551 25800
2040 1 5 . 1 1 8 8 SER HA H 8 4.240 4.240 4.639 -0.399 25800
2041 1 5 . 1 1 8 8 SER C C 8 172.500 172.500 173.661 -1.161 25800
2042 1 5 . 1 1 8 8 SER CA C 8 58.500 58.500 59.470 -0.970 25800
2043 1 5 . 1 1 8 8 SER CB C 8 63.600 63.600 63.683 -0.083 25800
2044 1 5 . 1 1 8 8 SER H H 8 8.530 8.530 8.626 -0.096 25800
2045 1 5 . 1 1 9 9 ARG N N 9 123.000 123.000 125.134 -2.134 25800
2046 1 5 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.489 0.011 25800
2047 1 5 . 1 1 9 9 ARG C C 9 175.000 175.000 175.001 -0.001 25800
2048 1 5 . 1 1 9 9 ARG CA C 9 54.300 54.300 55.016 -0.716 25800
2049 1 5 . 1 1 9 9 ARG CB C 9 33.400 33.400 35.153 -1.753 25800
2050 1 5 . 1 1 9 9 ARG H H 9 7.350 7.350 8.013 -0.663 25800
2051 1 5 . 1 1 10 10 ILE N N 10 114.000 114.000 120.000 -6.000 25800
2052 1 5 . 1 1 10 10 ILE HA H 10 4.820 4.820 3.989 0.831 25800
2053 1 5 . 1 1 10 10 ILE C C 10 173.000 173.000 173.844 -0.844 25800
2054 1 5 . 1 1 10 10 ILE CA C 10 59.400 59.400 59.767 -0.367 25800
2055 1 5 . 1 1 10 10 ILE CB C 10 40.900 40.900 40.430 0.470 25800
2056 1 5 . 1 1 10 10 ILE H H 10 8.830 8.830 8.715 0.115 25800
2057 1 5 . 1 1 11 11 TYR N N 11 123.400 123.400 125.638 -2.238 25800
2058 1 5 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.076 -0.146 25800
2059 1 5 . 1 1 11 11 TYR C C 11 173.000 173.000 173.243 -0.243 25800
2060 1 5 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.649 0.351 25800
2061 1 5 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.478 -1.578 25800
2062 1 5 . 1 1 11 11 TYR H H 11 8.690 8.690 7.844 0.846 25800
2063 1 5 . 1 1 12 12 VAL N N 12 126.300 126.300 122.879 3.421 25800
2064 1 5 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.140 0.420 25800
2065 1 5 . 1 1 12 12 VAL C C 12 174.100 174.100 173.801 0.299 25800
2066 1 5 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.755 -0.555 25800
2067 1 5 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.107 -1.707 25800
2068 1 5 . 1 1 12 12 VAL H H 12 8.370 8.370 7.253 1.117 25800
2069 1 5 . 1 1 13 13 GLY N N 13 113.000 113.000 111.114 1.886 25800
2070 1 5 . 1 1 13 13 GLY C C 13 173.100 173.100 173.627 -0.527 25800
2071 1 5 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.407 -0.107 25800
2072 1 5 . 1 1 13 13 GLY H H 13 9.350 9.350 8.617 0.733 25800
2073 1 5 . 1 1 14 14 ASN N N 14 113.900 113.900 116.093 -2.193 25800
2074 1 5 . 1 1 14 14 ASN HA H 14 4.280 4.280 3.918 0.362 25800
2075 1 5 . 1 1 14 14 ASN C C 14 175.800 175.800 174.646 1.154 25800
2076 1 5 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.809 -0.210 25800
2077 1 5 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.770 0.930 25800
2078 1 5 . 1 1 14 14 ASN H H 14 8.800 8.800 8.117 0.683 25800
2079 1 5 . 1 1 15 15 LEU N N 15 115.800 115.800 120.875 -5.075 25800
2080 1 5 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.381 0.609 25800
2081 1 5 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.164 2.436 25800
2082 1 5 . 1 1 15 15 LEU CB C 15 41.600 41.600 42.872 -1.272 25800
2083 1 5 . 1 1 15 15 LEU H H 15 7.150 7.150 7.404 -0.254 25800
2084 1 5 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.614 -0.544 25800
2085 1 5 . 1 1 16 16 PRO C C 16 171.500 171.500 177.716 -6.216 25800
2086 1 5 . 1 1 16 16 PRO CA C 16 62.500 62.500 61.878 0.622 25800
2087 1 5 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.793 -0.793 25800
2088 1 5 . 1 1 17 17 SER N N 17 115.200 115.200 114.699 0.501 25800
2089 1 5 . 1 1 17 17 SER HA H 17 4.300 4.300 4.227 0.073 25800
2090 1 5 . 1 1 17 17 SER C C 17 174.200 174.200 174.295 -0.095 25800
2091 1 5 . 1 1 17 17 SER CA C 17 58.200 58.200 57.591 0.609 25800
2092 1 5 . 1 1 17 17 SER CB C 17 63.900 63.900 62.059 1.841 25800
2093 1 5 . 1 1 17 17 SER H H 17 8.470 8.470 8.487 -0.017 25800
2094 1 5 . 1 1 18 18 HIS N N 18 120.800 120.800 121.002 -0.202 25800
2095 1 5 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.433 0.117 25800
2096 1 5 . 1 1 18 18 HIS C C 18 175.100 175.100 175.264 -0.164 25800
2097 1 5 . 1 1 18 18 HIS CA C 18 55.500 55.500 58.170 -2.670 25800
2098 1 5 . 1 1 18 18 HIS CB C 18 29.300 29.300 30.465 -1.165 25800
2099 1 5 . 1 1 18 18 HIS H H 18 8.540 8.540 7.998 0.542 25800
2100 1 5 . 1 1 19 19 VAL N N 19 115.700 115.700 114.359 1.341 25800
2101 1 5 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.468 -0.208 25800
2102 1 5 . 1 1 19 19 VAL C C 19 174.000 174.000 175.035 -1.035 25800
2103 1 5 . 1 1 19 19 VAL CA C 19 61.900 61.900 60.206 1.694 25800
2104 1 5 . 1 1 19 19 VAL CB C 19 32.600 32.600 33.992 -1.392 25800
2105 1 5 . 1 1 19 19 VAL H H 19 6.650 6.650 7.327 -0.677 25800
2106 1 5 . 1 1 20 20 SER N N 20 118.800 118.800 120.690 -1.890 25800
2107 1 5 . 1 1 20 20 SER HA H 20 4.710 4.710 4.677 0.033 25800
2108 1 5 . 1 1 20 20 SER C C 20 175.900 175.900 175.827 0.073 25800
2109 1 5 . 1 1 20 20 SER CA C 20 55.800 55.800 57.017 -1.217 25800
2110 1 5 . 1 1 20 20 SER CB C 20 66.600 66.600 65.348 1.252 25800
2111 1 5 . 1 1 20 20 SER H H 20 8.930 8.930 7.985 0.945 25800
2112 1 5 . 1 1 21 21 SER N N 21 117.100 117.100 117.434 -0.334 25800
2113 1 5 . 1 1 21 21 SER HA H 21 3.880 3.880 4.077 -0.197 25800
2114 1 5 . 1 1 21 21 SER C C 21 176.200 176.200 176.529 -0.329 25800
2115 1 5 . 1 1 21 21 SER CA C 21 62.300 62.300 61.156 1.144 25800
2116 1 5 . 1 1 21 21 SER CB C 21 66.800 66.800 62.947 3.853 25800
2117 1 5 . 1 1 21 21 SER H H 21 9.080 9.080 8.965 0.115 25800
2118 1 5 . 1 1 22 22 ARG N N 22 121.200 121.200 122.024 -0.824 25800
2119 1 5 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.119 -0.129 25800
2120 1 5 . 1 1 22 22 ARG C C 22 177.900 177.900 177.831 0.069 25800
2121 1 5 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.779 -0.079 25800
2122 1 5 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.830 -0.230 25800
2123 1 5 . 1 1 22 22 ARG H H 22 7.940 7.940 7.651 0.289 25800
2124 1 5 . 1 1 23 23 ASP N N 23 118.800 118.800 119.879 -1.079 25800
2125 1 5 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.516 -0.126 25800
2126 1 5 . 1 1 23 23 ASP C C 23 179.200 179.200 178.769 0.431 25800
2127 1 5 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.031 0.269 25800
2128 1 5 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.432 0.568 25800
2129 1 5 . 1 1 23 23 ASP H H 23 7.480 7.480 7.805 -0.325 25800
2130 1 5 . 1 1 24 24 VAL N N 24 119.500 119.500 119.717 -0.217 25800
2131 1 5 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.804 -0.434 25800
2132 1 5 . 1 1 24 24 VAL C C 24 177.500 177.500 177.566 -0.066 25800
2133 1 5 . 1 1 24 24 VAL CA C 24 66.900 66.900 67.413 -0.513 25800
2134 1 5 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.848 -0.448 25800
2135 1 5 . 1 1 24 24 VAL H H 24 7.450 7.450 8.632 -1.182 25800
2136 1 5 . 1 1 25 25 GLU N N 25 121.400 121.400 120.211 1.189 25800
2137 1 5 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.005 -0.435 25800
2138 1 5 . 1 1 25 25 GLU C C 25 178.400 178.400 178.734 -0.334 25800
2139 1 5 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.108 0.492 25800
2140 1 5 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.290 0.310 25800
2141 1 5 . 1 1 25 25 GLU H H 25 8.580 8.580 7.952 0.628 25800
2142 1 5 . 1 1 26 26 ASN N N 26 114.800 114.800 117.090 -2.290 25800
2143 1 5 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.442 -0.122 25800
2144 1 5 . 1 1 26 26 ASN C C 26 177.400 177.400 177.769 -0.369 25800
2145 1 5 . 1 1 26 26 ASN CA C 26 55.900 55.900 56.298 -0.398 25800
2146 1 5 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.497 -0.597 25800
2147 1 5 . 1 1 26 26 ASN H H 26 8.180 8.180 7.741 0.439 25800
2148 1 5 . 1 1 27 27 GLU N N 27 118.900 118.900 120.293 -1.393 25800
2149 1 5 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.162 -0.022 25800
2150 1 5 . 1 1 27 27 GLU C C 27 176.400 176.400 178.778 -2.378 25800
2151 1 5 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.686 -1.286 25800
2152 1 5 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.643 -0.243 25800
2153 1 5 . 1 1 27 27 GLU H H 27 7.340 7.340 8.237 -0.897 25800
2154 1 5 . 1 1 28 28 PHE N N 28 114.100 114.100 118.806 -4.706 25800
2155 1 5 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.502 0.048 25800
2156 1 5 . 1 1 28 28 PHE C C 28 176.300 176.300 177.947 -1.647 25800
2157 1 5 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.913 -0.913 25800
2158 1 5 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.961 1.839 25800
2159 1 5 . 1 1 28 28 PHE H H 28 7.660 7.660 8.387 -0.727 25800
2160 1 5 . 1 1 29 29 ARG N N 29 121.700 121.700 119.606 2.094 25800
2161 1 5 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.350 0.060 25800
2162 1 5 . 1 1 29 29 ARG C C 29 177.100 177.100 177.762 -0.662 25800
2163 1 5 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.953 -0.753 25800
2164 1 5 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.218 -0.918 25800
2165 1 5 . 1 1 29 29 ARG H H 29 8.120 8.120 8.224 -0.104 25800
2166 1 5 . 1 1 30 30 LYS N N 30 117.200 117.200 118.441 -1.241 25800
2167 1 5 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.172 -0.342 25800
2168 1 5 . 1 1 30 30 LYS C C 30 177.100 177.100 178.660 -1.560 25800
2169 1 5 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.320 -0.520 25800
2170 1 5 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.982 -0.882 25800
2171 1 5 . 1 1 30 30 LYS H H 30 7.630 7.630 7.648 -0.018 25800
2172 1 5 . 1 1 31 31 TYR N N 31 117.100 117.100 119.226 -2.126 25800
2173 1 5 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.487 -0.337 25800
2174 1 5 . 1 1 31 31 TYR C C 31 174.400 174.400 176.611 -2.211 25800
2175 1 5 . 1 1 31 31 TYR CA C 31 59.900 59.900 60.125 -0.225 25800
2176 1 5 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.709 -1.808 25800
2177 1 5 . 1 1 31 31 TYR H H 31 7.410 7.410 8.077 -0.667 25800
2178 1 5 . 1 1 32 32 GLY N N 32 104.100 104.100 103.863 0.237 25800
2179 1 5 . 1 1 32 32 GLY C C 32 177.000 177.000 172.490 4.510 25800
2180 1 5 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.965 -0.465 25800
2181 1 5 . 1 1 32 32 GLY H H 32 7.240 7.240 8.103 -0.863 25800
2182 1 5 . 1 1 33 33 ASN N N 33 115.300 115.300 121.029 -5.729 25800
2183 1 5 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.631 -0.191 25800
2184 1 5 . 1 1 33 33 ASN C C 33 175.500 175.500 174.617 0.883 25800
2185 1 5 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.796 1.504 25800
2186 1 5 . 1 1 33 33 ASN CB C 33 38.400 38.400 37.769 0.631 25800
2187 1 5 . 1 1 33 33 ASN H H 33 8.460 8.460 8.619 -0.159 25800
2188 1 5 . 1 1 34 34 ILE N N 34 126.700 126.700 123.904 2.796 25800
2189 1 5 . 1 1 34 34 ILE HA H 34 3.790 3.790 3.476 0.314 25800
2190 1 5 . 1 1 34 34 ILE C C 34 175.600 175.600 175.612 -0.012 25800
2191 1 5 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.927 -0.627 25800
2192 1 5 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.055 1.945 25800
2193 1 5 . 1 1 34 34 ILE H H 34 8.050 8.050 7.594 0.456 25800
2194 1 5 . 1 1 35 35 LEU N N 35 127.400 127.400 128.465 -1.065 25800
2195 1 5 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.399 -0.239 25800
2196 1 5 . 1 1 35 35 LEU C C 35 177.200 177.200 176.478 0.722 25800
2197 1 5 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.637 -0.137 25800
2198 1 5 . 1 1 35 35 LEU CB C 35 42.700 42.700 43.213 -0.513 25800
2199 1 5 . 1 1 35 35 LEU H H 35 8.780 8.780 8.917 -0.137 25800
2200 1 5 . 1 1 36 36 LYS N N 36 117.000 117.000 118.789 -1.789 25800
2201 1 5 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.590 -0.350 25800
2202 1 5 . 1 1 36 36 LYS C C 36 173.600 173.600 173.846 -0.246 25800
2203 1 5 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.390 0.510 25800
2204 1 5 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.617 0.983 25800
2205 1 5 . 1 1 36 36 LYS H H 36 7.110 7.110 7.461 -0.351 25800
2206 1 5 . 1 1 37 37 CYS N N 37 125.400 125.400 119.303 6.097 25800
2207 1 5 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.632 -0.932 25800
2208 1 5 . 1 1 37 37 CYS C C 37 171.600 171.600 172.977 -1.377 25800
2209 1 5 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.070 0.830 25800
2210 1 5 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.746 -4.646 25800
2211 1 5 . 1 1 37 37 CYS H H 37 8.610 8.610 8.455 0.155 25800
2212 1 5 . 1 1 38 38 ASP N N 38 128.200 128.200 122.170 6.030 25800
2213 1 5 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.849 0.101 25800
2214 1 5 . 1 1 38 38 ASP C C 38 174.300 174.300 174.708 -0.408 25800
2215 1 5 . 1 1 38 38 ASP CA C 38 53.200 53.200 54.312 -1.112 25800
2216 1 5 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.269 -0.969 25800
2217 1 5 . 1 1 38 38 ASP H H 38 8.290 8.290 8.622 -0.332 25800
2218 1 5 . 1 1 39 39 VAL N N 39 123.500 123.500 119.479 4.021 25800
2219 1 5 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.848 -0.548 25800
2220 1 5 . 1 1 39 39 VAL C C 39 175.000 175.000 175.244 -0.244 25800
2221 1 5 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.510 0.190 25800
2222 1 5 . 1 1 39 39 VAL CB C 39 33.100 33.100 33.006 0.094 25800
2223 1 5 . 1 1 39 39 VAL H H 39 8.380 8.380 8.484 -0.104 25800
2224 1 5 . 1 1 40 40 LYS N N 40 129.100 129.100 123.900 5.200 25800
2225 1 5 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.908 -0.588 25800
2226 1 5 . 1 1 40 40 LYS C C 40 173.700 173.700 174.587 -0.887 25800
2227 1 5 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.714 -0.814 25800
2228 1 5 . 1 1 40 40 LYS CB C 40 35.500 35.500 36.155 -0.655 25800
2229 1 5 . 1 1 40 40 LYS H H 40 8.680 8.680 9.131 -0.451 25800
2230 1 5 . 1 1 41 41 LYS N N 41 117.300 117.300 120.814 -3.514 25800
2231 1 5 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.514 -0.534 25800
2232 1 5 . 1 1 41 41 LYS C C 41 177.800 177.800 175.539 2.261 25800
2233 1 5 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.692 -0.092 25800
2234 1 5 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.692 -0.692 25800
2235 1 5 . 1 1 41 41 LYS H H 41 7.900 7.900 8.378 -0.478 25800
2236 1 5 . 1 1 42 42 THR N N 42 113.200 113.200 113.602 -0.402 25800
2237 1 5 . 1 1 42 42 THR HA H 42 4.680 4.680 4.693 -0.013 25800
2238 1 5 . 1 1 42 42 THR C C 42 176.900 176.900 176.514 0.386 25800
2239 1 5 . 1 1 42 42 THR CA C 42 60.200 60.200 60.739 -0.539 25800
2240 1 5 . 1 1 42 42 THR CB C 42 71.600 71.600 69.816 1.784 25800
2241 1 5 . 1 1 42 42 THR H H 42 8.730 8.730 8.673 0.057 25800
2242 1 5 . 1 1 43 43 VAL N N 43 120.000 120.000 121.618 -1.618 25800
2243 1 5 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.906 0.014 25800
2244 1 5 . 1 1 43 43 VAL C C 43 177.000 177.000 177.368 -0.368 25800
2245 1 5 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.424 0.276 25800
2246 1 5 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.408 0.392 25800
2247 1 5 . 1 1 43 43 VAL H H 43 8.730 8.730 8.543 0.187 25800
2248 1 5 . 1 1 44 44 SER N N 44 113.400 113.400 114.248 -0.848 25800
2249 1 5 . 1 1 44 44 SER HA H 44 4.360 4.360 4.355 0.005 25800
2250 1 5 . 1 1 44 44 SER C C 44 174.800 174.800 175.122 -0.322 25800
2251 1 5 . 1 1 44 44 SER CA C 44 58.400 58.400 58.655 -0.255 25800
2252 1 5 . 1 1 44 44 SER CB C 44 63.500 63.500 63.309 0.191 25800
2253 1 5 . 1 1 44 44 SER H H 44 7.760 7.760 8.387 -0.627 25800
2254 1 5 . 1 1 45 45 GLY N N 45 110.200 110.200 108.721 1.479 25800
2255 1 5 . 1 1 45 45 GLY C C 45 173.500 173.500 174.027 -0.527 25800
2256 1 5 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.052 0.248 25800
2257 1 5 . 1 1 45 45 GLY H H 45 7.820 7.820 7.783 0.037 25800
2258 1 5 . 1 1 46 46 ALA N N 46 123.900 123.900 123.051 0.849 25800
2259 1 5 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.276 0.114 25800
2260 1 5 . 1 1 46 46 ALA C C 46 176.100 176.100 175.538 0.562 25800
2261 1 5 . 1 1 46 46 ALA CA C 46 51.900 51.900 52.246 -0.346 25800
2262 1 5 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.949 -0.149 25800
2263 1 5 . 1 1 46 46 ALA H H 46 7.440 7.440 7.681 -0.241 25800
2264 1 5 . 1 1 47 47 ALA N N 47 123.100 123.100 123.719 -0.619 25800
2265 1 5 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.395 -0.195 25800
2266 1 5 . 1 1 47 47 ALA C C 47 176.100 176.100 175.015 1.085 25800
2267 1 5 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.140 0.760 25800
2268 1 5 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.570 -0.670 25800
2269 1 5 . 1 1 47 47 ALA H H 47 8.350 8.350 7.927 0.423 25800
2270 1 5 . 1 1 48 48 PHE N N 48 118.700 118.700 117.119 1.581 25800
2271 1 5 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.138 -0.108 25800
2272 1 5 . 1 1 48 48 PHE C C 48 171.600 171.600 174.351 -2.751 25800
2273 1 5 . 1 1 48 48 PHE CA C 48 55.700 55.700 57.000 -1.300 25800
2274 1 5 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.815 -2.615 25800
2275 1 5 . 1 1 48 48 PHE H H 48 8.550 8.550 9.173 -0.623 25800
2276 1 5 . 1 1 49 49 ALA N N 49 120.400 120.400 124.948 -4.548 25800
2277 1 5 . 1 1 49 49 ALA HA H 49 5.330 5.330 4.941 0.389 25800
2278 1 5 . 1 1 49 49 ALA C C 49 175.500 175.500 175.554 -0.054 25800
2279 1 5 . 1 1 49 49 ALA CA C 49 49.300 49.300 51.236 -1.936 25800
2280 1 5 . 1 1 49 49 ALA CB C 49 23.700 23.700 20.182 3.518 25800
2281 1 5 . 1 1 49 49 ALA H H 49 9.240 9.240 8.314 0.926 25800
2282 1 5 . 1 1 50 50 PHE N N 50 115.000 115.000 120.493 -5.493 25800
2283 1 5 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.478 0.122 25800
2284 1 5 . 1 1 50 50 PHE C C 50 176.000 176.000 174.255 1.745 25800
2285 1 5 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.870 -0.370 25800
2286 1 5 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.446 -1.246 25800
2287 1 5 . 1 1 50 50 PHE H H 50 7.920 7.920 7.889 0.031 25800
2288 1 5 . 1 1 51 51 ILE N N 51 123.000 123.000 121.689 1.311 25800
2289 1 5 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.850 -0.400 25800
2290 1 5 . 1 1 51 51 ILE C C 51 173.700 173.700 174.339 -0.639 25800
2291 1 5 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.320 -0.120 25800
2292 1 5 . 1 1 51 51 ILE CB C 51 40.700 40.700 42.068 -1.368 25800
2293 1 5 . 1 1 51 51 ILE H H 51 8.490 8.490 8.766 -0.276 25800
2294 1 5 . 1 1 52 52 GLU N N 52 126.600 126.600 125.835 0.765 25800
2295 1 5 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.044 -0.274 25800
2296 1 5 . 1 1 52 52 GLU C C 52 175.300 175.300 175.276 0.024 25800
2297 1 5 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.626 -0.926 25800
2298 1 5 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.294 -0.794 25800
2299 1 5 . 1 1 52 52 GLU H H 52 8.610 8.610 9.181 -0.571 25800
2300 1 5 . 1 1 53 53 PHE N N 53 126.100 126.100 125.126 0.974 25800
2301 1 5 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.222 -0.422 25800
2302 1 5 . 1 1 53 53 PHE C C 53 175.400 175.400 175.566 -0.166 25800
2303 1 5 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.572 1.628 25800
2304 1 5 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.560 -2.660 25800
2305 1 5 . 1 1 53 53 PHE H H 53 8.800 8.800 9.285 -0.485 25800
2306 1 5 . 1 1 54 54 GLU N N 54 120.700 120.700 121.045 -0.345 25800
2307 1 5 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.215 -0.285 25800
2308 1 5 . 1 1 54 54 GLU C C 54 175.300 175.300 176.332 -1.032 25800
2309 1 5 . 1 1 54 54 GLU CA C 54 59.100 59.100 58.008 1.092 25800
2310 1 5 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.284 0.516 25800
2311 1 5 . 1 1 54 54 GLU H H 54 8.160 8.160 8.212 -0.052 25800
2312 1 5 . 1 1 55 55 ASP N N 55 117.900 117.900 119.090 -1.190 25800
2313 1 5 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.887 0.033 25800
2314 1 5 . 1 1 55 55 ASP C C 55 176.400 176.400 175.358 1.042 25800
2315 1 5 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.355 -0.955 25800
2316 1 5 . 1 1 55 55 ASP CB C 55 44.400 44.400 43.152 1.248 25800
2317 1 5 . 1 1 55 55 ASP H H 55 8.740 8.740 7.900 0.840 25800
2318 1 5 . 1 1 56 56 ALA N N 56 128.900 128.900 125.763 3.137 25800
2319 1 5 . 1 1 56 56 ALA HA H 56 3.830 3.830 2.653 1.177 25800
2320 1 5 . 1 1 56 56 ALA C C 56 179.800 179.800 178.181 1.619 25800
2321 1 5 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.406 0.794 25800
2322 1 5 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.471 0.429 25800
2323 1 5 . 1 1 56 56 ALA H H 56 8.800 8.800 8.448 0.352 25800
2324 1 5 . 1 1 57 57 ARG N N 57 119.200 119.200 117.675 1.525 25800
2325 1 5 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.021 -0.131 25800
2326 1 5 . 1 1 57 57 ARG C C 57 178.000 178.000 177.252 0.748 25800
2327 1 5 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.428 0.472 25800
2328 1 5 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.687 0.613 25800
2329 1 5 . 1 1 57 57 ARG H H 57 8.950 8.950 8.438 0.512 25800
2330 1 5 . 1 1 58 58 ASP N N 58 120.900 120.900 118.889 2.011 25800
2331 1 5 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.497 -0.407 25800
2332 1 5 . 1 1 58 58 ASP C C 58 176.700 176.700 177.572 -0.872 25800
2333 1 5 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.900 -0.400 25800
2334 1 5 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.585 -0.685 25800
2335 1 5 . 1 1 58 58 ASP H H 58 7.020 7.020 8.472 -1.452 25800
2336 1 5 . 1 1 59 59 ALA N N 59 119.700 119.700 121.415 -1.715 25800
2337 1 5 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.773 -1.693 25800
2338 1 5 . 1 1 59 59 ALA C C 59 178.100 178.100 179.341 -1.241 25800
2339 1 5 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.134 0.166 25800
2340 1 5 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.837 -0.437 25800
2341 1 5 . 1 1 59 59 ALA H H 59 6.440 6.440 7.491 -1.051 25800
2342 1 5 . 1 1 60 60 ALA N N 60 117.600 117.600 121.762 -4.162 25800
2343 1 5 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.167 -0.337 25800
2344 1 5 . 1 1 60 60 ALA C C 60 180.900 180.900 179.191 1.709 25800
2345 1 5 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.568 -0.668 25800
2346 1 5 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.363 -0.663 25800
2347 1 5 . 1 1 60 60 ALA H H 60 7.330 7.330 8.585 -1.255 25800
2348 1 5 . 1 1 61 61 ASP N N 61 120.100 120.100 117.972 2.128 25800
2349 1 5 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.435 -0.225 25800
2350 1 5 . 1 1 61 61 ASP C C 61 176.700 176.700 178.055 -1.355 25800
2351 1 5 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.125 -0.025 25800
2352 1 5 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.359 -0.259 25800
2353 1 5 . 1 1 61 61 ASP H H 61 7.590 7.590 8.295 -0.705 25800
2354 1 5 . 1 1 62 62 ALA N N 62 122.200 122.200 121.959 0.241 25800
2355 1 5 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.186 -1.766 25800
2356 1 5 . 1 1 62 62 ALA C C 62 179.300 179.300 179.270 0.030 25800
2357 1 5 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.110 0.490 25800
2358 1 5 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.713 0.387 25800
2359 1 5 . 1 1 62 62 ALA H H 62 7.440 7.440 7.490 -0.050 25800
2360 1 5 . 1 1 63 63 ILE N N 63 116.700 116.700 119.262 -2.562 25800
2361 1 5 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.211 -0.971 25800
2362 1 5 . 1 1 63 63 ILE C C 63 177.800 177.800 177.825 -0.025 25800
2363 1 5 . 1 1 63 63 ILE CA C 63 65.600 65.600 62.636 2.964 25800
2364 1 5 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.224 0.676 25800
2365 1 5 . 1 1 63 63 ILE H H 63 7.540 7.540 8.275 -0.735 25800
2366 1 5 . 1 1 64 64 LYS N N 64 117.400 117.400 120.290 -2.890 25800
2367 1 5 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.124 -0.224 25800
2368 1 5 . 1 1 64 64 LYS C C 64 178.900 178.900 178.342 0.558 25800
2369 1 5 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.814 -0.014 25800
2370 1 5 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.516 1.084 25800
2371 1 5 . 1 1 64 64 LYS H H 64 7.490 7.490 8.507 -1.017 25800
2372 1 5 . 1 1 65 65 GLU N N 65 113.800 113.800 118.116 -4.316 25800
2373 1 5 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.262 -0.102 25800
2374 1 5 . 1 1 65 65 GLU C C 65 178.300 178.300 177.366 0.934 25800
2375 1 5 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.161 0.139 25800
2376 1 5 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.701 1.999 25800
2377 1 5 . 1 1 65 65 GLU H H 65 7.960 7.960 8.078 -0.118 25800
2378 1 5 . 1 1 66 66 LYS N N 66 114.700 114.700 118.234 -3.534 25800
2379 1 5 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.594 -0.124 25800
2380 1 5 . 1 1 66 66 LYS C C 66 177.500 177.500 176.223 1.277 25800
2381 1 5 . 1 1 66 66 LYS CA C 66 54.400 54.400 54.851 -0.451 25800
2382 1 5 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.252 0.748 25800
2383 1 5 . 1 1 66 66 LYS H H 66 8.050 8.050 7.670 0.380 25800
2384 1 5 . 1 1 67 67 ASP N N 67 118.800 118.800 120.800 -2.000 25800
2385 1 5 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.482 -0.262 25800
2386 1 5 . 1 1 67 67 ASP C C 67 177.700 177.700 177.642 0.058 25800
2387 1 5 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.331 4.069 25800
2388 1 5 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.187 0.213 25800
2389 1 5 . 1 1 67 67 ASP H H 67 7.620 7.620 7.517 0.103 25800
2390 1 5 . 1 1 68 68 GLY N N 68 115.600 115.600 107.509 8.091 25800
2391 1 5 . 1 1 68 68 GLY C C 68 173.800 173.800 174.762 -0.962 25800
2392 1 5 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.719 1.181 25800
2393 1 5 . 1 1 68 68 GLY H H 68 8.470 8.470 8.609 -0.139 25800
2394 1 5 . 1 1 69 69 CYS N N 69 119.200 119.200 119.250 -0.050 25800
2395 1 5 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.611 -0.451 25800
2396 1 5 . 1 1 69 69 CYS C C 69 172.600 172.600 174.357 -1.757 25800
2397 1 5 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.797 0.203 25800
2398 1 5 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.868 -0.168 25800
2399 1 5 . 1 1 69 69 CYS H H 69 7.890 7.890 8.178 -0.288 25800
2400 1 5 . 1 1 70 70 ASP N N 70 122.200 122.200 124.999 -2.799 25800
2401 1 5 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.636 0.194 25800
2402 1 5 . 1 1 70 70 ASP C C 70 176.400 176.400 174.805 1.595 25800
2403 1 5 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.763 0.937 25800
2404 1 5 . 1 1 70 70 ASP CB C 70 42.700 42.700 43.174 -0.474 25800
2405 1 5 . 1 1 70 70 ASP H H 70 8.360 8.360 8.426 -0.066 25800
2406 1 5 . 1 1 71 71 PHE N N 71 127.600 127.600 119.931 7.669 25800
2407 1 5 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.150 -0.550 25800
2408 1 5 . 1 1 71 71 PHE C C 71 173.600 173.600 175.378 -1.778 25800
2409 1 5 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.678 0.122 25800
2410 1 5 . 1 1 71 71 PHE CB C 71 40.700 40.700 40.799 -0.099 25800
2411 1 5 . 1 1 71 71 PHE H H 71 9.390 9.390 7.634 1.756 25800
2412 1 5 . 1 1 72 72 GLU N N 72 123.900 123.900 119.317 4.583 25800
2413 1 5 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.163 -0.623 25800
2414 1 5 . 1 1 72 72 GLU C C 72 175.500 175.500 176.123 -0.623 25800
2415 1 5 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.281 -0.581 25800
2416 1 5 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.492 -1.192 25800
2417 1 5 . 1 1 72 72 GLU H H 72 8.940 8.940 9.364 -0.424 25800
2418 1 5 . 1 1 73 73 GLY N N 73 105.200 105.200 103.628 1.572 25800
2419 1 5 . 1 1 73 73 GLY C C 73 174.100 174.100 173.967 0.133 25800
2420 1 5 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.866 0.734 25800
2421 1 5 . 1 1 73 73 GLY H H 73 8.350 8.350 8.158 0.192 25800
2422 1 5 . 1 1 74 74 ASN N N 74 121.000 121.000 119.970 1.030 25800
2423 1 5 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.986 -0.226 25800
2424 1 5 . 1 1 74 74 ASN C C 74 174.000 174.000 173.362 0.638 25800
2425 1 5 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.523 -1.623 25800
2426 1 5 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.121 -0.421 25800
2427 1 5 . 1 1 74 74 ASN H H 74 7.740 7.740 7.943 -0.203 25800
2428 1 5 . 1 1 75 75 LYS N N 75 121.400 121.400 121.307 0.093 25800
2429 1 5 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.572 -0.102 25800
2430 1 5 . 1 1 75 75 LYS C C 75 176.900 176.900 174.889 2.011 25800
2431 1 5 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.567 -0.267 25800
2432 1 5 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.555 -0.655 25800
2433 1 5 . 1 1 75 75 LYS H H 75 8.380 8.380 8.486 -0.106 25800
2434 1 5 . 1 1 76 76 LEU N N 76 127.400 127.400 123.586 3.814 25800
2435 1 5 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.466 -0.036 25800
2436 1 5 . 1 1 76 76 LEU C C 76 177.600 177.600 174.775 2.825 25800
2437 1 5 . 1 1 76 76 LEU CA C 76 55.300 55.300 54.884 0.416 25800
2438 1 5 . 1 1 76 76 LEU CB C 76 43.100 43.100 44.076 -0.976 25800
2439 1 5 . 1 1 76 76 LEU H H 76 8.950 8.950 7.953 0.997 25800
2440 1 5 . 1 1 77 77 ARG N N 77 121.800 121.800 124.052 -2.252 25800
2441 1 5 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.747 0.153 25800
2442 1 5 . 1 1 77 77 ARG C C 77 174.700 174.700 174.056 0.644 25800
2443 1 5 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.894 -1.894 25800
2444 1 5 . 1 1 77 77 ARG CB C 77 32.300 32.300 31.957 0.343 25800
2445 1 5 . 1 1 77 77 ARG H H 77 7.530 7.530 8.232 -0.702 25800
2446 1 5 . 1 1 78 78 VAL N N 78 127.000 127.000 126.053 0.947 25800
2447 1 5 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.232 1.048 25800
2448 1 5 . 1 1 78 78 VAL C C 78 174.200 174.200 174.549 -0.349 25800
2449 1 5 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.569 -0.369 25800
2450 1 5 . 1 1 78 78 VAL CB C 78 33.400 33.400 33.817 -0.417 25800
2451 1 5 . 1 1 78 78 VAL H H 78 9.660 9.660 8.584 1.076 25800
2452 1 5 . 1 1 79 79 GLU N N 79 121.900 121.900 128.318 -6.418 25800
2453 1 5 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.496 0.214 25800
2454 1 5 . 1 1 79 79 GLU C C 79 174.600 174.600 173.908 0.692 25800
2455 1 5 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.817 -1.917 25800
2456 1 5 . 1 1 79 79 GLU CB C 79 34.400 34.400 33.760 0.640 25800
2457 1 5 . 1 1 79 79 GLU H H 79 8.980 8.980 8.297 0.683 25800
2458 1 5 . 1 1 80 80 VAL N N 80 121.300 121.300 123.087 -1.787 25800
2459 1 5 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.303 0.067 25800
2460 1 5 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.264 2.736 25800
2461 1 5 . 1 1 80 80 VAL CB C 80 32.100 32.100 34.695 -2.595 25800
2462 1 5 . 1 1 80 80 VAL H H 80 8.410 8.410 8.347 0.063 25800
2463 1 5 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.679 -0.419 25800
2464 1 5 . 1 1 81 81 PRO C C 81 176.100 176.100 176.033 0.067 25800
2465 1 5 . 1 1 81 81 PRO CA C 81 63.100 63.100 62.903 0.197 25800
2466 1 5 . 1 1 81 81 PRO CB C 81 32.100 32.100 29.866 2.234 25800
2467 1 5 . 1 1 82 82 PHE N N 82 122.200 122.200 121.285 0.915 25800
2468 1 5 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.408 -0.118 25800
2469 1 5 . 1 1 82 82 PHE C C 82 175.300 175.300 175.926 -0.626 25800
2470 1 5 . 1 1 82 82 PHE CA C 82 58.100 58.100 56.739 1.361 25800
2471 1 5 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.946 0.454 25800
2472 1 5 . 1 1 82 82 PHE H H 82 8.150 8.150 7.842 0.308 25800
2473 1 5 . 1 1 83 83 ASN N N 83 120.800 120.800 115.115 5.685 25800
2474 1 5 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.435 0.005 25800
2475 1 5 . 1 1 83 83 ASN C C 83 174.100 174.100 174.684 -0.584 25800
2476 1 5 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.773 -1.073 25800
2477 1 5 . 1 1 83 83 ASN CB C 83 38.700 38.700 37.839 0.861 25800
2478 1 5 . 1 1 83 83 ASN H H 83 8.110 8.110 8.033 0.077 25800
2479 1 5 . 1 1 84 84 ALA N N 84 123.700 123.700 120.181 3.519 25800
2480 1 5 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.086 -0.006 25800
2481 1 5 . 1 1 84 84 ALA C C 84 177.100 177.100 176.492 0.608 25800
2482 1 5 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.942 -0.542 25800
2483 1 5 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.325 -0.225 25800
2484 1 5 . 1 1 84 84 ALA H H 84 8.020 8.020 8.257 -0.237 25800
2485 1 5 . 1 1 85 85 ARG N N 85 120.200 120.200 121.252 -1.052 25800
2486 1 5 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.558 -0.408 25800
2487 1 5 . 1 1 85 85 ARG C C 85 175.200 175.200 175.586 -0.386 25800
2488 1 5 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.146 0.854 25800
2489 1 5 . 1 1 85 85 ARG CB C 85 30.800 30.800 31.814 -1.014 25800
2490 1 5 . 1 1 85 85 ARG H H 85 8.040 8.040 8.463 -0.423 25800
2491 1 6 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.766 -0.176 25800
2492 1 6 . 1 1 0 0 HIS C C 0 174.000 174.000 174.704 -0.704 25800
2493 1 6 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.063 -0.763 25800
2494 1 6 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.121 -0.821 25800
2495 1 6 . 1 1 1 1 MET N N 1 122.400 122.400 119.511 2.889 25800
2496 1 6 . 1 1 1 1 MET HA H 1 4.340 4.340 4.656 -0.316 25800
2497 1 6 . 1 1 1 1 MET C C 1 175.600 175.600 174.183 1.417 25800
2498 1 6 . 1 1 1 1 MET CA C 1 55.600 55.600 54.908 0.692 25800
2499 1 6 . 1 1 1 1 MET CB C 1 32.800 32.800 35.090 -2.290 25800
2500 1 6 . 1 1 1 1 MET H H 1 8.310 8.310 8.450 -0.140 25800
2501 1 6 . 1 1 2 2 VAL N N 2 123.200 123.200 119.523 3.677 25800
2502 1 6 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.523 -0.563 25800
2503 1 6 . 1 1 2 2 VAL C C 2 175.600 175.600 174.401 1.199 25800
2504 1 6 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.136 0.164 25800
2505 1 6 . 1 1 2 2 VAL CB C 2 32.300 32.300 33.979 -1.679 25800
2506 1 6 . 1 1 2 2 VAL H H 2 8.180 8.180 8.373 -0.193 25800
2507 1 6 . 1 1 3 3 ILE N N 3 126.200 126.200 125.797 0.403 25800
2508 1 6 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.232 -0.182 25800
2509 1 6 . 1 1 3 3 ILE C C 3 175.800 175.800 175.321 0.479 25800
2510 1 6 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.331 -0.631 25800
2511 1 6 . 1 1 3 3 ILE CB C 3 38.300 38.300 39.359 -1.059 25800
2512 1 6 . 1 1 3 3 ILE H H 3 8.230 8.230 8.432 -0.202 25800
2513 1 6 . 1 1 4 4 ARG N N 4 126.100 126.100 119.405 6.695 25800
2514 1 6 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.378 -0.198 25800
2515 1 6 . 1 1 4 4 ARG C C 4 175.900 175.900 174.651 1.249 25800
2516 1 6 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.248 -0.248 25800
2517 1 6 . 1 1 4 4 ARG CB C 4 30.700 30.700 32.226 -1.526 25800
2518 1 6 . 1 1 4 4 ARG H H 4 8.360 8.360 7.824 0.536 25800
2519 1 6 . 1 1 5 5 GLU N N 5 122.200 122.200 119.833 2.367 25800
2520 1 6 . 1 1 5 5 GLU HA H 5 4.140 4.140 3.994 0.146 25800
2521 1 6 . 1 1 5 5 GLU C C 5 176.100 176.100 175.009 1.091 25800
2522 1 6 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.136 -0.536 25800
2523 1 6 . 1 1 5 5 GLU CB C 5 30.300 30.300 28.794 1.506 25800
2524 1 6 . 1 1 5 5 GLU H H 5 8.400 8.400 8.651 -0.251 25800
2525 1 6 . 1 1 6 6 SER N N 6 116.200 116.200 112.824 3.376 25800
2526 1 6 . 1 1 6 6 SER HA H 6 4.350 4.350 4.209 0.141 25800
2527 1 6 . 1 1 6 6 SER C C 6 174.300 174.300 173.406 0.894 25800
2528 1 6 . 1 1 6 6 SER CA C 6 58.200 58.200 58.342 -0.141 25800
2529 1 6 . 1 1 6 6 SER CB C 6 63.800 63.800 63.499 0.301 25800
2530 1 6 . 1 1 6 6 SER H H 6 8.270 8.270 7.915 0.355 25800
2531 1 6 . 1 1 7 7 VAL N N 7 119.800 119.800 122.405 -2.605 25800
2532 1 6 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.315 -0.015 25800
2533 1 6 . 1 1 7 7 VAL C C 7 175.500 175.500 176.022 -0.522 25800
2534 1 6 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.196 0.505 25800
2535 1 6 . 1 1 7 7 VAL CB C 7 32.800 32.800 31.834 0.966 25800
2536 1 6 . 1 1 7 7 VAL H H 7 7.840 7.840 8.467 -0.627 25800
2537 1 6 . 1 1 8 8 SER N N 8 117.800 117.800 116.969 0.831 25800
2538 1 6 . 1 1 8 8 SER HA H 8 4.240 4.240 4.222 0.018 25800
2539 1 6 . 1 1 8 8 SER C C 8 172.500 172.500 173.506 -1.006 25800
2540 1 6 . 1 1 8 8 SER CA C 8 58.500 58.500 58.679 -0.179 25800
2541 1 6 . 1 1 8 8 SER CB C 8 63.600 63.600 62.960 0.640 25800
2542 1 6 . 1 1 8 8 SER H H 8 8.530 8.530 7.886 0.644 25800
2543 1 6 . 1 1 9 9 ARG N N 9 123.000 123.000 121.996 1.004 25800
2544 1 6 . 1 1 9 9 ARG HA H 9 5.500 5.500 4.838 0.662 25800
2545 1 6 . 1 1 9 9 ARG C C 9 175.000 175.000 174.972 0.028 25800
2546 1 6 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.324 -0.024 25800
2547 1 6 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.339 0.061 25800
2548 1 6 . 1 1 9 9 ARG H H 9 7.350 7.350 8.147 -0.797 25800
2549 1 6 . 1 1 10 10 ILE N N 10 114.000 114.000 122.315 -8.315 25800
2550 1 6 . 1 1 10 10 ILE HA H 10 4.820 4.820 3.983 0.837 25800
2551 1 6 . 1 1 10 10 ILE C C 10 173.000 173.000 174.616 -1.616 25800
2552 1 6 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.960 -2.560 25800
2553 1 6 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.589 2.311 25800
2554 1 6 . 1 1 10 10 ILE H H 10 8.830 8.830 8.145 0.685 25800
2555 1 6 . 1 1 11 11 TYR N N 11 123.400 123.400 128.274 -4.874 25800
2556 1 6 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.977 -0.047 25800
2557 1 6 . 1 1 11 11 TYR C C 11 173.000 173.000 173.254 -0.254 25800
2558 1 6 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.636 0.364 25800
2559 1 6 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.120 -1.220 25800
2560 1 6 . 1 1 11 11 TYR H H 11 8.690 8.690 8.087 0.603 25800
2561 1 6 . 1 1 12 12 VAL N N 12 126.300 126.300 125.019 1.281 25800
2562 1 6 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.567 -0.007 25800
2563 1 6 . 1 1 12 12 VAL C C 12 174.100 174.100 173.349 0.751 25800
2564 1 6 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.166 1.034 25800
2565 1 6 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.769 -2.369 25800
2566 1 6 . 1 1 12 12 VAL H H 12 8.370 8.370 7.227 1.143 25800
2567 1 6 . 1 1 13 13 GLY N N 13 113.000 113.000 114.130 -1.130 25800
2568 1 6 . 1 1 13 13 GLY C C 13 173.100 173.100 173.199 -0.099 25800
2569 1 6 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.568 -0.268 25800
2570 1 6 . 1 1 13 13 GLY H H 13 9.350 9.350 8.658 0.692 25800
2571 1 6 . 1 1 14 14 ASN N N 14 113.900 113.900 117.642 -3.742 25800
2572 1 6 . 1 1 14 14 ASN HA H 14 4.280 4.280 3.920 0.360 25800
2573 1 6 . 1 1 14 14 ASN C C 14 175.800 175.800 174.748 1.052 25800
2574 1 6 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.986 -0.386 25800
2575 1 6 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.800 0.900 25800
2576 1 6 . 1 1 14 14 ASN H H 14 8.800 8.800 7.867 0.933 25800
2577 1 6 . 1 1 15 15 LEU N N 15 115.800 115.800 114.830 0.970 25800
2578 1 6 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.555 0.435 25800
2579 1 6 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.610 1.990 25800
2580 1 6 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.588 0.012 25800
2581 1 6 . 1 1 15 15 LEU H H 15 7.150 7.150 7.177 -0.027 25800
2582 1 6 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.562 -0.492 25800
2583 1 6 . 1 1 16 16 PRO C C 16 171.500 171.500 177.231 -5.731 25800
2584 1 6 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.192 -0.692 25800
2585 1 6 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.793 0.207 25800
2586 1 6 . 1 1 17 17 SER N N 17 115.200 115.200 118.685 -3.485 25800
2587 1 6 . 1 1 17 17 SER HA H 17 4.300 4.300 4.188 0.112 25800
2588 1 6 . 1 1 17 17 SER C C 17 174.200 174.200 173.700 0.500 25800
2589 1 6 . 1 1 17 17 SER CA C 17 58.200 58.200 60.146 -1.946 25800
2590 1 6 . 1 1 17 17 SER CB C 17 63.900 63.900 62.350 1.550 25800
2591 1 6 . 1 1 17 17 SER H H 17 8.470 8.470 8.651 -0.181 25800
2592 1 6 . 1 1 18 18 HIS N N 18 120.800 120.800 119.589 1.211 25800
2593 1 6 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.720 -0.170 25800
2594 1 6 . 1 1 18 18 HIS C C 18 175.100 175.100 173.940 1.160 25800
2595 1 6 . 1 1 18 18 HIS CA C 18 55.500 55.500 54.483 1.017 25800
2596 1 6 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.028 0.272 25800
2597 1 6 . 1 1 18 18 HIS H H 18 8.540 8.540 8.022 0.518 25800
2598 1 6 . 1 1 19 19 VAL N N 19 115.700 115.700 122.524 -6.824 25800
2599 1 6 . 1 1 19 19 VAL HA H 19 4.260 4.260 3.815 0.445 25800
2600 1 6 . 1 1 19 19 VAL C C 19 174.000 174.000 175.758 -1.758 25800
2601 1 6 . 1 1 19 19 VAL CA C 19 61.900 61.900 63.145 -1.245 25800
2602 1 6 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.644 -0.044 25800
2603 1 6 . 1 1 19 19 VAL H H 19 6.650 6.650 8.054 -1.404 25800
2604 1 6 . 1 1 20 20 SER N N 20 118.800 118.800 123.487 -4.687 25800
2605 1 6 . 1 1 20 20 SER HA H 20 4.710 4.710 4.595 0.115 25800
2606 1 6 . 1 1 20 20 SER C C 20 175.900 175.900 175.762 0.138 25800
2607 1 6 . 1 1 20 20 SER CA C 20 55.800 55.800 58.399 -2.599 25800
2608 1 6 . 1 1 20 20 SER CB C 20 66.600 66.600 64.103 2.497 25800
2609 1 6 . 1 1 20 20 SER H H 20 8.930 8.930 8.600 0.330 25800
2610 1 6 . 1 1 21 21 SER N N 21 117.100 117.100 120.655 -3.555 25800
2611 1 6 . 1 1 21 21 SER HA H 21 3.880 3.880 4.146 -0.266 25800
2612 1 6 . 1 1 21 21 SER C C 21 176.200 176.200 176.448 -0.248 25800
2613 1 6 . 1 1 21 21 SER CA C 21 62.300 62.300 61.928 0.372 25800
2614 1 6 . 1 1 21 21 SER CB C 21 66.800 66.800 63.239 3.561 25800
2615 1 6 . 1 1 21 21 SER H H 21 9.080 9.080 9.084 -0.004 25800
2616 1 6 . 1 1 22 22 ARG N N 22 121.200 121.200 120.355 0.845 25800
2617 1 6 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.187 -0.197 25800
2618 1 6 . 1 1 22 22 ARG C C 22 177.900 177.900 178.354 -0.454 25800
2619 1 6 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.228 -0.528 25800
2620 1 6 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.763 -0.163 25800
2621 1 6 . 1 1 22 22 ARG H H 22 7.940 7.940 8.488 -0.548 25800
2622 1 6 . 1 1 23 23 ASP N N 23 118.800 118.800 120.343 -1.543 25800
2623 1 6 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.522 -0.132 25800
2624 1 6 . 1 1 23 23 ASP C C 23 179.200 179.200 178.462 0.738 25800
2625 1 6 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.081 0.219 25800
2626 1 6 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.596 0.404 25800
2627 1 6 . 1 1 23 23 ASP H H 23 7.480 7.480 7.876 -0.396 25800
2628 1 6 . 1 1 24 24 VAL N N 24 119.500 119.500 117.558 1.942 25800
2629 1 6 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.679 -0.309 25800
2630 1 6 . 1 1 24 24 VAL C C 24 177.500 177.500 177.523 -0.023 25800
2631 1 6 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.950 0.951 25800
2632 1 6 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.417 -0.017 25800
2633 1 6 . 1 1 24 24 VAL H H 24 7.450 7.450 7.604 -0.154 25800
2634 1 6 . 1 1 25 25 GLU N N 25 121.400 121.400 120.973 0.427 25800
2635 1 6 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.998 -0.428 25800
2636 1 6 . 1 1 25 25 GLU C C 25 178.400 178.400 178.749 -0.349 25800
2637 1 6 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.189 0.411 25800
2638 1 6 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.442 0.159 25800
2639 1 6 . 1 1 25 25 GLU H H 25 8.580 8.580 8.657 -0.077 25800
2640 1 6 . 1 1 26 26 ASN N N 26 114.800 114.800 116.132 -1.332 25800
2641 1 6 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.524 -0.204 25800
2642 1 6 . 1 1 26 26 ASN C C 26 177.400 177.400 177.592 -0.192 25800
2643 1 6 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.539 0.360 25800
2644 1 6 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.473 -0.573 25800
2645 1 6 . 1 1 26 26 ASN H H 26 8.180 8.180 7.835 0.345 25800
2646 1 6 . 1 1 27 27 GLU N N 27 118.900 118.900 120.647 -1.747 25800
2647 1 6 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.098 0.042 25800
2648 1 6 . 1 1 27 27 GLU C C 27 176.400 176.400 178.824 -2.424 25800
2649 1 6 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.826 -1.426 25800
2650 1 6 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.668 -0.268 25800
2651 1 6 . 1 1 27 27 GLU H H 27 7.340 7.340 7.898 -0.558 25800
2652 1 6 . 1 1 28 28 PHE N N 28 114.100 114.100 118.063 -3.963 25800
2653 1 6 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.557 -0.007 25800
2654 1 6 . 1 1 28 28 PHE C C 28 176.300 176.300 178.230 -1.930 25800
2655 1 6 . 1 1 28 28 PHE CA C 28 60.000 60.000 59.521 0.479 25800
2656 1 6 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.458 2.342 25800
2657 1 6 . 1 1 28 28 PHE H H 28 7.660 7.660 8.343 -0.683 25800
2658 1 6 . 1 1 29 29 ARG N N 29 121.700 121.700 120.364 1.336 25800
2659 1 6 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.222 0.188 25800
2660 1 6 . 1 1 29 29 ARG C C 29 177.100 177.100 177.318 -0.218 25800
2661 1 6 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.678 -0.478 25800
2662 1 6 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.856 -0.556 25800
2663 1 6 . 1 1 29 29 ARG H H 29 8.120 8.120 7.901 0.219 25800
2664 1 6 . 1 1 30 30 LYS N N 30 117.200 117.200 118.742 -1.542 25800
2665 1 6 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.085 -0.255 25800
2666 1 6 . 1 1 30 30 LYS C C 30 177.100 177.100 178.141 -1.041 25800
2667 1 6 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.755 -0.955 25800
2668 1 6 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.632 -1.532 25800
2669 1 6 . 1 1 30 30 LYS H H 30 7.630 7.630 7.634 -0.004 25800
2670 1 6 . 1 1 31 31 TYR N N 31 117.100 117.100 116.099 1.001 25800
2671 1 6 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.555 -0.405 25800
2672 1 6 . 1 1 31 31 TYR C C 31 174.400 174.400 176.137 -1.737 25800
2673 1 6 . 1 1 31 31 TYR CA C 31 59.900 59.900 58.623 1.277 25800
2674 1 6 . 1 1 31 31 TYR CB C 31 37.900 37.900 40.140 -2.240 25800
2675 1 6 . 1 1 31 31 TYR H H 31 7.410 7.410 8.079 -0.669 25800
2676 1 6 . 1 1 32 32 GLY N N 32 104.100 104.100 103.958 0.142 25800
2677 1 6 . 1 1 32 32 GLY C C 32 177.000 177.000 172.585 4.415 25800
2678 1 6 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.137 -0.637 25800
2679 1 6 . 1 1 32 32 GLY H H 32 7.240 7.240 7.470 -0.230 25800
2680 1 6 . 1 1 33 33 ASN N N 33 115.300 115.300 120.933 -5.633 25800
2681 1 6 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.592 -0.152 25800
2682 1 6 . 1 1 33 33 ASN C C 33 175.500 175.500 175.428 0.072 25800
2683 1 6 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.217 1.083 25800
2684 1 6 . 1 1 33 33 ASN CB C 33 38.400 38.400 37.620 0.780 25800
2685 1 6 . 1 1 33 33 ASN H H 33 8.460 8.460 8.931 -0.471 25800
2686 1 6 . 1 1 34 34 ILE N N 34 126.700 126.700 123.680 3.020 25800
2687 1 6 . 1 1 34 34 ILE HA H 34 3.790 3.790 3.974 -0.184 25800
2688 1 6 . 1 1 34 34 ILE C C 34 175.600 175.600 176.091 -0.491 25800
2689 1 6 . 1 1 34 34 ILE CA C 34 61.300 61.300 62.288 -0.988 25800
2690 1 6 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.321 1.679 25800
2691 1 6 . 1 1 34 34 ILE H H 34 8.050 8.050 7.826 0.224 25800
2692 1 6 . 1 1 35 35 LEU N N 35 127.400 127.400 129.048 -1.648 25800
2693 1 6 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.378 -0.218 25800
2694 1 6 . 1 1 35 35 LEU C C 35 177.200 177.200 176.711 0.489 25800
2695 1 6 . 1 1 35 35 LEU CA C 35 55.500 55.500 56.040 -0.540 25800
2696 1 6 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.962 -0.262 25800
2697 1 6 . 1 1 35 35 LEU H H 35 8.780 8.780 8.915 -0.135 25800
2698 1 6 . 1 1 36 36 LYS N N 36 117.000 117.000 117.623 -0.623 25800
2699 1 6 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.602 -0.362 25800
2700 1 6 . 1 1 36 36 LYS C C 36 173.600 173.600 173.937 -0.337 25800
2701 1 6 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.620 0.280 25800
2702 1 6 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.474 1.126 25800
2703 1 6 . 1 1 36 36 LYS H H 36 7.110 7.110 7.687 -0.577 25800
2704 1 6 . 1 1 37 37 CYS N N 37 125.400 125.400 120.150 5.250 25800
2705 1 6 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.832 -1.132 25800
2706 1 6 . 1 1 37 37 CYS C C 37 171.600 171.600 172.945 -1.345 25800
2707 1 6 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.652 1.248 25800
2708 1 6 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.850 -4.750 25800
2709 1 6 . 1 1 37 37 CYS H H 37 8.610 8.610 8.633 -0.023 25800
2710 1 6 . 1 1 38 38 ASP N N 38 128.200 128.200 121.308 6.892 25800
2711 1 6 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.189 -0.239 25800
2712 1 6 . 1 1 38 38 ASP C C 38 174.300 174.300 174.439 -0.139 25800
2713 1 6 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.979 -0.779 25800
2714 1 6 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.992 -1.692 25800
2715 1 6 . 1 1 38 38 ASP H H 38 8.290 8.290 8.517 -0.227 25800
2716 1 6 . 1 1 39 39 VAL N N 39 123.500 123.500 119.681 3.819 25800
2717 1 6 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.924 -0.624 25800
2718 1 6 . 1 1 39 39 VAL C C 39 175.000 175.000 175.376 -0.376 25800
2719 1 6 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.070 0.630 25800
2720 1 6 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.119 -1.019 25800
2721 1 6 . 1 1 39 39 VAL H H 39 8.380 8.380 8.699 -0.319 25800
2722 1 6 . 1 1 40 40 LYS N N 40 129.100 129.100 125.633 3.467 25800
2723 1 6 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.955 -0.635 25800
2724 1 6 . 1 1 40 40 LYS C C 40 173.700 173.700 174.568 -0.868 25800
2725 1 6 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.375 -0.475 25800
2726 1 6 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.964 -0.464 25800
2727 1 6 . 1 1 40 40 LYS H H 40 8.680 8.680 9.233 -0.553 25800
2728 1 6 . 1 1 41 41 LYS N N 41 117.300 117.300 121.090 -3.790 25800
2729 1 6 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.530 -0.550 25800
2730 1 6 . 1 1 41 41 LYS C C 41 177.800 177.800 175.691 2.109 25800
2731 1 6 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.638 -0.038 25800
2732 1 6 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.590 -0.590 25800
2733 1 6 . 1 1 41 41 LYS H H 41 7.900 7.900 8.396 -0.496 25800
2734 1 6 . 1 1 42 42 THR N N 42 113.200 113.200 113.610 -0.410 25800
2735 1 6 . 1 1 42 42 THR HA H 42 4.680 4.680 4.742 -0.062 25800
2736 1 6 . 1 1 42 42 THR C C 42 176.900 176.900 176.488 0.412 25800
2737 1 6 . 1 1 42 42 THR CA C 42 60.200 60.200 60.674 -0.474 25800
2738 1 6 . 1 1 42 42 THR CB C 42 71.600 71.600 69.798 1.802 25800
2739 1 6 . 1 1 42 42 THR H H 42 8.730 8.730 8.593 0.137 25800
2740 1 6 . 1 1 43 43 VAL N N 43 120.000 120.000 118.372 1.628 25800
2741 1 6 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.006 -0.086 25800
2742 1 6 . 1 1 43 43 VAL C C 43 177.000 177.000 176.815 0.185 25800
2743 1 6 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.479 0.221 25800
2744 1 6 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.591 0.209 25800
2745 1 6 . 1 1 43 43 VAL H H 43 8.730 8.730 8.483 0.247 25800
2746 1 6 . 1 1 44 44 SER N N 44 113.400 113.400 115.715 -2.315 25800
2747 1 6 . 1 1 44 44 SER HA H 44 4.360 4.360 4.376 -0.016 25800
2748 1 6 . 1 1 44 44 SER C C 44 174.800 174.800 175.439 -0.639 25800
2749 1 6 . 1 1 44 44 SER CA C 44 58.400 58.400 58.473 -0.073 25800
2750 1 6 . 1 1 44 44 SER CB C 44 63.500 63.500 63.296 0.204 25800
2751 1 6 . 1 1 44 44 SER H H 44 7.760 7.760 8.016 -0.256 25800
2752 1 6 . 1 1 45 45 GLY N N 45 110.200 110.200 108.863 1.337 25800
2753 1 6 . 1 1 45 45 GLY C C 45 173.500 173.500 173.968 -0.468 25800
2754 1 6 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.069 0.231 25800
2755 1 6 . 1 1 45 45 GLY H H 45 7.820 7.820 7.776 0.044 25800
2756 1 6 . 1 1 46 46 ALA N N 46 123.900 123.900 123.021 0.879 25800
2757 1 6 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.359 0.031 25800
2758 1 6 . 1 1 46 46 ALA C C 46 176.100 176.100 175.587 0.513 25800
2759 1 6 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.729 0.171 25800
2760 1 6 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.960 -0.160 25800
2761 1 6 . 1 1 46 46 ALA H H 46 7.440 7.440 7.515 -0.075 25800
2762 1 6 . 1 1 47 47 ALA N N 47 123.100 123.100 124.569 -1.469 25800
2763 1 6 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.249 -0.049 25800
2764 1 6 . 1 1 47 47 ALA C C 47 176.100 176.100 175.555 0.545 25800
2765 1 6 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.238 0.662 25800
2766 1 6 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.742 0.158 25800
2767 1 6 . 1 1 47 47 ALA H H 47 8.350 8.350 8.000 0.350 25800
2768 1 6 . 1 1 48 48 PHE N N 48 118.700 118.700 119.601 -0.901 25800
2769 1 6 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.299 -0.269 25800
2770 1 6 . 1 1 48 48 PHE C C 48 171.600 171.600 174.118 -2.518 25800
2771 1 6 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.831 -1.131 25800
2772 1 6 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.605 -2.405 25800
2773 1 6 . 1 1 48 48 PHE H H 48 8.550 8.550 9.006 -0.456 25800
2774 1 6 . 1 1 49 49 ALA N N 49 120.400 120.400 124.684 -4.284 25800
2775 1 6 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.420 -0.090 25800
2776 1 6 . 1 1 49 49 ALA C C 49 175.500 175.500 175.173 0.327 25800
2777 1 6 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.060 -0.760 25800
2778 1 6 . 1 1 49 49 ALA CB C 49 23.700 23.700 22.188 1.512 25800
2779 1 6 . 1 1 49 49 ALA H H 49 9.240 9.240 8.217 1.023 25800
2780 1 6 . 1 1 50 50 PHE N N 50 115.000 115.000 119.014 -4.014 25800
2781 1 6 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.672 -0.072 25800
2782 1 6 . 1 1 50 50 PHE C C 50 176.000 176.000 174.417 1.583 25800
2783 1 6 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.358 0.142 25800
2784 1 6 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.375 -1.175 25800
2785 1 6 . 1 1 50 50 PHE H H 50 7.920 7.920 8.811 -0.891 25800
2786 1 6 . 1 1 51 51 ILE N N 51 123.000 123.000 122.128 0.872 25800
2787 1 6 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.661 -0.211 25800
2788 1 6 . 1 1 51 51 ILE C C 51 173.700 173.700 174.320 -0.620 25800
2789 1 6 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.712 -0.512 25800
2790 1 6 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.722 -0.022 25800
2791 1 6 . 1 1 51 51 ILE H H 51 8.490 8.490 8.898 -0.408 25800
2792 1 6 . 1 1 52 52 GLU N N 52 126.600 126.600 127.133 -0.533 25800
2793 1 6 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.753 0.017 25800
2794 1 6 . 1 1 52 52 GLU C C 52 175.300 175.300 175.501 -0.201 25800
2795 1 6 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.997 -1.297 25800
2796 1 6 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.543 -0.043 25800
2797 1 6 . 1 1 52 52 GLU H H 52 8.610 8.610 9.017 -0.407 25800
2798 1 6 . 1 1 53 53 PHE N N 53 126.100 126.100 125.700 0.400 25800
2799 1 6 . 1 1 53 53 PHE HA H 53 4.800 4.800 4.754 0.046 25800
2800 1 6 . 1 1 53 53 PHE C C 53 175.400 175.400 175.001 0.399 25800
2801 1 6 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.035 2.166 25800
2802 1 6 . 1 1 53 53 PHE CB C 53 40.900 40.900 40.309 0.591 25800
2803 1 6 . 1 1 53 53 PHE H H 53 8.800 8.800 8.963 -0.163 25800
2804 1 6 . 1 1 54 54 GLU N N 54 120.700 120.700 120.785 -0.085 25800
2805 1 6 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.206 -0.276 25800
2806 1 6 . 1 1 54 54 GLU C C 54 175.300 175.300 175.839 -0.539 25800
2807 1 6 . 1 1 54 54 GLU CA C 54 59.100 59.100 58.249 0.851 25800
2808 1 6 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.645 0.155 25800
2809 1 6 . 1 1 54 54 GLU H H 54 8.160 8.160 8.670 -0.510 25800
2810 1 6 . 1 1 55 55 ASP N N 55 117.900 117.900 117.701 0.199 25800
2811 1 6 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.797 0.123 25800
2812 1 6 . 1 1 55 55 ASP C C 55 176.400 176.400 175.477 0.923 25800
2813 1 6 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.025 -0.625 25800
2814 1 6 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.022 2.378 25800
2815 1 6 . 1 1 55 55 ASP H H 55 8.740 8.740 8.003 0.737 25800
2816 1 6 . 1 1 56 56 ALA N N 56 128.900 128.900 126.666 2.234 25800
2817 1 6 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.343 -0.513 25800
2818 1 6 . 1 1 56 56 ALA C C 56 179.800 179.800 179.669 0.131 25800
2819 1 6 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.187 0.013 25800
2820 1 6 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.161 -0.261 25800
2821 1 6 . 1 1 56 56 ALA H H 56 8.800 8.800 8.915 -0.115 25800
2822 1 6 . 1 1 57 57 ARG N N 57 119.200 119.200 117.913 1.287 25800
2823 1 6 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.114 -0.224 25800
2824 1 6 . 1 1 57 57 ARG C C 57 178.000 178.000 178.455 -0.455 25800
2825 1 6 . 1 1 57 57 ARG CA C 57 58.900 58.900 59.339 -0.439 25800
2826 1 6 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.493 -0.193 25800
2827 1 6 . 1 1 57 57 ARG H H 57 8.950 8.950 8.496 0.454 25800
2828 1 6 . 1 1 58 58 ASP N N 58 120.900 120.900 118.081 2.819 25800
2829 1 6 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.542 -0.452 25800
2830 1 6 . 1 1 58 58 ASP C C 58 176.700 176.700 177.802 -1.102 25800
2831 1 6 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.424 0.076 25800
2832 1 6 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.665 -0.765 25800
2833 1 6 . 1 1 58 58 ASP H H 58 7.020 7.020 8.026 -1.006 25800
2834 1 6 . 1 1 59 59 ALA N N 59 119.700 119.700 122.263 -2.563 25800
2835 1 6 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.227 -1.147 25800
2836 1 6 . 1 1 59 59 ALA C C 59 178.100 178.100 179.606 -1.506 25800
2837 1 6 . 1 1 59 59 ALA CA C 59 54.300 54.300 55.053 -0.753 25800
2838 1 6 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.933 -0.533 25800
2839 1 6 . 1 1 59 59 ALA H H 59 6.440 6.440 7.782 -1.342 25800
2840 1 6 . 1 1 60 60 ALA N N 60 117.600 117.600 120.353 -2.753 25800
2841 1 6 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.087 -0.257 25800
2842 1 6 . 1 1 60 60 ALA C C 60 180.900 180.900 179.138 1.762 25800
2843 1 6 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.347 -0.447 25800
2844 1 6 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.300 -0.600 25800
2845 1 6 . 1 1 60 60 ALA H H 60 7.330 7.330 8.379 -1.049 25800
2846 1 6 . 1 1 61 61 ASP N N 61 120.100 120.100 118.234 1.866 25800
2847 1 6 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.470 -0.260 25800
2848 1 6 . 1 1 61 61 ASP C C 61 176.700 176.700 177.209 -0.509 25800
2849 1 6 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.607 0.493 25800
2850 1 6 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.312 -0.212 25800
2851 1 6 . 1 1 61 61 ASP H H 61 7.590 7.590 8.030 -0.440 25800
2852 1 6 . 1 1 62 62 ALA N N 62 122.200 122.200 121.146 1.054 25800
2853 1 6 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.223 -1.803 25800
2854 1 6 . 1 1 62 62 ALA C C 62 179.300 179.300 179.756 -0.456 25800
2855 1 6 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.755 0.845 25800
2856 1 6 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.820 0.280 25800
2857 1 6 . 1 1 62 62 ALA H H 62 7.440 7.440 7.402 0.038 25800
2858 1 6 . 1 1 63 63 ILE N N 63 116.700 116.700 120.432 -3.732 25800
2859 1 6 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.206 -0.966 25800
2860 1 6 . 1 1 63 63 ILE C C 63 177.800 177.800 177.640 0.160 25800
2861 1 6 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.297 2.303 25800
2862 1 6 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.051 0.849 25800
2863 1 6 . 1 1 63 63 ILE H H 63 7.540 7.540 8.368 -0.828 25800
2864 1 6 . 1 1 64 64 LYS N N 64 117.400 117.400 119.352 -1.952 25800
2865 1 6 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.159 -0.259 25800
2866 1 6 . 1 1 64 64 LYS C C 64 178.900 178.900 177.437 1.463 25800
2867 1 6 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.407 0.393 25800
2868 1 6 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.425 1.175 25800
2869 1 6 . 1 1 64 64 LYS H H 64 7.490 7.490 8.294 -0.804 25800
2870 1 6 . 1 1 65 65 GLU N N 65 113.800 113.800 116.435 -2.635 25800
2871 1 6 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.427 -0.267 25800
2872 1 6 . 1 1 65 65 GLU C C 65 178.300 178.300 177.279 1.021 25800
2873 1 6 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.525 0.775 25800
2874 1 6 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.455 1.245 25800
2875 1 6 . 1 1 65 65 GLU H H 65 7.960 7.960 7.836 0.124 25800
2876 1 6 . 1 1 66 66 LYS N N 66 114.700 114.700 118.484 -3.784 25800
2877 1 6 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.537 -0.067 25800
2878 1 6 . 1 1 66 66 LYS C C 66 177.500 177.500 176.068 1.432 25800
2879 1 6 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.196 -0.796 25800
2880 1 6 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.328 0.673 25800
2881 1 6 . 1 1 66 66 LYS H H 66 8.050 8.050 7.840 0.210 25800
2882 1 6 . 1 1 67 67 ASP N N 67 118.800 118.800 119.576 -0.776 25800
2883 1 6 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.480 -0.260 25800
2884 1 6 . 1 1 67 67 ASP C C 67 177.700 177.700 177.973 -0.273 25800
2885 1 6 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.358 4.042 25800
2886 1 6 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.104 0.296 25800
2887 1 6 . 1 1 67 67 ASP H H 67 7.620 7.620 7.380 0.240 25800
2888 1 6 . 1 1 68 68 GLY N N 68 115.600 115.600 108.018 7.582 25800
2889 1 6 . 1 1 68 68 GLY C C 68 173.800 173.800 174.763 -0.963 25800
2890 1 6 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.893 1.007 25800
2891 1 6 . 1 1 68 68 GLY H H 68 8.470 8.470 8.551 -0.081 25800
2892 1 6 . 1 1 69 69 CYS N N 69 119.200 119.200 119.685 -0.485 25800
2893 1 6 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.718 -0.557 25800
2894 1 6 . 1 1 69 69 CYS C C 69 172.600 172.600 173.763 -1.163 25800
2895 1 6 . 1 1 69 69 CYS CA C 69 58.000 58.000 58.080 -0.080 25800
2896 1 6 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.067 -0.367 25800
2897 1 6 . 1 1 69 69 CYS H H 69 7.890 7.890 8.008 -0.118 25800
2898 1 6 . 1 1 70 70 ASP N N 70 122.200 122.200 124.035 -1.835 25800
2899 1 6 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.399 0.431 25800
2900 1 6 . 1 1 70 70 ASP C C 70 176.400 176.400 174.069 2.331 25800
2901 1 6 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.457 1.243 25800
2902 1 6 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.020 -1.320 25800
2903 1 6 . 1 1 70 70 ASP H H 70 8.360 8.360 8.786 -0.426 25800
2904 1 6 . 1 1 71 71 PHE N N 71 127.600 127.600 120.148 7.452 25800
2905 1 6 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.317 -0.717 25800
2906 1 6 . 1 1 71 71 PHE C C 71 173.600 173.600 175.414 -1.814 25800
2907 1 6 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.837 -0.037 25800
2908 1 6 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.005 -0.305 25800
2909 1 6 . 1 1 71 71 PHE H H 71 9.390 9.390 7.611 1.779 25800
2910 1 6 . 1 1 72 72 GLU N N 72 123.900 123.900 118.635 5.265 25800
2911 1 6 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.169 -0.629 25800
2912 1 6 . 1 1 72 72 GLU C C 72 175.500 175.500 176.161 -0.661 25800
2913 1 6 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.213 -0.513 25800
2914 1 6 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.219 -0.919 25800
2915 1 6 . 1 1 72 72 GLU H H 72 8.940 8.940 9.444 -0.504 25800
2916 1 6 . 1 1 73 73 GLY N N 73 105.200 105.200 104.151 1.049 25800
2917 1 6 . 1 1 73 73 GLY C C 73 174.100 174.100 173.755 0.345 25800
2918 1 6 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.167 0.433 25800
2919 1 6 . 1 1 73 73 GLY H H 73 8.350 8.350 8.201 0.149 25800
2920 1 6 . 1 1 74 74 ASN N N 74 121.000 121.000 119.079 1.921 25800
2921 1 6 . 1 1 74 74 ASN HA H 74 4.760 4.760 5.003 -0.243 25800
2922 1 6 . 1 1 74 74 ASN C C 74 174.000 174.000 173.619 0.381 25800
2923 1 6 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.431 -1.530 25800
2924 1 6 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.582 -0.882 25800
2925 1 6 . 1 1 74 74 ASN H H 74 7.740 7.740 7.898 -0.158 25800
2926 1 6 . 1 1 75 75 LYS N N 75 121.400 121.400 121.265 0.135 25800
2927 1 6 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.570 -0.100 25800
2928 1 6 . 1 1 75 75 LYS C C 75 176.900 176.900 174.428 2.472 25800
2929 1 6 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.689 -0.389 25800
2930 1 6 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.023 -0.123 25800
2931 1 6 . 1 1 75 75 LYS H H 75 8.380 8.380 8.660 -0.280 25800
2932 1 6 . 1 1 76 76 LEU N N 76 127.400 127.400 121.292 6.108 25800
2933 1 6 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.535 -0.105 25800
2934 1 6 . 1 1 76 76 LEU C C 76 177.600 177.600 174.143 3.457 25800
2935 1 6 . 1 1 76 76 LEU CA C 76 55.300 55.300 54.986 0.314 25800
2936 1 6 . 1 1 76 76 LEU CB C 76 43.100 43.100 45.128 -2.028 25800
2937 1 6 . 1 1 76 76 LEU H H 76 8.950 8.950 8.292 0.658 25800
2938 1 6 . 1 1 77 77 ARG N N 77 121.800 121.800 126.436 -4.636 25800
2939 1 6 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.755 0.145 25800
2940 1 6 . 1 1 77 77 ARG C C 77 174.700 174.700 174.269 0.431 25800
2941 1 6 . 1 1 77 77 ARG CA C 77 54.000 54.000 54.470 -0.470 25800
2942 1 6 . 1 1 77 77 ARG CB C 77 32.300 32.300 31.245 1.055 25800
2943 1 6 . 1 1 77 77 ARG H H 77 7.530 7.530 8.434 -0.904 25800
2944 1 6 . 1 1 78 78 VAL N N 78 127.000 127.000 127.281 -0.281 25800
2945 1 6 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.071 1.209 25800
2946 1 6 . 1 1 78 78 VAL C C 78 174.200 174.200 175.197 -0.997 25800
2947 1 6 . 1 1 78 78 VAL CA C 78 61.200 61.200 63.288 -2.088 25800
2948 1 6 . 1 1 78 78 VAL CB C 78 33.400 33.400 32.272 1.128 25800
2949 1 6 . 1 1 78 78 VAL H H 78 9.660 9.660 8.723 0.937 25800
2950 1 6 . 1 1 79 79 GLU N N 79 121.900 121.900 128.145 -6.245 25800
2951 1 6 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.591 0.119 25800
2952 1 6 . 1 1 79 79 GLU C C 79 174.600 174.600 174.169 0.431 25800
2953 1 6 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.545 -1.645 25800
2954 1 6 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.273 0.127 25800
2955 1 6 . 1 1 79 79 GLU H H 79 8.980 8.980 8.300 0.680 25800
2956 1 6 . 1 1 80 80 VAL N N 80 121.300 121.300 124.981 -3.681 25800
2957 1 6 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.228 0.142 25800
2958 1 6 . 1 1 80 80 VAL CA C 80 61.000 61.000 59.344 1.656 25800
2959 1 6 . 1 1 80 80 VAL CB C 80 32.100 32.100 32.394 -0.294 25800
2960 1 6 . 1 1 80 80 VAL H H 80 8.410 8.410 8.488 -0.078 25800
2961 1 6 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.432 -0.172 25800
2962 1 6 . 1 1 81 81 PRO C C 81 176.100 176.100 176.930 -0.830 25800
2963 1 6 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.269 -1.169 25800
2964 1 6 . 1 1 81 81 PRO CB C 81 32.100 32.100 32.103 -0.003 25800
2965 1 6 . 1 1 82 82 PHE N N 82 122.200 122.200 115.437 6.763 25800
2966 1 6 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.718 -0.428 25800
2967 1 6 . 1 1 82 82 PHE C C 82 175.300 175.300 175.539 -0.239 25800
2968 1 6 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.175 2.925 25800
2969 1 6 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.535 1.865 25800
2970 1 6 . 1 1 82 82 PHE H H 82 8.150 8.150 7.767 0.383 25800
2971 1 6 . 1 1 83 83 ASN N N 83 120.800 120.800 121.482 -0.682 25800
2972 1 6 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.431 0.009 25800
2973 1 6 . 1 1 83 83 ASN C C 83 174.100 174.100 174.597 -0.497 25800
2974 1 6 . 1 1 83 83 ASN CA C 83 52.700 52.700 52.464 0.236 25800
2975 1 6 . 1 1 83 83 ASN CB C 83 38.700 38.700 36.317 2.383 25800
2976 1 6 . 1 1 83 83 ASN H H 83 8.110 8.110 8.470 -0.360 25800
2977 1 6 . 1 1 84 84 ALA N N 84 123.700 123.700 122.178 1.522 25800
2978 1 6 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.670 -0.590 25800
2979 1 6 . 1 1 84 84 ALA C C 84 177.100 177.100 176.126 0.974 25800
2980 1 6 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.146 0.254 25800
2981 1 6 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.768 -1.668 25800
2982 1 6 . 1 1 84 84 ALA H H 84 8.020 8.020 7.607 0.413 25800
2983 1 6 . 1 1 85 85 ARG N N 85 120.200 120.200 119.587 0.613 25800
2984 1 6 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.457 -0.307 25800
2985 1 6 . 1 1 85 85 ARG C C 85 175.200 175.200 175.145 0.055 25800
2986 1 6 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.293 -0.293 25800
2987 1 6 . 1 1 85 85 ARG CB C 85 30.800 30.800 31.572 -0.772 25800
2988 1 6 . 1 1 85 85 ARG H H 85 8.040 8.040 8.550 -0.510 25800
2989 1 7 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.862 -0.272 25800
2990 1 7 . 1 1 0 0 HIS C C 0 174.000 174.000 173.221 0.779 25800
2991 1 7 . 1 1 0 0 HIS CA C 0 55.300 55.300 55.369 -0.069 25800
2992 1 7 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.513 -1.213 25800
2993 1 7 . 1 1 1 1 MET N N 1 122.400 122.400 120.744 1.656 25800
2994 1 7 . 1 1 1 1 MET HA H 1 4.340 4.340 4.762 -0.422 25800
2995 1 7 . 1 1 1 1 MET C C 1 175.600 175.600 174.183 1.417 25800
2996 1 7 . 1 1 1 1 MET CA C 1 55.600 55.600 54.858 0.742 25800
2997 1 7 . 1 1 1 1 MET CB C 1 32.800 32.800 34.294 -1.494 25800
2998 1 7 . 1 1 1 1 MET H H 1 8.310 8.310 8.215 0.095 25800
2999 1 7 . 1 1 2 2 VAL N N 2 123.200 123.200 120.576 2.624 25800
3000 1 7 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.599 -0.639 25800
3001 1 7 . 1 1 2 2 VAL C C 2 175.600 175.600 175.043 0.557 25800
3002 1 7 . 1 1 2 2 VAL CA C 2 62.300 62.300 60.948 1.352 25800
3003 1 7 . 1 1 2 2 VAL CB C 2 32.300 32.300 34.414 -2.114 25800
3004 1 7 . 1 1 2 2 VAL H H 2 8.180 8.180 8.274 -0.094 25800
3005 1 7 . 1 1 3 3 ILE N N 3 126.200 126.200 121.738 4.462 25800
3006 1 7 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.230 -0.180 25800
3007 1 7 . 1 1 3 3 ILE C C 3 175.800 175.800 175.207 0.593 25800
3008 1 7 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.733 -1.033 25800
3009 1 7 . 1 1 3 3 ILE CB C 3 38.300 38.300 38.482 -0.182 25800
3010 1 7 . 1 1 3 3 ILE H H 3 8.230 8.230 8.162 0.068 25800
3011 1 7 . 1 1 4 4 ARG N N 4 126.100 126.100 124.964 1.136 25800
3012 1 7 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.576 -0.396 25800
3013 1 7 . 1 1 4 4 ARG C C 4 175.900 175.900 176.038 -0.138 25800
3014 1 7 . 1 1 4 4 ARG CA C 4 56.000 56.000 55.585 0.415 25800
3015 1 7 . 1 1 4 4 ARG CB C 4 30.700 30.700 32.065 -1.365 25800
3016 1 7 . 1 1 4 4 ARG H H 4 8.360 8.360 8.256 0.104 25800
3017 1 7 . 1 1 5 5 GLU N N 5 122.200 122.200 120.321 1.879 25800
3018 1 7 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.091 0.049 25800
3019 1 7 . 1 1 5 5 GLU C C 5 176.100 176.100 175.407 0.693 25800
3020 1 7 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.220 -0.620 25800
3021 1 7 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.271 1.029 25800
3022 1 7 . 1 1 5 5 GLU H H 5 8.400 8.400 8.733 -0.333 25800
3023 1 7 . 1 1 6 6 SER N N 6 116.200 116.200 111.334 4.866 25800
3024 1 7 . 1 1 6 6 SER HA H 6 4.350 4.350 4.717 -0.367 25800
3025 1 7 . 1 1 6 6 SER C C 6 174.300 174.300 172.867 1.433 25800
3026 1 7 . 1 1 6 6 SER CA C 6 58.200 58.200 57.312 0.888 25800
3027 1 7 . 1 1 6 6 SER CB C 6 63.800 63.800 64.892 -1.092 25800
3028 1 7 . 1 1 6 6 SER H H 6 8.270 8.270 7.618 0.652 25800
3029 1 7 . 1 1 7 7 VAL N N 7 119.800 119.800 119.812 -0.012 25800
3030 1 7 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.407 -0.107 25800
3031 1 7 . 1 1 7 7 VAL C C 7 175.500 175.500 174.410 1.090 25800
3032 1 7 . 1 1 7 7 VAL CA C 7 61.700 61.700 62.025 -0.325 25800
3033 1 7 . 1 1 7 7 VAL CB C 7 32.800 32.800 34.300 -1.500 25800
3034 1 7 . 1 1 7 7 VAL H H 7 7.840 7.840 8.556 -0.716 25800
3035 1 7 . 1 1 8 8 SER N N 8 117.800 117.800 114.480 3.320 25800
3036 1 7 . 1 1 8 8 SER HA H 8 4.240 4.240 4.756 -0.516 25800
3037 1 7 . 1 1 8 8 SER C C 8 172.500 172.500 172.062 0.438 25800
3038 1 7 . 1 1 8 8 SER CA C 8 58.500 58.500 58.433 0.067 25800
3039 1 7 . 1 1 8 8 SER CB C 8 63.600 63.600 63.926 -0.326 25800
3040 1 7 . 1 1 8 8 SER H H 8 8.530 8.530 7.850 0.680 25800
3041 1 7 . 1 1 9 9 ARG N N 9 123.000 123.000 127.187 -4.187 25800
3042 1 7 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.206 0.294 25800
3043 1 7 . 1 1 9 9 ARG C C 9 175.000 175.000 174.995 0.005 25800
3044 1 7 . 1 1 9 9 ARG CA C 9 54.300 54.300 55.749 -1.449 25800
3045 1 7 . 1 1 9 9 ARG CB C 9 33.400 33.400 34.071 -0.670 25800
3046 1 7 . 1 1 9 9 ARG H H 9 7.350 7.350 8.778 -1.428 25800
3047 1 7 . 1 1 10 10 ILE N N 10 114.000 114.000 124.191 -10.191 25800
3048 1 7 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.358 0.462 25800
3049 1 7 . 1 1 10 10 ILE C C 10 173.000 173.000 174.750 -1.750 25800
3050 1 7 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.077 -1.677 25800
3051 1 7 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.674 2.226 25800
3052 1 7 . 1 1 10 10 ILE H H 10 8.830 8.830 9.068 -0.238 25800
3053 1 7 . 1 1 11 11 TYR N N 11 123.400 123.400 127.013 -3.613 25800
3054 1 7 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.102 -0.172 25800
3055 1 7 . 1 1 11 11 TYR C C 11 173.000 173.000 173.241 -0.241 25800
3056 1 7 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.830 0.170 25800
3057 1 7 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.845 -0.945 25800
3058 1 7 . 1 1 11 11 TYR H H 11 8.690 8.690 8.009 0.681 25800
3059 1 7 . 1 1 12 12 VAL N N 12 126.300 126.300 126.805 -0.505 25800
3060 1 7 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.453 0.107 25800
3061 1 7 . 1 1 12 12 VAL C C 12 174.100 174.100 174.026 0.074 25800
3062 1 7 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.540 -0.340 25800
3063 1 7 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.879 -1.479 25800
3064 1 7 . 1 1 12 12 VAL H H 12 8.370 8.370 7.754 0.616 25800
3065 1 7 . 1 1 13 13 GLY N N 13 113.000 113.000 111.509 1.491 25800
3066 1 7 . 1 1 13 13 GLY C C 13 173.100 173.100 173.632 -0.532 25800
3067 1 7 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.225 0.075 25800
3068 1 7 . 1 1 13 13 GLY H H 13 9.350 9.350 8.592 0.758 25800
3069 1 7 . 1 1 14 14 ASN N N 14 113.900 113.900 116.708 -2.808 25800
3070 1 7 . 1 1 14 14 ASN HA H 14 4.280 4.280 3.884 0.396 25800
3071 1 7 . 1 1 14 14 ASN C C 14 175.800 175.800 174.990 0.810 25800
3072 1 7 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.151 -0.551 25800
3073 1 7 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.681 1.019 25800
3074 1 7 . 1 1 14 14 ASN H H 14 8.800 8.800 7.480 1.320 25800
3075 1 7 . 1 1 15 15 LEU N N 15 115.800 115.800 117.753 -1.953 25800
3076 1 7 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.565 0.425 25800
3077 1 7 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.888 1.712 25800
3078 1 7 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.542 0.058 25800
3079 1 7 . 1 1 15 15 LEU H H 15 7.150 7.150 7.239 -0.089 25800
3080 1 7 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.611 -0.541 25800
3081 1 7 . 1 1 16 16 PRO C C 16 171.500 171.500 177.479 -5.979 25800
3082 1 7 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.218 0.283 25800
3083 1 7 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.584 -0.584 25800
3084 1 7 . 1 1 17 17 SER N N 17 115.200 115.200 115.862 -0.662 25800
3085 1 7 . 1 1 17 17 SER HA H 17 4.300 4.300 4.274 0.026 25800
3086 1 7 . 1 1 17 17 SER C C 17 174.200 174.200 174.322 -0.122 25800
3087 1 7 . 1 1 17 17 SER CA C 17 58.200 58.200 58.495 -0.295 25800
3088 1 7 . 1 1 17 17 SER CB C 17 63.900 63.900 61.762 2.138 25800
3089 1 7 . 1 1 17 17 SER H H 17 8.470 8.470 8.547 -0.077 25800
3090 1 7 . 1 1 18 18 HIS N N 18 120.800 120.800 121.215 -0.415 25800
3091 1 7 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.466 0.084 25800
3092 1 7 . 1 1 18 18 HIS C C 18 175.100 175.100 175.252 -0.152 25800
3093 1 7 . 1 1 18 18 HIS CA C 18 55.500 55.500 58.045 -2.545 25800
3094 1 7 . 1 1 18 18 HIS CB C 18 29.300 29.300 30.343 -1.043 25800
3095 1 7 . 1 1 18 18 HIS H H 18 8.540 8.540 8.099 0.441 25800
3096 1 7 . 1 1 19 19 VAL N N 19 115.700 115.700 117.820 -2.120 25800
3097 1 7 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.135 0.125 25800
3098 1 7 . 1 1 19 19 VAL C C 19 174.000 174.000 174.208 -0.208 25800
3099 1 7 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.701 0.199 25800
3100 1 7 . 1 1 19 19 VAL CB C 19 32.600 32.600 34.204 -1.604 25800
3101 1 7 . 1 1 19 19 VAL H H 19 6.650 6.650 7.864 -1.214 25800
3102 1 7 . 1 1 20 20 SER N N 20 118.800 118.800 121.942 -3.142 25800
3103 1 7 . 1 1 20 20 SER HA H 20 4.710 4.710 4.877 -0.167 25800
3104 1 7 . 1 1 20 20 SER C C 20 175.900 175.900 175.510 0.390 25800
3105 1 7 . 1 1 20 20 SER CA C 20 55.800 55.800 57.301 -1.501 25800
3106 1 7 . 1 1 20 20 SER CB C 20 66.600 66.600 64.531 2.069 25800
3107 1 7 . 1 1 20 20 SER H H 20 8.930 8.930 8.447 0.483 25800
3108 1 7 . 1 1 21 21 SER N N 21 117.100 117.100 119.000 -1.900 25800
3109 1 7 . 1 1 21 21 SER HA H 21 3.880 3.880 4.057 -0.177 25800
3110 1 7 . 1 1 21 21 SER C C 21 176.200 176.200 176.645 -0.445 25800
3111 1 7 . 1 1 21 21 SER CA C 21 62.300 62.300 61.318 0.982 25800
3112 1 7 . 1 1 21 21 SER CB C 21 66.800 66.800 62.975 3.825 25800
3113 1 7 . 1 1 21 21 SER H H 21 9.080 9.080 8.698 0.382 25800
3114 1 7 . 1 1 22 22 ARG N N 22 121.200 121.200 121.483 -0.283 25800
3115 1 7 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.068 -0.078 25800
3116 1 7 . 1 1 22 22 ARG C C 22 177.900 177.900 177.151 0.749 25800
3117 1 7 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.016 -0.315 25800
3118 1 7 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.356 0.244 25800
3119 1 7 . 1 1 22 22 ARG H H 22 7.940 7.940 8.650 -0.710 25800
3120 1 7 . 1 1 23 23 ASP N N 23 118.800 118.800 117.752 1.048 25800
3121 1 7 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.453 -0.063 25800
3122 1 7 . 1 1 23 23 ASP C C 23 179.200 179.200 178.067 1.133 25800
3123 1 7 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.795 0.505 25800
3124 1 7 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.562 0.438 25800
3125 1 7 . 1 1 23 23 ASP H H 23 7.480 7.480 7.893 -0.413 25800
3126 1 7 . 1 1 24 24 VAL N N 24 119.500 119.500 120.519 -1.019 25800
3127 1 7 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.479 -0.109 25800
3128 1 7 . 1 1 24 24 VAL C C 24 177.500 177.500 177.016 0.484 25800
3129 1 7 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.348 1.552 25800
3130 1 7 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.703 -0.303 25800
3131 1 7 . 1 1 24 24 VAL H H 24 7.450 7.450 8.176 -0.726 25800
3132 1 7 . 1 1 25 25 GLU N N 25 121.400 121.400 118.774 2.626 25800
3133 1 7 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.922 -0.352 25800
3134 1 7 . 1 1 25 25 GLU C C 25 178.400 178.400 177.314 1.086 25800
3135 1 7 . 1 1 25 25 GLU CA C 25 60.600 60.600 59.321 1.279 25800
3136 1 7 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.562 0.038 25800
3137 1 7 . 1 1 25 25 GLU H H 25 8.580 8.580 8.072 0.508 25800
3138 1 7 . 1 1 26 26 ASN N N 26 114.800 114.800 115.228 -0.428 25800
3139 1 7 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.844 -0.524 25800
3140 1 7 . 1 1 26 26 ASN C C 26 177.400 177.400 177.904 -0.504 25800
3141 1 7 . 1 1 26 26 ASN CA C 26 55.900 55.900 54.919 0.981 25800
3142 1 7 . 1 1 26 26 ASN CB C 26 37.900 37.900 39.658 -1.758 25800
3143 1 7 . 1 1 26 26 ASN H H 26 8.180 8.180 7.671 0.509 25800
3144 1 7 . 1 1 27 27 GLU N N 27 118.900 118.900 122.864 -3.964 25800
3145 1 7 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.277 -0.137 25800
3146 1 7 . 1 1 27 27 GLU C C 27 176.400 176.400 179.214 -2.814 25800
3147 1 7 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.975 -1.575 25800
3148 1 7 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.620 -0.220 25800
3149 1 7 . 1 1 27 27 GLU H H 27 7.340 7.340 8.668 -1.328 25800
3150 1 7 . 1 1 28 28 PHE N N 28 114.100 114.100 117.896 -3.796 25800
3151 1 7 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.828 -0.278 25800
3152 1 7 . 1 1 28 28 PHE C C 28 176.300 176.300 177.707 -1.407 25800
3153 1 7 . 1 1 28 28 PHE CA C 28 60.000 60.000 58.370 1.630 25800
3154 1 7 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.455 2.345 25800
3155 1 7 . 1 1 28 28 PHE H H 28 7.660 7.660 7.886 -0.226 25800
3156 1 7 . 1 1 29 29 ARG N N 29 121.700 121.700 118.331 3.369 25800
3157 1 7 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.432 -0.022 25800
3158 1 7 . 1 1 29 29 ARG C C 29 177.100 177.100 177.466 -0.366 25800
3159 1 7 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.615 -0.415 25800
3160 1 7 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.199 -0.899 25800
3161 1 7 . 1 1 29 29 ARG H H 29 8.120 8.120 7.687 0.433 25800
3162 1 7 . 1 1 30 30 LYS N N 30 117.200 117.200 117.729 -0.529 25800
3163 1 7 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.109 -0.279 25800
3164 1 7 . 1 1 30 30 LYS C C 30 177.100 177.100 178.326 -1.226 25800
3165 1 7 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.967 -0.167 25800
3166 1 7 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.011 -0.912 25800
3167 1 7 . 1 1 30 30 LYS H H 30 7.630 7.630 7.710 -0.080 25800
3168 1 7 . 1 1 31 31 TYR N N 31 117.100 117.100 118.195 -1.095 25800
3169 1 7 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.382 -0.232 25800
3170 1 7 . 1 1 31 31 TYR C C 31 174.400 174.400 176.505 -2.105 25800
3171 1 7 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.828 0.072 25800
3172 1 7 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.776 -1.876 25800
3173 1 7 . 1 1 31 31 TYR H H 31 7.410 7.410 7.779 -0.369 25800
3174 1 7 . 1 1 32 32 GLY N N 32 104.100 104.100 104.933 -0.833 25800
3175 1 7 . 1 1 32 32 GLY C C 32 177.000 177.000 172.575 4.425 25800
3176 1 7 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.372 -0.872 25800
3177 1 7 . 1 1 32 32 GLY H H 32 7.240 7.240 8.038 -0.798 25800
3178 1 7 . 1 1 33 33 ASN N N 33 115.300 115.300 120.664 -5.364 25800
3179 1 7 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.898 -0.458 25800
3180 1 7 . 1 1 33 33 ASN C C 33 175.500 175.500 174.801 0.699 25800
3181 1 7 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.900 0.400 25800
3182 1 7 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.021 -0.621 25800
3183 1 7 . 1 1 33 33 ASN H H 33 8.460 8.460 8.947 -0.487 25800
3184 1 7 . 1 1 34 34 ILE N N 34 126.700 126.700 126.092 0.608 25800
3185 1 7 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.092 -0.302 25800
3186 1 7 . 1 1 34 34 ILE C C 34 175.600 175.600 175.597 0.003 25800
3187 1 7 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.963 -0.663 25800
3188 1 7 . 1 1 34 34 ILE CB C 34 40.000 40.000 37.934 2.066 25800
3189 1 7 . 1 1 34 34 ILE H H 34 8.050 8.050 8.224 -0.174 25800
3190 1 7 . 1 1 35 35 LEU N N 35 127.400 127.400 128.831 -1.431 25800
3191 1 7 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.459 -0.299 25800
3192 1 7 . 1 1 35 35 LEU C C 35 177.200 177.200 176.573 0.627 25800
3193 1 7 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.759 -0.259 25800
3194 1 7 . 1 1 35 35 LEU CB C 35 42.700 42.700 43.227 -0.527 25800
3195 1 7 . 1 1 35 35 LEU H H 35 8.780 8.780 8.986 -0.206 25800
3196 1 7 . 1 1 36 36 LYS N N 36 117.000 117.000 118.379 -1.379 25800
3197 1 7 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.557 -0.317 25800
3198 1 7 . 1 1 36 36 LYS C C 36 173.600 173.600 173.756 -0.156 25800
3199 1 7 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.461 0.439 25800
3200 1 7 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.578 1.022 25800
3201 1 7 . 1 1 36 36 LYS H H 36 7.110 7.110 7.505 -0.395 25800
3202 1 7 . 1 1 37 37 CYS N N 37 125.400 125.400 120.546 4.854 25800
3203 1 7 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.751 -1.051 25800
3204 1 7 . 1 1 37 37 CYS C C 37 171.600 171.600 172.955 -1.355 25800
3205 1 7 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.823 1.077 25800
3206 1 7 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.416 -4.316 25800
3207 1 7 . 1 1 37 37 CYS H H 37 8.610 8.610 8.648 -0.038 25800
3208 1 7 . 1 1 38 38 ASP N N 38 128.200 128.200 121.878 6.322 25800
3209 1 7 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.891 0.059 25800
3210 1 7 . 1 1 38 38 ASP C C 38 174.300 174.300 173.593 0.707 25800
3211 1 7 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.881 -0.681 25800
3212 1 7 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.463 -1.163 25800
3213 1 7 . 1 1 38 38 ASP H H 38 8.290 8.290 8.877 -0.587 25800
3214 1 7 . 1 1 39 39 VAL N N 39 123.500 123.500 120.447 3.053 25800
3215 1 7 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.942 -0.642 25800
3216 1 7 . 1 1 39 39 VAL C C 39 175.000 175.000 173.971 1.029 25800
3217 1 7 . 1 1 39 39 VAL CA C 39 61.700 61.700 60.837 0.863 25800
3218 1 7 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.982 -1.882 25800
3219 1 7 . 1 1 39 39 VAL H H 39 8.380 8.380 8.477 -0.097 25800
3220 1 7 . 1 1 40 40 LYS N N 40 129.100 129.100 128.748 0.352 25800
3221 1 7 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.869 -0.549 25800
3222 1 7 . 1 1 40 40 LYS C C 40 173.700 173.700 174.855 -1.155 25800
3223 1 7 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.458 -0.558 25800
3224 1 7 . 1 1 40 40 LYS CB C 40 35.500 35.500 34.328 1.171 25800
3225 1 7 . 1 1 40 40 LYS H H 40 8.680 8.680 9.076 -0.396 25800
3226 1 7 . 1 1 41 41 LYS N N 41 117.300 117.300 120.697 -3.397 25800
3227 1 7 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.479 -0.499 25800
3228 1 7 . 1 1 41 41 LYS C C 41 177.800 177.800 175.602 2.198 25800
3229 1 7 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.687 -0.087 25800
3230 1 7 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.698 -0.698 25800
3231 1 7 . 1 1 41 41 LYS H H 41 7.900 7.900 8.311 -0.411 25800
3232 1 7 . 1 1 42 42 THR N N 42 113.200 113.200 113.429 -0.229 25800
3233 1 7 . 1 1 42 42 THR HA H 42 4.680 4.680 4.764 -0.084 25800
3234 1 7 . 1 1 42 42 THR C C 42 176.900 176.900 176.415 0.485 25800
3235 1 7 . 1 1 42 42 THR CA C 42 60.200 60.200 60.562 -0.362 25800
3236 1 7 . 1 1 42 42 THR CB C 42 71.600 71.600 69.892 1.708 25800
3237 1 7 . 1 1 42 42 THR H H 42 8.730 8.730 8.701 0.029 25800
3238 1 7 . 1 1 43 43 VAL N N 43 120.000 120.000 117.045 2.955 25800
3239 1 7 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.954 -0.034 25800
3240 1 7 . 1 1 43 43 VAL C C 43 177.000 177.000 176.341 0.659 25800
3241 1 7 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.697 0.003 25800
3242 1 7 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.468 0.332 25800
3243 1 7 . 1 1 43 43 VAL H H 43 8.730 8.730 8.464 0.266 25800
3244 1 7 . 1 1 44 44 SER N N 44 113.400 113.400 114.636 -1.236 25800
3245 1 7 . 1 1 44 44 SER HA H 44 4.360 4.360 4.392 -0.032 25800
3246 1 7 . 1 1 44 44 SER C C 44 174.800 174.800 175.322 -0.522 25800
3247 1 7 . 1 1 44 44 SER CA C 44 58.400 58.400 58.412 -0.012 25800
3248 1 7 . 1 1 44 44 SER CB C 44 63.500 63.500 62.969 0.531 25800
3249 1 7 . 1 1 44 44 SER H H 44 7.760 7.760 8.016 -0.256 25800
3250 1 7 . 1 1 45 45 GLY N N 45 110.200 110.200 108.664 1.536 25800
3251 1 7 . 1 1 45 45 GLY C C 45 173.500 173.500 174.179 -0.679 25800
3252 1 7 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.286 0.014 25800
3253 1 7 . 1 1 45 45 GLY H H 45 7.820 7.820 7.879 -0.059 25800
3254 1 7 . 1 1 46 46 ALA N N 46 123.900 123.900 123.277 0.623 25800
3255 1 7 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.338 0.052 25800
3256 1 7 . 1 1 46 46 ALA C C 46 176.100 176.100 175.669 0.431 25800
3257 1 7 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.647 0.253 25800
3258 1 7 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.919 -0.119 25800
3259 1 7 . 1 1 46 46 ALA H H 46 7.440 7.440 7.661 -0.221 25800
3260 1 7 . 1 1 47 47 ALA N N 47 123.100 123.100 125.186 -2.086 25800
3261 1 7 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.256 -0.056 25800
3262 1 7 . 1 1 47 47 ALA C C 47 176.100 176.100 175.596 0.504 25800
3263 1 7 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.154 0.746 25800
3264 1 7 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.729 0.171 25800
3265 1 7 . 1 1 47 47 ALA H H 47 8.350 8.350 8.127 0.223 25800
3266 1 7 . 1 1 48 48 PHE N N 48 118.700 118.700 118.227 0.473 25800
3267 1 7 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.273 -0.243 25800
3268 1 7 . 1 1 48 48 PHE C C 48 171.600 171.600 174.288 -2.688 25800
3269 1 7 . 1 1 48 48 PHE CA C 48 55.700 55.700 57.091 -1.391 25800
3270 1 7 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.286 -2.086 25800
3271 1 7 . 1 1 48 48 PHE H H 48 8.550 8.550 8.903 -0.353 25800
3272 1 7 . 1 1 49 49 ALA N N 49 120.400 120.400 125.586 -5.186 25800
3273 1 7 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.302 0.028 25800
3274 1 7 . 1 1 49 49 ALA C C 49 175.500 175.500 175.591 -0.091 25800
3275 1 7 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.351 -1.051 25800
3276 1 7 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.753 1.947 25800
3277 1 7 . 1 1 49 49 ALA H H 49 9.240 9.240 9.106 0.134 25800
3278 1 7 . 1 1 50 50 PHE N N 50 115.000 115.000 121.603 -6.603 25800
3279 1 7 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.372 0.228 25800
3280 1 7 . 1 1 50 50 PHE C C 50 176.000 176.000 174.219 1.781 25800
3281 1 7 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.618 -0.118 25800
3282 1 7 . 1 1 50 50 PHE CB C 50 42.200 42.200 42.373 -0.173 25800
3283 1 7 . 1 1 50 50 PHE H H 50 7.920 7.920 9.097 -1.177 25800
3284 1 7 . 1 1 51 51 ILE N N 51 123.000 123.000 123.290 -0.290 25800
3285 1 7 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.764 -0.314 25800
3286 1 7 . 1 1 51 51 ILE C C 51 173.700 173.700 174.262 -0.562 25800
3287 1 7 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.564 -0.364 25800
3288 1 7 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.920 -1.220 25800
3289 1 7 . 1 1 51 51 ILE H H 51 8.490 8.490 8.431 0.059 25800
3290 1 7 . 1 1 52 52 GLU N N 52 126.600 126.600 126.889 -0.289 25800
3291 1 7 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.898 -0.128 25800
3292 1 7 . 1 1 52 52 GLU C C 52 175.300 175.300 175.243 0.057 25800
3293 1 7 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.372 -0.672 25800
3294 1 7 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.939 -0.439 25800
3295 1 7 . 1 1 52 52 GLU H H 52 8.610 8.610 9.011 -0.401 25800
3296 1 7 . 1 1 53 53 PHE N N 53 126.100 126.100 125.209 0.891 25800
3297 1 7 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.021 -0.221 25800
3298 1 7 . 1 1 53 53 PHE C C 53 175.400 175.400 175.578 -0.178 25800
3299 1 7 . 1 1 53 53 PHE CA C 53 58.200 58.200 57.190 1.010 25800
3300 1 7 . 1 1 53 53 PHE CB C 53 40.900 40.900 41.389 -0.489 25800
3301 1 7 . 1 1 53 53 PHE H H 53 8.800 8.800 8.878 -0.078 25800
3302 1 7 . 1 1 54 54 GLU N N 54 120.700 120.700 121.037 -0.337 25800
3303 1 7 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.203 -0.273 25800
3304 1 7 . 1 1 54 54 GLU C C 54 175.300 175.300 176.471 -1.171 25800
3305 1 7 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.934 1.166 25800
3306 1 7 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.440 0.360 25800
3307 1 7 . 1 1 54 54 GLU H H 54 8.160 8.160 8.816 -0.656 25800
3308 1 7 . 1 1 55 55 ASP N N 55 117.900 117.900 118.284 -0.384 25800
3309 1 7 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.661 0.259 25800
3310 1 7 . 1 1 55 55 ASP C C 55 176.400 176.400 175.306 1.094 25800
3311 1 7 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.708 -1.308 25800
3312 1 7 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.979 1.421 25800
3313 1 7 . 1 1 55 55 ASP H H 55 8.740 8.740 8.013 0.727 25800
3314 1 7 . 1 1 56 56 ALA N N 56 128.900 128.900 123.535 5.365 25800
3315 1 7 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.273 -0.443 25800
3316 1 7 . 1 1 56 56 ALA C C 56 179.800 179.800 178.780 1.020 25800
3317 1 7 . 1 1 56 56 ALA CA C 56 55.200 55.200 53.690 1.510 25800
3318 1 7 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.795 -0.895 25800
3319 1 7 . 1 1 56 56 ALA H H 56 8.800 8.800 8.351 0.449 25800
3320 1 7 . 1 1 57 57 ARG N N 57 119.200 119.200 119.259 -0.059 25800
3321 1 7 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.103 -0.212 25800
3322 1 7 . 1 1 57 57 ARG C C 57 178.000 178.000 177.918 0.082 25800
3323 1 7 . 1 1 57 57 ARG CA C 57 58.900 58.900 59.372 -0.472 25800
3324 1 7 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.515 -0.214 25800
3325 1 7 . 1 1 57 57 ARG H H 57 8.950 8.950 8.586 0.364 25800
3326 1 7 . 1 1 58 58 ASP N N 58 120.900 120.900 118.837 2.063 25800
3327 1 7 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.531 -0.441 25800
3328 1 7 . 1 1 58 58 ASP C C 58 176.700 176.700 178.411 -1.711 25800
3329 1 7 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.462 0.038 25800
3330 1 7 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.575 -0.675 25800
3331 1 7 . 1 1 58 58 ASP H H 58 7.020 7.020 8.258 -1.238 25800
3332 1 7 . 1 1 59 59 ALA N N 59 119.700 119.700 122.254 -2.554 25800
3333 1 7 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.687 -0.607 25800
3334 1 7 . 1 1 59 59 ALA C C 59 178.100 178.100 179.229 -1.129 25800
3335 1 7 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.124 0.176 25800
3336 1 7 . 1 1 59 59 ALA CB C 59 18.400 18.400 17.424 0.977 25800
3337 1 7 . 1 1 59 59 ALA H H 59 6.440 6.440 7.928 -1.488 25800
3338 1 7 . 1 1 60 60 ALA N N 60 117.600 117.600 120.153 -2.553 25800
3339 1 7 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.077 -0.247 25800
3340 1 7 . 1 1 60 60 ALA C C 60 180.900 180.900 178.458 2.442 25800
3341 1 7 . 1 1 60 60 ALA CA C 60 54.900 54.900 54.416 0.484 25800
3342 1 7 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.328 -0.628 25800
3343 1 7 . 1 1 60 60 ALA H H 60 7.330 7.330 8.149 -0.819 25800
3344 1 7 . 1 1 61 61 ASP N N 61 120.100 120.100 119.794 0.306 25800
3345 1 7 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.424 -0.214 25800
3346 1 7 . 1 1 61 61 ASP C C 61 176.700 176.700 177.456 -0.756 25800
3347 1 7 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.444 0.656 25800
3348 1 7 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.791 -0.691 25800
3349 1 7 . 1 1 61 61 ASP H H 61 7.590 7.590 7.860 -0.270 25800
3350 1 7 . 1 1 62 62 ALA N N 62 122.200 122.200 121.190 1.010 25800
3351 1 7 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.761 -1.341 25800
3352 1 7 . 1 1 62 62 ALA C C 62 179.300 179.300 179.091 0.209 25800
3353 1 7 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.484 0.116 25800
3354 1 7 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.671 0.429 25800
3355 1 7 . 1 1 62 62 ALA H H 62 7.440 7.440 7.433 0.007 25800
3356 1 7 . 1 1 63 63 ILE N N 63 116.700 116.700 118.892 -2.192 25800
3357 1 7 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.678 -0.438 25800
3358 1 7 . 1 1 63 63 ILE C C 63 177.800 177.800 177.580 0.220 25800
3359 1 7 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.372 2.228 25800
3360 1 7 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.645 1.255 25800
3361 1 7 . 1 1 63 63 ILE H H 63 7.540 7.540 7.347 0.193 25800
3362 1 7 . 1 1 64 64 LYS N N 64 117.400 117.400 118.911 -1.511 25800
3363 1 7 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.348 -0.448 25800
3364 1 7 . 1 1 64 64 LYS C C 64 178.900 178.900 177.556 1.344 25800
3365 1 7 . 1 1 64 64 LYS CA C 64 58.800 58.800 57.963 0.837 25800
3366 1 7 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.828 0.772 25800
3367 1 7 . 1 1 64 64 LYS H H 64 7.490 7.490 8.272 -0.782 25800
3368 1 7 . 1 1 65 65 GLU N N 65 113.800 113.800 119.066 -5.266 25800
3369 1 7 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.301 -0.141 25800
3370 1 7 . 1 1 65 65 GLU C C 65 178.300 178.300 177.858 0.442 25800
3371 1 7 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.660 0.640 25800
3372 1 7 . 1 1 65 65 GLU CB C 65 30.700 30.700 30.315 0.385 25800
3373 1 7 . 1 1 65 65 GLU H H 65 7.960 7.960 7.995 -0.035 25800
3374 1 7 . 1 1 66 66 LYS N N 66 114.700 114.700 118.475 -3.775 25800
3375 1 7 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.326 0.144 25800
3376 1 7 . 1 1 66 66 LYS C C 66 177.500 177.500 177.310 0.190 25800
3377 1 7 . 1 1 66 66 LYS CA C 66 54.400 54.400 56.037 -1.637 25800
3378 1 7 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.485 0.515 25800
3379 1 7 . 1 1 66 66 LYS H H 66 8.050 8.050 7.702 0.348 25800
3380 1 7 . 1 1 67 67 ASP N N 67 118.800 118.800 120.433 -1.633 25800
3381 1 7 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.399 -0.179 25800
3382 1 7 . 1 1 67 67 ASP C C 67 177.700 177.700 177.503 0.197 25800
3383 1 7 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.353 4.047 25800
3384 1 7 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.003 0.397 25800
3385 1 7 . 1 1 67 67 ASP H H 67 7.620 7.620 7.846 -0.226 25800
3386 1 7 . 1 1 68 68 GLY N N 68 115.600 115.600 107.561 8.039 25800
3387 1 7 . 1 1 68 68 GLY C C 68 173.800 173.800 174.800 -1.000 25800
3388 1 7 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.642 1.258 25800
3389 1 7 . 1 1 68 68 GLY H H 68 8.470 8.470 8.584 -0.114 25800
3390 1 7 . 1 1 69 69 CYS N N 69 119.200 119.200 119.577 -0.377 25800
3391 1 7 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.702 -0.542 25800
3392 1 7 . 1 1 69 69 CYS C C 69 172.600 172.600 174.195 -1.595 25800
3393 1 7 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.922 0.078 25800
3394 1 7 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.871 -0.171 25800
3395 1 7 . 1 1 69 69 CYS H H 69 7.890 7.890 8.199 -0.309 25800
3396 1 7 . 1 1 70 70 ASP N N 70 122.200 122.200 125.041 -2.841 25800
3397 1 7 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.084 -0.254 25800
3398 1 7 . 1 1 70 70 ASP C C 70 176.400 176.400 174.495 1.905 25800
3399 1 7 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.486 1.214 25800
3400 1 7 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.034 -1.334 25800
3401 1 7 . 1 1 70 70 ASP H H 70 8.360 8.360 8.528 -0.168 25800
3402 1 7 . 1 1 71 71 PHE N N 71 127.600 127.600 121.333 6.267 25800
3403 1 7 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.259 -0.659 25800
3404 1 7 . 1 1 71 71 PHE C C 71 173.600 173.600 174.739 -1.139 25800
3405 1 7 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.499 0.301 25800
3406 1 7 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.433 -0.733 25800
3407 1 7 . 1 1 71 71 PHE H H 71 9.390 9.390 7.978 1.412 25800
3408 1 7 . 1 1 72 72 GLU N N 72 123.900 123.900 120.430 3.470 25800
3409 1 7 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.062 -0.522 25800
3410 1 7 . 1 1 72 72 GLU C C 72 175.500 175.500 176.194 -0.694 25800
3411 1 7 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.788 -0.088 25800
3412 1 7 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.965 -1.665 25800
3413 1 7 . 1 1 72 72 GLU H H 72 8.940 8.940 9.272 -0.332 25800
3414 1 7 . 1 1 73 73 GLY N N 73 105.200 105.200 109.399 -4.199 25800
3415 1 7 . 1 1 73 73 GLY C C 73 174.100 174.100 174.261 -0.161 25800
3416 1 7 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.787 0.813 25800
3417 1 7 . 1 1 73 73 GLY H H 73 8.350 8.350 8.485 -0.135 25800
3418 1 7 . 1 1 74 74 ASN N N 74 121.000 121.000 120.965 0.035 25800
3419 1 7 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.860 -0.100 25800
3420 1 7 . 1 1 74 74 ASN C C 74 174.000 174.000 173.823 0.177 25800
3421 1 7 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.622 -1.722 25800
3422 1 7 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.952 -0.252 25800
3423 1 7 . 1 1 74 74 ASN H H 74 7.740 7.740 7.762 -0.022 25800
3424 1 7 . 1 1 75 75 LYS N N 75 121.400 121.400 121.018 0.382 25800
3425 1 7 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.533 -0.063 25800
3426 1 7 . 1 1 75 75 LYS C C 75 176.900 176.900 174.830 2.070 25800
3427 1 7 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.199 -0.899 25800
3428 1 7 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.974 -1.074 25800
3429 1 7 . 1 1 75 75 LYS H H 75 8.380 8.380 8.577 -0.197 25800
3430 1 7 . 1 1 76 76 LEU N N 76 127.400 127.400 123.709 3.691 25800
3431 1 7 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.527 -0.097 25800
3432 1 7 . 1 1 76 76 LEU C C 76 177.600 177.600 174.566 3.034 25800
3433 1 7 . 1 1 76 76 LEU CA C 76 55.300 55.300 54.886 0.414 25800
3434 1 7 . 1 1 76 76 LEU CB C 76 43.100 43.100 44.260 -1.160 25800
3435 1 7 . 1 1 76 76 LEU H H 76 8.950 8.950 8.903 0.047 25800
3436 1 7 . 1 1 77 77 ARG N N 77 121.800 121.800 124.291 -2.491 25800
3437 1 7 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.620 0.280 25800
3438 1 7 . 1 1 77 77 ARG C C 77 174.700 174.700 173.967 0.733 25800
3439 1 7 . 1 1 77 77 ARG CA C 77 54.000 54.000 56.233 -2.233 25800
3440 1 7 . 1 1 77 77 ARG CB C 77 32.300 32.300 31.844 0.456 25800
3441 1 7 . 1 1 77 77 ARG H H 77 7.530 7.530 8.461 -0.931 25800
3442 1 7 . 1 1 78 78 VAL N N 78 127.000 127.000 125.116 1.884 25800
3443 1 7 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.563 0.717 25800
3444 1 7 . 1 1 78 78 VAL C C 78 174.200 174.200 174.312 -0.112 25800
3445 1 7 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.036 0.164 25800
3446 1 7 . 1 1 78 78 VAL CB C 78 33.400 33.400 35.423 -2.023 25800
3447 1 7 . 1 1 78 78 VAL H H 78 9.660 9.660 8.491 1.169 25800
3448 1 7 . 1 1 79 79 GLU N N 79 121.900 121.900 127.677 -5.777 25800
3449 1 7 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.615 0.095 25800
3450 1 7 . 1 1 79 79 GLU C C 79 174.600 174.600 173.730 0.870 25800
3451 1 7 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.626 -1.726 25800
3452 1 7 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.078 0.322 25800
3453 1 7 . 1 1 79 79 GLU H H 79 8.980 8.980 8.346 0.634 25800
3454 1 7 . 1 1 80 80 VAL N N 80 121.300 121.300 123.089 -1.789 25800
3455 1 7 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.537 -0.167 25800
3456 1 7 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.473 2.527 25800
3457 1 7 . 1 1 80 80 VAL CB C 80 32.100 32.100 34.750 -2.650 25800
3458 1 7 . 1 1 80 80 VAL H H 80 8.410 8.410 8.368 0.042 25800
3459 1 7 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.458 -0.198 25800
3460 1 7 . 1 1 81 81 PRO C C 81 176.100 176.100 177.114 -1.014 25800
3461 1 7 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.438 -1.338 25800
3462 1 7 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.941 0.159 25800
3463 1 7 . 1 1 82 82 PHE N N 82 122.200 122.200 114.646 7.554 25800
3464 1 7 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.712 -0.422 25800
3465 1 7 . 1 1 82 82 PHE C C 82 175.300 175.300 175.029 0.271 25800
3466 1 7 . 1 1 82 82 PHE CA C 82 58.100 58.100 56.020 2.080 25800
3467 1 7 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.306 2.094 25800
3468 1 7 . 1 1 82 82 PHE H H 82 8.150 8.150 7.867 0.283 25800
3469 1 7 . 1 1 83 83 ASN N N 83 120.800 120.800 119.259 1.541 25800
3470 1 7 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.225 0.215 25800
3471 1 7 . 1 1 83 83 ASN C C 83 174.100 174.100 175.043 -0.943 25800
3472 1 7 . 1 1 83 83 ASN CA C 83 52.700 52.700 54.716 -2.016 25800
3473 1 7 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.847 -0.147 25800
3474 1 7 . 1 1 83 83 ASN H H 83 8.110 8.110 7.868 0.242 25800
3475 1 7 . 1 1 84 84 ALA N N 84 123.700 123.700 120.815 2.885 25800
3476 1 7 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.642 -0.562 25800
3477 1 7 . 1 1 84 84 ALA C C 84 177.100 177.100 176.580 0.520 25800
3478 1 7 . 1 1 84 84 ALA CA C 84 52.400 52.400 51.258 1.142 25800
3479 1 7 . 1 1 84 84 ALA CB C 84 19.100 19.100 21.157 -2.057 25800
3480 1 7 . 1 1 84 84 ALA H H 84 8.020 8.020 7.783 0.237 25800
3481 1 7 . 1 1 85 85 ARG N N 85 120.200 120.200 119.582 0.618 25800
3482 1 7 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.174 -0.024 25800
3483 1 7 . 1 1 85 85 ARG C C 85 175.200 175.200 175.863 -0.663 25800
3484 1 7 . 1 1 85 85 ARG CA C 85 56.000 56.000 58.059 -2.059 25800
3485 1 7 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.506 0.294 25800
3486 1 7 . 1 1 85 85 ARG H H 85 8.040 8.040 8.637 -0.597 25800
3487 1 8 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.528 0.062 25800
3488 1 8 . 1 1 0 0 HIS C C 0 174.000 174.000 174.447 -0.447 25800
3489 1 8 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.776 -1.476 25800
3490 1 8 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.178 -0.878 25800
3491 1 8 . 1 1 1 1 MET N N 1 122.400 122.400 122.414 -0.014 25800
3492 1 8 . 1 1 1 1 MET HA H 1 4.340 4.340 4.805 -0.465 25800
3493 1 8 . 1 1 1 1 MET C C 1 175.600 175.600 174.580 1.020 25800
3494 1 8 . 1 1 1 1 MET CA C 1 55.600 55.600 54.176 1.424 25800
3495 1 8 . 1 1 1 1 MET CB C 1 32.800 32.800 36.299 -3.499 25800
3496 1 8 . 1 1 1 1 MET H H 1 8.310 8.310 8.701 -0.391 25800
3497 1 8 . 1 1 2 2 VAL N N 2 123.200 123.200 121.382 1.818 25800
3498 1 8 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.414 -0.454 25800
3499 1 8 . 1 1 2 2 VAL C C 2 175.600 175.600 174.378 1.222 25800
3500 1 8 . 1 1 2 2 VAL CA C 2 62.300 62.300 61.697 0.603 25800
3501 1 8 . 1 1 2 2 VAL CB C 2 32.300 32.300 34.692 -2.392 25800
3502 1 8 . 1 1 2 2 VAL H H 2 8.180 8.180 8.224 -0.044 25800
3503 1 8 . 1 1 3 3 ILE N N 3 126.200 126.200 123.924 2.276 25800
3504 1 8 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.446 -0.396 25800
3505 1 8 . 1 1 3 3 ILE C C 3 175.800 175.800 176.859 -1.059 25800
3506 1 8 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.926 -0.226 25800
3507 1 8 . 1 1 3 3 ILE CB C 3 38.300 38.300 39.891 -1.591 25800
3508 1 8 . 1 1 3 3 ILE H H 3 8.230 8.230 8.480 -0.250 25800
3509 1 8 . 1 1 4 4 ARG N N 4 126.100 126.100 125.609 0.491 25800
3510 1 8 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.240 -0.060 25800
3511 1 8 . 1 1 4 4 ARG C C 4 175.900 175.900 175.252 0.648 25800
3512 1 8 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.580 -0.580 25800
3513 1 8 . 1 1 4 4 ARG CB C 4 30.700 30.700 29.568 1.132 25800
3514 1 8 . 1 1 4 4 ARG H H 4 8.360 8.360 8.728 -0.368 25800
3515 1 8 . 1 1 5 5 GLU N N 5 122.200 122.200 117.282 4.918 25800
3516 1 8 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.454 -0.314 25800
3517 1 8 . 1 1 5 5 GLU C C 5 176.100 176.100 175.698 0.402 25800
3518 1 8 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.596 1.004 25800
3519 1 8 . 1 1 5 5 GLU CB C 5 30.300 30.300 31.828 -1.528 25800
3520 1 8 . 1 1 5 5 GLU H H 5 8.400 8.400 7.554 0.846 25800
3521 1 8 . 1 1 6 6 SER N N 6 116.200 116.200 119.694 -3.494 25800
3522 1 8 . 1 1 6 6 SER HA H 6 4.350 4.350 4.256 0.094 25800
3523 1 8 . 1 1 6 6 SER C C 6 174.300 174.300 174.593 -0.293 25800
3524 1 8 . 1 1 6 6 SER CA C 6 58.200 58.200 59.604 -1.404 25800
3525 1 8 . 1 1 6 6 SER CB C 6 63.800 63.800 63.481 0.319 25800
3526 1 8 . 1 1 6 6 SER H H 6 8.270 8.270 8.461 -0.191 25800
3527 1 8 . 1 1 7 7 VAL N N 7 119.800 119.800 120.710 -0.910 25800
3528 1 8 . 1 1 7 7 VAL HA H 7 4.300 4.300 3.882 0.418 25800
3529 1 8 . 1 1 7 7 VAL C C 7 175.500 175.500 175.389 0.111 25800
3530 1 8 . 1 1 7 7 VAL CA C 7 61.700 61.700 62.313 -0.613 25800
3531 1 8 . 1 1 7 7 VAL CB C 7 32.800 32.800 31.527 1.272 25800
3532 1 8 . 1 1 7 7 VAL H H 7 7.840 7.840 7.937 -0.097 25800
3533 1 8 . 1 1 8 8 SER N N 8 117.800 117.800 121.200 -3.400 25800
3534 1 8 . 1 1 8 8 SER HA H 8 4.240 4.240 4.544 -0.304 25800
3535 1 8 . 1 1 8 8 SER C C 8 172.500 172.500 173.946 -1.446 25800
3536 1 8 . 1 1 8 8 SER CA C 8 58.500 58.500 59.403 -0.903 25800
3537 1 8 . 1 1 8 8 SER CB C 8 63.600 63.600 63.565 0.035 25800
3538 1 8 . 1 1 8 8 SER H H 8 8.530 8.530 8.507 0.023 25800
3539 1 8 . 1 1 9 9 ARG N N 9 123.000 123.000 125.187 -2.187 25800
3540 1 8 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.544 -0.044 25800
3541 1 8 . 1 1 9 9 ARG C C 9 175.000 175.000 175.136 -0.136 25800
3542 1 8 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.906 -0.606 25800
3543 1 8 . 1 1 9 9 ARG CB C 9 33.400 33.400 35.251 -1.851 25800
3544 1 8 . 1 1 9 9 ARG H H 9 7.350 7.350 8.421 -1.071 25800
3545 1 8 . 1 1 10 10 ILE N N 10 114.000 114.000 119.450 -5.450 25800
3546 1 8 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.077 0.743 25800
3547 1 8 . 1 1 10 10 ILE C C 10 173.000 173.000 174.519 -1.519 25800
3548 1 8 . 1 1 10 10 ILE CA C 10 59.400 59.400 60.627 -1.227 25800
3549 1 8 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.880 1.020 25800
3550 1 8 . 1 1 10 10 ILE H H 10 8.830 8.830 8.691 0.139 25800
3551 1 8 . 1 1 11 11 TYR N N 11 123.400 123.400 127.077 -3.677 25800
3552 1 8 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.231 -0.301 25800
3553 1 8 . 1 1 11 11 TYR C C 11 173.000 173.000 173.234 -0.234 25800
3554 1 8 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.559 0.441 25800
3555 1 8 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.239 -1.339 25800
3556 1 8 . 1 1 11 11 TYR H H 11 8.690 8.690 9.021 -0.331 25800
3557 1 8 . 1 1 12 12 VAL N N 12 126.300 126.300 127.077 -0.777 25800
3558 1 8 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.235 0.325 25800
3559 1 8 . 1 1 12 12 VAL C C 12 174.100 174.100 174.059 0.041 25800
3560 1 8 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.559 -0.359 25800
3561 1 8 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.478 -1.078 25800
3562 1 8 . 1 1 12 12 VAL H H 12 8.370 8.370 8.285 0.085 25800
3563 1 8 . 1 1 13 13 GLY N N 13 113.000 113.000 112.084 0.916 25800
3564 1 8 . 1 1 13 13 GLY C C 13 173.100 173.100 173.338 -0.238 25800
3565 1 8 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.081 0.219 25800
3566 1 8 . 1 1 13 13 GLY H H 13 9.350 9.350 8.392 0.958 25800
3567 1 8 . 1 1 14 14 ASN N N 14 113.900 113.900 117.840 -3.940 25800
3568 1 8 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.309 -0.029 25800
3569 1 8 . 1 1 14 14 ASN C C 14 175.800 175.800 175.006 0.794 25800
3570 1 8 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.069 -0.469 25800
3571 1 8 . 1 1 14 14 ASN CB C 14 37.700 37.700 37.120 0.580 25800
3572 1 8 . 1 1 14 14 ASN H H 14 8.800 8.800 8.737 0.063 25800
3573 1 8 . 1 1 15 15 LEU N N 15 115.800 115.800 115.194 0.606 25800
3574 1 8 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.473 0.517 25800
3575 1 8 . 1 1 15 15 LEU CA C 15 55.600 55.600 54.011 1.589 25800
3576 1 8 . 1 1 15 15 LEU CB C 15 41.600 41.600 40.883 0.717 25800
3577 1 8 . 1 1 15 15 LEU H H 15 7.150 7.150 7.569 -0.419 25800
3578 1 8 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.462 -0.392 25800
3579 1 8 . 1 1 16 16 PRO C C 16 171.500 171.500 177.505 -6.005 25800
3580 1 8 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.033 -0.533 25800
3581 1 8 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.116 -0.116 25800
3582 1 8 . 1 1 17 17 SER N N 17 115.200 115.200 113.638 1.562 25800
3583 1 8 . 1 1 17 17 SER HA H 17 4.300 4.300 4.030 0.270 25800
3584 1 8 . 1 1 17 17 SER C C 17 174.200 174.200 173.850 0.350 25800
3585 1 8 . 1 1 17 17 SER CA C 17 58.200 58.200 59.072 -0.872 25800
3586 1 8 . 1 1 17 17 SER CB C 17 63.900 63.900 62.479 1.421 25800
3587 1 8 . 1 1 17 17 SER H H 17 8.470 8.470 8.713 -0.243 25800
3588 1 8 . 1 1 18 18 HIS N N 18 120.800 120.800 118.071 2.729 25800
3589 1 8 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.105 0.445 25800
3590 1 8 . 1 1 18 18 HIS C C 18 175.100 175.100 174.569 0.531 25800
3591 1 8 . 1 1 18 18 HIS CA C 18 55.500 55.500 56.451 -0.951 25800
3592 1 8 . 1 1 18 18 HIS CB C 18 29.300 29.300 28.524 0.776 25800
3593 1 8 . 1 1 18 18 HIS H H 18 8.540 8.540 7.746 0.794 25800
3594 1 8 . 1 1 19 19 VAL N N 19 115.700 115.700 115.819 -0.119 25800
3595 1 8 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.002 0.258 25800
3596 1 8 . 1 1 19 19 VAL C C 19 174.000 174.000 175.812 -1.812 25800
3597 1 8 . 1 1 19 19 VAL CA C 19 61.900 61.900 63.120 -1.220 25800
3598 1 8 . 1 1 19 19 VAL CB C 19 32.600 32.600 31.829 0.770 25800
3599 1 8 . 1 1 19 19 VAL H H 19 6.650 6.650 7.275 -0.625 25800
3600 1 8 . 1 1 20 20 SER N N 20 118.800 118.800 122.615 -3.815 25800
3601 1 8 . 1 1 20 20 SER HA H 20 4.710 4.710 4.291 0.419 25800
3602 1 8 . 1 1 20 20 SER C C 20 175.900 175.900 175.504 0.396 25800
3603 1 8 . 1 1 20 20 SER CA C 20 55.800 55.800 58.090 -2.290 25800
3604 1 8 . 1 1 20 20 SER CB C 20 66.600 66.600 64.589 2.011 25800
3605 1 8 . 1 1 20 20 SER H H 20 8.930 8.930 7.987 0.943 25800
3606 1 8 . 1 1 21 21 SER N N 21 117.100 117.100 121.174 -4.074 25800
3607 1 8 . 1 1 21 21 SER HA H 21 3.880 3.880 4.099 -0.219 25800
3608 1 8 . 1 1 21 21 SER C C 21 176.200 176.200 176.187 0.013 25800
3609 1 8 . 1 1 21 21 SER CA C 21 62.300 62.300 61.398 0.902 25800
3610 1 8 . 1 1 21 21 SER CB C 21 66.800 66.800 63.044 3.756 25800
3611 1 8 . 1 1 21 21 SER H H 21 9.080 9.080 8.795 0.285 25800
3612 1 8 . 1 1 22 22 ARG N N 22 121.200 121.200 119.890 1.310 25800
3613 1 8 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.412 -0.422 25800
3614 1 8 . 1 1 22 22 ARG C C 22 177.900 177.900 178.855 -0.955 25800
3615 1 8 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.680 0.020 25800
3616 1 8 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.433 0.167 25800
3617 1 8 . 1 1 22 22 ARG H H 22 7.940 7.940 8.541 -0.601 25800
3618 1 8 . 1 1 23 23 ASP N N 23 118.800 118.800 120.047 -1.247 25800
3619 1 8 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.486 -0.096 25800
3620 1 8 . 1 1 23 23 ASP C C 23 179.200 179.200 178.451 0.749 25800
3621 1 8 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.056 0.244 25800
3622 1 8 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.417 0.583 25800
3623 1 8 . 1 1 23 23 ASP H H 23 7.480 7.480 7.754 -0.274 25800
3624 1 8 . 1 1 24 24 VAL N N 24 119.500 119.500 119.383 0.117 25800
3625 1 8 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.592 -0.222 25800
3626 1 8 . 1 1 24 24 VAL C C 24 177.500 177.500 177.441 0.059 25800
3627 1 8 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.937 0.963 25800
3628 1 8 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.380 0.020 25800
3629 1 8 . 1 1 24 24 VAL H H 24 7.450 7.450 7.386 0.064 25800
3630 1 8 . 1 1 25 25 GLU N N 25 121.400 121.400 120.856 0.544 25800
3631 1 8 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.168 -0.598 25800
3632 1 8 . 1 1 25 25 GLU C C 25 178.400 178.400 178.966 -0.566 25800
3633 1 8 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.232 0.368 25800
3634 1 8 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.491 0.109 25800
3635 1 8 . 1 1 25 25 GLU H H 25 8.580 8.580 8.717 -0.137 25800
3636 1 8 . 1 1 26 26 ASN N N 26 114.800 114.800 116.071 -1.271 25800
3637 1 8 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.555 -0.235 25800
3638 1 8 . 1 1 26 26 ASN C C 26 177.400 177.400 176.920 0.480 25800
3639 1 8 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.861 0.039 25800
3640 1 8 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.823 -0.923 25800
3641 1 8 . 1 1 26 26 ASN H H 26 8.180 8.180 7.905 0.275 25800
3642 1 8 . 1 1 27 27 GLU N N 27 118.900 118.900 119.311 -0.411 25800
3643 1 8 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.253 -0.113 25800
3644 1 8 . 1 1 27 27 GLU C C 27 176.400 176.400 178.923 -2.523 25800
3645 1 8 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.527 -1.127 25800
3646 1 8 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.885 -0.485 25800
3647 1 8 . 1 1 27 27 GLU H H 27 7.340 7.340 7.511 -0.171 25800
3648 1 8 . 1 1 28 28 PHE N N 28 114.100 114.100 119.564 -5.464 25800
3649 1 8 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.419 0.131 25800
3650 1 8 . 1 1 28 28 PHE C C 28 176.300 176.300 178.483 -2.183 25800
3651 1 8 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.533 -1.533 25800
3652 1 8 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.487 2.313 25800
3653 1 8 . 1 1 28 28 PHE H H 28 7.660 7.660 8.749 -1.089 25800
3654 1 8 . 1 1 29 29 ARG N N 29 121.700 121.700 118.142 3.558 25800
3655 1 8 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.325 0.085 25800
3656 1 8 . 1 1 29 29 ARG C C 29 177.100 177.100 177.454 -0.354 25800
3657 1 8 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.714 -0.514 25800
3658 1 8 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.085 -0.785 25800
3659 1 8 . 1 1 29 29 ARG H H 29 8.120 8.120 7.917 0.203 25800
3660 1 8 . 1 1 30 30 LYS N N 30 117.200 117.200 117.698 -0.498 25800
3661 1 8 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.174 -0.344 25800
3662 1 8 . 1 1 30 30 LYS C C 30 177.100 177.100 177.571 -0.471 25800
3663 1 8 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.850 -0.050 25800
3664 1 8 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.365 -1.266 25800
3665 1 8 . 1 1 30 30 LYS H H 30 7.630 7.630 7.844 -0.214 25800
3666 1 8 . 1 1 31 31 TYR N N 31 117.100 117.100 117.917 -0.817 25800
3667 1 8 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.725 -0.575 25800
3668 1 8 . 1 1 31 31 TYR C C 31 174.400 174.400 175.696 -1.296 25800
3669 1 8 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.187 0.713 25800
3670 1 8 . 1 1 31 31 TYR CB C 31 37.900 37.900 40.093 -2.193 25800
3671 1 8 . 1 1 31 31 TYR H H 31 7.410 7.410 8.213 -0.803 25800
3672 1 8 . 1 1 32 32 GLY N N 32 104.100 104.100 104.238 -0.138 25800
3673 1 8 . 1 1 32 32 GLY C C 32 177.000 177.000 171.766 5.234 25800
3674 1 8 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.567 -0.067 25800
3675 1 8 . 1 1 32 32 GLY H H 32 7.240 7.240 7.971 -0.731 25800
3676 1 8 . 1 1 33 33 ASN N N 33 115.300 115.300 118.650 -3.350 25800
3677 1 8 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.864 -0.424 25800
3678 1 8 . 1 1 33 33 ASN C C 33 175.500 175.500 173.845 1.655 25800
3679 1 8 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.913 1.387 25800
3680 1 8 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.764 -1.365 25800
3681 1 8 . 1 1 33 33 ASN H H 33 8.460 8.460 8.083 0.377 25800
3682 1 8 . 1 1 34 34 ILE N N 34 126.700 126.700 125.021 1.679 25800
3683 1 8 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.883 -1.093 25800
3684 1 8 . 1 1 34 34 ILE C C 34 175.600 175.600 175.577 0.023 25800
3685 1 8 . 1 1 34 34 ILE CA C 34 61.300 61.300 59.336 1.964 25800
3686 1 8 . 1 1 34 34 ILE CB C 34 40.000 40.000 39.435 0.565 25800
3687 1 8 . 1 1 34 34 ILE H H 34 8.050 8.050 8.561 -0.511 25800
3688 1 8 . 1 1 35 35 LEU N N 35 127.400 127.400 128.951 -1.551 25800
3689 1 8 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.379 -0.219 25800
3690 1 8 . 1 1 35 35 LEU C C 35 177.200 177.200 176.545 0.655 25800
3691 1 8 . 1 1 35 35 LEU CA C 35 55.500 55.500 56.416 -0.916 25800
3692 1 8 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.776 -0.076 25800
3693 1 8 . 1 1 35 35 LEU H H 35 8.780 8.780 9.219 -0.439 25800
3694 1 8 . 1 1 36 36 LYS N N 36 117.000 117.000 114.022 2.978 25800
3695 1 8 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.636 -0.396 25800
3696 1 8 . 1 1 36 36 LYS C C 36 173.600 173.600 174.077 -0.477 25800
3697 1 8 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.670 0.230 25800
3698 1 8 . 1 1 36 36 LYS CB C 36 36.600 36.600 34.674 1.926 25800
3699 1 8 . 1 1 36 36 LYS H H 36 7.110 7.110 7.659 -0.549 25800
3700 1 8 . 1 1 37 37 CYS N N 37 125.400 125.400 117.751 7.649 25800
3701 1 8 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.411 -0.711 25800
3702 1 8 . 1 1 37 37 CYS C C 37 171.600 171.600 173.044 -1.444 25800
3703 1 8 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.050 0.850 25800
3704 1 8 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.569 -4.469 25800
3705 1 8 . 1 1 37 37 CYS H H 37 8.610 8.610 8.551 0.059 25800
3706 1 8 . 1 1 38 38 ASP N N 38 128.200 128.200 120.229 7.971 25800
3707 1 8 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.064 -0.114 25800
3708 1 8 . 1 1 38 38 ASP C C 38 174.300 174.300 173.876 0.424 25800
3709 1 8 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.601 -0.401 25800
3710 1 8 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.103 -0.803 25800
3711 1 8 . 1 1 38 38 ASP H H 38 8.290 8.290 8.642 -0.352 25800
3712 1 8 . 1 1 39 39 VAL N N 39 123.500 123.500 120.490 3.010 25800
3713 1 8 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.713 -0.413 25800
3714 1 8 . 1 1 39 39 VAL C C 39 175.000 175.000 175.355 -0.355 25800
3715 1 8 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.326 0.374 25800
3716 1 8 . 1 1 39 39 VAL CB C 39 33.100 33.100 33.323 -0.223 25800
3717 1 8 . 1 1 39 39 VAL H H 39 8.380 8.380 8.540 -0.160 25800
3718 1 8 . 1 1 40 40 LYS N N 40 129.100 129.100 127.265 1.835 25800
3719 1 8 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.564 -0.244 25800
3720 1 8 . 1 1 40 40 LYS C C 40 173.700 173.700 175.387 -1.687 25800
3721 1 8 . 1 1 40 40 LYS CA C 40 53.900 53.900 56.005 -2.104 25800
3722 1 8 . 1 1 40 40 LYS CB C 40 35.500 35.500 34.112 1.388 25800
3723 1 8 . 1 1 40 40 LYS H H 40 8.680 8.680 9.191 -0.511 25800
3724 1 8 . 1 1 41 41 LYS N N 41 117.300 117.300 121.447 -4.147 25800
3725 1 8 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.055 -0.075 25800
3726 1 8 . 1 1 41 41 LYS C C 41 177.800 177.800 175.574 2.226 25800
3727 1 8 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.243 0.357 25800
3728 1 8 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.136 -0.136 25800
3729 1 8 . 1 1 41 41 LYS H H 41 7.900 7.900 8.232 -0.332 25800
3730 1 8 . 1 1 42 42 THR N N 42 113.200 113.200 115.329 -2.129 25800
3731 1 8 . 1 1 42 42 THR HA H 42 4.680 4.680 4.582 0.098 25800
3732 1 8 . 1 1 42 42 THR C C 42 176.900 176.900 174.237 2.663 25800
3733 1 8 . 1 1 42 42 THR CA C 42 60.200 60.200 60.407 -0.207 25800
3734 1 8 . 1 1 42 42 THR CB C 42 71.600 71.600 70.615 0.984 25800
3735 1 8 . 1 1 42 42 THR H H 42 8.730 8.730 8.591 0.139 25800
3736 1 8 . 1 1 43 43 VAL N N 43 120.000 120.000 125.220 -5.220 25800
3737 1 8 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.898 0.022 25800
3738 1 8 . 1 1 43 43 VAL C C 43 177.000 177.000 177.206 -0.206 25800
3739 1 8 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.457 0.243 25800
3740 1 8 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.963 -0.163 25800
3741 1 8 . 1 1 43 43 VAL H H 43 8.730 8.730 8.799 -0.069 25800
3742 1 8 . 1 1 44 44 SER N N 44 113.400 113.400 114.752 -1.352 25800
3743 1 8 . 1 1 44 44 SER HA H 44 4.360 4.360 4.418 -0.058 25800
3744 1 8 . 1 1 44 44 SER C C 44 174.800 174.800 174.691 0.109 25800
3745 1 8 . 1 1 44 44 SER CA C 44 58.400 58.400 57.599 0.802 25800
3746 1 8 . 1 1 44 44 SER CB C 44 63.500 63.500 61.802 1.698 25800
3747 1 8 . 1 1 44 44 SER H H 44 7.760 7.760 8.287 -0.527 25800
3748 1 8 . 1 1 45 45 GLY N N 45 110.200 110.200 109.326 0.874 25800
3749 1 8 . 1 1 45 45 GLY C C 45 173.500 173.500 173.819 -0.319 25800
3750 1 8 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.851 -0.551 25800
3751 1 8 . 1 1 45 45 GLY H H 45 7.820 7.820 7.813 0.007 25800
3752 1 8 . 1 1 46 46 ALA N N 46 123.900 123.900 121.639 2.261 25800
3753 1 8 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.733 -0.343 25800
3754 1 8 . 1 1 46 46 ALA C C 46 176.100 176.100 174.920 1.180 25800
3755 1 8 . 1 1 46 46 ALA CA C 46 51.900 51.900 50.726 1.174 25800
3756 1 8 . 1 1 46 46 ALA CB C 46 19.800 19.800 21.824 -2.024 25800
3757 1 8 . 1 1 46 46 ALA H H 46 7.440 7.440 7.528 -0.088 25800
3758 1 8 . 1 1 47 47 ALA N N 47 123.100 123.100 121.936 1.164 25800
3759 1 8 . 1 1 47 47 ALA HA H 47 5.200 5.200 4.715 0.485 25800
3760 1 8 . 1 1 47 47 ALA C C 47 176.100 176.100 175.004 1.096 25800
3761 1 8 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.724 0.177 25800
3762 1 8 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.265 -0.365 25800
3763 1 8 . 1 1 47 47 ALA H H 47 8.350 8.350 8.130 0.220 25800
3764 1 8 . 1 1 48 48 PHE N N 48 118.700 118.700 118.784 -0.084 25800
3765 1 8 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.311 -0.281 25800
3766 1 8 . 1 1 48 48 PHE C C 48 171.600 171.600 174.191 -2.591 25800
3767 1 8 . 1 1 48 48 PHE CA C 48 55.700 55.700 54.750 0.950 25800
3768 1 8 . 1 1 48 48 PHE CB C 48 41.200 41.200 42.084 -0.883 25800
3769 1 8 . 1 1 48 48 PHE H H 48 8.550 8.550 8.573 -0.023 25800
3770 1 8 . 1 1 49 49 ALA N N 49 120.400 120.400 125.014 -4.614 25800
3771 1 8 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.068 0.262 25800
3772 1 8 . 1 1 49 49 ALA C C 49 175.500 175.500 175.461 0.039 25800
3773 1 8 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.392 -1.092 25800
3774 1 8 . 1 1 49 49 ALA CB C 49 23.700 23.700 20.971 2.729 25800
3775 1 8 . 1 1 49 49 ALA H H 49 9.240 9.240 8.964 0.276 25800
3776 1 8 . 1 1 50 50 PHE N N 50 115.000 115.000 120.327 -5.327 25800
3777 1 8 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.670 -0.070 25800
3778 1 8 . 1 1 50 50 PHE C C 50 176.000 176.000 174.655 1.345 25800
3779 1 8 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.307 0.193 25800
3780 1 8 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.753 -1.553 25800
3781 1 8 . 1 1 50 50 PHE H H 50 7.920 7.920 8.856 -0.936 25800
3782 1 8 . 1 1 51 51 ILE N N 51 123.000 123.000 120.391 2.609 25800
3783 1 8 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.690 -0.240 25800
3784 1 8 . 1 1 51 51 ILE C C 51 173.700 173.700 174.760 -1.060 25800
3785 1 8 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.669 -0.469 25800
3786 1 8 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.594 -0.894 25800
3787 1 8 . 1 1 51 51 ILE H H 51 8.490 8.490 8.640 -0.150 25800
3788 1 8 . 1 1 52 52 GLU N N 52 126.600 126.600 127.102 -0.502 25800
3789 1 8 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.913 -0.143 25800
3790 1 8 . 1 1 52 52 GLU C C 52 175.300 175.300 175.346 -0.046 25800
3791 1 8 . 1 1 52 52 GLU CA C 52 54.700 54.700 56.884 -2.184 25800
3792 1 8 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.102 0.398 25800
3793 1 8 . 1 1 52 52 GLU H H 52 8.610 8.610 8.889 -0.279 25800
3794 1 8 . 1 1 53 53 PHE N N 53 126.100 126.100 126.316 -0.216 25800
3795 1 8 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.304 -0.504 25800
3796 1 8 . 1 1 53 53 PHE C C 53 175.400 175.400 174.357 1.043 25800
3797 1 8 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.603 1.597 25800
3798 1 8 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.460 -2.560 25800
3799 1 8 . 1 1 53 53 PHE H H 53 8.800 8.800 9.183 -0.383 25800
3800 1 8 . 1 1 54 54 GLU N N 54 120.700 120.700 125.242 -4.542 25800
3801 1 8 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.109 -0.179 25800
3802 1 8 . 1 1 54 54 GLU C C 54 175.300 175.300 176.001 -0.701 25800
3803 1 8 . 1 1 54 54 GLU CA C 54 59.100 59.100 58.620 0.480 25800
3804 1 8 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.402 0.397 25800
3805 1 8 . 1 1 54 54 GLU H H 54 8.160 8.160 8.319 -0.159 25800
3806 1 8 . 1 1 55 55 ASP N N 55 117.900 117.900 119.887 -1.987 25800
3807 1 8 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.732 0.188 25800
3808 1 8 . 1 1 55 55 ASP C C 55 176.400 176.400 175.548 0.852 25800
3809 1 8 . 1 1 55 55 ASP CA C 55 52.400 52.400 52.661 -0.261 25800
3810 1 8 . 1 1 55 55 ASP CB C 55 44.400 44.400 39.877 4.522 25800
3811 1 8 . 1 1 55 55 ASP H H 55 8.740 8.740 7.818 0.922 25800
3812 1 8 . 1 1 56 56 ALA N N 56 128.900 128.900 125.020 3.880 25800
3813 1 8 . 1 1 56 56 ALA HA H 56 3.830 3.830 2.875 0.955 25800
3814 1 8 . 1 1 56 56 ALA C C 56 179.800 179.800 177.939 1.861 25800
3815 1 8 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.156 0.044 25800
3816 1 8 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.958 -0.058 25800
3817 1 8 . 1 1 56 56 ALA H H 56 8.800 8.800 7.735 1.065 25800
3818 1 8 . 1 1 57 57 ARG N N 57 119.200 119.200 113.422 5.778 25800
3819 1 8 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.317 -0.427 25800
3820 1 8 . 1 1 57 57 ARG C C 57 178.000 178.000 176.363 1.637 25800
3821 1 8 . 1 1 57 57 ARG CA C 57 58.900 58.900 57.284 1.616 25800
3822 1 8 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.754 -0.454 25800
3823 1 8 . 1 1 57 57 ARG H H 57 8.950 8.950 8.023 0.927 25800
3824 1 8 . 1 1 58 58 ASP N N 58 120.900 120.900 121.498 -0.598 25800
3825 1 8 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.583 -0.493 25800
3826 1 8 . 1 1 58 58 ASP C C 58 176.700 176.700 177.741 -1.041 25800
3827 1 8 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.602 -0.102 25800
3828 1 8 . 1 1 58 58 ASP CB C 58 39.900 39.900 41.090 -1.190 25800
3829 1 8 . 1 1 58 58 ASP H H 58 7.020 7.020 7.768 -0.748 25800
3830 1 8 . 1 1 59 59 ALA N N 59 119.700 119.700 121.845 -2.145 25800
3831 1 8 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.781 -1.701 25800
3832 1 8 . 1 1 59 59 ALA C C 59 178.100 178.100 179.589 -1.489 25800
3833 1 8 . 1 1 59 59 ALA CA C 59 54.300 54.300 53.987 0.313 25800
3834 1 8 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.556 -0.156 25800
3835 1 8 . 1 1 59 59 ALA H H 59 6.440 6.440 8.514 -2.074 25800
3836 1 8 . 1 1 60 60 ALA N N 60 117.600 117.600 123.345 -5.745 25800
3837 1 8 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.096 -0.266 25800
3838 1 8 . 1 1 60 60 ALA C C 60 180.900 180.900 178.895 2.005 25800
3839 1 8 . 1 1 60 60 ALA CA C 60 54.900 54.900 54.898 0.002 25800
3840 1 8 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.114 -0.414 25800
3841 1 8 . 1 1 60 60 ALA H H 60 7.330 7.330 7.974 -0.644 25800
3842 1 8 . 1 1 61 61 ASP N N 61 120.100 120.100 118.968 1.132 25800
3843 1 8 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.438 -0.228 25800
3844 1 8 . 1 1 61 61 ASP C C 61 176.700 176.700 178.137 -1.437 25800
3845 1 8 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.388 -0.288 25800
3846 1 8 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.477 -0.377 25800
3847 1 8 . 1 1 61 61 ASP H H 61 7.590 7.590 8.094 -0.504 25800
3848 1 8 . 1 1 62 62 ALA N N 62 122.200 122.200 119.837 2.363 25800
3849 1 8 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.065 -1.645 25800
3850 1 8 . 1 1 62 62 ALA C C 62 179.300 179.300 178.332 0.968 25800
3851 1 8 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.125 0.475 25800
3852 1 8 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.814 0.286 25800
3853 1 8 . 1 1 62 62 ALA H H 62 7.440 7.440 7.927 -0.487 25800
3854 1 8 . 1 1 63 63 ILE N N 63 116.700 116.700 118.044 -1.344 25800
3855 1 8 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.228 -0.988 25800
3856 1 8 . 1 1 63 63 ILE C C 63 177.800 177.800 177.271 0.529 25800
3857 1 8 . 1 1 63 63 ILE CA C 63 65.600 65.600 61.899 3.701 25800
3858 1 8 . 1 1 63 63 ILE CB C 63 38.900 38.900 39.269 -0.369 25800
3859 1 8 . 1 1 63 63 ILE H H 63 7.540 7.540 7.514 0.026 25800
3860 1 8 . 1 1 64 64 LYS N N 64 117.400 117.400 120.566 -3.166 25800
3861 1 8 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.240 -0.340 25800
3862 1 8 . 1 1 64 64 LYS C C 64 178.900 178.900 177.860 1.040 25800
3863 1 8 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.114 0.686 25800
3864 1 8 . 1 1 64 64 LYS CB C 64 32.600 32.600 32.342 0.258 25800
3865 1 8 . 1 1 64 64 LYS H H 64 7.490 7.490 8.450 -0.960 25800
3866 1 8 . 1 1 65 65 GLU N N 65 113.800 113.800 116.428 -2.628 25800
3867 1 8 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.466 -0.306 25800
3868 1 8 . 1 1 65 65 GLU C C 65 178.300 178.300 176.644 1.656 25800
3869 1 8 . 1 1 65 65 GLU CA C 65 58.300 58.300 56.604 1.696 25800
3870 1 8 . 1 1 65 65 GLU CB C 65 30.700 30.700 30.198 0.502 25800
3871 1 8 . 1 1 65 65 GLU H H 65 7.960 7.960 8.017 -0.057 25800
3872 1 8 . 1 1 66 66 LYS N N 66 114.700 114.700 118.767 -4.067 25800
3873 1 8 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.582 -0.112 25800
3874 1 8 . 1 1 66 66 LYS C C 66 177.500 177.500 176.473 1.027 25800
3875 1 8 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.712 -1.312 25800
3876 1 8 . 1 1 66 66 LYS CB C 66 33.000 33.000 33.667 -0.667 25800
3877 1 8 . 1 1 66 66 LYS H H 66 8.050 8.050 7.980 0.070 25800
3878 1 8 . 1 1 67 67 ASP N N 67 118.800 118.800 121.367 -2.567 25800
3879 1 8 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.472 -0.252 25800
3880 1 8 . 1 1 67 67 ASP C C 67 177.700 177.700 177.414 0.286 25800
3881 1 8 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.703 3.697 25800
3882 1 8 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.290 0.110 25800
3883 1 8 . 1 1 67 67 ASP H H 67 7.620 7.620 7.906 -0.286 25800
3884 1 8 . 1 1 68 68 GLY N N 68 115.600 115.600 107.927 7.673 25800
3885 1 8 . 1 1 68 68 GLY C C 68 173.800 173.800 174.692 -0.892 25800
3886 1 8 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.800 1.100 25800
3887 1 8 . 1 1 68 68 GLY H H 68 8.470 8.470 8.606 -0.136 25800
3888 1 8 . 1 1 69 69 CYS N N 69 119.200 119.200 119.990 -0.790 25800
3889 1 8 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.536 -0.376 25800
3890 1 8 . 1 1 69 69 CYS C C 69 172.600 172.600 174.241 -1.641 25800
3891 1 8 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.623 0.377 25800
3892 1 8 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.474 0.226 25800
3893 1 8 . 1 1 69 69 CYS H H 69 7.890 7.890 7.981 -0.091 25800
3894 1 8 . 1 1 70 70 ASP N N 70 122.200 122.200 124.387 -2.187 25800
3895 1 8 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.016 -0.186 25800
3896 1 8 . 1 1 70 70 ASP C C 70 176.400 176.400 174.351 2.049 25800
3897 1 8 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.931 0.770 25800
3898 1 8 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.456 -1.756 25800
3899 1 8 . 1 1 70 70 ASP H H 70 8.360 8.360 8.665 -0.305 25800
3900 1 8 . 1 1 71 71 PHE N N 71 127.600 127.600 122.417 5.183 25800
3901 1 8 . 1 1 71 71 PHE HA H 71 4.600 4.600 4.877 -0.277 25800
3902 1 8 . 1 1 71 71 PHE C C 71 173.600 173.600 174.992 -1.392 25800
3903 1 8 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.461 -0.661 25800
3904 1 8 . 1 1 71 71 PHE CB C 71 40.700 40.700 42.277 -1.577 25800
3905 1 8 . 1 1 71 71 PHE H H 71 9.390 9.390 8.493 0.897 25800
3906 1 8 . 1 1 72 72 GLU N N 72 123.900 123.900 118.244 5.656 25800
3907 1 8 . 1 1 72 72 GLU HA H 72 3.540 3.540 3.810 -0.270 25800
3908 1 8 . 1 1 72 72 GLU C C 72 175.500 175.500 174.980 0.520 25800
3909 1 8 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.841 -0.141 25800
3910 1 8 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.712 -1.411 25800
3911 1 8 . 1 1 72 72 GLU H H 72 8.940 8.940 7.930 1.010 25800
3912 1 8 . 1 1 73 73 GLY N N 73 105.200 105.200 105.275 -0.075 25800
3913 1 8 . 1 1 73 73 GLY C C 73 174.100 174.100 173.992 0.108 25800
3914 1 8 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.125 0.475 25800
3915 1 8 . 1 1 73 73 GLY H H 73 8.350 8.350 7.904 0.446 25800
3916 1 8 . 1 1 74 74 ASN N N 74 121.000 121.000 120.725 0.275 25800
3917 1 8 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.767 -0.007 25800
3918 1 8 . 1 1 74 74 ASN C C 74 174.000 174.000 173.789 0.211 25800
3919 1 8 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.373 -2.473 25800
3920 1 8 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.088 0.612 25800
3921 1 8 . 1 1 74 74 ASN H H 74 7.740 7.740 8.566 -0.826 25800
3922 1 8 . 1 1 75 75 LYS N N 75 121.400 121.400 119.456 1.944 25800
3923 1 8 . 1 1 75 75 LYS HA H 75 4.470 4.470 5.051 -0.581 25800
3924 1 8 . 1 1 75 75 LYS C C 75 176.900 176.900 175.314 1.586 25800
3925 1 8 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.643 -0.343 25800
3926 1 8 . 1 1 75 75 LYS CB C 75 31.900 31.900 34.416 -2.516 25800
3927 1 8 . 1 1 75 75 LYS H H 75 8.380 8.380 8.392 -0.012 25800
3928 1 8 . 1 1 76 76 LEU N N 76 127.400 127.400 125.521 1.879 25800
3929 1 8 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.551 -0.121 25800
3930 1 8 . 1 1 76 76 LEU C C 76 177.600 177.600 173.892 3.708 25800
3931 1 8 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.747 -0.447 25800
3932 1 8 . 1 1 76 76 LEU CB C 76 43.100 43.100 46.035 -2.934 25800
3933 1 8 . 1 1 76 76 LEU H H 76 8.950 8.950 9.175 -0.226 25800
3934 1 8 . 1 1 77 77 ARG N N 77 121.800 121.800 126.676 -4.876 25800
3935 1 8 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.896 0.004 25800
3936 1 8 . 1 1 77 77 ARG C C 77 174.700 174.700 173.492 1.208 25800
3937 1 8 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.279 -1.280 25800
3938 1 8 . 1 1 77 77 ARG CB C 77 32.300 32.300 34.172 -1.872 25800
3939 1 8 . 1 1 77 77 ARG H H 77 7.530 7.530 8.593 -1.063 25800
3940 1 8 . 1 1 78 78 VAL N N 78 127.000 127.000 124.174 2.826 25800
3941 1 8 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.647 0.633 25800
3942 1 8 . 1 1 78 78 VAL C C 78 174.200 174.200 174.611 -0.411 25800
3943 1 8 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.996 0.204 25800
3944 1 8 . 1 1 78 78 VAL CB C 78 33.400 33.400 35.768 -2.368 25800
3945 1 8 . 1 1 78 78 VAL H H 78 9.660 9.660 8.513 1.147 25800
3946 1 8 . 1 1 79 79 GLU N N 79 121.900 121.900 125.187 -3.287 25800
3947 1 8 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.711 -0.001 25800
3948 1 8 . 1 1 79 79 GLU C C 79 174.600 174.600 174.205 0.395 25800
3949 1 8 . 1 1 79 79 GLU CA C 79 53.900 53.900 54.848 -0.948 25800
3950 1 8 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.344 0.056 25800
3951 1 8 . 1 1 79 79 GLU H H 79 8.980 8.980 8.761 0.219 25800
3952 1 8 . 1 1 80 80 VAL N N 80 121.300 121.300 121.022 0.278 25800
3953 1 8 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.411 -0.041 25800
3954 1 8 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.244 2.756 25800
3955 1 8 . 1 1 80 80 VAL CB C 80 32.100 32.100 31.311 0.789 25800
3956 1 8 . 1 1 80 80 VAL H H 80 8.410 8.410 8.464 -0.054 25800
3957 1 8 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.381 -0.121 25800
3958 1 8 . 1 1 81 81 PRO C C 81 176.100 176.100 176.873 -0.773 25800
3959 1 8 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.656 -1.556 25800
3960 1 8 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.532 0.568 25800
3961 1 8 . 1 1 82 82 PHE N N 82 122.200 122.200 116.771 5.429 25800
3962 1 8 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.602 -0.312 25800
3963 1 8 . 1 1 82 82 PHE C C 82 175.300 175.300 175.677 -0.377 25800
3964 1 8 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.458 2.642 25800
3965 1 8 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.306 2.094 25800
3966 1 8 . 1 1 82 82 PHE H H 82 8.150 8.150 7.261 0.889 25800
3967 1 8 . 1 1 83 83 ASN N N 83 120.800 120.800 120.028 0.772 25800
3968 1 8 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.700 -0.260 25800
3969 1 8 . 1 1 83 83 ASN C C 83 174.100 174.100 174.561 -0.461 25800
3970 1 8 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.211 -0.511 25800
3971 1 8 . 1 1 83 83 ASN CB C 83 38.700 38.700 36.718 1.982 25800
3972 1 8 . 1 1 83 83 ASN H H 83 8.110 8.110 7.968 0.142 25800
3973 1 8 . 1 1 84 84 ALA N N 84 123.700 123.700 125.209 -1.509 25800
3974 1 8 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.702 -0.622 25800
3975 1 8 . 1 1 84 84 ALA C C 84 177.100 177.100 177.586 -0.486 25800
3976 1 8 . 1 1 84 84 ALA CA C 84 52.400 52.400 51.328 1.072 25800
3977 1 8 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.693 -1.593 25800
3978 1 8 . 1 1 84 84 ALA H H 84 8.020 8.020 8.468 -0.448 25800
3979 1 8 . 1 1 85 85 ARG N N 85 120.200 120.200 115.352 4.848 25800
3980 1 8 . 1 1 85 85 ARG HA H 85 4.150 4.150 3.990 0.160 25800
3981 1 8 . 1 1 85 85 ARG C C 85 175.200 175.200 176.470 -1.270 25800
3982 1 8 . 1 1 85 85 ARG CA C 85 56.000 56.000 57.870 -1.870 25800
3983 1 8 . 1 1 85 85 ARG CB C 85 30.800 30.800 27.770 3.030 25800
3984 1 8 . 1 1 85 85 ARG H H 85 8.040 8.040 8.836 -0.796 25800
3985 1 9 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.417 0.173 25800
3986 1 9 . 1 1 0 0 HIS C C 0 174.000 174.000 175.590 -1.590 25800
3987 1 9 . 1 1 0 0 HIS CA C 0 55.300 55.300 57.127 -1.827 25800
3988 1 9 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.049 -0.749 25800
3989 1 9 . 1 1 1 1 MET N N 1 122.400 122.400 114.304 8.096 25800
3990 1 9 . 1 1 1 1 MET HA H 1 4.340 4.340 4.151 0.189 25800
3991 1 9 . 1 1 1 1 MET C C 1 175.600 175.600 175.405 0.195 25800
3992 1 9 . 1 1 1 1 MET CA C 1 55.600 55.600 55.527 0.073 25800
3993 1 9 . 1 1 1 1 MET CB C 1 32.800 32.800 30.339 2.461 25800
3994 1 9 . 1 1 1 1 MET H H 1 8.310 8.310 8.487 -0.177 25800
3995 1 9 . 1 1 2 2 VAL N N 2 123.200 123.200 120.390 2.810 25800
3996 1 9 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.015 -0.055 25800
3997 1 9 . 1 1 2 2 VAL C C 2 175.600 175.600 175.446 0.154 25800
3998 1 9 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.976 -0.676 25800
3999 1 9 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.487 -0.187 25800
4000 1 9 . 1 1 2 2 VAL H H 2 8.180 8.180 7.861 0.319 25800
4001 1 9 . 1 1 3 3 ILE N N 3 126.200 126.200 123.075 3.125 25800
4002 1 9 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.553 -0.503 25800
4003 1 9 . 1 1 3 3 ILE C C 3 175.800 175.800 175.100 0.700 25800
4004 1 9 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.331 0.369 25800
4005 1 9 . 1 1 3 3 ILE CB C 3 38.300 38.300 40.027 -1.727 25800
4006 1 9 . 1 1 3 3 ILE H H 3 8.230 8.230 7.926 0.304 25800
4007 1 9 . 1 1 4 4 ARG N N 4 126.100 126.100 123.295 2.805 25800
4008 1 9 . 1 1 4 4 ARG HA H 4 4.180 4.180 3.980 0.200 25800
4009 1 9 . 1 1 4 4 ARG C C 4 175.900 175.900 175.831 0.069 25800
4010 1 9 . 1 1 4 4 ARG CA C 4 56.000 56.000 57.269 -1.269 25800
4011 1 9 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.044 0.655 25800
4012 1 9 . 1 1 4 4 ARG H H 4 8.360 8.360 8.670 -0.310 25800
4013 1 9 . 1 1 5 5 GLU N N 5 122.200 122.200 117.248 4.952 25800
4014 1 9 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.074 0.066 25800
4015 1 9 . 1 1 5 5 GLU C C 5 176.100 176.100 175.308 0.792 25800
4016 1 9 . 1 1 5 5 GLU CA C 5 56.600 56.600 58.516 -1.916 25800
4017 1 9 . 1 1 5 5 GLU CB C 5 30.300 30.300 28.303 1.997 25800
4018 1 9 . 1 1 5 5 GLU H H 5 8.400 8.400 8.681 -0.281 25800
4019 1 9 . 1 1 6 6 SER N N 6 116.200 116.200 113.212 2.988 25800
4020 1 9 . 1 1 6 6 SER HA H 6 4.350 4.350 4.645 -0.295 25800
4021 1 9 . 1 1 6 6 SER C C 6 174.300 174.300 173.212 1.088 25800
4022 1 9 . 1 1 6 6 SER CA C 6 58.200 58.200 57.461 0.739 25800
4023 1 9 . 1 1 6 6 SER CB C 6 63.800 63.800 64.768 -0.968 25800
4024 1 9 . 1 1 6 6 SER H H 6 8.270 8.270 7.620 0.650 25800
4025 1 9 . 1 1 7 7 VAL N N 7 119.800 119.800 121.792 -1.992 25800
4026 1 9 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.366 -0.066 25800
4027 1 9 . 1 1 7 7 VAL C C 7 175.500 175.500 174.899 0.601 25800
4028 1 9 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.892 -0.192 25800
4029 1 9 . 1 1 7 7 VAL CB C 7 32.800 32.800 34.873 -2.073 25800
4030 1 9 . 1 1 7 7 VAL H H 7 7.840 7.840 8.462 -0.622 25800
4031 1 9 . 1 1 8 8 SER N N 8 117.800 117.800 125.805 -8.005 25800
4032 1 9 . 1 1 8 8 SER HA H 8 4.240 4.240 4.532 -0.292 25800
4033 1 9 . 1 1 8 8 SER C C 8 172.500 172.500 173.739 -1.239 25800
4034 1 9 . 1 1 8 8 SER CA C 8 58.500 58.500 57.770 0.730 25800
4035 1 9 . 1 1 8 8 SER CB C 8 63.600 63.600 62.009 1.591 25800
4036 1 9 . 1 1 8 8 SER H H 8 8.530 8.530 8.952 -0.422 25800
4037 1 9 . 1 1 9 9 ARG N N 9 123.000 123.000 124.571 -1.571 25800
4038 1 9 . 1 1 9 9 ARG HA H 9 5.500 5.500 4.526 0.974 25800
4039 1 9 . 1 1 9 9 ARG C C 9 175.000 175.000 176.056 -1.056 25800
4040 1 9 . 1 1 9 9 ARG CA C 9 54.300 54.300 56.187 -1.887 25800
4041 1 9 . 1 1 9 9 ARG CB C 9 33.400 33.400 30.758 2.642 25800
4042 1 9 . 1 1 9 9 ARG H H 9 7.350 7.350 7.873 -0.523 25800
4043 1 9 . 1 1 10 10 ILE N N 10 114.000 114.000 124.274 -10.274 25800
4044 1 9 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.040 0.780 25800
4045 1 9 . 1 1 10 10 ILE C C 10 173.000 173.000 175.027 -2.027 25800
4046 1 9 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.304 -1.904 25800
4047 1 9 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.279 1.621 25800
4048 1 9 . 1 1 10 10 ILE H H 10 8.830 8.830 8.688 0.142 25800
4049 1 9 . 1 1 11 11 TYR N N 11 123.400 123.400 125.200 -1.800 25800
4050 1 9 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.251 -0.321 25800
4051 1 9 . 1 1 11 11 TYR C C 11 173.000 173.000 173.212 -0.212 25800
4052 1 9 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.971 0.029 25800
4053 1 9 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.326 -1.426 25800
4054 1 9 . 1 1 11 11 TYR H H 11 8.690 8.690 8.080 0.610 25800
4055 1 9 . 1 1 12 12 VAL N N 12 126.300 126.300 124.544 1.756 25800
4056 1 9 . 1 1 12 12 VAL HA H 12 4.560 4.560 3.927 0.633 25800
4057 1 9 . 1 1 12 12 VAL C C 12 174.100 174.100 173.708 0.392 25800
4058 1 9 . 1 1 12 12 VAL CA C 12 60.200 60.200 61.004 -0.804 25800
4059 1 9 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.681 -2.281 25800
4060 1 9 . 1 1 12 12 VAL H H 12 8.370 8.370 7.818 0.552 25800
4061 1 9 . 1 1 13 13 GLY N N 13 113.000 113.000 110.925 2.075 25800
4062 1 9 . 1 1 13 13 GLY C C 13 173.100 173.100 173.129 -0.029 25800
4063 1 9 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.438 -0.138 25800
4064 1 9 . 1 1 13 13 GLY H H 13 9.350 9.350 8.559 0.791 25800
4065 1 9 . 1 1 14 14 ASN N N 14 113.900 113.900 120.143 -6.243 25800
4066 1 9 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.238 0.042 25800
4067 1 9 . 1 1 14 14 ASN C C 14 175.800 175.800 175.055 0.745 25800
4068 1 9 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.837 -0.236 25800
4069 1 9 . 1 1 14 14 ASN CB C 14 37.700 37.700 38.334 -0.634 25800
4070 1 9 . 1 1 14 14 ASN H H 14 8.800 8.800 8.476 0.324 25800
4071 1 9 . 1 1 15 15 LEU N N 15 115.800 115.800 115.955 -0.155 25800
4072 1 9 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.559 0.431 25800
4073 1 9 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.056 2.544 25800
4074 1 9 . 1 1 15 15 LEU CB C 15 41.600 41.600 40.635 0.965 25800
4075 1 9 . 1 1 15 15 LEU H H 15 7.150 7.150 7.373 -0.223 25800
4076 1 9 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.395 -0.325 25800
4077 1 9 . 1 1 16 16 PRO C C 16 171.500 171.500 177.059 -5.559 25800
4078 1 9 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.179 -0.679 25800
4079 1 9 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.407 0.594 25800
4080 1 9 . 1 1 17 17 SER N N 17 115.200 115.200 117.216 -2.016 25800
4081 1 9 . 1 1 17 17 SER HA H 17 4.300 4.300 4.073 0.227 25800
4082 1 9 . 1 1 17 17 SER C C 17 174.200 174.200 173.951 0.249 25800
4083 1 9 . 1 1 17 17 SER CA C 17 58.200 58.200 58.186 0.014 25800
4084 1 9 . 1 1 17 17 SER CB C 17 63.900 63.900 63.613 0.287 25800
4085 1 9 . 1 1 17 17 SER H H 17 8.470 8.470 8.581 -0.111 25800
4086 1 9 . 1 1 18 18 HIS N N 18 120.800 120.800 121.725 -0.925 25800
4087 1 9 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.571 -0.021 25800
4088 1 9 . 1 1 18 18 HIS C C 18 175.100 175.100 175.622 -0.522 25800
4089 1 9 . 1 1 18 18 HIS CA C 18 55.500 55.500 54.964 0.536 25800
4090 1 9 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.385 -0.085 25800
4091 1 9 . 1 1 18 18 HIS H H 18 8.540 8.540 8.409 0.131 25800
4092 1 9 . 1 1 19 19 VAL N N 19 115.700 115.700 123.341 -7.641 25800
4093 1 9 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.180 0.080 25800
4094 1 9 . 1 1 19 19 VAL C C 19 174.000 174.000 175.034 -1.034 25800
4095 1 9 . 1 1 19 19 VAL CA C 19 61.900 61.900 62.620 -0.720 25800
4096 1 9 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.749 -0.150 25800
4097 1 9 . 1 1 19 19 VAL H H 19 6.650 6.650 7.711 -1.061 25800
4098 1 9 . 1 1 20 20 SER N N 20 118.800 118.800 120.299 -1.499 25800
4099 1 9 . 1 1 20 20 SER HA H 20 4.710 4.710 4.603 0.107 25800
4100 1 9 . 1 1 20 20 SER C C 20 175.900 175.900 175.586 0.314 25800
4101 1 9 . 1 1 20 20 SER CA C 20 55.800 55.800 57.314 -1.514 25800
4102 1 9 . 1 1 20 20 SER CB C 20 66.600 66.600 64.517 2.083 25800
4103 1 9 . 1 1 20 20 SER H H 20 8.930 8.930 8.484 0.446 25800
4104 1 9 . 1 1 21 21 SER N N 21 117.100 117.100 122.004 -4.904 25800
4105 1 9 . 1 1 21 21 SER HA H 21 3.880 3.880 4.118 -0.238 25800
4106 1 9 . 1 1 21 21 SER C C 21 176.200 176.200 176.217 -0.017 25800
4107 1 9 . 1 1 21 21 SER CA C 21 62.300 62.300 62.163 0.137 25800
4108 1 9 . 1 1 21 21 SER CB C 21 66.800 66.800 62.939 3.861 25800
4109 1 9 . 1 1 21 21 SER H H 21 9.080 9.080 9.179 -0.099 25800
4110 1 9 . 1 1 22 22 ARG N N 22 121.200 121.200 120.145 1.055 25800
4111 1 9 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.202 -0.212 25800
4112 1 9 . 1 1 22 22 ARG C C 22 177.900 177.900 178.396 -0.496 25800
4113 1 9 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.070 -0.370 25800
4114 1 9 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.741 -0.141 25800
4115 1 9 . 1 1 22 22 ARG H H 22 7.940 7.940 8.453 -0.513 25800
4116 1 9 . 1 1 23 23 ASP N N 23 118.800 118.800 120.848 -2.048 25800
4117 1 9 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.556 -0.166 25800
4118 1 9 . 1 1 23 23 ASP C C 23 179.200 179.200 178.529 0.671 25800
4119 1 9 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.943 0.357 25800
4120 1 9 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.311 0.689 25800
4121 1 9 . 1 1 23 23 ASP H H 23 7.480 7.480 7.779 -0.299 25800
4122 1 9 . 1 1 24 24 VAL N N 24 119.500 119.500 120.642 -1.142 25800
4123 1 9 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.741 -0.371 25800
4124 1 9 . 1 1 24 24 VAL C C 24 177.500 177.500 177.593 -0.093 25800
4125 1 9 . 1 1 24 24 VAL CA C 24 66.900 66.900 67.057 -0.157 25800
4126 1 9 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.552 -0.152 25800
4127 1 9 . 1 1 24 24 VAL H H 24 7.450 7.450 8.123 -0.673 25800
4128 1 9 . 1 1 25 25 GLU N N 25 121.400 121.400 119.844 1.556 25800
4129 1 9 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.002 -0.432 25800
4130 1 9 . 1 1 25 25 GLU C C 25 178.400 178.400 178.744 -0.344 25800
4131 1 9 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.014 0.585 25800
4132 1 9 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.335 0.265 25800
4133 1 9 . 1 1 25 25 GLU H H 25 8.580 8.580 8.335 0.245 25800
4134 1 9 . 1 1 26 26 ASN N N 26 114.800 114.800 117.480 -2.680 25800
4135 1 9 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.530 -0.210 25800
4136 1 9 . 1 1 26 26 ASN C C 26 177.400 177.400 177.460 -0.060 25800
4137 1 9 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.904 -0.004 25800
4138 1 9 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.678 -0.778 25800
4139 1 9 . 1 1 26 26 ASN H H 26 8.180 8.180 8.014 0.166 25800
4140 1 9 . 1 1 27 27 GLU N N 27 118.900 118.900 120.172 -1.272 25800
4141 1 9 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.126 0.014 25800
4142 1 9 . 1 1 27 27 GLU C C 27 176.400 176.400 178.898 -2.498 25800
4143 1 9 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.987 -1.587 25800
4144 1 9 . 1 1 27 27 GLU CB C 27 29.400 29.400 30.054 -0.654 25800
4145 1 9 . 1 1 27 27 GLU H H 27 7.340 7.340 7.929 -0.589 25800
4146 1 9 . 1 1 28 28 PHE N N 28 114.100 114.100 119.367 -5.267 25800
4147 1 9 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.492 0.059 25800
4148 1 9 . 1 1 28 28 PHE C C 28 176.300 176.300 177.139 -0.839 25800
4149 1 9 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.083 -1.083 25800
4150 1 9 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.728 1.072 25800
4151 1 9 . 1 1 28 28 PHE H H 28 7.660 7.660 8.583 -0.923 25800
4152 1 9 . 1 1 29 29 ARG N N 29 121.700 121.700 118.435 3.265 25800
4153 1 9 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.693 -0.283 25800
4154 1 9 . 1 1 29 29 ARG C C 29 177.100 177.100 176.741 0.359 25800
4155 1 9 . 1 1 29 29 ARG CA C 29 58.200 58.200 56.375 1.825 25800
4156 1 9 . 1 1 29 29 ARG CB C 29 29.300 29.300 28.976 0.324 25800
4157 1 9 . 1 1 29 29 ARG H H 29 8.120 8.120 8.015 0.105 25800
4158 1 9 . 1 1 30 30 LYS N N 30 117.200 117.200 118.832 -1.632 25800
4159 1 9 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.041 -0.211 25800
4160 1 9 . 1 1 30 30 LYS C C 30 177.100 177.100 177.615 -0.515 25800
4161 1 9 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.966 -0.166 25800
4162 1 9 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.496 -0.396 25800
4163 1 9 . 1 1 30 30 LYS H H 30 7.630 7.630 7.977 -0.347 25800
4164 1 9 . 1 1 31 31 TYR N N 31 117.100 117.100 118.659 -1.559 25800
4165 1 9 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.608 -0.458 25800
4166 1 9 . 1 1 31 31 TYR C C 31 174.400 174.400 176.430 -2.030 25800
4167 1 9 . 1 1 31 31 TYR CA C 31 59.900 59.900 58.799 1.101 25800
4168 1 9 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.910 -2.010 25800
4169 1 9 . 1 1 31 31 TYR H H 31 7.410 7.410 7.664 -0.254 25800
4170 1 9 . 1 1 32 32 GLY N N 32 104.100 104.100 105.489 -1.389 25800
4171 1 9 . 1 1 32 32 GLY C C 32 177.000 177.000 171.705 5.295 25800
4172 1 9 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.353 -0.853 25800
4173 1 9 . 1 1 32 32 GLY H H 32 7.240 7.240 7.727 -0.487 25800
4174 1 9 . 1 1 33 33 ASN N N 33 115.300 115.300 118.406 -3.106 25800
4175 1 9 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.764 -0.324 25800
4176 1 9 . 1 1 33 33 ASN C C 33 175.500 175.500 174.013 1.487 25800
4177 1 9 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.651 1.649 25800
4178 1 9 . 1 1 33 33 ASN CB C 33 38.400 38.400 40.003 -1.603 25800
4179 1 9 . 1 1 33 33 ASN H H 33 8.460 8.460 8.676 -0.216 25800
4180 1 9 . 1 1 34 34 ILE N N 34 126.700 126.700 123.618 3.082 25800
4181 1 9 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.331 -0.541 25800
4182 1 9 . 1 1 34 34 ILE C C 34 175.600 175.600 175.146 0.454 25800
4183 1 9 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.437 0.863 25800
4184 1 9 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.954 1.046 25800
4185 1 9 . 1 1 34 34 ILE H H 34 8.050 8.050 8.147 -0.097 25800
4186 1 9 . 1 1 35 35 LEU N N 35 127.400 127.400 127.774 -0.374 25800
4187 1 9 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.489 -0.329 25800
4188 1 9 . 1 1 35 35 LEU C C 35 177.200 177.200 176.518 0.682 25800
4189 1 9 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.605 -0.105 25800
4190 1 9 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.632 0.068 25800
4191 1 9 . 1 1 35 35 LEU H H 35 8.780 8.780 8.986 -0.206 25800
4192 1 9 . 1 1 36 36 LYS N N 36 117.000 117.000 118.534 -1.534 25800
4193 1 9 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.626 -0.386 25800
4194 1 9 . 1 1 36 36 LYS C C 36 173.600 173.600 174.314 -0.714 25800
4195 1 9 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.974 -0.074 25800
4196 1 9 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.087 0.513 25800
4197 1 9 . 1 1 36 36 LYS H H 36 7.110 7.110 7.711 -0.601 25800
4198 1 9 . 1 1 37 37 CYS N N 37 125.400 125.400 121.085 4.315 25800
4199 1 9 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.660 -0.960 25800
4200 1 9 . 1 1 37 37 CYS C C 37 171.600 171.600 173.145 -1.545 25800
4201 1 9 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.271 1.629 25800
4202 1 9 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.508 -4.408 25800
4203 1 9 . 1 1 37 37 CYS H H 37 8.610 8.610 8.543 0.067 25800
4204 1 9 . 1 1 38 38 ASP N N 38 128.200 128.200 121.235 6.965 25800
4205 1 9 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.074 -0.124 25800
4206 1 9 . 1 1 38 38 ASP C C 38 174.300 174.300 174.275 0.025 25800
4207 1 9 . 1 1 38 38 ASP CA C 38 53.200 53.200 54.599 -1.399 25800
4208 1 9 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.800 -1.500 25800
4209 1 9 . 1 1 38 38 ASP H H 38 8.290 8.290 9.078 -0.788 25800
4210 1 9 . 1 1 39 39 VAL N N 39 123.500 123.500 120.863 2.637 25800
4211 1 9 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.109 -0.809 25800
4212 1 9 . 1 1 39 39 VAL C C 39 175.000 175.000 175.044 -0.044 25800
4213 1 9 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.063 0.637 25800
4214 1 9 . 1 1 39 39 VAL CB C 39 33.100 33.100 35.126 -2.026 25800
4215 1 9 . 1 1 39 39 VAL H H 39 8.380 8.380 8.636 -0.256 25800
4216 1 9 . 1 1 40 40 LYS N N 40 129.100 129.100 124.483 4.617 25800
4217 1 9 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.937 -0.617 25800
4218 1 9 . 1 1 40 40 LYS C C 40 173.700 173.700 174.363 -0.663 25800
4219 1 9 . 1 1 40 40 LYS CA C 40 53.900 53.900 53.968 -0.068 25800
4220 1 9 . 1 1 40 40 LYS CB C 40 35.500 35.500 36.794 -1.294 25800
4221 1 9 . 1 1 40 40 LYS H H 40 8.680 8.680 9.508 -0.828 25800
4222 1 9 . 1 1 41 41 LYS N N 41 117.300 117.300 120.121 -2.821 25800
4223 1 9 . 1 1 41 41 LYS HA H 41 4.980 4.980 4.936 0.044 25800
4224 1 9 . 1 1 41 41 LYS C C 41 177.800 177.800 175.256 2.544 25800
4225 1 9 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.436 0.164 25800
4226 1 9 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.258 -0.258 25800
4227 1 9 . 1 1 41 41 LYS H H 41 7.900 7.900 8.437 -0.537 25800
4228 1 9 . 1 1 42 42 THR N N 42 113.200 113.200 114.115 -0.915 25800
4229 1 9 . 1 1 42 42 THR HA H 42 4.680 4.680 4.812 -0.132 25800
4230 1 9 . 1 1 42 42 THR C C 42 176.900 176.900 176.192 0.708 25800
4231 1 9 . 1 1 42 42 THR CA C 42 60.200 60.200 59.930 0.270 25800
4232 1 9 . 1 1 42 42 THR CB C 42 71.600 71.600 70.152 1.448 25800
4233 1 9 . 1 1 42 42 THR H H 42 8.730 8.730 8.130 0.600 25800
4234 1 9 . 1 1 43 43 VAL N N 43 120.000 120.000 123.073 -3.073 25800
4235 1 9 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.997 -0.077 25800
4236 1 9 . 1 1 43 43 VAL C C 43 177.000 177.000 176.217 0.783 25800
4237 1 9 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.299 0.401 25800
4238 1 9 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.745 0.055 25800
4239 1 9 . 1 1 43 43 VAL H H 43 8.730 8.730 8.563 0.167 25800
4240 1 9 . 1 1 44 44 SER N N 44 113.400 113.400 116.765 -3.365 25800
4241 1 9 . 1 1 44 44 SER HA H 44 4.360 4.360 4.334 0.026 25800
4242 1 9 . 1 1 44 44 SER C C 44 174.800 174.800 175.279 -0.479 25800
4243 1 9 . 1 1 44 44 SER CA C 44 58.400 58.400 58.675 -0.275 25800
4244 1 9 . 1 1 44 44 SER CB C 44 63.500 63.500 63.407 0.093 25800
4245 1 9 . 1 1 44 44 SER H H 44 7.760 7.760 7.896 -0.136 25800
4246 1 9 . 1 1 45 45 GLY N N 45 110.200 110.200 109.181 1.019 25800
4247 1 9 . 1 1 45 45 GLY C C 45 173.500 173.500 174.351 -0.851 25800
4248 1 9 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.831 0.469 25800
4249 1 9 . 1 1 45 45 GLY H H 45 7.820 7.820 7.765 0.055 25800
4250 1 9 . 1 1 46 46 ALA N N 46 123.900 123.900 122.051 1.849 25800
4251 1 9 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.239 0.151 25800
4252 1 9 . 1 1 46 46 ALA C C 46 176.100 176.100 175.256 0.844 25800
4253 1 9 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.701 0.199 25800
4254 1 9 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.248 -0.448 25800
4255 1 9 . 1 1 46 46 ALA H H 46 7.440 7.440 7.678 -0.238 25800
4256 1 9 . 1 1 47 47 ALA N N 47 123.100 123.100 121.934 1.166 25800
4257 1 9 . 1 1 47 47 ALA HA H 47 5.200 5.200 4.754 0.446 25800
4258 1 9 . 1 1 47 47 ALA C C 47 176.100 176.100 175.036 1.064 25800
4259 1 9 . 1 1 47 47 ALA CA C 47 50.900 50.900 49.922 0.978 25800
4260 1 9 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.180 -0.280 25800
4261 1 9 . 1 1 47 47 ALA H H 47 8.350 8.350 8.098 0.252 25800
4262 1 9 . 1 1 48 48 PHE N N 48 118.700 118.700 116.782 1.918 25800
4263 1 9 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.499 -0.469 25800
4264 1 9 . 1 1 48 48 PHE C C 48 171.600 171.600 173.988 -2.388 25800
4265 1 9 . 1 1 48 48 PHE CA C 48 55.700 55.700 55.890 -0.190 25800
4266 1 9 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.610 -2.410 25800
4267 1 9 . 1 1 48 48 PHE H H 48 8.550 8.550 8.702 -0.152 25800
4268 1 9 . 1 1 49 49 ALA N N 49 120.400 120.400 122.558 -2.158 25800
4269 1 9 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.230 0.100 25800
4270 1 9 . 1 1 49 49 ALA C C 49 175.500 175.500 174.801 0.699 25800
4271 1 9 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.265 -0.965 25800
4272 1 9 . 1 1 49 49 ALA CB C 49 23.700 23.700 22.440 1.260 25800
4273 1 9 . 1 1 49 49 ALA H H 49 9.240 9.240 8.640 0.600 25800
4274 1 9 . 1 1 50 50 PHE N N 50 115.000 115.000 119.185 -4.185 25800
4275 1 9 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.302 0.298 25800
4276 1 9 . 1 1 50 50 PHE C C 50 176.000 176.000 174.192 1.808 25800
4277 1 9 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.621 -0.121 25800
4278 1 9 . 1 1 50 50 PHE CB C 50 42.200 42.200 42.982 -0.782 25800
4279 1 9 . 1 1 50 50 PHE H H 50 7.920 7.920 9.146 -1.226 25800
4280 1 9 . 1 1 51 51 ILE N N 51 123.000 123.000 121.669 1.331 25800
4281 1 9 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.639 -0.189 25800
4282 1 9 . 1 1 51 51 ILE C C 51 173.700 173.700 174.432 -0.732 25800
4283 1 9 . 1 1 51 51 ILE CA C 51 60.200 60.200 61.015 -0.815 25800
4284 1 9 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.990 -1.290 25800
4285 1 9 . 1 1 51 51 ILE H H 51 8.490 8.490 8.477 0.013 25800
4286 1 9 . 1 1 52 52 GLU N N 52 126.600 126.600 127.384 -0.784 25800
4287 1 9 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.124 -0.354 25800
4288 1 9 . 1 1 52 52 GLU C C 52 175.300 175.300 175.320 -0.020 25800
4289 1 9 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.968 -0.268 25800
4290 1 9 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.473 0.027 25800
4291 1 9 . 1 1 52 52 GLU H H 52 8.610 8.610 9.281 -0.671 25800
4292 1 9 . 1 1 53 53 PHE N N 53 126.100 126.100 126.900 -0.800 25800
4293 1 9 . 1 1 53 53 PHE HA H 53 4.800 4.800 4.945 -0.145 25800
4294 1 9 . 1 1 53 53 PHE C C 53 175.400 175.400 176.448 -1.048 25800
4295 1 9 . 1 1 53 53 PHE CA C 53 58.200 58.200 57.036 1.164 25800
4296 1 9 . 1 1 53 53 PHE CB C 53 40.900 40.900 41.529 -0.628 25800
4297 1 9 . 1 1 53 53 PHE H H 53 8.800 8.800 9.049 -0.249 25800
4298 1 9 . 1 1 54 54 GLU N N 54 120.700 120.700 121.397 -0.697 25800
4299 1 9 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.120 -0.190 25800
4300 1 9 . 1 1 54 54 GLU C C 54 175.300 175.300 175.998 -0.698 25800
4301 1 9 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.959 1.141 25800
4302 1 9 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.065 0.735 25800
4303 1 9 . 1 1 54 54 GLU H H 54 8.160 8.160 8.433 -0.273 25800
4304 1 9 . 1 1 55 55 ASP N N 55 117.900 117.900 115.255 2.645 25800
4305 1 9 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.730 0.190 25800
4306 1 9 . 1 1 55 55 ASP C C 55 176.400 176.400 175.067 1.333 25800
4307 1 9 . 1 1 55 55 ASP CA C 55 52.400 52.400 52.759 -0.359 25800
4308 1 9 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.677 1.723 25800
4309 1 9 . 1 1 55 55 ASP H H 55 8.740 8.740 7.593 1.147 25800
4310 1 9 . 1 1 56 56 ALA N N 56 128.900 128.900 124.003 4.897 25800
4311 1 9 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.397 0.433 25800
4312 1 9 . 1 1 56 56 ALA C C 56 179.800 179.800 178.584 1.216 25800
4313 1 9 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.139 1.061 25800
4314 1 9 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.797 0.102 25800
4315 1 9 . 1 1 56 56 ALA H H 56 8.800 8.800 8.541 0.259 25800
4316 1 9 . 1 1 57 57 ARG N N 57 119.200 119.200 118.035 1.165 25800
4317 1 9 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.046 -0.156 25800
4318 1 9 . 1 1 57 57 ARG C C 57 178.000 178.000 176.815 1.185 25800
4319 1 9 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.630 0.270 25800
4320 1 9 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.111 0.189 25800
4321 1 9 . 1 1 57 57 ARG H H 57 8.950 8.950 8.496 0.454 25800
4322 1 9 . 1 1 58 58 ASP N N 58 120.900 120.900 120.034 0.866 25800
4323 1 9 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.486 -0.396 25800
4324 1 9 . 1 1 58 58 ASP C C 58 176.700 176.700 178.050 -1.350 25800
4325 1 9 . 1 1 58 58 ASP CA C 58 56.500 56.500 57.828 -1.328 25800
4326 1 9 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.614 -0.714 25800
4327 1 9 . 1 1 58 58 ASP H H 58 7.020 7.020 8.276 -1.256 25800
4328 1 9 . 1 1 59 59 ALA N N 59 119.700 119.700 121.796 -2.096 25800
4329 1 9 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.107 -1.027 25800
4330 1 9 . 1 1 59 59 ALA C C 59 178.100 178.100 178.626 -0.526 25800
4331 1 9 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.083 0.217 25800
4332 1 9 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.371 0.029 25800
4333 1 9 . 1 1 59 59 ALA H H 59 6.440 6.440 7.625 -1.185 25800
4334 1 9 . 1 1 60 60 ALA N N 60 117.600 117.600 120.889 -3.289 25800
4335 1 9 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.072 -0.242 25800
4336 1 9 . 1 1 60 60 ALA C C 60 180.900 180.900 178.924 1.976 25800
4337 1 9 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.083 -0.183 25800
4338 1 9 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.405 -0.705 25800
4339 1 9 . 1 1 60 60 ALA H H 60 7.330 7.330 8.289 -0.959 25800
4340 1 9 . 1 1 61 61 ASP N N 61 120.100 120.100 117.637 2.463 25800
4341 1 9 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.333 -0.123 25800
4342 1 9 . 1 1 61 61 ASP C C 61 176.700 176.700 177.420 -0.720 25800
4343 1 9 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.414 0.686 25800
4344 1 9 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.022 0.078 25800
4345 1 9 . 1 1 61 61 ASP H H 61 7.590 7.590 7.655 -0.065 25800
4346 1 9 . 1 1 62 62 ALA N N 62 122.200 122.200 122.763 -0.563 25800
4347 1 9 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.361 -1.941 25800
4348 1 9 . 1 1 62 62 ALA C C 62 179.300 179.300 179.165 0.135 25800
4349 1 9 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.251 0.349 25800
4350 1 9 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.830 0.270 25800
4351 1 9 . 1 1 62 62 ALA H H 62 7.440 7.440 7.200 0.240 25800
4352 1 9 . 1 1 63 63 ILE N N 63 116.700 116.700 118.617 -1.917 25800
4353 1 9 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.751 -0.511 25800
4354 1 9 . 1 1 63 63 ILE C C 63 177.800 177.800 176.895 0.905 25800
4355 1 9 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.650 1.950 25800
4356 1 9 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.970 0.930 25800
4357 1 9 . 1 1 63 63 ILE H H 63 7.540 7.540 7.638 -0.098 25800
4358 1 9 . 1 1 64 64 LYS N N 64 117.400 117.400 117.320 0.080 25800
4359 1 9 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.070 -0.170 25800
4360 1 9 . 1 1 64 64 LYS C C 64 178.900 178.900 177.968 0.932 25800
4361 1 9 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.290 0.510 25800
4362 1 9 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.750 0.850 25800
4363 1 9 . 1 1 64 64 LYS H H 64 7.490 7.490 7.494 -0.004 25800
4364 1 9 . 1 1 65 65 GLU N N 65 113.800 113.800 116.281 -2.481 25800
4365 1 9 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.244 -0.084 25800
4366 1 9 . 1 1 65 65 GLU C C 65 178.300 178.300 177.231 1.069 25800
4367 1 9 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.044 0.256 25800
4368 1 9 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.044 1.656 25800
4369 1 9 . 1 1 65 65 GLU H H 65 7.960 7.960 8.083 -0.123 25800
4370 1 9 . 1 1 66 66 LYS N N 66 114.700 114.700 118.702 -4.002 25800
4371 1 9 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.343 0.127 25800
4372 1 9 . 1 1 66 66 LYS C C 66 177.500 177.500 176.651 0.849 25800
4373 1 9 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.640 -1.240 25800
4374 1 9 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.341 0.659 25800
4375 1 9 . 1 1 66 66 LYS H H 66 8.050 8.050 7.483 0.567 25800
4376 1 9 . 1 1 67 67 ASP N N 67 118.800 118.800 119.859 -1.059 25800
4377 1 9 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.457 -0.237 25800
4378 1 9 . 1 1 67 67 ASP C C 67 177.700 177.700 177.296 0.404 25800
4379 1 9 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.439 3.961 25800
4380 1 9 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.163 0.237 25800
4381 1 9 . 1 1 67 67 ASP H H 67 7.620 7.620 7.495 0.125 25800
4382 1 9 . 1 1 68 68 GLY N N 68 115.600 115.600 107.907 7.693 25800
4383 1 9 . 1 1 68 68 GLY C C 68 173.800 173.800 174.386 -0.586 25800
4384 1 9 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.556 1.344 25800
4385 1 9 . 1 1 68 68 GLY H H 68 8.470 8.470 8.580 -0.110 25800
4386 1 9 . 1 1 69 69 CYS N N 69 119.200 119.200 120.506 -1.306 25800
4387 1 9 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.530 -0.370 25800
4388 1 9 . 1 1 69 69 CYS C C 69 172.600 172.600 173.468 -0.868 25800
4389 1 9 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.611 0.389 25800
4390 1 9 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.960 -0.260 25800
4391 1 9 . 1 1 69 69 CYS H H 69 7.890 7.890 8.146 -0.256 25800
4392 1 9 . 1 1 70 70 ASP N N 70 122.200 122.200 123.464 -1.264 25800
4393 1 9 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.664 0.166 25800
4394 1 9 . 1 1 70 70 ASP C C 70 176.400 176.400 174.694 1.706 25800
4395 1 9 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.342 1.358 25800
4396 1 9 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.127 -1.427 25800
4397 1 9 . 1 1 70 70 ASP H H 70 8.360 8.360 8.475 -0.115 25800
4398 1 9 . 1 1 71 71 PHE N N 71 127.600 127.600 117.922 9.678 25800
4399 1 9 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.022 -0.422 25800
4400 1 9 . 1 1 71 71 PHE C C 71 173.600 173.600 175.173 -1.573 25800
4401 1 9 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.009 -0.209 25800
4402 1 9 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.144 -0.444 25800
4403 1 9 . 1 1 71 71 PHE H H 71 9.390 9.390 7.501 1.889 25800
4404 1 9 . 1 1 72 72 GLU N N 72 123.900 123.900 118.728 5.172 25800
4405 1 9 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.171 -0.631 25800
4406 1 9 . 1 1 72 72 GLU C C 72 175.500 175.500 175.695 -0.195 25800
4407 1 9 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.079 -0.379 25800
4408 1 9 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.843 -1.543 25800
4409 1 9 . 1 1 72 72 GLU H H 72 8.940 8.940 9.160 -0.220 25800
4410 1 9 . 1 1 73 73 GLY N N 73 105.200 105.200 105.717 -0.517 25800
4411 1 9 . 1 1 73 73 GLY C C 73 174.100 174.100 174.533 -0.433 25800
4412 1 9 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.162 0.438 25800
4413 1 9 . 1 1 73 73 GLY H H 73 8.350 8.350 8.053 0.297 25800
4414 1 9 . 1 1 74 74 ASN N N 74 121.000 121.000 121.474 -0.474 25800
4415 1 9 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.747 0.013 25800
4416 1 9 . 1 1 74 74 ASN C C 74 174.000 174.000 173.997 0.003 25800
4417 1 9 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.438 -2.538 25800
4418 1 9 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.263 0.437 25800
4419 1 9 . 1 1 74 74 ASN H H 74 7.740 7.740 8.492 -0.752 25800
4420 1 9 . 1 1 75 75 LYS N N 75 121.400 121.400 119.748 1.652 25800
4421 1 9 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.755 -0.285 25800
4422 1 9 . 1 1 75 75 LYS C C 75 176.900 176.900 175.021 1.879 25800
4423 1 9 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.204 -0.904 25800
4424 1 9 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.959 -2.059 25800
4425 1 9 . 1 1 75 75 LYS H H 75 8.380 8.380 8.289 0.091 25800
4426 1 9 . 1 1 76 76 LEU N N 76 127.400 127.400 125.024 2.376 25800
4427 1 9 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.576 -0.146 25800
4428 1 9 . 1 1 76 76 LEU C C 76 177.600 177.600 174.265 3.335 25800
4429 1 9 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.121 0.179 25800
4430 1 9 . 1 1 76 76 LEU CB C 76 43.100 43.100 47.158 -4.058 25800
4431 1 9 . 1 1 76 76 LEU H H 76 8.950 8.950 8.448 0.502 25800
4432 1 9 . 1 1 77 77 ARG N N 77 121.800 121.800 123.238 -1.438 25800
4433 1 9 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.848 0.052 25800
4434 1 9 . 1 1 77 77 ARG C C 77 174.700 174.700 173.414 1.286 25800
4435 1 9 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.777 -1.777 25800
4436 1 9 . 1 1 77 77 ARG CB C 77 32.300 32.300 33.861 -1.560 25800
4437 1 9 . 1 1 77 77 ARG H H 77 7.530 7.530 8.746 -1.216 25800
4438 1 9 . 1 1 78 78 VAL N N 78 127.000 127.000 121.224 5.776 25800
4439 1 9 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.303 0.977 25800
4440 1 9 . 1 1 78 78 VAL C C 78 174.200 174.200 174.169 0.031 25800
4441 1 9 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.916 0.284 25800
4442 1 9 . 1 1 78 78 VAL CB C 78 33.400 33.400 33.848 -0.448 25800
4443 1 9 . 1 1 78 78 VAL H H 78 9.660 9.660 8.483 1.177 25800
4444 1 9 . 1 1 79 79 GLU N N 79 121.900 121.900 126.397 -4.497 25800
4445 1 9 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.534 0.176 25800
4446 1 9 . 1 1 79 79 GLU C C 79 174.600 174.600 173.814 0.786 25800
4447 1 9 . 1 1 79 79 GLU CA C 79 53.900 53.900 56.069 -2.169 25800
4448 1 9 . 1 1 79 79 GLU CB C 79 34.400 34.400 33.785 0.615 25800
4449 1 9 . 1 1 79 79 GLU H H 79 8.980 8.980 7.919 1.061 25800
4450 1 9 . 1 1 80 80 VAL N N 80 121.300 121.300 123.794 -2.494 25800
4451 1 9 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.407 -0.037 25800
4452 1 9 . 1 1 80 80 VAL CA C 80 61.000 61.000 57.942 3.058 25800
4453 1 9 . 1 1 80 80 VAL CB C 80 32.100 32.100 34.526 -2.426 25800
4454 1 9 . 1 1 80 80 VAL H H 80 8.410 8.410 9.062 -0.652 25800
4455 1 9 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.646 -0.386 25800
4456 1 9 . 1 1 81 81 PRO C C 81 176.100 176.100 175.939 0.161 25800
4457 1 9 . 1 1 81 81 PRO CA C 81 63.100 63.100 62.725 0.375 25800
4458 1 9 . 1 1 81 81 PRO CB C 81 32.100 32.100 29.867 2.233 25800
4459 1 9 . 1 1 82 82 PHE N N 82 122.200 122.200 120.122 2.078 25800
4460 1 9 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.418 -0.128 25800
4461 1 9 . 1 1 82 82 PHE C C 82 175.300 175.300 176.432 -1.132 25800
4462 1 9 . 1 1 82 82 PHE CA C 82 58.100 58.100 56.636 1.464 25800
4463 1 9 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.569 0.831 25800
4464 1 9 . 1 1 82 82 PHE H H 82 8.150 8.150 7.818 0.332 25800
4465 1 9 . 1 1 83 83 ASN N N 83 120.800 120.800 115.620 5.180 25800
4466 1 9 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.350 0.090 25800
4467 1 9 . 1 1 83 83 ASN C C 83 174.100 174.100 174.396 -0.296 25800
4468 1 9 . 1 1 83 83 ASN CA C 83 52.700 52.700 54.151 -1.451 25800
4469 1 9 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.151 0.549 25800
4470 1 9 . 1 1 83 83 ASN H H 83 8.110 8.110 8.544 -0.434 25800
4471 1 9 . 1 1 84 84 ALA N N 84 123.700 123.700 118.582 5.118 25800
4472 1 9 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.491 -0.411 25800
4473 1 9 . 1 1 84 84 ALA C C 84 177.100 177.100 176.967 0.133 25800
4474 1 9 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.883 -0.483 25800
4475 1 9 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.090 -0.990 25800
4476 1 9 . 1 1 84 84 ALA H H 84 8.020 8.020 8.572 -0.552 25800
4477 1 9 . 1 1 85 85 ARG N N 85 120.200 120.200 118.875 1.325 25800
4478 1 9 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.523 -0.373 25800
4479 1 9 . 1 1 85 85 ARG C C 85 175.200 175.200 176.538 -1.338 25800
4480 1 9 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.771 0.229 25800
4481 1 9 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.848 -0.048 25800
4482 1 9 . 1 1 85 85 ARG H H 85 8.040 8.040 8.492 -0.452 25800
4483 1 10 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.758 -0.168 25800
4484 1 10 . 1 1 0 0 HIS C C 0 174.000 174.000 174.053 -0.053 25800
4485 1 10 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.072 -0.772 25800
4486 1 10 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.092 -0.792 25800
4487 1 10 . 1 1 1 1 MET N N 1 122.400 122.400 121.958 0.442 25800
4488 1 10 . 1 1 1 1 MET HA H 1 4.340 4.340 4.543 -0.203 25800
4489 1 10 . 1 1 1 1 MET C C 1 175.600 175.600 176.530 -0.930 25800
4490 1 10 . 1 1 1 1 MET CA C 1 55.600 55.600 55.282 0.318 25800
4491 1 10 . 1 1 1 1 MET CB C 1 32.800 32.800 33.752 -0.952 25800
4492 1 10 . 1 1 1 1 MET H H 1 8.310 8.310 7.586 0.724 25800
4493 1 10 . 1 1 2 2 VAL N N 2 123.200 123.200 125.487 -2.287 25800
4494 1 10 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.060 -0.100 25800
4495 1 10 . 1 1 2 2 VAL C C 2 175.600 175.600 174.982 0.618 25800
4496 1 10 . 1 1 2 2 VAL CA C 2 62.300 62.300 63.040 -0.740 25800
4497 1 10 . 1 1 2 2 VAL CB C 2 32.300 32.300 30.085 2.215 25800
4498 1 10 . 1 1 2 2 VAL H H 2 8.180 8.180 8.451 -0.271 25800
4499 1 10 . 1 1 3 3 ILE N N 3 126.200 126.200 123.940 2.260 25800
4500 1 10 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.371 -0.321 25800
4501 1 10 . 1 1 3 3 ILE C C 3 175.800 175.800 176.528 -0.728 25800
4502 1 10 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.099 0.601 25800
4503 1 10 . 1 1 3 3 ILE CB C 3 38.300 38.300 39.327 -1.026 25800
4504 1 10 . 1 1 3 3 ILE H H 3 8.230 8.230 8.081 0.149 25800
4505 1 10 . 1 1 4 4 ARG N N 4 126.100 126.100 129.241 -3.141 25800
4506 1 10 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.114 0.066 25800
4507 1 10 . 1 1 4 4 ARG C C 4 175.900 175.900 176.674 -0.774 25800
4508 1 10 . 1 1 4 4 ARG CA C 4 56.000 56.000 58.410 -2.410 25800
4509 1 10 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.463 0.237 25800
4510 1 10 . 1 1 4 4 ARG H H 4 8.360 8.360 8.847 -0.487 25800
4511 1 10 . 1 1 5 5 GLU N N 5 122.200 122.200 118.083 4.117 25800
4512 1 10 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.338 -0.198 25800
4513 1 10 . 1 1 5 5 GLU C C 5 176.100 176.100 175.921 0.179 25800
4514 1 10 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.578 1.022 25800
4515 1 10 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.333 0.967 25800
4516 1 10 . 1 1 5 5 GLU H H 5 8.400 8.400 8.306 0.094 25800
4517 1 10 . 1 1 6 6 SER N N 6 116.200 116.200 114.481 1.719 25800
4518 1 10 . 1 1 6 6 SER HA H 6 4.350 4.350 3.965 0.385 25800
4519 1 10 . 1 1 6 6 SER C C 6 174.300 174.300 172.720 1.580 25800
4520 1 10 . 1 1 6 6 SER CA C 6 58.200 58.200 58.776 -0.576 25800
4521 1 10 . 1 1 6 6 SER CB C 6 63.800 63.800 63.433 0.367 25800
4522 1 10 . 1 1 6 6 SER H H 6 8.270 8.270 7.671 0.599 25800
4523 1 10 . 1 1 7 7 VAL N N 7 119.800 119.800 120.421 -0.621 25800
4524 1 10 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.359 -0.059 25800
4525 1 10 . 1 1 7 7 VAL C C 7 175.500 175.500 174.497 1.003 25800
4526 1 10 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.470 0.230 25800
4527 1 10 . 1 1 7 7 VAL CB C 7 32.800 32.800 35.050 -2.250 25800
4528 1 10 . 1 1 7 7 VAL H H 7 7.840 7.840 8.145 -0.305 25800
4529 1 10 . 1 1 8 8 SER N N 8 117.800 117.800 122.879 -5.079 25800
4530 1 10 . 1 1 8 8 SER HA H 8 4.240 4.240 4.746 -0.506 25800
4531 1 10 . 1 1 8 8 SER C C 8 172.500 172.500 173.205 -0.705 25800
4532 1 10 . 1 1 8 8 SER CA C 8 58.500 58.500 58.094 0.406 25800
4533 1 10 . 1 1 8 8 SER CB C 8 63.600 63.600 63.093 0.507 25800
4534 1 10 . 1 1 8 8 SER H H 8 8.530 8.530 8.731 -0.201 25800
4535 1 10 . 1 1 9 9 ARG N N 9 123.000 123.000 124.737 -1.737 25800
4536 1 10 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.182 0.318 25800
4537 1 10 . 1 1 9 9 ARG C C 9 175.000 175.000 174.828 0.172 25800
4538 1 10 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.959 -0.659 25800
4539 1 10 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.092 0.308 25800
4540 1 10 . 1 1 9 9 ARG H H 9 7.350 7.350 8.639 -1.289 25800
4541 1 10 . 1 1 10 10 ILE N N 10 114.000 114.000 121.968 -7.968 25800
4542 1 10 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.186 0.634 25800
4543 1 10 . 1 1 10 10 ILE C C 10 173.000 173.000 174.241 -1.241 25800
4544 1 10 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.307 -1.907 25800
4545 1 10 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.349 1.551 25800
4546 1 10 . 1 1 10 10 ILE H H 10 8.830 8.830 8.703 0.127 25800
4547 1 10 . 1 1 11 11 TYR N N 11 123.400 123.400 128.331 -4.931 25800
4548 1 10 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.010 -0.080 25800
4549 1 10 . 1 1 11 11 TYR C C 11 173.000 173.000 173.315 -0.315 25800
4550 1 10 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.566 0.434 25800
4551 1 10 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.392 -0.492 25800
4552 1 10 . 1 1 11 11 TYR H H 11 8.690 8.690 7.978 0.712 25800
4553 1 10 . 1 1 12 12 VAL N N 12 126.300 126.300 121.878 4.422 25800
4554 1 10 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.471 0.089 25800
4555 1 10 . 1 1 12 12 VAL C C 12 174.100 174.100 173.462 0.638 25800
4556 1 10 . 1 1 12 12 VAL CA C 12 60.200 60.200 58.976 1.224 25800
4557 1 10 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.095 -1.695 25800
4558 1 10 . 1 1 12 12 VAL H H 12 8.370 8.370 8.086 0.284 25800
4559 1 10 . 1 1 13 13 GLY N N 13 113.000 113.000 109.426 3.574 25800
4560 1 10 . 1 1 13 13 GLY C C 13 173.100 173.100 173.267 -0.167 25800
4561 1 10 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.630 -0.330 25800
4562 1 10 . 1 1 13 13 GLY H H 13 9.350 9.350 8.473 0.877 25800
4563 1 10 . 1 1 14 14 ASN N N 14 113.900 113.900 114.925 -1.025 25800
4564 1 10 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.217 0.063 25800
4565 1 10 . 1 1 14 14 ASN C C 14 175.800 175.800 175.335 0.465 25800
4566 1 10 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.292 -0.692 25800
4567 1 10 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.942 0.758 25800
4568 1 10 . 1 1 14 14 ASN H H 14 8.800 8.800 8.163 0.637 25800
4569 1 10 . 1 1 15 15 LEU N N 15 115.800 115.800 116.139 -0.339 25800
4570 1 10 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.660 0.330 25800
4571 1 10 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.208 2.392 25800
4572 1 10 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.693 -0.093 25800
4573 1 10 . 1 1 15 15 LEU H H 15 7.150 7.150 7.189 -0.039 25800
4574 1 10 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.463 -0.393 25800
4575 1 10 . 1 1 16 16 PRO C C 16 171.500 171.500 176.596 -5.096 25800
4576 1 10 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.291 -0.791 25800
4577 1 10 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.393 0.607 25800
4578 1 10 . 1 1 17 17 SER N N 17 115.200 115.200 116.920 -1.720 25800
4579 1 10 . 1 1 17 17 SER HA H 17 4.300 4.300 4.082 0.218 25800
4580 1 10 . 1 1 17 17 SER C C 17 174.200 174.200 173.540 0.660 25800
4581 1 10 . 1 1 17 17 SER CA C 17 58.200 58.200 59.983 -1.783 25800
4582 1 10 . 1 1 17 17 SER CB C 17 63.900 63.900 62.489 1.411 25800
4583 1 10 . 1 1 17 17 SER H H 17 8.470 8.470 8.551 -0.081 25800
4584 1 10 . 1 1 18 18 HIS N N 18 120.800 120.800 119.689 1.111 25800
4585 1 10 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.763 -0.213 25800
4586 1 10 . 1 1 18 18 HIS C C 18 175.100 175.100 173.321 1.779 25800
4587 1 10 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.043 0.457 25800
4588 1 10 . 1 1 18 18 HIS CB C 18 29.300 29.300 31.470 -2.170 25800
4589 1 10 . 1 1 18 18 HIS H H 18 8.540 8.540 8.009 0.531 25800
4590 1 10 . 1 1 19 19 VAL N N 19 115.700 115.700 120.368 -4.668 25800
4591 1 10 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.307 -0.047 25800
4592 1 10 . 1 1 19 19 VAL C C 19 174.000 174.000 175.991 -1.991 25800
4593 1 10 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.367 0.533 25800
4594 1 10 . 1 1 19 19 VAL CB C 19 32.600 32.600 33.448 -0.848 25800
4595 1 10 . 1 1 19 19 VAL H H 19 6.650 6.650 8.246 -1.596 25800
4596 1 10 . 1 1 20 20 SER N N 20 118.800 118.800 120.976 -2.176 25800
4597 1 10 . 1 1 20 20 SER HA H 20 4.710 4.710 4.677 0.033 25800
4598 1 10 . 1 1 20 20 SER C C 20 175.900 175.900 175.488 0.412 25800
4599 1 10 . 1 1 20 20 SER CA C 20 55.800 55.800 57.854 -2.054 25800
4600 1 10 . 1 1 20 20 SER CB C 20 66.600 66.600 65.474 1.127 25800
4601 1 10 . 1 1 20 20 SER H H 20 8.930 8.930 8.719 0.211 25800
4602 1 10 . 1 1 21 21 SER N N 21 117.100 117.100 117.747 -0.647 25800
4603 1 10 . 1 1 21 21 SER HA H 21 3.880 3.880 4.225 -0.345 25800
4604 1 10 . 1 1 21 21 SER C C 21 176.200 176.200 176.530 -0.330 25800
4605 1 10 . 1 1 21 21 SER CA C 21 62.300 62.300 61.505 0.795 25800
4606 1 10 . 1 1 21 21 SER CB C 21 66.800 66.800 63.023 3.777 25800
4607 1 10 . 1 1 21 21 SER H H 21 9.080 9.080 8.921 0.159 25800
4608 1 10 . 1 1 22 22 ARG N N 22 121.200 121.200 120.693 0.507 25800
4609 1 10 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.222 -0.232 25800
4610 1 10 . 1 1 22 22 ARG C C 22 177.900 177.900 178.376 -0.476 25800
4611 1 10 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.947 -0.247 25800
4612 1 10 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.997 -0.397 25800
4613 1 10 . 1 1 22 22 ARG H H 22 7.940 7.940 7.502 0.438 25800
4614 1 10 . 1 1 23 23 ASP N N 23 118.800 118.800 120.934 -2.134 25800
4615 1 10 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.433 -0.043 25800
4616 1 10 . 1 1 23 23 ASP C C 23 179.200 179.200 178.837 0.363 25800
4617 1 10 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.538 -0.238 25800
4618 1 10 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.753 0.247 25800
4619 1 10 . 1 1 23 23 ASP H H 23 7.480 7.480 7.903 -0.423 25800
4620 1 10 . 1 1 24 24 VAL N N 24 119.500 119.500 119.998 -0.498 25800
4621 1 10 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.896 -0.526 25800
4622 1 10 . 1 1 24 24 VAL C C 24 177.500 177.500 177.163 0.337 25800
4623 1 10 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.048 0.852 25800
4624 1 10 . 1 1 24 24 VAL CB C 24 31.400 31.400 32.264 -0.864 25800
4625 1 10 . 1 1 24 24 VAL H H 24 7.450 7.450 8.236 -0.786 25800
4626 1 10 . 1 1 25 25 GLU N N 25 121.400 121.400 120.371 1.029 25800
4627 1 10 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.034 -0.464 25800
4628 1 10 . 1 1 25 25 GLU C C 25 178.400 178.400 178.768 -0.368 25800
4629 1 10 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.260 0.340 25800
4630 1 10 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.418 0.182 25800
4631 1 10 . 1 1 25 25 GLU H H 25 8.580 8.580 7.945 0.635 25800
4632 1 10 . 1 1 26 26 ASN N N 26 114.800 114.800 116.706 -1.906 25800
4633 1 10 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.512 -0.192 25800
4634 1 10 . 1 1 26 26 ASN C C 26 177.400 177.400 177.582 -0.182 25800
4635 1 10 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.535 0.365 25800
4636 1 10 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.237 -0.337 25800
4637 1 10 . 1 1 26 26 ASN H H 26 8.180 8.180 8.164 0.016 25800
4638 1 10 . 1 1 27 27 GLU N N 27 118.900 118.900 120.350 -1.450 25800
4639 1 10 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.184 -0.044 25800
4640 1 10 . 1 1 27 27 GLU C C 27 176.400 176.400 179.014 -2.614 25800
4641 1 10 . 1 1 27 27 GLU CA C 27 57.400 57.400 59.133 -1.733 25800
4642 1 10 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.961 -0.561 25800
4643 1 10 . 1 1 27 27 GLU H H 27 7.340 7.340 8.062 -0.722 25800
4644 1 10 . 1 1 28 28 PHE N N 28 114.100 114.100 118.345 -4.245 25800
4645 1 10 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.437 0.113 25800
4646 1 10 . 1 1 28 28 PHE C C 28 176.300 176.300 178.189 -1.889 25800
4647 1 10 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.797 -0.798 25800
4648 1 10 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.096 1.704 25800
4649 1 10 . 1 1 28 28 PHE H H 28 7.660 7.660 8.449 -0.789 25800
4650 1 10 . 1 1 29 29 ARG N N 29 121.700 121.700 120.506 1.194 25800
4651 1 10 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.293 0.117 25800
4652 1 10 . 1 1 29 29 ARG C C 29 177.100 177.100 177.160 -0.060 25800
4653 1 10 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.483 -0.283 25800
4654 1 10 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.484 -0.184 25800
4655 1 10 . 1 1 29 29 ARG H H 29 8.120 8.120 8.085 0.035 25800
4656 1 10 . 1 1 30 30 LYS N N 30 117.200 117.200 117.632 -0.432 25800
4657 1 10 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.195 -0.365 25800
4658 1 10 . 1 1 30 30 LYS C C 30 177.100 177.100 178.400 -1.300 25800
4659 1 10 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.824 -0.024 25800
4660 1 10 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.842 -0.742 25800
4661 1 10 . 1 1 30 30 LYS H H 30 7.630 7.630 7.712 -0.082 25800
4662 1 10 . 1 1 31 31 TYR N N 31 117.100 117.100 119.572 -2.472 25800
4663 1 10 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.507 -0.357 25800
4664 1 10 . 1 1 31 31 TYR C C 31 174.400 174.400 176.610 -2.210 25800
4665 1 10 . 1 1 31 31 TYR CA C 31 59.900 59.900 60.353 -0.453 25800
4666 1 10 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.796 -1.896 25800
4667 1 10 . 1 1 31 31 TYR H H 31 7.410 7.410 8.131 -0.721 25800
4668 1 10 . 1 1 32 32 GLY N N 32 104.100 104.100 104.261 -0.161 25800
4669 1 10 . 1 1 32 32 GLY C C 32 177.000 177.000 172.350 4.650 25800
4670 1 10 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.011 -0.511 25800
4671 1 10 . 1 1 32 32 GLY H H 32 7.240 7.240 7.926 -0.686 25800
4672 1 10 . 1 1 33 33 ASN N N 33 115.300 115.300 120.731 -5.431 25800
4673 1 10 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.632 -0.192 25800
4674 1 10 . 1 1 33 33 ASN C C 33 175.500 175.500 174.115 1.385 25800
4675 1 10 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.910 1.390 25800
4676 1 10 . 1 1 33 33 ASN CB C 33 38.400 38.400 37.886 0.514 25800
4677 1 10 . 1 1 33 33 ASN H H 33 8.460 8.460 8.433 0.027 25800
4678 1 10 . 1 1 34 34 ILE N N 34 126.700 126.700 125.281 1.419 25800
4679 1 10 . 1 1 34 34 ILE HA H 34 3.790 3.790 3.857 -0.067 25800
4680 1 10 . 1 1 34 34 ILE C C 34 175.600 175.600 175.274 0.326 25800
4681 1 10 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.231 0.069 25800
4682 1 10 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.276 1.724 25800
4683 1 10 . 1 1 34 34 ILE H H 34 8.050 8.050 7.737 0.313 25800
4684 1 10 . 1 1 35 35 LEU N N 35 127.400 127.400 129.356 -1.956 25800
4685 1 10 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.441 -0.281 25800
4686 1 10 . 1 1 35 35 LEU C C 35 177.200 177.200 176.709 0.491 25800
4687 1 10 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.002 0.498 25800
4688 1 10 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.176 0.524 25800
4689 1 10 . 1 1 35 35 LEU H H 35 8.780 8.780 8.880 -0.100 25800
4690 1 10 . 1 1 36 36 LYS N N 36 117.000 117.000 118.231 -1.231 25800
4691 1 10 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.591 -0.351 25800
4692 1 10 . 1 1 36 36 LYS C C 36 173.600 173.600 174.110 -0.510 25800
4693 1 10 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.648 0.252 25800
4694 1 10 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.222 0.378 25800
4695 1 10 . 1 1 36 36 LYS H H 36 7.110 7.110 7.634 -0.524 25800
4696 1 10 . 1 1 37 37 CYS N N 37 125.400 125.400 119.738 5.662 25800
4697 1 10 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.748 -1.048 25800
4698 1 10 . 1 1 37 37 CYS C C 37 171.600 171.600 172.992 -1.392 25800
4699 1 10 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.605 1.295 25800
4700 1 10 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.466 -4.366 25800
4701 1 10 . 1 1 37 37 CYS H H 37 8.610 8.610 8.578 0.032 25800
4702 1 10 . 1 1 38 38 ASP N N 38 128.200 128.200 120.969 7.231 25800
4703 1 10 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.078 -0.128 25800
4704 1 10 . 1 1 38 38 ASP C C 38 174.300 174.300 174.280 0.020 25800
4705 1 10 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.788 -0.588 25800
4706 1 10 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.819 -1.518 25800
4707 1 10 . 1 1 38 38 ASP H H 38 8.290 8.290 8.719 -0.429 25800
4708 1 10 . 1 1 39 39 VAL N N 39 123.500 123.500 120.778 2.722 25800
4709 1 10 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.153 -0.853 25800
4710 1 10 . 1 1 39 39 VAL C C 39 175.000 175.000 175.400 -0.400 25800
4711 1 10 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.246 0.454 25800
4712 1 10 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.169 -1.069 25800
4713 1 10 . 1 1 39 39 VAL H H 39 8.380 8.380 8.649 -0.269 25800
4714 1 10 . 1 1 40 40 LYS N N 40 129.100 129.100 126.392 2.708 25800
4715 1 10 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.963 -0.643 25800
4716 1 10 . 1 1 40 40 LYS C C 40 173.700 173.700 174.406 -0.706 25800
4717 1 10 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.381 -0.481 25800
4718 1 10 . 1 1 40 40 LYS CB C 40 35.500 35.500 36.095 -0.595 25800
4719 1 10 . 1 1 40 40 LYS H H 40 8.680 8.680 9.334 -0.654 25800
4720 1 10 . 1 1 41 41 LYS N N 41 117.300 117.300 120.498 -3.198 25800
4721 1 10 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.230 -0.250 25800
4722 1 10 . 1 1 41 41 LYS C C 41 177.800 177.800 175.676 2.124 25800
4723 1 10 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.485 0.115 25800
4724 1 10 . 1 1 41 41 LYS CB C 41 35.000 35.000 34.973 0.027 25800
4725 1 10 . 1 1 41 41 LYS H H 41 7.900 7.900 8.369 -0.469 25800
4726 1 10 . 1 1 42 42 THR N N 42 113.200 113.200 116.026 -2.826 25800
4727 1 10 . 1 1 42 42 THR HA H 42 4.680 4.680 4.631 0.049 25800
4728 1 10 . 1 1 42 42 THR C C 42 176.900 176.900 176.239 0.661 25800
4729 1 10 . 1 1 42 42 THR CA C 42 60.200 60.200 60.882 -0.682 25800
4730 1 10 . 1 1 42 42 THR CB C 42 71.600 71.600 69.879 1.721 25800
4731 1 10 . 1 1 42 42 THR H H 42 8.730 8.730 8.489 0.241 25800
4732 1 10 . 1 1 43 43 VAL N N 43 120.000 120.000 127.396 -7.396 25800
4733 1 10 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.943 -0.023 25800
4734 1 10 . 1 1 43 43 VAL C C 43 177.000 177.000 176.335 0.665 25800
4735 1 10 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.289 0.411 25800
4736 1 10 . 1 1 43 43 VAL CB C 43 31.800 31.800 32.024 -0.224 25800
4737 1 10 . 1 1 43 43 VAL H H 43 8.730 8.730 8.618 0.112 25800
4738 1 10 . 1 1 44 44 SER N N 44 113.400 113.400 113.954 -0.554 25800
4739 1 10 . 1 1 44 44 SER HA H 44 4.360 4.360 4.376 -0.016 25800
4740 1 10 . 1 1 44 44 SER C C 44 174.800 174.800 175.186 -0.386 25800
4741 1 10 . 1 1 44 44 SER CA C 44 58.400 58.400 58.618 -0.218 25800
4742 1 10 . 1 1 44 44 SER CB C 44 63.500 63.500 63.520 -0.020 25800
4743 1 10 . 1 1 44 44 SER H H 44 7.760 7.760 7.915 -0.155 25800
4744 1 10 . 1 1 45 45 GLY N N 45 110.200 110.200 108.600 1.600 25800
4745 1 10 . 1 1 45 45 GLY C C 45 173.500 173.500 173.950 -0.450 25800
4746 1 10 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.794 0.506 25800
4747 1 10 . 1 1 45 45 GLY H H 45 7.820 7.820 7.750 0.070 25800
4748 1 10 . 1 1 46 46 ALA N N 46 123.900 123.900 122.376 1.524 25800
4749 1 10 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.223 0.167 25800
4750 1 10 . 1 1 46 46 ALA C C 46 176.100 176.100 175.695 0.405 25800
4751 1 10 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.804 0.096 25800
4752 1 10 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.862 -0.062 25800
4753 1 10 . 1 1 46 46 ALA H H 46 7.440 7.440 7.815 -0.375 25800
4754 1 10 . 1 1 47 47 ALA N N 47 123.100 123.100 123.293 -0.193 25800
4755 1 10 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.034 0.166 25800
4756 1 10 . 1 1 47 47 ALA C C 47 176.100 176.100 175.697 0.403 25800
4757 1 10 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.196 0.704 25800
4758 1 10 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.827 0.073 25800
4759 1 10 . 1 1 47 47 ALA H H 47 8.350 8.350 7.920 0.430 25800
4760 1 10 . 1 1 48 48 PHE N N 48 118.700 118.700 118.516 0.184 25800
4761 1 10 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.186 -0.156 25800
4762 1 10 . 1 1 48 48 PHE C C 48 171.600 171.600 173.923 -2.323 25800
4763 1 10 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.468 -0.768 25800
4764 1 10 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.086 -1.886 25800
4765 1 10 . 1 1 48 48 PHE H H 48 8.550 8.550 8.913 -0.363 25800
4766 1 10 . 1 1 49 49 ALA N N 49 120.400 120.400 124.402 -4.002 25800
4767 1 10 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.441 -0.111 25800
4768 1 10 . 1 1 49 49 ALA C C 49 175.500 175.500 175.255 0.245 25800
4769 1 10 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.006 -0.706 25800
4770 1 10 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.838 1.862 25800
4771 1 10 . 1 1 49 49 ALA H H 49 9.240 9.240 9.035 0.205 25800
4772 1 10 . 1 1 50 50 PHE N N 50 115.000 115.000 120.678 -5.678 25800
4773 1 10 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.659 -0.059 25800
4774 1 10 . 1 1 50 50 PHE C C 50 176.000 176.000 174.366 1.634 25800
4775 1 10 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.327 0.173 25800
4776 1 10 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.489 -1.289 25800
4777 1 10 . 1 1 50 50 PHE H H 50 7.920 7.920 9.146 -1.226 25800
4778 1 10 . 1 1 51 51 ILE N N 51 123.000 123.000 121.722 1.278 25800
4779 1 10 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.779 -0.329 25800
4780 1 10 . 1 1 51 51 ILE C C 51 173.700 173.700 174.688 -0.988 25800
4781 1 10 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.426 -0.226 25800
4782 1 10 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.681 0.020 25800
4783 1 10 . 1 1 51 51 ILE H H 51 8.490 8.490 9.023 -0.533 25800
4784 1 10 . 1 1 52 52 GLU N N 52 126.600 126.600 127.442 -0.842 25800
4785 1 10 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.627 0.143 25800
4786 1 10 . 1 1 52 52 GLU C C 52 175.300 175.300 175.158 0.142 25800
4787 1 10 . 1 1 52 52 GLU CA C 52 54.700 54.700 56.893 -2.193 25800
4788 1 10 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.357 0.143 25800
4789 1 10 . 1 1 52 52 GLU H H 52 8.610 8.610 9.006 -0.396 25800
4790 1 10 . 1 1 53 53 PHE N N 53 126.100 126.100 125.261 0.839 25800
4791 1 10 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.130 -0.330 25800
4792 1 10 . 1 1 53 53 PHE C C 53 175.400 175.400 174.572 0.828 25800
4793 1 10 . 1 1 53 53 PHE CA C 53 58.200 58.200 57.183 1.017 25800
4794 1 10 . 1 1 53 53 PHE CB C 53 40.900 40.900 42.986 -2.086 25800
4795 1 10 . 1 1 53 53 PHE H H 53 8.800 8.800 8.838 -0.038 25800
4796 1 10 . 1 1 54 54 GLU N N 54 120.700 120.700 121.590 -0.890 25800
4797 1 10 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.210 -0.280 25800
4798 1 10 . 1 1 54 54 GLU C C 54 175.300 175.300 176.216 -0.916 25800
4799 1 10 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.311 1.789 25800
4800 1 10 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.762 0.038 25800
4801 1 10 . 1 1 54 54 GLU H H 54 8.160 8.160 8.233 -0.073 25800
4802 1 10 . 1 1 55 55 ASP N N 55 117.900 117.900 120.239 -2.339 25800
4803 1 10 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.882 0.038 25800
4804 1 10 . 1 1 55 55 ASP C C 55 176.400 176.400 175.648 0.752 25800
4805 1 10 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.201 -0.801 25800
4806 1 10 . 1 1 55 55 ASP CB C 55 44.400 44.400 41.195 3.205 25800
4807 1 10 . 1 1 55 55 ASP H H 55 8.740 8.740 8.360 0.380 25800
4808 1 10 . 1 1 56 56 ALA N N 56 128.900 128.900 125.983 2.917 25800
4809 1 10 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.505 0.325 25800
4810 1 10 . 1 1 56 56 ALA C C 56 179.800 179.800 178.610 1.190 25800
4811 1 10 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.367 -0.167 25800
4812 1 10 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.834 0.066 25800
4813 1 10 . 1 1 56 56 ALA H H 56 8.800 8.800 8.356 0.444 25800
4814 1 10 . 1 1 57 57 ARG N N 57 119.200 119.200 117.812 1.388 25800
4815 1 10 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.138 -0.248 25800
4816 1 10 . 1 1 57 57 ARG C C 57 178.000 178.000 177.150 0.850 25800
4817 1 10 . 1 1 57 57 ARG CA C 57 58.900 58.900 59.396 -0.496 25800
4818 1 10 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.180 0.120 25800
4819 1 10 . 1 1 57 57 ARG H H 57 8.950 8.950 8.464 0.486 25800
4820 1 10 . 1 1 58 58 ASP N N 58 120.900 120.900 118.103 2.797 25800
4821 1 10 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.510 -0.420 25800
4822 1 10 . 1 1 58 58 ASP C C 58 176.700 176.700 177.934 -1.234 25800
4823 1 10 . 1 1 58 58 ASP CA C 58 56.500 56.500 57.055 -0.555 25800
4824 1 10 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.616 -0.716 25800
4825 1 10 . 1 1 58 58 ASP H H 58 7.020 7.020 8.410 -1.390 25800
4826 1 10 . 1 1 59 59 ALA N N 59 119.700 119.700 122.219 -2.519 25800
4827 1 10 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.546 -1.466 25800
4828 1 10 . 1 1 59 59 ALA C C 59 178.100 178.100 179.577 -1.477 25800
4829 1 10 . 1 1 59 59 ALA CA C 59 54.300 54.300 55.030 -0.730 25800
4830 1 10 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.662 -0.262 25800
4831 1 10 . 1 1 59 59 ALA H H 59 6.440 6.440 8.289 -1.849 25800
4832 1 10 . 1 1 60 60 ALA N N 60 117.600 117.600 121.260 -3.660 25800
4833 1 10 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.034 -0.204 25800
4834 1 10 . 1 1 60 60 ALA C C 60 180.900 180.900 179.505 1.395 25800
4835 1 10 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.555 -0.655 25800
4836 1 10 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.322 -0.622 25800
4837 1 10 . 1 1 60 60 ALA H H 60 7.330 7.330 8.347 -1.017 25800
4838 1 10 . 1 1 61 61 ASP N N 61 120.100 120.100 117.607 2.493 25800
4839 1 10 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.460 -0.250 25800
4840 1 10 . 1 1 61 61 ASP C C 61 176.700 176.700 177.318 -0.618 25800
4841 1 10 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.822 0.278 25800
4842 1 10 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.397 -0.297 25800
4843 1 10 . 1 1 61 61 ASP H H 61 7.590 7.590 7.998 -0.408 25800
4844 1 10 . 1 1 62 62 ALA N N 62 122.200 122.200 120.686 1.514 25800
4845 1 10 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.220 -1.800 25800
4846 1 10 . 1 1 62 62 ALA C C 62 179.300 179.300 179.385 -0.085 25800
4847 1 10 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.800 0.800 25800
4848 1 10 . 1 1 62 62 ALA CB C 62 19.100 19.100 19.621 -0.521 25800
4849 1 10 . 1 1 62 62 ALA H H 62 7.440 7.440 7.497 -0.057 25800
4850 1 10 . 1 1 63 63 ILE N N 63 116.700 116.700 120.094 -3.394 25800
4851 1 10 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.191 -0.951 25800
4852 1 10 . 1 1 63 63 ILE C C 63 177.800 177.800 177.962 -0.162 25800
4853 1 10 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.387 2.213 25800
4854 1 10 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.952 0.948 25800
4855 1 10 . 1 1 63 63 ILE H H 63 7.540 7.540 8.776 -1.236 25800
4856 1 10 . 1 1 64 64 LYS N N 64 117.400 117.400 119.641 -2.241 25800
4857 1 10 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.094 -0.194 25800
4858 1 10 . 1 1 64 64 LYS C C 64 178.900 178.900 178.288 0.612 25800
4859 1 10 . 1 1 64 64 LYS CA C 64 58.800 58.800 59.012 -0.212 25800
4860 1 10 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.470 1.130 25800
4861 1 10 . 1 1 64 64 LYS H H 64 7.490 7.490 8.356 -0.866 25800
4862 1 10 . 1 1 65 65 GLU N N 65 113.800 113.800 118.413 -4.613 25800
4863 1 10 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.261 -0.101 25800
4864 1 10 . 1 1 65 65 GLU C C 65 178.300 178.300 177.659 0.641 25800
4865 1 10 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.315 -0.015 25800
4866 1 10 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.767 1.933 25800
4867 1 10 . 1 1 65 65 GLU H H 65 7.960 7.960 7.938 0.022 25800
4868 1 10 . 1 1 66 66 LYS N N 66 114.700 114.700 117.766 -3.066 25800
4869 1 10 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.513 -0.043 25800
4870 1 10 . 1 1 66 66 LYS C C 66 177.500 177.500 176.400 1.100 25800
4871 1 10 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.159 -0.759 25800
4872 1 10 . 1 1 66 66 LYS CB C 66 33.000 33.000 31.823 1.177 25800
4873 1 10 . 1 1 66 66 LYS H H 66 8.050 8.050 7.781 0.269 25800
4874 1 10 . 1 1 67 67 ASP N N 67 118.800 118.800 120.058 -1.258 25800
4875 1 10 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.465 -0.244 25800
4876 1 10 . 1 1 67 67 ASP C C 67 177.700 177.700 177.763 -0.063 25800
4877 1 10 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.312 4.088 25800
4878 1 10 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.260 0.140 25800
4879 1 10 . 1 1 67 67 ASP H H 67 7.620 7.620 7.476 0.144 25800
4880 1 10 . 1 1 68 68 GLY N N 68 115.600 115.600 108.633 6.967 25800
4881 1 10 . 1 1 68 68 GLY C C 68 173.800 173.800 174.810 -1.010 25800
4882 1 10 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.858 1.042 25800
4883 1 10 . 1 1 68 68 GLY H H 68 8.470 8.470 8.590 -0.120 25800
4884 1 10 . 1 1 69 69 CYS N N 69 119.200 119.200 119.745 -0.545 25800
4885 1 10 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.550 -0.390 25800
4886 1 10 . 1 1 69 69 CYS C C 69 172.600 172.600 173.920 -1.320 25800
4887 1 10 . 1 1 69 69 CYS CA C 69 58.000 58.000 58.061 -0.061 25800
4888 1 10 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.270 -0.570 25800
4889 1 10 . 1 1 69 69 CYS H H 69 7.890 7.890 8.208 -0.318 25800
4890 1 10 . 1 1 70 70 ASP N N 70 122.200 122.200 121.955 0.245 25800
4891 1 10 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.001 -0.171 25800
4892 1 10 . 1 1 70 70 ASP C C 70 176.400 176.400 174.386 2.014 25800
4893 1 10 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.700 1.000 25800
4894 1 10 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.594 -1.894 25800
4895 1 10 . 1 1 70 70 ASP H H 70 8.360 8.360 8.824 -0.464 25800
4896 1 10 . 1 1 71 71 PHE N N 71 127.600 127.600 121.854 5.746 25800
4897 1 10 . 1 1 71 71 PHE HA H 71 4.600 4.600 4.913 -0.313 25800
4898 1 10 . 1 1 71 71 PHE C C 71 173.600 173.600 174.840 -1.240 25800
4899 1 10 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.192 -0.392 25800
4900 1 10 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.459 -0.758 25800
4901 1 10 . 1 1 71 71 PHE H H 71 9.390 9.390 8.354 1.036 25800
4902 1 10 . 1 1 72 72 GLU N N 72 123.900 123.900 120.683 3.217 25800
4903 1 10 . 1 1 72 72 GLU HA H 72 3.540 3.540 3.695 -0.155 25800
4904 1 10 . 1 1 72 72 GLU C C 72 175.500 175.500 175.728 -0.228 25800
4905 1 10 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.591 0.109 25800
4906 1 10 . 1 1 72 72 GLU CB C 72 27.300 27.300 29.288 -1.988 25800
4907 1 10 . 1 1 72 72 GLU H H 72 8.940 8.940 7.721 1.219 25800
4908 1 10 . 1 1 73 73 GLY N N 73 105.200 105.200 107.066 -1.866 25800
4909 1 10 . 1 1 73 73 GLY C C 73 174.100 174.100 173.788 0.312 25800
4910 1 10 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.708 0.892 25800
4911 1 10 . 1 1 73 73 GLY H H 73 8.350 8.350 8.239 0.111 25800
4912 1 10 . 1 1 74 74 ASN N N 74 121.000 121.000 118.060 2.940 25800
4913 1 10 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.939 -0.179 25800
4914 1 10 . 1 1 74 74 ASN C C 74 174.000 174.000 173.067 0.933 25800
4915 1 10 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.514 -1.614 25800
4916 1 10 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.831 -1.131 25800
4917 1 10 . 1 1 74 74 ASN H H 74 7.740 7.740 7.329 0.411 25800
4918 1 10 . 1 1 75 75 LYS N N 75 121.400 121.400 121.385 0.015 25800
4919 1 10 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.665 -0.195 25800
4920 1 10 . 1 1 75 75 LYS C C 75 176.900 176.900 174.597 2.303 25800
4921 1 10 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.100 -0.800 25800
4922 1 10 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.507 -1.607 25800
4923 1 10 . 1 1 75 75 LYS H H 75 8.380 8.380 8.471 -0.091 25800
4924 1 10 . 1 1 76 76 LEU N N 76 127.400 127.400 123.812 3.588 25800
4925 1 10 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.640 -0.210 25800
4926 1 10 . 1 1 76 76 LEU C C 76 177.600 177.600 173.630 3.970 25800
4927 1 10 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.368 -0.068 25800
4928 1 10 . 1 1 76 76 LEU CB C 76 43.100 43.100 47.014 -3.914 25800
4929 1 10 . 1 1 76 76 LEU H H 76 8.950 8.950 8.598 0.352 25800
4930 1 10 . 1 1 77 77 ARG N N 77 121.800 121.800 123.495 -1.695 25800
4931 1 10 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.842 0.058 25800
4932 1 10 . 1 1 77 77 ARG C C 77 174.700 174.700 173.530 1.170 25800
4933 1 10 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.610 -1.610 25800
4934 1 10 . 1 1 77 77 ARG CB C 77 32.300 32.300 34.197 -1.897 25800
4935 1 10 . 1 1 77 77 ARG H H 77 7.530 7.530 8.886 -1.356 25800
4936 1 10 . 1 1 78 78 VAL N N 78 127.000 127.000 125.100 1.900 25800
4937 1 10 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.323 0.957 25800
4938 1 10 . 1 1 78 78 VAL C C 78 174.200 174.200 174.053 0.147 25800
4939 1 10 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.635 -0.435 25800
4940 1 10 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.809 -1.409 25800
4941 1 10 . 1 1 78 78 VAL H H 78 9.660 9.660 8.549 1.111 25800
4942 1 10 . 1 1 79 79 GLU N N 79 121.900 121.900 126.906 -5.006 25800
4943 1 10 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.568 0.142 25800
4944 1 10 . 1 1 79 79 GLU C C 79 174.600 174.600 174.269 0.331 25800
4945 1 10 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.475 -1.575 25800
4946 1 10 . 1 1 79 79 GLU CB C 79 34.400 34.400 33.928 0.472 25800
4947 1 10 . 1 1 79 79 GLU H H 79 8.980 8.980 8.188 0.792 25800
4948 1 10 . 1 1 80 80 VAL N N 80 121.300 121.300 122.089 -0.789 25800
4949 1 10 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.364 0.006 25800
4950 1 10 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.636 2.364 25800
4951 1 10 . 1 1 80 80 VAL CB C 80 32.100 32.100 31.270 0.830 25800
4952 1 10 . 1 1 80 80 VAL H H 80 8.410 8.410 8.364 0.046 25800
4953 1 10 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.293 -0.033 25800
4954 1 10 . 1 1 81 81 PRO C C 81 176.100 176.100 177.190 -1.090 25800
4955 1 10 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.733 -1.633 25800
4956 1 10 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.762 0.338 25800
4957 1 10 . 1 1 82 82 PHE N N 82 122.200 122.200 115.104 7.096 25800
4958 1 10 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.446 -0.156 25800
4959 1 10 . 1 1 82 82 PHE C C 82 175.300 175.300 176.223 -0.923 25800
4960 1 10 . 1 1 82 82 PHE CA C 82 58.100 58.100 57.597 0.503 25800
4961 1 10 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.610 0.790 25800
4962 1 10 . 1 1 82 82 PHE H H 82 8.150 8.150 7.736 0.414 25800
4963 1 10 . 1 1 83 83 ASN N N 83 120.800 120.800 116.300 4.500 25800
4964 1 10 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.027 0.413 25800
4965 1 10 . 1 1 83 83 ASN C C 83 174.100 174.100 174.237 -0.137 25800
4966 1 10 . 1 1 83 83 ASN CA C 83 52.700 52.700 55.322 -2.622 25800
4967 1 10 . 1 1 83 83 ASN CB C 83 38.700 38.700 37.706 0.994 25800
4968 1 10 . 1 1 83 83 ASN H H 83 8.110 8.110 7.826 0.284 25800
4969 1 10 . 1 1 84 84 ALA N N 84 123.700 123.700 119.022 4.678 25800
4970 1 10 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.802 -0.722 25800
4971 1 10 . 1 1 84 84 ALA C C 84 177.100 177.100 176.214 0.886 25800
4972 1 10 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.082 0.318 25800
4973 1 10 . 1 1 84 84 ALA CB C 84 19.100 19.100 21.173 -2.073 25800
4974 1 10 . 1 1 84 84 ALA H H 84 8.020 8.020 8.011 0.009 25800
4975 1 10 . 1 1 85 85 ARG N N 85 120.200 120.200 120.211 -0.011 25800
4976 1 10 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.314 -0.164 25800
4977 1 10 . 1 1 85 85 ARG C C 85 175.200 175.200 175.144 0.056 25800
4978 1 10 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.090 -0.090 25800
4979 1 10 . 1 1 85 85 ARG CB C 85 30.800 30.800 28.175 2.625 25800
4980 1 10 . 1 1 85 85 ARG H H 85 8.040 8.040 8.845 -0.805 25800
4981 1 11 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.359 0.231 25800
4982 1 11 . 1 1 0 0 HIS C C 0 174.000 174.000 173.471 0.529 25800
4983 1 11 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.335 -1.035 25800
4984 1 11 . 1 1 0 0 HIS CB C 0 29.300 29.300 28.822 0.478 25800
4985 1 11 . 1 1 1 1 MET N N 1 122.400 122.400 118.705 3.695 25800
4986 1 11 . 1 1 1 1 MET HA H 1 4.340 4.340 4.505 -0.165 25800
4987 1 11 . 1 1 1 1 MET C C 1 175.600 175.600 174.508 1.092 25800
4988 1 11 . 1 1 1 1 MET CA C 1 55.600 55.600 54.719 0.881 25800
4989 1 11 . 1 1 1 1 MET CB C 1 32.800 32.800 34.729 -1.929 25800
4990 1 11 . 1 1 1 1 MET H H 1 8.310 8.310 7.941 0.369 25800
4991 1 11 . 1 1 2 2 VAL N N 2 123.200 123.200 121.237 1.963 25800
4992 1 11 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.270 -0.310 25800
4993 1 11 . 1 1 2 2 VAL C C 2 175.600 175.600 176.240 -0.640 25800
4994 1 11 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.096 0.204 25800
4995 1 11 . 1 1 2 2 VAL CB C 2 32.300 32.300 33.325 -1.025 25800
4996 1 11 . 1 1 2 2 VAL H H 2 8.180 8.180 8.238 -0.058 25800
4997 1 11 . 1 1 3 3 ILE N N 3 126.200 126.200 124.036 2.164 25800
4998 1 11 . 1 1 3 3 ILE HA H 3 4.050 4.050 3.882 0.168 25800
4999 1 11 . 1 1 3 3 ILE C C 3 175.800 175.800 175.456 0.344 25800
5000 1 11 . 1 1 3 3 ILE CA C 3 60.700 60.700 62.059 -1.359 25800
5001 1 11 . 1 1 3 3 ILE CB C 3 38.300 38.300 37.005 1.295 25800
5002 1 11 . 1 1 3 3 ILE H H 3 8.230 8.230 8.387 -0.157 25800
5003 1 11 . 1 1 4 4 ARG N N 4 126.100 126.100 121.787 4.313 25800
5004 1 11 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.424 -0.244 25800
5005 1 11 . 1 1 4 4 ARG C C 4 175.900 175.900 175.075 0.825 25800
5006 1 11 . 1 1 4 4 ARG CA C 4 56.000 56.000 54.999 1.001 25800
5007 1 11 . 1 1 4 4 ARG CB C 4 30.700 30.700 32.539 -1.839 25800
5008 1 11 . 1 1 4 4 ARG H H 4 8.360 8.360 7.846 0.514 25800
5009 1 11 . 1 1 5 5 GLU N N 5 122.200 122.200 124.315 -2.115 25800
5010 1 11 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.379 -0.239 25800
5011 1 11 . 1 1 5 5 GLU C C 5 176.100 176.100 176.187 -0.087 25800
5012 1 11 . 1 1 5 5 GLU CA C 5 56.600 56.600 56.247 0.353 25800
5013 1 11 . 1 1 5 5 GLU CB C 5 30.300 30.300 30.590 -0.290 25800
5014 1 11 . 1 1 5 5 GLU H H 5 8.400 8.400 8.598 -0.198 25800
5015 1 11 . 1 1 6 6 SER N N 6 116.200 116.200 119.755 -3.555 25800
5016 1 11 . 1 1 6 6 SER HA H 6 4.350 4.350 4.414 -0.064 25800
5017 1 11 . 1 1 6 6 SER C C 6 174.300 174.300 174.165 0.135 25800
5018 1 11 . 1 1 6 6 SER CA C 6 58.200 58.200 58.336 -0.136 25800
5019 1 11 . 1 1 6 6 SER CB C 6 63.800 63.800 63.772 0.028 25800
5020 1 11 . 1 1 6 6 SER H H 6 8.270 8.270 8.480 -0.210 25800
5021 1 11 . 1 1 7 7 VAL N N 7 119.800 119.800 125.017 -5.217 25800
5022 1 11 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.213 0.087 25800
5023 1 11 . 1 1 7 7 VAL C C 7 175.500 175.500 175.389 0.111 25800
5024 1 11 . 1 1 7 7 VAL CA C 7 61.700 61.700 62.288 -0.588 25800
5025 1 11 . 1 1 7 7 VAL CB C 7 32.800 32.800 32.394 0.406 25800
5026 1 11 . 1 1 7 7 VAL H H 7 7.840 7.840 8.445 -0.605 25800
5027 1 11 . 1 1 8 8 SER N N 8 117.800 117.800 122.953 -5.153 25800
5028 1 11 . 1 1 8 8 SER HA H 8 4.240 4.240 4.802 -0.562 25800
5029 1 11 . 1 1 8 8 SER C C 8 172.500 172.500 172.907 -0.407 25800
5030 1 11 . 1 1 8 8 SER CA C 8 58.500 58.500 58.240 0.260 25800
5031 1 11 . 1 1 8 8 SER CB C 8 63.600 63.600 63.370 0.230 25800
5032 1 11 . 1 1 8 8 SER H H 8 8.530 8.530 8.942 -0.412 25800
5033 1 11 . 1 1 9 9 ARG N N 9 123.000 123.000 123.499 -0.499 25800
5034 1 11 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.036 0.464 25800
5035 1 11 . 1 1 9 9 ARG C C 9 175.000 175.000 174.470 0.530 25800
5036 1 11 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.664 -0.364 25800
5037 1 11 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.450 0.950 25800
5038 1 11 . 1 1 9 9 ARG H H 9 7.350 7.350 8.506 -1.156 25800
5039 1 11 . 1 1 10 10 ILE N N 10 114.000 114.000 121.524 -7.524 25800
5040 1 11 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.128 0.692 25800
5041 1 11 . 1 1 10 10 ILE C C 10 173.000 173.000 174.514 -1.514 25800
5042 1 11 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.324 -1.924 25800
5043 1 11 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.965 1.935 25800
5044 1 11 . 1 1 10 10 ILE H H 10 8.830 8.830 8.543 0.287 25800
5045 1 11 . 1 1 11 11 TYR N N 11 123.400 123.400 126.479 -3.079 25800
5046 1 11 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.016 -0.086 25800
5047 1 11 . 1 1 11 11 TYR C C 11 173.000 173.000 173.459 -0.459 25800
5048 1 11 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.452 0.548 25800
5049 1 11 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.980 -1.079 25800
5050 1 11 . 1 1 11 11 TYR H H 11 8.690 8.690 7.861 0.829 25800
5051 1 11 . 1 1 12 12 VAL N N 12 126.300 126.300 125.409 0.891 25800
5052 1 11 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.181 0.379 25800
5053 1 11 . 1 1 12 12 VAL C C 12 174.100 174.100 174.065 0.035 25800
5054 1 11 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.580 -0.380 25800
5055 1 11 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.025 -1.625 25800
5056 1 11 . 1 1 12 12 VAL H H 12 8.370 8.370 7.904 0.466 25800
5057 1 11 . 1 1 13 13 GLY N N 13 113.000 113.000 110.737 2.263 25800
5058 1 11 . 1 1 13 13 GLY C C 13 173.100 173.100 173.305 -0.205 25800
5059 1 11 . 1 1 13 13 GLY CA C 13 43.300 43.300 42.998 0.301 25800
5060 1 11 . 1 1 13 13 GLY H H 13 9.350 9.350 8.538 0.812 25800
5061 1 11 . 1 1 14 14 ASN N N 14 113.900 113.900 115.918 -2.018 25800
5062 1 11 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.057 0.223 25800
5063 1 11 . 1 1 14 14 ASN C C 14 175.800 175.800 174.702 1.098 25800
5064 1 11 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.914 -0.314 25800
5065 1 11 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.972 0.728 25800
5066 1 11 . 1 1 14 14 ASN H H 14 8.800 8.800 8.277 0.523 25800
5067 1 11 . 1 1 15 15 LEU N N 15 115.800 115.800 121.384 -5.584 25800
5068 1 11 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.303 0.687 25800
5069 1 11 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.820 1.780 25800
5070 1 11 . 1 1 15 15 LEU CB C 15 41.600 41.600 42.954 -1.354 25800
5071 1 11 . 1 1 15 15 LEU H H 15 7.150 7.150 7.737 -0.587 25800
5072 1 11 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.552 -0.482 25800
5073 1 11 . 1 1 16 16 PRO C C 16 171.500 171.500 178.094 -6.594 25800
5074 1 11 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.544 -0.044 25800
5075 1 11 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.533 -0.533 25800
5076 1 11 . 1 1 17 17 SER N N 17 115.200 115.200 114.488 0.712 25800
5077 1 11 . 1 1 17 17 SER HA H 17 4.300 4.300 3.894 0.406 25800
5078 1 11 . 1 1 17 17 SER C C 17 174.200 174.200 173.759 0.441 25800
5079 1 11 . 1 1 17 17 SER CA C 17 58.200 58.200 59.282 -1.082 25800
5080 1 11 . 1 1 17 17 SER CB C 17 63.900 63.900 62.992 0.908 25800
5081 1 11 . 1 1 17 17 SER H H 17 8.470 8.470 8.488 -0.018 25800
5082 1 11 . 1 1 18 18 HIS N N 18 120.800 120.800 117.156 3.644 25800
5083 1 11 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.206 0.344 25800
5084 1 11 . 1 1 18 18 HIS C C 18 175.100 175.100 174.891 0.209 25800
5085 1 11 . 1 1 18 18 HIS CA C 18 55.500 55.500 56.175 -0.675 25800
5086 1 11 . 1 1 18 18 HIS CB C 18 29.300 29.300 27.758 1.542 25800
5087 1 11 . 1 1 18 18 HIS H H 18 8.540 8.540 7.904 0.636 25800
5088 1 11 . 1 1 19 19 VAL N N 19 115.700 115.700 115.123 0.577 25800
5089 1 11 . 1 1 19 19 VAL HA H 19 4.260 4.260 3.891 0.369 25800
5090 1 11 . 1 1 19 19 VAL C C 19 174.000 174.000 176.457 -2.457 25800
5091 1 11 . 1 1 19 19 VAL CA C 19 61.900 61.900 63.169 -1.269 25800
5092 1 11 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.169 0.431 25800
5093 1 11 . 1 1 19 19 VAL H H 19 6.650 6.650 7.999 -1.349 25800
5094 1 11 . 1 1 20 20 SER N N 20 118.800 118.800 121.974 -3.174 25800
5095 1 11 . 1 1 20 20 SER HA H 20 4.710 4.710 4.590 0.120 25800
5096 1 11 . 1 1 20 20 SER C C 20 175.900 175.900 176.213 -0.313 25800
5097 1 11 . 1 1 20 20 SER CA C 20 55.800 55.800 58.264 -2.464 25800
5098 1 11 . 1 1 20 20 SER CB C 20 66.600 66.600 64.722 1.878 25800
5099 1 11 . 1 1 20 20 SER H H 20 8.930 8.930 8.142 0.788 25800
5100 1 11 . 1 1 21 21 SER N N 21 117.100 117.100 118.914 -1.814 25800
5101 1 11 . 1 1 21 21 SER HA H 21 3.880 3.880 4.138 -0.258 25800
5102 1 11 . 1 1 21 21 SER C C 21 176.200 176.200 176.801 -0.601 25800
5103 1 11 . 1 1 21 21 SER CA C 21 62.300 62.300 61.527 0.773 25800
5104 1 11 . 1 1 21 21 SER CB C 21 66.800 66.800 63.319 3.481 25800
5105 1 11 . 1 1 21 21 SER H H 21 9.080 9.080 9.032 0.048 25800
5106 1 11 . 1 1 22 22 ARG N N 22 121.200 121.200 120.114 1.086 25800
5107 1 11 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.145 -0.155 25800
5108 1 11 . 1 1 22 22 ARG C C 22 177.900 177.900 178.347 -0.447 25800
5109 1 11 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.522 -0.822 25800
5110 1 11 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.991 -0.391 25800
5111 1 11 . 1 1 22 22 ARG H H 22 7.940 7.940 8.489 -0.549 25800
5112 1 11 . 1 1 23 23 ASP N N 23 118.800 118.800 120.392 -1.592 25800
5113 1 11 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.587 -0.197 25800
5114 1 11 . 1 1 23 23 ASP C C 23 179.200 179.200 178.512 0.688 25800
5115 1 11 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.897 0.403 25800
5116 1 11 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.870 0.130 25800
5117 1 11 . 1 1 23 23 ASP H H 23 7.480 7.480 7.704 -0.224 25800
5118 1 11 . 1 1 24 24 VAL N N 24 119.500 119.500 120.944 -1.444 25800
5119 1 11 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.957 -0.587 25800
5120 1 11 . 1 1 24 24 VAL C C 24 177.500 177.500 177.535 -0.035 25800
5121 1 11 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.133 1.767 25800
5122 1 11 . 1 1 24 24 VAL CB C 24 31.400 31.400 32.177 -0.777 25800
5123 1 11 . 1 1 24 24 VAL H H 24 7.450 7.450 8.440 -0.990 25800
5124 1 11 . 1 1 25 25 GLU N N 25 121.400 121.400 120.969 0.431 25800
5125 1 11 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.941 -0.371 25800
5126 1 11 . 1 1 25 25 GLU C C 25 178.400 178.400 178.699 -0.299 25800
5127 1 11 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.591 0.009 25800
5128 1 11 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.525 0.075 25800
5129 1 11 . 1 1 25 25 GLU H H 25 8.580 8.580 8.178 0.402 25800
5130 1 11 . 1 1 26 26 ASN N N 26 114.800 114.800 116.615 -1.815 25800
5131 1 11 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.526 -0.206 25800
5132 1 11 . 1 1 26 26 ASN C C 26 177.400 177.400 177.573 -0.173 25800
5133 1 11 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.468 0.432 25800
5134 1 11 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.251 -0.351 25800
5135 1 11 . 1 1 26 26 ASN H H 26 8.180 8.180 7.823 0.357 25800
5136 1 11 . 1 1 27 27 GLU N N 27 118.900 118.900 120.669 -1.769 25800
5137 1 11 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.131 0.009 25800
5138 1 11 . 1 1 27 27 GLU C C 27 176.400 176.400 179.093 -2.693 25800
5139 1 11 . 1 1 27 27 GLU CA C 27 57.400 57.400 59.214 -1.814 25800
5140 1 11 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.847 -0.447 25800
5141 1 11 . 1 1 27 27 GLU H H 27 7.340 7.340 8.062 -0.722 25800
5142 1 11 . 1 1 28 28 PHE N N 28 114.100 114.100 118.719 -4.619 25800
5143 1 11 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.542 0.008 25800
5144 1 11 . 1 1 28 28 PHE C C 28 176.300 176.300 177.767 -1.467 25800
5145 1 11 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.019 -1.019 25800
5146 1 11 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.268 1.532 25800
5147 1 11 . 1 1 28 28 PHE H H 28 7.660 7.660 8.254 -0.594 25800
5148 1 11 . 1 1 29 29 ARG N N 29 121.700 121.700 119.048 2.652 25800
5149 1 11 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.322 0.088 25800
5150 1 11 . 1 1 29 29 ARG C C 29 177.100 177.100 177.653 -0.553 25800
5151 1 11 . 1 1 29 29 ARG CA C 29 58.200 58.200 59.038 -0.838 25800
5152 1 11 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.103 -0.803 25800
5153 1 11 . 1 1 29 29 ARG H H 29 8.120 8.120 8.289 -0.169 25800
5154 1 11 . 1 1 30 30 LYS N N 30 117.200 117.200 117.760 -0.560 25800
5155 1 11 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.179 -0.349 25800
5156 1 11 . 1 1 30 30 LYS C C 30 177.100 177.100 178.657 -1.557 25800
5157 1 11 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.050 -0.251 25800
5158 1 11 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.879 -0.779 25800
5159 1 11 . 1 1 30 30 LYS H H 30 7.630 7.630 7.783 -0.153 25800
5160 1 11 . 1 1 31 31 TYR N N 31 117.100 117.100 119.638 -2.538 25800
5161 1 11 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.474 -0.324 25800
5162 1 11 . 1 1 31 31 TYR C C 31 174.400 174.400 176.549 -2.149 25800
5163 1 11 . 1 1 31 31 TYR CA C 31 59.900 59.900 60.359 -0.459 25800
5164 1 11 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.740 -1.840 25800
5165 1 11 . 1 1 31 31 TYR H H 31 7.410 7.410 8.093 -0.683 25800
5166 1 11 . 1 1 32 32 GLY N N 32 104.100 104.100 103.910 0.190 25800
5167 1 11 . 1 1 32 32 GLY C C 32 177.000 177.000 171.663 5.337 25800
5168 1 11 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.713 -0.213 25800
5169 1 11 . 1 1 32 32 GLY H H 32 7.240 7.240 7.997 -0.757 25800
5170 1 11 . 1 1 33 33 ASN N N 33 115.300 115.300 118.594 -3.294 25800
5171 1 11 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.671 -0.231 25800
5172 1 11 . 1 1 33 33 ASN C C 33 175.500 175.500 174.547 0.953 25800
5173 1 11 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.224 2.076 25800
5174 1 11 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.021 -0.621 25800
5175 1 11 . 1 1 33 33 ASN H H 33 8.460 8.460 8.401 0.059 25800
5176 1 11 . 1 1 34 34 ILE N N 34 126.700 126.700 124.812 1.888 25800
5177 1 11 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.176 -0.386 25800
5178 1 11 . 1 1 34 34 ILE C C 34 175.600 175.600 174.943 0.657 25800
5179 1 11 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.877 0.423 25800
5180 1 11 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.502 1.498 25800
5181 1 11 . 1 1 34 34 ILE H H 34 8.050 8.050 8.145 -0.095 25800
5182 1 11 . 1 1 35 35 LEU N N 35 127.400 127.400 129.004 -1.604 25800
5183 1 11 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.490 -0.330 25800
5184 1 11 . 1 1 35 35 LEU C C 35 177.200 177.200 177.254 -0.054 25800
5185 1 11 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.137 0.363 25800
5186 1 11 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.086 0.615 25800
5187 1 11 . 1 1 35 35 LEU H H 35 8.780 8.780 8.774 0.006 25800
5188 1 11 . 1 1 36 36 LYS N N 36 117.000 117.000 118.250 -1.250 25800
5189 1 11 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.557 -0.317 25800
5190 1 11 . 1 1 36 36 LYS C C 36 173.600 173.600 173.958 -0.358 25800
5191 1 11 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.635 0.265 25800
5192 1 11 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.205 1.395 25800
5193 1 11 . 1 1 36 36 LYS H H 36 7.110 7.110 7.654 -0.544 25800
5194 1 11 . 1 1 37 37 CYS N N 37 125.400 125.400 120.334 5.066 25800
5195 1 11 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.729 -1.029 25800
5196 1 11 . 1 1 37 37 CYS C C 37 171.600 171.600 172.767 -1.167 25800
5197 1 11 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.781 1.119 25800
5198 1 11 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.334 -4.234 25800
5199 1 11 . 1 1 37 37 CYS H H 37 8.610 8.610 8.727 -0.117 25800
5200 1 11 . 1 1 38 38 ASP N N 38 128.200 128.200 121.770 6.430 25800
5201 1 11 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.953 -0.003 25800
5202 1 11 . 1 1 38 38 ASP C C 38 174.300 174.300 173.942 0.358 25800
5203 1 11 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.908 -0.708 25800
5204 1 11 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.428 -1.129 25800
5205 1 11 . 1 1 38 38 ASP H H 38 8.290 8.290 8.812 -0.522 25800
5206 1 11 . 1 1 39 39 VAL N N 39 123.500 123.500 120.590 2.910 25800
5207 1 11 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.944 -0.644 25800
5208 1 11 . 1 1 39 39 VAL C C 39 175.000 175.000 175.092 -0.092 25800
5209 1 11 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.323 0.377 25800
5210 1 11 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.081 -0.981 25800
5211 1 11 . 1 1 39 39 VAL H H 39 8.380 8.380 8.557 -0.177 25800
5212 1 11 . 1 1 40 40 LYS N N 40 129.100 129.100 126.990 2.110 25800
5213 1 11 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.909 -0.589 25800
5214 1 11 . 1 1 40 40 LYS C C 40 173.700 173.700 174.699 -0.999 25800
5215 1 11 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.511 -0.611 25800
5216 1 11 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.340 0.161 25800
5217 1 11 . 1 1 40 40 LYS H H 40 8.680 8.680 9.266 -0.586 25800
5218 1 11 . 1 1 41 41 LYS N N 41 117.300 117.300 120.605 -3.305 25800
5219 1 11 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.239 -0.259 25800
5220 1 11 . 1 1 41 41 LYS C C 41 177.800 177.800 175.648 2.152 25800
5221 1 11 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.457 0.143 25800
5222 1 11 . 1 1 41 41 LYS CB C 41 35.000 35.000 34.968 0.032 25800
5223 1 11 . 1 1 41 41 LYS H H 41 7.900 7.900 8.317 -0.417 25800
5224 1 11 . 1 1 42 42 THR N N 42 113.200 113.200 115.951 -2.751 25800
5225 1 11 . 1 1 42 42 THR HA H 42 4.680 4.680 4.692 -0.012 25800
5226 1 11 . 1 1 42 42 THR C C 42 176.900 176.900 176.550 0.350 25800
5227 1 11 . 1 1 42 42 THR CA C 42 60.200 60.200 60.544 -0.344 25800
5228 1 11 . 1 1 42 42 THR CB C 42 71.600 71.600 69.944 1.656 25800
5229 1 11 . 1 1 42 42 THR H H 42 8.730 8.730 8.485 0.245 25800
5230 1 11 . 1 1 43 43 VAL N N 43 120.000 120.000 124.122 -4.122 25800
5231 1 11 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.014 -0.094 25800
5232 1 11 . 1 1 43 43 VAL C C 43 177.000 177.000 176.541 0.459 25800
5233 1 11 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.473 0.227 25800
5234 1 11 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.715 0.085 25800
5235 1 11 . 1 1 43 43 VAL H H 43 8.730 8.730 8.540 0.190 25800
5236 1 11 . 1 1 44 44 SER N N 44 113.400 113.400 115.474 -2.074 25800
5237 1 11 . 1 1 44 44 SER HA H 44 4.360 4.360 4.372 -0.012 25800
5238 1 11 . 1 1 44 44 SER C C 44 174.800 174.800 175.455 -0.655 25800
5239 1 11 . 1 1 44 44 SER CA C 44 58.400 58.400 58.610 -0.210 25800
5240 1 11 . 1 1 44 44 SER CB C 44 63.500 63.500 63.506 -0.006 25800
5241 1 11 . 1 1 44 44 SER H H 44 7.760 7.760 7.989 -0.229 25800
5242 1 11 . 1 1 45 45 GLY N N 45 110.200 110.200 108.601 1.599 25800
5243 1 11 . 1 1 45 45 GLY C C 45 173.500 173.500 173.947 -0.447 25800
5244 1 11 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.786 0.514 25800
5245 1 11 . 1 1 45 45 GLY H H 45 7.820 7.820 7.754 0.066 25800
5246 1 11 . 1 1 46 46 ALA N N 46 123.900 123.900 122.221 1.679 25800
5247 1 11 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.241 0.149 25800
5248 1 11 . 1 1 46 46 ALA C C 46 176.100 176.100 175.633 0.467 25800
5249 1 11 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.833 0.067 25800
5250 1 11 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.900 -0.100 25800
5251 1 11 . 1 1 46 46 ALA H H 46 7.440 7.440 7.813 -0.373 25800
5252 1 11 . 1 1 47 47 ALA N N 47 123.100 123.100 122.829 0.271 25800
5253 1 11 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.062 0.138 25800
5254 1 11 . 1 1 47 47 ALA C C 47 176.100 176.100 175.602 0.498 25800
5255 1 11 . 1 1 47 47 ALA CA C 47 50.900 50.900 49.988 0.912 25800
5256 1 11 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.041 -0.141 25800
5257 1 11 . 1 1 47 47 ALA H H 47 8.350 8.350 7.901 0.449 25800
5258 1 11 . 1 1 48 48 PHE N N 48 118.700 118.700 117.745 0.955 25800
5259 1 11 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.325 -0.295 25800
5260 1 11 . 1 1 48 48 PHE C C 48 171.600 171.600 174.209 -2.609 25800
5261 1 11 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.718 -1.018 25800
5262 1 11 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.099 -1.899 25800
5263 1 11 . 1 1 48 48 PHE H H 48 8.550 8.550 9.042 -0.492 25800
5264 1 11 . 1 1 49 49 ALA N N 49 120.400 120.400 124.823 -4.423 25800
5265 1 11 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.234 0.096 25800
5266 1 11 . 1 1 49 49 ALA C C 49 175.500 175.500 175.497 0.003 25800
5267 1 11 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.312 -1.012 25800
5268 1 11 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.350 2.350 25800
5269 1 11 . 1 1 49 49 ALA H H 49 9.240 9.240 8.920 0.320 25800
5270 1 11 . 1 1 50 50 PHE N N 50 115.000 115.000 120.039 -5.039 25800
5271 1 11 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.553 0.047 25800
5272 1 11 . 1 1 50 50 PHE C C 50 176.000 176.000 174.278 1.722 25800
5273 1 11 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.422 0.078 25800
5274 1 11 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.288 -1.087 25800
5275 1 11 . 1 1 50 50 PHE H H 50 7.920 7.920 8.956 -1.036 25800
5276 1 11 . 1 1 51 51 ILE N N 51 123.000 123.000 122.030 0.970 25800
5277 1 11 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.649 -0.199 25800
5278 1 11 . 1 1 51 51 ILE C C 51 173.700 173.700 174.472 -0.772 25800
5279 1 11 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.558 -0.358 25800
5280 1 11 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.499 0.201 25800
5281 1 11 . 1 1 51 51 ILE H H 51 8.490 8.490 8.837 -0.347 25800
5282 1 11 . 1 1 52 52 GLU N N 52 126.600 126.600 127.444 -0.844 25800
5283 1 11 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.846 -0.076 25800
5284 1 11 . 1 1 52 52 GLU C C 52 175.300 175.300 175.250 0.050 25800
5285 1 11 . 1 1 52 52 GLU CA C 52 54.700 54.700 56.337 -1.637 25800
5286 1 11 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.662 -0.162 25800
5287 1 11 . 1 1 52 52 GLU H H 52 8.610 8.610 9.123 -0.513 25800
5288 1 11 . 1 1 53 53 PHE N N 53 126.100 126.100 125.513 0.587 25800
5289 1 11 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.162 -0.362 25800
5290 1 11 . 1 1 53 53 PHE C C 53 175.400 175.400 175.108 0.292 25800
5291 1 11 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.456 1.744 25800
5292 1 11 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.556 -2.656 25800
5293 1 11 . 1 1 53 53 PHE H H 53 8.800 8.800 8.995 -0.195 25800
5294 1 11 . 1 1 54 54 GLU N N 54 120.700 120.700 120.828 -0.128 25800
5295 1 11 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.294 -0.364 25800
5296 1 11 . 1 1 54 54 GLU C C 54 175.300 175.300 175.899 -0.599 25800
5297 1 11 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.424 1.676 25800
5298 1 11 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.323 0.477 25800
5299 1 11 . 1 1 54 54 GLU H H 54 8.160 8.160 8.142 0.018 25800
5300 1 11 . 1 1 55 55 ASP N N 55 117.900 117.900 120.925 -3.025 25800
5301 1 11 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.925 -0.005 25800
5302 1 11 . 1 1 55 55 ASP C C 55 176.400 176.400 175.552 0.848 25800
5303 1 11 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.317 -0.917 25800
5304 1 11 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.051 2.349 25800
5305 1 11 . 1 1 55 55 ASP H H 55 8.740 8.740 8.051 0.689 25800
5306 1 11 . 1 1 56 56 ALA N N 56 128.900 128.900 127.398 1.502 25800
5307 1 11 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.180 0.650 25800
5308 1 11 . 1 1 56 56 ALA C C 56 179.800 179.800 178.330 1.470 25800
5309 1 11 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.992 0.208 25800
5310 1 11 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.188 -0.288 25800
5311 1 11 . 1 1 56 56 ALA H H 56 8.800 8.800 8.497 0.303 25800
5312 1 11 . 1 1 57 57 ARG N N 57 119.200 119.200 116.453 2.747 25800
5313 1 11 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.127 -0.237 25800
5314 1 11 . 1 1 57 57 ARG C C 57 178.000 178.000 177.133 0.867 25800
5315 1 11 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.728 0.172 25800
5316 1 11 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.457 -0.158 25800
5317 1 11 . 1 1 57 57 ARG H H 57 8.950 8.950 8.410 0.540 25800
5318 1 11 . 1 1 58 58 ASP N N 58 120.900 120.900 120.048 0.852 25800
5319 1 11 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.551 -0.461 25800
5320 1 11 . 1 1 58 58 ASP C C 58 176.700 176.700 177.628 -0.928 25800
5321 1 11 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.545 -0.045 25800
5322 1 11 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.576 -0.676 25800
5323 1 11 . 1 1 58 58 ASP H H 58 7.020 7.020 8.236 -1.216 25800
5324 1 11 . 1 1 59 59 ALA N N 59 119.700 119.700 122.185 -2.485 25800
5325 1 11 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.613 -1.533 25800
5326 1 11 . 1 1 59 59 ALA C C 59 178.100 178.100 179.612 -1.512 25800
5327 1 11 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.802 -0.502 25800
5328 1 11 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.709 -0.309 25800
5329 1 11 . 1 1 59 59 ALA H H 59 6.440 6.440 7.645 -1.205 25800
5330 1 11 . 1 1 60 60 ALA N N 60 117.600 117.600 121.173 -3.573 25800
5331 1 11 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.156 -0.326 25800
5332 1 11 . 1 1 60 60 ALA C C 60 180.900 180.900 178.983 1.917 25800
5333 1 11 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.694 -0.794 25800
5334 1 11 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.330 -0.630 25800
5335 1 11 . 1 1 60 60 ALA H H 60 7.330 7.330 8.584 -1.254 25800
5336 1 11 . 1 1 61 61 ASP N N 61 120.100 120.100 117.667 2.433 25800
5337 1 11 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.477 -0.267 25800
5338 1 11 . 1 1 61 61 ASP C C 61 176.700 176.700 177.476 -0.776 25800
5339 1 11 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.613 0.487 25800
5340 1 11 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.688 -0.588 25800
5341 1 11 . 1 1 61 61 ASP H H 61 7.590 7.590 8.275 -0.685 25800
5342 1 11 . 1 1 62 62 ALA N N 62 122.200 122.200 121.681 0.519 25800
5343 1 11 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.245 -1.825 25800
5344 1 11 . 1 1 62 62 ALA C C 62 179.300 179.300 179.308 -0.008 25800
5345 1 11 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.134 0.466 25800
5346 1 11 . 1 1 62 62 ALA CB C 62 19.100 19.100 19.027 0.073 25800
5347 1 11 . 1 1 62 62 ALA H H 62 7.440 7.440 7.451 -0.011 25800
5348 1 11 . 1 1 63 63 ILE N N 63 116.700 116.700 119.517 -2.817 25800
5349 1 11 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.180 -0.940 25800
5350 1 11 . 1 1 63 63 ILE C C 63 177.800 177.800 177.879 -0.079 25800
5351 1 11 . 1 1 63 63 ILE CA C 63 65.600 65.600 62.684 2.916 25800
5352 1 11 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.011 0.889 25800
5353 1 11 . 1 1 63 63 ILE H H 63 7.540 7.540 8.538 -0.998 25800
5354 1 11 . 1 1 64 64 LYS N N 64 117.400 117.400 120.213 -2.813 25800
5355 1 11 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.096 -0.196 25800
5356 1 11 . 1 1 64 64 LYS C C 64 178.900 178.900 178.277 0.623 25800
5357 1 11 . 1 1 64 64 LYS CA C 64 58.800 58.800 59.112 -0.312 25800
5358 1 11 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.521 1.079 25800
5359 1 11 . 1 1 64 64 LYS H H 64 7.490 7.490 8.493 -1.003 25800
5360 1 11 . 1 1 65 65 GLU N N 65 113.800 113.800 117.754 -3.954 25800
5361 1 11 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.279 -0.119 25800
5362 1 11 . 1 1 65 65 GLU C C 65 178.300 178.300 177.455 0.845 25800
5363 1 11 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.124 0.176 25800
5364 1 11 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.563 2.137 25800
5365 1 11 . 1 1 65 65 GLU H H 65 7.960 7.960 8.325 -0.365 25800
5366 1 11 . 1 1 66 66 LYS N N 66 114.700 114.700 118.288 -3.588 25800
5367 1 11 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.522 -0.052 25800
5368 1 11 . 1 1 66 66 LYS C C 66 177.500 177.500 176.555 0.945 25800
5369 1 11 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.298 -0.898 25800
5370 1 11 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.351 0.649 25800
5371 1 11 . 1 1 66 66 LYS H H 66 8.050 8.050 7.774 0.276 25800
5372 1 11 . 1 1 67 67 ASP N N 67 118.800 118.800 120.765 -1.965 25800
5373 1 11 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.484 -0.264 25800
5374 1 11 . 1 1 67 67 ASP C C 67 177.700 177.700 177.564 0.136 25800
5375 1 11 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.424 3.976 25800
5376 1 11 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.171 0.229 25800
5377 1 11 . 1 1 67 67 ASP H H 67 7.620 7.620 7.534 0.086 25800
5378 1 11 . 1 1 68 68 GLY N N 68 115.600 115.600 108.009 7.591 25800
5379 1 11 . 1 1 68 68 GLY C C 68 173.800 173.800 174.722 -0.922 25800
5380 1 11 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.685 1.215 25800
5381 1 11 . 1 1 68 68 GLY H H 68 8.470 8.470 8.614 -0.144 25800
5382 1 11 . 1 1 69 69 CYS N N 69 119.200 119.200 120.224 -1.024 25800
5383 1 11 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.758 -0.598 25800
5384 1 11 . 1 1 69 69 CYS C C 69 172.600 172.600 174.700 -2.100 25800
5385 1 11 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.708 0.292 25800
5386 1 11 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.971 -0.271 25800
5387 1 11 . 1 1 69 69 CYS H H 69 7.890 7.890 8.244 -0.354 25800
5388 1 11 . 1 1 70 70 ASP N N 70 122.200 122.200 125.511 -3.311 25800
5389 1 11 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.033 -0.203 25800
5390 1 11 . 1 1 70 70 ASP C C 70 176.400 176.400 174.970 1.430 25800
5391 1 11 . 1 1 70 70 ASP CA C 70 54.700 54.700 54.080 0.620 25800
5392 1 11 . 1 1 70 70 ASP CB C 70 42.700 42.700 42.928 -0.228 25800
5393 1 11 . 1 1 70 70 ASP H H 70 8.360 8.360 8.572 -0.212 25800
5394 1 11 . 1 1 71 71 PHE N N 71 127.600 127.600 121.230 6.370 25800
5395 1 11 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.149 -0.549 25800
5396 1 11 . 1 1 71 71 PHE C C 71 173.600 173.600 174.773 -1.173 25800
5397 1 11 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.374 0.426 25800
5398 1 11 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.544 -0.844 25800
5399 1 11 . 1 1 71 71 PHE H H 71 9.390 9.390 7.952 1.438 25800
5400 1 11 . 1 1 72 72 GLU N N 72 123.900 123.900 120.292 3.608 25800
5401 1 11 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.044 -0.504 25800
5402 1 11 . 1 1 72 72 GLU C C 72 175.500 175.500 176.884 -1.384 25800
5403 1 11 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.443 0.257 25800
5404 1 11 . 1 1 72 72 GLU CB C 72 27.300 27.300 29.197 -1.897 25800
5405 1 11 . 1 1 72 72 GLU H H 72 8.940 8.940 9.210 -0.270 25800
5406 1 11 . 1 1 73 73 GLY N N 73 105.200 105.200 112.299 -7.099 25800
5407 1 11 . 1 1 73 73 GLY C C 73 174.100 174.100 174.510 -0.410 25800
5408 1 11 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.303 0.296 25800
5409 1 11 . 1 1 73 73 GLY H H 73 8.350 8.350 8.734 -0.384 25800
5410 1 11 . 1 1 74 74 ASN N N 74 121.000 121.000 122.399 -1.399 25800
5411 1 11 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.686 0.074 25800
5412 1 11 . 1 1 74 74 ASN C C 74 174.000 174.000 174.154 -0.154 25800
5413 1 11 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.323 -2.423 25800
5414 1 11 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.151 0.549 25800
5415 1 11 . 1 1 74 74 ASN H H 74 7.740 7.740 8.008 -0.268 25800
5416 1 11 . 1 1 75 75 LYS N N 75 121.400 121.400 120.569 0.831 25800
5417 1 11 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.684 -0.214 25800
5418 1 11 . 1 1 75 75 LYS C C 75 176.900 176.900 175.155 1.745 25800
5419 1 11 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.301 -1.001 25800
5420 1 11 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.618 -1.718 25800
5421 1 11 . 1 1 75 75 LYS H H 75 8.380 8.380 8.426 -0.046 25800
5422 1 11 . 1 1 76 76 LEU N N 76 127.400 127.400 124.373 3.027 25800
5423 1 11 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.497 -0.067 25800
5424 1 11 . 1 1 76 76 LEU C C 76 177.600 177.600 174.506 3.094 25800
5425 1 11 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.252 0.048 25800
5426 1 11 . 1 1 76 76 LEU CB C 76 43.100 43.100 44.708 -1.608 25800
5427 1 11 . 1 1 76 76 LEU H H 76 8.950 8.950 8.868 0.082 25800
5428 1 11 . 1 1 77 77 ARG N N 77 121.800 121.800 125.593 -3.793 25800
5429 1 11 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.739 0.161 25800
5430 1 11 . 1 1 77 77 ARG C C 77 174.700 174.700 173.935 0.765 25800
5431 1 11 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.949 -1.949 25800
5432 1 11 . 1 1 77 77 ARG CB C 77 32.300 32.300 31.952 0.348 25800
5433 1 11 . 1 1 77 77 ARG H H 77 7.530 7.530 8.665 -1.135 25800
5434 1 11 . 1 1 78 78 VAL N N 78 127.000 127.000 120.745 6.255 25800
5435 1 11 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.534 0.746 25800
5436 1 11 . 1 1 78 78 VAL C C 78 174.200 174.200 174.437 -0.237 25800
5437 1 11 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.586 0.614 25800
5438 1 11 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.132 -0.732 25800
5439 1 11 . 1 1 78 78 VAL H H 78 9.660 9.660 8.494 1.166 25800
5440 1 11 . 1 1 79 79 GLU N N 79 121.900 121.900 126.066 -4.166 25800
5441 1 11 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.591 0.119 25800
5442 1 11 . 1 1 79 79 GLU C C 79 174.600 174.600 173.781 0.819 25800
5443 1 11 . 1 1 79 79 GLU CA C 79 53.900 53.900 56.043 -2.143 25800
5444 1 11 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.172 0.228 25800
5445 1 11 . 1 1 79 79 GLU H H 79 8.980 8.980 8.067 0.913 25800
5446 1 11 . 1 1 80 80 VAL N N 80 121.300 121.300 118.736 2.564 25800
5447 1 11 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.571 -0.201 25800
5448 1 11 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.334 2.666 25800
5449 1 11 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.229 -1.129 25800
5450 1 11 . 1 1 80 80 VAL H H 80 8.410 8.410 8.159 0.251 25800
5451 1 11 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.367 -0.107 25800
5452 1 11 . 1 1 81 81 PRO C C 81 176.100 176.100 177.256 -1.156 25800
5453 1 11 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.993 -1.893 25800
5454 1 11 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.756 0.344 25800
5455 1 11 . 1 1 82 82 PHE N N 82 122.200 122.200 115.281 6.919 25800
5456 1 11 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.656 -0.366 25800
5457 1 11 . 1 1 82 82 PHE C C 82 175.300 175.300 175.711 -0.411 25800
5458 1 11 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.654 2.446 25800
5459 1 11 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.628 1.772 25800
5460 1 11 . 1 1 82 82 PHE H H 82 8.150 8.150 7.718 0.432 25800
5461 1 11 . 1 1 83 83 ASN N N 83 120.800 120.800 122.994 -2.194 25800
5462 1 11 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.638 -0.198 25800
5463 1 11 . 1 1 83 83 ASN C C 83 174.100 174.100 174.679 -0.579 25800
5464 1 11 . 1 1 83 83 ASN CA C 83 52.700 52.700 52.805 -0.105 25800
5465 1 11 . 1 1 83 83 ASN CB C 83 38.700 38.700 36.747 1.953 25800
5466 1 11 . 1 1 83 83 ASN H H 83 8.110 8.110 7.741 0.369 25800
5467 1 11 . 1 1 84 84 ALA N N 84 123.700 123.700 121.165 2.535 25800
5468 1 11 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.562 -0.482 25800
5469 1 11 . 1 1 84 84 ALA C C 84 177.100 177.100 176.944 0.156 25800
5470 1 11 . 1 1 84 84 ALA CA C 84 52.400 52.400 53.066 -0.666 25800
5471 1 11 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.805 -0.705 25800
5472 1 11 . 1 1 84 84 ALA H H 84 8.020 8.020 8.219 -0.199 25800
5473 1 11 . 1 1 85 85 ARG N N 85 120.200 120.200 120.128 0.072 25800
5474 1 11 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.579 -0.429 25800
5475 1 11 . 1 1 85 85 ARG C C 85 175.200 175.200 175.557 -0.357 25800
5476 1 11 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.715 0.285 25800
5477 1 11 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.384 0.416 25800
5478 1 11 . 1 1 85 85 ARG H H 85 8.040 8.040 8.815 -0.775 25800
5479 1 12 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.738 -0.148 25800
5480 1 12 . 1 1 0 0 HIS C C 0 174.000 174.000 174.214 -0.214 25800
5481 1 12 . 1 1 0 0 HIS CA C 0 55.300 55.300 55.323 -0.023 25800
5482 1 12 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.054 -0.754 25800
5483 1 12 . 1 1 1 1 MET N N 1 122.400 122.400 118.920 3.480 25800
5484 1 12 . 1 1 1 1 MET HA H 1 4.340 4.340 4.529 -0.189 25800
5485 1 12 . 1 1 1 1 MET C C 1 175.600 175.600 176.210 -0.610 25800
5486 1 12 . 1 1 1 1 MET CA C 1 55.600 55.600 55.599 0.001 25800
5487 1 12 . 1 1 1 1 MET CB C 1 32.800 32.800 33.296 -0.496 25800
5488 1 12 . 1 1 1 1 MET H H 1 8.310 8.310 8.686 -0.376 25800
5489 1 12 . 1 1 2 2 VAL N N 2 123.200 123.200 117.928 5.272 25800
5490 1 12 . 1 1 2 2 VAL HA H 2 3.960 3.960 3.802 0.158 25800
5491 1 12 . 1 1 2 2 VAL C C 2 175.600 175.600 175.826 -0.226 25800
5492 1 12 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.772 -0.472 25800
5493 1 12 . 1 1 2 2 VAL CB C 2 32.300 32.300 29.939 2.361 25800
5494 1 12 . 1 1 2 2 VAL H H 2 8.180 8.180 8.027 0.153 25800
5495 1 12 . 1 1 3 3 ILE N N 3 126.200 126.200 113.823 12.377 25800
5496 1 12 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.063 -0.013 25800
5497 1 12 . 1 1 3 3 ILE C C 3 175.800 175.800 176.746 -0.946 25800
5498 1 12 . 1 1 3 3 ILE CA C 3 60.700 60.700 62.464 -1.764 25800
5499 1 12 . 1 1 3 3 ILE CB C 3 38.300 38.300 37.623 0.677 25800
5500 1 12 . 1 1 3 3 ILE H H 3 8.230 8.230 7.909 0.321 25800
5501 1 12 . 1 1 4 4 ARG N N 4 126.100 126.100 121.760 4.340 25800
5502 1 12 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.398 -0.218 25800
5503 1 12 . 1 1 4 4 ARG C C 4 175.900 175.900 177.239 -1.339 25800
5504 1 12 . 1 1 4 4 ARG CA C 4 56.000 56.000 55.834 0.166 25800
5505 1 12 . 1 1 4 4 ARG CB C 4 30.700 30.700 31.130 -0.430 25800
5506 1 12 . 1 1 4 4 ARG H H 4 8.360 8.360 7.663 0.697 25800
5507 1 12 . 1 1 5 5 GLU N N 5 122.200 122.200 118.300 3.900 25800
5508 1 12 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.104 0.036 25800
5509 1 12 . 1 1 5 5 GLU C C 5 176.100 176.100 174.927 1.173 25800
5510 1 12 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.709 -1.109 25800
5511 1 12 . 1 1 5 5 GLU CB C 5 30.300 30.300 28.844 1.456 25800
5512 1 12 . 1 1 5 5 GLU H H 5 8.400 8.400 8.790 -0.390 25800
5513 1 12 . 1 1 6 6 SER N N 6 116.200 116.200 109.865 6.335 25800
5514 1 12 . 1 1 6 6 SER HA H 6 4.350 4.350 4.632 -0.282 25800
5515 1 12 . 1 1 6 6 SER C C 6 174.300 174.300 172.835 1.465 25800
5516 1 12 . 1 1 6 6 SER CA C 6 58.200 58.200 57.249 0.951 25800
5517 1 12 . 1 1 6 6 SER CB C 6 63.800 63.800 66.162 -2.362 25800
5518 1 12 . 1 1 6 6 SER H H 6 8.270 8.270 7.476 0.794 25800
5519 1 12 . 1 1 7 7 VAL N N 7 119.800 119.800 120.271 -0.471 25800
5520 1 12 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.309 -0.009 25800
5521 1 12 . 1 1 7 7 VAL C C 7 175.500 175.500 174.896 0.604 25800
5522 1 12 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.903 -0.203 25800
5523 1 12 . 1 1 7 7 VAL CB C 7 32.800 32.800 34.180 -1.380 25800
5524 1 12 . 1 1 7 7 VAL H H 7 7.840 7.840 8.392 -0.552 25800
5525 1 12 . 1 1 8 8 SER N N 8 117.800 117.800 117.896 -0.096 25800
5526 1 12 . 1 1 8 8 SER HA H 8 4.240 4.240 4.715 -0.475 25800
5527 1 12 . 1 1 8 8 SER C C 8 172.500 172.500 172.660 -0.160 25800
5528 1 12 . 1 1 8 8 SER CA C 8 58.500 58.500 57.600 0.900 25800
5529 1 12 . 1 1 8 8 SER CB C 8 63.600 63.600 63.906 -0.306 25800
5530 1 12 . 1 1 8 8 SER H H 8 8.530 8.530 8.254 0.276 25800
5531 1 12 . 1 1 9 9 ARG N N 9 123.000 123.000 124.468 -1.468 25800
5532 1 12 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.135 0.365 25800
5533 1 12 . 1 1 9 9 ARG C C 9 175.000 175.000 174.898 0.102 25800
5534 1 12 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.271 0.029 25800
5535 1 12 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.608 -0.207 25800
5536 1 12 . 1 1 9 9 ARG H H 9 7.350 7.350 7.920 -0.570 25800
5537 1 12 . 1 1 10 10 ILE N N 10 114.000 114.000 121.219 -7.219 25800
5538 1 12 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.447 0.373 25800
5539 1 12 . 1 1 10 10 ILE C C 10 173.000 173.000 175.014 -2.014 25800
5540 1 12 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.362 -1.962 25800
5541 1 12 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.548 1.352 25800
5542 1 12 . 1 1 10 10 ILE H H 10 8.830 8.830 8.726 0.104 25800
5543 1 12 . 1 1 11 11 TYR N N 11 123.400 123.400 126.082 -2.682 25800
5544 1 12 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.861 0.069 25800
5545 1 12 . 1 1 11 11 TYR C C 11 173.000 173.000 173.258 -0.258 25800
5546 1 12 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.796 0.204 25800
5547 1 12 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.325 -1.425 25800
5548 1 12 . 1 1 11 11 TYR H H 11 8.690 8.690 8.005 0.685 25800
5549 1 12 . 1 1 12 12 VAL N N 12 126.300 126.300 124.221 2.079 25800
5550 1 12 . 1 1 12 12 VAL HA H 12 4.560 4.560 3.853 0.708 25800
5551 1 12 . 1 1 12 12 VAL C C 12 174.100 174.100 173.910 0.190 25800
5552 1 12 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.700 -0.500 25800
5553 1 12 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.724 -1.324 25800
5554 1 12 . 1 1 12 12 VAL H H 12 8.370 8.370 7.646 0.724 25800
5555 1 12 . 1 1 13 13 GLY N N 13 113.000 113.000 111.398 1.602 25800
5556 1 12 . 1 1 13 13 GLY C C 13 173.100 173.100 173.436 -0.336 25800
5557 1 12 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.545 -0.245 25800
5558 1 12 . 1 1 13 13 GLY H H 13 9.350 9.350 8.366 0.984 25800
5559 1 12 . 1 1 14 14 ASN N N 14 113.900 113.900 117.494 -3.594 25800
5560 1 12 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.041 0.239 25800
5561 1 12 . 1 1 14 14 ASN C C 14 175.800 175.800 175.039 0.761 25800
5562 1 12 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.678 -0.078 25800
5563 1 12 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.582 1.118 25800
5564 1 12 . 1 1 14 14 ASN H H 14 8.800 8.800 8.567 0.233 25800
5565 1 12 . 1 1 15 15 LEU N N 15 115.800 115.800 121.031 -5.231 25800
5566 1 12 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.192 0.798 25800
5567 1 12 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.945 1.655 25800
5568 1 12 . 1 1 15 15 LEU CB C 15 41.600 41.600 42.937 -1.337 25800
5569 1 12 . 1 1 15 15 LEU H H 15 7.150 7.150 7.681 -0.531 25800
5570 1 12 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.474 -0.404 25800
5571 1 12 . 1 1 16 16 PRO C C 16 171.500 171.500 176.789 -5.289 25800
5572 1 12 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.910 -0.410 25800
5573 1 12 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.455 0.545 25800
5574 1 12 . 1 1 17 17 SER N N 17 115.200 115.200 117.395 -2.195 25800
5575 1 12 . 1 1 17 17 SER HA H 17 4.300 4.300 4.125 0.175 25800
5576 1 12 . 1 1 17 17 SER C C 17 174.200 174.200 173.308 0.892 25800
5577 1 12 . 1 1 17 17 SER CA C 17 58.200 58.200 58.433 -0.233 25800
5578 1 12 . 1 1 17 17 SER CB C 17 63.900 63.900 63.606 0.294 25800
5579 1 12 . 1 1 17 17 SER H H 17 8.470 8.470 8.349 0.121 25800
5580 1 12 . 1 1 18 18 HIS N N 18 120.800 120.800 118.686 2.114 25800
5581 1 12 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.703 -0.153 25800
5582 1 12 . 1 1 18 18 HIS C C 18 175.100 175.100 174.989 0.111 25800
5583 1 12 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.084 0.416 25800
5584 1 12 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.357 -0.057 25800
5585 1 12 . 1 1 18 18 HIS H H 18 8.540 8.540 8.268 0.273 25800
5586 1 12 . 1 1 19 19 VAL N N 19 115.700 115.700 121.828 -6.128 25800
5587 1 12 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.219 0.041 25800
5588 1 12 . 1 1 19 19 VAL C C 19 174.000 174.000 175.843 -1.843 25800
5589 1 12 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.949 -0.049 25800
5590 1 12 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.732 -0.132 25800
5591 1 12 . 1 1 19 19 VAL H H 19 6.650 6.650 7.913 -1.263 25800
5592 1 12 . 1 1 20 20 SER N N 20 118.800 118.800 120.731 -1.931 25800
5593 1 12 . 1 1 20 20 SER HA H 20 4.710 4.710 4.669 0.041 25800
5594 1 12 . 1 1 20 20 SER C C 20 175.900 175.900 175.959 -0.059 25800
5595 1 12 . 1 1 20 20 SER CA C 20 55.800 55.800 57.619 -1.819 25800
5596 1 12 . 1 1 20 20 SER CB C 20 66.600 66.600 64.499 2.101 25800
5597 1 12 . 1 1 20 20 SER H H 20 8.930 8.930 8.454 0.476 25800
5598 1 12 . 1 1 21 21 SER N N 21 117.100 117.100 122.731 -5.631 25800
5599 1 12 . 1 1 21 21 SER HA H 21 3.880 3.880 3.980 -0.100 25800
5600 1 12 . 1 1 21 21 SER C C 21 176.200 176.200 176.408 -0.208 25800
5601 1 12 . 1 1 21 21 SER CA C 21 62.300 62.300 61.473 0.827 25800
5602 1 12 . 1 1 21 21 SER CB C 21 66.800 66.800 62.678 4.122 25800
5603 1 12 . 1 1 21 21 SER H H 21 9.080 9.080 9.022 0.058 25800
5604 1 12 . 1 1 22 22 ARG N N 22 121.200 121.200 119.391 1.809 25800
5605 1 12 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.240 -0.250 25800
5606 1 12 . 1 1 22 22 ARG C C 22 177.900 177.900 178.095 -0.195 25800
5607 1 12 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.501 0.199 25800
5608 1 12 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.034 0.566 25800
5609 1 12 . 1 1 22 22 ARG H H 22 7.940 7.940 8.681 -0.741 25800
5610 1 12 . 1 1 23 23 ASP N N 23 118.800 118.800 121.204 -2.404 25800
5611 1 12 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.588 -0.198 25800
5612 1 12 . 1 1 23 23 ASP C C 23 179.200 179.200 178.571 0.629 25800
5613 1 12 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.057 0.242 25800
5614 1 12 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.223 0.777 25800
5615 1 12 . 1 1 23 23 ASP H H 23 7.480 7.480 7.476 0.004 25800
5616 1 12 . 1 1 24 24 VAL N N 24 119.500 119.500 120.573 -1.073 25800
5617 1 12 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.754 -0.384 25800
5618 1 12 . 1 1 24 24 VAL C C 24 177.500 177.500 177.516 -0.016 25800
5619 1 12 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.871 0.029 25800
5620 1 12 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.593 -0.193 25800
5621 1 12 . 1 1 24 24 VAL H H 24 7.450 7.450 7.977 -0.527 25800
5622 1 12 . 1 1 25 25 GLU N N 25 121.400 121.400 120.016 1.384 25800
5623 1 12 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.840 -0.270 25800
5624 1 12 . 1 1 25 25 GLU C C 25 178.400 178.400 178.613 -0.213 25800
5625 1 12 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.029 0.571 25800
5626 1 12 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.425 0.175 25800
5627 1 12 . 1 1 25 25 GLU H H 25 8.580 8.580 8.522 0.058 25800
5628 1 12 . 1 1 26 26 ASN N N 26 114.800 114.800 117.254 -2.454 25800
5629 1 12 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.477 -0.157 25800
5630 1 12 . 1 1 26 26 ASN C C 26 177.400 177.400 177.445 -0.045 25800
5631 1 12 . 1 1 26 26 ASN CA C 26 55.900 55.900 56.000 -0.100 25800
5632 1 12 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.638 -0.738 25800
5633 1 12 . 1 1 26 26 ASN H H 26 8.180 8.180 8.052 0.128 25800
5634 1 12 . 1 1 27 27 GLU N N 27 118.900 118.900 119.677 -0.777 25800
5635 1 12 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.166 -0.026 25800
5636 1 12 . 1 1 27 27 GLU C C 27 176.400 176.400 179.326 -2.926 25800
5637 1 12 . 1 1 27 27 GLU CA C 27 57.400 57.400 59.166 -1.766 25800
5638 1 12 . 1 1 27 27 GLU CB C 27 29.400 29.400 30.147 -0.747 25800
5639 1 12 . 1 1 27 27 GLU H H 27 7.340 7.340 7.845 -0.505 25800
5640 1 12 . 1 1 28 28 PHE N N 28 114.100 114.100 119.017 -4.917 25800
5641 1 12 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.891 -0.341 25800
5642 1 12 . 1 1 28 28 PHE C C 28 176.300 176.300 178.001 -1.701 25800
5643 1 12 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.111 -0.111 25800
5644 1 12 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.005 1.796 25800
5645 1 12 . 1 1 28 28 PHE H H 28 7.660 7.660 8.680 -1.020 25800
5646 1 12 . 1 1 29 29 ARG N N 29 121.700 121.700 120.793 0.907 25800
5647 1 12 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.466 -0.056 25800
5648 1 12 . 1 1 29 29 ARG C C 29 177.100 177.100 178.617 -1.517 25800
5649 1 12 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.428 -0.228 25800
5650 1 12 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.449 -0.149 25800
5651 1 12 . 1 1 29 29 ARG H H 29 8.120 8.120 8.319 -0.199 25800
5652 1 12 . 1 1 30 30 LYS N N 30 117.200 117.200 119.204 -2.004 25800
5653 1 12 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.102 -0.272 25800
5654 1 12 . 1 1 30 30 LYS C C 30 177.100 177.100 177.457 -0.357 25800
5655 1 12 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.343 -0.543 25800
5656 1 12 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.344 -0.244 25800
5657 1 12 . 1 1 30 30 LYS H H 30 7.630 7.630 7.702 -0.072 25800
5658 1 12 . 1 1 31 31 TYR N N 31 117.100 117.100 117.854 -0.754 25800
5659 1 12 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.798 -0.648 25800
5660 1 12 . 1 1 31 31 TYR C C 31 174.400 174.400 175.305 -0.905 25800
5661 1 12 . 1 1 31 31 TYR CA C 31 59.900 59.900 57.319 2.581 25800
5662 1 12 . 1 1 31 31 TYR CB C 31 37.900 37.900 38.574 -0.674 25800
5663 1 12 . 1 1 31 31 TYR H H 31 7.410 7.410 7.876 -0.466 25800
5664 1 12 . 1 1 32 32 GLY N N 32 104.100 104.100 106.230 -2.130 25800
5665 1 12 . 1 1 32 32 GLY C C 32 177.000 177.000 172.805 4.195 25800
5666 1 12 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.423 0.077 25800
5667 1 12 . 1 1 32 32 GLY H H 32 7.240 7.240 7.634 -0.394 25800
5668 1 12 . 1 1 33 33 ASN N N 33 115.300 115.300 120.611 -5.311 25800
5669 1 12 . 1 1 33 33 ASN HA H 33 4.440 4.440 5.140 -0.700 25800
5670 1 12 . 1 1 33 33 ASN C C 33 175.500 175.500 175.487 0.013 25800
5671 1 12 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.373 1.927 25800
5672 1 12 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.529 -0.129 25800
5673 1 12 . 1 1 33 33 ASN H H 33 8.460 8.460 8.468 -0.008 25800
5674 1 12 . 1 1 34 34 ILE N N 34 126.700 126.700 123.947 2.753 25800
5675 1 12 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.165 -0.375 25800
5676 1 12 . 1 1 34 34 ILE C C 34 175.600 175.600 175.057 0.543 25800
5677 1 12 . 1 1 34 34 ILE CA C 34 61.300 61.300 62.198 -0.898 25800
5678 1 12 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.684 1.316 25800
5679 1 12 . 1 1 34 34 ILE H H 34 8.050 8.050 8.488 -0.438 25800
5680 1 12 . 1 1 35 35 LEU N N 35 127.400 127.400 127.172 0.228 25800
5681 1 12 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.394 -0.234 25800
5682 1 12 . 1 1 35 35 LEU C C 35 177.200 177.200 177.243 -0.043 25800
5683 1 12 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.907 -0.407 25800
5684 1 12 . 1 1 35 35 LEU CB C 35 42.700 42.700 41.991 0.709 25800
5685 1 12 . 1 1 35 35 LEU H H 35 8.780 8.780 9.034 -0.254 25800
5686 1 12 . 1 1 36 36 LYS N N 36 117.000 117.000 115.926 1.074 25800
5687 1 12 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.507 -0.267 25800
5688 1 12 . 1 1 36 36 LYS C C 36 173.600 173.600 173.734 -0.134 25800
5689 1 12 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.161 0.739 25800
5690 1 12 . 1 1 36 36 LYS CB C 36 36.600 36.600 34.849 1.751 25800
5691 1 12 . 1 1 36 36 LYS H H 36 7.110 7.110 7.537 -0.427 25800
5692 1 12 . 1 1 37 37 CYS N N 37 125.400 125.400 118.965 6.435 25800
5693 1 12 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.594 -0.894 25800
5694 1 12 . 1 1 37 37 CYS C C 37 171.600 171.600 173.103 -1.503 25800
5695 1 12 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.826 1.074 25800
5696 1 12 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.427 -4.327 25800
5697 1 12 . 1 1 37 37 CYS H H 37 8.610 8.610 8.448 0.162 25800
5698 1 12 . 1 1 38 38 ASP N N 38 128.200 128.200 120.988 7.212 25800
5699 1 12 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.016 -0.066 25800
5700 1 12 . 1 1 38 38 ASP C C 38 174.300 174.300 173.811 0.489 25800
5701 1 12 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.521 -0.321 25800
5702 1 12 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.159 -0.859 25800
5703 1 12 . 1 1 38 38 ASP H H 38 8.290 8.290 8.973 -0.683 25800
5704 1 12 . 1 1 39 39 VAL N N 39 123.500 123.500 120.331 3.169 25800
5705 1 12 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.971 -0.671 25800
5706 1 12 . 1 1 39 39 VAL C C 39 175.000 175.000 175.022 -0.022 25800
5707 1 12 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.333 0.367 25800
5708 1 12 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.335 -1.235 25800
5709 1 12 . 1 1 39 39 VAL H H 39 8.380 8.380 8.507 -0.127 25800
5710 1 12 . 1 1 40 40 LYS N N 40 129.100 129.100 126.938 2.162 25800
5711 1 12 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.957 -0.637 25800
5712 1 12 . 1 1 40 40 LYS C C 40 173.700 173.700 174.662 -0.962 25800
5713 1 12 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.459 -0.558 25800
5714 1 12 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.487 0.013 25800
5715 1 12 . 1 1 40 40 LYS H H 40 8.680 8.680 9.270 -0.590 25800
5716 1 12 . 1 1 41 41 LYS N N 41 117.300 117.300 120.437 -3.137 25800
5717 1 12 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.226 -0.246 25800
5718 1 12 . 1 1 41 41 LYS C C 41 177.800 177.800 175.534 2.266 25800
5719 1 12 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.599 0.001 25800
5720 1 12 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.076 -0.076 25800
5721 1 12 . 1 1 41 41 LYS H H 41 7.900 7.900 8.338 -0.438 25800
5722 1 12 . 1 1 42 42 THR N N 42 113.200 113.200 115.860 -2.660 25800
5723 1 12 . 1 1 42 42 THR HA H 42 4.680 4.680 4.636 0.044 25800
5724 1 12 . 1 1 42 42 THR C C 42 176.900 176.900 176.123 0.777 25800
5725 1 12 . 1 1 42 42 THR CA C 42 60.200 60.200 60.657 -0.457 25800
5726 1 12 . 1 1 42 42 THR CB C 42 71.600 71.600 69.868 1.732 25800
5727 1 12 . 1 1 42 42 THR H H 42 8.730 8.730 8.570 0.160 25800
5728 1 12 . 1 1 43 43 VAL N N 43 120.000 120.000 127.609 -7.609 25800
5729 1 12 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.941 -0.021 25800
5730 1 12 . 1 1 43 43 VAL C C 43 177.000 177.000 176.318 0.682 25800
5731 1 12 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.236 0.464 25800
5732 1 12 . 1 1 43 43 VAL CB C 43 31.800 31.800 32.014 -0.214 25800
5733 1 12 . 1 1 43 43 VAL H H 43 8.730 8.730 8.596 0.134 25800
5734 1 12 . 1 1 44 44 SER N N 44 113.400 113.400 113.997 -0.597 25800
5735 1 12 . 1 1 44 44 SER HA H 44 4.360 4.360 4.342 0.018 25800
5736 1 12 . 1 1 44 44 SER C C 44 174.800 174.800 175.203 -0.403 25800
5737 1 12 . 1 1 44 44 SER CA C 44 58.400 58.400 58.673 -0.273 25800
5738 1 12 . 1 1 44 44 SER CB C 44 63.500 63.500 63.497 0.003 25800
5739 1 12 . 1 1 44 44 SER H H 44 7.760 7.760 7.884 -0.124 25800
5740 1 12 . 1 1 45 45 GLY N N 45 110.200 110.200 108.483 1.717 25800
5741 1 12 . 1 1 45 45 GLY C C 45 173.500 173.500 173.847 -0.347 25800
5742 1 12 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.738 0.562 25800
5743 1 12 . 1 1 45 45 GLY H H 45 7.820 7.820 7.721 0.099 25800
5744 1 12 . 1 1 46 46 ALA N N 46 123.900 123.900 122.716 1.184 25800
5745 1 12 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.214 0.176 25800
5746 1 12 . 1 1 46 46 ALA C C 46 176.100 176.100 175.782 0.318 25800
5747 1 12 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.766 0.134 25800
5748 1 12 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.783 0.017 25800
5749 1 12 . 1 1 46 46 ALA H H 46 7.440 7.440 7.814 -0.374 25800
5750 1 12 . 1 1 47 47 ALA N N 47 123.100 123.100 123.980 -0.880 25800
5751 1 12 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.066 0.134 25800
5752 1 12 . 1 1 47 47 ALA C C 47 176.100 176.100 175.703 0.397 25800
5753 1 12 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.092 0.808 25800
5754 1 12 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.778 0.122 25800
5755 1 12 . 1 1 47 47 ALA H H 47 8.350 8.350 8.016 0.334 25800
5756 1 12 . 1 1 48 48 PHE N N 48 118.700 118.700 117.082 1.618 25800
5757 1 12 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.290 -0.260 25800
5758 1 12 . 1 1 48 48 PHE C C 48 171.600 171.600 174.418 -2.818 25800
5759 1 12 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.797 -1.097 25800
5760 1 12 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.038 -1.838 25800
5761 1 12 . 1 1 48 48 PHE H H 48 8.550 8.550 8.928 -0.378 25800
5762 1 12 . 1 1 49 49 ALA N N 49 120.400 120.400 125.443 -5.043 25800
5763 1 12 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.088 0.241 25800
5764 1 12 . 1 1 49 49 ALA C C 49 175.500 175.500 175.496 0.004 25800
5765 1 12 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.700 -1.400 25800
5766 1 12 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.080 2.620 25800
5767 1 12 . 1 1 49 49 ALA H H 49 9.240 9.240 8.339 0.901 25800
5768 1 12 . 1 1 50 50 PHE N N 50 115.000 115.000 119.924 -4.924 25800
5769 1 12 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.281 0.319 25800
5770 1 12 . 1 1 50 50 PHE C C 50 176.000 176.000 174.096 1.904 25800
5771 1 12 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.749 -0.249 25800
5772 1 12 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.647 -1.447 25800
5773 1 12 . 1 1 50 50 PHE H H 50 7.920 7.920 8.914 -0.994 25800
5774 1 12 . 1 1 51 51 ILE N N 51 123.000 123.000 121.225 1.775 25800
5775 1 12 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.673 -0.223 25800
5776 1 12 . 1 1 51 51 ILE C C 51 173.700 173.700 174.242 -0.542 25800
5777 1 12 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.546 -0.346 25800
5778 1 12 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.987 -1.287 25800
5779 1 12 . 1 1 51 51 ILE H H 51 8.490 8.490 8.457 0.033 25800
5780 1 12 . 1 1 52 52 GLU N N 52 126.600 126.600 127.122 -0.522 25800
5781 1 12 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.992 -0.222 25800
5782 1 12 . 1 1 52 52 GLU C C 52 175.300 175.300 174.928 0.372 25800
5783 1 12 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.760 -1.060 25800
5784 1 12 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.032 -0.532 25800
5785 1 12 . 1 1 52 52 GLU H H 52 8.610 8.610 9.032 -0.422 25800
5786 1 12 . 1 1 53 53 PHE N N 53 126.100 126.100 126.076 0.024 25800
5787 1 12 . 1 1 53 53 PHE HA H 53 4.800 4.800 4.981 -0.181 25800
5788 1 12 . 1 1 53 53 PHE C C 53 175.400 175.400 175.035 0.365 25800
5789 1 12 . 1 1 53 53 PHE CA C 53 58.200 58.200 55.319 2.881 25800
5790 1 12 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.395 -2.494 25800
5791 1 12 . 1 1 53 53 PHE H H 53 8.800 8.800 8.871 -0.071 25800
5792 1 12 . 1 1 54 54 GLU N N 54 120.700 120.700 121.640 -0.940 25800
5793 1 12 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.399 -0.469 25800
5794 1 12 . 1 1 54 54 GLU C C 54 175.300 175.300 176.108 -0.808 25800
5795 1 12 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.055 2.045 25800
5796 1 12 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.544 0.256 25800
5797 1 12 . 1 1 54 54 GLU H H 54 8.160 8.160 8.733 -0.573 25800
5798 1 12 . 1 1 55 55 ASP N N 55 117.900 117.900 118.707 -0.807 25800
5799 1 12 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.753 0.167 25800
5800 1 12 . 1 1 55 55 ASP C C 55 176.400 176.400 175.594 0.806 25800
5801 1 12 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.167 -0.767 25800
5802 1 12 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.352 2.048 25800
5803 1 12 . 1 1 55 55 ASP H H 55 8.740 8.740 7.683 1.057 25800
5804 1 12 . 1 1 56 56 ALA N N 56 128.900 128.900 128.628 0.272 25800
5805 1 12 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.043 0.787 25800
5806 1 12 . 1 1 56 56 ALA C C 56 179.800 179.800 178.981 0.819 25800
5807 1 12 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.617 0.583 25800
5808 1 12 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.032 -0.132 25800
5809 1 12 . 1 1 56 56 ALA H H 56 8.800 8.800 8.821 -0.021 25800
5810 1 12 . 1 1 57 57 ARG N N 57 119.200 119.200 115.718 3.482 25800
5811 1 12 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.027 -0.137 25800
5812 1 12 . 1 1 57 57 ARG C C 57 178.000 178.000 177.531 0.469 25800
5813 1 12 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.670 0.230 25800
5814 1 12 . 1 1 57 57 ARG CB C 57 29.300 29.300 30.002 -0.702 25800
5815 1 12 . 1 1 57 57 ARG H H 57 8.950 8.950 8.262 0.688 25800
5816 1 12 . 1 1 58 58 ASP N N 58 120.900 120.900 118.606 2.294 25800
5817 1 12 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.464 -0.374 25800
5818 1 12 . 1 1 58 58 ASP C C 58 176.700 176.700 177.718 -1.018 25800
5819 1 12 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.407 0.093 25800
5820 1 12 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.695 -0.795 25800
5821 1 12 . 1 1 58 58 ASP H H 58 7.020 7.020 7.729 -0.709 25800
5822 1 12 . 1 1 59 59 ALA N N 59 119.700 119.700 121.894 -2.194 25800
5823 1 12 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.881 -0.801 25800
5824 1 12 . 1 1 59 59 ALA C C 59 178.100 178.100 179.101 -1.001 25800
5825 1 12 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.490 -0.190 25800
5826 1 12 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.158 0.242 25800
5827 1 12 . 1 1 59 59 ALA H H 59 6.440 6.440 7.698 -1.258 25800
5828 1 12 . 1 1 60 60 ALA N N 60 117.600 117.600 121.143 -3.543 25800
5829 1 12 . 1 1 60 60 ALA HA H 60 3.830 3.830 3.908 -0.078 25800
5830 1 12 . 1 1 60 60 ALA C C 60 180.900 180.900 178.754 2.146 25800
5831 1 12 . 1 1 60 60 ALA CA C 60 54.900 54.900 54.830 0.070 25800
5832 1 12 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.188 -0.488 25800
5833 1 12 . 1 1 60 60 ALA H H 60 7.330 7.330 7.752 -0.422 25800
5834 1 12 . 1 1 61 61 ASP N N 61 120.100 120.100 117.939 2.161 25800
5835 1 12 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.438 -0.228 25800
5836 1 12 . 1 1 61 61 ASP C C 61 176.700 176.700 177.246 -0.546 25800
5837 1 12 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.441 0.659 25800
5838 1 12 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.442 -0.342 25800
5839 1 12 . 1 1 61 61 ASP H H 61 7.590 7.590 7.728 -0.138 25800
5840 1 12 . 1 1 62 62 ALA N N 62 122.200 122.200 121.748 0.452 25800
5841 1 12 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.804 -1.384 25800
5842 1 12 . 1 1 62 62 ALA C C 62 179.300 179.300 178.884 0.416 25800
5843 1 12 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.909 0.691 25800
5844 1 12 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.689 0.412 25800
5845 1 12 . 1 1 62 62 ALA H H 62 7.440 7.440 7.227 0.213 25800
5846 1 12 . 1 1 63 63 ILE N N 63 116.700 116.700 119.292 -2.592 25800
5847 1 12 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.739 -0.499 25800
5848 1 12 . 1 1 63 63 ILE C C 63 177.800 177.800 177.028 0.772 25800
5849 1 12 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.549 2.051 25800
5850 1 12 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.903 0.997 25800
5851 1 12 . 1 1 63 63 ILE H H 63 7.540 7.540 7.483 0.057 25800
5852 1 12 . 1 1 64 64 LYS N N 64 117.400 117.400 117.893 -0.493 25800
5853 1 12 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.142 -0.242 25800
5854 1 12 . 1 1 64 64 LYS C C 64 178.900 178.900 177.876 1.024 25800
5855 1 12 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.246 0.554 25800
5856 1 12 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.889 0.711 25800
5857 1 12 . 1 1 64 64 LYS H H 64 7.490 7.490 7.692 -0.202 25800
5858 1 12 . 1 1 65 65 GLU N N 65 113.800 113.800 117.699 -3.899 25800
5859 1 12 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.367 -0.207 25800
5860 1 12 . 1 1 65 65 GLU C C 65 178.300 178.300 178.032 0.268 25800
5861 1 12 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.177 1.123 25800
5862 1 12 . 1 1 65 65 GLU CB C 65 30.700 30.700 30.381 0.319 25800
5863 1 12 . 1 1 65 65 GLU H H 65 7.960 7.960 7.833 0.127 25800
5864 1 12 . 1 1 66 66 LYS N N 66 114.700 114.700 119.146 -4.446 25800
5865 1 12 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.365 0.105 25800
5866 1 12 . 1 1 66 66 LYS C C 66 177.500 177.500 176.984 0.516 25800
5867 1 12 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.771 -1.371 25800
5868 1 12 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.134 0.866 25800
5869 1 12 . 1 1 66 66 LYS H H 66 8.050 8.050 7.833 0.217 25800
5870 1 12 . 1 1 67 67 ASP N N 67 118.800 118.800 120.372 -1.572 25800
5871 1 12 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.521 -0.301 25800
5872 1 12 . 1 1 67 67 ASP C C 67 177.700 177.700 176.983 0.717 25800
5873 1 12 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.401 3.999 25800
5874 1 12 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.331 0.069 25800
5875 1 12 . 1 1 67 67 ASP H H 67 7.620 7.620 7.603 0.017 25800
5876 1 12 . 1 1 68 68 GLY N N 68 115.600 115.600 106.767 8.833 25800
5877 1 12 . 1 1 68 68 GLY C C 68 173.800 173.800 174.595 -0.795 25800
5878 1 12 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.644 1.256 25800
5879 1 12 . 1 1 68 68 GLY H H 68 8.470 8.470 8.543 -0.073 25800
5880 1 12 . 1 1 69 69 CYS N N 69 119.200 119.200 119.879 -0.679 25800
5881 1 12 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.730 -0.570 25800
5882 1 12 . 1 1 69 69 CYS C C 69 172.600 172.600 174.794 -2.194 25800
5883 1 12 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.709 0.291 25800
5884 1 12 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.237 0.463 25800
5885 1 12 . 1 1 69 69 CYS H H 69 7.890 7.890 8.088 -0.198 25800
5886 1 12 . 1 1 70 70 ASP N N 70 122.200 122.200 127.003 -4.803 25800
5887 1 12 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.892 -0.062 25800
5888 1 12 . 1 1 70 70 ASP C C 70 176.400 176.400 175.223 1.177 25800
5889 1 12 . 1 1 70 70 ASP CA C 70 54.700 54.700 54.474 0.226 25800
5890 1 12 . 1 1 70 70 ASP CB C 70 42.700 42.700 42.072 0.628 25800
5891 1 12 . 1 1 70 70 ASP H H 70 8.360 8.360 8.450 -0.090 25800
5892 1 12 . 1 1 71 71 PHE N N 71 127.600 127.600 119.554 8.046 25800
5893 1 12 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.100 -0.500 25800
5894 1 12 . 1 1 71 71 PHE C C 71 173.600 173.600 174.633 -1.033 25800
5895 1 12 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.479 0.321 25800
5896 1 12 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.733 -1.034 25800
5897 1 12 . 1 1 71 71 PHE H H 71 9.390 9.390 7.847 1.543 25800
5898 1 12 . 1 1 72 72 GLU N N 72 123.900 123.900 120.221 3.679 25800
5899 1 12 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.164 -0.624 25800
5900 1 12 . 1 1 72 72 GLU C C 72 175.500 175.500 176.477 -0.977 25800
5901 1 12 . 1 1 72 72 GLU CA C 72 56.700 56.700 58.195 -1.495 25800
5902 1 12 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.328 -1.028 25800
5903 1 12 . 1 1 72 72 GLU H H 72 8.940 8.940 9.662 -0.722 25800
5904 1 12 . 1 1 73 73 GLY N N 73 105.200 105.200 109.899 -4.699 25800
5905 1 12 . 1 1 73 73 GLY C C 73 174.100 174.100 173.713 0.387 25800
5906 1 12 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.740 -0.140 25800
5907 1 12 . 1 1 73 73 GLY H H 73 8.350 8.350 8.637 -0.287 25800
5908 1 12 . 1 1 74 74 ASN N N 74 121.000 121.000 118.416 2.584 25800
5909 1 12 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.896 -0.136 25800
5910 1 12 . 1 1 74 74 ASN C C 74 174.000 174.000 173.378 0.622 25800
5911 1 12 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.539 -1.639 25800
5912 1 12 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.798 -1.098 25800
5913 1 12 . 1 1 74 74 ASN H H 74 7.740 7.740 7.974 -0.234 25800
5914 1 12 . 1 1 75 75 LYS N N 75 121.400 121.400 121.238 0.162 25800
5915 1 12 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.580 -0.110 25800
5916 1 12 . 1 1 75 75 LYS C C 75 176.900 176.900 175.085 1.815 25800
5917 1 12 . 1 1 75 75 LYS CA C 75 55.300 55.300 56.151 -0.851 25800
5918 1 12 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.867 -0.967 25800
5919 1 12 . 1 1 75 75 LYS H H 75 8.380 8.380 8.483 -0.103 25800
5920 1 12 . 1 1 76 76 LEU N N 76 127.400 127.400 124.789 2.611 25800
5921 1 12 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.668 -0.238 25800
5922 1 12 . 1 1 76 76 LEU C C 76 177.600 177.600 174.981 2.619 25800
5923 1 12 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.120 0.180 25800
5924 1 12 . 1 1 76 76 LEU CB C 76 43.100 43.100 43.920 -0.820 25800
5925 1 12 . 1 1 76 76 LEU H H 76 8.950 8.950 8.394 0.556 25800
5926 1 12 . 1 1 77 77 ARG N N 77 121.800 121.800 124.476 -2.676 25800
5927 1 12 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.488 0.412 25800
5928 1 12 . 1 1 77 77 ARG C C 77 174.700 174.700 173.840 0.860 25800
5929 1 12 . 1 1 77 77 ARG CA C 77 54.000 54.000 56.842 -2.842 25800
5930 1 12 . 1 1 77 77 ARG CB C 77 32.300 32.300 31.898 0.402 25800
5931 1 12 . 1 1 77 77 ARG H H 77 7.530 7.530 7.899 -0.369 25800
5932 1 12 . 1 1 78 78 VAL N N 78 127.000 127.000 118.757 8.243 25800
5933 1 12 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.365 0.915 25800
5934 1 12 . 1 1 78 78 VAL C C 78 174.200 174.200 174.155 0.045 25800
5935 1 12 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.755 0.445 25800
5936 1 12 . 1 1 78 78 VAL CB C 78 33.400 33.400 33.798 -0.398 25800
5937 1 12 . 1 1 78 78 VAL H H 78 9.660 9.660 8.274 1.386 25800
5938 1 12 . 1 1 79 79 GLU N N 79 121.900 121.900 125.949 -4.049 25800
5939 1 12 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.649 0.061 25800
5940 1 12 . 1 1 79 79 GLU C C 79 174.600 174.600 174.062 0.538 25800
5941 1 12 . 1 1 79 79 GLU CA C 79 53.900 53.900 56.105 -2.205 25800
5942 1 12 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.290 0.110 25800
5943 1 12 . 1 1 79 79 GLU H H 79 8.980 8.980 8.188 0.792 25800
5944 1 12 . 1 1 80 80 VAL N N 80 121.300 121.300 118.910 2.390 25800
5945 1 12 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.778 -0.408 25800
5946 1 12 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.673 2.327 25800
5947 1 12 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.778 -1.678 25800
5948 1 12 . 1 1 80 80 VAL H H 80 8.410 8.410 8.432 -0.022 25800
5949 1 12 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.827 -0.567 25800
5950 1 12 . 1 1 81 81 PRO C C 81 176.100 176.100 175.546 0.554 25800
5951 1 12 . 1 1 81 81 PRO CA C 81 63.100 63.100 62.852 0.248 25800
5952 1 12 . 1 1 81 81 PRO CB C 81 32.100 32.100 30.658 1.442 25800
5953 1 12 . 1 1 82 82 PHE N N 82 122.200 122.200 122.605 -0.405 25800
5954 1 12 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.809 -0.519 25800
5955 1 12 . 1 1 82 82 PHE C C 82 175.300 175.300 175.641 -0.341 25800
5956 1 12 . 1 1 82 82 PHE CA C 82 58.100 58.100 57.095 1.005 25800
5957 1 12 . 1 1 82 82 PHE CB C 82 39.400 39.400 39.262 0.138 25800
5958 1 12 . 1 1 82 82 PHE H H 82 8.150 8.150 8.197 -0.047 25800
5959 1 12 . 1 1 83 83 ASN N N 83 120.800 120.800 121.824 -1.024 25800
5960 1 12 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.725 -0.285 25800
5961 1 12 . 1 1 83 83 ASN C C 83 174.100 174.100 174.942 -0.842 25800
5962 1 12 . 1 1 83 83 ASN CA C 83 52.700 52.700 54.099 -1.399 25800
5963 1 12 . 1 1 83 83 ASN CB C 83 38.700 38.700 36.686 2.014 25800
5964 1 12 . 1 1 83 83 ASN H H 83 8.110 8.110 8.788 -0.678 25800
5965 1 12 . 1 1 84 84 ALA N N 84 123.700 123.700 120.067 3.633 25800
5966 1 12 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.556 -0.476 25800
5967 1 12 . 1 1 84 84 ALA C C 84 177.100 177.100 177.020 0.080 25800
5968 1 12 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.221 0.179 25800
5969 1 12 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.220 -1.120 25800
5970 1 12 . 1 1 84 84 ALA H H 84 8.020 8.020 7.893 0.127 25800
5971 1 12 . 1 1 85 85 ARG N N 85 120.200 120.200 119.748 0.452 25800
5972 1 12 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.564 -0.414 25800
5973 1 12 . 1 1 85 85 ARG C C 85 175.200 175.200 174.650 0.550 25800
5974 1 12 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.258 -0.258 25800
5975 1 12 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.830 -0.030 25800
5976 1 12 . 1 1 85 85 ARG H H 85 8.040 8.040 8.252 -0.212 25800
5977 1 13 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.290 0.300 25800
5978 1 13 . 1 1 0 0 HIS C C 0 174.000 174.000 173.443 0.557 25800
5979 1 13 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.614 -1.314 25800
5980 1 13 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.067 -0.767 25800
5981 1 13 . 1 1 1 1 MET N N 1 122.400 122.400 120.364 2.036 25800
5982 1 13 . 1 1 1 1 MET HA H 1 4.340 4.340 4.707 -0.367 25800
5983 1 13 . 1 1 1 1 MET C C 1 175.600 175.600 174.483 1.117 25800
5984 1 13 . 1 1 1 1 MET CA C 1 55.600 55.600 55.013 0.587 25800
5985 1 13 . 1 1 1 1 MET CB C 1 32.800 32.800 34.300 -1.500 25800
5986 1 13 . 1 1 1 1 MET H H 1 8.310 8.310 8.197 0.113 25800
5987 1 13 . 1 1 2 2 VAL N N 2 123.200 123.200 126.893 -3.693 25800
5988 1 13 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.824 -0.864 25800
5989 1 13 . 1 1 2 2 VAL C C 2 175.600 175.600 173.674 1.926 25800
5990 1 13 . 1 1 2 2 VAL CA C 2 62.300 62.300 61.833 0.467 25800
5991 1 13 . 1 1 2 2 VAL CB C 2 32.300 32.300 34.706 -2.405 25800
5992 1 13 . 1 1 2 2 VAL H H 2 8.180 8.180 8.913 -0.733 25800
5993 1 13 . 1 1 3 3 ILE N N 3 126.200 126.200 125.503 0.697 25800
5994 1 13 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.473 -0.423 25800
5995 1 13 . 1 1 3 3 ILE C C 3 175.800 175.800 174.306 1.494 25800
5996 1 13 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.199 -0.499 25800
5997 1 13 . 1 1 3 3 ILE CB C 3 38.300 38.300 40.185 -1.885 25800
5998 1 13 . 1 1 3 3 ILE H H 3 8.230 8.230 8.390 -0.160 25800
5999 1 13 . 1 1 4 4 ARG N N 4 126.100 126.100 123.749 2.351 25800
6000 1 13 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.730 -0.550 25800
6001 1 13 . 1 1 4 4 ARG C C 4 175.900 175.900 175.949 -0.049 25800
6002 1 13 . 1 1 4 4 ARG CA C 4 56.000 56.000 55.736 0.264 25800
6003 1 13 . 1 1 4 4 ARG CB C 4 30.700 30.700 31.371 -0.671 25800
6004 1 13 . 1 1 4 4 ARG H H 4 8.360 8.360 8.932 -0.572 25800
6005 1 13 . 1 1 5 5 GLU N N 5 122.200 122.200 121.286 0.914 25800
6006 1 13 . 1 1 5 5 GLU HA H 5 4.140 4.140 3.886 0.254 25800
6007 1 13 . 1 1 5 5 GLU C C 5 176.100 176.100 175.719 0.381 25800
6008 1 13 . 1 1 5 5 GLU CA C 5 56.600 56.600 56.924 -0.324 25800
6009 1 13 . 1 1 5 5 GLU CB C 5 30.300 30.300 28.665 1.635 25800
6010 1 13 . 1 1 5 5 GLU H H 5 8.400 8.400 9.044 -0.644 25800
6011 1 13 . 1 1 6 6 SER N N 6 116.200 116.200 112.141 4.059 25800
6012 1 13 . 1 1 6 6 SER HA H 6 4.350 4.350 4.053 0.297 25800
6013 1 13 . 1 1 6 6 SER C C 6 174.300 174.300 173.986 0.314 25800
6014 1 13 . 1 1 6 6 SER CA C 6 58.200 58.200 59.928 -1.728 25800
6015 1 13 . 1 1 6 6 SER CB C 6 63.800 63.800 62.327 1.473 25800
6016 1 13 . 1 1 6 6 SER H H 6 8.270 8.270 8.085 0.185 25800
6017 1 13 . 1 1 7 7 VAL N N 7 119.800 119.800 118.147 1.653 25800
6018 1 13 . 1 1 7 7 VAL HA H 7 4.300 4.300 3.739 0.561 25800
6019 1 13 . 1 1 7 7 VAL C C 7 175.500 175.500 175.201 0.299 25800
6020 1 13 . 1 1 7 7 VAL CA C 7 61.700 61.700 62.648 -0.948 25800
6021 1 13 . 1 1 7 7 VAL CB C 7 32.800 32.800 30.601 2.199 25800
6022 1 13 . 1 1 7 7 VAL H H 7 7.840 7.840 8.112 -0.272 25800
6023 1 13 . 1 1 8 8 SER N N 8 117.800 117.800 116.426 1.374 25800
6024 1 13 . 1 1 8 8 SER HA H 8 4.240 4.240 4.287 -0.047 25800
6025 1 13 . 1 1 8 8 SER C C 8 172.500 172.500 174.758 -2.258 25800
6026 1 13 . 1 1 8 8 SER CA C 8 58.500 58.500 59.576 -1.076 25800
6027 1 13 . 1 1 8 8 SER CB C 8 63.600 63.600 62.956 0.644 25800
6028 1 13 . 1 1 8 8 SER H H 8 8.530 8.530 8.308 0.222 25800
6029 1 13 . 1 1 9 9 ARG N N 9 123.000 123.000 124.278 -1.278 25800
6030 1 13 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.202 0.298 25800
6031 1 13 . 1 1 9 9 ARG C C 9 175.000 175.000 175.659 -0.659 25800
6032 1 13 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.239 0.061 25800
6033 1 13 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.725 0.675 25800
6034 1 13 . 1 1 9 9 ARG H H 9 7.350 7.350 8.395 -1.045 25800
6035 1 13 . 1 1 10 10 ILE N N 10 114.000 114.000 122.778 -8.778 25800
6036 1 13 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.232 0.588 25800
6037 1 13 . 1 1 10 10 ILE C C 10 173.000 173.000 174.727 -1.727 25800
6038 1 13 . 1 1 10 10 ILE CA C 10 59.400 59.400 62.018 -2.618 25800
6039 1 13 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.010 1.891 25800
6040 1 13 . 1 1 10 10 ILE H H 10 8.830 8.830 8.765 0.065 25800
6041 1 13 . 1 1 11 11 TYR N N 11 123.400 123.400 129.051 -5.651 25800
6042 1 13 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.936 -0.006 25800
6043 1 13 . 1 1 11 11 TYR C C 11 173.000 173.000 173.459 -0.459 25800
6044 1 13 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.452 0.548 25800
6045 1 13 . 1 1 11 11 TYR CB C 11 40.900 40.900 40.846 0.055 25800
6046 1 13 . 1 1 11 11 TYR H H 11 8.690 8.690 8.125 0.565 25800
6047 1 13 . 1 1 12 12 VAL N N 12 126.300 126.300 121.471 4.829 25800
6048 1 13 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.478 0.082 25800
6049 1 13 . 1 1 12 12 VAL C C 12 174.100 174.100 173.651 0.449 25800
6050 1 13 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.394 0.806 25800
6051 1 13 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.859 -1.460 25800
6052 1 13 . 1 1 12 12 VAL H H 12 8.370 8.370 8.083 0.287 25800
6053 1 13 . 1 1 13 13 GLY N N 13 113.000 113.000 110.337 2.663 25800
6054 1 13 . 1 1 13 13 GLY C C 13 173.100 173.100 173.580 -0.480 25800
6055 1 13 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.334 -0.034 25800
6056 1 13 . 1 1 13 13 GLY H H 13 9.350 9.350 8.554 0.796 25800
6057 1 13 . 1 1 14 14 ASN N N 14 113.900 113.900 116.351 -2.451 25800
6058 1 13 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.155 0.125 25800
6059 1 13 . 1 1 14 14 ASN C C 14 175.800 175.800 175.469 0.331 25800
6060 1 13 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.486 -0.886 25800
6061 1 13 . 1 1 14 14 ASN CB C 14 37.700 37.700 37.302 0.398 25800
6062 1 13 . 1 1 14 14 ASN H H 14 8.800 8.800 8.306 0.494 25800
6063 1 13 . 1 1 15 15 LEU N N 15 115.800 115.800 116.485 -0.685 25800
6064 1 13 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.523 0.467 25800
6065 1 13 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.819 1.781 25800
6066 1 13 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.380 0.220 25800
6067 1 13 . 1 1 15 15 LEU H H 15 7.150 7.150 7.286 -0.136 25800
6068 1 13 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.350 -0.280 25800
6069 1 13 . 1 1 16 16 PRO C C 16 171.500 171.500 177.299 -5.799 25800
6070 1 13 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.354 0.146 25800
6071 1 13 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.184 -0.183 25800
6072 1 13 . 1 1 17 17 SER N N 17 115.200 115.200 113.058 2.142 25800
6073 1 13 . 1 1 17 17 SER HA H 17 4.300 4.300 3.962 0.338 25800
6074 1 13 . 1 1 17 17 SER C C 17 174.200 174.200 173.864 0.336 25800
6075 1 13 . 1 1 17 17 SER CA C 17 58.200 58.200 59.369 -1.169 25800
6076 1 13 . 1 1 17 17 SER CB C 17 63.900 63.900 62.645 1.254 25800
6077 1 13 . 1 1 17 17 SER H H 17 8.470 8.470 8.490 -0.020 25800
6078 1 13 . 1 1 18 18 HIS N N 18 120.800 120.800 117.152 3.648 25800
6079 1 13 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.174 0.376 25800
6080 1 13 . 1 1 18 18 HIS C C 18 175.100 175.100 174.657 0.443 25800
6081 1 13 . 1 1 18 18 HIS CA C 18 55.500 55.500 56.370 -0.870 25800
6082 1 13 . 1 1 18 18 HIS CB C 18 29.300 29.300 27.113 2.187 25800
6083 1 13 . 1 1 18 18 HIS H H 18 8.540 8.540 7.652 0.888 25800
6084 1 13 . 1 1 19 19 VAL N N 19 115.700 115.700 119.987 -4.287 25800
6085 1 13 . 1 1 19 19 VAL HA H 19 4.260 4.260 3.834 0.426 25800
6086 1 13 . 1 1 19 19 VAL C C 19 174.000 174.000 175.967 -1.967 25800
6087 1 13 . 1 1 19 19 VAL CA C 19 61.900 61.900 63.672 -1.772 25800
6088 1 13 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.369 0.231 25800
6089 1 13 . 1 1 19 19 VAL H H 19 6.650 6.650 8.119 -1.469 25800
6090 1 13 . 1 1 20 20 SER N N 20 118.800 118.800 123.274 -4.474 25800
6091 1 13 . 1 1 20 20 SER HA H 20 4.710 4.710 4.525 0.185 25800
6092 1 13 . 1 1 20 20 SER C C 20 175.900 175.900 175.918 -0.018 25800
6093 1 13 . 1 1 20 20 SER CA C 20 55.800 55.800 58.724 -2.924 25800
6094 1 13 . 1 1 20 20 SER CB C 20 66.600 66.600 64.261 2.339 25800
6095 1 13 . 1 1 20 20 SER H H 20 8.930 8.930 8.661 0.269 25800
6096 1 13 . 1 1 21 21 SER N N 21 117.100 117.100 120.410 -3.310 25800
6097 1 13 . 1 1 21 21 SER HA H 21 3.880 3.880 4.004 -0.124 25800
6098 1 13 . 1 1 21 21 SER C C 21 176.200 176.200 176.646 -0.446 25800
6099 1 13 . 1 1 21 21 SER CA C 21 62.300 62.300 61.438 0.862 25800
6100 1 13 . 1 1 21 21 SER CB C 21 66.800 66.800 63.101 3.699 25800
6101 1 13 . 1 1 21 21 SER H H 21 9.080 9.080 9.054 0.026 25800
6102 1 13 . 1 1 22 22 ARG N N 22 121.200 121.200 121.337 -0.137 25800
6103 1 13 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.099 -0.109 25800
6104 1 13 . 1 1 22 22 ARG C C 22 177.900 177.900 178.136 -0.236 25800
6105 1 13 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.135 -0.435 25800
6106 1 13 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.643 -0.043 25800
6107 1 13 . 1 1 22 22 ARG H H 22 7.940 7.940 8.575 -0.635 25800
6108 1 13 . 1 1 23 23 ASP N N 23 118.800 118.800 119.883 -1.083 25800
6109 1 13 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.542 -0.152 25800
6110 1 13 . 1 1 23 23 ASP C C 23 179.200 179.200 178.641 0.559 25800
6111 1 13 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.126 0.174 25800
6112 1 13 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.810 0.190 25800
6113 1 13 . 1 1 23 23 ASP H H 23 7.480 7.480 7.452 0.028 25800
6114 1 13 . 1 1 24 24 VAL N N 24 119.500 119.500 120.580 -1.080 25800
6115 1 13 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.734 -0.364 25800
6116 1 13 . 1 1 24 24 VAL C C 24 177.500 177.500 177.062 0.438 25800
6117 1 13 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.772 1.128 25800
6118 1 13 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.972 -0.572 25800
6119 1 13 . 1 1 24 24 VAL H H 24 7.450 7.450 8.330 -0.880 25800
6120 1 13 . 1 1 25 25 GLU N N 25 121.400 121.400 120.045 1.355 25800
6121 1 13 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.866 -0.296 25800
6122 1 13 . 1 1 25 25 GLU C C 25 178.400 178.400 178.624 -0.224 25800
6123 1 13 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.357 0.243 25800
6124 1 13 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.342 0.258 25800
6125 1 13 . 1 1 25 25 GLU H H 25 8.580 8.580 8.497 0.083 25800
6126 1 13 . 1 1 26 26 ASN N N 26 114.800 114.800 116.406 -1.606 25800
6127 1 13 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.548 -0.228 25800
6128 1 13 . 1 1 26 26 ASN C C 26 177.400 177.400 177.626 -0.226 25800
6129 1 13 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.773 0.127 25800
6130 1 13 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.478 -0.578 25800
6131 1 13 . 1 1 26 26 ASN H H 26 8.180 8.180 7.765 0.415 25800
6132 1 13 . 1 1 27 27 GLU N N 27 118.900 118.900 120.652 -1.752 25800
6133 1 13 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.256 -0.116 25800
6134 1 13 . 1 1 27 27 GLU C C 27 176.400 176.400 179.416 -3.016 25800
6135 1 13 . 1 1 27 27 GLU CA C 27 57.400 57.400 59.344 -1.944 25800
6136 1 13 . 1 1 27 27 GLU CB C 27 29.400 29.400 30.215 -0.815 25800
6137 1 13 . 1 1 27 27 GLU H H 27 7.340 7.340 7.955 -0.615 25800
6138 1 13 . 1 1 28 28 PHE N N 28 114.100 114.100 119.104 -5.004 25800
6139 1 13 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.871 -0.321 25800
6140 1 13 . 1 1 28 28 PHE C C 28 176.300 176.300 178.316 -2.016 25800
6141 1 13 . 1 1 28 28 PHE CA C 28 60.000 60.000 59.840 0.160 25800
6142 1 13 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.869 1.931 25800
6143 1 13 . 1 1 28 28 PHE H H 28 7.660 7.660 8.670 -1.010 25800
6144 1 13 . 1 1 29 29 ARG N N 29 121.700 121.700 119.294 2.406 25800
6145 1 13 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.417 -0.007 25800
6146 1 13 . 1 1 29 29 ARG C C 29 177.100 177.100 177.209 -0.109 25800
6147 1 13 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.775 -0.575 25800
6148 1 13 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.189 -0.890 25800
6149 1 13 . 1 1 29 29 ARG H H 29 8.120 8.120 8.286 -0.166 25800
6150 1 13 . 1 1 30 30 LYS N N 30 117.200 117.200 117.949 -0.749 25800
6151 1 13 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.046 -0.216 25800
6152 1 13 . 1 1 30 30 LYS C C 30 177.100 177.100 177.761 -0.661 25800
6153 1 13 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.002 -0.202 25800
6154 1 13 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.154 -1.054 25800
6155 1 13 . 1 1 30 30 LYS H H 30 7.630 7.630 7.642 -0.012 25800
6156 1 13 . 1 1 31 31 TYR N N 31 117.100 117.100 116.779 0.321 25800
6157 1 13 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.488 -0.338 25800
6158 1 13 . 1 1 31 31 TYR C C 31 174.400 174.400 175.720 -1.320 25800
6159 1 13 . 1 1 31 31 TYR CA C 31 59.900 59.900 58.607 1.293 25800
6160 1 13 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.647 -1.747 25800
6161 1 13 . 1 1 31 31 TYR H H 31 7.410 7.410 7.835 -0.425 25800
6162 1 13 . 1 1 32 32 GLY N N 32 104.100 104.100 105.103 -1.003 25800
6163 1 13 . 1 1 32 32 GLY C C 32 177.000 177.000 172.563 4.437 25800
6164 1 13 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.009 -0.509 25800
6165 1 13 . 1 1 32 32 GLY H H 32 7.240 7.240 7.567 -0.327 25800
6166 1 13 . 1 1 33 33 ASN N N 33 115.300 115.300 119.392 -4.092 25800
6167 1 13 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.894 -0.454 25800
6168 1 13 . 1 1 33 33 ASN C C 33 175.500 175.500 174.826 0.674 25800
6169 1 13 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.616 0.684 25800
6170 1 13 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.875 -0.475 25800
6171 1 13 . 1 1 33 33 ASN H H 33 8.460 8.460 8.435 0.025 25800
6172 1 13 . 1 1 34 34 ILE N N 34 126.700 126.700 126.618 0.082 25800
6173 1 13 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.526 -0.736 25800
6174 1 13 . 1 1 34 34 ILE C C 34 175.600 175.600 175.545 0.055 25800
6175 1 13 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.638 0.662 25800
6176 1 13 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.632 1.368 25800
6177 1 13 . 1 1 34 34 ILE H H 34 8.050 8.050 8.236 -0.186 25800
6178 1 13 . 1 1 35 35 LEU N N 35 127.400 127.400 130.412 -3.012 25800
6179 1 13 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.417 -0.257 25800
6180 1 13 . 1 1 35 35 LEU C C 35 177.200 177.200 176.962 0.238 25800
6181 1 13 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.688 -0.188 25800
6182 1 13 . 1 1 35 35 LEU CB C 35 42.700 42.700 41.932 0.768 25800
6183 1 13 . 1 1 35 35 LEU H H 35 8.780 8.780 9.250 -0.470 25800
6184 1 13 . 1 1 36 36 LYS N N 36 117.000 117.000 116.869 0.131 25800
6185 1 13 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.525 -0.285 25800
6186 1 13 . 1 1 36 36 LYS C C 36 173.600 173.600 174.179 -0.579 25800
6187 1 13 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.855 0.045 25800
6188 1 13 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.430 1.170 25800
6189 1 13 . 1 1 36 36 LYS H H 36 7.110 7.110 7.857 -0.747 25800
6190 1 13 . 1 1 37 37 CYS N N 37 125.400 125.400 120.103 5.297 25800
6191 1 13 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.611 -0.911 25800
6192 1 13 . 1 1 37 37 CYS C C 37 171.600 171.600 172.805 -1.205 25800
6193 1 13 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.626 1.274 25800
6194 1 13 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.271 -4.171 25800
6195 1 13 . 1 1 37 37 CYS H H 37 8.610 8.610 8.542 0.068 25800
6196 1 13 . 1 1 38 38 ASP N N 38 128.200 128.200 120.755 7.445 25800
6197 1 13 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.867 0.083 25800
6198 1 13 . 1 1 38 38 ASP C C 38 174.300 174.300 174.134 0.166 25800
6199 1 13 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.898 -0.698 25800
6200 1 13 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.433 -1.133 25800
6201 1 13 . 1 1 38 38 ASP H H 38 8.290 8.290 8.533 -0.243 25800
6202 1 13 . 1 1 39 39 VAL N N 39 123.500 123.500 120.536 2.964 25800
6203 1 13 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.796 -0.496 25800
6204 1 13 . 1 1 39 39 VAL C C 39 175.000 175.000 175.676 -0.676 25800
6205 1 13 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.416 0.284 25800
6206 1 13 . 1 1 39 39 VAL CB C 39 33.100 33.100 33.012 0.088 25800
6207 1 13 . 1 1 39 39 VAL H H 39 8.380 8.380 8.527 -0.147 25800
6208 1 13 . 1 1 40 40 LYS N N 40 129.100 129.100 127.460 1.640 25800
6209 1 13 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.876 -0.556 25800
6210 1 13 . 1 1 40 40 LYS C C 40 173.700 173.700 174.699 -0.999 25800
6211 1 13 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.509 -0.609 25800
6212 1 13 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.534 -0.034 25800
6213 1 13 . 1 1 40 40 LYS H H 40 8.680 8.680 9.240 -0.560 25800
6214 1 13 . 1 1 41 41 LYS N N 41 117.300 117.300 120.537 -3.237 25800
6215 1 13 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.248 -0.268 25800
6216 1 13 . 1 1 41 41 LYS C C 41 177.800 177.800 175.372 2.428 25800
6217 1 13 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.725 -0.125 25800
6218 1 13 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.308 -0.308 25800
6219 1 13 . 1 1 41 41 LYS H H 41 7.900 7.900 8.329 -0.429 25800
6220 1 13 . 1 1 42 42 THR N N 42 113.200 113.200 114.286 -1.086 25800
6221 1 13 . 1 1 42 42 THR HA H 42 4.680 4.680 4.825 -0.145 25800
6222 1 13 . 1 1 42 42 THR C C 42 176.900 176.900 176.254 0.646 25800
6223 1 13 . 1 1 42 42 THR CA C 42 60.200 60.200 60.048 0.152 25800
6224 1 13 . 1 1 42 42 THR CB C 42 71.600 71.600 70.208 1.392 25800
6225 1 13 . 1 1 42 42 THR H H 42 8.730 8.730 8.379 0.351 25800
6226 1 13 . 1 1 43 43 VAL N N 43 120.000 120.000 123.397 -3.397 25800
6227 1 13 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.047 -0.127 25800
6228 1 13 . 1 1 43 43 VAL C C 43 177.000 177.000 176.540 0.460 25800
6229 1 13 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.459 0.241 25800
6230 1 13 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.779 0.021 25800
6231 1 13 . 1 1 43 43 VAL H H 43 8.730 8.730 8.540 0.190 25800
6232 1 13 . 1 1 44 44 SER N N 44 113.400 113.400 115.662 -2.262 25800
6233 1 13 . 1 1 44 44 SER HA H 44 4.360 4.360 4.350 0.010 25800
6234 1 13 . 1 1 44 44 SER C C 44 174.800 174.800 175.501 -0.701 25800
6235 1 13 . 1 1 44 44 SER CA C 44 58.400 58.400 58.543 -0.143 25800
6236 1 13 . 1 1 44 44 SER CB C 44 63.500 63.500 63.469 0.031 25800
6237 1 13 . 1 1 44 44 SER H H 44 7.760 7.760 7.968 -0.208 25800
6238 1 13 . 1 1 45 45 GLY N N 45 110.200 110.200 108.642 1.558 25800
6239 1 13 . 1 1 45 45 GLY C C 45 173.500 173.500 174.257 -0.757 25800
6240 1 13 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.718 0.582 25800
6241 1 13 . 1 1 45 45 GLY H H 45 7.820 7.820 7.851 -0.031 25800
6242 1 13 . 1 1 46 46 ALA N N 46 123.900 123.900 124.028 -0.128 25800
6243 1 13 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.174 0.216 25800
6244 1 13 . 1 1 46 46 ALA C C 46 176.100 176.100 175.570 0.530 25800
6245 1 13 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.980 -0.080 25800
6246 1 13 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.032 -0.232 25800
6247 1 13 . 1 1 46 46 ALA H H 46 7.440 7.440 7.877 -0.437 25800
6248 1 13 . 1 1 47 47 ALA N N 47 123.100 123.100 122.049 1.051 25800
6249 1 13 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.039 0.161 25800
6250 1 13 . 1 1 47 47 ALA C C 47 176.100 176.100 175.142 0.958 25800
6251 1 13 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.484 0.416 25800
6252 1 13 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.187 -0.287 25800
6253 1 13 . 1 1 47 47 ALA H H 47 8.350 8.350 7.905 0.445 25800
6254 1 13 . 1 1 48 48 PHE N N 48 118.700 118.700 117.222 1.478 25800
6255 1 13 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.333 -0.303 25800
6256 1 13 . 1 1 48 48 PHE C C 48 171.600 171.600 174.260 -2.660 25800
6257 1 13 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.750 -1.050 25800
6258 1 13 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.156 -1.956 25800
6259 1 13 . 1 1 48 48 PHE H H 48 8.550 8.550 9.017 -0.467 25800
6260 1 13 . 1 1 49 49 ALA N N 49 120.400 120.400 125.051 -4.651 25800
6261 1 13 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.194 0.136 25800
6262 1 13 . 1 1 49 49 ALA C C 49 175.500 175.500 175.570 -0.070 25800
6263 1 13 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.478 -1.178 25800
6264 1 13 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.081 2.619 25800
6265 1 13 . 1 1 49 49 ALA H H 49 9.240 9.240 9.032 0.208 25800
6266 1 13 . 1 1 50 50 PHE N N 50 115.000 115.000 121.376 -6.376 25800
6267 1 13 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.678 -0.078 25800
6268 1 13 . 1 1 50 50 PHE C C 50 176.000 176.000 174.492 1.508 25800
6269 1 13 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.155 0.345 25800
6270 1 13 . 1 1 50 50 PHE CB C 50 42.200 42.200 42.974 -0.774 25800
6271 1 13 . 1 1 50 50 PHE H H 50 7.920 7.920 8.944 -1.024 25800
6272 1 13 . 1 1 51 51 ILE N N 51 123.000 123.000 122.419 0.581 25800
6273 1 13 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.290 0.160 25800
6274 1 13 . 1 1 51 51 ILE C C 51 173.700 173.700 174.022 -0.322 25800
6275 1 13 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.715 -0.515 25800
6276 1 13 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.470 0.230 25800
6277 1 13 . 1 1 51 51 ILE H H 51 8.490 8.490 9.093 -0.603 25800
6278 1 13 . 1 1 52 52 GLU N N 52 126.600 126.600 127.369 -0.769 25800
6279 1 13 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.558 0.212 25800
6280 1 13 . 1 1 52 52 GLU C C 52 175.300 175.300 174.930 0.370 25800
6281 1 13 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.351 -0.651 25800
6282 1 13 . 1 1 52 52 GLU CB C 52 31.500 31.500 30.951 0.549 25800
6283 1 13 . 1 1 52 52 GLU H H 52 8.610 8.610 8.710 -0.100 25800
6284 1 13 . 1 1 53 53 PHE N N 53 126.100 126.100 125.745 0.355 25800
6285 1 13 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.243 -0.443 25800
6286 1 13 . 1 1 53 53 PHE C C 53 175.400 175.400 176.882 -1.482 25800
6287 1 13 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.752 1.448 25800
6288 1 13 . 1 1 53 53 PHE CB C 53 40.900 40.900 41.088 -0.188 25800
6289 1 13 . 1 1 53 53 PHE H H 53 8.800 8.800 8.947 -0.147 25800
6290 1 13 . 1 1 54 54 GLU N N 54 120.700 120.700 120.661 0.039 25800
6291 1 13 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.256 -0.326 25800
6292 1 13 . 1 1 54 54 GLU C C 54 175.300 175.300 176.204 -0.904 25800
6293 1 13 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.592 1.508 25800
6294 1 13 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.629 0.171 25800
6295 1 13 . 1 1 54 54 GLU H H 54 8.160 8.160 8.817 -0.657 25800
6296 1 13 . 1 1 55 55 ASP N N 55 117.900 117.900 120.174 -2.274 25800
6297 1 13 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.794 0.126 25800
6298 1 13 . 1 1 55 55 ASP C C 55 176.400 176.400 175.489 0.911 25800
6299 1 13 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.116 -0.716 25800
6300 1 13 . 1 1 55 55 ASP CB C 55 44.400 44.400 41.158 3.242 25800
6301 1 13 . 1 1 55 55 ASP H H 55 8.740 8.740 8.220 0.520 25800
6302 1 13 . 1 1 56 56 ALA N N 56 128.900 128.900 126.119 2.781 25800
6303 1 13 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.365 0.465 25800
6304 1 13 . 1 1 56 56 ALA C C 56 179.800 179.800 178.304 1.496 25800
6305 1 13 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.290 -0.090 25800
6306 1 13 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.742 0.158 25800
6307 1 13 . 1 1 56 56 ALA H H 56 8.800 8.800 8.393 0.407 25800
6308 1 13 . 1 1 57 57 ARG N N 57 119.200 119.200 118.240 0.960 25800
6309 1 13 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.118 -0.228 25800
6310 1 13 . 1 1 57 57 ARG C C 57 178.000 178.000 177.194 0.806 25800
6311 1 13 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.944 -0.044 25800
6312 1 13 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.376 -0.076 25800
6313 1 13 . 1 1 57 57 ARG H H 57 8.950 8.950 8.169 0.781 25800
6314 1 13 . 1 1 58 58 ASP N N 58 120.900 120.900 117.992 2.908 25800
6315 1 13 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.468 -0.378 25800
6316 1 13 . 1 1 58 58 ASP C C 58 176.700 176.700 177.973 -1.273 25800
6317 1 13 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.603 -0.103 25800
6318 1 13 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.591 -0.691 25800
6319 1 13 . 1 1 58 58 ASP H H 58 7.020 7.020 7.689 -0.669 25800
6320 1 13 . 1 1 59 59 ALA N N 59 119.700 119.700 121.917 -2.217 25800
6321 1 13 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.782 -0.702 25800
6322 1 13 . 1 1 59 59 ALA C C 59 178.100 178.100 179.533 -1.433 25800
6323 1 13 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.598 -0.298 25800
6324 1 13 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.115 0.285 25800
6325 1 13 . 1 1 59 59 ALA H H 59 6.440 6.440 8.039 -1.599 25800
6326 1 13 . 1 1 60 60 ALA N N 60 117.600 117.600 121.020 -3.420 25800
6327 1 13 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.117 -0.287 25800
6328 1 13 . 1 1 60 60 ALA C C 60 180.900 180.900 178.828 2.072 25800
6329 1 13 . 1 1 60 60 ALA CA C 60 54.900 54.900 54.803 0.097 25800
6330 1 13 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.326 -0.626 25800
6331 1 13 . 1 1 60 60 ALA H H 60 7.330 7.330 7.724 -0.394 25800
6332 1 13 . 1 1 61 61 ASP N N 61 120.100 120.100 118.468 1.632 25800
6333 1 13 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.470 -0.260 25800
6334 1 13 . 1 1 61 61 ASP C C 61 176.700 176.700 177.128 -0.428 25800
6335 1 13 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.491 0.609 25800
6336 1 13 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.412 -0.312 25800
6337 1 13 . 1 1 61 61 ASP H H 61 7.590 7.590 7.881 -0.291 25800
6338 1 13 . 1 1 62 62 ALA N N 62 122.200 122.200 121.563 0.637 25800
6339 1 13 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.570 -1.150 25800
6340 1 13 . 1 1 62 62 ALA C C 62 179.300 179.300 179.114 0.186 25800
6341 1 13 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.921 0.679 25800
6342 1 13 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.366 0.734 25800
6343 1 13 . 1 1 62 62 ALA H H 62 7.440 7.440 7.408 0.032 25800
6344 1 13 . 1 1 63 63 ILE N N 63 116.700 116.700 119.065 -2.365 25800
6345 1 13 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.710 -0.470 25800
6346 1 13 . 1 1 63 63 ILE C C 63 177.800 177.800 177.283 0.517 25800
6347 1 13 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.152 2.448 25800
6348 1 13 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.709 1.191 25800
6349 1 13 . 1 1 63 63 ILE H H 63 7.540 7.540 7.441 0.099 25800
6350 1 13 . 1 1 64 64 LYS N N 64 117.400 117.400 118.592 -1.192 25800
6351 1 13 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.330 -0.430 25800
6352 1 13 . 1 1 64 64 LYS C C 64 178.900 178.900 177.281 1.619 25800
6353 1 13 . 1 1 64 64 LYS CA C 64 58.800 58.800 57.900 0.900 25800
6354 1 13 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.908 0.692 25800
6355 1 13 . 1 1 64 64 LYS H H 64 7.490 7.490 7.876 -0.386 25800
6356 1 13 . 1 1 65 65 GLU N N 65 113.800 113.800 116.638 -2.838 25800
6357 1 13 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.380 -0.220 25800
6358 1 13 . 1 1 65 65 GLU C C 65 178.300 178.300 177.758 0.542 25800
6359 1 13 . 1 1 65 65 GLU CA C 65 58.300 58.300 56.860 1.440 25800
6360 1 13 . 1 1 65 65 GLU CB C 65 30.700 30.700 30.635 0.065 25800
6361 1 13 . 1 1 65 65 GLU H H 65 7.960 7.960 7.781 0.179 25800
6362 1 13 . 1 1 66 66 LYS N N 66 114.700 114.700 119.251 -4.551 25800
6363 1 13 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.391 0.079 25800
6364 1 13 . 1 1 66 66 LYS C C 66 177.500 177.500 177.107 0.393 25800
6365 1 13 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.984 -1.584 25800
6366 1 13 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.597 0.403 25800
6367 1 13 . 1 1 66 66 LYS H H 66 8.050 8.050 7.684 0.366 25800
6368 1 13 . 1 1 67 67 ASP N N 67 118.800 118.800 119.912 -1.112 25800
6369 1 13 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.442 -0.222 25800
6370 1 13 . 1 1 67 67 ASP C C 67 177.700 177.700 177.684 0.016 25800
6371 1 13 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.305 4.095 25800
6372 1 13 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.142 0.258 25800
6373 1 13 . 1 1 67 67 ASP H H 67 7.620 7.620 7.822 -0.202 25800
6374 1 13 . 1 1 68 68 GLY N N 68 115.600 115.600 107.738 7.862 25800
6375 1 13 . 1 1 68 68 GLY C C 68 173.800 173.800 174.775 -0.975 25800
6376 1 13 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.670 1.230 25800
6377 1 13 . 1 1 68 68 GLY H H 68 8.470 8.470 8.658 -0.188 25800
6378 1 13 . 1 1 69 69 CYS N N 69 119.200 119.200 118.569 0.631 25800
6379 1 13 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.635 -0.475 25800
6380 1 13 . 1 1 69 69 CYS C C 69 172.600 172.600 174.228 -1.628 25800
6381 1 13 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.844 0.155 25800
6382 1 13 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.449 -0.749 25800
6383 1 13 . 1 1 69 69 CYS H H 69 7.890 7.890 8.253 -0.363 25800
6384 1 13 . 1 1 70 70 ASP N N 70 122.200 122.200 122.080 0.120 25800
6385 1 13 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.303 0.527 25800
6386 1 13 . 1 1 70 70 ASP C C 70 176.400 176.400 174.175 2.225 25800
6387 1 13 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.228 1.472 25800
6388 1 13 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.394 -1.694 25800
6389 1 13 . 1 1 70 70 ASP H H 70 8.360 8.360 8.856 -0.496 25800
6390 1 13 . 1 1 71 71 PHE N N 71 127.600 127.600 118.493 9.107 25800
6391 1 13 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.146 -0.546 25800
6392 1 13 . 1 1 71 71 PHE C C 71 173.600 173.600 175.348 -1.748 25800
6393 1 13 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.099 -0.299 25800
6394 1 13 . 1 1 71 71 PHE CB C 71 40.700 40.700 40.801 -0.101 25800
6395 1 13 . 1 1 71 71 PHE H H 71 9.390 9.390 7.494 1.896 25800
6396 1 13 . 1 1 72 72 GLU N N 72 123.900 123.900 118.620 5.280 25800
6397 1 13 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.202 -0.662 25800
6398 1 13 . 1 1 72 72 GLU C C 72 175.500 175.500 175.781 -0.281 25800
6399 1 13 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.384 -0.684 25800
6400 1 13 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.382 -1.082 25800
6401 1 13 . 1 1 72 72 GLU H H 72 8.940 8.940 9.237 -0.297 25800
6402 1 13 . 1 1 73 73 GLY N N 73 105.200 105.200 104.901 0.299 25800
6403 1 13 . 1 1 73 73 GLY C C 73 174.100 174.100 174.084 0.016 25800
6404 1 13 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.190 0.410 25800
6405 1 13 . 1 1 73 73 GLY H H 73 8.350 8.350 8.145 0.205 25800
6406 1 13 . 1 1 74 74 ASN N N 74 121.000 121.000 121.592 -0.592 25800
6407 1 13 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.726 0.034 25800
6408 1 13 . 1 1 74 74 ASN C C 74 174.000 174.000 174.168 -0.168 25800
6409 1 13 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.317 -2.417 25800
6410 1 13 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.336 0.364 25800
6411 1 13 . 1 1 74 74 ASN H H 74 7.740 7.740 8.439 -0.699 25800
6412 1 13 . 1 1 75 75 LYS N N 75 121.400 121.400 120.947 0.453 25800
6413 1 13 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.579 -0.109 25800
6414 1 13 . 1 1 75 75 LYS C C 75 176.900 176.900 175.175 1.725 25800
6415 1 13 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.665 -0.365 25800
6416 1 13 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.969 -1.069 25800
6417 1 13 . 1 1 75 75 LYS H H 75 8.380 8.380 8.365 0.015 25800
6418 1 13 . 1 1 76 76 LEU N N 76 127.400 127.400 124.143 3.257 25800
6419 1 13 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.528 -0.098 25800
6420 1 13 . 1 1 76 76 LEU C C 76 177.600 177.600 173.861 3.739 25800
6421 1 13 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.165 0.135 25800
6422 1 13 . 1 1 76 76 LEU CB C 76 43.100 43.100 46.520 -3.420 25800
6423 1 13 . 1 1 76 76 LEU H H 76 8.950 8.950 8.003 0.947 25800
6424 1 13 . 1 1 77 77 ARG N N 77 121.800 121.800 124.854 -3.054 25800
6425 1 13 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.908 -0.008 25800
6426 1 13 . 1 1 77 77 ARG C C 77 174.700 174.700 173.573 1.127 25800
6427 1 13 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.757 -1.757 25800
6428 1 13 . 1 1 77 77 ARG CB C 77 32.300 32.300 34.888 -2.587 25800
6429 1 13 . 1 1 77 77 ARG H H 77 7.530 7.530 9.033 -1.503 25800
6430 1 13 . 1 1 78 78 VAL N N 78 127.000 127.000 124.566 2.434 25800
6431 1 13 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.446 0.834 25800
6432 1 13 . 1 1 78 78 VAL C C 78 174.200 174.200 173.987 0.213 25800
6433 1 13 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.652 -0.452 25800
6434 1 13 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.615 -1.215 25800
6435 1 13 . 1 1 78 78 VAL H H 78 9.660 9.660 8.570 1.090 25800
6436 1 13 . 1 1 79 79 GLU N N 79 121.900 121.900 127.569 -5.669 25800
6437 1 13 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.760 -0.050 25800
6438 1 13 . 1 1 79 79 GLU C C 79 174.600 174.600 173.923 0.677 25800
6439 1 13 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.012 -1.112 25800
6440 1 13 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.249 0.151 25800
6441 1 13 . 1 1 79 79 GLU H H 79 8.980 8.980 8.452 0.528 25800
6442 1 13 . 1 1 80 80 VAL N N 80 121.300 121.300 118.667 2.633 25800
6443 1 13 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.624 -0.254 25800
6444 1 13 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.226 2.774 25800
6445 1 13 . 1 1 80 80 VAL CB C 80 32.100 32.100 31.993 0.107 25800
6446 1 13 . 1 1 80 80 VAL H H 80 8.410 8.410 8.416 -0.006 25800
6447 1 13 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.331 -0.071 25800
6448 1 13 . 1 1 81 81 PRO C C 81 176.100 176.100 177.215 -1.115 25800
6449 1 13 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.876 -1.776 25800
6450 1 13 . 1 1 81 81 PRO CB C 81 32.100 32.100 32.112 -0.013 25800
6451 1 13 . 1 1 82 82 PHE N N 82 122.200 122.200 115.226 6.974 25800
6452 1 13 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.512 -0.222 25800
6453 1 13 . 1 1 82 82 PHE C C 82 175.300 175.300 175.339 -0.039 25800
6454 1 13 . 1 1 82 82 PHE CA C 82 58.100 58.100 57.587 0.513 25800
6455 1 13 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.630 0.770 25800
6456 1 13 . 1 1 82 82 PHE H H 82 8.150 8.150 7.772 0.378 25800
6457 1 13 . 1 1 83 83 ASN N N 83 120.800 120.800 117.272 3.528 25800
6458 1 13 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.189 0.251 25800
6459 1 13 . 1 1 83 83 ASN C C 83 174.100 174.100 174.696 -0.596 25800
6460 1 13 . 1 1 83 83 ASN CA C 83 52.700 52.700 52.836 -0.136 25800
6461 1 13 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.149 0.551 25800
6462 1 13 . 1 1 83 83 ASN H H 83 8.110 8.110 7.473 0.637 25800
6463 1 13 . 1 1 84 84 ALA N N 84 123.700 123.700 120.593 3.107 25800
6464 1 13 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.234 -0.154 25800
6465 1 13 . 1 1 84 84 ALA C C 84 177.100 177.100 177.018 0.082 25800
6466 1 13 . 1 1 84 84 ALA CA C 84 52.400 52.400 54.167 -1.767 25800
6467 1 13 . 1 1 84 84 ALA CB C 84 19.100 19.100 18.379 0.721 25800
6468 1 13 . 1 1 84 84 ALA H H 84 8.020 8.020 8.703 -0.683 25800
6469 1 13 . 1 1 85 85 ARG N N 85 120.200 120.200 119.694 0.506 25800
6470 1 13 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.429 -0.279 25800
6471 1 13 . 1 1 85 85 ARG C C 85 175.200 175.200 175.576 -0.376 25800
6472 1 13 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.926 0.074 25800
6473 1 13 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.934 -0.134 25800
6474 1 13 . 1 1 85 85 ARG H H 85 8.040 8.040 8.393 -0.353 25800
6475 1 14 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.810 -0.220 25800
6476 1 14 . 1 1 0 0 HIS C C 0 174.000 174.000 173.696 0.304 25800
6477 1 14 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.782 -1.482 25800
6478 1 14 . 1 1 0 0 HIS CB C 0 29.300 29.300 31.192 -1.892 25800
6479 1 14 . 1 1 1 1 MET N N 1 122.400 122.400 123.047 -0.647 25800
6480 1 14 . 1 1 1 1 MET HA H 1 4.340 4.340 4.774 -0.434 25800
6481 1 14 . 1 1 1 1 MET C C 1 175.600 175.600 174.727 0.873 25800
6482 1 14 . 1 1 1 1 MET CA C 1 55.600 55.600 55.684 -0.084 25800
6483 1 14 . 1 1 1 1 MET CB C 1 32.800 32.800 32.829 -0.029 25800
6484 1 14 . 1 1 1 1 MET H H 1 8.310 8.310 8.197 0.113 25800
6485 1 14 . 1 1 2 2 VAL N N 2 123.200 123.200 122.474 0.726 25800
6486 1 14 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.122 -0.162 25800
6487 1 14 . 1 1 2 2 VAL C C 2 175.600 175.600 175.033 0.567 25800
6488 1 14 . 1 1 2 2 VAL CA C 2 62.300 62.300 63.706 -1.406 25800
6489 1 14 . 1 1 2 2 VAL CB C 2 32.300 32.300 30.669 1.631 25800
6490 1 14 . 1 1 2 2 VAL H H 2 8.180 8.180 8.151 0.029 25800
6491 1 14 . 1 1 3 3 ILE N N 3 126.200 126.200 125.884 0.316 25800
6492 1 14 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.354 -0.304 25800
6493 1 14 . 1 1 3 3 ILE C C 3 175.800 175.800 174.597 1.203 25800
6494 1 14 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.205 0.495 25800
6495 1 14 . 1 1 3 3 ILE CB C 3 38.300 38.300 41.185 -2.885 25800
6496 1 14 . 1 1 3 3 ILE H H 3 8.230 8.230 7.705 0.525 25800
6497 1 14 . 1 1 4 4 ARG N N 4 126.100 126.100 122.540 3.560 25800
6498 1 14 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.582 -0.402 25800
6499 1 14 . 1 1 4 4 ARG C C 4 175.900 175.900 176.234 -0.334 25800
6500 1 14 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.280 -0.280 25800
6501 1 14 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.902 -0.202 25800
6502 1 14 . 1 1 4 4 ARG H H 4 8.360 8.360 8.429 -0.069 25800
6503 1 14 . 1 1 5 5 GLU N N 5 122.200 122.200 119.628 2.572 25800
6504 1 14 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.560 -0.420 25800
6505 1 14 . 1 1 5 5 GLU C C 5 176.100 176.100 174.834 1.266 25800
6506 1 14 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.585 1.015 25800
6507 1 14 . 1 1 5 5 GLU CB C 5 30.300 30.300 31.324 -1.024 25800
6508 1 14 . 1 1 5 5 GLU H H 5 8.400 8.400 7.821 0.579 25800
6509 1 14 . 1 1 6 6 SER N N 6 116.200 116.200 115.870 0.330 25800
6510 1 14 . 1 1 6 6 SER HA H 6 4.350 4.350 4.607 -0.257 25800
6511 1 14 . 1 1 6 6 SER C C 6 174.300 174.300 174.224 0.076 25800
6512 1 14 . 1 1 6 6 SER CA C 6 58.200 58.200 57.654 0.546 25800
6513 1 14 . 1 1 6 6 SER CB C 6 63.800 63.800 63.721 0.079 25800
6514 1 14 . 1 1 6 6 SER H H 6 8.270 8.270 8.345 -0.075 25800
6515 1 14 . 1 1 7 7 VAL N N 7 119.800 119.800 126.193 -6.393 25800
6516 1 14 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.191 0.109 25800
6517 1 14 . 1 1 7 7 VAL C C 7 175.500 175.500 175.227 0.273 25800
6518 1 14 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.419 0.282 25800
6519 1 14 . 1 1 7 7 VAL CB C 7 32.800 32.800 31.019 1.781 25800
6520 1 14 . 1 1 7 7 VAL H H 7 7.840 7.840 8.440 -0.600 25800
6521 1 14 . 1 1 8 8 SER N N 8 117.800 117.800 122.674 -4.874 25800
6522 1 14 . 1 1 8 8 SER HA H 8 4.240 4.240 4.594 -0.354 25800
6523 1 14 . 1 1 8 8 SER C C 8 172.500 172.500 174.382 -1.882 25800
6524 1 14 . 1 1 8 8 SER CA C 8 58.500 58.500 58.812 -0.312 25800
6525 1 14 . 1 1 8 8 SER CB C 8 63.600 63.600 63.719 -0.119 25800
6526 1 14 . 1 1 8 8 SER H H 8 8.530 8.530 7.995 0.535 25800
6527 1 14 . 1 1 9 9 ARG N N 9 123.000 123.000 123.430 -0.430 25800
6528 1 14 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.525 -0.025 25800
6529 1 14 . 1 1 9 9 ARG C C 9 175.000 175.000 175.262 -0.262 25800
6530 1 14 . 1 1 9 9 ARG CA C 9 54.300 54.300 55.108 -0.808 25800
6531 1 14 . 1 1 9 9 ARG CB C 9 33.400 33.400 35.679 -2.280 25800
6532 1 14 . 1 1 9 9 ARG H H 9 7.350 7.350 8.470 -1.120 25800
6533 1 14 . 1 1 10 10 ILE N N 10 114.000 114.000 118.864 -4.864 25800
6534 1 14 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.307 0.513 25800
6535 1 14 . 1 1 10 10 ILE C C 10 173.000 173.000 174.075 -1.075 25800
6536 1 14 . 1 1 10 10 ILE CA C 10 59.400 59.400 60.091 -0.691 25800
6537 1 14 . 1 1 10 10 ILE CB C 10 40.900 40.900 41.328 -0.428 25800
6538 1 14 . 1 1 10 10 ILE H H 10 8.830 8.830 8.954 -0.124 25800
6539 1 14 . 1 1 11 11 TYR N N 11 123.400 123.400 126.287 -2.887 25800
6540 1 14 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.220 -0.290 25800
6541 1 14 . 1 1 11 11 TYR C C 11 173.000 173.000 173.007 -0.007 25800
6542 1 14 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.755 0.245 25800
6543 1 14 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.760 -1.860 25800
6544 1 14 . 1 1 11 11 TYR H H 11 8.690 8.690 8.824 -0.134 25800
6545 1 14 . 1 1 12 12 VAL N N 12 126.300 126.300 124.600 1.700 25800
6546 1 14 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.223 0.337 25800
6547 1 14 . 1 1 12 12 VAL C C 12 174.100 174.100 174.505 -0.405 25800
6548 1 14 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.682 -0.482 25800
6549 1 14 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.072 -0.672 25800
6550 1 14 . 1 1 12 12 VAL H H 12 8.370 8.370 7.932 0.438 25800
6551 1 14 . 1 1 13 13 GLY N N 13 113.000 113.000 112.610 0.390 25800
6552 1 14 . 1 1 13 13 GLY C C 13 173.100 173.100 173.787 -0.687 25800
6553 1 14 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.985 -0.685 25800
6554 1 14 . 1 1 13 13 GLY H H 13 9.350 9.350 8.480 0.870 25800
6555 1 14 . 1 1 14 14 ASN N N 14 113.900 113.900 116.477 -2.577 25800
6556 1 14 . 1 1 14 14 ASN HA H 14 4.280 4.280 3.869 0.411 25800
6557 1 14 . 1 1 14 14 ASN C C 14 175.800 175.800 174.598 1.202 25800
6558 1 14 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.800 -0.200 25800
6559 1 14 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.739 0.961 25800
6560 1 14 . 1 1 14 14 ASN H H 14 8.800 8.800 7.615 1.185 25800
6561 1 14 . 1 1 15 15 LEU N N 15 115.800 115.800 120.944 -5.144 25800
6562 1 14 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.458 0.532 25800
6563 1 14 . 1 1 15 15 LEU CA C 15 55.600 55.600 52.873 2.727 25800
6564 1 14 . 1 1 15 15 LEU CB C 15 41.600 41.600 42.947 -1.347 25800
6565 1 14 . 1 1 15 15 LEU H H 15 7.150 7.150 7.351 -0.201 25800
6566 1 14 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.634 -0.564 25800
6567 1 14 . 1 1 16 16 PRO C C 16 171.500 171.500 177.576 -6.076 25800
6568 1 14 . 1 1 16 16 PRO CA C 16 62.500 62.500 61.839 0.661 25800
6569 1 14 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.887 -0.887 25800
6570 1 14 . 1 1 17 17 SER N N 17 115.200 115.200 115.694 -0.494 25800
6571 1 14 . 1 1 17 17 SER HA H 17 4.300 4.300 4.303 -0.003 25800
6572 1 14 . 1 1 17 17 SER C C 17 174.200 174.200 174.881 -0.681 25800
6573 1 14 . 1 1 17 17 SER CA C 17 58.200 58.200 57.929 0.271 25800
6574 1 14 . 1 1 17 17 SER CB C 17 63.900 63.900 62.030 1.870 25800
6575 1 14 . 1 1 17 17 SER H H 17 8.470 8.470 8.461 0.009 25800
6576 1 14 . 1 1 18 18 HIS N N 18 120.800 120.800 122.075 -1.275 25800
6577 1 14 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.457 0.093 25800
6578 1 14 . 1 1 18 18 HIS C C 18 175.100 175.100 174.858 0.242 25800
6579 1 14 . 1 1 18 18 HIS CA C 18 55.500 55.500 57.508 -2.008 25800
6580 1 14 . 1 1 18 18 HIS CB C 18 29.300 29.300 30.459 -1.159 25800
6581 1 14 . 1 1 18 18 HIS H H 18 8.540 8.540 8.261 0.279 25800
6582 1 14 . 1 1 19 19 VAL N N 19 115.700 115.700 115.569 0.131 25800
6583 1 14 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.441 -0.181 25800
6584 1 14 . 1 1 19 19 VAL C C 19 174.000 174.000 174.816 -0.816 25800
6585 1 14 . 1 1 19 19 VAL CA C 19 61.900 61.900 60.382 1.518 25800
6586 1 14 . 1 1 19 19 VAL CB C 19 32.600 32.600 34.528 -1.928 25800
6587 1 14 . 1 1 19 19 VAL H H 19 6.650 6.650 7.299 -0.649 25800
6588 1 14 . 1 1 20 20 SER N N 20 118.800 118.800 120.000 -1.200 25800
6589 1 14 . 1 1 20 20 SER HA H 20 4.710 4.710 4.782 -0.072 25800
6590 1 14 . 1 1 20 20 SER C C 20 175.900 175.900 175.549 0.351 25800
6591 1 14 . 1 1 20 20 SER CA C 20 55.800 55.800 56.680 -0.880 25800
6592 1 14 . 1 1 20 20 SER CB C 20 66.600 66.600 64.718 1.882 25800
6593 1 14 . 1 1 20 20 SER H H 20 8.930 8.930 8.257 0.673 25800
6594 1 14 . 1 1 21 21 SER N N 21 117.100 117.100 116.050 1.050 25800
6595 1 14 . 1 1 21 21 SER HA H 21 3.880 3.880 4.133 -0.253 25800
6596 1 14 . 1 1 21 21 SER C C 21 176.200 176.200 176.283 -0.083 25800
6597 1 14 . 1 1 21 21 SER CA C 21 62.300 62.300 60.893 1.407 25800
6598 1 14 . 1 1 21 21 SER CB C 21 66.800 66.800 62.776 4.024 25800
6599 1 14 . 1 1 21 21 SER H H 21 9.080 9.080 8.831 0.249 25800
6600 1 14 . 1 1 22 22 ARG N N 22 121.200 121.200 122.958 -1.758 25800
6601 1 14 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.115 -0.125 25800
6602 1 14 . 1 1 22 22 ARG C C 22 177.900 177.900 178.244 -0.344 25800
6603 1 14 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.760 -0.060 25800
6604 1 14 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.642 -0.042 25800
6605 1 14 . 1 1 22 22 ARG H H 22 7.940 7.940 7.758 0.182 25800
6606 1 14 . 1 1 23 23 ASP N N 23 118.800 118.800 119.081 -0.281 25800
6607 1 14 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.530 -0.140 25800
6608 1 14 . 1 1 23 23 ASP C C 23 179.200 179.200 178.378 0.822 25800
6609 1 14 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.833 0.467 25800
6610 1 14 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.546 0.454 25800
6611 1 14 . 1 1 23 23 ASP H H 23 7.480 7.480 7.658 -0.178 25800
6612 1 14 . 1 1 24 24 VAL N N 24 119.500 119.500 119.961 -0.461 25800
6613 1 14 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.735 -0.365 25800
6614 1 14 . 1 1 24 24 VAL C C 24 177.500 177.500 177.462 0.038 25800
6615 1 14 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.951 -0.051 25800
6616 1 14 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.744 -0.344 25800
6617 1 14 . 1 1 24 24 VAL H H 24 7.450 7.450 8.158 -0.708 25800
6618 1 14 . 1 1 25 25 GLU N N 25 121.400 121.400 120.480 0.920 25800
6619 1 14 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.974 -0.404 25800
6620 1 14 . 1 1 25 25 GLU C C 25 178.400 178.400 178.685 -0.285 25800
6621 1 14 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.129 0.471 25800
6622 1 14 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.347 0.253 25800
6623 1 14 . 1 1 25 25 GLU H H 25 8.580 8.580 7.918 0.662 25800
6624 1 14 . 1 1 26 26 ASN N N 26 114.800 114.800 117.621 -2.821 25800
6625 1 14 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.434 -0.114 25800
6626 1 14 . 1 1 26 26 ASN C C 26 177.400 177.400 178.078 -0.678 25800
6627 1 14 . 1 1 26 26 ASN CA C 26 55.900 55.900 56.460 -0.560 25800
6628 1 14 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.450 -0.550 25800
6629 1 14 . 1 1 26 26 ASN H H 26 8.180 8.180 7.907 0.273 25800
6630 1 14 . 1 1 27 27 GLU N N 27 118.900 118.900 120.593 -1.693 25800
6631 1 14 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.138 0.002 25800
6632 1 14 . 1 1 27 27 GLU C C 27 176.400 176.400 179.087 -2.687 25800
6633 1 14 . 1 1 27 27 GLU CA C 27 57.400 57.400 59.037 -1.637 25800
6634 1 14 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.648 -0.248 25800
6635 1 14 . 1 1 27 27 GLU H H 27 7.340 7.340 8.245 -0.905 25800
6636 1 14 . 1 1 28 28 PHE N N 28 114.100 114.100 118.493 -4.393 25800
6637 1 14 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.493 0.057 25800
6638 1 14 . 1 1 28 28 PHE C C 28 176.300 176.300 178.417 -2.117 25800
6639 1 14 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.788 -0.788 25800
6640 1 14 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.200 1.600 25800
6641 1 14 . 1 1 28 28 PHE H H 28 7.660 7.660 8.404 -0.744 25800
6642 1 14 . 1 1 29 29 ARG N N 29 121.700 121.700 119.327 2.373 25800
6643 1 14 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.134 0.276 25800
6644 1 14 . 1 1 29 29 ARG C C 29 177.100 177.100 177.192 -0.092 25800
6645 1 14 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.915 -0.715 25800
6646 1 14 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.239 -0.939 25800
6647 1 14 . 1 1 29 29 ARG H H 29 8.120 8.120 8.210 -0.090 25800
6648 1 14 . 1 1 30 30 LYS N N 30 117.200 117.200 117.099 0.101 25800
6649 1 14 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.194 -0.364 25800
6650 1 14 . 1 1 30 30 LYS C C 30 177.100 177.100 178.563 -1.463 25800
6651 1 14 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.013 -0.213 25800
6652 1 14 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.900 -0.800 25800
6653 1 14 . 1 1 30 30 LYS H H 30 7.630 7.630 7.745 -0.115 25800
6654 1 14 . 1 1 31 31 TYR N N 31 117.100 117.100 120.085 -2.985 25800
6655 1 14 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.380 -0.230 25800
6656 1 14 . 1 1 31 31 TYR C C 31 174.400 174.400 177.082 -2.682 25800
6657 1 14 . 1 1 31 31 TYR CA C 31 59.900 59.900 60.651 -0.751 25800
6658 1 14 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.505 -1.605 25800
6659 1 14 . 1 1 31 31 TYR H H 31 7.410 7.410 8.104 -0.694 25800
6660 1 14 . 1 1 32 32 GLY N N 32 104.100 104.100 103.715 0.385 25800
6661 1 14 . 1 1 32 32 GLY C C 32 177.000 177.000 172.734 4.266 25800
6662 1 14 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.107 -0.607 25800
6663 1 14 . 1 1 32 32 GLY H H 32 7.240 7.240 7.890 -0.650 25800
6664 1 14 . 1 1 33 33 ASN N N 33 115.300 115.300 122.101 -6.801 25800
6665 1 14 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.728 -0.288 25800
6666 1 14 . 1 1 33 33 ASN C C 33 175.500 175.500 174.481 1.019 25800
6667 1 14 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.664 0.635 25800
6668 1 14 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.117 0.283 25800
6669 1 14 . 1 1 33 33 ASN H H 33 8.460 8.460 8.777 -0.317 25800
6670 1 14 . 1 1 34 34 ILE N N 34 126.700 126.700 123.365 3.335 25800
6671 1 14 . 1 1 34 34 ILE HA H 34 3.790 3.790 3.136 0.654 25800
6672 1 14 . 1 1 34 34 ILE C C 34 175.600 175.600 175.395 0.205 25800
6673 1 14 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.135 0.166 25800
6674 1 14 . 1 1 34 34 ILE CB C 34 40.000 40.000 37.981 2.018 25800
6675 1 14 . 1 1 34 34 ILE H H 34 8.050 8.050 7.829 0.221 25800
6676 1 14 . 1 1 35 35 LEU N N 35 127.400 127.400 128.815 -1.415 25800
6677 1 14 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.392 -0.232 25800
6678 1 14 . 1 1 35 35 LEU C C 35 177.200 177.200 176.497 0.703 25800
6679 1 14 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.429 0.071 25800
6680 1 14 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.742 -0.042 25800
6681 1 14 . 1 1 35 35 LEU H H 35 8.780 8.780 8.862 -0.082 25800
6682 1 14 . 1 1 36 36 LYS N N 36 117.000 117.000 118.304 -1.304 25800
6683 1 14 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.570 -0.330 25800
6684 1 14 . 1 1 36 36 LYS C C 36 173.600 173.600 173.961 -0.361 25800
6685 1 14 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.136 0.764 25800
6686 1 14 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.628 -0.028 25800
6687 1 14 . 1 1 36 36 LYS H H 36 7.110 7.110 7.479 -0.369 25800
6688 1 14 . 1 1 37 37 CYS N N 37 125.400 125.400 119.249 6.151 25800
6689 1 14 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.681 -0.981 25800
6690 1 14 . 1 1 37 37 CYS C C 37 171.600 171.600 173.096 -1.496 25800
6691 1 14 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.721 1.179 25800
6692 1 14 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.973 -4.873 25800
6693 1 14 . 1 1 37 37 CYS H H 37 8.610 8.610 8.459 0.151 25800
6694 1 14 . 1 1 38 38 ASP N N 38 128.200 128.200 120.098 8.102 25800
6695 1 14 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.891 0.059 25800
6696 1 14 . 1 1 38 38 ASP C C 38 174.300 174.300 173.777 0.523 25800
6697 1 14 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.917 -0.717 25800
6698 1 14 . 1 1 38 38 ASP CB C 38 44.300 44.300 44.796 -0.496 25800
6699 1 14 . 1 1 38 38 ASP H H 38 8.290 8.290 8.790 -0.500 25800
6700 1 14 . 1 1 39 39 VAL N N 39 123.500 123.500 117.276 6.224 25800
6701 1 14 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.234 -0.934 25800
6702 1 14 . 1 1 39 39 VAL C C 39 175.000 175.000 174.775 0.225 25800
6703 1 14 . 1 1 39 39 VAL CA C 39 61.700 61.700 60.496 1.204 25800
6704 1 14 . 1 1 39 39 VAL CB C 39 33.100 33.100 33.936 -0.836 25800
6705 1 14 . 1 1 39 39 VAL H H 39 8.380 8.380 8.409 -0.029 25800
6706 1 14 . 1 1 40 40 LYS N N 40 129.100 129.100 126.205 2.895 25800
6707 1 14 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.720 -0.400 25800
6708 1 14 . 1 1 40 40 LYS C C 40 173.700 173.700 175.287 -1.587 25800
6709 1 14 . 1 1 40 40 LYS CA C 40 53.900 53.900 55.779 -1.879 25800
6710 1 14 . 1 1 40 40 LYS CB C 40 35.500 35.500 34.867 0.633 25800
6711 1 14 . 1 1 40 40 LYS H H 40 8.680 8.680 9.206 -0.526 25800
6712 1 14 . 1 1 41 41 LYS N N 41 117.300 117.300 120.811 -3.511 25800
6713 1 14 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.588 -0.608 25800
6714 1 14 . 1 1 41 41 LYS C C 41 177.800 177.800 175.493 2.307 25800
6715 1 14 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.640 -0.040 25800
6716 1 14 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.810 -0.810 25800
6717 1 14 . 1 1 41 41 LYS H H 41 7.900 7.900 8.336 -0.436 25800
6718 1 14 . 1 1 42 42 THR N N 42 113.200 113.200 111.390 1.810 25800
6719 1 14 . 1 1 42 42 THR HA H 42 4.680 4.680 4.724 -0.044 25800
6720 1 14 . 1 1 42 42 THR C C 42 176.900 176.900 176.125 0.775 25800
6721 1 14 . 1 1 42 42 THR CA C 42 60.200 60.200 60.713 -0.513 25800
6722 1 14 . 1 1 42 42 THR CB C 42 71.600 71.600 70.544 1.056 25800
6723 1 14 . 1 1 42 42 THR H H 42 8.730 8.730 8.368 0.362 25800
6724 1 14 . 1 1 43 43 VAL N N 43 120.000 120.000 120.698 -0.698 25800
6725 1 14 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.939 -0.019 25800
6726 1 14 . 1 1 43 43 VAL C C 43 177.000 177.000 176.892 0.108 25800
6727 1 14 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.592 0.108 25800
6728 1 14 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.596 0.204 25800
6729 1 14 . 1 1 43 43 VAL H H 43 8.730 8.730 8.638 0.092 25800
6730 1 14 . 1 1 44 44 SER N N 44 113.400 113.400 114.879 -1.479 25800
6731 1 14 . 1 1 44 44 SER HA H 44 4.360 4.360 4.402 -0.042 25800
6732 1 14 . 1 1 44 44 SER C C 44 174.800 174.800 175.627 -0.827 25800
6733 1 14 . 1 1 44 44 SER CA C 44 58.400 58.400 58.918 -0.518 25800
6734 1 14 . 1 1 44 44 SER CB C 44 63.500 63.500 63.567 -0.067 25800
6735 1 14 . 1 1 44 44 SER H H 44 7.760 7.760 7.994 -0.234 25800
6736 1 14 . 1 1 45 45 GLY N N 45 110.200 110.200 108.796 1.404 25800
6737 1 14 . 1 1 45 45 GLY C C 45 173.500 173.500 174.111 -0.611 25800
6738 1 14 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.557 -0.257 25800
6739 1 14 . 1 1 45 45 GLY H H 45 7.820 7.820 7.990 -0.170 25800
6740 1 14 . 1 1 46 46 ALA N N 46 123.900 123.900 123.696 0.204 25800
6741 1 14 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.187 0.203 25800
6742 1 14 . 1 1 46 46 ALA C C 46 176.100 176.100 176.075 0.025 25800
6743 1 14 . 1 1 46 46 ALA CA C 46 51.900 51.900 52.095 -0.195 25800
6744 1 14 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.514 0.286 25800
6745 1 14 . 1 1 46 46 ALA H H 46 7.440 7.440 7.912 -0.472 25800
6746 1 14 . 1 1 47 47 ALA N N 47 123.100 123.100 124.672 -1.572 25800
6747 1 14 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.315 -0.115 25800
6748 1 14 . 1 1 47 47 ALA C C 47 176.100 176.100 175.542 0.558 25800
6749 1 14 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.217 0.683 25800
6750 1 14 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.083 -0.183 25800
6751 1 14 . 1 1 47 47 ALA H H 47 8.350 8.350 8.120 0.230 25800
6752 1 14 . 1 1 48 48 PHE N N 48 118.700 118.700 116.743 1.957 25800
6753 1 14 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.104 -0.074 25800
6754 1 14 . 1 1 48 48 PHE C C 48 171.600 171.600 174.070 -2.470 25800
6755 1 14 . 1 1 48 48 PHE CA C 48 55.700 55.700 57.044 -1.344 25800
6756 1 14 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.737 -2.537 25800
6757 1 14 . 1 1 48 48 PHE H H 48 8.550 8.550 9.083 -0.533 25800
6758 1 14 . 1 1 49 49 ALA N N 49 120.400 120.400 124.607 -4.207 25800
6759 1 14 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.030 0.300 25800
6760 1 14 . 1 1 49 49 ALA C C 49 175.500 175.500 175.500 0.000 25800
6761 1 14 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.429 -1.129 25800
6762 1 14 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.093 2.607 25800
6763 1 14 . 1 1 49 49 ALA H H 49 9.240 9.240 8.448 0.792 25800
6764 1 14 . 1 1 50 50 PHE N N 50 115.000 115.000 120.635 -5.635 25800
6765 1 14 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.618 -0.018 25800
6766 1 14 . 1 1 50 50 PHE C C 50 176.000 176.000 174.202 1.798 25800
6767 1 14 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.701 -0.201 25800
6768 1 14 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.576 -1.376 25800
6769 1 14 . 1 1 50 50 PHE H H 50 7.920 7.920 8.686 -0.766 25800
6770 1 14 . 1 1 51 51 ILE N N 51 123.000 123.000 120.347 2.653 25800
6771 1 14 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.827 -0.377 25800
6772 1 14 . 1 1 51 51 ILE C C 51 173.700 173.700 174.080 -0.380 25800
6773 1 14 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.283 -0.083 25800
6774 1 14 . 1 1 51 51 ILE CB C 51 40.700 40.700 42.351 -1.651 25800
6775 1 14 . 1 1 51 51 ILE H H 51 8.490 8.490 9.053 -0.563 25800
6776 1 14 . 1 1 52 52 GLU N N 52 126.600 126.600 124.331 2.269 25800
6777 1 14 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.079 -0.309 25800
6778 1 14 . 1 1 52 52 GLU C C 52 175.300 175.300 174.843 0.457 25800
6779 1 14 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.691 0.009 25800
6780 1 14 . 1 1 52 52 GLU CB C 52 31.500 31.500 33.342 -1.842 25800
6781 1 14 . 1 1 52 52 GLU H H 52 8.610 8.610 9.077 -0.467 25800
6782 1 14 . 1 1 53 53 PHE N N 53 126.100 126.100 123.927 2.173 25800
6783 1 14 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.350 -0.550 25800
6784 1 14 . 1 1 53 53 PHE C C 53 175.400 175.400 175.587 -0.187 25800
6785 1 14 . 1 1 53 53 PHE CA C 53 58.200 58.200 57.036 1.164 25800
6786 1 14 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.536 -2.636 25800
6787 1 14 . 1 1 53 53 PHE H H 53 8.800 8.800 9.124 -0.324 25800
6788 1 14 . 1 1 54 54 GLU N N 54 120.700 120.700 122.808 -2.108 25800
6789 1 14 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.299 -0.369 25800
6790 1 14 . 1 1 54 54 GLU C C 54 175.300 175.300 176.838 -1.538 25800
6791 1 14 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.958 1.143 25800
6792 1 14 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.269 0.531 25800
6793 1 14 . 1 1 54 54 GLU H H 54 8.160 8.160 8.488 -0.328 25800
6794 1 14 . 1 1 55 55 ASP N N 55 117.900 117.900 121.849 -3.949 25800
6795 1 14 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.906 0.014 25800
6796 1 14 . 1 1 55 55 ASP C C 55 176.400 176.400 175.483 0.917 25800
6797 1 14 . 1 1 55 55 ASP CA C 55 52.400 52.400 52.790 -0.390 25800
6798 1 14 . 1 1 55 55 ASP CB C 55 44.400 44.400 39.996 4.404 25800
6799 1 14 . 1 1 55 55 ASP H H 55 8.740 8.740 8.041 0.699 25800
6800 1 14 . 1 1 56 56 ALA N N 56 128.900 128.900 123.868 5.032 25800
6801 1 14 . 1 1 56 56 ALA HA H 56 3.830 3.830 2.799 1.031 25800
6802 1 14 . 1 1 56 56 ALA C C 56 179.800 179.800 178.066 1.734 25800
6803 1 14 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.939 0.261 25800
6804 1 14 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.172 0.728 25800
6805 1 14 . 1 1 56 56 ALA H H 56 8.800 8.800 7.647 1.153 25800
6806 1 14 . 1 1 57 57 ARG N N 57 119.200 119.200 116.694 2.506 25800
6807 1 14 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.201 -0.311 25800
6808 1 14 . 1 1 57 57 ARG C C 57 178.000 178.000 175.866 2.134 25800
6809 1 14 . 1 1 57 57 ARG CA C 57 58.900 58.900 57.170 1.730 25800
6810 1 14 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.692 0.608 25800
6811 1 14 . 1 1 57 57 ARG H H 57 8.950 8.950 7.898 1.052 25800
6812 1 14 . 1 1 58 58 ASP N N 58 120.900 120.900 120.650 0.250 25800
6813 1 14 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.706 -0.616 25800
6814 1 14 . 1 1 58 58 ASP C C 58 176.700 176.700 177.033 -0.333 25800
6815 1 14 . 1 1 58 58 ASP CA C 58 56.500 56.500 55.584 0.916 25800
6816 1 14 . 1 1 58 58 ASP CB C 58 39.900 39.900 42.191 -2.291 25800
6817 1 14 . 1 1 58 58 ASP H H 58 7.020 7.020 7.604 -0.584 25800
6818 1 14 . 1 1 59 59 ALA N N 59 119.700 119.700 122.980 -3.280 25800
6819 1 14 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.503 -1.423 25800
6820 1 14 . 1 1 59 59 ALA C C 59 178.100 178.100 179.096 -0.996 25800
6821 1 14 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.206 0.094 25800
6822 1 14 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.539 -0.139 25800
6823 1 14 . 1 1 59 59 ALA H H 59 6.440 6.440 8.072 -1.632 25800
6824 1 14 . 1 1 60 60 ALA N N 60 117.600 117.600 121.830 -4.230 25800
6825 1 14 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.109 -0.279 25800
6826 1 14 . 1 1 60 60 ALA C C 60 180.900 180.900 179.267 1.633 25800
6827 1 14 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.539 -0.639 25800
6828 1 14 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.260 -0.560 25800
6829 1 14 . 1 1 60 60 ALA H H 60 7.330 7.330 8.093 -0.763 25800
6830 1 14 . 1 1 61 61 ASP N N 61 120.100 120.100 119.018 1.082 25800
6831 1 14 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.375 -0.165 25800
6832 1 14 . 1 1 61 61 ASP C C 61 176.700 176.700 178.175 -1.475 25800
6833 1 14 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.116 -0.016 25800
6834 1 14 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.279 -0.179 25800
6835 1 14 . 1 1 61 61 ASP H H 61 7.590 7.590 7.984 -0.394 25800
6836 1 14 . 1 1 62 62 ALA N N 62 122.200 122.200 121.499 0.701 25800
6837 1 14 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.991 -1.571 25800
6838 1 14 . 1 1 62 62 ALA C C 62 179.300 179.300 179.243 0.057 25800
6839 1 14 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.337 0.263 25800
6840 1 14 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.185 0.915 25800
6841 1 14 . 1 1 62 62 ALA H H 62 7.440 7.440 7.883 -0.443 25800
6842 1 14 . 1 1 63 63 ILE N N 63 116.700 116.700 117.941 -1.241 25800
6843 1 14 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.111 -0.871 25800
6844 1 14 . 1 1 63 63 ILE C C 63 177.800 177.800 178.308 -0.508 25800
6845 1 14 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.328 2.272 25800
6846 1 14 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.086 0.815 25800
6847 1 14 . 1 1 63 63 ILE H H 63 7.540 7.540 7.793 -0.253 25800
6848 1 14 . 1 1 64 64 LYS N N 64 117.400 117.400 119.748 -2.348 25800
6849 1 14 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.196 -0.296 25800
6850 1 14 . 1 1 64 64 LYS C C 64 178.900 178.900 178.718 0.182 25800
6851 1 14 . 1 1 64 64 LYS CA C 64 58.800 58.800 57.915 0.885 25800
6852 1 14 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.257 1.343 25800
6853 1 14 . 1 1 64 64 LYS H H 64 7.490 7.490 8.419 -0.929 25800
6854 1 14 . 1 1 65 65 GLU N N 65 113.800 113.800 118.632 -4.832 25800
6855 1 14 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.280 -0.120 25800
6856 1 14 . 1 1 65 65 GLU C C 65 178.300 178.300 177.088 1.212 25800
6857 1 14 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.066 0.234 25800
6858 1 14 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.922 1.778 25800
6859 1 14 . 1 1 65 65 GLU H H 65 7.960 7.960 8.056 -0.096 25800
6860 1 14 . 1 1 66 66 LYS N N 66 114.700 114.700 118.424 -3.724 25800
6861 1 14 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.692 -0.222 25800
6862 1 14 . 1 1 66 66 LYS C C 66 177.500 177.500 175.816 1.684 25800
6863 1 14 . 1 1 66 66 LYS CA C 66 54.400 54.400 54.794 -0.394 25800
6864 1 14 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.614 0.386 25800
6865 1 14 . 1 1 66 66 LYS H H 66 8.050 8.050 7.884 0.166 25800
6866 1 14 . 1 1 67 67 ASP N N 67 118.800 118.800 120.774 -1.974 25800
6867 1 14 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.547 -0.327 25800
6868 1 14 . 1 1 67 67 ASP C C 67 177.700 177.700 177.457 0.243 25800
6869 1 14 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.108 4.292 25800
6870 1 14 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.275 0.125 25800
6871 1 14 . 1 1 67 67 ASP H H 67 7.620 7.620 7.533 0.087 25800
6872 1 14 . 1 1 68 68 GLY N N 68 115.600 115.600 107.474 8.126 25800
6873 1 14 . 1 1 68 68 GLY C C 68 173.800 173.800 174.550 -0.750 25800
6874 1 14 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.738 1.162 25800
6875 1 14 . 1 1 68 68 GLY H H 68 8.470 8.470 8.543 -0.073 25800
6876 1 14 . 1 1 69 69 CYS N N 69 119.200 119.200 120.675 -1.475 25800
6877 1 14 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.804 -0.644 25800
6878 1 14 . 1 1 69 69 CYS C C 69 172.600 172.600 174.113 -1.513 25800
6879 1 14 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.770 0.230 25800
6880 1 14 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.619 -0.918 25800
6881 1 14 . 1 1 69 69 CYS H H 69 7.890 7.890 8.263 -0.373 25800
6882 1 14 . 1 1 70 70 ASP N N 70 122.200 122.200 122.239 -0.039 25800
6883 1 14 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.646 0.184 25800
6884 1 14 . 1 1 70 70 ASP C C 70 176.400 176.400 174.621 1.779 25800
6885 1 14 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.893 0.807 25800
6886 1 14 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.558 -1.858 25800
6887 1 14 . 1 1 70 70 ASP H H 70 8.360 8.360 8.751 -0.391 25800
6888 1 14 . 1 1 71 71 PHE N N 71 127.600 127.600 119.124 8.476 25800
6889 1 14 . 1 1 71 71 PHE HA H 71 4.600 4.600 4.981 -0.381 25800
6890 1 14 . 1 1 71 71 PHE C C 71 173.600 173.600 175.567 -1.967 25800
6891 1 14 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.276 -0.476 25800
6892 1 14 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.707 -1.007 25800
6893 1 14 . 1 1 71 71 PHE H H 71 9.390 9.390 7.517 1.873 25800
6894 1 14 . 1 1 72 72 GLU N N 72 123.900 123.900 118.734 5.166 25800
6895 1 14 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.061 -0.521 25800
6896 1 14 . 1 1 72 72 GLU C C 72 175.500 175.500 175.771 -0.271 25800
6897 1 14 . 1 1 72 72 GLU CA C 72 56.700 56.700 58.147 -1.447 25800
6898 1 14 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.588 -1.288 25800
6899 1 14 . 1 1 72 72 GLU H H 72 8.940 8.940 9.253 -0.313 25800
6900 1 14 . 1 1 73 73 GLY N N 73 105.200 105.200 105.648 -0.448 25800
6901 1 14 . 1 1 73 73 GLY C C 73 174.100 174.100 174.477 -0.377 25800
6902 1 14 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.223 0.377 25800
6903 1 14 . 1 1 73 73 GLY H H 73 8.350 8.350 8.089 0.261 25800
6904 1 14 . 1 1 74 74 ASN N N 74 121.000 121.000 120.291 0.709 25800
6905 1 14 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.659 0.101 25800
6906 1 14 . 1 1 74 74 ASN C C 74 174.000 174.000 173.717 0.283 25800
6907 1 14 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.119 -2.219 25800
6908 1 14 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.096 0.604 25800
6909 1 14 . 1 1 74 74 ASN H H 74 7.740 7.740 8.283 -0.543 25800
6910 1 14 . 1 1 75 75 LYS N N 75 121.400 121.400 119.449 1.951 25800
6911 1 14 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.838 -0.368 25800
6912 1 14 . 1 1 75 75 LYS C C 75 176.900 176.900 175.064 1.836 25800
6913 1 14 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.544 -0.244 25800
6914 1 14 . 1 1 75 75 LYS CB C 75 31.900 31.900 34.743 -2.843 25800
6915 1 14 . 1 1 75 75 LYS H H 75 8.380 8.380 8.221 0.159 25800
6916 1 14 . 1 1 76 76 LEU N N 76 127.400 127.400 123.331 4.069 25800
6917 1 14 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.654 -0.224 25800
6918 1 14 . 1 1 76 76 LEU C C 76 177.600 177.600 174.207 3.393 25800
6919 1 14 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.023 0.277 25800
6920 1 14 . 1 1 76 76 LEU CB C 76 43.100 43.100 46.526 -3.426 25800
6921 1 14 . 1 1 76 76 LEU H H 76 8.950 8.950 8.756 0.194 25800
6922 1 14 . 1 1 77 77 ARG N N 77 121.800 121.800 126.227 -4.427 25800
6923 1 14 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.725 0.175 25800
6924 1 14 . 1 1 77 77 ARG C C 77 174.700 174.700 174.687 0.013 25800
6925 1 14 . 1 1 77 77 ARG CA C 77 54.000 54.000 54.566 -0.566 25800
6926 1 14 . 1 1 77 77 ARG CB C 77 32.300 32.300 31.472 0.828 25800
6927 1 14 . 1 1 77 77 ARG H H 77 7.530 7.530 8.601 -1.071 25800
6928 1 14 . 1 1 78 78 VAL N N 78 127.000 127.000 125.909 1.091 25800
6929 1 14 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.144 1.136 25800
6930 1 14 . 1 1 78 78 VAL C C 78 174.200 174.200 175.859 -1.659 25800
6931 1 14 . 1 1 78 78 VAL CA C 78 61.200 61.200 63.908 -2.708 25800
6932 1 14 . 1 1 78 78 VAL CB C 78 33.400 33.400 31.896 1.504 25800
6933 1 14 . 1 1 78 78 VAL H H 78 9.660 9.660 8.531 1.129 25800
6934 1 14 . 1 1 79 79 GLU N N 79 121.900 121.900 128.689 -6.789 25800
6935 1 14 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.608 0.102 25800
6936 1 14 . 1 1 79 79 GLU C C 79 174.600 174.600 173.820 0.780 25800
6937 1 14 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.521 -1.621 25800
6938 1 14 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.393 0.007 25800
6939 1 14 . 1 1 79 79 GLU H H 79 8.980 8.980 8.680 0.300 25800
6940 1 14 . 1 1 80 80 VAL N N 80 121.300 121.300 123.413 -2.113 25800
6941 1 14 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.431 -0.061 25800
6942 1 14 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.310 2.689 25800
6943 1 14 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.648 -1.548 25800
6944 1 14 . 1 1 80 80 VAL H H 80 8.410 8.410 8.482 -0.072 25800
6945 1 14 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.676 -0.416 25800
6946 1 14 . 1 1 81 81 PRO C C 81 176.100 176.100 176.167 -0.067 25800
6947 1 14 . 1 1 81 81 PRO CA C 81 63.100 63.100 63.014 0.086 25800
6948 1 14 . 1 1 81 81 PRO CB C 81 32.100 32.100 29.591 2.509 25800
6949 1 14 . 1 1 82 82 PHE N N 82 122.200 122.200 121.048 1.152 25800
6950 1 14 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.526 -0.236 25800
6951 1 14 . 1 1 82 82 PHE C C 82 175.300 175.300 176.053 -0.753 25800
6952 1 14 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.813 2.287 25800
6953 1 14 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.979 0.421 25800
6954 1 14 . 1 1 82 82 PHE H H 82 8.150 8.150 8.158 -0.008 25800
6955 1 14 . 1 1 83 83 ASN N N 83 120.800 120.800 114.955 5.845 25800
6956 1 14 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.444 -0.004 25800
6957 1 14 . 1 1 83 83 ASN C C 83 174.100 174.100 174.859 -0.759 25800
6958 1 14 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.414 -0.714 25800
6959 1 14 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.064 0.636 25800
6960 1 14 . 1 1 83 83 ASN H H 83 8.110 8.110 8.388 -0.278 25800
6961 1 14 . 1 1 84 84 ALA N N 84 123.700 123.700 120.583 3.117 25800
6962 1 14 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.103 -0.023 25800
6963 1 14 . 1 1 84 84 ALA C C 84 177.100 177.100 176.570 0.530 25800
6964 1 14 . 1 1 84 84 ALA CA C 84 52.400 52.400 53.024 -0.624 25800
6965 1 14 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.372 -0.272 25800
6966 1 14 . 1 1 84 84 ALA H H 84 8.020 8.020 8.288 -0.268 25800
6967 1 14 . 1 1 85 85 ARG N N 85 120.200 120.200 121.956 -1.756 25800
6968 1 14 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.556 -0.406 25800
6969 1 14 . 1 1 85 85 ARG C C 85 175.200 175.200 175.480 -0.280 25800
6970 1 14 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.340 0.660 25800
6971 1 14 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.256 0.544 25800
6972 1 14 . 1 1 85 85 ARG H H 85 8.040 8.040 8.519 -0.479 25800
6973 1 15 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.784 -0.194 25800
6974 1 15 . 1 1 0 0 HIS C C 0 174.000 174.000 173.979 0.021 25800
6975 1 15 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.001 -0.701 25800
6976 1 15 . 1 1 0 0 HIS CB C 0 29.300 29.300 31.529 -2.229 25800
6977 1 15 . 1 1 1 1 MET N N 1 122.400 122.400 123.731 -1.331 25800
6978 1 15 . 1 1 1 1 MET HA H 1 4.340 4.340 4.424 -0.084 25800
6979 1 15 . 1 1 1 1 MET C C 1 175.600 175.600 175.115 0.485 25800
6980 1 15 . 1 1 1 1 MET CA C 1 55.600 55.600 54.355 1.244 25800
6981 1 15 . 1 1 1 1 MET CB C 1 32.800 32.800 34.279 -1.479 25800
6982 1 15 . 1 1 1 1 MET H H 1 8.310 8.310 7.910 0.400 25800
6983 1 15 . 1 1 2 2 VAL N N 2 123.200 123.200 122.767 0.433 25800
6984 1 15 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.003 -0.043 25800
6985 1 15 . 1 1 2 2 VAL C C 2 175.600 175.600 175.849 -0.249 25800
6986 1 15 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.677 -0.377 25800
6987 1 15 . 1 1 2 2 VAL CB C 2 32.300 32.300 33.024 -0.724 25800
6988 1 15 . 1 1 2 2 VAL H H 2 8.180 8.180 8.259 -0.079 25800
6989 1 15 . 1 1 3 3 ILE N N 3 126.200 126.200 129.483 -3.283 25800
6990 1 15 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.058 -0.008 25800
6991 1 15 . 1 1 3 3 ILE C C 3 175.800 175.800 175.718 0.082 25800
6992 1 15 . 1 1 3 3 ILE CA C 3 60.700 60.700 62.394 -1.694 25800
6993 1 15 . 1 1 3 3 ILE CB C 3 38.300 38.300 37.151 1.149 25800
6994 1 15 . 1 1 3 3 ILE H H 3 8.230 8.230 8.481 -0.251 25800
6995 1 15 . 1 1 4 4 ARG N N 4 126.100 126.100 127.267 -1.167 25800
6996 1 15 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.480 -0.300 25800
6997 1 15 . 1 1 4 4 ARG C C 4 175.900 175.900 175.111 0.789 25800
6998 1 15 . 1 1 4 4 ARG CA C 4 56.000 56.000 55.545 0.455 25800
6999 1 15 . 1 1 4 4 ARG CB C 4 30.700 30.700 32.114 -1.413 25800
7000 1 15 . 1 1 4 4 ARG H H 4 8.360 8.360 8.559 -0.199 25800
7001 1 15 . 1 1 5 5 GLU N N 5 122.200 122.200 121.716 0.484 25800
7002 1 15 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.025 0.115 25800
7003 1 15 . 1 1 5 5 GLU C C 5 176.100 176.100 175.470 0.630 25800
7004 1 15 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.237 -0.637 25800
7005 1 15 . 1 1 5 5 GLU CB C 5 30.300 30.300 30.103 0.197 25800
7006 1 15 . 1 1 5 5 GLU H H 5 8.400 8.400 8.699 -0.299 25800
7007 1 15 . 1 1 6 6 SER N N 6 116.200 116.200 115.269 0.931 25800
7008 1 15 . 1 1 6 6 SER HA H 6 4.350 4.350 4.393 -0.043 25800
7009 1 15 . 1 1 6 6 SER C C 6 174.300 174.300 174.782 -0.482 25800
7010 1 15 . 1 1 6 6 SER CA C 6 58.200 58.200 58.094 0.106 25800
7011 1 15 . 1 1 6 6 SER CB C 6 63.800 63.800 64.091 -0.291 25800
7012 1 15 . 1 1 6 6 SER H H 6 8.270 8.270 8.175 0.095 25800
7013 1 15 . 1 1 7 7 VAL N N 7 119.800 119.800 118.999 0.801 25800
7014 1 15 . 1 1 7 7 VAL HA H 7 4.300 4.300 3.954 0.346 25800
7015 1 15 . 1 1 7 7 VAL C C 7 175.500 175.500 175.320 0.180 25800
7016 1 15 . 1 1 7 7 VAL CA C 7 61.700 61.700 63.071 -1.371 25800
7017 1 15 . 1 1 7 7 VAL CB C 7 32.800 32.800 30.241 2.559 25800
7018 1 15 . 1 1 7 7 VAL H H 7 7.840 7.840 8.277 -0.437 25800
7019 1 15 . 1 1 8 8 SER N N 8 117.800 117.800 116.382 1.418 25800
7020 1 15 . 1 1 8 8 SER HA H 8 4.240 4.240 4.336 -0.096 25800
7021 1 15 . 1 1 8 8 SER C C 8 172.500 172.500 173.681 -1.181 25800
7022 1 15 . 1 1 8 8 SER CA C 8 58.500 58.500 60.017 -1.517 25800
7023 1 15 . 1 1 8 8 SER CB C 8 63.600 63.600 63.830 -0.230 25800
7024 1 15 . 1 1 8 8 SER H H 8 8.530 8.530 8.044 0.486 25800
7025 1 15 . 1 1 9 9 ARG N N 9 123.000 123.000 124.663 -1.663 25800
7026 1 15 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.266 0.234 25800
7027 1 15 . 1 1 9 9 ARG C C 9 175.000 175.000 175.019 -0.019 25800
7028 1 15 . 1 1 9 9 ARG CA C 9 54.300 54.300 55.354 -1.054 25800
7029 1 15 . 1 1 9 9 ARG CB C 9 33.400 33.400 34.070 -0.670 25800
7030 1 15 . 1 1 9 9 ARG H H 9 7.350 7.350 8.576 -1.226 25800
7031 1 15 . 1 1 10 10 ILE N N 10 114.000 114.000 124.724 -10.724 25800
7032 1 15 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.093 0.727 25800
7033 1 15 . 1 1 10 10 ILE C C 10 173.000 173.000 174.112 -1.112 25800
7034 1 15 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.288 -1.888 25800
7035 1 15 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.650 1.250 25800
7036 1 15 . 1 1 10 10 ILE H H 10 8.830 8.830 8.840 -0.010 25800
7037 1 15 . 1 1 11 11 TYR N N 11 123.400 123.400 126.953 -3.553 25800
7038 1 15 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.231 -0.301 25800
7039 1 15 . 1 1 11 11 TYR C C 11 173.000 173.000 173.295 -0.295 25800
7040 1 15 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.921 0.079 25800
7041 1 15 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.443 -1.543 25800
7042 1 15 . 1 1 11 11 TYR H H 11 8.690 8.690 7.985 0.705 25800
7043 1 15 . 1 1 12 12 VAL N N 12 126.300 126.300 126.227 0.073 25800
7044 1 15 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.760 -0.200 25800
7045 1 15 . 1 1 12 12 VAL C C 12 174.100 174.100 173.121 0.979 25800
7046 1 15 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.055 0.145 25800
7047 1 15 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.953 -2.553 25800
7048 1 15 . 1 1 12 12 VAL H H 12 8.370 8.370 7.885 0.485 25800
7049 1 15 . 1 1 13 13 GLY N N 13 113.000 113.000 113.879 -0.879 25800
7050 1 15 . 1 1 13 13 GLY C C 13 173.100 173.100 173.036 0.064 25800
7051 1 15 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.662 -0.362 25800
7052 1 15 . 1 1 13 13 GLY H H 13 9.350 9.350 9.088 0.262 25800
7053 1 15 . 1 1 14 14 ASN N N 14 113.900 113.900 116.964 -3.064 25800
7054 1 15 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.045 0.235 25800
7055 1 15 . 1 1 14 14 ASN C C 14 175.800 175.800 175.118 0.682 25800
7056 1 15 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.175 -0.575 25800
7057 1 15 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.910 0.790 25800
7058 1 15 . 1 1 14 14 ASN H H 14 8.800 8.800 7.913 0.887 25800
7059 1 15 . 1 1 15 15 LEU N N 15 115.800 115.800 117.298 -1.498 25800
7060 1 15 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.400 0.590 25800
7061 1 15 . 1 1 15 15 LEU CA C 15 55.600 55.600 54.315 1.286 25800
7062 1 15 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.084 0.516 25800
7063 1 15 . 1 1 15 15 LEU H H 15 7.150 7.150 7.345 -0.195 25800
7064 1 15 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.506 -0.436 25800
7065 1 15 . 1 1 16 16 PRO C C 16 171.500 171.500 177.048 -5.548 25800
7066 1 15 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.965 -0.465 25800
7067 1 15 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.952 0.048 25800
7068 1 15 . 1 1 17 17 SER N N 17 115.200 115.200 116.573 -1.373 25800
7069 1 15 . 1 1 17 17 SER HA H 17 4.300 4.300 4.104 0.196 25800
7070 1 15 . 1 1 17 17 SER C C 17 174.200 174.200 173.886 0.314 25800
7071 1 15 . 1 1 17 17 SER CA C 17 58.200 58.200 59.508 -1.308 25800
7072 1 15 . 1 1 17 17 SER CB C 17 63.900 63.900 63.191 0.710 25800
7073 1 15 . 1 1 17 17 SER H H 17 8.470 8.470 8.454 0.016 25800
7074 1 15 . 1 1 18 18 HIS N N 18 120.800 120.800 120.918 -0.118 25800
7075 1 15 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.789 -0.239 25800
7076 1 15 . 1 1 18 18 HIS C C 18 175.100 175.100 173.582 1.518 25800
7077 1 15 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.517 -0.017 25800
7078 1 15 . 1 1 18 18 HIS CB C 18 29.300 29.300 30.929 -1.629 25800
7079 1 15 . 1 1 18 18 HIS H H 18 8.540 8.540 8.274 0.266 25800
7080 1 15 . 1 1 19 19 VAL N N 19 115.700 115.700 122.757 -7.057 25800
7081 1 15 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.283 -0.023 25800
7082 1 15 . 1 1 19 19 VAL C C 19 174.000 174.000 175.206 -1.206 25800
7083 1 15 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.920 -0.021 25800
7084 1 15 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.259 0.341 25800
7085 1 15 . 1 1 19 19 VAL H H 19 6.650 6.650 7.895 -1.245 25800
7086 1 15 . 1 1 20 20 SER N N 20 118.800 118.800 122.368 -3.568 25800
7087 1 15 . 1 1 20 20 SER HA H 20 4.710 4.710 4.677 0.033 25800
7088 1 15 . 1 1 20 20 SER C C 20 175.900 175.900 176.039 -0.139 25800
7089 1 15 . 1 1 20 20 SER CA C 20 55.800 55.800 57.875 -2.075 25800
7090 1 15 . 1 1 20 20 SER CB C 20 66.600 66.600 64.629 1.972 25800
7091 1 15 . 1 1 20 20 SER H H 20 8.930 8.930 8.401 0.529 25800
7092 1 15 . 1 1 21 21 SER N N 21 117.100 117.100 121.821 -4.721 25800
7093 1 15 . 1 1 21 21 SER HA H 21 3.880 3.880 4.152 -0.272 25800
7094 1 15 . 1 1 21 21 SER C C 21 176.200 176.200 176.757 -0.557 25800
7095 1 15 . 1 1 21 21 SER CA C 21 62.300 62.300 61.094 1.206 25800
7096 1 15 . 1 1 21 21 SER CB C 21 66.800 66.800 63.269 3.531 25800
7097 1 15 . 1 1 21 21 SER H H 21 9.080 9.080 9.017 0.063 25800
7098 1 15 . 1 1 22 22 ARG N N 22 121.200 121.200 121.829 -0.629 25800
7099 1 15 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.149 -0.159 25800
7100 1 15 . 1 1 22 22 ARG C C 22 177.900 177.900 177.956 -0.056 25800
7101 1 15 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.007 -0.307 25800
7102 1 15 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.753 -0.153 25800
7103 1 15 . 1 1 22 22 ARG H H 22 7.940 7.940 8.545 -0.605 25800
7104 1 15 . 1 1 23 23 ASP N N 23 118.800 118.800 119.634 -0.834 25800
7105 1 15 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.479 -0.089 25800
7106 1 15 . 1 1 23 23 ASP C C 23 179.200 179.200 178.724 0.476 25800
7107 1 15 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.319 -0.019 25800
7108 1 15 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.438 0.562 25800
7109 1 15 . 1 1 23 23 ASP H H 23 7.480 7.480 7.768 -0.288 25800
7110 1 15 . 1 1 24 24 VAL N N 24 119.500 119.500 119.037 0.463 25800
7111 1 15 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.719 -0.349 25800
7112 1 15 . 1 1 24 24 VAL C C 24 177.500 177.500 177.921 -0.421 25800
7113 1 15 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.311 0.590 25800
7114 1 15 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.479 -0.079 25800
7115 1 15 . 1 1 24 24 VAL H H 24 7.450 7.450 7.537 -0.087 25800
7116 1 15 . 1 1 25 25 GLU N N 25 121.400 121.400 121.084 0.316 25800
7117 1 15 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.026 -0.456 25800
7118 1 15 . 1 1 25 25 GLU C C 25 178.400 178.400 178.661 -0.261 25800
7119 1 15 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.132 0.468 25800
7120 1 15 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.441 0.159 25800
7121 1 15 . 1 1 25 25 GLU H H 25 8.580 8.580 8.644 -0.064 25800
7122 1 15 . 1 1 26 26 ASN N N 26 114.800 114.800 117.462 -2.662 25800
7123 1 15 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.508 -0.188 25800
7124 1 15 . 1 1 26 26 ASN C C 26 177.400 177.400 178.018 -0.618 25800
7125 1 15 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.663 0.237 25800
7126 1 15 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.619 -0.719 25800
7127 1 15 . 1 1 26 26 ASN H H 26 8.180 8.180 8.211 -0.031 25800
7128 1 15 . 1 1 27 27 GLU N N 27 118.900 118.900 120.624 -1.724 25800
7129 1 15 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.138 0.002 25800
7130 1 15 . 1 1 27 27 GLU C C 27 176.400 176.400 179.199 -2.799 25800
7131 1 15 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.872 -1.472 25800
7132 1 15 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.448 -0.048 25800
7133 1 15 . 1 1 27 27 GLU H H 27 7.340 7.340 7.785 -0.445 25800
7134 1 15 . 1 1 28 28 PHE N N 28 114.100 114.100 119.190 -5.090 25800
7135 1 15 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.736 -0.186 25800
7136 1 15 . 1 1 28 28 PHE C C 28 176.300 176.300 177.989 -1.689 25800
7137 1 15 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.645 -0.645 25800
7138 1 15 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.231 1.569 25800
7139 1 15 . 1 1 28 28 PHE H H 28 7.660 7.660 8.375 -0.715 25800
7140 1 15 . 1 1 29 29 ARG N N 29 121.700 121.700 119.817 1.883 25800
7141 1 15 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.479 -0.069 25800
7142 1 15 . 1 1 29 29 ARG C C 29 177.100 177.100 178.171 -1.071 25800
7143 1 15 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.052 0.148 25800
7144 1 15 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.152 0.148 25800
7145 1 15 . 1 1 29 29 ARG H H 29 8.120 8.120 8.641 -0.521 25800
7146 1 15 . 1 1 30 30 LYS N N 30 117.200 117.200 119.936 -2.736 25800
7147 1 15 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.180 -0.350 25800
7148 1 15 . 1 1 30 30 LYS C C 30 177.100 177.100 177.334 -0.234 25800
7149 1 15 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.497 -0.697 25800
7150 1 15 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.463 -0.363 25800
7151 1 15 . 1 1 30 30 LYS H H 30 7.630 7.630 8.022 -0.392 25800
7152 1 15 . 1 1 31 31 TYR N N 31 117.100 117.100 117.997 -0.897 25800
7153 1 15 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.661 -0.511 25800
7154 1 15 . 1 1 31 31 TYR C C 31 174.400 174.400 175.514 -1.114 25800
7155 1 15 . 1 1 31 31 TYR CA C 31 59.900 59.900 58.071 1.829 25800
7156 1 15 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.440 -1.540 25800
7157 1 15 . 1 1 31 31 TYR H H 31 7.410 7.410 8.085 -0.675 25800
7158 1 15 . 1 1 32 32 GLY N N 32 104.100 104.100 105.937 -1.837 25800
7159 1 15 . 1 1 32 32 GLY C C 32 177.000 177.000 172.306 4.694 25800
7160 1 15 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.560 -0.060 25800
7161 1 15 . 1 1 32 32 GLY H H 32 7.240 7.240 7.578 -0.338 25800
7162 1 15 . 1 1 33 33 ASN N N 33 115.300 115.300 119.917 -4.617 25800
7163 1 15 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.706 -0.266 25800
7164 1 15 . 1 1 33 33 ASN C C 33 175.500 175.500 174.110 1.390 25800
7165 1 15 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.327 0.973 25800
7166 1 15 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.889 -0.489 25800
7167 1 15 . 1 1 33 33 ASN H H 33 8.460 8.460 8.673 -0.213 25800
7168 1 15 . 1 1 34 34 ILE N N 34 126.700 126.700 125.519 1.181 25800
7169 1 15 . 1 1 34 34 ILE HA H 34 3.790 3.790 3.759 0.031 25800
7170 1 15 . 1 1 34 34 ILE C C 34 175.600 175.600 175.066 0.534 25800
7171 1 15 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.353 0.947 25800
7172 1 15 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.116 1.884 25800
7173 1 15 . 1 1 34 34 ILE H H 34 8.050 8.050 8.216 -0.166 25800
7174 1 15 . 1 1 35 35 LEU N N 35 127.400 127.400 129.017 -1.617 25800
7175 1 15 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.336 -0.176 25800
7176 1 15 . 1 1 35 35 LEU C C 35 177.200 177.200 176.293 0.907 25800
7177 1 15 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.791 -0.291 25800
7178 1 15 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.947 -0.247 25800
7179 1 15 . 1 1 35 35 LEU H H 35 8.780 8.780 8.895 -0.115 25800
7180 1 15 . 1 1 36 36 LYS N N 36 117.000 117.000 117.511 -0.511 25800
7181 1 15 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.521 -0.281 25800
7182 1 15 . 1 1 36 36 LYS C C 36 173.600 173.600 173.868 -0.268 25800
7183 1 15 . 1 1 36 36 LYS CA C 36 55.900 55.900 56.243 -0.343 25800
7184 1 15 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.259 1.341 25800
7185 1 15 . 1 1 36 36 LYS H H 36 7.110 7.110 7.646 -0.536 25800
7186 1 15 . 1 1 37 37 CYS N N 37 125.400 125.400 126.109 -0.709 25800
7187 1 15 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.595 -0.895 25800
7188 1 15 . 1 1 37 37 CYS C C 37 171.600 171.600 172.778 -1.178 25800
7189 1 15 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.225 0.675 25800
7190 1 15 . 1 1 37 37 CYS CB C 37 27.100 27.100 30.014 -2.914 25800
7191 1 15 . 1 1 37 37 CYS H H 37 8.610 8.610 8.656 -0.046 25800
7192 1 15 . 1 1 38 38 ASP N N 38 128.200 128.200 127.004 1.196 25800
7193 1 15 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.953 -0.003 25800
7194 1 15 . 1 1 38 38 ASP C C 38 174.300 174.300 173.644 0.656 25800
7195 1 15 . 1 1 38 38 ASP CA C 38 53.200 53.200 54.060 -0.860 25800
7196 1 15 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.780 -1.480 25800
7197 1 15 . 1 1 38 38 ASP H H 38 8.290 8.290 8.692 -0.402 25800
7198 1 15 . 1 1 39 39 VAL N N 39 123.500 123.500 120.388 3.112 25800
7199 1 15 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.048 -0.748 25800
7200 1 15 . 1 1 39 39 VAL C C 39 175.000 175.000 174.284 0.716 25800
7201 1 15 . 1 1 39 39 VAL CA C 39 61.700 61.700 60.376 1.324 25800
7202 1 15 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.783 -1.683 25800
7203 1 15 . 1 1 39 39 VAL H H 39 8.380 8.380 8.515 -0.135 25800
7204 1 15 . 1 1 40 40 LYS N N 40 129.100 129.100 127.631 1.469 25800
7205 1 15 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.929 -0.610 25800
7206 1 15 . 1 1 40 40 LYS C C 40 173.700 173.700 174.355 -0.655 25800
7207 1 15 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.260 -0.360 25800
7208 1 15 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.822 -0.322 25800
7209 1 15 . 1 1 40 40 LYS H H 40 8.680 8.680 9.144 -0.464 25800
7210 1 15 . 1 1 41 41 LYS N N 41 117.300 117.300 120.797 -3.497 25800
7211 1 15 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.303 -0.323 25800
7212 1 15 . 1 1 41 41 LYS C C 41 177.800 177.800 175.414 2.386 25800
7213 1 15 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.729 -0.129 25800
7214 1 15 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.373 -0.373 25800
7215 1 15 . 1 1 41 41 LYS H H 41 7.900 7.900 8.383 -0.483 25800
7216 1 15 . 1 1 42 42 THR N N 42 113.200 113.200 115.301 -2.101 25800
7217 1 15 . 1 1 42 42 THR HA H 42 4.680 4.680 4.772 -0.092 25800
7218 1 15 . 1 1 42 42 THR C C 42 176.900 176.900 176.454 0.446 25800
7219 1 15 . 1 1 42 42 THR CA C 42 60.200 60.200 60.196 0.004 25800
7220 1 15 . 1 1 42 42 THR CB C 42 71.600 71.600 70.027 1.573 25800
7221 1 15 . 1 1 42 42 THR H H 42 8.730 8.730 8.486 0.244 25800
7222 1 15 . 1 1 43 43 VAL N N 43 120.000 120.000 124.023 -4.023 25800
7223 1 15 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.039 -0.119 25800
7224 1 15 . 1 1 43 43 VAL C C 43 177.000 177.000 176.548 0.452 25800
7225 1 15 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.453 0.247 25800
7226 1 15 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.750 0.050 25800
7227 1 15 . 1 1 43 43 VAL H H 43 8.730 8.730 8.547 0.183 25800
7228 1 15 . 1 1 44 44 SER N N 44 113.400 113.400 115.568 -2.168 25800
7229 1 15 . 1 1 44 44 SER HA H 44 4.360 4.360 4.364 -0.004 25800
7230 1 15 . 1 1 44 44 SER C C 44 174.800 174.800 175.478 -0.678 25800
7231 1 15 . 1 1 44 44 SER CA C 44 58.400 58.400 58.604 -0.204 25800
7232 1 15 . 1 1 44 44 SER CB C 44 63.500 63.500 63.493 0.007 25800
7233 1 15 . 1 1 44 44 SER H H 44 7.760 7.760 7.958 -0.198 25800
7234 1 15 . 1 1 45 45 GLY N N 45 110.200 110.200 108.601 1.599 25800
7235 1 15 . 1 1 45 45 GLY C C 45 173.500 173.500 174.250 -0.750 25800
7236 1 15 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.716 0.584 25800
7237 1 15 . 1 1 45 45 GLY H H 45 7.820 7.820 7.864 -0.044 25800
7238 1 15 . 1 1 46 46 ALA N N 46 123.900 123.900 121.900 2.000 25800
7239 1 15 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.277 0.113 25800
7240 1 15 . 1 1 46 46 ALA C C 46 176.100 176.100 175.361 0.739 25800
7241 1 15 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.730 0.170 25800
7242 1 15 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.135 -0.335 25800
7243 1 15 . 1 1 46 46 ALA H H 46 7.440 7.440 7.849 -0.409 25800
7244 1 15 . 1 1 47 47 ALA N N 47 123.100 123.100 122.390 0.710 25800
7245 1 15 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.132 0.068 25800
7246 1 15 . 1 1 47 47 ALA C C 47 176.100 176.100 175.128 0.972 25800
7247 1 15 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.093 0.807 25800
7248 1 15 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.445 -0.545 25800
7249 1 15 . 1 1 47 47 ALA H H 47 8.350 8.350 7.870 0.480 25800
7250 1 15 . 1 1 48 48 PHE N N 48 118.700 118.700 118.071 0.629 25800
7251 1 15 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.405 -0.375 25800
7252 1 15 . 1 1 48 48 PHE C C 48 171.600 171.600 174.045 -2.445 25800
7253 1 15 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.374 -0.674 25800
7254 1 15 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.252 -2.052 25800
7255 1 15 . 1 1 48 48 PHE H H 48 8.550 8.550 8.951 -0.401 25800
7256 1 15 . 1 1 49 49 ALA N N 49 120.400 120.400 124.414 -4.014 25800
7257 1 15 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.394 -0.064 25800
7258 1 15 . 1 1 49 49 ALA C C 49 175.500 175.500 175.552 -0.052 25800
7259 1 15 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.234 -0.935 25800
7260 1 15 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.917 1.783 25800
7261 1 15 . 1 1 49 49 ALA H H 49 9.240 9.240 9.097 0.143 25800
7262 1 15 . 1 1 50 50 PHE N N 50 115.000 115.000 121.668 -6.668 25800
7263 1 15 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.544 0.056 25800
7264 1 15 . 1 1 50 50 PHE C C 50 176.000 176.000 174.319 1.681 25800
7265 1 15 . 1 1 50 50 PHE CA C 50 56.500 56.500 55.636 0.864 25800
7266 1 15 . 1 1 50 50 PHE CB C 50 42.200 42.200 42.773 -0.573 25800
7267 1 15 . 1 1 50 50 PHE H H 50 7.920 7.920 9.223 -1.303 25800
7268 1 15 . 1 1 51 51 ILE N N 51 123.000 123.000 123.263 -0.263 25800
7269 1 15 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.866 -0.416 25800
7270 1 15 . 1 1 51 51 ILE C C 51 173.700 173.700 174.336 -0.636 25800
7271 1 15 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.609 -0.409 25800
7272 1 15 . 1 1 51 51 ILE CB C 51 40.700 40.700 40.897 -0.196 25800
7273 1 15 . 1 1 51 51 ILE H H 51 8.490 8.490 8.856 -0.366 25800
7274 1 15 . 1 1 52 52 GLU N N 52 126.600 126.600 127.150 -0.550 25800
7275 1 15 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.304 -0.534 25800
7276 1 15 . 1 1 52 52 GLU C C 52 175.300 175.300 174.853 0.447 25800
7277 1 15 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.757 -0.057 25800
7278 1 15 . 1 1 52 52 GLU CB C 52 31.500 31.500 33.377 -1.877 25800
7279 1 15 . 1 1 52 52 GLU H H 52 8.610 8.610 9.130 -0.520 25800
7280 1 15 . 1 1 53 53 PHE N N 53 126.100 126.100 124.013 2.087 25800
7281 1 15 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.000 -0.200 25800
7282 1 15 . 1 1 53 53 PHE C C 53 175.400 175.400 174.726 0.674 25800
7283 1 15 . 1 1 53 53 PHE CA C 53 58.200 58.200 57.435 0.765 25800
7284 1 15 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.500 -2.600 25800
7285 1 15 . 1 1 53 53 PHE H H 53 8.800 8.800 9.339 -0.539 25800
7286 1 15 . 1 1 54 54 GLU N N 54 120.700 120.700 121.716 -1.016 25800
7287 1 15 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.219 -0.289 25800
7288 1 15 . 1 1 54 54 GLU C C 54 175.300 175.300 175.697 -0.397 25800
7289 1 15 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.605 1.495 25800
7290 1 15 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.546 0.254 25800
7291 1 15 . 1 1 54 54 GLU H H 54 8.160 8.160 8.703 -0.543 25800
7292 1 15 . 1 1 55 55 ASP N N 55 117.900 117.900 117.567 0.333 25800
7293 1 15 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.776 0.144 25800
7294 1 15 . 1 1 55 55 ASP C C 55 176.400 176.400 175.021 1.379 25800
7295 1 15 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.481 -1.081 25800
7296 1 15 . 1 1 55 55 ASP CB C 55 44.400 44.400 43.340 1.060 25800
7297 1 15 . 1 1 55 55 ASP H H 55 8.740 8.740 8.093 0.647 25800
7298 1 15 . 1 1 56 56 ALA N N 56 128.900 128.900 127.366 1.534 25800
7299 1 15 . 1 1 56 56 ALA HA H 56 3.830 3.830 2.907 0.923 25800
7300 1 15 . 1 1 56 56 ALA C C 56 179.800 179.800 178.061 1.739 25800
7301 1 15 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.289 -0.089 25800
7302 1 15 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.308 0.591 25800
7303 1 15 . 1 1 56 56 ALA H H 56 8.800 8.800 8.097 0.703 25800
7304 1 15 . 1 1 57 57 ARG N N 57 119.200 119.200 116.401 2.799 25800
7305 1 15 . 1 1 57 57 ARG HA H 57 3.890 3.890 3.967 -0.077 25800
7306 1 15 . 1 1 57 57 ARG C C 57 178.000 178.000 177.082 0.918 25800
7307 1 15 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.323 0.577 25800
7308 1 15 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.845 0.455 25800
7309 1 15 . 1 1 57 57 ARG H H 57 8.950 8.950 8.311 0.639 25800
7310 1 15 . 1 1 58 58 ASP N N 58 120.900 120.900 119.220 1.680 25800
7311 1 15 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.537 -0.447 25800
7312 1 15 . 1 1 58 58 ASP C C 58 176.700 176.700 178.031 -1.331 25800
7313 1 15 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.717 -0.217 25800
7314 1 15 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.523 -0.623 25800
7315 1 15 . 1 1 58 58 ASP H H 58 7.020 7.020 8.131 -1.111 25800
7316 1 15 . 1 1 59 59 ALA N N 59 119.700 119.700 122.105 -2.405 25800
7317 1 15 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.890 -0.810 25800
7318 1 15 . 1 1 59 59 ALA C C 59 178.100 178.100 178.646 -0.546 25800
7319 1 15 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.101 0.199 25800
7320 1 15 . 1 1 59 59 ALA CB C 59 18.400 18.400 17.717 0.683 25800
7321 1 15 . 1 1 59 59 ALA H H 59 6.440 6.440 7.186 -0.746 25800
7322 1 15 . 1 1 60 60 ALA N N 60 117.600 117.600 120.780 -3.180 25800
7323 1 15 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.072 -0.242 25800
7324 1 15 . 1 1 60 60 ALA C C 60 180.900 180.900 178.725 2.175 25800
7325 1 15 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.135 -0.235 25800
7326 1 15 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.330 -0.630 25800
7327 1 15 . 1 1 60 60 ALA H H 60 7.330 7.330 8.160 -0.830 25800
7328 1 15 . 1 1 61 61 ASP N N 61 120.100 120.100 118.442 1.658 25800
7329 1 15 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.436 -0.226 25800
7330 1 15 . 1 1 61 61 ASP C C 61 176.700 176.700 177.267 -0.567 25800
7331 1 15 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.670 0.430 25800
7332 1 15 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.404 -0.304 25800
7333 1 15 . 1 1 61 61 ASP H H 61 7.590 7.590 7.891 -0.301 25800
7334 1 15 . 1 1 62 62 ALA N N 62 122.200 122.200 121.193 1.007 25800
7335 1 15 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.824 -1.404 25800
7336 1 15 . 1 1 62 62 ALA C C 62 179.300 179.300 178.901 0.399 25800
7337 1 15 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.949 0.651 25800
7338 1 15 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.863 0.237 25800
7339 1 15 . 1 1 62 62 ALA H H 62 7.440 7.440 7.137 0.303 25800
7340 1 15 . 1 1 63 63 ILE N N 63 116.700 116.700 119.275 -2.575 25800
7341 1 15 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.775 -0.535 25800
7342 1 15 . 1 1 63 63 ILE C C 63 177.800 177.800 177.831 -0.031 25800
7343 1 15 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.700 1.900 25800
7344 1 15 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.659 1.241 25800
7345 1 15 . 1 1 63 63 ILE H H 63 7.540 7.540 7.894 -0.354 25800
7346 1 15 . 1 1 64 64 LYS N N 64 117.400 117.400 119.465 -2.065 25800
7347 1 15 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.398 -0.498 25800
7348 1 15 . 1 1 64 64 LYS C C 64 178.900 178.900 177.791 1.109 25800
7349 1 15 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.196 0.604 25800
7350 1 15 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.981 0.619 25800
7351 1 15 . 1 1 64 64 LYS H H 64 7.490 7.490 8.413 -0.923 25800
7352 1 15 . 1 1 65 65 GLU N N 65 113.800 113.800 118.869 -5.069 25800
7353 1 15 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.217 -0.057 25800
7354 1 15 . 1 1 65 65 GLU C C 65 178.300 178.300 177.704 0.596 25800
7355 1 15 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.639 0.660 25800
7356 1 15 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.902 0.798 25800
7357 1 15 . 1 1 65 65 GLU H H 65 7.960 7.960 7.833 0.127 25800
7358 1 15 . 1 1 66 66 LYS N N 66 114.700 114.700 118.211 -3.511 25800
7359 1 15 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.328 0.142 25800
7360 1 15 . 1 1 66 66 LYS C C 66 177.500 177.500 177.394 0.106 25800
7361 1 15 . 1 1 66 66 LYS CA C 66 54.400 54.400 56.461 -2.061 25800
7362 1 15 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.332 0.668 25800
7363 1 15 . 1 1 66 66 LYS H H 66 8.050 8.050 7.703 0.347 25800
7364 1 15 . 1 1 67 67 ASP N N 67 118.800 118.800 120.316 -1.516 25800
7365 1 15 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.552 -0.332 25800
7366 1 15 . 1 1 67 67 ASP C C 67 177.700 177.700 176.391 1.309 25800
7367 1 15 . 1 1 67 67 ASP CA C 67 58.400 58.400 55.538 2.862 25800
7368 1 15 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.159 0.241 25800
7369 1 15 . 1 1 67 67 ASP H H 67 7.620 7.620 8.019 -0.399 25800
7370 1 15 . 1 1 68 68 GLY N N 68 115.600 115.600 110.232 5.368 25800
7371 1 15 . 1 1 68 68 GLY C C 68 173.800 173.800 174.526 -0.726 25800
7372 1 15 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.453 1.447 25800
7373 1 15 . 1 1 68 68 GLY H H 68 8.470 8.470 8.633 -0.163 25800
7374 1 15 . 1 1 69 69 CYS N N 69 119.200 119.200 119.992 -0.792 25800
7375 1 15 . 1 1 69 69 CYS HA H 69 4.160 4.160 5.029 -0.869 25800
7376 1 15 . 1 1 69 69 CYS C C 69 172.600 172.600 173.791 -1.191 25800
7377 1 15 . 1 1 69 69 CYS CA C 69 58.000 58.000 58.022 -0.021 25800
7378 1 15 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.107 -0.407 25800
7379 1 15 . 1 1 69 69 CYS H H 69 7.890 7.890 8.117 -0.227 25800
7380 1 15 . 1 1 70 70 ASP N N 70 122.200 122.200 124.510 -2.310 25800
7381 1 15 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.396 0.434 25800
7382 1 15 . 1 1 70 70 ASP C C 70 176.400 176.400 174.054 2.346 25800
7383 1 15 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.456 1.244 25800
7384 1 15 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.073 -1.373 25800
7385 1 15 . 1 1 70 70 ASP H H 70 8.360 8.360 8.710 -0.350 25800
7386 1 15 . 1 1 71 71 PHE N N 71 127.600 127.600 119.661 7.939 25800
7387 1 15 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.229 -0.629 25800
7388 1 15 . 1 1 71 71 PHE C C 71 173.600 173.600 175.111 -1.511 25800
7389 1 15 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.910 -0.111 25800
7390 1 15 . 1 1 71 71 PHE CB C 71 40.700 40.700 40.687 0.013 25800
7391 1 15 . 1 1 71 71 PHE H H 71 9.390 9.390 7.645 1.745 25800
7392 1 15 . 1 1 72 72 GLU N N 72 123.900 123.900 119.128 4.772 25800
7393 1 15 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.173 -0.633 25800
7394 1 15 . 1 1 72 72 GLU C C 72 175.500 175.500 176.508 -1.008 25800
7395 1 15 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.118 -0.418 25800
7396 1 15 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.313 -1.013 25800
7397 1 15 . 1 1 72 72 GLU H H 72 8.940 8.940 9.432 -0.492 25800
7398 1 15 . 1 1 73 73 GLY N N 73 105.200 105.200 104.611 0.589 25800
7399 1 15 . 1 1 73 73 GLY C C 73 174.100 174.100 173.735 0.365 25800
7400 1 15 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.017 0.583 25800
7401 1 15 . 1 1 73 73 GLY H H 73 8.350 8.350 8.252 0.098 25800
7402 1 15 . 1 1 74 74 ASN N N 74 121.000 121.000 118.679 2.321 25800
7403 1 15 . 1 1 74 74 ASN HA H 74 4.760 4.760 5.014 -0.254 25800
7404 1 15 . 1 1 74 74 ASN C C 74 174.000 174.000 173.249 0.751 25800
7405 1 15 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.367 -1.467 25800
7406 1 15 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.932 -1.232 25800
7407 1 15 . 1 1 74 74 ASN H H 74 7.740 7.740 7.795 -0.055 25800
7408 1 15 . 1 1 75 75 LYS N N 75 121.400 121.400 121.234 0.166 25800
7409 1 15 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.597 -0.127 25800
7410 1 15 . 1 1 75 75 LYS C C 75 176.900 176.900 174.394 2.506 25800
7411 1 15 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.999 -0.700 25800
7412 1 15 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.983 -1.083 25800
7413 1 15 . 1 1 75 75 LYS H H 75 8.380 8.380 8.577 -0.197 25800
7414 1 15 . 1 1 76 76 LEU N N 76 127.400 127.400 123.838 3.562 25800
7415 1 15 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.597 -0.167 25800
7416 1 15 . 1 1 76 76 LEU C C 76 177.600 177.600 174.245 3.355 25800
7417 1 15 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.205 0.095 25800
7418 1 15 . 1 1 76 76 LEU CB C 76 43.100 43.100 44.573 -1.473 25800
7419 1 15 . 1 1 76 76 LEU H H 76 8.950 8.950 8.467 0.482 25800
7420 1 15 . 1 1 77 77 ARG N N 77 121.800 121.800 125.124 -3.324 25800
7421 1 15 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.913 -0.013 25800
7422 1 15 . 1 1 77 77 ARG C C 77 174.700 174.700 173.979 0.721 25800
7423 1 15 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.351 -1.351 25800
7424 1 15 . 1 1 77 77 ARG CB C 77 32.300 32.300 32.319 -0.019 25800
7425 1 15 . 1 1 77 77 ARG H H 77 7.530 7.530 8.890 -1.360 25800
7426 1 15 . 1 1 78 78 VAL N N 78 127.000 127.000 125.676 1.324 25800
7427 1 15 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.484 0.796 25800
7428 1 15 . 1 1 78 78 VAL C C 78 174.200 174.200 175.052 -0.852 25800
7429 1 15 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.364 -0.163 25800
7430 1 15 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.190 -0.790 25800
7431 1 15 . 1 1 78 78 VAL H H 78 9.660 9.660 8.693 0.967 25800
7432 1 15 . 1 1 79 79 GLU N N 79 121.900 121.900 127.888 -5.988 25800
7433 1 15 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.645 0.065 25800
7434 1 15 . 1 1 79 79 GLU C C 79 174.600 174.600 173.826 0.774 25800
7435 1 15 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.507 -1.607 25800
7436 1 15 . 1 1 79 79 GLU CB C 79 34.400 34.400 33.482 0.918 25800
7437 1 15 . 1 1 79 79 GLU H H 79 8.980 8.980 8.342 0.638 25800
7438 1 15 . 1 1 80 80 VAL N N 80 121.300 121.300 117.862 3.438 25800
7439 1 15 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.371 -0.001 25800
7440 1 15 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.090 2.910 25800
7441 1 15 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.757 -1.657 25800
7442 1 15 . 1 1 80 80 VAL H H 80 8.410 8.410 8.141 0.269 25800
7443 1 15 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.481 -0.221 25800
7444 1 15 . 1 1 81 81 PRO C C 81 176.100 176.100 177.498 -1.398 25800
7445 1 15 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.775 -1.675 25800
7446 1 15 . 1 1 81 81 PRO CB C 81 32.100 32.100 32.177 -0.077 25800
7447 1 15 . 1 1 82 82 PHE N N 82 122.200 122.200 114.362 7.838 25800
7448 1 15 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.567 -0.277 25800
7449 1 15 . 1 1 82 82 PHE C C 82 175.300 175.300 175.603 -0.303 25800
7450 1 15 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.676 2.424 25800
7451 1 15 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.334 2.066 25800
7452 1 15 . 1 1 82 82 PHE H H 82 8.150 8.150 8.001 0.149 25800
7453 1 15 . 1 1 83 83 ASN N N 83 120.800 120.800 122.373 -1.573 25800
7454 1 15 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.627 -0.187 25800
7455 1 15 . 1 1 83 83 ASN C C 83 174.100 174.100 174.899 -0.799 25800
7456 1 15 . 1 1 83 83 ASN CA C 83 52.700 52.700 52.930 -0.230 25800
7457 1 15 . 1 1 83 83 ASN CB C 83 38.700 38.700 36.639 2.061 25800
7458 1 15 . 1 1 83 83 ASN H H 83 8.110 8.110 7.951 0.159 25800
7459 1 15 . 1 1 84 84 ALA N N 84 123.700 123.700 120.573 3.127 25800
7460 1 15 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.569 -0.489 25800
7461 1 15 . 1 1 84 84 ALA C C 84 177.100 177.100 178.108 -1.008 25800
7462 1 15 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.442 -0.042 25800
7463 1 15 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.106 -1.006 25800
7464 1 15 . 1 1 84 84 ALA H H 84 8.020 8.020 8.361 -0.341 25800
7465 1 15 . 1 1 85 85 ARG N N 85 120.200 120.200 120.443 -0.243 25800
7466 1 15 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.344 -0.194 25800
7467 1 15 . 1 1 85 85 ARG C C 85 175.200 175.200 175.730 -0.530 25800
7468 1 15 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.303 -0.303 25800
7469 1 15 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.297 0.503 25800
7470 1 15 . 1 1 85 85 ARG H H 85 8.040 8.040 8.119 -0.079 25800
7471 1 16 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.837 -0.247 25800
7472 1 16 . 1 1 0 0 HIS C C 0 174.000 174.000 174.323 -0.323 25800
7473 1 16 . 1 1 0 0 HIS CA C 0 55.300 55.300 55.647 -0.347 25800
7474 1 16 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.686 -1.386 25800
7475 1 16 . 1 1 1 1 MET N N 1 122.400 122.400 121.567 0.833 25800
7476 1 16 . 1 1 1 1 MET HA H 1 4.340 4.340 4.696 -0.356 25800
7477 1 16 . 1 1 1 1 MET C C 1 175.600 175.600 175.058 0.542 25800
7478 1 16 . 1 1 1 1 MET CA C 1 55.600 55.600 55.507 0.093 25800
7479 1 16 . 1 1 1 1 MET CB C 1 32.800 32.800 33.727 -0.927 25800
7480 1 16 . 1 1 1 1 MET H H 1 8.310 8.310 8.506 -0.196 25800
7481 1 16 . 1 1 2 2 VAL N N 2 123.200 123.200 121.503 1.697 25800
7482 1 16 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.468 -0.508 25800
7483 1 16 . 1 1 2 2 VAL C C 2 175.600 175.600 174.101 1.499 25800
7484 1 16 . 1 1 2 2 VAL CA C 2 62.300 62.300 61.912 0.388 25800
7485 1 16 . 1 1 2 2 VAL CB C 2 32.300 32.300 33.463 -1.163 25800
7486 1 16 . 1 1 2 2 VAL H H 2 8.180 8.180 8.265 -0.085 25800
7487 1 16 . 1 1 3 3 ILE N N 3 126.200 126.200 125.535 0.665 25800
7488 1 16 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.552 -0.502 25800
7489 1 16 . 1 1 3 3 ILE C C 3 175.800 175.800 175.578 0.222 25800
7490 1 16 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.277 0.423 25800
7491 1 16 . 1 1 3 3 ILE CB C 3 38.300 38.300 39.849 -1.549 25800
7492 1 16 . 1 1 3 3 ILE H H 3 8.230 8.230 8.310 -0.080 25800
7493 1 16 . 1 1 4 4 ARG N N 4 126.100 126.100 125.148 0.952 25800
7494 1 16 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.100 0.080 25800
7495 1 16 . 1 1 4 4 ARG C C 4 175.900 175.900 175.886 0.014 25800
7496 1 16 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.593 -0.593 25800
7497 1 16 . 1 1 4 4 ARG CB C 4 30.700 30.700 28.916 1.784 25800
7498 1 16 . 1 1 4 4 ARG H H 4 8.360 8.360 8.707 -0.347 25800
7499 1 16 . 1 1 5 5 GLU N N 5 122.200 122.200 118.232 3.968 25800
7500 1 16 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.087 0.053 25800
7501 1 16 . 1 1 5 5 GLU C C 5 176.100 176.100 174.523 1.577 25800
7502 1 16 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.096 -0.496 25800
7503 1 16 . 1 1 5 5 GLU CB C 5 30.300 30.300 30.374 -0.074 25800
7504 1 16 . 1 1 5 5 GLU H H 5 8.400 8.400 8.284 0.116 25800
7505 1 16 . 1 1 6 6 SER N N 6 116.200 116.200 115.228 0.972 25800
7506 1 16 . 1 1 6 6 SER HA H 6 4.350 4.350 4.743 -0.393 25800
7507 1 16 . 1 1 6 6 SER C C 6 174.300 174.300 172.676 1.624 25800
7508 1 16 . 1 1 6 6 SER CA C 6 58.200 58.200 57.728 0.472 25800
7509 1 16 . 1 1 6 6 SER CB C 6 63.800 63.800 64.893 -1.093 25800
7510 1 16 . 1 1 6 6 SER H H 6 8.270 8.270 8.184 0.086 25800
7511 1 16 . 1 1 7 7 VAL N N 7 119.800 119.800 120.958 -1.158 25800
7512 1 16 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.337 -0.037 25800
7513 1 16 . 1 1 7 7 VAL C C 7 175.500 175.500 174.434 1.066 25800
7514 1 16 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.956 -0.256 25800
7515 1 16 . 1 1 7 7 VAL CB C 7 32.800 32.800 35.301 -2.501 25800
7516 1 16 . 1 1 7 7 VAL H H 7 7.840 7.840 8.196 -0.356 25800
7517 1 16 . 1 1 8 8 SER N N 8 117.800 117.800 121.070 -3.270 25800
7518 1 16 . 1 1 8 8 SER HA H 8 4.240 4.240 4.702 -0.462 25800
7519 1 16 . 1 1 8 8 SER C C 8 172.500 172.500 173.416 -0.916 25800
7520 1 16 . 1 1 8 8 SER CA C 8 58.500 58.500 58.500 0.000 25800
7521 1 16 . 1 1 8 8 SER CB C 8 63.600 63.600 63.047 0.553 25800
7522 1 16 . 1 1 8 8 SER H H 8 8.530 8.530 8.723 -0.193 25800
7523 1 16 . 1 1 9 9 ARG N N 9 123.000 123.000 125.648 -2.648 25800
7524 1 16 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.352 0.148 25800
7525 1 16 . 1 1 9 9 ARG C C 9 175.000 175.000 174.854 0.146 25800
7526 1 16 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.687 -0.387 25800
7527 1 16 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.740 0.660 25800
7528 1 16 . 1 1 9 9 ARG H H 9 7.350 7.350 8.654 -1.304 25800
7529 1 16 . 1 1 10 10 ILE N N 10 114.000 114.000 122.315 -8.315 25800
7530 1 16 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.197 0.623 25800
7531 1 16 . 1 1 10 10 ILE C C 10 173.000 173.000 174.122 -1.122 25800
7532 1 16 . 1 1 10 10 ILE CA C 10 59.400 59.400 62.011 -2.611 25800
7533 1 16 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.589 1.311 25800
7534 1 16 . 1 1 10 10 ILE H H 10 8.830 8.830 8.898 -0.068 25800
7535 1 16 . 1 1 11 11 TYR N N 11 123.400 123.400 126.573 -3.173 25800
7536 1 16 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.128 -0.198 25800
7537 1 16 . 1 1 11 11 TYR C C 11 173.000 173.000 173.335 -0.335 25800
7538 1 16 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.828 0.172 25800
7539 1 16 . 1 1 11 11 TYR CB C 11 40.900 40.900 42.090 -1.190 25800
7540 1 16 . 1 1 11 11 TYR H H 11 8.690 8.690 8.149 0.541 25800
7541 1 16 . 1 1 12 12 VAL N N 12 126.300 126.300 125.488 0.812 25800
7542 1 16 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.293 0.267 25800
7543 1 16 . 1 1 12 12 VAL C C 12 174.100 174.100 172.833 1.267 25800
7544 1 16 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.958 0.242 25800
7545 1 16 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.980 -2.580 25800
7546 1 16 . 1 1 12 12 VAL H H 12 8.370 8.370 7.350 1.020 25800
7547 1 16 . 1 1 13 13 GLY N N 13 113.000 113.000 112.721 0.279 25800
7548 1 16 . 1 1 13 13 GLY C C 13 173.100 173.100 172.976 0.124 25800
7549 1 16 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.924 -0.624 25800
7550 1 16 . 1 1 13 13 GLY H H 13 9.350 9.350 8.729 0.621 25800
7551 1 16 . 1 1 14 14 ASN N N 14 113.900 113.900 116.836 -2.936 25800
7552 1 16 . 1 1 14 14 ASN HA H 14 4.280 4.280 3.993 0.287 25800
7553 1 16 . 1 1 14 14 ASN C C 14 175.800 175.800 175.315 0.485 25800
7554 1 16 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.113 -0.513 25800
7555 1 16 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.899 0.801 25800
7556 1 16 . 1 1 14 14 ASN H H 14 8.800 8.800 7.867 0.933 25800
7557 1 16 . 1 1 15 15 LEU N N 15 115.800 115.800 118.362 -2.562 25800
7558 1 16 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.367 0.623 25800
7559 1 16 . 1 1 15 15 LEU CA C 15 55.600 55.600 54.551 1.049 25800
7560 1 16 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.264 0.336 25800
7561 1 16 . 1 1 15 15 LEU H H 15 7.150 7.150 7.139 0.011 25800
7562 1 16 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.432 -0.362 25800
7563 1 16 . 1 1 16 16 PRO C C 16 171.500 171.500 176.812 -5.312 25800
7564 1 16 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.434 -0.933 25800
7565 1 16 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.415 0.585 25800
7566 1 16 . 1 1 17 17 SER N N 17 115.200 115.200 118.741 -3.541 25800
7567 1 16 . 1 1 17 17 SER HA H 17 4.300 4.300 4.024 0.276 25800
7568 1 16 . 1 1 17 17 SER C C 17 174.200 174.200 173.232 0.968 25800
7569 1 16 . 1 1 17 17 SER CA C 17 58.200 58.200 59.681 -1.481 25800
7570 1 16 . 1 1 17 17 SER CB C 17 63.900 63.900 62.975 0.925 25800
7571 1 16 . 1 1 17 17 SER H H 17 8.470 8.470 8.643 -0.173 25800
7572 1 16 . 1 1 18 18 HIS N N 18 120.800 120.800 119.784 1.016 25800
7573 1 16 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.899 -0.349 25800
7574 1 16 . 1 1 18 18 HIS C C 18 175.100 175.100 173.950 1.150 25800
7575 1 16 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.577 -0.077 25800
7576 1 16 . 1 1 18 18 HIS CB C 18 29.300 29.300 32.136 -2.836 25800
7577 1 16 . 1 1 18 18 HIS H H 18 8.540 8.540 8.362 0.178 25800
7578 1 16 . 1 1 19 19 VAL N N 19 115.700 115.700 121.229 -5.529 25800
7579 1 16 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.319 -0.059 25800
7580 1 16 . 1 1 19 19 VAL C C 19 174.000 174.000 174.455 -0.455 25800
7581 1 16 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.676 0.224 25800
7582 1 16 . 1 1 19 19 VAL CB C 19 32.600 32.600 35.301 -2.701 25800
7583 1 16 . 1 1 19 19 VAL H H 19 6.650 6.650 8.265 -1.615 25800
7584 1 16 . 1 1 20 20 SER N N 20 118.800 118.800 122.181 -3.381 25800
7585 1 16 . 1 1 20 20 SER HA H 20 4.710 4.710 4.943 -0.233 25800
7586 1 16 . 1 1 20 20 SER C C 20 175.900 175.900 176.191 -0.291 25800
7587 1 16 . 1 1 20 20 SER CA C 20 55.800 55.800 57.495 -1.695 25800
7588 1 16 . 1 1 20 20 SER CB C 20 66.600 66.600 64.675 1.925 25800
7589 1 16 . 1 1 20 20 SER H H 20 8.930 8.930 8.544 0.386 25800
7590 1 16 . 1 1 21 21 SER N N 21 117.100 117.100 120.003 -2.903 25800
7591 1 16 . 1 1 21 21 SER HA H 21 3.880 3.880 4.030 -0.150 25800
7592 1 16 . 1 1 21 21 SER C C 21 176.200 176.200 176.558 -0.358 25800
7593 1 16 . 1 1 21 21 SER CA C 21 62.300 62.300 61.551 0.749 25800
7594 1 16 . 1 1 21 21 SER CB C 21 66.800 66.800 62.797 4.003 25800
7595 1 16 . 1 1 21 21 SER H H 21 9.080 9.080 8.990 0.090 25800
7596 1 16 . 1 1 22 22 ARG N N 22 121.200 121.200 121.241 -0.041 25800
7597 1 16 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.108 -0.118 25800
7598 1 16 . 1 1 22 22 ARG C C 22 177.900 177.900 178.008 -0.108 25800
7599 1 16 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.092 -0.392 25800
7600 1 16 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.780 -0.180 25800
7601 1 16 . 1 1 22 22 ARG H H 22 7.940 7.940 8.643 -0.703 25800
7602 1 16 . 1 1 23 23 ASP N N 23 118.800 118.800 119.431 -0.631 25800
7603 1 16 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.523 -0.133 25800
7604 1 16 . 1 1 23 23 ASP C C 23 179.200 179.200 178.497 0.703 25800
7605 1 16 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.190 0.110 25800
7606 1 16 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.952 0.048 25800
7607 1 16 . 1 1 23 23 ASP H H 23 7.480 7.480 7.752 -0.272 25800
7608 1 16 . 1 1 24 24 VAL N N 24 119.500 119.500 117.700 1.800 25800
7609 1 16 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.958 -0.588 25800
7610 1 16 . 1 1 24 24 VAL C C 24 177.500 177.500 177.734 -0.234 25800
7611 1 16 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.212 0.688 25800
7612 1 16 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.482 -0.082 25800
7613 1 16 . 1 1 24 24 VAL H H 24 7.450 7.450 7.878 -0.428 25800
7614 1 16 . 1 1 25 25 GLU N N 25 121.400 121.400 120.890 0.510 25800
7615 1 16 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.903 -0.333 25800
7616 1 16 . 1 1 25 25 GLU C C 25 178.400 178.400 178.466 -0.066 25800
7617 1 16 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.189 0.411 25800
7618 1 16 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.496 0.104 25800
7619 1 16 . 1 1 25 25 GLU H H 25 8.580 8.580 8.632 -0.052 25800
7620 1 16 . 1 1 26 26 ASN N N 26 114.800 114.800 117.027 -2.227 25800
7621 1 16 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.502 -0.182 25800
7622 1 16 . 1 1 26 26 ASN C C 26 177.400 177.400 177.502 -0.102 25800
7623 1 16 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.793 0.107 25800
7624 1 16 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.766 -0.866 25800
7625 1 16 . 1 1 26 26 ASN H H 26 8.180 8.180 7.773 0.407 25800
7626 1 16 . 1 1 27 27 GLU N N 27 118.900 118.900 119.920 -1.020 25800
7627 1 16 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.142 -0.002 25800
7628 1 16 . 1 1 27 27 GLU C C 27 176.400 176.400 179.166 -2.766 25800
7629 1 16 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.756 -1.356 25800
7630 1 16 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.852 -0.452 25800
7631 1 16 . 1 1 27 27 GLU H H 27 7.340 7.340 8.210 -0.870 25800
7632 1 16 . 1 1 28 28 PHE N N 28 114.100 114.100 118.043 -3.943 25800
7633 1 16 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.799 -0.249 25800
7634 1 16 . 1 1 28 28 PHE C C 28 176.300 176.300 178.059 -1.759 25800
7635 1 16 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.692 -0.692 25800
7636 1 16 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.389 1.411 25800
7637 1 16 . 1 1 28 28 PHE H H 28 7.660 7.660 8.325 -0.665 25800
7638 1 16 . 1 1 29 29 ARG N N 29 121.700 121.700 119.422 2.278 25800
7639 1 16 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.386 0.024 25800
7640 1 16 . 1 1 29 29 ARG C C 29 177.100 177.100 177.374 -0.274 25800
7641 1 16 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.722 -0.522 25800
7642 1 16 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.536 -0.236 25800
7643 1 16 . 1 1 29 29 ARG H H 29 8.120 8.120 7.781 0.339 25800
7644 1 16 . 1 1 30 30 LYS N N 30 117.200 117.200 118.667 -1.467 25800
7645 1 16 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.131 -0.301 25800
7646 1 16 . 1 1 30 30 LYS C C 30 177.100 177.100 178.225 -1.125 25800
7647 1 16 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.828 -0.028 25800
7648 1 16 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.928 -0.828 25800
7649 1 16 . 1 1 30 30 LYS H H 30 7.630 7.630 7.962 -0.332 25800
7650 1 16 . 1 1 31 31 TYR N N 31 117.100 117.100 118.418 -1.318 25800
7651 1 16 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.468 -0.318 25800
7652 1 16 . 1 1 31 31 TYR C C 31 174.400 174.400 176.004 -1.604 25800
7653 1 16 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.611 0.289 25800
7654 1 16 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.663 -1.764 25800
7655 1 16 . 1 1 31 31 TYR H H 31 7.410 7.410 7.908 -0.498 25800
7656 1 16 . 1 1 32 32 GLY N N 32 104.100 104.100 105.022 -0.922 25800
7657 1 16 . 1 1 32 32 GLY C C 32 177.000 177.000 172.652 4.348 25800
7658 1 16 . 1 1 32 32 GLY CA C 32 44.500 44.500 45.117 -0.617 25800
7659 1 16 . 1 1 32 32 GLY H H 32 7.240 7.240 7.673 -0.433 25800
7660 1 16 . 1 1 33 33 ASN N N 33 115.300 115.300 119.994 -4.694 25800
7661 1 16 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.719 -0.279 25800
7662 1 16 . 1 1 33 33 ASN C C 33 175.500 175.500 175.168 0.332 25800
7663 1 16 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.804 1.496 25800
7664 1 16 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.139 -0.739 25800
7665 1 16 . 1 1 33 33 ASN H H 33 8.460 8.460 8.585 -0.125 25800
7666 1 16 . 1 1 34 34 ILE N N 34 126.700 126.700 126.035 0.665 25800
7667 1 16 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.160 -0.370 25800
7668 1 16 . 1 1 34 34 ILE C C 34 175.600 175.600 175.467 0.133 25800
7669 1 16 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.612 0.688 25800
7670 1 16 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.468 1.532 25800
7671 1 16 . 1 1 34 34 ILE H H 34 8.050 8.050 8.385 -0.335 25800
7672 1 16 . 1 1 35 35 LEU N N 35 127.400 127.400 129.101 -1.701 25800
7673 1 16 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.360 -0.200 25800
7674 1 16 . 1 1 35 35 LEU C C 35 177.200 177.200 175.997 1.203 25800
7675 1 16 . 1 1 35 35 LEU CA C 35 55.500 55.500 56.434 -0.934 25800
7676 1 16 . 1 1 35 35 LEU CB C 35 42.700 42.700 43.139 -0.438 25800
7677 1 16 . 1 1 35 35 LEU H H 35 8.780 8.780 8.645 0.135 25800
7678 1 16 . 1 1 36 36 LYS N N 36 117.000 117.000 117.678 -0.678 25800
7679 1 16 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.467 -0.227 25800
7680 1 16 . 1 1 36 36 LYS C C 36 173.600 173.600 173.938 -0.338 25800
7681 1 16 . 1 1 36 36 LYS CA C 36 55.900 55.900 56.227 -0.327 25800
7682 1 16 . 1 1 36 36 LYS CB C 36 36.600 36.600 34.843 1.757 25800
7683 1 16 . 1 1 36 36 LYS H H 36 7.110 7.110 7.625 -0.515 25800
7684 1 16 . 1 1 37 37 CYS N N 37 125.400 125.400 121.746 3.654 25800
7685 1 16 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.675 -0.975 25800
7686 1 16 . 1 1 37 37 CYS C C 37 171.600 171.600 173.067 -1.467 25800
7687 1 16 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.885 1.015 25800
7688 1 16 . 1 1 37 37 CYS CB C 37 27.100 27.100 30.832 -3.732 25800
7689 1 16 . 1 1 37 37 CYS H H 37 8.610 8.610 8.675 -0.065 25800
7690 1 16 . 1 1 38 38 ASP N N 38 128.200 128.200 124.616 3.584 25800
7691 1 16 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.936 0.014 25800
7692 1 16 . 1 1 38 38 ASP C C 38 174.300 174.300 173.899 0.401 25800
7693 1 16 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.903 -0.703 25800
7694 1 16 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.312 -1.012 25800
7695 1 16 . 1 1 38 38 ASP H H 38 8.290 8.290 8.847 -0.557 25800
7696 1 16 . 1 1 39 39 VAL N N 39 123.500 123.500 120.144 3.356 25800
7697 1 16 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.865 -0.565 25800
7698 1 16 . 1 1 39 39 VAL C C 39 175.000 175.000 175.161 -0.161 25800
7699 1 16 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.365 0.335 25800
7700 1 16 . 1 1 39 39 VAL CB C 39 33.100 33.100 33.898 -0.798 25800
7701 1 16 . 1 1 39 39 VAL H H 39 8.380 8.380 8.595 -0.215 25800
7702 1 16 . 1 1 40 40 LYS N N 40 129.100 129.100 127.073 2.027 25800
7703 1 16 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.876 -0.556 25800
7704 1 16 . 1 1 40 40 LYS C C 40 173.700 173.700 175.002 -1.302 25800
7705 1 16 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.971 -1.071 25800
7706 1 16 . 1 1 40 40 LYS CB C 40 35.500 35.500 34.735 0.765 25800
7707 1 16 . 1 1 40 40 LYS H H 40 8.680 8.680 9.269 -0.589 25800
7708 1 16 . 1 1 41 41 LYS N N 41 117.300 117.300 120.625 -3.325 25800
7709 1 16 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.476 -0.496 25800
7710 1 16 . 1 1 41 41 LYS C C 41 177.800 177.800 175.647 2.153 25800
7711 1 16 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.639 -0.039 25800
7712 1 16 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.204 -0.204 25800
7713 1 16 . 1 1 41 41 LYS H H 41 7.900 7.900 8.333 -0.433 25800
7714 1 16 . 1 1 42 42 THR N N 42 113.200 113.200 115.572 -2.372 25800
7715 1 16 . 1 1 42 42 THR HA H 42 4.680 4.680 4.763 -0.083 25800
7716 1 16 . 1 1 42 42 THR C C 42 176.900 176.900 176.511 0.389 25800
7717 1 16 . 1 1 42 42 THR CA C 42 60.200 60.200 60.439 -0.239 25800
7718 1 16 . 1 1 42 42 THR CB C 42 71.600 71.600 70.017 1.583 25800
7719 1 16 . 1 1 42 42 THR H H 42 8.730 8.730 8.571 0.159 25800
7720 1 16 . 1 1 43 43 VAL N N 43 120.000 120.000 122.533 -2.533 25800
7721 1 16 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.018 -0.098 25800
7722 1 16 . 1 1 43 43 VAL C C 43 177.000 177.000 176.223 0.777 25800
7723 1 16 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.408 0.292 25800
7724 1 16 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.777 0.023 25800
7725 1 16 . 1 1 43 43 VAL H H 43 8.730 8.730 8.600 0.130 25800
7726 1 16 . 1 1 44 44 SER N N 44 113.400 113.400 116.842 -3.442 25800
7727 1 16 . 1 1 44 44 SER HA H 44 4.360 4.360 4.385 -0.025 25800
7728 1 16 . 1 1 44 44 SER C C 44 174.800 174.800 175.250 -0.450 25800
7729 1 16 . 1 1 44 44 SER CA C 44 58.400 58.400 58.538 -0.138 25800
7730 1 16 . 1 1 44 44 SER CB C 44 63.500 63.500 63.450 0.049 25800
7731 1 16 . 1 1 44 44 SER H H 44 7.760 7.760 8.047 -0.287 25800
7732 1 16 . 1 1 45 45 GLY N N 45 110.200 110.200 109.132 1.068 25800
7733 1 16 . 1 1 45 45 GLY C C 45 173.500 173.500 174.109 -0.609 25800
7734 1 16 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.935 0.364 25800
7735 1 16 . 1 1 45 45 GLY H H 45 7.820 7.820 7.768 0.052 25800
7736 1 16 . 1 1 46 46 ALA N N 46 123.900 123.900 122.551 1.349 25800
7737 1 16 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.241 0.149 25800
7738 1 16 . 1 1 46 46 ALA C C 46 176.100 176.100 175.861 0.239 25800
7739 1 16 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.758 0.142 25800
7740 1 16 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.802 -0.002 25800
7741 1 16 . 1 1 46 46 ALA H H 46 7.440 7.440 7.851 -0.411 25800
7742 1 16 . 1 1 47 47 ALA N N 47 123.100 123.100 124.110 -1.010 25800
7743 1 16 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.154 0.046 25800
7744 1 16 . 1 1 47 47 ALA C C 47 176.100 176.100 175.591 0.509 25800
7745 1 16 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.194 0.706 25800
7746 1 16 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.578 0.322 25800
7747 1 16 . 1 1 47 47 ALA H H 47 8.350 8.350 8.022 0.328 25800
7748 1 16 . 1 1 48 48 PHE N N 48 118.700 118.700 118.313 0.387 25800
7749 1 16 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.257 -0.227 25800
7750 1 16 . 1 1 48 48 PHE C C 48 171.600 171.600 174.345 -2.745 25800
7751 1 16 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.662 -0.962 25800
7752 1 16 . 1 1 48 48 PHE CB C 48 41.200 41.200 42.785 -1.585 25800
7753 1 16 . 1 1 48 48 PHE H H 48 8.550 8.550 8.962 -0.412 25800
7754 1 16 . 1 1 49 49 ALA N N 49 120.400 120.400 125.538 -5.138 25800
7755 1 16 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.194 0.136 25800
7756 1 16 . 1 1 49 49 ALA C C 49 175.500 175.500 175.524 -0.024 25800
7757 1 16 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.467 -1.167 25800
7758 1 16 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.309 2.391 25800
7759 1 16 . 1 1 49 49 ALA H H 49 9.240 9.240 8.681 0.559 25800
7760 1 16 . 1 1 50 50 PHE N N 50 115.000 115.000 120.340 -5.340 25800
7761 1 16 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.618 -0.018 25800
7762 1 16 . 1 1 50 50 PHE C C 50 176.000 176.000 174.375 1.625 25800
7763 1 16 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.351 0.149 25800
7764 1 16 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.213 -1.013 25800
7765 1 16 . 1 1 50 50 PHE H H 50 7.920 7.920 8.814 -0.894 25800
7766 1 16 . 1 1 51 51 ILE N N 51 123.000 123.000 122.130 0.870 25800
7767 1 16 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.541 -0.091 25800
7768 1 16 . 1 1 51 51 ILE C C 51 173.700 173.700 173.847 -0.147 25800
7769 1 16 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.606 -0.406 25800
7770 1 16 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.303 -0.603 25800
7771 1 16 . 1 1 51 51 ILE H H 51 8.490 8.490 8.509 -0.019 25800
7772 1 16 . 1 1 52 52 GLU N N 52 126.600 126.600 126.475 0.125 25800
7773 1 16 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.151 -0.381 25800
7774 1 16 . 1 1 52 52 GLU C C 52 175.300 175.300 174.985 0.315 25800
7775 1 16 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.460 0.240 25800
7776 1 16 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.595 -1.095 25800
7777 1 16 . 1 1 52 52 GLU H H 52 8.610 8.610 8.892 -0.282 25800
7778 1 16 . 1 1 53 53 PHE N N 53 126.100 126.100 123.183 2.917 25800
7779 1 16 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.209 -0.409 25800
7780 1 16 . 1 1 53 53 PHE C C 53 175.400 175.400 175.732 -0.332 25800
7781 1 16 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.581 1.619 25800
7782 1 16 . 1 1 53 53 PHE CB C 53 40.900 40.900 43.068 -2.168 25800
7783 1 16 . 1 1 53 53 PHE H H 53 8.800 8.800 8.964 -0.164 25800
7784 1 16 . 1 1 54 54 GLU N N 54 120.700 120.700 119.588 1.112 25800
7785 1 16 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.273 -0.343 25800
7786 1 16 . 1 1 54 54 GLU C C 54 175.300 175.300 176.086 -0.786 25800
7787 1 16 . 1 1 54 54 GLU CA C 54 59.100 59.100 56.925 2.175 25800
7788 1 16 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.256 0.544 25800
7789 1 16 . 1 1 54 54 GLU H H 54 8.160 8.160 8.488 -0.328 25800
7790 1 16 . 1 1 55 55 ASP N N 55 117.900 117.900 119.549 -1.649 25800
7791 1 16 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.824 0.096 25800
7792 1 16 . 1 1 55 55 ASP C C 55 176.400 176.400 175.683 0.717 25800
7793 1 16 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.601 -1.201 25800
7794 1 16 . 1 1 55 55 ASP CB C 55 44.400 44.400 43.199 1.201 25800
7795 1 16 . 1 1 55 55 ASP H H 55 8.740 8.740 7.831 0.909 25800
7796 1 16 . 1 1 56 56 ALA N N 56 128.900 128.900 127.544 1.356 25800
7797 1 16 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.339 0.491 25800
7798 1 16 . 1 1 56 56 ALA C C 56 179.800 179.800 178.377 1.423 25800
7799 1 16 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.443 0.757 25800
7800 1 16 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.025 -0.125 25800
7801 1 16 . 1 1 56 56 ALA H H 56 8.800 8.800 8.465 0.335 25800
7802 1 16 . 1 1 57 57 ARG N N 57 119.200 119.200 116.532 2.668 25800
7803 1 16 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.159 -0.269 25800
7804 1 16 . 1 1 57 57 ARG C C 57 178.000 178.000 176.267 1.733 25800
7805 1 16 . 1 1 57 57 ARG CA C 57 58.900 58.900 57.844 1.056 25800
7806 1 16 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.614 0.686 25800
7807 1 16 . 1 1 57 57 ARG H H 57 8.950 8.950 8.493 0.457 25800
7808 1 16 . 1 1 58 58 ASP N N 58 120.900 120.900 119.729 1.171 25800
7809 1 16 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.576 -0.486 25800
7810 1 16 . 1 1 58 58 ASP C C 58 176.700 176.700 177.669 -0.969 25800
7811 1 16 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.679 -0.179 25800
7812 1 16 . 1 1 58 58 ASP CB C 58 39.900 39.900 41.084 -1.184 25800
7813 1 16 . 1 1 58 58 ASP H H 58 7.020 7.020 7.599 -0.579 25800
7814 1 16 . 1 1 59 59 ALA N N 59 119.700 119.700 122.512 -2.812 25800
7815 1 16 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.756 -0.676 25800
7816 1 16 . 1 1 59 59 ALA C C 59 178.100 178.100 179.394 -1.294 25800
7817 1 16 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.465 -0.165 25800
7818 1 16 . 1 1 59 59 ALA CB C 59 18.400 18.400 17.676 0.724 25800
7819 1 16 . 1 1 59 59 ALA H H 59 6.440 6.440 7.445 -1.005 25800
7820 1 16 . 1 1 60 60 ALA N N 60 117.600 117.600 121.374 -3.774 25800
7821 1 16 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.105 -0.275 25800
7822 1 16 . 1 1 60 60 ALA C C 60 180.900 180.900 178.875 2.025 25800
7823 1 16 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.172 -0.272 25800
7824 1 16 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.356 -0.656 25800
7825 1 16 . 1 1 60 60 ALA H H 60 7.330 7.330 8.323 -0.993 25800
7826 1 16 . 1 1 61 61 ASP N N 61 120.100 120.100 118.238 1.862 25800
7827 1 16 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.495 -0.285 25800
7828 1 16 . 1 1 61 61 ASP C C 61 176.700 176.700 177.506 -0.806 25800
7829 1 16 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.654 0.446 25800
7830 1 16 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.462 -0.362 25800
7831 1 16 . 1 1 61 61 ASP H H 61 7.590 7.590 7.935 -0.345 25800
7832 1 16 . 1 1 62 62 ALA N N 62 122.200 122.200 121.809 0.391 25800
7833 1 16 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.705 -1.285 25800
7834 1 16 . 1 1 62 62 ALA C C 62 179.300 179.300 179.192 0.108 25800
7835 1 16 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.108 0.492 25800
7836 1 16 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.730 0.370 25800
7837 1 16 . 1 1 62 62 ALA H H 62 7.440 7.440 7.546 -0.106 25800
7838 1 16 . 1 1 63 63 ILE N N 63 116.700 116.700 118.573 -1.873 25800
7839 1 16 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.820 -0.580 25800
7840 1 16 . 1 1 63 63 ILE C C 63 177.800 177.800 177.184 0.616 25800
7841 1 16 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.193 2.408 25800
7842 1 16 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.673 1.226 25800
7843 1 16 . 1 1 63 63 ILE H H 63 7.540 7.540 7.467 0.073 25800
7844 1 16 . 1 1 64 64 LYS N N 64 117.400 117.400 118.186 -0.786 25800
7845 1 16 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.098 -0.198 25800
7846 1 16 . 1 1 64 64 LYS C C 64 178.900 178.900 177.690 1.210 25800
7847 1 16 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.353 0.447 25800
7848 1 16 . 1 1 64 64 LYS CB C 64 32.600 32.600 32.159 0.441 25800
7849 1 16 . 1 1 64 64 LYS H H 64 7.490 7.490 8.109 -0.619 25800
7850 1 16 . 1 1 65 65 GLU N N 65 113.800 113.800 120.074 -6.274 25800
7851 1 16 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.242 -0.082 25800
7852 1 16 . 1 1 65 65 GLU C C 65 178.300 178.300 178.036 0.264 25800
7853 1 16 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.904 0.396 25800
7854 1 16 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.689 1.011 25800
7855 1 16 . 1 1 65 65 GLU H H 65 7.960 7.960 7.709 0.251 25800
7856 1 16 . 1 1 66 66 LYS N N 66 114.700 114.700 118.793 -4.093 25800
7857 1 16 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.195 0.275 25800
7858 1 16 . 1 1 66 66 LYS C C 66 177.500 177.500 176.667 0.833 25800
7859 1 16 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.859 -1.459 25800
7860 1 16 . 1 1 66 66 LYS CB C 66 33.000 33.000 31.723 1.277 25800
7861 1 16 . 1 1 66 66 LYS H H 66 8.050 8.050 7.940 0.110 25800
7862 1 16 . 1 1 67 67 ASP N N 67 118.800 118.800 119.462 -0.662 25800
7863 1 16 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.445 -0.225 25800
7864 1 16 . 1 1 67 67 ASP C C 67 177.700 177.700 177.497 0.203 25800
7865 1 16 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.637 3.763 25800
7866 1 16 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.062 0.338 25800
7867 1 16 . 1 1 67 67 ASP H H 67 7.620 7.620 7.314 0.306 25800
7868 1 16 . 1 1 68 68 GLY N N 68 115.600 115.600 108.088 7.512 25800
7869 1 16 . 1 1 68 68 GLY C C 68 173.800 173.800 174.495 -0.695 25800
7870 1 16 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.592 1.308 25800
7871 1 16 . 1 1 68 68 GLY H H 68 8.470 8.470 8.541 -0.071 25800
7872 1 16 . 1 1 69 69 CYS N N 69 119.200 119.200 120.360 -1.160 25800
7873 1 16 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.919 -0.759 25800
7874 1 16 . 1 1 69 69 CYS C C 69 172.600 172.600 174.027 -1.427 25800
7875 1 16 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.718 0.282 25800
7876 1 16 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.412 -0.712 25800
7877 1 16 . 1 1 69 69 CYS H H 69 7.890 7.890 8.237 -0.347 25800
7878 1 16 . 1 1 70 70 ASP N N 70 122.200 122.200 123.763 -1.563 25800
7879 1 16 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.553 0.277 25800
7880 1 16 . 1 1 70 70 ASP C C 70 176.400 176.400 174.439 1.961 25800
7881 1 16 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.533 1.167 25800
7882 1 16 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.254 -1.554 25800
7883 1 16 . 1 1 70 70 ASP H H 70 8.360 8.360 8.602 -0.242 25800
7884 1 16 . 1 1 71 71 PHE N N 71 127.600 127.600 119.834 7.766 25800
7885 1 16 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.197 -0.597 25800
7886 1 16 . 1 1 71 71 PHE C C 71 173.600 173.600 175.156 -1.556 25800
7887 1 16 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.628 0.172 25800
7888 1 16 . 1 1 71 71 PHE CB C 71 40.700 40.700 40.712 -0.013 25800
7889 1 16 . 1 1 71 71 PHE H H 71 9.390 9.390 7.598 1.792 25800
7890 1 16 . 1 1 72 72 GLU N N 72 123.900 123.900 118.882 5.018 25800
7891 1 16 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.159 -0.619 25800
7892 1 16 . 1 1 72 72 GLU C C 72 175.500 175.500 176.006 -0.506 25800
7893 1 16 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.380 -0.680 25800
7894 1 16 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.615 -1.315 25800
7895 1 16 . 1 1 72 72 GLU H H 72 8.940 8.940 9.304 -0.364 25800
7896 1 16 . 1 1 73 73 GLY N N 73 105.200 105.200 103.718 1.482 25800
7897 1 16 . 1 1 73 73 GLY C C 73 174.100 174.100 174.179 -0.079 25800
7898 1 16 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.857 0.743 25800
7899 1 16 . 1 1 73 73 GLY H H 73 8.350 8.350 8.120 0.230 25800
7900 1 16 . 1 1 74 74 ASN N N 74 121.000 121.000 120.471 0.529 25800
7901 1 16 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.886 -0.126 25800
7902 1 16 . 1 1 74 74 ASN C C 74 174.000 174.000 173.591 0.409 25800
7903 1 16 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.004 -2.104 25800
7904 1 16 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.477 0.223 25800
7905 1 16 . 1 1 74 74 ASN H H 74 7.740 7.740 8.041 -0.301 25800
7906 1 16 . 1 1 75 75 LYS N N 75 121.400 121.400 120.970 0.430 25800
7907 1 16 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.585 -0.115 25800
7908 1 16 . 1 1 75 75 LYS C C 75 176.900 176.900 174.529 2.371 25800
7909 1 16 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.743 -0.443 25800
7910 1 16 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.434 -1.534 25800
7911 1 16 . 1 1 75 75 LYS H H 75 8.380 8.380 8.418 -0.038 25800
7912 1 16 . 1 1 76 76 LEU N N 76 127.400 127.400 124.246 3.154 25800
7913 1 16 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.477 -0.047 25800
7914 1 16 . 1 1 76 76 LEU C C 76 177.600 177.600 174.331 3.269 25800
7915 1 16 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.137 0.163 25800
7916 1 16 . 1 1 76 76 LEU CB C 76 43.100 43.100 44.769 -1.669 25800
7917 1 16 . 1 1 76 76 LEU H H 76 8.950 8.950 8.504 0.446 25800
7918 1 16 . 1 1 77 77 ARG N N 77 121.800 121.800 125.680 -3.880 25800
7919 1 16 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.865 0.035 25800
7920 1 16 . 1 1 77 77 ARG C C 77 174.700 174.700 173.905 0.795 25800
7921 1 16 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.692 -1.692 25800
7922 1 16 . 1 1 77 77 ARG CB C 77 32.300 32.300 32.031 0.269 25800
7923 1 16 . 1 1 77 77 ARG H H 77 7.530 7.530 8.888 -1.358 25800
7924 1 16 . 1 1 78 78 VAL N N 78 127.000 127.000 120.779 6.221 25800
7925 1 16 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.562 0.718 25800
7926 1 16 . 1 1 78 78 VAL C C 78 174.200 174.200 174.367 -0.167 25800
7927 1 16 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.420 0.780 25800
7928 1 16 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.485 -1.085 25800
7929 1 16 . 1 1 78 78 VAL H H 78 9.660 9.660 8.561 1.099 25800
7930 1 16 . 1 1 79 79 GLU N N 79 121.900 121.900 124.828 -2.928 25800
7931 1 16 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.553 0.157 25800
7932 1 16 . 1 1 79 79 GLU C C 79 174.600 174.600 173.769 0.831 25800
7933 1 16 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.932 -2.032 25800
7934 1 16 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.299 0.101 25800
7935 1 16 . 1 1 79 79 GLU H H 79 8.980 8.980 8.185 0.795 25800
7936 1 16 . 1 1 80 80 VAL N N 80 121.300 121.300 122.191 -0.891 25800
7937 1 16 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.402 -0.032 25800
7938 1 16 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.034 2.966 25800
7939 1 16 . 1 1 80 80 VAL CB C 80 32.100 32.100 34.809 -2.709 25800
7940 1 16 . 1 1 80 80 VAL H H 80 8.410 8.410 8.261 0.149 25800
7941 1 16 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.499 -0.239 25800
7942 1 16 . 1 1 81 81 PRO C C 81 176.100 176.100 176.576 -0.476 25800
7943 1 16 . 1 1 81 81 PRO CA C 81 63.100 63.100 63.856 -0.756 25800
7944 1 16 . 1 1 81 81 PRO CB C 81 32.100 32.100 32.287 -0.187 25800
7945 1 16 . 1 1 82 82 PHE N N 82 122.200 122.200 117.483 4.717 25800
7946 1 16 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.670 -0.380 25800
7947 1 16 . 1 1 82 82 PHE C C 82 175.300 175.300 174.090 1.210 25800
7948 1 16 . 1 1 82 82 PHE CA C 82 58.100 58.100 57.405 0.695 25800
7949 1 16 . 1 1 82 82 PHE CB C 82 39.400 39.400 39.496 -0.096 25800
7950 1 16 . 1 1 82 82 PHE H H 82 8.150 8.150 7.784 0.366 25800
7951 1 16 . 1 1 83 83 ASN N N 83 120.800 120.800 118.739 2.061 25800
7952 1 16 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.821 -0.381 25800
7953 1 16 . 1 1 83 83 ASN C C 83 174.100 174.100 174.441 -0.341 25800
7954 1 16 . 1 1 83 83 ASN CA C 83 52.700 52.700 52.196 0.504 25800
7955 1 16 . 1 1 83 83 ASN CB C 83 38.700 38.700 40.421 -1.721 25800
7956 1 16 . 1 1 83 83 ASN H H 83 8.110 8.110 8.627 -0.517 25800
7957 1 16 . 1 1 84 84 ALA N N 84 123.700 123.700 123.081 0.619 25800
7958 1 16 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.283 -0.203 25800
7959 1 16 . 1 1 84 84 ALA C C 84 177.100 177.100 177.091 0.009 25800
7960 1 16 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.969 -0.569 25800
7961 1 16 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.491 -0.392 25800
7962 1 16 . 1 1 84 84 ALA H H 84 8.020 8.020 8.489 -0.469 25800
7963 1 16 . 1 1 85 85 ARG N N 85 120.200 120.200 121.569 -1.369 25800
7964 1 16 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.665 -0.515 25800
7965 1 16 . 1 1 85 85 ARG C C 85 175.200 175.200 174.548 0.652 25800
7966 1 16 . 1 1 85 85 ARG CA C 85 56.000 56.000 55.254 0.746 25800
7967 1 16 . 1 1 85 85 ARG CB C 85 30.800 30.800 32.697 -1.897 25800
7968 1 16 . 1 1 85 85 ARG H H 85 8.040 8.040 8.426 -0.386 25800
7969 1 17 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.482 0.108 25800
7970 1 17 . 1 1 0 0 HIS C C 0 174.000 174.000 175.945 -1.945 25800
7971 1 17 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.991 -1.691 25800
7972 1 17 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.250 -0.950 25800
7973 1 17 . 1 1 1 1 MET N N 1 122.400 122.400 120.663 1.737 25800
7974 1 17 . 1 1 1 1 MET HA H 1 4.340 4.340 4.119 0.221 25800
7975 1 17 . 1 1 1 1 MET C C 1 175.600 175.600 175.516 0.084 25800
7976 1 17 . 1 1 1 1 MET CA C 1 55.600 55.600 55.792 -0.192 25800
7977 1 17 . 1 1 1 1 MET CB C 1 32.800 32.800 30.820 1.980 25800
7978 1 17 . 1 1 1 1 MET H H 1 8.310 8.310 8.409 -0.099 25800
7979 1 17 . 1 1 2 2 VAL N N 2 123.200 123.200 117.183 6.017 25800
7980 1 17 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.002 -0.042 25800
7981 1 17 . 1 1 2 2 VAL C C 2 175.600 175.600 175.990 -0.390 25800
7982 1 17 . 1 1 2 2 VAL CA C 2 62.300 62.300 63.108 -0.808 25800
7983 1 17 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.665 -0.365 25800
7984 1 17 . 1 1 2 2 VAL H H 2 8.180 8.180 8.030 0.150 25800
7985 1 17 . 1 1 3 3 ILE N N 3 126.200 126.200 117.647 8.553 25800
7986 1 17 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.670 -0.620 25800
7987 1 17 . 1 1 3 3 ILE C C 3 175.800 175.800 175.892 -0.092 25800
7988 1 17 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.555 -0.855 25800
7989 1 17 . 1 1 3 3 ILE CB C 3 38.300 38.300 38.634 -0.334 25800
7990 1 17 . 1 1 3 3 ILE H H 3 8.230 8.230 8.186 0.044 25800
7991 1 17 . 1 1 4 4 ARG N N 4 126.100 126.100 120.540 5.560 25800
7992 1 17 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.592 -0.412 25800
7993 1 17 . 1 1 4 4 ARG C C 4 175.900 175.900 175.581 0.319 25800
7994 1 17 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.173 -0.173 25800
7995 1 17 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.533 0.167 25800
7996 1 17 . 1 1 4 4 ARG H H 4 8.360 8.360 8.213 0.147 25800
7997 1 17 . 1 1 5 5 GLU N N 5 122.200 122.200 120.402 1.798 25800
7998 1 17 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.461 -0.321 25800
7999 1 17 . 1 1 5 5 GLU C C 5 176.100 176.100 175.398 0.702 25800
8000 1 17 . 1 1 5 5 GLU CA C 5 56.600 56.600 56.109 0.491 25800
8001 1 17 . 1 1 5 5 GLU CB C 5 30.300 30.300 30.598 -0.298 25800
8002 1 17 . 1 1 5 5 GLU H H 5 8.400 8.400 8.131 0.269 25800
8003 1 17 . 1 1 6 6 SER N N 6 116.200 116.200 116.170 0.030 25800
8004 1 17 . 1 1 6 6 SER HA H 6 4.350 4.350 4.383 -0.033 25800
8005 1 17 . 1 1 6 6 SER C C 6 174.300 174.300 174.315 -0.015 25800
8006 1 17 . 1 1 6 6 SER CA C 6 58.200 58.200 58.431 -0.231 25800
8007 1 17 . 1 1 6 6 SER CB C 6 63.800 63.800 63.679 0.121 25800
8008 1 17 . 1 1 6 6 SER H H 6 8.270 8.270 7.877 0.393 25800
8009 1 17 . 1 1 7 7 VAL N N 7 119.800 119.800 125.368 -5.568 25800
8010 1 17 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.268 0.032 25800
8011 1 17 . 1 1 7 7 VAL C C 7 175.500 175.500 175.684 -0.184 25800
8012 1 17 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.903 -0.203 25800
8013 1 17 . 1 1 7 7 VAL CB C 7 32.800 32.800 32.413 0.388 25800
8014 1 17 . 1 1 7 7 VAL H H 7 7.840 7.840 8.321 -0.481 25800
8015 1 17 . 1 1 8 8 SER N N 8 117.800 117.800 123.791 -5.991 25800
8016 1 17 . 1 1 8 8 SER HA H 8 4.240 4.240 4.839 -0.599 25800
8017 1 17 . 1 1 8 8 SER C C 8 172.500 172.500 173.559 -1.059 25800
8018 1 17 . 1 1 8 8 SER CA C 8 58.500 58.500 58.269 0.231 25800
8019 1 17 . 1 1 8 8 SER CB C 8 63.600 63.600 63.580 0.020 25800
8020 1 17 . 1 1 8 8 SER H H 8 8.530 8.530 8.789 -0.259 25800
8021 1 17 . 1 1 9 9 ARG N N 9 123.000 123.000 121.695 1.305 25800
8022 1 17 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.068 0.432 25800
8023 1 17 . 1 1 9 9 ARG C C 9 175.000 175.000 175.037 -0.037 25800
8024 1 17 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.671 -0.371 25800
8025 1 17 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.674 0.726 25800
8026 1 17 . 1 1 9 9 ARG H H 9 7.350 7.350 8.451 -1.101 25800
8027 1 17 . 1 1 10 10 ILE N N 10 114.000 114.000 120.960 -6.960 25800
8028 1 17 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.129 0.691 25800
8029 1 17 . 1 1 10 10 ILE C C 10 173.000 173.000 174.753 -1.753 25800
8030 1 17 . 1 1 10 10 ILE CA C 10 59.400 59.400 62.048 -2.648 25800
8031 1 17 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.952 1.948 25800
8032 1 17 . 1 1 10 10 ILE H H 10 8.830 8.830 8.414 0.416 25800
8033 1 17 . 1 1 11 11 TYR N N 11 123.400 123.400 127.501 -4.101 25800
8034 1 17 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.912 0.018 25800
8035 1 17 . 1 1 11 11 TYR C C 11 173.000 173.000 173.316 -0.316 25800
8036 1 17 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.593 0.407 25800
8037 1 17 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.369 -0.469 25800
8038 1 17 . 1 1 11 11 TYR H H 11 8.690 8.690 8.015 0.675 25800
8039 1 17 . 1 1 12 12 VAL N N 12 126.300 126.300 122.864 3.436 25800
8040 1 17 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.667 -0.107 25800
8041 1 17 . 1 1 12 12 VAL C C 12 174.100 174.100 173.543 0.557 25800
8042 1 17 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.276 0.924 25800
8043 1 17 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.950 -1.550 25800
8044 1 17 . 1 1 12 12 VAL H H 12 8.370 8.370 7.679 0.691 25800
8045 1 17 . 1 1 13 13 GLY N N 13 113.000 113.000 111.018 1.982 25800
8046 1 17 . 1 1 13 13 GLY C C 13 173.100 173.100 172.811 0.289 25800
8047 1 17 . 1 1 13 13 GLY CA C 13 43.300 43.300 44.224 -0.923 25800
8048 1 17 . 1 1 13 13 GLY H H 13 9.350 9.350 8.693 0.657 25800
8049 1 17 . 1 1 14 14 ASN N N 14 113.900 113.900 117.720 -3.820 25800
8050 1 17 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.283 -0.003 25800
8051 1 17 . 1 1 14 14 ASN C C 14 175.800 175.800 175.036 0.764 25800
8052 1 17 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.160 -0.560 25800
8053 1 17 . 1 1 14 14 ASN CB C 14 37.700 37.700 38.030 -0.330 25800
8054 1 17 . 1 1 14 14 ASN H H 14 8.800 8.800 8.647 0.153 25800
8055 1 17 . 1 1 15 15 LEU N N 15 115.800 115.800 119.333 -3.533 25800
8056 1 17 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.444 0.546 25800
8057 1 17 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.714 1.886 25800
8058 1 17 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.908 -0.308 25800
8059 1 17 . 1 1 15 15 LEU H H 15 7.150 7.150 7.720 -0.570 25800
8060 1 17 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.543 -0.473 25800
8061 1 17 . 1 1 16 16 PRO C C 16 171.500 171.500 178.369 -6.869 25800
8062 1 17 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.170 -0.670 25800
8063 1 17 . 1 1 16 16 PRO CB C 16 32.000 32.000 32.288 -0.287 25800
8064 1 17 . 1 1 17 17 SER N N 17 115.200 115.200 118.785 -3.585 25800
8065 1 17 . 1 1 17 17 SER HA H 17 4.300 4.300 4.045 0.255 25800
8066 1 17 . 1 1 17 17 SER C C 17 174.200 174.200 173.954 0.246 25800
8067 1 17 . 1 1 17 17 SER CA C 17 58.200 58.200 59.133 -0.933 25800
8068 1 17 . 1 1 17 17 SER CB C 17 63.900 63.900 63.245 0.656 25800
8069 1 17 . 1 1 17 17 SER H H 17 8.470 8.470 8.787 -0.317 25800
8070 1 17 . 1 1 18 18 HIS N N 18 120.800 120.800 118.291 2.509 25800
8071 1 17 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.238 0.312 25800
8072 1 17 . 1 1 18 18 HIS C C 18 175.100 175.100 173.037 2.063 25800
8073 1 17 . 1 1 18 18 HIS CA C 18 55.500 55.500 57.138 -1.638 25800
8074 1 17 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.836 -0.536 25800
8075 1 17 . 1 1 18 18 HIS H H 18 8.540 8.540 7.823 0.717 25800
8076 1 17 . 1 1 19 19 VAL N N 19 115.700 115.700 118.173 -2.473 25800
8077 1 17 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.215 0.045 25800
8078 1 17 . 1 1 19 19 VAL C C 19 174.000 174.000 175.689 -1.689 25800
8079 1 17 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.281 0.619 25800
8080 1 17 . 1 1 19 19 VAL CB C 19 32.600 32.600 33.045 -0.445 25800
8081 1 17 . 1 1 19 19 VAL H H 19 6.650 6.650 8.168 -1.518 25800
8082 1 17 . 1 1 20 20 SER N N 20 118.800 118.800 121.195 -2.395 25800
8083 1 17 . 1 1 20 20 SER HA H 20 4.710 4.710 4.436 0.274 25800
8084 1 17 . 1 1 20 20 SER C C 20 175.900 175.900 176.011 -0.111 25800
8085 1 17 . 1 1 20 20 SER CA C 20 55.800 55.800 57.521 -1.721 25800
8086 1 17 . 1 1 20 20 SER CB C 20 66.600 66.600 64.742 1.858 25800
8087 1 17 . 1 1 20 20 SER H H 20 8.930 8.930 8.227 0.703 25800
8088 1 17 . 1 1 21 21 SER N N 21 117.100 117.100 117.318 -0.218 25800
8089 1 17 . 1 1 21 21 SER HA H 21 3.880 3.880 4.132 -0.252 25800
8090 1 17 . 1 1 21 21 SER C C 21 176.200 176.200 176.670 -0.470 25800
8091 1 17 . 1 1 21 21 SER CA C 21 62.300 62.300 61.237 1.063 25800
8092 1 17 . 1 1 21 21 SER CB C 21 66.800 66.800 62.680 4.120 25800
8093 1 17 . 1 1 21 21 SER H H 21 9.080 9.080 8.850 0.230 25800
8094 1 17 . 1 1 22 22 ARG N N 22 121.200 121.200 122.210 -1.010 25800
8095 1 17 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.130 -0.140 25800
8096 1 17 . 1 1 22 22 ARG C C 22 177.900 177.900 177.988 -0.088 25800
8097 1 17 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.028 -0.328 25800
8098 1 17 . 1 1 22 22 ARG CB C 22 29.600 29.600 30.058 -0.458 25800
8099 1 17 . 1 1 22 22 ARG H H 22 7.940 7.940 8.353 -0.413 25800
8100 1 17 . 1 1 23 23 ASP N N 23 118.800 118.800 120.009 -1.209 25800
8101 1 17 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.495 -0.105 25800
8102 1 17 . 1 1 23 23 ASP C C 23 179.200 179.200 178.839 0.361 25800
8103 1 17 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.151 0.148 25800
8104 1 17 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.400 0.600 25800
8105 1 17 . 1 1 23 23 ASP H H 23 7.480 7.480 7.991 -0.511 25800
8106 1 17 . 1 1 24 24 VAL N N 24 119.500 119.500 120.499 -0.999 25800
8107 1 17 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.807 -0.437 25800
8108 1 17 . 1 1 24 24 VAL C C 24 177.500 177.500 177.695 -0.195 25800
8109 1 17 . 1 1 24 24 VAL CA C 24 66.900 66.900 67.223 -0.323 25800
8110 1 17 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.768 -0.368 25800
8111 1 17 . 1 1 24 24 VAL H H 24 7.450 7.450 8.526 -1.076 25800
8112 1 17 . 1 1 25 25 GLU N N 25 121.400 121.400 119.423 1.977 25800
8113 1 17 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.966 -0.396 25800
8114 1 17 . 1 1 25 25 GLU C C 25 178.400 178.400 179.010 -0.610 25800
8115 1 17 . 1 1 25 25 GLU CA C 25 60.600 60.600 59.867 0.733 25800
8116 1 17 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.490 0.110 25800
8117 1 17 . 1 1 25 25 GLU H H 25 8.580 8.580 8.117 0.463 25800
8118 1 17 . 1 1 26 26 ASN N N 26 114.800 114.800 117.224 -2.424 25800
8119 1 17 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.480 -0.160 25800
8120 1 17 . 1 1 26 26 ASN C C 26 177.400 177.400 177.625 -0.225 25800
8121 1 17 . 1 1 26 26 ASN CA C 26 55.900 55.900 56.125 -0.225 25800
8122 1 17 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.734 -0.834 25800
8123 1 17 . 1 1 26 26 ASN H H 26 8.180 8.180 8.248 -0.068 25800
8124 1 17 . 1 1 27 27 GLU N N 27 118.900 118.900 119.767 -0.867 25800
8125 1 17 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.167 -0.027 25800
8126 1 17 . 1 1 27 27 GLU C C 27 176.400 176.400 179.036 -2.636 25800
8127 1 17 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.531 -1.131 25800
8128 1 17 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.878 -0.478 25800
8129 1 17 . 1 1 27 27 GLU H H 27 7.340 7.340 8.148 -0.808 25800
8130 1 17 . 1 1 28 28 PHE N N 28 114.100 114.100 118.889 -4.789 25800
8131 1 17 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.349 0.201 25800
8132 1 17 . 1 1 28 28 PHE C C 28 176.300 176.300 177.810 -1.510 25800
8133 1 17 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.950 -0.950 25800
8134 1 17 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.746 2.054 25800
8135 1 17 . 1 1 28 28 PHE H H 28 7.660 7.660 8.393 -0.733 25800
8136 1 17 . 1 1 29 29 ARG N N 29 121.700 121.700 119.162 2.538 25800
8137 1 17 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.347 0.063 25800
8138 1 17 . 1 1 29 29 ARG C C 29 177.100 177.100 177.332 -0.232 25800
8139 1 17 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.867 -0.667 25800
8140 1 17 . 1 1 29 29 ARG CB C 29 29.300 29.300 30.357 -1.056 25800
8141 1 17 . 1 1 29 29 ARG H H 29 8.120 8.120 7.881 0.239 25800
8142 1 17 . 1 1 30 30 LYS N N 30 117.200 117.200 116.636 0.564 25800
8143 1 17 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.200 -0.370 25800
8144 1 17 . 1 1 30 30 LYS C C 30 177.100 177.100 178.448 -1.348 25800
8145 1 17 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.916 -0.117 25800
8146 1 17 . 1 1 30 30 LYS CB C 30 31.100 31.100 32.215 -1.115 25800
8147 1 17 . 1 1 30 30 LYS H H 30 7.630 7.630 7.657 -0.027 25800
8148 1 17 . 1 1 31 31 TYR N N 31 117.100 117.100 119.539 -2.439 25800
8149 1 17 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.378 -0.228 25800
8150 1 17 . 1 1 31 31 TYR C C 31 174.400 174.400 175.991 -1.591 25800
8151 1 17 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.966 -0.066 25800
8152 1 17 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.759 -1.859 25800
8153 1 17 . 1 1 31 31 TYR H H 31 7.410 7.410 7.971 -0.561 25800
8154 1 17 . 1 1 32 32 GLY N N 32 104.100 104.100 103.264 0.836 25800
8155 1 17 . 1 1 32 32 GLY C C 32 177.000 177.000 172.148 4.852 25800
8156 1 17 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.253 0.247 25800
8157 1 17 . 1 1 32 32 GLY H H 32 7.240 7.240 7.684 -0.445 25800
8158 1 17 . 1 1 33 33 ASN N N 33 115.300 115.300 119.924 -4.624 25800
8159 1 17 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.843 -0.403 25800
8160 1 17 . 1 1 33 33 ASN C C 33 175.500 175.500 175.192 0.308 25800
8161 1 17 . 1 1 33 33 ASN CA C 33 54.300 54.300 52.931 1.369 25800
8162 1 17 . 1 1 33 33 ASN CB C 33 38.400 38.400 37.634 0.766 25800
8163 1 17 . 1 1 33 33 ASN H H 33 8.460 8.460 8.443 0.017 25800
8164 1 17 . 1 1 34 34 ILE N N 34 126.700 126.700 125.371 1.329 25800
8165 1 17 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.327 -0.537 25800
8166 1 17 . 1 1 34 34 ILE C C 34 175.600 175.600 175.987 -0.387 25800
8167 1 17 . 1 1 34 34 ILE CA C 34 61.300 61.300 62.222 -0.922 25800
8168 1 17 . 1 1 34 34 ILE CB C 34 40.000 40.000 37.966 2.034 25800
8169 1 17 . 1 1 34 34 ILE H H 34 8.050 8.050 8.235 -0.185 25800
8170 1 17 . 1 1 35 35 LEU N N 35 127.400 127.400 128.880 -1.480 25800
8171 1 17 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.474 -0.314 25800
8172 1 17 . 1 1 35 35 LEU C C 35 177.200 177.200 176.569 0.631 25800
8173 1 17 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.596 -0.096 25800
8174 1 17 . 1 1 35 35 LEU CB C 35 42.700 42.700 43.128 -0.428 25800
8175 1 17 . 1 1 35 35 LEU H H 35 8.780 8.780 8.829 -0.049 25800
8176 1 17 . 1 1 36 36 LYS N N 36 117.000 117.000 118.593 -1.593 25800
8177 1 17 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.599 -0.359 25800
8178 1 17 . 1 1 36 36 LYS C C 36 173.600 173.600 173.984 -0.384 25800
8179 1 17 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.544 0.356 25800
8180 1 17 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.396 0.204 25800
8181 1 17 . 1 1 36 36 LYS H H 36 7.110 7.110 7.627 -0.517 25800
8182 1 17 . 1 1 37 37 CYS N N 37 125.400 125.400 119.532 5.868 25800
8183 1 17 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.563 -0.863 25800
8184 1 17 . 1 1 37 37 CYS C C 37 171.600 171.600 172.801 -1.201 25800
8185 1 17 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.459 1.441 25800
8186 1 17 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.872 -4.772 25800
8187 1 17 . 1 1 37 37 CYS H H 37 8.610 8.610 8.554 0.056 25800
8188 1 17 . 1 1 38 38 ASP N N 38 128.200 128.200 120.405 7.795 25800
8189 1 17 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.971 -0.021 25800
8190 1 17 . 1 1 38 38 ASP C C 38 174.300 174.300 173.869 0.431 25800
8191 1 17 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.919 -0.719 25800
8192 1 17 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.470 -1.170 25800
8193 1 17 . 1 1 38 38 ASP H H 38 8.290 8.290 9.036 -0.746 25800
8194 1 17 . 1 1 39 39 VAL N N 39 123.500 123.500 119.758 3.742 25800
8195 1 17 . 1 1 39 39 VAL HA H 39 4.300 4.300 5.187 -0.887 25800
8196 1 17 . 1 1 39 39 VAL C C 39 175.000 175.000 174.301 0.699 25800
8197 1 17 . 1 1 39 39 VAL CA C 39 61.700 61.700 60.511 1.189 25800
8198 1 17 . 1 1 39 39 VAL CB C 39 33.100 33.100 35.164 -2.064 25800
8199 1 17 . 1 1 39 39 VAL H H 39 8.380 8.380 8.484 -0.104 25800
8200 1 17 . 1 1 40 40 LYS N N 40 129.100 129.100 126.971 2.129 25800
8201 1 17 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.953 -0.633 25800
8202 1 17 . 1 1 40 40 LYS C C 40 173.700 173.700 174.272 -0.572 25800
8203 1 17 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.013 -0.113 25800
8204 1 17 . 1 1 40 40 LYS CB C 40 35.500 35.500 36.769 -1.269 25800
8205 1 17 . 1 1 40 40 LYS H H 40 8.680 8.680 9.372 -0.692 25800
8206 1 17 . 1 1 41 41 LYS N N 41 117.300 117.300 119.363 -2.063 25800
8207 1 17 . 1 1 41 41 LYS HA H 41 4.980 4.980 4.656 0.324 25800
8208 1 17 . 1 1 41 41 LYS C C 41 177.800 177.800 175.421 2.379 25800
8209 1 17 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.418 0.182 25800
8210 1 17 . 1 1 41 41 LYS CB C 41 35.000 35.000 34.948 0.052 25800
8211 1 17 . 1 1 41 41 LYS H H 41 7.900 7.900 8.363 -0.463 25800
8212 1 17 . 1 1 42 42 THR N N 42 113.200 113.200 114.380 -1.180 25800
8213 1 17 . 1 1 42 42 THR HA H 42 4.680 4.680 4.745 -0.065 25800
8214 1 17 . 1 1 42 42 THR C C 42 176.900 176.900 176.648 0.252 25800
8215 1 17 . 1 1 42 42 THR CA C 42 60.200 60.200 60.515 -0.315 25800
8216 1 17 . 1 1 42 42 THR CB C 42 71.600 71.600 70.976 0.624 25800
8217 1 17 . 1 1 42 42 THR H H 42 8.730 8.730 8.437 0.293 25800
8218 1 17 . 1 1 43 43 VAL N N 43 120.000 120.000 123.633 -3.633 25800
8219 1 17 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.975 -0.055 25800
8220 1 17 . 1 1 43 43 VAL C C 43 177.000 177.000 176.770 0.230 25800
8221 1 17 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.618 0.082 25800
8222 1 17 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.582 0.218 25800
8223 1 17 . 1 1 43 43 VAL H H 43 8.730 8.730 8.406 0.324 25800
8224 1 17 . 1 1 44 44 SER N N 44 113.400 113.400 115.456 -2.056 25800
8225 1 17 . 1 1 44 44 SER HA H 44 4.360 4.360 4.345 0.015 25800
8226 1 17 . 1 1 44 44 SER C C 44 174.800 174.800 175.443 -0.643 25800
8227 1 17 . 1 1 44 44 SER CA C 44 58.400 58.400 58.709 -0.309 25800
8228 1 17 . 1 1 44 44 SER CB C 44 63.500 63.500 63.501 -0.001 25800
8229 1 17 . 1 1 44 44 SER H H 44 7.760 7.760 8.069 -0.309 25800
8230 1 17 . 1 1 45 45 GLY N N 45 110.200 110.200 108.457 1.743 25800
8231 1 17 . 1 1 45 45 GLY C C 45 173.500 173.500 173.847 -0.347 25800
8232 1 17 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.695 0.605 25800
8233 1 17 . 1 1 45 45 GLY H H 45 7.820 7.820 7.685 0.135 25800
8234 1 17 . 1 1 46 46 ALA N N 46 123.900 123.900 122.416 1.484 25800
8235 1 17 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.254 0.136 25800
8236 1 17 . 1 1 46 46 ALA C C 46 176.100 176.100 175.594 0.506 25800
8237 1 17 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.968 -0.068 25800
8238 1 17 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.209 -0.409 25800
8239 1 17 . 1 1 46 46 ALA H H 46 7.440 7.440 7.827 -0.387 25800
8240 1 17 . 1 1 47 47 ALA N N 47 123.100 123.100 123.455 -0.355 25800
8241 1 17 . 1 1 47 47 ALA HA H 47 5.200 5.200 4.687 0.513 25800
8242 1 17 . 1 1 47 47 ALA C C 47 176.100 176.100 175.494 0.606 25800
8243 1 17 . 1 1 47 47 ALA CA C 47 50.900 50.900 49.798 1.101 25800
8244 1 17 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.934 -0.034 25800
8245 1 17 . 1 1 47 47 ALA H H 47 8.350 8.350 7.980 0.370 25800
8246 1 17 . 1 1 48 48 PHE N N 48 118.700 118.700 115.333 3.367 25800
8247 1 17 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.232 -0.202 25800
8248 1 17 . 1 1 48 48 PHE C C 48 171.600 171.600 173.475 -1.875 25800
8249 1 17 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.322 -0.622 25800
8250 1 17 . 1 1 48 48 PHE CB C 48 41.200 41.200 42.374 -1.174 25800
8251 1 17 . 1 1 48 48 PHE H H 48 8.550 8.550 8.819 -0.269 25800
8252 1 17 . 1 1 49 49 ALA N N 49 120.400 120.400 122.588 -2.188 25800
8253 1 17 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.435 -0.105 25800
8254 1 17 . 1 1 49 49 ALA C C 49 175.500 175.500 175.068 0.432 25800
8255 1 17 . 1 1 49 49 ALA CA C 49 49.300 49.300 49.840 -0.540 25800
8256 1 17 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.848 1.852 25800
8257 1 17 . 1 1 49 49 ALA H H 49 9.240 9.240 8.841 0.399 25800
8258 1 17 . 1 1 50 50 PHE N N 50 115.000 115.000 118.633 -3.633 25800
8259 1 17 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.342 0.258 25800
8260 1 17 . 1 1 50 50 PHE C C 50 176.000 176.000 174.324 1.676 25800
8261 1 17 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.347 0.152 25800
8262 1 17 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.128 -0.928 25800
8263 1 17 . 1 1 50 50 PHE H H 50 7.920 7.920 9.009 -1.089 25800
8264 1 17 . 1 1 51 51 ILE N N 51 123.000 123.000 121.075 1.925 25800
8265 1 17 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.434 0.016 25800
8266 1 17 . 1 1 51 51 ILE C C 51 173.700 173.700 174.093 -0.393 25800
8267 1 17 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.319 -0.119 25800
8268 1 17 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.555 -0.855 25800
8269 1 17 . 1 1 51 51 ILE H H 51 8.490 8.490 8.244 0.246 25800
8270 1 17 . 1 1 52 52 GLU N N 52 126.600 126.600 125.955 0.645 25800
8271 1 17 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.849 -0.079 25800
8272 1 17 . 1 1 52 52 GLU C C 52 175.300 175.300 174.810 0.490 25800
8273 1 17 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.486 0.214 25800
8274 1 17 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.481 -0.981 25800
8275 1 17 . 1 1 52 52 GLU H H 52 8.610 8.610 8.772 -0.162 25800
8276 1 17 . 1 1 53 53 PHE N N 53 126.100 126.100 123.708 2.392 25800
8277 1 17 . 1 1 53 53 PHE HA H 53 4.800 4.800 4.914 -0.114 25800
8278 1 17 . 1 1 53 53 PHE C C 53 175.400 175.400 176.233 -0.833 25800
8279 1 17 . 1 1 53 53 PHE CA C 53 58.200 58.200 55.779 2.421 25800
8280 1 17 . 1 1 53 53 PHE CB C 53 40.900 40.900 42.231 -1.331 25800
8281 1 17 . 1 1 53 53 PHE H H 53 8.800 8.800 8.194 0.606 25800
8282 1 17 . 1 1 54 54 GLU N N 54 120.700 120.700 119.277 1.423 25800
8283 1 17 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.163 -0.233 25800
8284 1 17 . 1 1 54 54 GLU C C 54 175.300 175.300 176.196 -0.896 25800
8285 1 17 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.630 1.470 25800
8286 1 17 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.168 0.632 25800
8287 1 17 . 1 1 54 54 GLU H H 54 8.160 8.160 8.949 -0.789 25800
8288 1 17 . 1 1 55 55 ASP N N 55 117.900 117.900 119.824 -1.924 25800
8289 1 17 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.817 0.103 25800
8290 1 17 . 1 1 55 55 ASP C C 55 176.400 176.400 175.407 0.993 25800
8291 1 17 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.326 -0.926 25800
8292 1 17 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.199 2.201 25800
8293 1 17 . 1 1 55 55 ASP H H 55 8.740 8.740 8.045 0.695 25800
8294 1 17 . 1 1 56 56 ALA N N 56 128.900 128.900 126.521 2.379 25800
8295 1 17 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.576 0.254 25800
8296 1 17 . 1 1 56 56 ALA C C 56 179.800 179.800 178.740 1.060 25800
8297 1 17 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.956 0.244 25800
8298 1 17 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.902 -0.003 25800
8299 1 17 . 1 1 56 56 ALA H H 56 8.800 8.800 8.578 0.222 25800
8300 1 17 . 1 1 57 57 ARG N N 57 119.200 119.200 116.958 2.242 25800
8301 1 17 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.146 -0.256 25800
8302 1 17 . 1 1 57 57 ARG C C 57 178.000 178.000 177.095 0.905 25800
8303 1 17 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.233 0.667 25800
8304 1 17 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.639 0.661 25800
8305 1 17 . 1 1 57 57 ARG H H 57 8.950 8.950 8.578 0.372 25800
8306 1 17 . 1 1 58 58 ASP N N 58 120.900 120.900 120.448 0.452 25800
8307 1 17 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.515 -0.425 25800
8308 1 17 . 1 1 58 58 ASP C C 58 176.700 176.700 177.389 -0.689 25800
8309 1 17 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.612 -0.112 25800
8310 1 17 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.786 -0.886 25800
8311 1 17 . 1 1 58 58 ASP H H 58 7.020 7.020 7.584 -0.564 25800
8312 1 17 . 1 1 59 59 ALA N N 59 119.700 119.700 121.949 -2.249 25800
8313 1 17 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.496 -1.416 25800
8314 1 17 . 1 1 59 59 ALA C C 59 178.100 178.100 179.573 -1.473 25800
8315 1 17 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.488 -0.188 25800
8316 1 17 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.842 -0.442 25800
8317 1 17 . 1 1 59 59 ALA H H 59 6.440 6.440 7.375 -0.935 25800
8318 1 17 . 1 1 60 60 ALA N N 60 117.600 117.600 121.199 -3.599 25800
8319 1 17 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.124 -0.294 25800
8320 1 17 . 1 1 60 60 ALA C C 60 180.900 180.900 179.059 1.841 25800
8321 1 17 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.570 -0.670 25800
8322 1 17 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.446 -0.746 25800
8323 1 17 . 1 1 60 60 ALA H H 60 7.330 7.330 8.583 -1.253 25800
8324 1 17 . 1 1 61 61 ASP N N 61 120.100 120.100 117.752 2.348 25800
8325 1 17 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.458 -0.248 25800
8326 1 17 . 1 1 61 61 ASP C C 61 176.700 176.700 177.678 -0.978 25800
8327 1 17 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.596 0.504 25800
8328 1 17 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.706 -0.606 25800
8329 1 17 . 1 1 61 61 ASP H H 61 7.590 7.590 8.134 -0.544 25800
8330 1 17 . 1 1 62 62 ALA N N 62 122.200 122.200 121.194 1.006 25800
8331 1 17 . 1 1 62 62 ALA HA H 62 2.420 2.420 4.064 -1.644 25800
8332 1 17 . 1 1 62 62 ALA C C 62 179.300 179.300 178.651 0.649 25800
8333 1 17 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.753 0.847 25800
8334 1 17 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.755 0.345 25800
8335 1 17 . 1 1 62 62 ALA H H 62 7.440 7.440 7.340 0.100 25800
8336 1 17 . 1 1 63 63 ILE N N 63 116.700 116.700 118.883 -2.183 25800
8337 1 17 . 1 1 63 63 ILE HA H 63 3.240 3.240 4.295 -1.055 25800
8338 1 17 . 1 1 63 63 ILE C C 63 177.800 177.800 177.909 -0.109 25800
8339 1 17 . 1 1 63 63 ILE CA C 63 65.600 65.600 62.617 2.983 25800
8340 1 17 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.326 0.574 25800
8341 1 17 . 1 1 63 63 ILE H H 63 7.540 7.540 8.437 -0.897 25800
8342 1 17 . 1 1 64 64 LYS N N 64 117.400 117.400 120.267 -2.867 25800
8343 1 17 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.085 -0.185 25800
8344 1 17 . 1 1 64 64 LYS C C 64 178.900 178.900 178.369 0.531 25800
8345 1 17 . 1 1 64 64 LYS CA C 64 58.800 58.800 59.051 -0.251 25800
8346 1 17 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.487 1.113 25800
8347 1 17 . 1 1 64 64 LYS H H 64 7.490 7.490 8.368 -0.878 25800
8348 1 17 . 1 1 65 65 GLU N N 65 113.800 113.800 118.236 -4.436 25800
8349 1 17 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.244 -0.084 25800
8350 1 17 . 1 1 65 65 GLU C C 65 178.300 178.300 177.549 0.751 25800
8351 1 17 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.241 0.059 25800
8352 1 17 . 1 1 65 65 GLU CB C 65 30.700 30.700 28.684 2.016 25800
8353 1 17 . 1 1 65 65 GLU H H 65 7.960 7.960 8.154 -0.194 25800
8354 1 17 . 1 1 66 66 LYS N N 66 114.700 114.700 117.658 -2.958 25800
8355 1 17 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.573 -0.103 25800
8356 1 17 . 1 1 66 66 LYS C C 66 177.500 177.500 176.352 1.148 25800
8357 1 17 . 1 1 66 66 LYS CA C 66 54.400 54.400 54.950 -0.549 25800
8358 1 17 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.015 0.985 25800
8359 1 17 . 1 1 66 66 LYS H H 66 8.050 8.050 7.665 0.385 25800
8360 1 17 . 1 1 67 67 ASP N N 67 118.800 118.800 120.462 -1.662 25800
8361 1 17 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.491 -0.271 25800
8362 1 17 . 1 1 67 67 ASP C C 67 177.700 177.700 177.677 0.023 25800
8363 1 17 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.291 4.109 25800
8364 1 17 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.241 0.159 25800
8365 1 17 . 1 1 67 67 ASP H H 67 7.620 7.620 7.523 0.097 25800
8366 1 17 . 1 1 68 68 GLY N N 68 115.600 115.600 108.027 7.573 25800
8367 1 17 . 1 1 68 68 GLY C C 68 173.800 173.800 174.743 -0.943 25800
8368 1 17 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.916 0.984 25800
8369 1 17 . 1 1 68 68 GLY H H 68 8.470 8.470 8.589 -0.119 25800
8370 1 17 . 1 1 69 69 CYS N N 69 119.200 119.200 120.635 -1.435 25800
8371 1 17 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.760 -0.600 25800
8372 1 17 . 1 1 69 69 CYS C C 69 172.600 172.600 174.856 -2.256 25800
8373 1 17 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.920 0.080 25800
8374 1 17 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.014 -0.314 25800
8375 1 17 . 1 1 69 69 CYS H H 69 7.890 7.890 8.117 -0.227 25800
8376 1 17 . 1 1 70 70 ASP N N 70 122.200 122.200 126.007 -3.807 25800
8377 1 17 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.006 -0.176 25800
8378 1 17 . 1 1 70 70 ASP C C 70 176.400 176.400 175.255 1.145 25800
8379 1 17 . 1 1 70 70 ASP CA C 70 54.700 54.700 54.206 0.494 25800
8380 1 17 . 1 1 70 70 ASP CB C 70 42.700 42.700 42.529 0.171 25800
8381 1 17 . 1 1 70 70 ASP H H 70 8.360 8.360 8.762 -0.402 25800
8382 1 17 . 1 1 71 71 PHE N N 71 127.600 127.600 119.950 7.650 25800
8383 1 17 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.015 -0.415 25800
8384 1 17 . 1 1 71 71 PHE C C 71 173.600 173.600 174.997 -1.397 25800
8385 1 17 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.639 0.161 25800
8386 1 17 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.550 -0.850 25800
8387 1 17 . 1 1 71 71 PHE H H 71 9.390 9.390 7.868 1.522 25800
8388 1 17 . 1 1 72 72 GLU N N 72 123.900 123.900 120.572 3.328 25800
8389 1 17 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.054 -0.514 25800
8390 1 17 . 1 1 72 72 GLU C C 72 175.500 175.500 176.538 -1.038 25800
8391 1 17 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.305 0.395 25800
8392 1 17 . 1 1 72 72 GLU CB C 72 27.300 27.300 29.298 -1.998 25800
8393 1 17 . 1 1 72 72 GLU H H 72 8.940 8.940 9.111 -0.171 25800
8394 1 17 . 1 1 73 73 GLY N N 73 105.200 105.200 111.610 -6.410 25800
8395 1 17 . 1 1 73 73 GLY C C 73 174.100 174.100 174.263 -0.163 25800
8396 1 17 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.817 0.783 25800
8397 1 17 . 1 1 73 73 GLY H H 73 8.350 8.350 8.523 -0.173 25800
8398 1 17 . 1 1 74 74 ASN N N 74 121.000 121.000 122.820 -1.820 25800
8399 1 17 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.729 0.031 25800
8400 1 17 . 1 1 74 74 ASN C C 74 174.000 174.000 174.042 -0.042 25800
8401 1 17 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.460 -2.560 25800
8402 1 17 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.283 0.417 25800
8403 1 17 . 1 1 74 74 ASN H H 74 7.740 7.740 8.307 -0.567 25800
8404 1 17 . 1 1 75 75 LYS N N 75 121.400 121.400 117.413 3.987 25800
8405 1 17 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.776 -0.306 25800
8406 1 17 . 1 1 75 75 LYS C C 75 176.900 176.900 174.490 2.410 25800
8407 1 17 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.400 -0.100 25800
8408 1 17 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.368 -1.468 25800
8409 1 17 . 1 1 75 75 LYS H H 75 8.380 8.380 8.219 0.161 25800
8410 1 17 . 1 1 76 76 LEU N N 76 127.400 127.400 124.259 3.141 25800
8411 1 17 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.649 -0.219 25800
8412 1 17 . 1 1 76 76 LEU C C 76 177.600 177.600 174.532 3.068 25800
8413 1 17 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.570 -0.270 25800
8414 1 17 . 1 1 76 76 LEU CB C 76 43.100 43.100 46.132 -3.032 25800
8415 1 17 . 1 1 76 76 LEU H H 76 8.950 8.950 8.203 0.747 25800
8416 1 17 . 1 1 77 77 ARG N N 77 121.800 121.800 125.273 -3.473 25800
8417 1 17 . 1 1 77 77 ARG HA H 77 4.900 4.900 5.000 -0.100 25800
8418 1 17 . 1 1 77 77 ARG C C 77 174.700 174.700 173.694 1.006 25800
8419 1 17 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.026 -1.026 25800
8420 1 17 . 1 1 77 77 ARG CB C 77 32.300 32.300 33.127 -0.827 25800
8421 1 17 . 1 1 77 77 ARG H H 77 7.530 7.530 9.015 -1.485 25800
8422 1 17 . 1 1 78 78 VAL N N 78 127.000 127.000 125.100 1.900 25800
8423 1 17 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.528 0.752 25800
8424 1 17 . 1 1 78 78 VAL C C 78 174.200 174.200 174.268 -0.068 25800
8425 1 17 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.451 -0.251 25800
8426 1 17 . 1 1 78 78 VAL CB C 78 33.400 33.400 35.139 -1.739 25800
8427 1 17 . 1 1 78 78 VAL H H 78 9.660 9.660 8.623 1.037 25800
8428 1 17 . 1 1 79 79 GLU N N 79 121.900 121.900 126.383 -4.483 25800
8429 1 17 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.651 0.059 25800
8430 1 17 . 1 1 79 79 GLU C C 79 174.600 174.600 173.919 0.681 25800
8431 1 17 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.628 -1.728 25800
8432 1 17 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.436 -0.036 25800
8433 1 17 . 1 1 79 79 GLU H H 79 8.980 8.980 8.255 0.725 25800
8434 1 17 . 1 1 80 80 VAL N N 80 121.300 121.300 124.193 -2.893 25800
8435 1 17 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.497 -0.127 25800
8436 1 17 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.085 2.915 25800
8437 1 17 . 1 1 80 80 VAL CB C 80 32.100 32.100 34.499 -2.399 25800
8438 1 17 . 1 1 80 80 VAL H H 80 8.410 8.410 8.431 -0.021 25800
8439 1 17 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.396 -0.136 25800
8440 1 17 . 1 1 81 81 PRO C C 81 176.100 176.100 176.959 -0.859 25800
8441 1 17 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.703 -1.603 25800
8442 1 17 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.720 0.380 25800
8443 1 17 . 1 1 82 82 PHE N N 82 122.200 122.200 115.094 7.106 25800
8444 1 17 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.839 -0.549 25800
8445 1 17 . 1 1 82 82 PHE C C 82 175.300 175.300 175.076 0.224 25800
8446 1 17 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.513 2.587 25800
8447 1 17 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.042 2.358 25800
8448 1 17 . 1 1 82 82 PHE H H 82 8.150 8.150 7.895 0.255 25800
8449 1 17 . 1 1 83 83 ASN N N 83 120.800 120.800 118.913 1.887 25800
8450 1 17 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.345 0.095 25800
8451 1 17 . 1 1 83 83 ASN C C 83 174.100 174.100 175.653 -1.553 25800
8452 1 17 . 1 1 83 83 ASN CA C 83 52.700 52.700 54.459 -1.759 25800
8453 1 17 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.459 0.241 25800
8454 1 17 . 1 1 83 83 ASN H H 83 8.110 8.110 7.857 0.253 25800
8455 1 17 . 1 1 84 84 ALA N N 84 123.700 123.700 120.827 2.873 25800
8456 1 17 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.563 -0.483 25800
8457 1 17 . 1 1 84 84 ALA C C 84 177.100 177.100 176.694 0.406 25800
8458 1 17 . 1 1 84 84 ALA CA C 84 52.400 52.400 50.948 1.452 25800
8459 1 17 . 1 1 84 84 ALA CB C 84 19.100 19.100 21.473 -2.373 25800
8460 1 17 . 1 1 84 84 ALA H H 84 8.020 8.020 7.534 0.486 25800
8461 1 17 . 1 1 85 85 ARG N N 85 120.200 120.200 119.766 0.434 25800
8462 1 17 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.202 -0.052 25800
8463 1 17 . 1 1 85 85 ARG C C 85 175.200 175.200 176.273 -1.073 25800
8464 1 17 . 1 1 85 85 ARG CA C 85 56.000 56.000 58.087 -2.087 25800
8465 1 17 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.699 0.101 25800
8466 1 17 . 1 1 85 85 ARG H H 85 8.040 8.040 8.657 -0.617 25800
8467 1 18 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.979 -0.389 25800
8468 1 18 . 1 1 0 0 HIS C C 0 174.000 174.000 175.015 -1.015 25800
8469 1 18 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.280 -0.980 25800
8470 1 18 . 1 1 0 0 HIS CB C 0 29.300 29.300 29.748 -0.449 25800
8471 1 18 . 1 1 1 1 MET N N 1 122.400 122.400 118.855 3.545 25800
8472 1 18 . 1 1 1 1 MET HA H 1 4.340 4.340 4.453 -0.113 25800
8473 1 18 . 1 1 1 1 MET C C 1 175.600 175.600 176.938 -1.338 25800
8474 1 18 . 1 1 1 1 MET CA C 1 55.600 55.600 56.321 -0.721 25800
8475 1 18 . 1 1 1 1 MET CB C 1 32.800 32.800 33.405 -0.605 25800
8476 1 18 . 1 1 1 1 MET H H 1 8.310 8.310 8.309 0.001 25800
8477 1 18 . 1 1 2 2 VAL N N 2 123.200 123.200 117.734 5.466 25800
8478 1 18 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.084 -0.124 25800
8479 1 18 . 1 1 2 2 VAL C C 2 175.600 175.600 176.463 -0.863 25800
8480 1 18 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.501 -0.201 25800
8481 1 18 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.037 0.263 25800
8482 1 18 . 1 1 2 2 VAL H H 2 8.180 8.180 7.821 0.359 25800
8483 1 18 . 1 1 3 3 ILE N N 3 126.200 126.200 117.541 8.659 25800
8484 1 18 . 1 1 3 3 ILE HA H 3 4.050 4.050 3.833 0.216 25800
8485 1 18 . 1 1 3 3 ILE C C 3 175.800 175.800 175.043 0.757 25800
8486 1 18 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.797 -1.097 25800
8487 1 18 . 1 1 3 3 ILE CB C 3 38.300 38.300 36.182 2.118 25800
8488 1 18 . 1 1 3 3 ILE H H 3 8.230 8.230 8.396 -0.166 25800
8489 1 18 . 1 1 4 4 ARG N N 4 126.100 126.100 120.837 5.263 25800
8490 1 18 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.555 -0.375 25800
8491 1 18 . 1 1 4 4 ARG C C 4 175.900 175.900 174.926 0.974 25800
8492 1 18 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.348 -0.348 25800
8493 1 18 . 1 1 4 4 ARG CB C 4 30.700 30.700 31.043 -0.343 25800
8494 1 18 . 1 1 4 4 ARG H H 4 8.360 8.360 8.230 0.130 25800
8495 1 18 . 1 1 5 5 GLU N N 5 122.200 122.200 120.007 2.193 25800
8496 1 18 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.642 -0.502 25800
8497 1 18 . 1 1 5 5 GLU C C 5 176.100 176.100 175.161 0.939 25800
8498 1 18 . 1 1 5 5 GLU CA C 5 56.600 56.600 55.337 1.263 25800
8499 1 18 . 1 1 5 5 GLU CB C 5 30.300 30.300 30.550 -0.250 25800
8500 1 18 . 1 1 5 5 GLU H H 5 8.400 8.400 8.101 0.299 25800
8501 1 18 . 1 1 6 6 SER N N 6 116.200 116.200 115.452 0.748 25800
8502 1 18 . 1 1 6 6 SER HA H 6 4.350 4.350 4.348 0.002 25800
8503 1 18 . 1 1 6 6 SER C C 6 174.300 174.300 173.252 1.048 25800
8504 1 18 . 1 1 6 6 SER CA C 6 58.200 58.200 58.437 -0.237 25800
8505 1 18 . 1 1 6 6 SER CB C 6 63.800 63.800 63.936 -0.136 25800
8506 1 18 . 1 1 6 6 SER H H 6 8.270 8.270 8.482 -0.212 25800
8507 1 18 . 1 1 7 7 VAL N N 7 119.800 119.800 119.802 -0.002 25800
8508 1 18 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.362 -0.062 25800
8509 1 18 . 1 1 7 7 VAL C C 7 175.500 175.500 175.466 0.034 25800
8510 1 18 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.476 0.224 25800
8511 1 18 . 1 1 7 7 VAL CB C 7 32.800 32.800 33.378 -0.578 25800
8512 1 18 . 1 1 7 7 VAL H H 7 7.840 7.840 8.836 -0.996 25800
8513 1 18 . 1 1 8 8 SER N N 8 117.800 117.800 116.546 1.254 25800
8514 1 18 . 1 1 8 8 SER HA H 8 4.240 4.240 4.580 -0.340 25800
8515 1 18 . 1 1 8 8 SER C C 8 172.500 172.500 173.353 -0.853 25800
8516 1 18 . 1 1 8 8 SER CA C 8 58.500 58.500 58.074 0.426 25800
8517 1 18 . 1 1 8 8 SER CB C 8 63.600 63.600 62.342 1.258 25800
8518 1 18 . 1 1 8 8 SER H H 8 8.530 8.530 8.560 -0.030 25800
8519 1 18 . 1 1 9 9 ARG N N 9 123.000 123.000 127.487 -4.487 25800
8520 1 18 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.403 0.097 25800
8521 1 18 . 1 1 9 9 ARG C C 9 175.000 175.000 176.024 -1.024 25800
8522 1 18 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.726 -0.426 25800
8523 1 18 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.912 -0.512 25800
8524 1 18 . 1 1 9 9 ARG H H 9 7.350 7.350 8.356 -1.006 25800
8525 1 18 . 1 1 10 10 ILE N N 10 114.000 114.000 122.330 -8.330 25800
8526 1 18 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.037 0.783 25800
8527 1 18 . 1 1 10 10 ILE C C 10 173.000 173.000 174.400 -1.400 25800
8528 1 18 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.542 -2.142 25800
8529 1 18 . 1 1 10 10 ILE CB C 10 40.900 40.900 38.962 1.938 25800
8530 1 18 . 1 1 10 10 ILE H H 10 8.830 8.830 8.770 0.060 25800
8531 1 18 . 1 1 11 11 TYR N N 11 123.400 123.400 126.674 -3.274 25800
8532 1 18 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.759 0.171 25800
8533 1 18 . 1 1 11 11 TYR C C 11 173.000 173.000 173.305 -0.305 25800
8534 1 18 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.611 0.389 25800
8535 1 18 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.336 -0.436 25800
8536 1 18 . 1 1 11 11 TYR H H 11 8.690 8.690 7.879 0.811 25800
8537 1 18 . 1 1 12 12 VAL N N 12 126.300 126.300 126.317 -0.017 25800
8538 1 18 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.400 0.160 25800
8539 1 18 . 1 1 12 12 VAL C C 12 174.100 174.100 174.322 -0.222 25800
8540 1 18 . 1 1 12 12 VAL CA C 12 60.200 60.200 60.345 -0.145 25800
8541 1 18 . 1 1 12 12 VAL CB C 12 33.400 33.400 34.933 -1.533 25800
8542 1 18 . 1 1 12 12 VAL H H 12 8.370 8.370 7.839 0.531 25800
8543 1 18 . 1 1 13 13 GLY N N 13 113.000 113.000 109.901 3.099 25800
8544 1 18 . 1 1 13 13 GLY C C 13 173.100 173.100 172.888 0.212 25800
8545 1 18 . 1 1 13 13 GLY CA C 13 43.300 43.300 44.020 -0.720 25800
8546 1 18 . 1 1 13 13 GLY H H 13 9.350 9.350 8.729 0.621 25800
8547 1 18 . 1 1 14 14 ASN N N 14 113.900 113.900 115.920 -2.020 25800
8548 1 18 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.090 0.190 25800
8549 1 18 . 1 1 14 14 ASN C C 14 175.800 175.800 175.250 0.550 25800
8550 1 18 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.582 -0.982 25800
8551 1 18 . 1 1 14 14 ASN CB C 14 37.700 37.700 37.495 0.205 25800
8552 1 18 . 1 1 14 14 ASN H H 14 8.800 8.800 8.077 0.723 25800
8553 1 18 . 1 1 15 15 LEU N N 15 115.800 115.800 115.212 0.588 25800
8554 1 18 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.472 0.518 25800
8555 1 18 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.980 1.620 25800
8556 1 18 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.302 0.298 25800
8557 1 18 . 1 1 15 15 LEU H H 15 7.150 7.150 7.119 0.031 25800
8558 1 18 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.495 -0.425 25800
8559 1 18 . 1 1 16 16 PRO C C 16 171.500 171.500 177.373 -5.873 25800
8560 1 18 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.347 -0.847 25800
8561 1 18 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.471 0.528 25800
8562 1 18 . 1 1 17 17 SER N N 17 115.200 115.200 117.510 -2.310 25800
8563 1 18 . 1 1 17 17 SER HA H 17 4.300 4.300 4.089 0.211 25800
8564 1 18 . 1 1 17 17 SER C C 17 174.200 174.200 173.832 0.368 25800
8565 1 18 . 1 1 17 17 SER CA C 17 58.200 58.200 58.872 -0.672 25800
8566 1 18 . 1 1 17 17 SER CB C 17 63.900 63.900 63.468 0.432 25800
8567 1 18 . 1 1 17 17 SER H H 17 8.470 8.470 8.471 -0.001 25800
8568 1 18 . 1 1 18 18 HIS N N 18 120.800 120.800 120.692 0.108 25800
8569 1 18 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.814 -0.264 25800
8570 1 18 . 1 1 18 18 HIS C C 18 175.100 175.100 174.519 0.581 25800
8571 1 18 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.334 0.166 25800
8572 1 18 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.992 -0.693 25800
8573 1 18 . 1 1 18 18 HIS H H 18 8.540 8.540 8.406 0.134 25800
8574 1 18 . 1 1 19 19 VAL N N 19 115.700 115.700 121.835 -6.135 25800
8575 1 18 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.118 0.142 25800
8576 1 18 . 1 1 19 19 VAL C C 19 174.000 174.000 175.642 -1.642 25800
8577 1 18 . 1 1 19 19 VAL CA C 19 61.900 61.900 62.586 -0.686 25800
8578 1 18 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.304 0.296 25800
8579 1 18 . 1 1 19 19 VAL H H 19 6.650 6.650 7.889 -1.239 25800
8580 1 18 . 1 1 20 20 SER N N 20 118.800 118.800 121.284 -2.484 25800
8581 1 18 . 1 1 20 20 SER HA H 20 4.710 4.710 4.607 0.103 25800
8582 1 18 . 1 1 20 20 SER C C 20 175.900 175.900 175.571 0.329 25800
8583 1 18 . 1 1 20 20 SER CA C 20 55.800 55.800 57.739 -1.939 25800
8584 1 18 . 1 1 20 20 SER CB C 20 66.600 66.600 64.578 2.022 25800
8585 1 18 . 1 1 20 20 SER H H 20 8.930 8.930 8.606 0.324 25800
8586 1 18 . 1 1 21 21 SER N N 21 117.100 117.100 121.075 -3.975 25800
8587 1 18 . 1 1 21 21 SER HA H 21 3.880 3.880 4.071 -0.191 25800
8588 1 18 . 1 1 21 21 SER C C 21 176.200 176.200 176.326 -0.126 25800
8589 1 18 . 1 1 21 21 SER CA C 21 62.300 62.300 61.741 0.559 25800
8590 1 18 . 1 1 21 21 SER CB C 21 66.800 66.800 63.344 3.456 25800
8591 1 18 . 1 1 21 21 SER H H 21 9.080 9.080 9.073 0.007 25800
8592 1 18 . 1 1 22 22 ARG N N 22 121.200 121.200 117.526 3.674 25800
8593 1 18 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.244 -0.254 25800
8594 1 18 . 1 1 22 22 ARG C C 22 177.900 177.900 178.177 -0.277 25800
8595 1 18 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.502 0.198 25800
8596 1 18 . 1 1 22 22 ARG CB C 22 29.600 29.600 28.953 0.647 25800
8597 1 18 . 1 1 22 22 ARG H H 22 7.940 7.940 8.605 -0.665 25800
8598 1 18 . 1 1 23 23 ASP N N 23 118.800 118.800 121.248 -2.448 25800
8599 1 18 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.553 -0.163 25800
8600 1 18 . 1 1 23 23 ASP C C 23 179.200 179.200 178.246 0.954 25800
8601 1 18 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.923 0.377 25800
8602 1 18 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.570 0.430 25800
8603 1 18 . 1 1 23 23 ASP H H 23 7.480 7.480 7.904 -0.424 25800
8604 1 18 . 1 1 24 24 VAL N N 24 119.500 119.500 119.063 0.437 25800
8605 1 18 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.691 -0.321 25800
8606 1 18 . 1 1 24 24 VAL C C 24 177.500 177.500 177.593 -0.093 25800
8607 1 18 . 1 1 24 24 VAL CA C 24 66.900 66.900 65.786 1.114 25800
8608 1 18 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.434 -0.035 25800
8609 1 18 . 1 1 24 24 VAL H H 24 7.450 7.450 7.475 -0.025 25800
8610 1 18 . 1 1 25 25 GLU N N 25 121.400 121.400 120.855 0.545 25800
8611 1 18 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.992 -0.422 25800
8612 1 18 . 1 1 25 25 GLU C C 25 178.400 178.400 178.506 -0.106 25800
8613 1 18 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.239 0.361 25800
8614 1 18 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.324 0.276 25800
8615 1 18 . 1 1 25 25 GLU H H 25 8.580 8.580 8.532 0.048 25800
8616 1 18 . 1 1 26 26 ASN N N 26 114.800 114.800 115.167 -0.367 25800
8617 1 18 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.578 -0.258 25800
8618 1 18 . 1 1 26 26 ASN C C 26 177.400 177.400 176.694 0.706 25800
8619 1 18 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.272 0.628 25800
8620 1 18 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.500 -0.600 25800
8621 1 18 . 1 1 26 26 ASN H H 26 8.180 8.180 7.806 0.374 25800
8622 1 18 . 1 1 27 27 GLU N N 27 118.900 118.900 120.309 -1.409 25800
8623 1 18 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.229 -0.089 25800
8624 1 18 . 1 1 27 27 GLU C C 27 176.400 176.400 178.608 -2.208 25800
8625 1 18 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.511 -1.111 25800
8626 1 18 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.912 -0.512 25800
8627 1 18 . 1 1 27 27 GLU H H 27 7.340 7.340 7.503 -0.163 25800
8628 1 18 . 1 1 28 28 PHE N N 28 114.100 114.100 119.487 -5.387 25800
8629 1 18 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.833 -0.283 25800
8630 1 18 . 1 1 28 28 PHE C C 28 176.300 176.300 178.075 -1.775 25800
8631 1 18 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.284 -0.284 25800
8632 1 18 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.001 1.799 25800
8633 1 18 . 1 1 28 28 PHE H H 28 7.660 7.660 8.245 -0.585 25800
8634 1 18 . 1 1 29 29 ARG N N 29 121.700 121.700 119.663 2.037 25800
8635 1 18 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.435 -0.025 25800
8636 1 18 . 1 1 29 29 ARG C C 29 177.100 177.100 178.227 -1.127 25800
8637 1 18 . 1 1 29 29 ARG CA C 29 58.200 58.200 59.091 -0.891 25800
8638 1 18 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.653 -0.353 25800
8639 1 18 . 1 1 29 29 ARG H H 29 8.120 8.120 8.690 -0.570 25800
8640 1 18 . 1 1 30 30 LYS N N 30 117.200 117.200 119.878 -2.678 25800
8641 1 18 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.204 -0.374 25800
8642 1 18 . 1 1 30 30 LYS C C 30 177.100 177.100 177.335 -0.235 25800
8643 1 18 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.319 -0.519 25800
8644 1 18 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.609 -0.509 25800
8645 1 18 . 1 1 30 30 LYS H H 30 7.630 7.630 7.983 -0.353 25800
8646 1 18 . 1 1 31 31 TYR N N 31 117.100 117.100 117.949 -0.849 25800
8647 1 18 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.656 -0.506 25800
8648 1 18 . 1 1 31 31 TYR C C 31 174.400 174.400 175.283 -0.883 25800
8649 1 18 . 1 1 31 31 TYR CA C 31 59.900 59.900 57.668 2.232 25800
8650 1 18 . 1 1 31 31 TYR CB C 31 37.900 37.900 38.920 -1.020 25800
8651 1 18 . 1 1 31 31 TYR H H 31 7.410 7.410 8.047 -0.637 25800
8652 1 18 . 1 1 32 32 GLY N N 32 104.100 104.100 106.062 -1.962 25800
8653 1 18 . 1 1 32 32 GLY C C 32 177.000 177.000 172.491 4.509 25800
8654 1 18 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.425 0.075 25800
8655 1 18 . 1 1 32 32 GLY H H 32 7.240 7.240 7.525 -0.285 25800
8656 1 18 . 1 1 33 33 ASN N N 33 115.300 115.300 118.753 -3.453 25800
8657 1 18 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.751 -0.311 25800
8658 1 18 . 1 1 33 33 ASN C C 33 175.500 175.500 174.840 0.660 25800
8659 1 18 . 1 1 33 33 ASN CA C 33 54.300 54.300 54.211 0.090 25800
8660 1 18 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.205 -0.805 25800
8661 1 18 . 1 1 33 33 ASN H H 33 8.460 8.460 8.504 -0.044 25800
8662 1 18 . 1 1 34 34 ILE N N 34 126.700 126.700 125.156 1.544 25800
8663 1 18 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.492 -0.702 25800
8664 1 18 . 1 1 34 34 ILE C C 34 175.600 175.600 175.234 0.366 25800
8665 1 18 . 1 1 34 34 ILE CA C 34 61.300 61.300 60.535 0.765 25800
8666 1 18 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.640 1.360 25800
8667 1 18 . 1 1 34 34 ILE H H 34 8.050 8.050 8.440 -0.390 25800
8668 1 18 . 1 1 35 35 LEU N N 35 127.400 127.400 128.781 -1.381 25800
8669 1 18 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.534 -0.374 25800
8670 1 18 . 1 1 35 35 LEU C C 35 177.200 177.200 176.446 0.754 25800
8671 1 18 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.367 0.133 25800
8672 1 18 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.617 0.083 25800
8673 1 18 . 1 1 35 35 LEU H H 35 8.780 8.780 8.575 0.205 25800
8674 1 18 . 1 1 36 36 LYS N N 36 117.000 117.000 118.087 -1.087 25800
8675 1 18 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.503 -0.263 25800
8676 1 18 . 1 1 36 36 LYS C C 36 173.600 173.600 173.710 -0.110 25800
8677 1 18 . 1 1 36 36 LYS CA C 36 55.900 55.900 56.184 -0.284 25800
8678 1 18 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.366 1.234 25800
8679 1 18 . 1 1 36 36 LYS H H 36 7.110 7.110 7.610 -0.500 25800
8680 1 18 . 1 1 37 37 CYS N N 37 125.400 125.400 124.745 0.655 25800
8681 1 18 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.393 -0.693 25800
8682 1 18 . 1 1 37 37 CYS C C 37 171.600 171.600 172.742 -1.142 25800
8683 1 18 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.407 0.493 25800
8684 1 18 . 1 1 37 37 CYS CB C 37 27.100 27.100 29.173 -2.073 25800
8685 1 18 . 1 1 37 37 CYS H H 37 8.610 8.610 8.909 -0.299 25800
8686 1 18 . 1 1 38 38 ASP N N 38 128.200 128.200 128.636 -0.436 25800
8687 1 18 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.108 -0.158 25800
8688 1 18 . 1 1 38 38 ASP C C 38 174.300 174.300 173.869 0.431 25800
8689 1 18 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.667 -0.467 25800
8690 1 18 . 1 1 38 38 ASP CB C 38 44.300 44.300 46.461 -2.161 25800
8691 1 18 . 1 1 38 38 ASP H H 38 8.290 8.290 9.030 -0.740 25800
8692 1 18 . 1 1 39 39 VAL N N 39 123.500 123.500 120.739 2.761 25800
8693 1 18 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.961 -0.661 25800
8694 1 18 . 1 1 39 39 VAL C C 39 175.000 175.000 175.476 -0.476 25800
8695 1 18 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.475 0.225 25800
8696 1 18 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.021 -0.921 25800
8697 1 18 . 1 1 39 39 VAL H H 39 8.380 8.380 8.565 -0.185 25800
8698 1 18 . 1 1 40 40 LYS N N 40 129.100 129.100 127.739 1.361 25800
8699 1 18 . 1 1 40 40 LYS HA H 40 4.320 4.320 5.075 -0.755 25800
8700 1 18 . 1 1 40 40 LYS C C 40 173.700 173.700 174.864 -1.164 25800
8701 1 18 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.711 -0.811 25800
8702 1 18 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.448 0.052 25800
8703 1 18 . 1 1 40 40 LYS H H 40 8.680 8.680 9.356 -0.676 25800
8704 1 18 . 1 1 41 41 LYS N N 41 117.300 117.300 120.254 -2.954 25800
8705 1 18 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.277 -0.297 25800
8706 1 18 . 1 1 41 41 LYS C C 41 177.800 177.800 175.527 2.273 25800
8707 1 18 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.649 -0.049 25800
8708 1 18 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.258 -0.258 25800
8709 1 18 . 1 1 41 41 LYS H H 41 7.900 7.900 8.371 -0.471 25800
8710 1 18 . 1 1 42 42 THR N N 42 113.200 113.200 115.564 -2.364 25800
8711 1 18 . 1 1 42 42 THR HA H 42 4.680 4.680 4.736 -0.056 25800
8712 1 18 . 1 1 42 42 THR C C 42 176.900 176.900 176.551 0.349 25800
8713 1 18 . 1 1 42 42 THR CA C 42 60.200 60.200 60.476 -0.276 25800
8714 1 18 . 1 1 42 42 THR CB C 42 71.600 71.600 69.969 1.631 25800
8715 1 18 . 1 1 42 42 THR H H 42 8.730 8.730 8.436 0.294 25800
8716 1 18 . 1 1 43 43 VAL N N 43 120.000 120.000 124.173 -4.173 25800
8717 1 18 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.019 -0.099 25800
8718 1 18 . 1 1 43 43 VAL C C 43 177.000 177.000 176.545 0.455 25800
8719 1 18 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.466 0.234 25800
8720 1 18 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.726 0.074 25800
8721 1 18 . 1 1 43 43 VAL H H 43 8.730 8.730 8.551 0.179 25800
8722 1 18 . 1 1 44 44 SER N N 44 113.400 113.400 115.492 -2.092 25800
8723 1 18 . 1 1 44 44 SER HA H 44 4.360 4.360 4.366 -0.006 25800
8724 1 18 . 1 1 44 44 SER C C 44 174.800 174.800 175.445 -0.645 25800
8725 1 18 . 1 1 44 44 SER CA C 44 58.400 58.400 58.641 -0.241 25800
8726 1 18 . 1 1 44 44 SER CB C 44 63.500 63.500 63.503 -0.003 25800
8727 1 18 . 1 1 44 44 SER H H 44 7.760 7.760 8.001 -0.241 25800
8728 1 18 . 1 1 45 45 GLY N N 45 110.200 110.200 108.496 1.704 25800
8729 1 18 . 1 1 45 45 GLY C C 45 173.500 173.500 173.808 -0.308 25800
8730 1 18 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.764 0.536 25800
8731 1 18 . 1 1 45 45 GLY H H 45 7.820 7.820 7.712 0.108 25800
8732 1 18 . 1 1 46 46 ALA N N 46 123.900 123.900 122.896 1.004 25800
8733 1 18 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.223 0.167 25800
8734 1 18 . 1 1 46 46 ALA C C 46 176.100 176.100 175.845 0.255 25800
8735 1 18 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.711 0.189 25800
8736 1 18 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.725 0.075 25800
8737 1 18 . 1 1 46 46 ALA H H 46 7.440 7.440 7.831 -0.391 25800
8738 1 18 . 1 1 47 47 ALA N N 47 123.100 123.100 124.775 -1.675 25800
8739 1 18 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.041 0.159 25800
8740 1 18 . 1 1 47 47 ALA C C 47 176.100 176.100 175.785 0.315 25800
8741 1 18 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.390 0.510 25800
8742 1 18 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.334 0.566 25800
8743 1 18 . 1 1 47 47 ALA H H 47 8.350 8.350 8.107 0.243 25800
8744 1 18 . 1 1 48 48 PHE N N 48 118.700 118.700 118.066 0.634 25800
8745 1 18 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.187 -0.157 25800
8746 1 18 . 1 1 48 48 PHE C C 48 171.600 171.600 174.210 -2.610 25800
8747 1 18 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.437 -0.737 25800
8748 1 18 . 1 1 48 48 PHE CB C 48 41.200 41.200 42.927 -1.727 25800
8749 1 18 . 1 1 48 48 PHE H H 48 8.550 8.550 8.915 -0.365 25800
8750 1 18 . 1 1 49 49 ALA N N 49 120.400 120.400 125.238 -4.838 25800
8751 1 18 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.086 0.244 25800
8752 1 18 . 1 1 49 49 ALA C C 49 175.500 175.500 175.520 -0.020 25800
8753 1 18 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.514 -1.214 25800
8754 1 18 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.256 2.444 25800
8755 1 18 . 1 1 49 49 ALA H H 49 9.240 9.240 8.688 0.551 25800
8756 1 18 . 1 1 50 50 PHE N N 50 115.000 115.000 121.782 -6.782 25800
8757 1 18 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.448 0.152 25800
8758 1 18 . 1 1 50 50 PHE C C 50 176.000 176.000 174.273 1.727 25800
8759 1 18 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.664 -0.164 25800
8760 1 18 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.048 -0.848 25800
8761 1 18 . 1 1 50 50 PHE H H 50 7.920 7.920 9.117 -1.197 25800
8762 1 18 . 1 1 51 51 ILE N N 51 123.000 123.000 122.466 0.534 25800
8763 1 18 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.829 -0.379 25800
8764 1 18 . 1 1 51 51 ILE C C 51 173.700 173.700 174.583 -0.883 25800
8765 1 18 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.381 -0.181 25800
8766 1 18 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.964 -1.264 25800
8767 1 18 . 1 1 51 51 ILE H H 51 8.490 8.490 8.310 0.180 25800
8768 1 18 . 1 1 52 52 GLU N N 52 126.600 126.600 125.374 1.226 25800
8769 1 18 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.200 -0.430 25800
8770 1 18 . 1 1 52 52 GLU C C 52 175.300 175.300 175.893 -0.593 25800
8771 1 18 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.739 -1.039 25800
8772 1 18 . 1 1 52 52 GLU CB C 52 31.500 31.500 31.615 -0.115 25800
8773 1 18 . 1 1 52 52 GLU H H 52 8.610 8.610 8.826 -0.216 25800
8774 1 18 . 1 1 53 53 PHE N N 53 126.100 126.100 124.048 2.052 25800
8775 1 18 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.018 -0.218 25800
8776 1 18 . 1 1 53 53 PHE C C 53 175.400 175.400 175.794 -0.394 25800
8777 1 18 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.502 1.698 25800
8778 1 18 . 1 1 53 53 PHE CB C 53 40.900 40.900 42.255 -1.355 25800
8779 1 18 . 1 1 53 53 PHE H H 53 8.800 8.800 8.804 -0.004 25800
8780 1 18 . 1 1 54 54 GLU N N 54 120.700 120.700 120.549 0.151 25800
8781 1 18 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.178 -0.248 25800
8782 1 18 . 1 1 54 54 GLU C C 54 175.300 175.300 176.154 -0.854 25800
8783 1 18 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.742 1.357 25800
8784 1 18 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.276 0.523 25800
8785 1 18 . 1 1 54 54 GLU H H 54 8.160 8.160 8.642 -0.482 25800
8786 1 18 . 1 1 55 55 ASP N N 55 117.900 117.900 118.356 -0.456 25800
8787 1 18 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.708 0.212 25800
8788 1 18 . 1 1 55 55 ASP C C 55 176.400 176.400 175.398 1.002 25800
8789 1 18 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.261 -0.861 25800
8790 1 18 . 1 1 55 55 ASP CB C 55 44.400 44.400 43.055 1.345 25800
8791 1 18 . 1 1 55 55 ASP H H 55 8.740 8.740 7.659 1.081 25800
8792 1 18 . 1 1 56 56 ALA N N 56 128.900 128.900 127.551 1.349 25800
8793 1 18 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.650 0.180 25800
8794 1 18 . 1 1 56 56 ALA C C 56 179.800 179.800 178.713 1.087 25800
8795 1 18 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.294 0.906 25800
8796 1 18 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.457 -0.558 25800
8797 1 18 . 1 1 56 56 ALA H H 56 8.800 8.800 8.535 0.265 25800
8798 1 18 . 1 1 57 57 ARG N N 57 119.200 119.200 118.056 1.144 25800
8799 1 18 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.122 -0.232 25800
8800 1 18 . 1 1 57 57 ARG C C 57 178.000 178.000 177.033 0.967 25800
8801 1 18 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.534 0.366 25800
8802 1 18 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.270 0.030 25800
8803 1 18 . 1 1 57 57 ARG H H 57 8.950 8.950 8.417 0.533 25800
8804 1 18 . 1 1 58 58 ASP N N 58 120.900 120.900 119.811 1.089 25800
8805 1 18 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.530 -0.440 25800
8806 1 18 . 1 1 58 58 ASP C C 58 176.700 176.700 177.729 -1.029 25800
8807 1 18 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.643 -0.143 25800
8808 1 18 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.624 -0.724 25800
8809 1 18 . 1 1 58 58 ASP H H 58 7.020 7.020 8.092 -1.072 25800
8810 1 18 . 1 1 59 59 ALA N N 59 119.700 119.700 122.119 -2.419 25800
8811 1 18 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.725 -0.645 25800
8812 1 18 . 1 1 59 59 ALA C C 59 178.100 178.100 179.390 -1.290 25800
8813 1 18 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.307 -0.007 25800
8814 1 18 . 1 1 59 59 ALA CB C 59 18.400 18.400 17.981 0.419 25800
8815 1 18 . 1 1 59 59 ALA H H 59 6.440 6.440 7.256 -0.816 25800
8816 1 18 . 1 1 60 60 ALA N N 60 117.600 117.600 121.415 -3.815 25800
8817 1 18 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.015 -0.185 25800
8818 1 18 . 1 1 60 60 ALA C C 60 180.900 180.900 178.800 2.100 25800
8819 1 18 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.001 -0.101 25800
8820 1 18 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.340 -0.640 25800
8821 1 18 . 1 1 60 60 ALA H H 60 7.330 7.330 8.220 -0.890 25800
8822 1 18 . 1 1 61 61 ASP N N 61 120.100 120.100 117.807 2.293 25800
8823 1 18 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.506 -0.296 25800
8824 1 18 . 1 1 61 61 ASP C C 61 176.700 176.700 176.992 -0.292 25800
8825 1 18 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.330 0.770 25800
8826 1 18 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.552 -0.452 25800
8827 1 18 . 1 1 61 61 ASP H H 61 7.590 7.590 7.810 -0.220 25800
8828 1 18 . 1 1 62 62 ALA N N 62 122.200 122.200 121.398 0.802 25800
8829 1 18 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.860 -1.440 25800
8830 1 18 . 1 1 62 62 ALA C C 62 179.300 179.300 179.431 -0.131 25800
8831 1 18 . 1 1 62 62 ALA CA C 62 54.600 54.600 53.918 0.682 25800
8832 1 18 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.899 0.201 25800
8833 1 18 . 1 1 62 62 ALA H H 62 7.440 7.440 7.317 0.123 25800
8834 1 18 . 1 1 63 63 ILE N N 63 116.700 116.700 119.681 -2.981 25800
8835 1 18 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.763 -0.523 25800
8836 1 18 . 1 1 63 63 ILE C C 63 177.800 177.800 176.905 0.895 25800
8837 1 18 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.747 1.853 25800
8838 1 18 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.863 1.037 25800
8839 1 18 . 1 1 63 63 ILE H H 63 7.540 7.540 7.472 0.068 25800
8840 1 18 . 1 1 64 64 LYS N N 64 117.400 117.400 118.797 -1.397 25800
8841 1 18 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.322 -0.422 25800
8842 1 18 . 1 1 64 64 LYS C C 64 178.900 178.900 177.621 1.279 25800
8843 1 18 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.047 0.753 25800
8844 1 18 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.729 0.871 25800
8845 1 18 . 1 1 64 64 LYS H H 64 7.490 7.490 7.742 -0.252 25800
8846 1 18 . 1 1 65 65 GLU N N 65 113.800 113.800 118.311 -4.511 25800
8847 1 18 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.329 -0.169 25800
8848 1 18 . 1 1 65 65 GLU C C 65 178.300 178.300 177.369 0.931 25800
8849 1 18 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.746 0.554 25800
8850 1 18 . 1 1 65 65 GLU CB C 65 30.700 30.700 30.175 0.525 25800
8851 1 18 . 1 1 65 65 GLU H H 65 7.960 7.960 8.020 -0.060 25800
8852 1 18 . 1 1 66 66 LYS N N 66 114.700 114.700 118.291 -3.591 25800
8853 1 18 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.437 0.033 25800
8854 1 18 . 1 1 66 66 LYS C C 66 177.500 177.500 177.241 0.259 25800
8855 1 18 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.705 -1.304 25800
8856 1 18 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.841 0.159 25800
8857 1 18 . 1 1 66 66 LYS H H 66 8.050 8.050 7.728 0.322 25800
8858 1 18 . 1 1 67 67 ASP N N 67 118.800 118.800 120.124 -1.324 25800
8859 1 18 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.473 -0.253 25800
8860 1 18 . 1 1 67 67 ASP C C 67 177.700 177.700 177.554 0.146 25800
8861 1 18 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.192 4.208 25800
8862 1 18 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.283 0.117 25800
8863 1 18 . 1 1 67 67 ASP H H 67 7.620 7.620 7.865 -0.245 25800
8864 1 18 . 1 1 68 68 GLY N N 68 115.600 115.600 107.110 8.490 25800
8865 1 18 . 1 1 68 68 GLY C C 68 173.800 173.800 174.597 -0.797 25800
8866 1 18 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.775 1.125 25800
8867 1 18 . 1 1 68 68 GLY H H 68 8.470 8.470 8.565 -0.095 25800
8868 1 18 . 1 1 69 69 CYS N N 69 119.200 119.200 120.565 -1.365 25800
8869 1 18 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.905 -0.745 25800
8870 1 18 . 1 1 69 69 CYS C C 69 172.600 172.600 174.792 -2.192 25800
8871 1 18 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.234 0.766 25800
8872 1 18 . 1 1 69 69 CYS CB C 69 28.700 28.700 28.105 0.595 25800
8873 1 18 . 1 1 69 69 CYS H H 69 7.890 7.890 8.092 -0.202 25800
8874 1 18 . 1 1 70 70 ASP N N 70 122.200 122.200 126.625 -4.425 25800
8875 1 18 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.600 0.230 25800
8876 1 18 . 1 1 70 70 ASP C C 70 176.400 176.400 174.985 1.415 25800
8877 1 18 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.670 1.030 25800
8878 1 18 . 1 1 70 70 ASP CB C 70 42.700 42.700 42.824 -0.124 25800
8879 1 18 . 1 1 70 70 ASP H H 70 8.360 8.360 8.814 -0.454 25800
8880 1 18 . 1 1 71 71 PHE N N 71 127.600 127.600 118.826 8.774 25800
8881 1 18 . 1 1 71 71 PHE HA H 71 4.600 4.600 4.959 -0.359 25800
8882 1 18 . 1 1 71 71 PHE C C 71 173.600 173.600 175.217 -1.617 25800
8883 1 18 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.814 -0.014 25800
8884 1 18 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.056 -0.356 25800
8885 1 18 . 1 1 71 71 PHE H H 71 9.390 9.390 7.485 1.905 25800
8886 1 18 . 1 1 72 72 GLU N N 72 123.900 123.900 118.603 5.297 25800
8887 1 18 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.186 -0.646 25800
8888 1 18 . 1 1 72 72 GLU C C 72 175.500 175.500 175.665 -0.165 25800
8889 1 18 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.090 -0.390 25800
8890 1 18 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.989 -1.689 25800
8891 1 18 . 1 1 72 72 GLU H H 72 8.940 8.940 9.128 -0.188 25800
8892 1 18 . 1 1 73 73 GLY N N 73 105.200 105.200 104.740 0.460 25800
8893 1 18 . 1 1 73 73 GLY C C 73 174.100 174.100 173.768 0.332 25800
8894 1 18 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.222 0.378 25800
8895 1 18 . 1 1 73 73 GLY H H 73 8.350 8.350 7.977 0.373 25800
8896 1 18 . 1 1 74 74 ASN N N 74 121.000 121.000 122.140 -1.140 25800
8897 1 18 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.692 0.068 25800
8898 1 18 . 1 1 74 74 ASN C C 74 174.000 174.000 174.184 -0.184 25800
8899 1 18 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.585 -2.685 25800
8900 1 18 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.230 0.470 25800
8901 1 18 . 1 1 74 74 ASN H H 74 7.740 7.740 8.488 -0.748 25800
8902 1 18 . 1 1 75 75 LYS N N 75 121.400 121.400 117.877 3.523 25800
8903 1 18 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.683 -0.213 25800
8904 1 18 . 1 1 75 75 LYS C C 75 176.900 176.900 174.454 2.446 25800
8905 1 18 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.265 0.035 25800
8906 1 18 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.661 -0.761 25800
8907 1 18 . 1 1 75 75 LYS H H 75 8.380 8.380 8.340 0.040 25800
8908 1 18 . 1 1 76 76 LEU N N 76 127.400 127.400 123.677 3.723 25800
8909 1 18 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.630 -0.200 25800
8910 1 18 . 1 1 76 76 LEU C C 76 177.600 177.600 174.489 3.111 25800
8911 1 18 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.431 -0.131 25800
8912 1 18 . 1 1 76 76 LEU CB C 76 43.100 43.100 45.915 -2.815 25800
8913 1 18 . 1 1 76 76 LEU H H 76 8.950 8.950 7.853 1.097 25800
8914 1 18 . 1 1 77 77 ARG N N 77 121.800 121.800 125.145 -3.345 25800
8915 1 18 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.984 -0.084 25800
8916 1 18 . 1 1 77 77 ARG C C 77 174.700 174.700 173.624 1.076 25800
8917 1 18 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.090 -1.091 25800
8918 1 18 . 1 1 77 77 ARG CB C 77 32.300 32.300 33.770 -1.470 25800
8919 1 18 . 1 1 77 77 ARG H H 77 7.530 7.530 8.872 -1.342 25800
8920 1 18 . 1 1 78 78 VAL N N 78 127.000 127.000 124.815 2.185 25800
8921 1 18 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.573 0.707 25800
8922 1 18 . 1 1 78 78 VAL C C 78 174.200 174.200 174.229 -0.029 25800
8923 1 18 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.533 -0.333 25800
8924 1 18 . 1 1 78 78 VAL CB C 78 33.400 33.400 35.048 -1.648 25800
8925 1 18 . 1 1 78 78 VAL H H 78 9.660 9.660 8.627 1.033 25800
8926 1 18 . 1 1 79 79 GLU N N 79 121.900 121.900 126.143 -4.243 25800
8927 1 18 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.608 0.102 25800
8928 1 18 . 1 1 79 79 GLU C C 79 174.600 174.600 174.056 0.544 25800
8929 1 18 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.854 -1.954 25800
8930 1 18 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.340 0.060 25800
8931 1 18 . 1 1 79 79 GLU H H 79 8.980 8.980 8.500 0.480 25800
8932 1 18 . 1 1 80 80 VAL N N 80 121.300 121.300 124.004 -2.704 25800
8933 1 18 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.327 0.043 25800
8934 1 18 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.977 2.023 25800
8935 1 18 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.533 -1.433 25800
8936 1 18 . 1 1 80 80 VAL H H 80 8.410 8.410 8.442 -0.032 25800
8937 1 18 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.326 -0.066 25800
8938 1 18 . 1 1 81 81 PRO C C 81 176.100 176.100 177.067 -0.967 25800
8939 1 18 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.781 -1.681 25800
8940 1 18 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.730 0.370 25800
8941 1 18 . 1 1 82 82 PHE N N 82 122.200 122.200 114.865 7.335 25800
8942 1 18 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.646 -0.356 25800
8943 1 18 . 1 1 82 82 PHE C C 82 175.300 175.300 175.856 -0.556 25800
8944 1 18 . 1 1 82 82 PHE CA C 82 58.100 58.100 55.811 2.289 25800
8945 1 18 . 1 1 82 82 PHE CB C 82 39.400 39.400 37.946 1.454 25800
8946 1 18 . 1 1 82 82 PHE H H 82 8.150 8.150 7.833 0.317 25800
8947 1 18 . 1 1 83 83 ASN N N 83 120.800 120.800 120.116 0.684 25800
8948 1 18 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.532 -0.092 25800
8949 1 18 . 1 1 83 83 ASN C C 83 174.100 174.100 174.545 -0.445 25800
8950 1 18 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.743 -1.043 25800
8951 1 18 . 1 1 83 83 ASN CB C 83 38.700 38.700 37.471 1.229 25800
8952 1 18 . 1 1 83 83 ASN H H 83 8.110 8.110 7.832 0.278 25800
8953 1 18 . 1 1 84 84 ALA N N 84 123.700 123.700 123.012 0.688 25800
8954 1 18 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.424 -0.344 25800
8955 1 18 . 1 1 84 84 ALA C C 84 177.100 177.100 177.184 -0.084 25800
8956 1 18 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.872 -0.472 25800
8957 1 18 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.895 -0.795 25800
8958 1 18 . 1 1 84 84 ALA H H 84 8.020 8.020 8.227 -0.207 25800
8959 1 18 . 1 1 85 85 ARG N N 85 120.200 120.200 119.690 0.510 25800
8960 1 18 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.132 0.018 25800
8961 1 18 . 1 1 85 85 ARG C C 85 175.200 175.200 174.827 0.373 25800
8962 1 18 . 1 1 85 85 ARG CA C 85 56.000 56.000 57.026 -1.026 25800
8963 1 18 . 1 1 85 85 ARG CB C 85 30.800 30.800 28.522 2.278 25800
8964 1 18 . 1 1 85 85 ARG H H 85 8.040 8.040 8.761 -0.721 25800
8965 1 19 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.698 -0.108 25800
8966 1 19 . 1 1 0 0 HIS C C 0 174.000 174.000 174.586 -0.586 25800
8967 1 19 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.225 -0.925 25800
8968 1 19 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.563 -1.263 25800
8969 1 19 . 1 1 1 1 MET N N 1 122.400 122.400 117.157 5.243 25800
8970 1 19 . 1 1 1 1 MET HA H 1 4.340 4.340 4.705 -0.365 25800
8971 1 19 . 1 1 1 1 MET C C 1 175.600 175.600 173.664 1.936 25800
8972 1 19 . 1 1 1 1 MET CA C 1 55.600 55.600 54.964 0.636 25800
8973 1 19 . 1 1 1 1 MET CB C 1 32.800 32.800 34.804 -2.004 25800
8974 1 19 . 1 1 1 1 MET H H 1 8.310 8.310 7.791 0.519 25800
8975 1 19 . 1 1 2 2 VAL N N 2 123.200 123.200 120.396 2.804 25800
8976 1 19 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.830 -0.870 25800
8977 1 19 . 1 1 2 2 VAL C C 2 175.600 175.600 174.505 1.095 25800
8978 1 19 . 1 1 2 2 VAL CA C 2 62.300 62.300 61.739 0.561 25800
8979 1 19 . 1 1 2 2 VAL CB C 2 32.300 32.300 34.740 -2.441 25800
8980 1 19 . 1 1 2 2 VAL H H 2 8.180 8.180 8.272 -0.092 25800
8981 1 19 . 1 1 3 3 ILE N N 3 126.200 126.200 129.353 -3.153 25800
8982 1 19 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.210 -0.160 25800
8983 1 19 . 1 1 3 3 ILE C C 3 175.800 175.800 174.591 1.209 25800
8984 1 19 . 1 1 3 3 ILE CA C 3 60.700 60.700 60.857 -0.157 25800
8985 1 19 . 1 1 3 3 ILE CB C 3 38.300 38.300 39.885 -1.585 25800
8986 1 19 . 1 1 3 3 ILE H H 3 8.230 8.230 8.377 -0.147 25800
8987 1 19 . 1 1 4 4 ARG N N 4 126.100 126.100 124.234 1.866 25800
8988 1 19 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.305 -0.125 25800
8989 1 19 . 1 1 4 4 ARG C C 4 175.900 175.900 175.826 0.074 25800
8990 1 19 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.374 -0.374 25800
8991 1 19 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.412 0.288 25800
8992 1 19 . 1 1 4 4 ARG H H 4 8.360 8.360 8.321 0.039 25800
8993 1 19 . 1 1 5 5 GLU N N 5 122.200 122.200 120.951 1.249 25800
8994 1 19 . 1 1 5 5 GLU HA H 5 4.140 4.140 3.952 0.188 25800
8995 1 19 . 1 1 5 5 GLU C C 5 176.100 176.100 177.366 -1.266 25800
8996 1 19 . 1 1 5 5 GLU CA C 5 56.600 56.600 57.140 -0.540 25800
8997 1 19 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.647 0.653 25800
8998 1 19 . 1 1 5 5 GLU H H 5 8.400 8.400 8.643 -0.243 25800
8999 1 19 . 1 1 6 6 SER N N 6 116.200 116.200 118.025 -1.825 25800
9000 1 19 . 1 1 6 6 SER HA H 6 4.350 4.350 4.429 -0.079 25800
9001 1 19 . 1 1 6 6 SER C C 6 174.300 174.300 174.856 -0.556 25800
9002 1 19 . 1 1 6 6 SER CA C 6 58.200 58.200 59.941 -1.741 25800
9003 1 19 . 1 1 6 6 SER CB C 6 63.800 63.800 63.929 -0.129 25800
9004 1 19 . 1 1 6 6 SER H H 6 8.270 8.270 8.634 -0.364 25800
9005 1 19 . 1 1 7 7 VAL N N 7 119.800 119.800 116.014 3.786 25800
9006 1 19 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.023 0.277 25800
9007 1 19 . 1 1 7 7 VAL C C 7 175.500 175.500 174.495 1.005 25800
9008 1 19 . 1 1 7 7 VAL CA C 7 61.700 61.700 63.184 -1.484 25800
9009 1 19 . 1 1 7 7 VAL CB C 7 32.800 32.800 31.961 0.839 25800
9010 1 19 . 1 1 7 7 VAL H H 7 7.840 7.840 7.777 0.063 25800
9011 1 19 . 1 1 8 8 SER N N 8 117.800 117.800 120.910 -3.110 25800
9012 1 19 . 1 1 8 8 SER HA H 8 4.240 4.240 4.691 -0.451 25800
9013 1 19 . 1 1 8 8 SER C C 8 172.500 172.500 173.460 -0.960 25800
9014 1 19 . 1 1 8 8 SER CA C 8 58.500 58.500 58.618 -0.118 25800
9015 1 19 . 1 1 8 8 SER CB C 8 63.600 63.600 64.620 -1.020 25800
9016 1 19 . 1 1 8 8 SER H H 8 8.530 8.530 8.551 -0.021 25800
9017 1 19 . 1 1 9 9 ARG N N 9 123.000 123.000 122.366 0.634 25800
9018 1 19 . 1 1 9 9 ARG HA H 9 5.500 5.500 4.667 0.833 25800
9019 1 19 . 1 1 9 9 ARG C C 9 175.000 175.000 175.025 -0.025 25800
9020 1 19 . 1 1 9 9 ARG CA C 9 54.300 54.300 55.026 -0.726 25800
9021 1 19 . 1 1 9 9 ARG CB C 9 33.400 33.400 32.734 0.666 25800
9022 1 19 . 1 1 9 9 ARG H H 9 7.350 7.350 8.454 -1.104 25800
9023 1 19 . 1 1 10 10 ILE N N 10 114.000 114.000 118.252 -4.252 25800
9024 1 19 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.430 0.390 25800
9025 1 19 . 1 1 10 10 ILE C C 10 173.000 173.000 172.747 0.253 25800
9026 1 19 . 1 1 10 10 ILE CA C 10 59.400 59.400 59.612 -0.212 25800
9027 1 19 . 1 1 10 10 ILE CB C 10 40.900 40.900 41.350 -0.450 25800
9028 1 19 . 1 1 10 10 ILE H H 10 8.830 8.830 7.969 0.861 25800
9029 1 19 . 1 1 11 11 TYR N N 11 123.400 123.400 125.770 -2.370 25800
9030 1 19 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.195 -0.265 25800
9031 1 19 . 1 1 11 11 TYR C C 11 173.000 173.000 173.230 -0.230 25800
9032 1 19 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.324 0.676 25800
9033 1 19 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.472 -0.572 25800
9034 1 19 . 1 1 11 11 TYR H H 11 8.690 8.690 8.067 0.623 25800
9035 1 19 . 1 1 12 12 VAL N N 12 126.300 126.300 122.972 3.328 25800
9036 1 19 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.608 -0.048 25800
9037 1 19 . 1 1 12 12 VAL C C 12 174.100 174.100 174.887 -0.787 25800
9038 1 19 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.500 0.700 25800
9039 1 19 . 1 1 12 12 VAL CB C 12 33.400 33.400 31.733 1.667 25800
9040 1 19 . 1 1 12 12 VAL H H 12 8.370 8.370 7.885 0.485 25800
9041 1 19 . 1 1 13 13 GLY N N 13 113.000 113.000 112.668 0.332 25800
9042 1 19 . 1 1 13 13 GLY C C 13 173.100 173.100 174.021 -0.921 25800
9043 1 19 . 1 1 13 13 GLY CA C 13 43.300 43.300 44.107 -0.807 25800
9044 1 19 . 1 1 13 13 GLY H H 13 9.350 9.350 8.120 1.230 25800
9045 1 19 . 1 1 14 14 ASN N N 14 113.900 113.900 117.562 -3.662 25800
9046 1 19 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.230 0.050 25800
9047 1 19 . 1 1 14 14 ASN C C 14 175.800 175.800 174.851 0.949 25800
9048 1 19 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.297 -0.697 25800
9049 1 19 . 1 1 14 14 ASN CB C 14 37.700 37.700 36.823 0.877 25800
9050 1 19 . 1 1 14 14 ASN H H 14 8.800 8.800 8.601 0.199 25800
9051 1 19 . 1 1 15 15 LEU N N 15 115.800 115.800 114.957 0.843 25800
9052 1 19 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.548 0.442 25800
9053 1 19 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.724 1.876 25800
9054 1 19 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.830 -0.230 25800
9055 1 19 . 1 1 15 15 LEU H H 15 7.150 7.150 7.382 -0.232 25800
9056 1 19 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.384 -0.314 25800
9057 1 19 . 1 1 16 16 PRO C C 16 171.500 171.500 177.015 -5.515 25800
9058 1 19 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.133 -0.633 25800
9059 1 19 . 1 1 16 16 PRO CB C 16 32.000 32.000 30.904 1.096 25800
9060 1 19 . 1 1 17 17 SER N N 17 115.200 115.200 118.394 -3.194 25800
9061 1 19 . 1 1 17 17 SER HA H 17 4.300 4.300 4.118 0.182 25800
9062 1 19 . 1 1 17 17 SER C C 17 174.200 174.200 173.971 0.229 25800
9063 1 19 . 1 1 17 17 SER CA C 17 58.200 58.200 57.989 0.211 25800
9064 1 19 . 1 1 17 17 SER CB C 17 63.900 63.900 63.626 0.274 25800
9065 1 19 . 1 1 17 17 SER H H 17 8.470 8.470 8.690 -0.220 25800
9066 1 19 . 1 1 18 18 HIS N N 18 120.800 120.800 122.530 -1.730 25800
9067 1 19 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.504 0.046 25800
9068 1 19 . 1 1 18 18 HIS C C 18 175.100 175.100 173.946 1.154 25800
9069 1 19 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.693 -0.193 25800
9070 1 19 . 1 1 18 18 HIS CB C 18 29.300 29.300 30.482 -1.182 25800
9071 1 19 . 1 1 18 18 HIS H H 18 8.540 8.540 8.185 0.355 25800
9072 1 19 . 1 1 19 19 VAL N N 19 115.700 115.700 122.600 -6.900 25800
9073 1 19 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.281 -0.021 25800
9074 1 19 . 1 1 19 19 VAL C C 19 174.000 174.000 175.780 -1.780 25800
9075 1 19 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.315 0.585 25800
9076 1 19 . 1 1 19 19 VAL CB C 19 32.600 32.600 34.804 -2.204 25800
9077 1 19 . 1 1 19 19 VAL H H 19 6.650 6.650 8.352 -1.702 25800
9078 1 19 . 1 1 20 20 SER N N 20 118.800 118.800 122.393 -3.593 25800
9079 1 19 . 1 1 20 20 SER HA H 20 4.710 4.710 4.714 -0.004 25800
9080 1 19 . 1 1 20 20 SER C C 20 175.900 175.900 175.716 0.184 25800
9081 1 19 . 1 1 20 20 SER CA C 20 55.800 55.800 58.142 -2.342 25800
9082 1 19 . 1 1 20 20 SER CB C 20 66.600 66.600 64.229 2.371 25800
9083 1 19 . 1 1 20 20 SER H H 20 8.930 8.930 8.666 0.264 25800
9084 1 19 . 1 1 21 21 SER N N 21 117.100 117.100 120.626 -3.526 25800
9085 1 19 . 1 1 21 21 SER HA H 21 3.880 3.880 4.198 -0.318 25800
9086 1 19 . 1 1 21 21 SER C C 21 176.200 176.200 176.504 -0.304 25800
9087 1 19 . 1 1 21 21 SER CA C 21 62.300 62.300 61.310 0.990 25800
9088 1 19 . 1 1 21 21 SER CB C 21 66.800 66.800 63.022 3.778 25800
9089 1 19 . 1 1 21 21 SER H H 21 9.080 9.080 8.936 0.144 25800
9090 1 19 . 1 1 22 22 ARG N N 22 121.200 121.200 121.819 -0.619 25800
9091 1 19 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.159 -0.169 25800
9092 1 19 . 1 1 22 22 ARG C C 22 177.900 177.900 177.934 -0.034 25800
9093 1 19 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.228 -0.528 25800
9094 1 19 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.699 -0.099 25800
9095 1 19 . 1 1 22 22 ARG H H 22 7.940 7.940 8.588 -0.648 25800
9096 1 19 . 1 1 23 23 ASP N N 23 118.800 118.800 118.785 0.015 25800
9097 1 19 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.494 -0.104 25800
9098 1 19 . 1 1 23 23 ASP C C 23 179.200 179.200 178.803 0.397 25800
9099 1 19 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.436 -0.136 25800
9100 1 19 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.349 0.651 25800
9101 1 19 . 1 1 23 23 ASP H H 23 7.480 7.480 7.611 -0.131 25800
9102 1 19 . 1 1 24 24 VAL N N 24 119.500 119.500 117.564 1.936 25800
9103 1 19 . 1 1 24 24 VAL HA H 24 3.370 3.370 4.082 -0.712 25800
9104 1 19 . 1 1 24 24 VAL C C 24 177.500 177.500 177.802 -0.302 25800
9105 1 19 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.402 0.498 25800
9106 1 19 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.569 -0.169 25800
9107 1 19 . 1 1 24 24 VAL H H 24 7.450 7.450 7.854 -0.404 25800
9108 1 19 . 1 1 25 25 GLU N N 25 121.400 121.400 120.620 0.780 25800
9109 1 19 . 1 1 25 25 GLU HA H 25 3.570 3.570 4.062 -0.492 25800
9110 1 19 . 1 1 25 25 GLU C C 25 178.400 178.400 179.161 -0.761 25800
9111 1 19 . 1 1 25 25 GLU CA C 25 60.600 60.600 59.792 0.807 25800
9112 1 19 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.426 0.174 25800
9113 1 19 . 1 1 25 25 GLU H H 25 8.580 8.580 8.523 0.057 25800
9114 1 19 . 1 1 26 26 ASN N N 26 114.800 114.800 116.294 -1.494 25800
9115 1 19 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.584 -0.264 25800
9116 1 19 . 1 1 26 26 ASN C C 26 177.400 177.400 176.972 0.428 25800
9117 1 19 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.404 0.497 25800
9118 1 19 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.887 -0.987 25800
9119 1 19 . 1 1 26 26 ASN H H 26 8.180 8.180 8.260 -0.080 25800
9120 1 19 . 1 1 27 27 GLU N N 27 118.900 118.900 119.396 -0.496 25800
9121 1 19 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.201 -0.061 25800
9122 1 19 . 1 1 27 27 GLU C C 27 176.400 176.400 178.672 -2.272 25800
9123 1 19 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.584 -1.184 25800
9124 1 19 . 1 1 27 27 GLU CB C 27 29.400 29.400 30.100 -0.700 25800
9125 1 19 . 1 1 27 27 GLU H H 27 7.340 7.340 8.080 -0.740 25800
9126 1 19 . 1 1 28 28 PHE N N 28 114.100 114.100 118.798 -4.698 25800
9127 1 19 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.672 -0.122 25800
9128 1 19 . 1 1 28 28 PHE C C 28 176.300 176.300 177.651 -1.351 25800
9129 1 19 . 1 1 28 28 PHE CA C 28 60.000 60.000 61.521 -1.521 25800
9130 1 19 . 1 1 28 28 PHE CB C 28 40.800 40.800 39.501 1.299 25800
9131 1 19 . 1 1 28 28 PHE H H 28 7.660 7.660 8.563 -0.903 25800
9132 1 19 . 1 1 29 29 ARG N N 29 121.700 121.700 118.570 3.130 25800
9133 1 19 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.226 0.184 25800
9134 1 19 . 1 1 29 29 ARG C C 29 177.100 177.100 177.111 -0.011 25800
9135 1 19 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.215 -0.015 25800
9136 1 19 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.570 -0.270 25800
9137 1 19 . 1 1 29 29 ARG H H 29 8.120 8.120 7.995 0.125 25800
9138 1 19 . 1 1 30 30 LYS N N 30 117.200 117.200 119.145 -1.945 25800
9139 1 19 . 1 1 30 30 LYS HA H 30 3.830 3.830 3.923 -0.093 25800
9140 1 19 . 1 1 30 30 LYS C C 30 177.100 177.100 178.138 -1.038 25800
9141 1 19 . 1 1 30 30 LYS CA C 30 57.800 57.800 57.963 -0.163 25800
9142 1 19 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.744 -0.644 25800
9143 1 19 . 1 1 30 30 LYS H H 30 7.630 7.630 7.447 0.183 25800
9144 1 19 . 1 1 31 31 TYR N N 31 117.100 117.100 117.507 -0.407 25800
9145 1 19 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.368 -0.218 25800
9146 1 19 . 1 1 31 31 TYR C C 31 174.400 174.400 175.737 -1.337 25800
9147 1 19 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.572 0.328 25800
9148 1 19 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.433 -1.533 25800
9149 1 19 . 1 1 31 31 TYR H H 31 7.410 7.410 7.433 -0.023 25800
9150 1 19 . 1 1 32 32 GLY N N 32 104.100 104.100 103.316 0.784 25800
9151 1 19 . 1 1 32 32 GLY C C 32 177.000 177.000 171.577 5.423 25800
9152 1 19 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.347 0.153 25800
9153 1 19 . 1 1 32 32 GLY H H 32 7.240 7.240 6.746 0.494 25800
9154 1 19 . 1 1 33 33 ASN N N 33 115.300 115.300 119.526 -4.226 25800
9155 1 19 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.655 -0.215 25800
9156 1 19 . 1 1 33 33 ASN C C 33 175.500 175.500 175.018 0.482 25800
9157 1 19 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.855 0.445 25800
9158 1 19 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.981 -0.581 25800
9159 1 19 . 1 1 33 33 ASN H H 33 8.460 8.460 8.607 -0.147 25800
9160 1 19 . 1 1 34 34 ILE N N 34 126.700 126.700 126.490 0.210 25800
9161 1 19 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.642 -0.852 25800
9162 1 19 . 1 1 34 34 ILE C C 34 175.600 175.600 175.598 0.002 25800
9163 1 19 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.929 -0.629 25800
9164 1 19 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.473 1.527 25800
9165 1 19 . 1 1 34 34 ILE H H 34 8.050 8.050 8.592 -0.542 25800
9166 1 19 . 1 1 35 35 LEU N N 35 127.400 127.400 129.289 -1.889 25800
9167 1 19 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.537 -0.377 25800
9168 1 19 . 1 1 35 35 LEU C C 35 177.200 177.200 176.656 0.544 25800
9169 1 19 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.705 -0.205 25800
9170 1 19 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.588 0.112 25800
9171 1 19 . 1 1 35 35 LEU H H 35 8.780 8.780 8.993 -0.213 25800
9172 1 19 . 1 1 36 36 LYS N N 36 117.000 117.000 117.928 -0.928 25800
9173 1 19 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.677 -0.437 25800
9174 1 19 . 1 1 36 36 LYS C C 36 173.600 173.600 174.375 -0.775 25800
9175 1 19 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.814 0.086 25800
9176 1 19 . 1 1 36 36 LYS CB C 36 36.600 36.600 36.430 0.170 25800
9177 1 19 . 1 1 36 36 LYS H H 36 7.110 7.110 7.693 -0.583 25800
9178 1 19 . 1 1 37 37 CYS N N 37 125.400 125.400 119.063 6.337 25800
9179 1 19 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.784 -1.084 25800
9180 1 19 . 1 1 37 37 CYS C C 37 171.600 171.600 173.056 -1.456 25800
9181 1 19 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.453 1.447 25800
9182 1 19 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.982 -4.882 25800
9183 1 19 . 1 1 37 37 CYS H H 37 8.610 8.610 8.588 0.022 25800
9184 1 19 . 1 1 38 38 ASP N N 38 128.200 128.200 121.113 7.087 25800
9185 1 19 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.027 -0.077 25800
9186 1 19 . 1 1 38 38 ASP C C 38 174.300 174.300 174.151 0.149 25800
9187 1 19 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.747 -0.547 25800
9188 1 19 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.693 -1.393 25800
9189 1 19 . 1 1 38 38 ASP H H 38 8.290 8.290 9.040 -0.750 25800
9190 1 19 . 1 1 39 39 VAL N N 39 123.500 123.500 121.358 2.142 25800
9191 1 19 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.725 -0.425 25800
9192 1 19 . 1 1 39 39 VAL C C 39 175.000 175.000 175.941 -0.941 25800
9193 1 19 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.837 -0.136 25800
9194 1 19 . 1 1 39 39 VAL CB C 39 33.100 33.100 33.209 -0.109 25800
9195 1 19 . 1 1 39 39 VAL H H 39 8.380 8.380 8.583 -0.203 25800
9196 1 19 . 1 1 40 40 LYS N N 40 129.100 129.100 127.386 1.714 25800
9197 1 19 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.771 -0.451 25800
9198 1 19 . 1 1 40 40 LYS C C 40 173.700 173.700 174.841 -1.141 25800
9199 1 19 . 1 1 40 40 LYS CA C 40 53.900 53.900 53.926 -0.026 25800
9200 1 19 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.695 -0.195 25800
9201 1 19 . 1 1 40 40 LYS H H 40 8.680 8.680 9.429 -0.749 25800
9202 1 19 . 1 1 41 41 LYS N N 41 117.300 117.300 120.892 -3.592 25800
9203 1 19 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.093 -0.113 25800
9204 1 19 . 1 1 41 41 LYS C C 41 177.800 177.800 175.909 1.891 25800
9205 1 19 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.960 -0.360 25800
9206 1 19 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.819 -0.819 25800
9207 1 19 . 1 1 41 41 LYS H H 41 7.900 7.900 8.528 -0.628 25800
9208 1 19 . 1 1 42 42 THR N N 42 113.200 113.200 117.084 -3.884 25800
9209 1 19 . 1 1 42 42 THR HA H 42 4.680 4.680 4.831 -0.151 25800
9210 1 19 . 1 1 42 42 THR C C 42 176.900 176.900 176.065 0.835 25800
9211 1 19 . 1 1 42 42 THR CA C 42 60.200 60.200 60.188 0.012 25800
9212 1 19 . 1 1 42 42 THR CB C 42 71.600 71.600 70.008 1.592 25800
9213 1 19 . 1 1 42 42 THR H H 42 8.730 8.730 8.168 0.562 25800
9214 1 19 . 1 1 43 43 VAL N N 43 120.000 120.000 127.467 -7.467 25800
9215 1 19 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.908 0.012 25800
9216 1 19 . 1 1 43 43 VAL C C 43 177.000 177.000 176.672 0.328 25800
9217 1 19 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.520 0.180 25800
9218 1 19 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.910 -0.110 25800
9219 1 19 . 1 1 43 43 VAL H H 43 8.730 8.730 8.670 0.060 25800
9220 1 19 . 1 1 44 44 SER N N 44 113.400 113.400 114.367 -0.967 25800
9221 1 19 . 1 1 44 44 SER HA H 44 4.360 4.360 4.353 0.007 25800
9222 1 19 . 1 1 44 44 SER C C 44 174.800 174.800 175.418 -0.618 25800
9223 1 19 . 1 1 44 44 SER CA C 44 58.400 58.400 58.658 -0.258 25800
9224 1 19 . 1 1 44 44 SER CB C 44 63.500 63.500 63.499 0.001 25800
9225 1 19 . 1 1 44 44 SER H H 44 7.760 7.760 7.928 -0.168 25800
9226 1 19 . 1 1 45 45 GLY N N 45 110.200 110.200 108.599 1.601 25800
9227 1 19 . 1 1 45 45 GLY C C 45 173.500 173.500 173.855 -0.355 25800
9228 1 19 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.847 0.453 25800
9229 1 19 . 1 1 45 45 GLY H H 45 7.820 7.820 7.781 0.039 25800
9230 1 19 . 1 1 46 46 ALA N N 46 123.900 123.900 121.297 2.603 25800
9231 1 19 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.358 0.032 25800
9232 1 19 . 1 1 46 46 ALA C C 46 176.100 176.100 175.271 0.829 25800
9233 1 19 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.925 -0.025 25800
9234 1 19 . 1 1 46 46 ALA CB C 46 19.800 19.800 19.847 -0.047 25800
9235 1 19 . 1 1 46 46 ALA H H 46 7.440 7.440 7.672 -0.232 25800
9236 1 19 . 1 1 47 47 ALA N N 47 123.100 123.100 121.719 1.381 25800
9237 1 19 . 1 1 47 47 ALA HA H 47 5.200 5.200 4.787 0.413 25800
9238 1 19 . 1 1 47 47 ALA C C 47 176.100 176.100 175.051 1.049 25800
9239 1 19 . 1 1 47 47 ALA CA C 47 50.900 50.900 49.850 1.050 25800
9240 1 19 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.274 -0.374 25800
9241 1 19 . 1 1 47 47 ALA H H 47 8.350 8.350 7.904 0.446 25800
9242 1 19 . 1 1 48 48 PHE N N 48 118.700 118.700 116.189 2.511 25800
9243 1 19 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.348 -0.318 25800
9244 1 19 . 1 1 48 48 PHE C C 48 171.600 171.600 174.075 -2.475 25800
9245 1 19 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.356 -0.656 25800
9246 1 19 . 1 1 48 48 PHE CB C 48 41.200 41.200 42.248 -1.048 25800
9247 1 19 . 1 1 48 48 PHE H H 48 8.550 8.550 8.394 0.156 25800
9248 1 19 . 1 1 49 49 ALA N N 49 120.400 120.400 123.807 -3.407 25800
9249 1 19 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.358 -0.028 25800
9250 1 19 . 1 1 49 49 ALA C C 49 175.500 175.500 175.563 -0.063 25800
9251 1 19 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.450 -1.150 25800
9252 1 19 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.306 2.394 25800
9253 1 19 . 1 1 49 49 ALA H H 49 9.240 9.240 8.385 0.855 25800
9254 1 19 . 1 1 50 50 PHE N N 50 115.000 115.000 119.769 -4.769 25800
9255 1 19 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.561 0.039 25800
9256 1 19 . 1 1 50 50 PHE C C 50 176.000 176.000 174.529 1.471 25800
9257 1 19 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.564 -0.064 25800
9258 1 19 . 1 1 50 50 PHE CB C 50 42.200 42.200 42.619 -0.419 25800
9259 1 19 . 1 1 50 50 PHE H H 50 7.920 7.920 9.154 -1.234 25800
9260 1 19 . 1 1 51 51 ILE N N 51 123.000 123.000 121.154 1.846 25800
9261 1 19 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.897 -0.447 25800
9262 1 19 . 1 1 51 51 ILE C C 51 173.700 173.700 173.822 -0.122 25800
9263 1 19 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.190 0.010 25800
9264 1 19 . 1 1 51 51 ILE CB C 51 40.700 40.700 42.630 -1.930 25800
9265 1 19 . 1 1 51 51 ILE H H 51 8.490 8.490 8.523 -0.033 25800
9266 1 19 . 1 1 52 52 GLU N N 52 126.600 126.600 123.381 3.219 25800
9267 1 19 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.117 -0.347 25800
9268 1 19 . 1 1 52 52 GLU C C 52 175.300 175.300 174.921 0.379 25800
9269 1 19 . 1 1 52 52 GLU CA C 52 54.700 54.700 53.858 0.842 25800
9270 1 19 . 1 1 52 52 GLU CB C 52 31.500 31.500 33.171 -1.671 25800
9271 1 19 . 1 1 52 52 GLU H H 52 8.610 8.610 8.668 -0.058 25800
9272 1 19 . 1 1 53 53 PHE N N 53 126.100 126.100 124.168 1.932 25800
9273 1 19 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.447 -0.647 25800
9274 1 19 . 1 1 53 53 PHE C C 53 175.400 175.400 177.096 -1.696 25800
9275 1 19 . 1 1 53 53 PHE CA C 53 58.200 58.200 55.138 3.062 25800
9276 1 19 . 1 1 53 53 PHE CB C 53 40.900 40.900 41.301 -0.401 25800
9277 1 19 . 1 1 53 53 PHE H H 53 8.800 8.800 8.147 0.653 25800
9278 1 19 . 1 1 54 54 GLU N N 54 120.700 120.700 121.882 -1.182 25800
9279 1 19 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.113 -0.183 25800
9280 1 19 . 1 1 54 54 GLU C C 54 175.300 175.300 175.806 -0.506 25800
9281 1 19 . 1 1 54 54 GLU CA C 54 59.100 59.100 59.918 -0.818 25800
9282 1 19 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.467 0.333 25800
9283 1 19 . 1 1 54 54 GLU H H 54 8.160 8.160 8.654 -0.494 25800
9284 1 19 . 1 1 55 55 ASP N N 55 117.900 117.900 118.203 -0.303 25800
9285 1 19 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.913 0.007 25800
9286 1 19 . 1 1 55 55 ASP C C 55 176.400 176.400 175.764 0.636 25800
9287 1 19 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.505 -1.105 25800
9288 1 19 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.437 1.963 25800
9289 1 19 . 1 1 55 55 ASP H H 55 8.740 8.740 8.065 0.675 25800
9290 1 19 . 1 1 56 56 ALA N N 56 128.900 128.900 126.880 2.020 25800
9291 1 19 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.203 -0.373 25800
9292 1 19 . 1 1 56 56 ALA C C 56 179.800 179.800 178.800 1.000 25800
9293 1 19 . 1 1 56 56 ALA CA C 56 55.200 55.200 55.519 -0.319 25800
9294 1 19 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.995 -0.095 25800
9295 1 19 . 1 1 56 56 ALA H H 56 8.800 8.800 8.796 0.004 25800
9296 1 19 . 1 1 57 57 ARG N N 57 119.200 119.200 116.618 2.582 25800
9297 1 19 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.164 -0.274 25800
9298 1 19 . 1 1 57 57 ARG C C 57 178.000 178.000 177.446 0.554 25800
9299 1 19 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.243 0.657 25800
9300 1 19 . 1 1 57 57 ARG CB C 57 29.300 29.300 28.933 0.367 25800
9301 1 19 . 1 1 57 57 ARG H H 57 8.950 8.950 8.483 0.467 25800
9302 1 19 . 1 1 58 58 ASP N N 58 120.900 120.900 119.239 1.661 25800
9303 1 19 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.496 -0.406 25800
9304 1 19 . 1 1 58 58 ASP C C 58 176.700 176.700 177.667 -0.967 25800
9305 1 19 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.641 -0.141 25800
9306 1 19 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.592 -0.692 25800
9307 1 19 . 1 1 58 58 ASP H H 58 7.020 7.020 8.476 -1.456 25800
9308 1 19 . 1 1 59 59 ALA N N 59 119.700 119.700 120.671 -0.971 25800
9309 1 19 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.626 -1.546 25800
9310 1 19 . 1 1 59 59 ALA C C 59 178.100 178.100 179.054 -0.954 25800
9311 1 19 . 1 1 59 59 ALA CA C 59 54.300 54.300 53.298 1.002 25800
9312 1 19 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.679 -0.279 25800
9313 1 19 . 1 1 59 59 ALA H H 59 6.440 6.440 7.553 -1.113 25800
9314 1 19 . 1 1 60 60 ALA N N 60 117.600 117.600 122.889 -5.289 25800
9315 1 19 . 1 1 60 60 ALA HA H 60 3.830 3.830 3.979 -0.149 25800
9316 1 19 . 1 1 60 60 ALA C C 60 180.900 180.900 178.242 2.658 25800
9317 1 19 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.085 -0.185 25800
9318 1 19 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.381 -0.680 25800
9319 1 19 . 1 1 60 60 ALA H H 60 7.330 7.330 8.121 -0.791 25800
9320 1 19 . 1 1 61 61 ASP N N 61 120.100 120.100 118.679 1.421 25800
9321 1 19 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.434 -0.224 25800
9322 1 19 . 1 1 61 61 ASP C C 61 176.700 176.700 177.354 -0.654 25800
9323 1 19 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.449 0.651 25800
9324 1 19 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.265 -0.165 25800
9325 1 19 . 1 1 61 61 ASP H H 61 7.590 7.590 8.228 -0.638 25800
9326 1 19 . 1 1 62 62 ALA N N 62 122.200 122.200 122.422 -0.222 25800
9327 1 19 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.981 -1.561 25800
9328 1 19 . 1 1 62 62 ALA C C 62 179.300 179.300 179.310 -0.010 25800
9329 1 19 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.504 0.096 25800
9330 1 19 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.829 0.271 25800
9331 1 19 . 1 1 62 62 ALA H H 62 7.440 7.440 7.841 -0.401 25800
9332 1 19 . 1 1 63 63 ILE N N 63 116.700 116.700 119.160 -2.460 25800
9333 1 19 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.633 -0.393 25800
9334 1 19 . 1 1 63 63 ILE C C 63 177.800 177.800 177.989 -0.189 25800
9335 1 19 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.966 1.634 25800
9336 1 19 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.385 1.515 25800
9337 1 19 . 1 1 63 63 ILE H H 63 7.540 7.540 7.546 -0.006 25800
9338 1 19 . 1 1 64 64 LYS N N 64 117.400 117.400 117.893 -0.493 25800
9339 1 19 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.413 -0.513 25800
9340 1 19 . 1 1 64 64 LYS C C 64 178.900 178.900 176.950 1.950 25800
9341 1 19 . 1 1 64 64 LYS CA C 64 58.800 58.800 57.687 1.113 25800
9342 1 19 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.631 0.969 25800
9343 1 19 . 1 1 64 64 LYS H H 64 7.490 7.490 7.911 -0.421 25800
9344 1 19 . 1 1 65 65 GLU N N 65 113.800 113.800 115.925 -2.125 25800
9345 1 19 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.445 -0.285 25800
9346 1 19 . 1 1 65 65 GLU C C 65 178.300 178.300 177.151 1.149 25800
9347 1 19 . 1 1 65 65 GLU CA C 65 58.300 58.300 55.835 2.465 25800
9348 1 19 . 1 1 65 65 GLU CB C 65 30.700 30.700 31.292 -0.592 25800
9349 1 19 . 1 1 65 65 GLU H H 65 7.960 7.960 7.973 -0.013 25800
9350 1 19 . 1 1 66 66 LYS N N 66 114.700 114.700 118.877 -4.177 25800
9351 1 19 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.317 0.153 25800
9352 1 19 . 1 1 66 66 LYS C C 66 177.500 177.500 177.106 0.394 25800
9353 1 19 . 1 1 66 66 LYS CA C 66 54.400 54.400 56.888 -2.488 25800
9354 1 19 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.314 0.686 25800
9355 1 19 . 1 1 66 66 LYS H H 66 8.050 8.050 8.369 -0.319 25800
9356 1 19 . 1 1 67 67 ASP N N 67 118.800 118.800 119.545 -0.745 25800
9357 1 19 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.469 -0.249 25800
9358 1 19 . 1 1 67 67 ASP C C 67 177.700 177.700 177.290 0.410 25800
9359 1 19 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.332 4.068 25800
9360 1 19 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.026 0.374 25800
9361 1 19 . 1 1 67 67 ASP H H 67 7.620 7.620 7.817 -0.197 25800
9362 1 19 . 1 1 68 68 GLY N N 68 115.600 115.600 107.227 8.373 25800
9363 1 19 . 1 1 68 68 GLY C C 68 173.800 173.800 175.307 -1.507 25800
9364 1 19 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.823 1.077 25800
9365 1 19 . 1 1 68 68 GLY H H 68 8.470 8.470 8.608 -0.138 25800
9366 1 19 . 1 1 69 69 CYS N N 69 119.200 119.200 118.256 0.944 25800
9367 1 19 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.742 -0.582 25800
9368 1 19 . 1 1 69 69 CYS C C 69 172.600 172.600 174.627 -2.027 25800
9369 1 19 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.958 0.042 25800
9370 1 19 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.170 -0.470 25800
9371 1 19 . 1 1 69 69 CYS H H 69 7.890 7.890 8.169 -0.279 25800
9372 1 19 . 1 1 70 70 ASP N N 70 122.200 122.200 122.672 -0.472 25800
9373 1 19 . 1 1 70 70 ASP HA H 70 4.830 4.830 5.068 -0.238 25800
9374 1 19 . 1 1 70 70 ASP C C 70 176.400 176.400 174.284 2.116 25800
9375 1 19 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.564 1.136 25800
9376 1 19 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.165 -1.465 25800
9377 1 19 . 1 1 70 70 ASP H H 70 8.360 8.360 8.896 -0.536 25800
9378 1 19 . 1 1 71 71 PHE N N 71 127.600 127.600 120.506 7.094 25800
9379 1 19 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.020 -0.420 25800
9380 1 19 . 1 1 71 71 PHE C C 71 173.600 173.600 175.673 -2.073 25800
9381 1 19 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.405 -0.605 25800
9382 1 19 . 1 1 71 71 PHE CB C 71 40.700 40.700 42.233 -1.534 25800
9383 1 19 . 1 1 71 71 PHE H H 71 9.390 9.390 8.278 1.112 25800
9384 1 19 . 1 1 72 72 GLU N N 72 123.900 123.900 118.506 5.394 25800
9385 1 19 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.045 -0.505 25800
9386 1 19 . 1 1 72 72 GLU C C 72 175.500 175.500 175.295 0.205 25800
9387 1 19 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.314 -0.614 25800
9388 1 19 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.821 -1.521 25800
9389 1 19 . 1 1 72 72 GLU H H 72 8.940 8.940 8.604 0.336 25800
9390 1 19 . 1 1 73 73 GLY N N 73 105.200 105.200 104.356 0.844 25800
9391 1 19 . 1 1 73 73 GLY C C 73 174.100 174.100 174.027 0.073 25800
9392 1 19 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.022 0.578 25800
9393 1 19 . 1 1 73 73 GLY H H 73 8.350 8.350 7.958 0.392 25800
9394 1 19 . 1 1 74 74 ASN N N 74 121.000 121.000 120.293 0.707 25800
9395 1 19 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.844 -0.084 25800
9396 1 19 . 1 1 74 74 ASN C C 74 174.000 174.000 173.653 0.347 25800
9397 1 19 . 1 1 74 74 ASN CA C 74 50.900 50.900 53.032 -2.132 25800
9398 1 19 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.425 0.276 25800
9399 1 19 . 1 1 74 74 ASN H H 74 7.740 7.740 8.355 -0.615 25800
9400 1 19 . 1 1 75 75 LYS N N 75 121.400 121.400 121.239 0.161 25800
9401 1 19 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.470 0.000 25800
9402 1 19 . 1 1 75 75 LYS C C 75 176.900 176.900 174.485 2.415 25800
9403 1 19 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.811 -0.511 25800
9404 1 19 . 1 1 75 75 LYS CB C 75 31.900 31.900 32.607 -0.707 25800
9405 1 19 . 1 1 75 75 LYS H H 75 8.380 8.380 8.490 -0.110 25800
9406 1 19 . 1 1 76 76 LEU N N 76 127.400 127.400 123.321 4.079 25800
9407 1 19 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.665 -0.235 25800
9408 1 19 . 1 1 76 76 LEU C C 76 177.600 177.600 174.228 3.372 25800
9409 1 19 . 1 1 76 76 LEU CA C 76 55.300 55.300 54.778 0.522 25800
9410 1 19 . 1 1 76 76 LEU CB C 76 43.100 43.100 45.512 -2.412 25800
9411 1 19 . 1 1 76 76 LEU H H 76 8.950 8.950 8.195 0.755 25800
9412 1 19 . 1 1 77 77 ARG N N 77 121.800 121.800 125.846 -4.046 25800
9413 1 19 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.902 -0.002 25800
9414 1 19 . 1 1 77 77 ARG C C 77 174.700 174.700 173.698 1.002 25800
9415 1 19 . 1 1 77 77 ARG CA C 77 54.000 54.000 54.989 -0.989 25800
9416 1 19 . 1 1 77 77 ARG CB C 77 32.300 32.300 33.094 -0.794 25800
9417 1 19 . 1 1 77 77 ARG H H 77 7.530 7.530 8.603 -1.073 25800
9418 1 19 . 1 1 78 78 VAL N N 78 127.000 127.000 124.451 2.549 25800
9419 1 19 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.919 0.361 25800
9420 1 19 . 1 1 78 78 VAL C C 78 174.200 174.200 174.530 -0.330 25800
9421 1 19 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.948 0.252 25800
9422 1 19 . 1 1 78 78 VAL CB C 78 33.400 33.400 35.191 -1.791 25800
9423 1 19 . 1 1 78 78 VAL H H 78 9.660 9.660 8.468 1.192 25800
9424 1 19 . 1 1 79 79 GLU N N 79 121.900 121.900 126.430 -4.530 25800
9425 1 19 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.545 0.165 25800
9426 1 19 . 1 1 79 79 GLU C C 79 174.600 174.600 174.063 0.537 25800
9427 1 19 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.009 -1.109 25800
9428 1 19 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.119 0.281 25800
9429 1 19 . 1 1 79 79 GLU H H 79 8.980 8.980 8.118 0.862 25800
9430 1 19 . 1 1 80 80 VAL N N 80 121.300 121.300 120.156 1.144 25800
9431 1 19 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.317 0.053 25800
9432 1 19 . 1 1 80 80 VAL CA C 80 61.000 61.000 59.846 1.154 25800
9433 1 19 . 1 1 80 80 VAL CB C 80 32.100 32.100 31.863 0.237 25800
9434 1 19 . 1 1 80 80 VAL H H 80 8.410 8.410 8.280 0.130 25800
9435 1 19 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.074 0.186 25800
9436 1 19 . 1 1 81 81 PRO C C 81 176.100 176.100 176.234 -0.134 25800
9437 1 19 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.451 -1.351 25800
9438 1 19 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.811 0.289 25800
9439 1 19 . 1 1 82 82 PHE N N 82 122.200 122.200 114.006 8.194 25800
9440 1 19 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.391 -0.101 25800
9441 1 19 . 1 1 82 82 PHE C C 82 175.300 175.300 174.990 0.310 25800
9442 1 19 . 1 1 82 82 PHE CA C 82 58.100 58.100 56.583 1.517 25800
9443 1 19 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.300 1.100 25800
9444 1 19 . 1 1 82 82 PHE H H 82 8.150 8.150 7.087 1.063 25800
9445 1 19 . 1 1 83 83 ASN N N 83 120.800 120.800 117.048 3.752 25800
9446 1 19 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.374 0.066 25800
9447 1 19 . 1 1 83 83 ASN C C 83 174.100 174.100 174.217 -0.117 25800
9448 1 19 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.917 -1.217 25800
9449 1 19 . 1 1 83 83 ASN CB C 83 38.700 38.700 39.345 -0.645 25800
9450 1 19 . 1 1 83 83 ASN H H 83 8.110 8.110 8.136 -0.026 25800
9451 1 19 . 1 1 84 84 ALA N N 84 123.700 123.700 127.781 -4.081 25800
9452 1 19 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.511 -0.431 25800
9453 1 19 . 1 1 84 84 ALA C C 84 177.100 177.100 176.372 0.728 25800
9454 1 19 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.304 0.096 25800
9455 1 19 . 1 1 84 84 ALA CB C 84 19.100 19.100 19.910 -0.810 25800
9456 1 19 . 1 1 84 84 ALA H H 84 8.020 8.020 8.228 -0.208 25800
9457 1 19 . 1 1 85 85 ARG N N 85 120.200 120.200 120.905 -0.705 25800
9458 1 19 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.404 -0.254 25800
9459 1 19 . 1 1 85 85 ARG C C 85 175.200 175.200 176.088 -0.888 25800
9460 1 19 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.149 -0.149 25800
9461 1 19 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.530 0.270 25800
9462 1 19 . 1 1 85 85 ARG H H 85 8.040 8.040 8.429 -0.389 25800
9463 1 20 . 1 1 0 0 HIS HA H 0 4.590 4.590 4.754 -0.164 25800
9464 1 20 . 1 1 0 0 HIS C C 0 174.000 174.000 173.892 0.108 25800
9465 1 20 . 1 1 0 0 HIS CA C 0 55.300 55.300 55.507 -0.207 25800
9466 1 20 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.265 -0.965 25800
9467 1 20 . 1 1 1 1 MET N N 1 122.400 122.400 118.451 3.949 25800
9468 1 20 . 1 1 1 1 MET HA H 1 4.340 4.340 4.122 0.218 25800
9469 1 20 . 1 1 1 1 MET C C 1 175.600 175.600 175.895 -0.295 25800
9470 1 20 . 1 1 1 1 MET CA C 1 55.600 55.600 56.060 -0.460 25800
9471 1 20 . 1 1 1 1 MET CB C 1 32.800 32.800 32.643 0.157 25800
9472 1 20 . 1 1 1 1 MET H H 1 8.310 8.310 7.981 0.329 25800
9473 1 20 . 1 1 2 2 VAL N N 2 123.200 123.200 119.837 3.363 25800
9474 1 20 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.280 -0.320 25800
9475 1 20 . 1 1 2 2 VAL C C 2 175.600 175.600 175.322 0.278 25800
9476 1 20 . 1 1 2 2 VAL CA C 2 62.300 62.300 61.993 0.307 25800
9477 1 20 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.991 -0.691 25800
9478 1 20 . 1 1 2 2 VAL H H 2 8.180 8.180 8.569 -0.389 25800
9479 1 20 . 1 1 3 3 ILE N N 3 126.200 126.200 121.120 5.080 25800
9480 1 20 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.062 -0.012 25800
9481 1 20 . 1 1 3 3 ILE C C 3 175.800 175.800 176.281 -0.481 25800
9482 1 20 . 1 1 3 3 ILE CA C 3 60.700 60.700 62.001 -1.301 25800
9483 1 20 . 1 1 3 3 ILE CB C 3 38.300 38.300 38.137 0.163 25800
9484 1 20 . 1 1 3 3 ILE H H 3 8.230 8.230 8.011 0.219 25800
9485 1 20 . 1 1 4 4 ARG N N 4 126.100 126.100 124.578 1.522 25800
9486 1 20 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.366 -0.186 25800
9487 1 20 . 1 1 4 4 ARG C C 4 175.900 175.900 176.093 -0.193 25800
9488 1 20 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.348 -0.348 25800
9489 1 20 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.939 -0.238 25800
9490 1 20 . 1 1 4 4 ARG H H 4 8.360 8.360 8.528 -0.168 25800
9491 1 20 . 1 1 5 5 GLU N N 5 122.200 122.200 120.945 1.255 25800
9492 1 20 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.580 -0.440 25800
9493 1 20 . 1 1 5 5 GLU C C 5 176.100 176.100 175.497 0.603 25800
9494 1 20 . 1 1 5 5 GLU CA C 5 56.600 56.600 56.253 0.347 25800
9495 1 20 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.677 0.623 25800
9496 1 20 . 1 1 5 5 GLU H H 5 8.400 8.400 8.119 0.281 25800
9497 1 20 . 1 1 6 6 SER N N 6 116.200 116.200 119.695 -3.495 25800
9498 1 20 . 1 1 6 6 SER HA H 6 4.350 4.350 4.621 -0.271 25800
9499 1 20 . 1 1 6 6 SER C C 6 174.300 174.300 172.514 1.786 25800
9500 1 20 . 1 1 6 6 SER CA C 6 58.200 58.200 57.819 0.381 25800
9501 1 20 . 1 1 6 6 SER CB C 6 63.800 63.800 64.049 -0.249 25800
9502 1 20 . 1 1 6 6 SER H H 6 8.270 8.270 8.346 -0.076 25800
9503 1 20 . 1 1 7 7 VAL N N 7 119.800 119.800 119.056 0.744 25800
9504 1 20 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.531 -0.231 25800
9505 1 20 . 1 1 7 7 VAL C C 7 175.500 175.500 174.315 1.185 25800
9506 1 20 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.260 0.440 25800
9507 1 20 . 1 1 7 7 VAL CB C 7 32.800 32.800 34.817 -2.017 25800
9508 1 20 . 1 1 7 7 VAL H H 7 7.840 7.840 8.239 -0.399 25800
9509 1 20 . 1 1 8 8 SER N N 8 117.800 117.800 119.678 -1.878 25800
9510 1 20 . 1 1 8 8 SER HA H 8 4.240 4.240 4.655 -0.415 25800
9511 1 20 . 1 1 8 8 SER C C 8 172.500 172.500 174.188 -1.688 25800
9512 1 20 . 1 1 8 8 SER CA C 8 58.500 58.500 57.805 0.695 25800
9513 1 20 . 1 1 8 8 SER CB C 8 63.600 63.600 63.824 -0.224 25800
9514 1 20 . 1 1 8 8 SER H H 8 8.530 8.530 8.623 -0.093 25800
9515 1 20 . 1 1 9 9 ARG N N 9 123.000 123.000 120.245 2.755 25800
9516 1 20 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.256 0.244 25800
9517 1 20 . 1 1 9 9 ARG C C 9 175.000 175.000 175.462 -0.462 25800
9518 1 20 . 1 1 9 9 ARG CA C 9 54.300 54.300 55.341 -1.041 25800
9519 1 20 . 1 1 9 9 ARG CB C 9 33.400 33.400 34.477 -1.077 25800
9520 1 20 . 1 1 9 9 ARG H H 9 7.350 7.350 8.470 -1.120 25800
9521 1 20 . 1 1 10 10 ILE N N 10 114.000 114.000 119.445 -5.445 25800
9522 1 20 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.387 0.433 25800
9523 1 20 . 1 1 10 10 ILE C C 10 173.000 173.000 174.299 -1.299 25800
9524 1 20 . 1 1 10 10 ILE CA C 10 59.400 59.400 60.298 -0.898 25800
9525 1 20 . 1 1 10 10 ILE CB C 10 40.900 40.900 40.014 0.886 25800
9526 1 20 . 1 1 10 10 ILE H H 10 8.830 8.830 8.816 0.014 25800
9527 1 20 . 1 1 11 11 TYR N N 11 123.400 123.400 129.671 -6.271 25800
9528 1 20 . 1 1 11 11 TYR HA H 11 4.930 4.930 4.647 0.283 25800
9529 1 20 . 1 1 11 11 TYR C C 11 173.000 173.000 173.662 -0.662 25800
9530 1 20 . 1 1 11 11 TYR CA C 11 56.000 56.000 57.087 -1.087 25800
9531 1 20 . 1 1 11 11 TYR CB C 11 40.900 40.900 39.517 1.383 25800
9532 1 20 . 1 1 11 11 TYR H H 11 8.690 8.690 8.640 0.050 25800
9533 1 20 . 1 1 12 12 VAL N N 12 126.300 126.300 128.998 -2.698 25800
9534 1 20 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.706 -0.146 25800
9535 1 20 . 1 1 12 12 VAL C C 12 174.100 174.100 173.307 0.793 25800
9536 1 20 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.608 0.592 25800
9537 1 20 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.666 -2.265 25800
9538 1 20 . 1 1 12 12 VAL H H 12 8.370 8.370 7.631 0.739 25800
9539 1 20 . 1 1 13 13 GLY N N 13 113.000 113.000 113.547 -0.547 25800
9540 1 20 . 1 1 13 13 GLY C C 13 173.100 173.100 172.586 0.514 25800
9541 1 20 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.156 0.144 25800
9542 1 20 . 1 1 13 13 GLY H H 13 9.350 9.350 8.674 0.676 25800
9543 1 20 . 1 1 14 14 ASN N N 14 113.900 113.900 114.503 -0.603 25800
9544 1 20 . 1 1 14 14 ASN HA H 14 4.280 4.280 3.984 0.296 25800
9545 1 20 . 1 1 14 14 ASN C C 14 175.800 175.800 174.653 1.147 25800
9546 1 20 . 1 1 14 14 ASN CA C 14 53.600 53.600 53.904 -0.304 25800
9547 1 20 . 1 1 14 14 ASN CB C 14 37.700 37.700 37.206 0.494 25800
9548 1 20 . 1 1 14 14 ASN H H 14 8.800 8.800 7.559 1.241 25800
9549 1 20 . 1 1 15 15 LEU N N 15 115.800 115.800 115.344 0.456 25800
9550 1 20 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.610 0.380 25800
9551 1 20 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.754 1.846 25800
9552 1 20 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.606 -0.006 25800
9553 1 20 . 1 1 15 15 LEU H H 15 7.150 7.150 7.078 0.072 25800
9554 1 20 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.511 -0.441 25800
9555 1 20 . 1 1 16 16 PRO C C 16 171.500 171.500 176.435 -4.935 25800
9556 1 20 . 1 1 16 16 PRO CA C 16 62.500 62.500 63.000 -0.500 25800
9557 1 20 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.779 0.221 25800
9558 1 20 . 1 1 17 17 SER N N 17 115.200 115.200 116.298 -1.098 25800
9559 1 20 . 1 1 17 17 SER HA H 17 4.300 4.300 4.074 0.226 25800
9560 1 20 . 1 1 17 17 SER C C 17 174.200 174.200 174.277 -0.077 25800
9561 1 20 . 1 1 17 17 SER CA C 17 58.200 58.200 60.015 -1.815 25800
9562 1 20 . 1 1 17 17 SER CB C 17 63.900 63.900 62.727 1.173 25800
9563 1 20 . 1 1 17 17 SER H H 17 8.470 8.470 8.802 -0.332 25800
9564 1 20 . 1 1 18 18 HIS N N 18 120.800 120.800 120.313 0.487 25800
9565 1 20 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.748 -0.198 25800
9566 1 20 . 1 1 18 18 HIS C C 18 175.100 175.100 173.494 1.606 25800
9567 1 20 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.286 0.214 25800
9568 1 20 . 1 1 18 18 HIS CB C 18 29.300 29.300 31.024 -1.724 25800
9569 1 20 . 1 1 18 18 HIS H H 18 8.540 8.540 8.102 0.438 25800
9570 1 20 . 1 1 19 19 VAL N N 19 115.700 115.700 123.273 -7.573 25800
9571 1 20 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.261 -0.001 25800
9572 1 20 . 1 1 19 19 VAL C C 19 174.000 174.000 175.394 -1.394 25800
9573 1 20 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.906 -0.006 25800
9574 1 20 . 1 1 19 19 VAL CB C 19 32.600 32.600 32.964 -0.364 25800
9575 1 20 . 1 1 19 19 VAL H H 19 6.650 6.650 7.934 -1.284 25800
9576 1 20 . 1 1 20 20 SER N N 20 118.800 118.800 121.232 -2.432 25800
9577 1 20 . 1 1 20 20 SER HA H 20 4.710 4.710 4.626 0.084 25800
9578 1 20 . 1 1 20 20 SER C C 20 175.900 175.900 175.739 0.161 25800
9579 1 20 . 1 1 20 20 SER CA C 20 55.800 55.800 57.953 -2.153 25800
9580 1 20 . 1 1 20 20 SER CB C 20 66.600 66.600 64.254 2.346 25800
9581 1 20 . 1 1 20 20 SER H H 20 8.930 8.930 8.538 0.392 25800
9582 1 20 . 1 1 21 21 SER N N 21 117.100 117.100 122.605 -5.505 25800
9583 1 20 . 1 1 21 21 SER HA H 21 3.880 3.880 4.150 -0.270 25800
9584 1 20 . 1 1 21 21 SER C C 21 176.200 176.200 176.456 -0.256 25800
9585 1 20 . 1 1 21 21 SER CA C 21 62.300 62.300 61.039 1.261 25800
9586 1 20 . 1 1 21 21 SER CB C 21 66.800 66.800 63.309 3.490 25800
9587 1 20 . 1 1 21 21 SER H H 21 9.080 9.080 9.097 -0.017 25800
9588 1 20 . 1 1 22 22 ARG N N 22 121.200 121.200 120.799 0.401 25800
9589 1 20 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.172 -0.182 25800
9590 1 20 . 1 1 22 22 ARG C C 22 177.900 177.900 178.276 -0.376 25800
9591 1 20 . 1 1 22 22 ARG CA C 22 58.700 58.700 59.013 -0.313 25800
9592 1 20 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.872 -0.272 25800
9593 1 20 . 1 1 22 22 ARG H H 22 7.940 7.940 8.384 -0.444 25800
9594 1 20 . 1 1 23 23 ASP N N 23 118.800 118.800 120.211 -1.411 25800
9595 1 20 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.528 -0.138 25800
9596 1 20 . 1 1 23 23 ASP C C 23 179.200 179.200 178.399 0.801 25800
9597 1 20 . 1 1 23 23 ASP CA C 23 57.300 57.300 56.888 0.412 25800
9598 1 20 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.425 0.575 25800
9599 1 20 . 1 1 23 23 ASP H H 23 7.480 7.480 7.787 -0.307 25800
9600 1 20 . 1 1 24 24 VAL N N 24 119.500 119.500 119.139 0.361 25800
9601 1 20 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.567 -0.197 25800
9602 1 20 . 1 1 24 24 VAL C C 24 177.500 177.500 177.404 0.096 25800
9603 1 20 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.127 0.773 25800
9604 1 20 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.467 -0.067 25800
9605 1 20 . 1 1 24 24 VAL H H 24 7.450 7.450 7.477 -0.027 25800
9606 1 20 . 1 1 25 25 GLU N N 25 121.400 121.400 121.618 -0.218 25800
9607 1 20 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.906 -0.336 25800
9608 1 20 . 1 1 25 25 GLU C C 25 178.400 178.400 178.190 0.210 25800
9609 1 20 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.270 0.330 25800
9610 1 20 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.545 0.055 25800
9611 1 20 . 1 1 25 25 GLU H H 25 8.580 8.580 8.243 0.337 25800
9612 1 20 . 1 1 26 26 ASN N N 26 114.800 114.800 117.166 -2.366 25800
9613 1 20 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.459 -0.139 25800
9614 1 20 . 1 1 26 26 ASN C C 26 177.400 177.400 177.421 -0.021 25800
9615 1 20 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.792 0.108 25800
9616 1 20 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.559 -0.659 25800
9617 1 20 . 1 1 26 26 ASN H H 26 8.180 8.180 7.998 0.182 25800
9618 1 20 . 1 1 27 27 GLU N N 27 118.900 118.900 119.660 -0.760 25800
9619 1 20 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.124 0.016 25800
9620 1 20 . 1 1 27 27 GLU C C 27 176.400 176.400 179.153 -2.753 25800
9621 1 20 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.788 -1.388 25800
9622 1 20 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.513 -0.113 25800
9623 1 20 . 1 1 27 27 GLU H H 27 7.340 7.340 7.425 -0.085 25800
9624 1 20 . 1 1 28 28 PHE N N 28 114.100 114.100 119.007 -4.907 25800
9625 1 20 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.681 -0.131 25800
9626 1 20 . 1 1 28 28 PHE C C 28 176.300 176.300 178.210 -1.910 25800
9627 1 20 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.446 -0.446 25800
9628 1 20 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.864 1.936 25800
9629 1 20 . 1 1 28 28 PHE H H 28 7.660 7.660 8.049 -0.389 25800
9630 1 20 . 1 1 29 29 ARG N N 29 121.700 121.700 118.693 3.007 25800
9631 1 20 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.565 -0.155 25800
9632 1 20 . 1 1 29 29 ARG C C 29 177.100 177.100 177.767 -0.667 25800
9633 1 20 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.722 -0.522 25800
9634 1 20 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.772 -0.472 25800
9635 1 20 . 1 1 29 29 ARG H H 29 8.120 8.120 8.623 -0.503 25800
9636 1 20 . 1 1 30 30 LYS N N 30 117.200 117.200 118.985 -1.785 25800
9637 1 20 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.185 -0.355 25800
9638 1 20 . 1 1 30 30 LYS C C 30 177.100 177.100 178.054 -0.954 25800
9639 1 20 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.141 -0.341 25800
9640 1 20 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.952 -0.852 25800
9641 1 20 . 1 1 30 30 LYS H H 30 7.630 7.630 8.009 -0.379 25800
9642 1 20 . 1 1 31 31 TYR N N 31 117.100 117.100 118.552 -1.452 25800
9643 1 20 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.359 -0.209 25800
9644 1 20 . 1 1 31 31 TYR C C 31 174.400 174.400 175.651 -1.251 25800
9645 1 20 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.478 0.422 25800
9646 1 20 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.334 -1.434 25800
9647 1 20 . 1 1 31 31 TYR H H 31 7.410 7.410 8.096 -0.686 25800
9648 1 20 . 1 1 32 32 GLY N N 32 104.100 104.100 104.837 -0.737 25800
9649 1 20 . 1 1 32 32 GLY C C 32 177.000 177.000 172.999 4.001 25800
9650 1 20 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.487 0.013 25800
9651 1 20 . 1 1 32 32 GLY H H 32 7.240 7.240 7.306 -0.066 25800
9652 1 20 . 1 1 33 33 ASN N N 33 115.300 115.300 119.457 -4.157 25800
9653 1 20 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.886 -0.446 25800
9654 1 20 . 1 1 33 33 ASN C C 33 175.500 175.500 174.770 0.730 25800
9655 1 20 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.582 0.718 25800
9656 1 20 . 1 1 33 33 ASN CB C 33 38.400 38.400 39.480 -1.081 25800
9657 1 20 . 1 1 33 33 ASN H H 33 8.460 8.460 8.572 -0.112 25800
9658 1 20 . 1 1 34 34 ILE N N 34 126.700 126.700 125.480 1.220 25800
9659 1 20 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.720 -0.930 25800
9660 1 20 . 1 1 34 34 ILE C C 34 175.600 175.600 175.465 0.135 25800
9661 1 20 . 1 1 34 34 ILE CA C 34 61.300 61.300 59.834 1.466 25800
9662 1 20 . 1 1 34 34 ILE CB C 34 40.000 40.000 39.265 0.735 25800
9663 1 20 . 1 1 34 34 ILE H H 34 8.050 8.050 8.490 -0.440 25800
9664 1 20 . 1 1 35 35 LEU N N 35 127.400 127.400 129.426 -2.026 25800
9665 1 20 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.358 -0.198 25800
9666 1 20 . 1 1 35 35 LEU C C 35 177.200 177.200 176.668 0.532 25800
9667 1 20 . 1 1 35 35 LEU CA C 35 55.500 55.500 56.541 -1.042 25800
9668 1 20 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.096 0.604 25800
9669 1 20 . 1 1 35 35 LEU H H 35 8.780 8.780 9.189 -0.409 25800
9670 1 20 . 1 1 36 36 LYS N N 36 117.000 117.000 114.339 2.661 25800
9671 1 20 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.492 -0.252 25800
9672 1 20 . 1 1 36 36 LYS C C 36 173.600 173.600 174.017 -0.417 25800
9673 1 20 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.876 0.024 25800
9674 1 20 . 1 1 36 36 LYS CB C 36 36.600 36.600 34.813 1.787 25800
9675 1 20 . 1 1 36 36 LYS H H 36 7.110 7.110 7.459 -0.349 25800
9676 1 20 . 1 1 37 37 CYS N N 37 125.400 125.400 120.581 4.819 25800
9677 1 20 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.389 -0.689 25800
9678 1 20 . 1 1 37 37 CYS C C 37 171.600 171.600 173.192 -1.592 25800
9679 1 20 . 1 1 37 37 CYS CA C 37 57.900 57.900 57.411 0.489 25800
9680 1 20 . 1 1 37 37 CYS CB C 37 27.100 27.100 30.257 -3.157 25800
9681 1 20 . 1 1 37 37 CYS H H 37 8.610 8.610 8.589 0.021 25800
9682 1 20 . 1 1 38 38 ASP N N 38 128.200 128.200 124.661 3.539 25800
9683 1 20 . 1 1 38 38 ASP HA H 38 4.950 4.950 4.928 0.022 25800
9684 1 20 . 1 1 38 38 ASP C C 38 174.300 174.300 173.559 0.741 25800
9685 1 20 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.751 -0.551 25800
9686 1 20 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.098 -0.798 25800
9687 1 20 . 1 1 38 38 ASP H H 38 8.290 8.290 8.659 -0.369 25800
9688 1 20 . 1 1 39 39 VAL N N 39 123.500 123.500 120.716 2.784 25800
9689 1 20 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.944 -0.644 25800
9690 1 20 . 1 1 39 39 VAL C C 39 175.000 175.000 173.900 1.100 25800
9691 1 20 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.037 0.663 25800
9692 1 20 . 1 1 39 39 VAL CB C 39 33.100 33.100 35.503 -2.403 25800
9693 1 20 . 1 1 39 39 VAL H H 39 8.380 8.380 8.441 -0.061 25800
9694 1 20 . 1 1 40 40 LYS N N 40 129.100 129.100 127.485 1.615 25800
9695 1 20 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.885 -0.565 25800
9696 1 20 . 1 1 40 40 LYS C C 40 173.700 173.700 174.526 -0.826 25800
9697 1 20 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.981 -1.081 25800
9698 1 20 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.661 -0.161 25800
9699 1 20 . 1 1 40 40 LYS H H 40 8.680 8.680 9.281 -0.601 25800
9700 1 20 . 1 1 41 41 LYS N N 41 117.300 117.300 121.347 -4.047 25800
9701 1 20 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.516 -0.536 25800
9702 1 20 . 1 1 41 41 LYS C C 41 177.800 177.800 175.498 2.302 25800
9703 1 20 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.678 -0.078 25800
9704 1 20 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.899 -0.899 25800
9705 1 20 . 1 1 41 41 LYS H H 41 7.900 7.900 8.413 -0.513 25800
9706 1 20 . 1 1 42 42 THR N N 42 113.200 113.200 112.732 0.468 25800
9707 1 20 . 1 1 42 42 THR HA H 42 4.680 4.680 4.798 -0.118 25800
9708 1 20 . 1 1 42 42 THR C C 42 176.900 176.900 176.361 0.539 25800
9709 1 20 . 1 1 42 42 THR CA C 42 60.200 60.200 60.479 -0.279 25800
9710 1 20 . 1 1 42 42 THR CB C 42 71.600 71.600 70.301 1.299 25800
9711 1 20 . 1 1 42 42 THR H H 42 8.730 8.730 8.620 0.110 25800
9712 1 20 . 1 1 43 43 VAL N N 43 120.000 120.000 118.755 1.245 25800
9713 1 20 . 1 1 43 43 VAL HA H 43 3.920 3.920 4.037 -0.117 25800
9714 1 20 . 1 1 43 43 VAL C C 43 177.000 177.000 176.762 0.238 25800
9715 1 20 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.429 0.271 25800
9716 1 20 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.673 0.127 25800
9717 1 20 . 1 1 43 43 VAL H H 43 8.730 8.730 8.506 0.224 25800
9718 1 20 . 1 1 44 44 SER N N 44 113.400 113.400 115.762 -2.362 25800
9719 1 20 . 1 1 44 44 SER HA H 44 4.360 4.360 4.401 -0.041 25800
9720 1 20 . 1 1 44 44 SER C C 44 174.800 174.800 175.446 -0.646 25800
9721 1 20 . 1 1 44 44 SER CA C 44 58.400 58.400 58.484 -0.084 25800
9722 1 20 . 1 1 44 44 SER CB C 44 63.500 63.500 63.356 0.144 25800
9723 1 20 . 1 1 44 44 SER H H 44 7.760 7.760 8.037 -0.277 25800
9724 1 20 . 1 1 45 45 GLY N N 45 110.200 110.200 108.791 1.409 25800
9725 1 20 . 1 1 45 45 GLY C C 45 173.500 173.500 174.103 -0.603 25800
9726 1 20 . 1 1 45 45 GLY CA C 45 45.300 45.300 45.049 0.251 25800
9727 1 20 . 1 1 45 45 GLY H H 45 7.820 7.820 7.771 0.049 25800
9728 1 20 . 1 1 46 46 ALA N N 46 123.900 123.900 122.526 1.374 25800
9729 1 20 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.464 -0.074 25800
9730 1 20 . 1 1 46 46 ALA C C 46 176.100 176.100 175.501 0.599 25800
9731 1 20 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.774 0.126 25800
9732 1 20 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.236 -0.436 25800
9733 1 20 . 1 1 46 46 ALA H H 46 7.440 7.440 7.500 -0.060 25800
9734 1 20 . 1 1 47 47 ALA N N 47 123.100 123.100 122.402 0.698 25800
9735 1 20 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.260 -0.060 25800
9736 1 20 . 1 1 47 47 ALA C C 47 176.100 176.100 175.229 0.871 25800
9737 1 20 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.860 0.040 25800
9738 1 20 . 1 1 47 47 ALA CB C 47 21.900 21.900 22.510 -0.610 25800
9739 1 20 . 1 1 47 47 ALA H H 47 8.350 8.350 7.785 0.565 25800
9740 1 20 . 1 1 48 48 PHE N N 48 118.700 118.700 118.834 -0.134 25800
9741 1 20 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.223 -0.193 25800
9742 1 20 . 1 1 48 48 PHE C C 48 171.600 171.600 173.969 -2.369 25800
9743 1 20 . 1 1 48 48 PHE CA C 48 55.700 55.700 57.213 -1.513 25800
9744 1 20 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.756 -2.556 25800
9745 1 20 . 1 1 48 48 PHE H H 48 8.550 8.550 9.073 -0.523 25800
9746 1 20 . 1 1 49 49 ALA N N 49 120.400 120.400 124.740 -4.340 25800
9747 1 20 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.418 -0.088 25800
9748 1 20 . 1 1 49 49 ALA C C 49 175.500 175.500 175.471 0.029 25800
9749 1 20 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.181 -0.881 25800
9750 1 20 . 1 1 49 49 ALA CB C 49 23.700 23.700 22.104 1.596 25800
9751 1 20 . 1 1 49 49 ALA H H 49 9.240 9.240 9.209 0.031 25800
9752 1 20 . 1 1 50 50 PHE N N 50 115.000 115.000 120.654 -5.654 25800
9753 1 20 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.409 0.191 25800
9754 1 20 . 1 1 50 50 PHE C C 50 176.000 176.000 174.415 1.585 25800
9755 1 20 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.708 -0.208 25800
9756 1 20 . 1 1 50 50 PHE CB C 50 42.200 42.200 41.751 0.449 25800
9757 1 20 . 1 1 50 50 PHE H H 50 7.920 7.920 9.067 -1.147 25800
9758 1 20 . 1 1 51 51 ILE N N 51 123.000 123.000 122.243 0.757 25800
9759 1 20 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.670 -0.220 25800
9760 1 20 . 1 1 51 51 ILE C C 51 173.700 173.700 173.980 -0.280 25800
9761 1 20 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.412 -0.212 25800
9762 1 20 . 1 1 51 51 ILE CB C 51 40.700 40.700 42.291 -1.591 25800
9763 1 20 . 1 1 51 51 ILE H H 51 8.490 8.490 8.529 -0.039 25800
9764 1 20 . 1 1 52 52 GLU N N 52 126.600 126.600 125.882 0.718 25800
9765 1 20 . 1 1 52 52 GLU HA H 52 4.770 4.770 5.011 -0.241 25800
9766 1 20 . 1 1 52 52 GLU C C 52 175.300 175.300 175.094 0.206 25800
9767 1 20 . 1 1 52 52 GLU CA C 52 54.700 54.700 54.093 0.607 25800
9768 1 20 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.157 -0.657 25800
9769 1 20 . 1 1 52 52 GLU H H 52 8.610 8.610 8.934 -0.324 25800
9770 1 20 . 1 1 53 53 PHE N N 53 126.100 126.100 126.163 -0.063 25800
9771 1 20 . 1 1 53 53 PHE HA H 53 4.800 4.800 4.930 -0.130 25800
9772 1 20 . 1 1 53 53 PHE C C 53 175.400 175.400 176.532 -1.132 25800
9773 1 20 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.963 1.237 25800
9774 1 20 . 1 1 53 53 PHE CB C 53 40.900 40.900 40.952 -0.052 25800
9775 1 20 . 1 1 53 53 PHE H H 53 8.800 8.800 8.764 0.036 25800
9776 1 20 . 1 1 54 54 GLU N N 54 120.700 120.700 121.570 -0.870 25800
9777 1 20 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.189 -0.259 25800
9778 1 20 . 1 1 54 54 GLU C C 54 175.300 175.300 175.749 -0.449 25800
9779 1 20 . 1 1 54 54 GLU CA C 54 59.100 59.100 59.115 -0.015 25800
9780 1 20 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.579 0.221 25800
9781 1 20 . 1 1 54 54 GLU H H 54 8.160 8.160 8.675 -0.515 25800
9782 1 20 . 1 1 55 55 ASP N N 55 117.900 117.900 118.682 -0.782 25800
9783 1 20 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.868 0.052 25800
9784 1 20 . 1 1 55 55 ASP C C 55 176.400 176.400 175.475 0.925 25800
9785 1 20 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.344 -0.944 25800
9786 1 20 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.440 1.960 25800
9787 1 20 . 1 1 55 55 ASP H H 55 8.740 8.740 8.065 0.675 25800
9788 1 20 . 1 1 56 56 ALA N N 56 128.900 128.900 127.907 0.993 25800
9789 1 20 . 1 1 56 56 ALA HA H 56 3.830 3.830 4.023 -0.193 25800
9790 1 20 . 1 1 56 56 ALA C C 56 179.800 179.800 178.405 1.395 25800
9791 1 20 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.895 0.305 25800
9792 1 20 . 1 1 56 56 ALA CB C 56 18.900 18.900 19.214 -0.314 25800
9793 1 20 . 1 1 56 56 ALA H H 56 8.800 8.800 8.574 0.226 25800
9794 1 20 . 1 1 57 57 ARG N N 57 119.200 119.200 117.672 1.528 25800
9795 1 20 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.097 -0.207 25800
9796 1 20 . 1 1 57 57 ARG C C 57 178.000 178.000 177.670 0.330 25800
9797 1 20 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.992 -0.092 25800
9798 1 20 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.675 -0.375 25800
9799 1 20 . 1 1 57 57 ARG H H 57 8.950 8.950 8.098 0.852 25800
9800 1 20 . 1 1 58 58 ASP N N 58 120.900 120.900 117.624 3.276 25800
9801 1 20 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.500 -0.410 25800
9802 1 20 . 1 1 58 58 ASP C C 58 176.700 176.700 177.374 -0.674 25800
9803 1 20 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.191 0.309 25800
9804 1 20 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.788 -0.888 25800
9805 1 20 . 1 1 58 58 ASP H H 58 7.020 7.020 8.231 -1.211 25800
9806 1 20 . 1 1 59 59 ALA N N 59 119.700 119.700 121.600 -1.900 25800
9807 1 20 . 1 1 59 59 ALA HA H 59 3.080 3.080 3.915 -0.835 25800
9808 1 20 . 1 1 59 59 ALA C C 59 178.100 178.100 178.287 -0.187 25800
9809 1 20 . 1 1 59 59 ALA CA C 59 54.300 54.300 53.150 1.150 25800
9810 1 20 . 1 1 59 59 ALA CB C 59 18.400 18.400 17.694 0.706 25800
9811 1 20 . 1 1 59 59 ALA H H 59 6.440 6.440 7.843 -1.403 25800
9812 1 20 . 1 1 60 60 ALA N N 60 117.600 117.600 122.106 -4.506 25800
9813 1 20 . 1 1 60 60 ALA HA H 60 3.830 3.830 3.860 -0.030 25800
9814 1 20 . 1 1 60 60 ALA C C 60 180.900 180.900 178.851 2.049 25800
9815 1 20 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.019 -0.119 25800
9816 1 20 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.242 -0.542 25800
9817 1 20 . 1 1 60 60 ALA H H 60 7.330 7.330 7.697 -0.367 25800
9818 1 20 . 1 1 61 61 ASP N N 61 120.100 120.100 118.519 1.581 25800
9819 1 20 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.367 -0.157 25800
9820 1 20 . 1 1 61 61 ASP C C 61 176.700 176.700 178.171 -1.471 25800
9821 1 20 . 1 1 61 61 ASP CA C 61 57.100 57.100 57.347 -0.248 25800
9822 1 20 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.379 -0.279 25800
9823 1 20 . 1 1 61 61 ASP H H 61 7.590 7.590 7.914 -0.324 25800
9824 1 20 . 1 1 62 62 ALA N N 62 122.200 122.200 122.941 -0.741 25800
9825 1 20 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.739 -1.319 25800
9826 1 20 . 1 1 62 62 ALA C C 62 179.300 179.300 179.360 -0.060 25800
9827 1 20 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.502 0.098 25800
9828 1 20 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.072 1.028 25800
9829 1 20 . 1 1 62 62 ALA H H 62 7.440 7.440 7.123 0.317 25800
9830 1 20 . 1 1 63 63 ILE N N 63 116.700 116.700 117.951 -1.251 25800
9831 1 20 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.753 -0.513 25800
9832 1 20 . 1 1 63 63 ILE C C 63 177.800 177.800 177.257 0.543 25800
9833 1 20 . 1 1 63 63 ILE CA C 63 65.600 65.600 64.201 1.399 25800
9834 1 20 . 1 1 63 63 ILE CB C 63 38.900 38.900 37.517 1.383 25800
9835 1 20 . 1 1 63 63 ILE H H 63 7.540 7.540 7.642 -0.102 25800
9836 1 20 . 1 1 64 64 LYS N N 64 117.400 117.400 116.368 1.032 25800
9837 1 20 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.176 -0.276 25800
9838 1 20 . 1 1 64 64 LYS C C 64 178.900 178.900 179.439 -0.539 25800
9839 1 20 . 1 1 64 64 LYS CA C 64 58.800 58.800 57.897 0.903 25800
9840 1 20 . 1 1 64 64 LYS CB C 64 32.600 32.600 32.612 -0.012 25800
9841 1 20 . 1 1 64 64 LYS H H 64 7.490 7.490 8.071 -0.581 25800
9842 1 20 . 1 1 65 65 GLU N N 65 113.800 113.800 120.450 -6.650 25800
9843 1 20 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.308 -0.148 25800
9844 1 20 . 1 1 65 65 GLU C C 65 178.300 178.300 178.269 0.031 25800
9845 1 20 . 1 1 65 65 GLU CA C 65 58.300 58.300 58.559 -0.259 25800
9846 1 20 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.278 1.422 25800
9847 1 20 . 1 1 65 65 GLU H H 65 7.960 7.960 8.200 -0.240 25800
9848 1 20 . 1 1 66 66 LYS N N 66 114.700 114.700 118.089 -3.389 25800
9849 1 20 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.389 0.081 25800
9850 1 20 . 1 1 66 66 LYS C C 66 177.500 177.500 176.470 1.030 25800
9851 1 20 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.774 -1.374 25800
9852 1 20 . 1 1 66 66 LYS CB C 66 33.000 33.000 31.975 1.025 25800
9853 1 20 . 1 1 66 66 LYS H H 66 8.050 8.050 7.910 0.140 25800
9854 1 20 . 1 1 67 67 ASP N N 67 118.800 118.800 119.413 -0.613 25800
9855 1 20 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.495 -0.276 25800
9856 1 20 . 1 1 67 67 ASP C C 67 177.700 177.700 177.607 0.093 25800
9857 1 20 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.340 4.060 25800
9858 1 20 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.125 0.275 25800
9859 1 20 . 1 1 67 67 ASP H H 67 7.620 7.620 7.466 0.154 25800
9860 1 20 . 1 1 68 68 GLY N N 68 115.600 115.600 107.891 7.709 25800
9861 1 20 . 1 1 68 68 GLY C C 68 173.800 173.800 175.346 -1.546 25800
9862 1 20 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.894 1.006 25800
9863 1 20 . 1 1 68 68 GLY H H 68 8.470 8.470 8.593 -0.123 25800
9864 1 20 . 1 1 69 69 CYS N N 69 119.200 119.200 118.568 0.632 25800
9865 1 20 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.645 -0.485 25800
9866 1 20 . 1 1 69 69 CYS C C 69 172.600 172.600 174.558 -1.958 25800
9867 1 20 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.779 0.222 25800
9868 1 20 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.389 -0.689 25800
9869 1 20 . 1 1 69 69 CYS H H 69 7.890 7.890 8.407 -0.517 25800
9870 1 20 . 1 1 70 70 ASP N N 70 122.200 122.200 122.823 -0.623 25800
9871 1 20 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.948 -0.118 25800
9872 1 20 . 1 1 70 70 ASP C C 70 176.400 176.400 174.506 1.894 25800
9873 1 20 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.451 1.249 25800
9874 1 20 . 1 1 70 70 ASP CB C 70 42.700 42.700 44.559 -1.859 25800
9875 1 20 . 1 1 70 70 ASP H H 70 8.360 8.360 8.697 -0.337 25800
9876 1 20 . 1 1 71 71 PHE N N 71 127.600 127.600 120.886 6.714 25800
9877 1 20 . 1 1 71 71 PHE HA H 71 4.600 4.600 4.887 -0.287 25800
9878 1 20 . 1 1 71 71 PHE C C 71 173.600 173.600 175.243 -1.643 25800
9879 1 20 . 1 1 71 71 PHE CA C 71 56.800 56.800 57.151 -0.351 25800
9880 1 20 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.133 -0.433 25800
9881 1 20 . 1 1 71 71 PHE H H 71 9.390 9.390 8.252 1.138 25800
9882 1 20 . 1 1 72 72 GLU N N 72 123.900 123.900 118.942 4.958 25800
9883 1 20 . 1 1 72 72 GLU HA H 72 3.540 3.540 3.684 -0.144 25800
9884 1 20 . 1 1 72 72 GLU C C 72 175.500 175.500 175.393 0.107 25800
9885 1 20 . 1 1 72 72 GLU CA C 72 56.700 56.700 56.797 -0.097 25800
9886 1 20 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.549 -1.249 25800
9887 1 20 . 1 1 72 72 GLU H H 72 8.940 8.940 7.716 1.224 25800
9888 1 20 . 1 1 73 73 GLY N N 73 105.200 105.200 103.530 1.670 25800
9889 1 20 . 1 1 73 73 GLY C C 73 174.100 174.100 173.587 0.513 25800
9890 1 20 . 1 1 73 73 GLY CA C 73 45.600 45.600 44.899 0.701 25800
9891 1 20 . 1 1 73 73 GLY H H 73 8.350 8.350 7.924 0.426 25800
9892 1 20 . 1 1 74 74 ASN N N 74 121.000 121.000 120.614 0.386 25800
9893 1 20 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.898 -0.138 25800
9894 1 20 . 1 1 74 74 ASN C C 74 174.000 174.000 174.291 -0.291 25800
9895 1 20 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.819 -1.919 25800
9896 1 20 . 1 1 74 74 ASN CB C 74 39.700 39.700 40.425 -0.725 25800
9897 1 20 . 1 1 74 74 ASN H H 74 7.740 7.740 7.798 -0.058 25800
9898 1 20 . 1 1 75 75 LYS N N 75 121.400 121.400 123.041 -1.641 25800
9899 1 20 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.606 -0.136 25800
9900 1 20 . 1 1 75 75 LYS C C 75 176.900 176.900 175.082 1.818 25800
9901 1 20 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.344 -0.045 25800
9902 1 20 . 1 1 75 75 LYS CB C 75 31.900 31.900 31.307 0.593 25800
9903 1 20 . 1 1 75 75 LYS H H 75 8.380 8.380 8.636 -0.256 25800
9904 1 20 . 1 1 76 76 LEU N N 76 127.400 127.400 120.758 6.642 25800
9905 1 20 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.501 -0.071 25800
9906 1 20 . 1 1 76 76 LEU C C 76 177.600 177.600 174.380 3.220 25800
9907 1 20 . 1 1 76 76 LEU CA C 76 55.300 55.300 54.590 0.710 25800
9908 1 20 . 1 1 76 76 LEU CB C 76 43.100 43.100 45.263 -2.163 25800
9909 1 20 . 1 1 76 76 LEU H H 76 8.950 8.950 7.635 1.315 25800
9910 1 20 . 1 1 77 77 ARG N N 77 121.800 121.800 125.776 -3.976 25800
9911 1 20 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.862 0.038 25800
9912 1 20 . 1 1 77 77 ARG C C 77 174.700 174.700 173.548 1.152 25800
9913 1 20 . 1 1 77 77 ARG CA C 77 54.000 54.000 54.951 -0.951 25800
9914 1 20 . 1 1 77 77 ARG CB C 77 32.300 32.300 33.090 -0.790 25800
9915 1 20 . 1 1 77 77 ARG H H 77 7.530 7.530 8.364 -0.834 25800
9916 1 20 . 1 1 78 78 VAL N N 78 127.000 127.000 125.722 1.278 25800
9917 1 20 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.908 0.372 25800
9918 1 20 . 1 1 78 78 VAL C C 78 174.200 174.200 174.439 -0.239 25800
9919 1 20 . 1 1 78 78 VAL CA C 78 61.200 61.200 60.708 0.492 25800
9920 1 20 . 1 1 78 78 VAL CB C 78 33.400 33.400 36.085 -2.685 25800
9921 1 20 . 1 1 78 78 VAL H H 78 9.660 9.660 8.558 1.102 25800
9922 1 20 . 1 1 79 79 GLU N N 79 121.900 121.900 124.836 -2.936 25800
9923 1 20 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.567 0.143 25800
9924 1 20 . 1 1 79 79 GLU C C 79 174.600 174.600 175.120 -0.520 25800
9925 1 20 . 1 1 79 79 GLU CA C 79 53.900 53.900 54.811 -0.911 25800
9926 1 20 . 1 1 79 79 GLU CB C 79 34.400 34.400 32.282 2.118 25800
9927 1 20 . 1 1 79 79 GLU H H 79 8.980 8.980 8.078 0.902 25800
9928 1 20 . 1 1 80 80 VAL N N 80 121.300 121.300 120.402 0.898 25800
9929 1 20 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.012 0.358 25800
9930 1 20 . 1 1 80 80 VAL CA C 80 61.000 61.000 62.239 -1.239 25800
9931 1 20 . 1 1 80 80 VAL CB C 80 32.100 32.100 32.163 -0.062 25800
9932 1 20 . 1 1 80 80 VAL H H 80 8.410 8.410 8.390 0.020 25800
9933 1 20 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.594 -0.334 25800
9934 1 20 . 1 1 81 81 PRO C C 81 176.100 176.100 176.084 0.016 25800
9935 1 20 . 1 1 81 81 PRO CA C 81 63.100 63.100 63.137 -0.037 25800
9936 1 20 . 1 1 81 81 PRO CB C 81 32.100 32.100 29.743 2.357 25800
9937 1 20 . 1 1 82 82 PHE N N 82 122.200 122.200 116.099 6.101 25800
9938 1 20 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.020 0.270 25800
9939 1 20 . 1 1 82 82 PHE C C 82 175.300 175.300 174.393 0.907 25800
9940 1 20 . 1 1 82 82 PHE CA C 82 58.100 58.100 59.259 -1.159 25800
9941 1 20 . 1 1 82 82 PHE CB C 82 39.400 39.400 36.747 2.653 25800
9942 1 20 . 1 1 82 82 PHE H H 82 8.150 8.150 8.110 0.040 25800
9943 1 20 . 1 1 83 83 ASN N N 83 120.800 120.800 115.325 5.475 25800
9944 1 20 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.406 0.034 25800
9945 1 20 . 1 1 83 83 ASN C C 83 174.100 174.100 173.996 0.104 25800
9946 1 20 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.702 -1.002 25800
9947 1 20 . 1 1 83 83 ASN CB C 83 38.700 38.700 38.049 0.651 25800
9948 1 20 . 1 1 83 83 ASN H H 83 8.110 8.110 8.332 -0.222 25800
9949 1 20 . 1 1 84 84 ALA N N 84 123.700 123.700 123.830 -0.130 25800
9950 1 20 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.471 -0.391 25800
9951 1 20 . 1 1 84 84 ALA C C 84 177.100 177.100 176.574 0.526 25800
9952 1 20 . 1 1 84 84 ALA CA C 84 52.400 52.400 51.170 1.230 25800
9953 1 20 . 1 1 84 84 ALA CB C 84 19.100 19.100 21.706 -2.606 25800
9954 1 20 . 1 1 84 84 ALA H H 84 8.020 8.020 8.007 0.013 25800
9955 1 20 . 1 1 85 85 ARG N N 85 120.200 120.200 118.816 1.384 25800
9956 1 20 . 1 1 85 85 ARG HA H 85 4.150 4.150 3.955 0.195 25800
9957 1 20 . 1 1 85 85 ARG C C 85 175.200 175.200 175.119 0.081 25800
9958 1 20 . 1 1 85 85 ARG CA C 85 56.000 56.000 57.508 -1.508 25800
9959 1 20 . 1 1 85 85 ARG CB C 85 30.800 30.800 28.823 1.977 25800
9960 1 20 . 1 1 85 85 ARG H H 85 8.040 8.040 8.527 -0.487 25800
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 83 3.481 -0.261 3.492 25800
2 1 1 "Average Difference" HA 91 0.391 0.138 0.368 25800
3 1 1 "Average Difference" C 84 1.363 -0.033 1.371 25800
4 1 1 "Average Difference" CA 86 1.145 -0.073 1.149 25800
5 1 1 "Average Difference" CB 81 1.389 0.151 1.390 25800
6 1 1 "Average Difference" HN 83 0.561 0.048 0.562 25800
7 1 2 "Average Difference" N 83 3.395 0.454 3.385 25800
8 1 2 "Average Difference" HA 91 0.440 0.170 0.408 25800
9 1 2 "Average Difference" C 84 1.356 -0.055 1.363 25800
10 1 2 "Average Difference" CA 86 1.099 -0.001 1.106 25800
11 1 2 "Average Difference" CB 81 1.226 0.211 1.215 25800
12 1 2 "Average Difference" HN 83 0.585 0.148 0.570 25800
13 1 3 "Average Difference" N 83 3.503 0.191 3.520 25800
14 1 3 "Average Difference" HA 91 0.455 0.139 0.435 25800
15 1 3 "Average Difference" C 84 1.280 0.042 1.287 25800
16 1 3 "Average Difference" CA 86 1.215 0.026 1.222 25800
17 1 3 "Average Difference" CB 81 1.419 0.017 1.428 25800
18 1 3 "Average Difference" HN 83 0.601 0.090 0.598 25800
19 1 4 "Average Difference" N 83 3.479 -0.088 3.499 25800
20 1 4 "Average Difference" HA 91 0.452 0.122 0.438 25800
21 1 4 "Average Difference" C 84 1.472 0.148 1.474 25800
22 1 4 "Average Difference" CA 86 1.259 0.072 1.264 25800
23 1 4 "Average Difference" CB 81 1.565 0.087 1.572 25800
24 1 4 "Average Difference" HN 83 0.581 0.074 0.579 25800
25 1 5 "Average Difference" N 83 3.256 0.170 3.271 25800
26 1 5 "Average Difference" HA 91 0.459 0.123 0.445 25800
27 1 5 "Average Difference" C 84 1.321 0.071 1.327 25800
28 1 5 "Average Difference" CA 86 1.079 -0.002 1.085 25800
29 1 5 "Average Difference" CB 81 1.370 0.190 1.365 25800
30 1 5 "Average Difference" HN 83 0.595 0.045 0.597 25800
31 1 6 "Average Difference" N 83 3.334 0.063 3.353 25800
32 1 6 "Average Difference" HA 91 0.447 0.142 0.427 25800
33 1 6 "Average Difference" C 84 1.339 0.009 1.347 25800
34 1 6 "Average Difference" CA 86 1.085 0.001 1.091 25800
35 1 6 "Average Difference" CB 81 1.331 0.010 1.339 25800
36 1 6 "Average Difference" HN 83 0.575 0.076 0.574 25800
37 1 7 "Average Difference" N 83 3.228 0.162 3.244 25800
38 1 7 "Average Difference" HA 91 0.389 0.164 0.355 25800
39 1 7 "Average Difference" C 84 1.348 -0.056 1.355 25800
40 1 7 "Average Difference" CA 86 1.145 -0.048 1.151 25800
41 1 7 "Average Difference" CB 81 1.346 0.216 1.337 25800
42 1 7 "Average Difference" HN 83 0.586 0.095 0.582 25800
43 1 8 "Average Difference" N 83 3.249 0.107 3.267 25800
44 1 8 "Average Difference" HA 91 0.471 0.150 0.449 25800
45 1 8 "Average Difference" C 84 1.464 -0.048 1.472 25800
46 1 8 "Average Difference" CA 86 1.195 -0.044 1.201 25800
47 1 8 "Average Difference" CB 81 1.577 0.161 1.579 25800
48 1 8 "Average Difference" HN 83 0.583 0.117 0.575 25800
49 1 9 "Average Difference" N 83 3.606 -0.076 3.627 25800
50 1 9 "Average Difference" HA 91 0.448 0.121 0.434 25800
51 1 9 "Average Difference" C 84 1.360 -0.044 1.368 25800
52 1 9 "Average Difference" CA 86 1.136 -0.020 1.142 25800
53 1 9 "Average Difference" CB 81 1.412 0.127 1.415 25800
54 1 9 "Average Difference" HN 83 0.580 0.098 0.575 25800
55 1 10 "Average Difference" N 83 3.235 0.232 3.246 25800
56 1 10 "Average Difference" HA 91 0.437 0.145 0.414 25800
57 1 10 "Average Difference" C 84 1.333 -0.021 1.340 25800
58 1 10 "Average Difference" CA 86 1.100 0.068 1.104 25800
59 1 10 "Average Difference" CB 81 1.408 0.127 1.411 25800
60 1 10 "Average Difference" HN 83 0.625 0.107 0.619 25800
61 1 11 "Average Difference" N 83 3.294 0.400 3.290 25800
62 1 11 "Average Difference" HA 91 0.457 0.138 0.438 25800
63 1 11 "Average Difference" C 84 1.396 0.090 1.402 25800
64 1 11 "Average Difference" CA 86 1.151 0.004 1.158 25800
65 1 11 "Average Difference" CB 81 1.258 0.029 1.265 25800
66 1 11 "Average Difference" HN 83 0.598 0.143 0.584 25800
67 1 12 "Average Difference" N 83 3.811 -0.019 3.834 25800
68 1 12 "Average Difference" HA 91 0.416 0.125 0.399 25800
69 1 12 "Average Difference" C 84 1.260 0.027 1.267 25800
70 1 12 "Average Difference" CA 86 1.123 -0.053 1.128 25800
71 1 12 "Average Difference" CB 81 1.254 0.016 1.262 25800
72 1 12 "Average Difference" HN 83 0.537 0.055 0.537 25800
73 1 13 "Average Difference" N 83 3.310 -0.034 3.330 25800
74 1 13 "Average Difference" HA 91 0.404 0.103 0.393 25800
75 1 13 "Average Difference" C 84 1.395 0.031 1.403 25800
76 1 13 "Average Difference" CA 86 1.143 0.062 1.148 25800
77 1 13 "Average Difference" CB 81 1.328 -0.018 1.336 25800
78 1 13 "Average Difference" HN 83 0.592 0.119 0.584 25800
79 1 14 "Average Difference" N 83 3.382 0.163 3.398 25800
80 1 14 "Average Difference" HA 91 0.447 0.150 0.424 25800
81 1 14 "Average Difference" C 84 1.402 0.062 1.409 25800
82 1 14 "Average Difference" CA 86 1.121 -0.036 1.127 25800
83 1 14 "Average Difference" CB 81 1.569 0.181 1.568 25800
84 1 14 "Average Difference" HN 83 0.583 0.080 0.581 25800
85 1 15 "Average Difference" N 83 3.120 0.680 3.063 25800
86 1 15 "Average Difference" HA 91 0.406 0.149 0.379 25800
87 1 15 "Average Difference" C 84 1.347 -0.066 1.353 25800
88 1 15 "Average Difference" CA 86 1.026 0.001 1.032 25800
89 1 15 "Average Difference" CB 81 1.235 0.105 1.238 25800
90 1 15 "Average Difference" HN 83 0.547 0.125 0.536 25800
91 1 16 "Average Difference" N 83 3.020 0.374 3.014 25800
92 1 16 "Average Difference" HA 91 0.394 0.162 0.362 25800
93 1 16 "Average Difference" C 84 1.317 -0.126 1.319 25800
94 1 16 "Average Difference" CA 86 1.031 -0.032 1.036 25800
95 1 16 "Average Difference" CB 81 1.345 0.268 1.327 25800
96 1 16 "Average Difference" HN 83 0.559 0.104 0.553 25800
97 1 17 "Average Difference" N 83 3.505 0.005 3.526 25800
98 1 17 "Average Difference" HA 91 0.443 0.131 0.425 25800
99 1 17 "Average Difference" C 84 1.401 0.093 1.406 25800
100 1 17 "Average Difference" CA 86 1.162 -0.015 1.169 25800
101 1 17 "Average Difference" CB 81 1.323 0.152 1.323 25800
102 1 17 "Average Difference" HN 83 0.590 0.101 0.585 25800
103 1 18 "Average Difference" N 83 3.372 0.211 3.386 25800
104 1 18 "Average Difference" HA 91 0.396 0.151 0.368 25800
105 1 18 "Average Difference" C 84 1.318 0.034 1.326 25800
106 1 18 "Average Difference" CA 86 1.056 0.001 1.062 25800
107 1 18 "Average Difference" CB 81 1.119 -0.020 1.126 25800
108 1 18 "Average Difference" HN 83 0.564 0.084 0.561 25800
109 1 19 "Average Difference" N 83 3.325 -0.004 3.345 25800
110 1 19 "Average Difference" HA 91 0.423 0.161 0.394 25800
111 1 19 "Average Difference" C 84 1.398 -0.025 1.406 25800
112 1 19 "Average Difference" CA 86 1.062 -0.022 1.068 25800
113 1 19 "Average Difference" CB 81 1.265 0.207 1.256 25800
114 1 19 "Average Difference" HN 83 0.591 0.077 0.589 25800
115 1 20 "Average Difference" N 83 3.168 0.061 3.186 25800
116 1 20 "Average Difference" HA 91 0.357 0.139 0.330 25800
117 1 20 "Average Difference" C 84 1.276 -0.030 1.283 25800
118 1 20 "Average Difference" CA 86 0.937 0.039 0.942 25800
119 1 20 "Average Difference" CB 81 1.321 0.064 1.328 25800
120 1 20 "Average Difference" HN 83 0.552 0.060 0.552 25800
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 25800
_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 0 0 HIS HA H 0 4.590 4.590 4.649 -0.059 25800
2 1 . 1 1 0 0 HIS C C 0 174.000 174.000 174.403 -0.403 25800
3 1 . 1 1 0 0 HIS CA C 0 55.300 55.300 56.266 -0.966 25800
4 1 . 1 1 0 0 HIS CB C 0 29.300 29.300 30.314 -1.014 25800
5 1 . 1 1 1 1 MET N N 1 122.400 122.400 120.375 2.025 25800
6 1 . 1 1 1 1 MET HA H 1 4.340 4.340 4.482 -0.142 25800
7 1 . 1 1 1 1 MET C C 1 175.600 175.600 175.137 0.463 25800
8 1 . 1 1 1 1 MET CA C 1 55.600 55.600 55.250 0.350 25800
9 1 . 1 1 1 1 MET CB C 1 32.800 32.800 33.556 -0.756 25800
10 1 . 1 1 1 1 MET H H 1 8.310 8.310 8.195 0.115 25800
11 1 . 1 1 2 2 VAL N N 2 123.200 123.200 121.423 1.777 25800
12 1 . 1 1 2 2 VAL HA H 2 3.960 3.960 4.274 -0.314 25800
13 1 . 1 1 2 2 VAL C C 2 175.600 175.600 175.218 0.382 25800
14 1 . 1 1 2 2 VAL CA C 2 62.300 62.300 62.415 -0.115 25800
15 1 . 1 1 2 2 VAL CB C 2 32.300 32.300 32.702 -0.402 25800
16 1 . 1 1 2 2 VAL H H 2 8.180 8.180 8.255 -0.075 25800
17 1 . 1 1 3 3 ILE N N 3 126.200 126.200 123.226 2.974 25800
18 1 . 1 1 3 3 ILE HA H 3 4.050 4.050 4.244 -0.194 25800
19 1 . 1 1 3 3 ILE C C 3 175.800 175.800 175.699 0.101 25800
20 1 . 1 1 3 3 ILE CA C 3 60.700 60.700 61.313 -0.613 25800
21 1 . 1 1 3 3 ILE CB C 3 38.300 38.300 38.902 -0.601 25800
22 1 . 1 1 3 3 ILE H H 3 8.230 8.230 8.168 0.062 25800
23 1 . 1 1 4 4 ARG N N 4 126.100 126.100 123.304 2.796 25800
24 1 . 1 1 4 4 ARG HA H 4 4.180 4.180 4.353 -0.173 25800
25 1 . 1 1 4 4 ARG C C 4 175.900 175.900 175.734 0.166 25800
26 1 . 1 1 4 4 ARG CA C 4 56.000 56.000 56.417 -0.417 25800
27 1 . 1 1 4 4 ARG CB C 4 30.700 30.700 30.796 -0.096 25800
28 1 . 1 1 4 4 ARG H H 4 8.360 8.360 8.371 -0.011 25800
29 1 . 1 1 5 5 GLU N N 5 122.200 122.200 119.529 2.671 25800
30 1 . 1 1 5 5 GLU HA H 5 4.140 4.140 4.255 -0.115 25800
31 1 . 1 1 5 5 GLU C C 5 176.100 176.100 175.428 0.672 25800
32 1 . 1 1 5 5 GLU CA C 5 56.600 56.600 56.528 0.072 25800
33 1 . 1 1 5 5 GLU CB C 5 30.300 30.300 29.944 0.356 25800
34 1 . 1 1 5 5 GLU H H 5 8.400 8.400 8.336 0.064 25800
35 1 . 1 1 6 6 SER N N 6 116.200 116.200 115.191 1.009 25800
36 1 . 1 1 6 6 SER HA H 6 4.350 4.350 4.402 -0.052 25800
37 1 . 1 1 6 6 SER C C 6 174.300 174.300 173.665 0.635 25800
38 1 . 1 1 6 6 SER CA C 6 58.200 58.200 58.383 -0.183 25800
39 1 . 1 1 6 6 SER CB C 6 63.800 63.800 63.961 -0.161 25800
40 1 . 1 1 6 6 SER H H 6 8.270 8.270 8.068 0.202 25800
41 1 . 1 1 7 7 VAL N N 7 119.800 119.800 121.751 -1.951 25800
42 1 . 1 1 7 7 VAL HA H 7 4.300 4.300 4.211 0.089 25800
43 1 . 1 1 7 7 VAL C C 7 175.500 175.500 175.095 0.405 25800
44 1 . 1 1 7 7 VAL CA C 7 61.700 61.700 61.994 -0.294 25800
45 1 . 1 1 7 7 VAL CB C 7 32.800 32.800 32.864 -0.064 25800
46 1 . 1 1 7 7 VAL H H 7 7.840 7.840 8.324 -0.484 25800
47 1 . 1 1 8 8 SER N N 8 117.800 117.800 120.682 -2.882 25800
48 1 . 1 1 8 8 SER HA H 8 4.240 4.240 4.578 -0.338 25800
49 1 . 1 1 8 8 SER C C 8 172.500 172.500 173.530 -1.030 25800
50 1 . 1 1 8 8 SER CA C 8 58.500 58.500 58.544 -0.044 25800
51 1 . 1 1 8 8 SER CB C 8 63.600 63.600 63.416 0.184 25800
52 1 . 1 1 8 8 SER H H 8 8.530 8.530 8.471 0.059 25800
53 1 . 1 1 9 9 ARG N N 9 123.000 123.000 123.695 -0.695 25800
54 1 . 1 1 9 9 ARG HA H 9 5.500 5.500 5.129 0.371 25800
55 1 . 1 1 9 9 ARG C C 9 175.000 175.000 175.136 -0.136 25800
56 1 . 1 1 9 9 ARG CA C 9 54.300 54.300 54.848 -0.548 25800
57 1 . 1 1 9 9 ARG CB C 9 33.400 33.400 33.461 -0.061 25800
58 1 . 1 1 9 9 ARG H H 9 7.350 7.350 8.296 -0.946 25800
59 1 . 1 1 10 10 ILE N N 10 114.000 114.000 121.487 -7.487 25800
60 1 . 1 1 10 10 ILE HA H 10 4.820 4.820 4.202 0.618 25800
61 1 . 1 1 10 10 ILE C C 10 173.000 173.000 174.420 -1.420 25800
62 1 . 1 1 10 10 ILE CA C 10 59.400 59.400 61.070 -1.670 25800
63 1 . 1 1 10 10 ILE CB C 10 40.900 40.900 39.493 1.407 25800
64 1 . 1 1 10 10 ILE H H 10 8.830 8.830 8.642 0.188 25800
65 1 . 1 1 11 11 TYR N N 11 123.400 123.400 127.236 -3.836 25800
66 1 . 1 1 11 11 TYR HA H 11 4.930 4.930 5.060 -0.130 25800
67 1 . 1 1 11 11 TYR C C 11 173.000 173.000 173.288 -0.288 25800
68 1 . 1 1 11 11 TYR CA C 11 56.000 56.000 55.712 0.288 25800
69 1 . 1 1 11 11 TYR CB C 11 40.900 40.900 41.788 -0.888 25800
70 1 . 1 1 11 11 TYR H H 11 8.690 8.690 8.183 0.507 25800
71 1 . 1 1 12 12 VAL N N 12 126.300 126.300 124.586 1.714 25800
72 1 . 1 1 12 12 VAL HA H 12 4.560 4.560 4.407 0.153 25800
73 1 . 1 1 12 12 VAL C C 12 174.100 174.100 173.718 0.382 25800
74 1 . 1 1 12 12 VAL CA C 12 60.200 60.200 59.843 0.357 25800
75 1 . 1 1 12 12 VAL CB C 12 33.400 33.400 35.051 -1.651 25800
76 1 . 1 1 12 12 VAL H H 12 8.370 8.370 7.856 0.514 25800
77 1 . 1 1 13 13 GLY N N 13 113.000 113.000 111.661 1.339 25800
78 1 . 1 1 13 13 GLY C C 13 173.100 173.100 173.206 -0.106 25800
79 1 . 1 1 13 13 GLY CA C 13 43.300 43.300 43.638 -0.338 25800
80 1 . 1 1 13 13 GLY H H 13 9.350 9.350 8.569 0.781 25800
81 1 . 1 1 14 14 ASN N N 14 113.900 113.900 116.716 -2.816 25800
82 1 . 1 1 14 14 ASN HA H 14 4.280 4.280 4.097 0.183 25800
83 1 . 1 1 14 14 ASN C C 14 175.800 175.800 174.990 0.810 25800
84 1 . 1 1 14 14 ASN CA C 14 53.600 53.600 54.097 -0.497 25800
85 1 . 1 1 14 14 ASN CB C 14 37.700 37.700 37.154 0.546 25800
86 1 . 1 1 14 14 ASN H H 14 8.800 8.800 8.168 0.632 25800
87 1 . 1 1 15 15 LEU N N 15 115.800 115.800 117.675 -1.875 25800
88 1 . 1 1 15 15 LEU HA H 15 4.990 4.990 4.487 0.504 25800
89 1 . 1 1 15 15 LEU CA C 15 55.600 55.600 53.610 1.990 25800
90 1 . 1 1 15 15 LEU CB C 15 41.600 41.600 41.782 -0.182 25800
91 1 . 1 1 15 15 LEU H H 15 7.150 7.150 7.405 -0.255 25800
92 1 . 1 1 16 16 PRO HA H 16 4.070 4.070 4.512 -0.442 25800
93 1 . 1 1 16 16 PRO C C 16 171.500 171.500 177.263 -5.763 25800
94 1 . 1 1 16 16 PRO CA C 16 62.500 62.500 62.842 -0.342 25800
95 1 . 1 1 16 16 PRO CB C 16 32.000 32.000 31.998 0.003 25800
96 1 . 1 1 17 17 SER N N 17 115.200 115.200 116.731 -1.531 25800
97 1 . 1 1 17 17 SER HA H 17 4.300 4.300 4.106 0.194 25800
98 1 . 1 1 17 17 SER C C 17 174.200 174.200 173.867 0.333 25800
99 1 . 1 1 17 17 SER CA C 17 58.200 58.200 59.148 -0.948 25800
100 1 . 1 1 17 17 SER CB C 17 63.900 63.900 62.808 1.092 25800
101 1 . 1 1 17 17 SER H H 17 8.470 8.470 8.586 -0.116 25800
102 1 . 1 1 18 18 HIS N N 18 120.800 120.800 119.926 0.874 25800
103 1 . 1 1 18 18 HIS HA H 18 4.550 4.550 4.561 -0.011 25800
104 1 . 1 1 18 18 HIS C C 18 175.100 175.100 174.258 0.842 25800
105 1 . 1 1 18 18 HIS CA C 18 55.500 55.500 55.971 -0.471 25800
106 1 . 1 1 18 18 HIS CB C 18 29.300 29.300 29.972 -0.672 25800
107 1 . 1 1 18 18 HIS H H 18 8.540 8.540 8.095 0.445 25800
108 1 . 1 1 19 19 VAL N N 19 115.700 115.700 119.835 -4.135 25800
109 1 . 1 1 19 19 VAL HA H 19 4.260 4.260 4.186 0.074 25800
110 1 . 1 1 19 19 VAL C C 19 174.000 174.000 175.426 -1.426 25800
111 1 . 1 1 19 19 VAL CA C 19 61.900 61.900 61.937 -0.037 25800
112 1 . 1 1 19 19 VAL CB C 19 32.600 32.600 33.153 -0.553 25800
113 1 . 1 1 19 19 VAL H H 19 6.650 6.650 7.874 -1.224 25800
114 1 . 1 1 20 20 SER N N 20 118.800 118.800 121.654 -2.854 25800
115 1 . 1 1 20 20 SER HA H 20 4.710 4.710 4.641 0.069 25800
116 1 . 1 1 20 20 SER C C 20 175.900 175.900 175.772 0.128 25800
117 1 . 1 1 20 20 SER CA C 20 55.800 55.800 57.735 -1.935 25800
118 1 . 1 1 20 20 SER CB C 20 66.600 66.600 64.604 1.996 25800
119 1 . 1 1 20 20 SER H H 20 8.930 8.930 8.418 0.512 25800
120 1 . 1 1 21 21 SER N N 21 117.100 117.100 119.887 -2.787 25800
121 1 . 1 1 21 21 SER HA H 21 3.880 3.880 4.111 -0.231 25800
122 1 . 1 1 21 21 SER C C 21 176.200 176.200 176.511 -0.311 25800
123 1 . 1 1 21 21 SER CA C 21 62.300 62.300 61.467 0.833 25800
124 1 . 1 1 21 21 SER CB C 21 66.800 66.800 63.015 3.785 25800
125 1 . 1 1 21 21 SER H H 21 9.080 9.080 8.973 0.107 25800
126 1 . 1 1 22 22 ARG N N 22 121.200 121.200 120.711 0.489 25800
127 1 . 1 1 22 22 ARG HA H 22 3.990 3.990 4.171 -0.181 25800
128 1 . 1 1 22 22 ARG C C 22 177.900 177.900 178.190 -0.290 25800
129 1 . 1 1 22 22 ARG CA C 22 58.700 58.700 58.966 -0.266 25800
130 1 . 1 1 22 22 ARG CB C 22 29.600 29.600 29.690 -0.089 25800
131 1 . 1 1 22 22 ARG H H 22 7.940 7.940 8.372 -0.432 25800
132 1 . 1 1 23 23 ASP N N 23 118.800 118.800 119.963 -1.163 25800
133 1 . 1 1 23 23 ASP HA H 23 4.390 4.390 4.521 -0.131 25800
134 1 . 1 1 23 23 ASP C C 23 179.200 179.200 178.526 0.674 25800
135 1 . 1 1 23 23 ASP CA C 23 57.300 57.300 57.089 0.211 25800
136 1 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.576 0.424 25800
137 1 . 1 1 23 23 ASP H H 23 7.480 7.480 7.750 -0.270 25800
138 1 . 1 1 24 24 VAL N N 24 119.500 119.500 119.465 0.035 25800
139 1 . 1 1 24 24 VAL HA H 24 3.370 3.370 3.760 -0.390 25800
140 1 . 1 1 24 24 VAL C C 24 177.500 177.500 177.517 -0.017 25800
141 1 . 1 1 24 24 VAL CA C 24 66.900 66.900 66.313 0.588 25800
142 1 . 1 1 24 24 VAL CB C 24 31.400 31.400 31.667 -0.267 25800
143 1 . 1 1 24 24 VAL H H 24 7.450 7.450 7.989 -0.539 25800
144 1 . 1 1 25 25 GLU N N 25 121.400 121.400 120.437 0.963 25800
145 1 . 1 1 25 25 GLU HA H 25 3.570 3.570 3.976 -0.406 25800
146 1 . 1 1 25 25 GLU C C 25 178.400 178.400 178.587 -0.187 25800
147 1 . 1 1 25 25 GLU CA C 25 60.600 60.600 60.099 0.501 25800
148 1 . 1 1 25 25 GLU CB C 25 29.600 29.600 29.428 0.172 25800
149 1 . 1 1 25 25 GLU H H 25 8.580 8.580 8.307 0.273 25800
150 1 . 1 1 26 26 ASN N N 26 114.800 114.800 116.755 -1.955 25800
151 1 . 1 1 26 26 ASN HA H 26 4.320 4.320 4.529 -0.209 25800
152 1 . 1 1 26 26 ASN C C 26 177.400 177.400 177.514 -0.114 25800
153 1 . 1 1 26 26 ASN CA C 26 55.900 55.900 55.751 0.149 25800
154 1 . 1 1 26 26 ASN CB C 26 37.900 37.900 38.646 -0.746 25800
155 1 . 1 1 26 26 ASN H H 26 8.180 8.180 7.914 0.266 25800
156 1 . 1 1 27 27 GLU N N 27 118.900 118.900 120.314 -1.413 25800
157 1 . 1 1 27 27 GLU HA H 27 4.140 4.140 4.169 -0.029 25800
158 1 . 1 1 27 27 GLU C C 27 176.400 176.400 179.018 -2.618 25800
159 1 . 1 1 27 27 GLU CA C 27 57.400 57.400 58.881 -1.481 25800
160 1 . 1 1 27 27 GLU CB C 27 29.400 29.400 29.834 -0.434 25800
161 1 . 1 1 27 27 GLU H H 27 7.340 7.340 7.964 -0.624 25800
162 1 . 1 1 28 28 PHE N N 28 114.100 114.100 118.773 -4.673 25800
163 1 . 1 1 28 28 PHE HA H 28 4.550 4.550 4.612 -0.062 25800
164 1 . 1 1 28 28 PHE C C 28 176.300 176.300 178.014 -1.714 25800
165 1 . 1 1 28 28 PHE CA C 28 60.000 60.000 60.612 -0.612 25800
166 1 . 1 1 28 28 PHE CB C 28 40.800 40.800 38.992 1.808 25800
167 1 . 1 1 28 28 PHE H H 28 7.660 7.660 8.399 -0.739 25800
168 1 . 1 1 29 29 ARG N N 29 121.700 121.700 119.316 2.384 25800
169 1 . 1 1 29 29 ARG HA H 29 4.410 4.410 4.371 0.039 25800
170 1 . 1 1 29 29 ARG C C 29 177.100 177.100 177.558 -0.458 25800
171 1 . 1 1 29 29 ARG CA C 29 58.200 58.200 58.558 -0.359 25800
172 1 . 1 1 29 29 ARG CB C 29 29.300 29.300 29.851 -0.551 25800
173 1 . 1 1 29 29 ARG H H 29 8.120 8.120 8.137 -0.017 25800
174 1 . 1 1 30 30 LYS N N 30 117.200 117.200 118.484 -1.284 25800
175 1 . 1 1 30 30 LYS HA H 30 3.830 3.830 4.134 -0.304 25800
176 1 . 1 1 30 30 LYS C C 30 177.100 177.100 178.042 -0.942 25800
177 1 . 1 1 30 30 LYS CA C 30 57.800 57.800 58.132 -0.332 25800
178 1 . 1 1 30 30 LYS CB C 30 31.100 31.100 31.927 -0.827 25800
179 1 . 1 1 30 30 LYS H H 30 7.630 7.630 7.762 -0.132 25800
180 1 . 1 1 31 31 TYR N N 31 117.100 117.100 118.259 -1.159 25800
181 1 . 1 1 31 31 TYR HA H 31 4.150 4.150 4.529 -0.379 25800
182 1 . 1 1 31 31 TYR C C 31 174.400 174.400 176.026 -1.627 25800
183 1 . 1 1 31 31 TYR CA C 31 59.900 59.900 59.301 0.599 25800
184 1 . 1 1 31 31 TYR CB C 31 37.900 37.900 39.672 -1.772 25800
185 1 . 1 1 31 31 TYR H H 31 7.410 7.410 7.979 -0.569 25800
186 1 . 1 1 32 32 GLY N N 32 104.100 104.100 104.631 -0.531 25800
187 1 . 1 1 32 32 GLY C C 32 177.000 177.000 172.278 4.723 25800
188 1 . 1 1 32 32 GLY CA C 32 44.500 44.500 44.778 -0.278 25800
189 1 . 1 1 32 32 GLY H H 32 7.240 7.240 7.663 -0.423 25800
190 1 . 1 1 33 33 ASN N N 33 115.300 115.300 119.768 -4.468 25800
191 1 . 1 1 33 33 ASN HA H 33 4.440 4.440 4.763 -0.323 25800
192 1 . 1 1 33 33 ASN C C 33 175.500 175.500 174.720 0.780 25800
193 1 . 1 1 33 33 ASN CA C 33 54.300 54.300 53.155 1.145 25800
194 1 . 1 1 33 33 ASN CB C 33 38.400 38.400 38.691 -0.291 25800
195 1 . 1 1 33 33 ASN H H 33 8.460 8.460 8.551 -0.091 25800
196 1 . 1 1 34 34 ILE N N 34 126.700 126.700 124.956 1.744 25800
197 1 . 1 1 34 34 ILE HA H 34 3.790 3.790 4.183 -0.393 25800
198 1 . 1 1 34 34 ILE C C 34 175.600 175.600 175.425 0.175 25800
199 1 . 1 1 34 34 ILE CA C 34 61.300 61.300 61.123 0.177 25800
200 1 . 1 1 34 34 ILE CB C 34 40.000 40.000 38.437 1.563 25800
201 1 . 1 1 34 34 ILE H H 34 8.050 8.050 8.197 -0.147 25800
202 1 . 1 1 35 35 LEU N N 35 127.400 127.400 128.740 -1.340 25800
203 1 . 1 1 35 35 LEU HA H 35 4.160 4.160 4.428 -0.268 25800
204 1 . 1 1 35 35 LEU C C 35 177.200 177.200 176.610 0.590 25800
205 1 . 1 1 35 35 LEU CA C 35 55.500 55.500 55.704 -0.204 25800
206 1 . 1 1 35 35 LEU CB C 35 42.700 42.700 42.662 0.038 25800
207 1 . 1 1 35 35 LEU H H 35 8.780 8.780 8.884 -0.104 25800
208 1 . 1 1 36 36 LYS N N 36 117.000 117.000 117.439 -0.439 25800
209 1 . 1 1 36 36 LYS HA H 36 4.240 4.240 4.570 -0.330 25800
210 1 . 1 1 36 36 LYS C C 36 173.600 173.600 174.020 -0.420 25800
211 1 . 1 1 36 36 LYS CA C 36 55.900 55.900 55.718 0.182 25800
212 1 . 1 1 36 36 LYS CB C 36 36.600 36.600 35.690 0.910 25800
213 1 . 1 1 36 36 LYS H H 36 7.110 7.110 7.611 -0.501 25800
214 1 . 1 1 37 37 CYS N N 37 125.400 125.400 120.471 4.929 25800
215 1 . 1 1 37 37 CYS HA H 37 4.700 4.700 5.617 -0.917 25800
216 1 . 1 1 37 37 CYS C C 37 171.600 171.600 172.959 -1.359 25800
217 1 . 1 1 37 37 CYS CA C 37 57.900 57.900 56.792 1.108 25800
218 1 . 1 1 37 37 CYS CB C 37 27.100 27.100 31.126 -4.026 25800
219 1 . 1 1 37 37 CYS H H 37 8.610 8.610 8.607 0.003 25800
220 1 . 1 1 38 38 ASP N N 38 128.200 128.200 122.555 5.645 25800
221 1 . 1 1 38 38 ASP HA H 38 4.950 4.950 5.002 -0.052 25800
222 1 . 1 1 38 38 ASP C C 38 174.300 174.300 174.050 0.250 25800
223 1 . 1 1 38 38 ASP CA C 38 53.200 53.200 53.921 -0.721 25800
224 1 . 1 1 38 38 ASP CB C 38 44.300 44.300 45.473 -1.173 25800
225 1 . 1 1 38 38 ASP H H 38 8.290 8.290 8.795 -0.505 25800
226 1 . 1 1 39 39 VAL N N 39 123.500 123.500 120.063 3.437 25800
227 1 . 1 1 39 39 VAL HA H 39 4.300 4.300 4.980 -0.680 25800
228 1 . 1 1 39 39 VAL C C 39 175.000 175.000 175.036 -0.036 25800
229 1 . 1 1 39 39 VAL CA C 39 61.700 61.700 61.156 0.544 25800
230 1 . 1 1 39 39 VAL CB C 39 33.100 33.100 34.216 -1.116 25800
231 1 . 1 1 39 39 VAL H H 39 8.380 8.380 8.546 -0.166 25800
232 1 . 1 1 40 40 LYS N N 40 129.100 129.100 126.426 2.674 25800
233 1 . 1 1 40 40 LYS HA H 40 4.320 4.320 4.889 -0.569 25800
234 1 . 1 1 40 40 LYS C C 40 173.700 173.700 174.660 -0.960 25800
235 1 . 1 1 40 40 LYS CA C 40 53.900 53.900 54.600 -0.700 25800
236 1 . 1 1 40 40 LYS CB C 40 35.500 35.500 35.751 -0.251 25800
237 1 . 1 1 40 40 LYS H H 40 8.680 8.680 9.274 -0.594 25800
238 1 . 1 1 41 41 LYS N N 41 117.300 117.300 120.601 -3.301 25800
239 1 . 1 1 41 41 LYS HA H 41 4.980 4.980 5.235 -0.255 25800
240 1 . 1 1 41 41 LYS C C 41 177.800 177.800 175.537 2.263 25800
241 1 . 1 1 41 41 LYS CA C 41 54.600 54.600 54.607 -0.007 25800
242 1 . 1 1 41 41 LYS CB C 41 35.000 35.000 35.330 -0.330 25800
243 1 . 1 1 41 41 LYS H H 41 7.900 7.900 8.377 -0.477 25800
244 1 . 1 1 42 42 THR N N 42 113.200 113.200 114.659 -1.459 25800
245 1 . 1 1 42 42 THR HA H 42 4.680 4.680 4.730 -0.050 25800
246 1 . 1 1 42 42 THR C C 42 176.900 176.900 176.260 0.640 25800
247 1 . 1 1 42 42 THR CA C 42 60.200 60.200 60.487 -0.287 25800
248 1 . 1 1 42 42 THR CB C 42 71.600 71.600 70.136 1.464 25800
249 1 . 1 1 42 42 THR H H 42 8.730 8.730 8.452 0.278 25800
250 1 . 1 1 43 43 VAL N N 43 120.000 120.000 123.029 -3.029 25800
251 1 . 1 1 43 43 VAL HA H 43 3.920 3.920 3.981 -0.061 25800
252 1 . 1 1 43 43 VAL C C 43 177.000 177.000 176.615 0.385 25800
253 1 . 1 1 43 43 VAL CA C 43 64.700 64.700 64.446 0.254 25800
254 1 . 1 1 43 43 VAL CB C 43 31.800 31.800 31.740 0.060 25800
255 1 . 1 1 43 43 VAL H H 43 8.730 8.730 8.557 0.173 25800
256 1 . 1 1 44 44 SER N N 44 113.400 113.400 115.166 -1.766 25800
257 1 . 1 1 44 44 SER HA H 44 4.360 4.360 4.371 -0.011 25800
258 1 . 1 1 44 44 SER C C 44 174.800 174.800 175.330 -0.530 25800
259 1 . 1 1 44 44 SER CA C 44 58.400 58.400 58.562 -0.162 25800
260 1 . 1 1 44 44 SER CB C 44 63.500 63.500 63.340 0.160 25800
261 1 . 1 1 44 44 SER H H 44 7.760 7.760 8.015 -0.255 25800
262 1 . 1 1 45 45 GLY N N 45 110.200 110.200 108.697 1.503 25800
263 1 . 1 1 45 45 GLY C C 45 173.500 173.500 173.985 -0.485 25800
264 1 . 1 1 45 45 GLY CA C 45 45.300 45.300 44.969 0.331 25800
265 1 . 1 1 45 45 GLY H H 45 7.820 7.820 7.776 0.044 25800
266 1 . 1 1 46 46 ALA N N 46 123.900 123.900 122.664 1.236 25800
267 1 . 1 1 46 46 ALA HA H 46 4.390 4.390 4.289 0.101 25800
268 1 . 1 1 46 46 ALA C C 46 176.100 176.100 175.585 0.515 25800
269 1 . 1 1 46 46 ALA CA C 46 51.900 51.900 51.805 0.095 25800
270 1 . 1 1 46 46 ALA CB C 46 19.800 19.800 20.032 -0.232 25800
271 1 . 1 1 46 46 ALA H H 46 7.440 7.440 7.741 -0.301 25800
272 1 . 1 1 47 47 ALA N N 47 123.100 123.100 123.473 -0.373 25800
273 1 . 1 1 47 47 ALA HA H 47 5.200 5.200 5.031 0.169 25800
274 1 . 1 1 47 47 ALA C C 47 176.100 176.100 175.408 0.692 25800
275 1 . 1 1 47 47 ALA CA C 47 50.900 50.900 50.248 0.652 25800
276 1 . 1 1 47 47 ALA CB C 47 21.900 21.900 21.951 -0.051 25800
277 1 . 1 1 47 47 ALA H H 47 8.350 8.350 8.008 0.342 25800
278 1 . 1 1 48 48 PHE N N 48 118.700 118.700 117.700 1.000 25800
279 1 . 1 1 48 48 PHE HA H 48 5.030 5.030 5.299 -0.269 25800
280 1 . 1 1 48 48 PHE C C 48 171.600 171.600 174.099 -2.499 25800
281 1 . 1 1 48 48 PHE CA C 48 55.700 55.700 56.480 -0.780 25800
282 1 . 1 1 48 48 PHE CB C 48 41.200 41.200 43.220 -2.020 25800
283 1 . 1 1 48 48 PHE H H 48 8.550 8.550 8.895 -0.345 25800
284 1 . 1 1 49 49 ALA N N 49 120.400 120.400 124.144 -3.744 25800
285 1 . 1 1 49 49 ALA HA H 49 5.330 5.330 5.267 0.063 25800
286 1 . 1 1 49 49 ALA C C 49 175.500 175.500 175.308 0.192 25800
287 1 . 1 1 49 49 ALA CA C 49 49.300 49.300 50.406 -1.106 25800
288 1 . 1 1 49 49 ALA CB C 49 23.700 23.700 21.690 2.010 25800
289 1 . 1 1 49 49 ALA H H 49 9.240 9.240 8.791 0.449 25800
290 1 . 1 1 50 50 PHE N N 50 115.000 115.000 120.044 -5.044 25800
291 1 . 1 1 50 50 PHE HA H 50 5.600 5.600 5.525 0.075 25800
292 1 . 1 1 50 50 PHE C C 50 176.000 176.000 174.322 1.678 25800
293 1 . 1 1 50 50 PHE CA C 50 56.500 56.500 56.468 0.032 25800
294 1 . 1 1 50 50 PHE CB C 50 42.200 42.200 43.155 -0.955 25800
295 1 . 1 1 50 50 PHE H H 50 7.920 7.920 8.920 -1.000 25800
296 1 . 1 1 51 51 ILE N N 51 123.000 123.000 121.771 1.229 25800
297 1 . 1 1 51 51 ILE HA H 51 4.450 4.450 4.680 -0.230 25800
298 1 . 1 1 51 51 ILE C C 51 173.700 173.700 174.284 -0.584 25800
299 1 . 1 1 51 51 ILE CA C 51 60.200 60.200 60.488 -0.288 25800
300 1 . 1 1 51 51 ILE CB C 51 40.700 40.700 41.434 -0.734 25800
301 1 . 1 1 51 51 ILE H H 51 8.490 8.490 8.708 -0.218 25800
302 1 . 1 1 52 52 GLU N N 52 126.600 126.600 126.453 0.147 25800
303 1 . 1 1 52 52 GLU HA H 52 4.770 4.770 4.904 -0.134 25800
304 1 . 1 1 52 52 GLU C C 52 175.300 175.300 175.149 0.151 25800
305 1 . 1 1 52 52 GLU CA C 52 54.700 54.700 55.437 -0.737 25800
306 1 . 1 1 52 52 GLU CB C 52 31.500 31.500 32.013 -0.513 25800
307 1 . 1 1 52 52 GLU H H 52 8.610 8.610 8.953 -0.343 25800
308 1 . 1 1 53 53 PHE N N 53 126.100 126.100 124.856 1.244 25800
309 1 . 1 1 53 53 PHE HA H 53 4.800 4.800 5.106 -0.305 25800
310 1 . 1 1 53 53 PHE C C 53 175.400 175.400 175.645 -0.245 25800
311 1 . 1 1 53 53 PHE CA C 53 58.200 58.200 56.527 1.673 25800
312 1 . 1 1 53 53 PHE CB C 53 40.900 40.900 42.407 -1.507 25800
313 1 . 1 1 53 53 PHE H H 53 8.800 8.800 8.861 -0.061 25800
314 1 . 1 1 54 54 GLU N N 54 120.700 120.700 121.624 -0.924 25800
315 1 . 1 1 54 54 GLU HA H 54 3.930 3.930 4.211 -0.281 25800
316 1 . 1 1 54 54 GLU C C 54 175.300 175.300 176.131 -0.831 25800
317 1 . 1 1 54 54 GLU CA C 54 59.100 59.100 57.982 1.118 25800
318 1 . 1 1 54 54 GLU CB C 54 30.800 30.800 30.441 0.359 25800
319 1 . 1 1 54 54 GLU H H 54 8.160 8.160 8.576 -0.416 25800
320 1 . 1 1 55 55 ASP N N 55 117.900 117.900 119.044 -1.144 25800
321 1 . 1 1 55 55 ASP HA H 55 4.920 4.920 4.811 0.109 25800
322 1 . 1 1 55 55 ASP C C 55 176.400 176.400 175.520 0.880 25800
323 1 . 1 1 55 55 ASP CA C 55 52.400 52.400 53.233 -0.833 25800
324 1 . 1 1 55 55 ASP CB C 55 44.400 44.400 42.007 2.393 25800
325 1 . 1 1 55 55 ASP H H 55 8.740 8.740 7.995 0.745 25800
326 1 . 1 1 56 56 ALA N N 56 128.900 128.900 126.107 2.794 25800
327 1 . 1 1 56 56 ALA HA H 56 3.830 3.830 3.564 0.266 25800
328 1 . 1 1 56 56 ALA C C 56 179.800 179.800 178.624 1.176 25800
329 1 . 1 1 56 56 ALA CA C 56 55.200 55.200 54.897 0.303 25800
330 1 . 1 1 56 56 ALA CB C 56 18.900 18.900 18.956 -0.056 25800
331 1 . 1 1 56 56 ALA H H 56 8.800 8.800 8.434 0.366 25800
332 1 . 1 1 57 57 ARG N N 57 119.200 119.200 117.006 2.194 25800
333 1 . 1 1 57 57 ARG HA H 57 3.890 3.890 4.117 -0.227 25800
334 1 . 1 1 57 57 ARG C C 57 178.000 178.000 177.237 0.763 25800
335 1 . 1 1 57 57 ARG CA C 57 58.900 58.900 58.577 0.323 25800
336 1 . 1 1 57 57 ARG CB C 57 29.300 29.300 29.255 0.045 25800
337 1 . 1 1 57 57 ARG H H 57 8.950 8.950 8.372 0.578 25800
338 1 . 1 1 58 58 ASP N N 58 120.900 120.900 119.219 1.681 25800
339 1 . 1 1 58 58 ASP HA H 58 4.090 4.090 4.537 -0.447 25800
340 1 . 1 1 58 58 ASP C C 58 176.700 176.700 177.762 -1.062 25800
341 1 . 1 1 58 58 ASP CA C 58 56.500 56.500 56.600 -0.100 25800
342 1 . 1 1 58 58 ASP CB C 58 39.900 39.900 40.855 -0.955 25800
343 1 . 1 1 58 58 ASP H H 58 7.020 7.020 8.038 -1.018 25800
344 1 . 1 1 59 59 ALA N N 59 119.700 119.700 122.082 -2.382 25800
345 1 . 1 1 59 59 ALA HA H 59 3.080 3.080 4.206 -1.126 25800
346 1 . 1 1 59 59 ALA C C 59 178.100 178.100 179.225 -1.125 25800
347 1 . 1 1 59 59 ALA CA C 59 54.300 54.300 54.340 -0.040 25800
348 1 . 1 1 59 59 ALA CB C 59 18.400 18.400 18.346 0.054 25800
349 1 . 1 1 59 59 ALA H H 59 6.440 6.440 7.765 -1.325 25800
350 1 . 1 1 60 60 ALA N N 60 117.600 117.600 121.315 -3.715 25800
351 1 . 1 1 60 60 ALA HA H 60 3.830 3.830 4.053 -0.223 25800
352 1 . 1 1 60 60 ALA C C 60 180.900 180.900 178.945 1.955 25800
353 1 . 1 1 60 60 ALA CA C 60 54.900 54.900 55.188 -0.288 25800
354 1 . 1 1 60 60 ALA CB C 60 17.700 17.700 18.310 -0.610 25800
355 1 . 1 1 60 60 ALA H H 60 7.330 7.330 8.186 -0.856 25800
356 1 . 1 1 61 61 ASP N N 61 120.100 120.100 118.268 1.832 25800
357 1 . 1 1 61 61 ASP HA H 61 4.210 4.210 4.438 -0.228 25800
358 1 . 1 1 61 61 ASP C C 61 176.700 176.700 177.618 -0.918 25800
359 1 . 1 1 61 61 ASP CA C 61 57.100 57.100 56.785 0.315 25800
360 1 . 1 1 61 61 ASP CB C 61 40.100 40.100 40.448 -0.348 25800
361 1 . 1 1 61 61 ASP H H 61 7.590 7.590 7.989 -0.399 25800
362 1 . 1 1 62 62 ALA N N 62 122.200 122.200 121.612 0.588 25800
363 1 . 1 1 62 62 ALA HA H 62 2.420 2.420 3.990 -1.571 25800
364 1 . 1 1 62 62 ALA C C 62 179.300 179.300 179.076 0.224 25800
365 1 . 1 1 62 62 ALA CA C 62 54.600 54.600 54.084 0.516 25800
366 1 . 1 1 62 62 ALA CB C 62 19.100 19.100 18.702 0.398 25800
367 1 . 1 1 62 62 ALA H H 62 7.440 7.440 7.453 -0.013 25800
368 1 . 1 1 63 63 ILE N N 63 116.700 116.700 118.978 -2.278 25800
369 1 . 1 1 63 63 ILE HA H 63 3.240 3.240 3.978 -0.738 25800
370 1 . 1 1 63 63 ILE C C 63 177.800 177.800 177.611 0.189 25800
371 1 . 1 1 63 63 ILE CA C 63 65.600 65.600 63.250 2.350 25800
372 1 . 1 1 63 63 ILE CB C 63 38.900 38.900 38.010 0.890 25800
373 1 . 1 1 63 63 ILE H H 63 7.540 7.540 7.872 -0.332 25800
374 1 . 1 1 64 64 LYS N N 64 117.400 117.400 118.975 -1.576 25800
375 1 . 1 1 64 64 LYS HA H 64 3.900 3.900 4.192 -0.292 25800
376 1 . 1 1 64 64 LYS C C 64 178.900 178.900 178.051 0.849 25800
377 1 . 1 1 64 64 LYS CA C 64 58.800 58.800 58.367 0.433 25800
378 1 . 1 1 64 64 LYS CB C 64 32.600 32.600 31.750 0.850 25800
379 1 . 1 1 64 64 LYS H H 64 7.490 7.490 8.206 -0.716 25800
380 1 . 1 1 65 65 GLU N N 65 113.800 113.800 118.008 -4.208 25800
381 1 . 1 1 65 65 GLU HA H 65 4.160 4.160 4.302 -0.142 25800
382 1 . 1 1 65 65 GLU C C 65 178.300 178.300 177.554 0.746 25800
383 1 . 1 1 65 65 GLU CA C 65 58.300 58.300 57.782 0.518 25800
384 1 . 1 1 65 65 GLU CB C 65 30.700 30.700 29.521 1.179 25800
385 1 . 1 1 65 65 GLU H H 65 7.960 7.960 7.992 -0.032 25800
386 1 . 1 1 66 66 LYS N N 66 114.700 114.700 118.418 -3.718 25800
387 1 . 1 1 66 66 LYS HA H 66 4.470 4.470 4.444 0.026 25800
388 1 . 1 1 66 66 LYS C C 66 177.500 177.500 176.654 0.846 25800
389 1 . 1 1 66 66 LYS CA C 66 54.400 54.400 55.621 -1.221 25800
390 1 . 1 1 66 66 LYS CB C 66 33.000 33.000 32.328 0.672 25800
391 1 . 1 1 66 66 LYS H H 66 8.050 8.050 7.833 0.217 25800
392 1 . 1 1 67 67 ASP N N 67 118.800 118.800 120.158 -1.358 25800
393 1 . 1 1 67 67 ASP HA H 67 4.220 4.220 4.480 -0.260 25800
394 1 . 1 1 67 67 ASP C C 67 177.700 177.700 177.494 0.206 25800
395 1 . 1 1 67 67 ASP CA C 67 58.400 58.400 54.426 3.974 25800
396 1 . 1 1 67 67 ASP CB C 67 41.400 41.400 41.187 0.213 25800
397 1 . 1 1 67 67 ASP H H 67 7.620 7.620 7.605 0.015 25800
398 1 . 1 1 68 68 GLY N N 68 115.600 115.600 107.899 7.701 25800
399 1 . 1 1 68 68 GLY C C 68 173.800 173.800 174.769 -0.969 25800
400 1 . 1 1 68 68 GLY CA C 68 45.900 45.900 44.720 1.180 25800
401 1 . 1 1 68 68 GLY H H 68 8.470 8.470 8.591 -0.121 25800
402 1 . 1 1 69 69 CYS N N 69 119.200 119.200 119.779 -0.579 25800
403 1 . 1 1 69 69 CYS HA H 69 4.160 4.160 4.711 -0.551 25800
404 1 . 1 1 69 69 CYS C C 69 172.600 172.600 174.284 -1.684 25800
405 1 . 1 1 69 69 CYS CA C 69 58.000 58.000 57.780 0.220 25800
406 1 . 1 1 69 69 CYS CB C 69 28.700 28.700 29.049 -0.349 25800
407 1 . 1 1 69 69 CYS H H 69 7.890 7.890 8.182 -0.292 25800
408 1 . 1 1 70 70 ASP N N 70 122.200 122.200 124.068 -1.868 25800
409 1 . 1 1 70 70 ASP HA H 70 4.830 4.830 4.751 0.079 25800
410 1 . 1 1 70 70 ASP C C 70 176.400 176.400 174.575 1.825 25800
411 1 . 1 1 70 70 ASP CA C 70 54.700 54.700 53.677 1.023 25800
412 1 . 1 1 70 70 ASP CB C 70 42.700 42.700 43.798 -1.098 25800
413 1 . 1 1 70 70 ASP H H 70 8.360 8.360 8.679 -0.319 25800
414 1 . 1 1 71 71 PHE N N 71 127.600 127.600 119.988 7.612 25800
415 1 . 1 1 71 71 PHE HA H 71 4.600 4.600 5.080 -0.480 25800
416 1 . 1 1 71 71 PHE C C 71 173.600 173.600 175.043 -1.443 25800
417 1 . 1 1 71 71 PHE CA C 71 56.800 56.800 56.871 -0.071 25800
418 1 . 1 1 71 71 PHE CB C 71 40.700 40.700 41.359 -0.659 25800
419 1 . 1 1 71 71 PHE H H 71 9.390 9.390 7.824 1.566 25800
420 1 . 1 1 72 72 GLU N N 72 123.900 123.900 119.479 4.421 25800
421 1 . 1 1 72 72 GLU HA H 72 3.540 3.540 4.063 -0.523 25800
422 1 . 1 1 72 72 GLU C C 72 175.500 175.500 176.085 -0.585 25800
423 1 . 1 1 72 72 GLU CA C 72 56.700 56.700 57.043 -0.343 25800
424 1 . 1 1 72 72 GLU CB C 72 27.300 27.300 28.801 -1.501 25800
425 1 . 1 1 72 72 GLU H H 72 8.940 8.940 9.018 -0.078 25800
426 1 . 1 1 73 73 GLY N N 73 105.200 105.200 107.104 -1.904 25800
427 1 . 1 1 73 73 GLY C C 73 174.100 174.100 173.995 0.105 25800
428 1 . 1 1 73 73 GLY CA C 73 45.600 45.600 45.100 0.500 25800
429 1 . 1 1 73 73 GLY H H 73 8.350 8.350 8.285 0.065 25800
430 1 . 1 1 74 74 ASN N N 74 121.000 121.000 120.333 0.667 25800
431 1 . 1 1 74 74 ASN HA H 74 4.760 4.760 4.824 -0.064 25800
432 1 . 1 1 74 74 ASN C C 74 174.000 174.000 173.737 0.263 25800
433 1 . 1 1 74 74 ASN CA C 74 50.900 50.900 52.948 -2.048 25800
434 1 . 1 1 74 74 ASN CB C 74 39.700 39.700 39.789 -0.089 25800
435 1 . 1 1 74 74 ASN H H 74 7.740 7.740 8.079 -0.339 25800
436 1 . 1 1 75 75 LYS N N 75 121.400 121.400 120.470 0.930 25800
437 1 . 1 1 75 75 LYS HA H 75 4.470 4.470 4.658 -0.188 25800
438 1 . 1 1 75 75 LYS C C 75 176.900 176.900 174.824 2.076 25800
439 1 . 1 1 75 75 LYS CA C 75 55.300 55.300 55.796 -0.496 25800
440 1 . 1 1 75 75 LYS CB C 75 31.900 31.900 33.121 -1.221 25800
441 1 . 1 1 75 75 LYS H H 75 8.380 8.380 8.434 -0.054 25800
442 1 . 1 1 76 76 LEU N N 76 127.400 127.400 123.687 3.712 25800
443 1 . 1 1 76 76 LEU HA H 76 4.430 4.430 4.576 -0.146 25800
444 1 . 1 1 76 76 LEU C C 76 177.600 177.600 174.327 3.273 25800
445 1 . 1 1 76 76 LEU CA C 76 55.300 55.300 55.152 0.148 25800
446 1 . 1 1 76 76 LEU CB C 76 43.100 43.100 45.511 -2.410 25800
447 1 . 1 1 76 76 LEU H H 76 8.950 8.950 8.422 0.528 25800
448 1 . 1 1 77 77 ARG N N 77 121.800 121.800 124.886 -3.086 25800
449 1 . 1 1 77 77 ARG HA H 77 4.900 4.900 4.796 0.104 25800
450 1 . 1 1 77 77 ARG C C 77 174.700 174.700 173.829 0.871 25800
451 1 . 1 1 77 77 ARG CA C 77 54.000 54.000 55.464 -1.464 25800
452 1 . 1 1 77 77 ARG CB C 77 32.300 32.300 32.820 -0.520 25800
453 1 . 1 1 77 77 ARG H H 77 7.530 7.530 8.629 -1.099 25800
454 1 . 1 1 78 78 VAL N N 78 127.000 127.000 124.265 2.735 25800
455 1 . 1 1 78 78 VAL HA H 78 5.280 5.280 4.466 0.815 25800
456 1 . 1 1 78 78 VAL C C 78 174.200 174.200 174.506 -0.306 25800
457 1 . 1 1 78 78 VAL CA C 78 61.200 61.200 61.502 -0.302 25800
458 1 . 1 1 78 78 VAL CB C 78 33.400 33.400 34.386 -0.986 25800
459 1 . 1 1 78 78 VAL H H 78 9.660 9.660 8.508 1.152 25800
460 1 . 1 1 79 79 GLU N N 79 121.900 121.900 126.593 -4.693 25800
461 1 . 1 1 79 79 GLU HA H 79 4.710 4.710 4.623 0.087 25800
462 1 . 1 1 79 79 GLU C C 79 174.600 174.600 174.042 0.558 25800
463 1 . 1 1 79 79 GLU CA C 79 53.900 53.900 55.509 -1.609 25800
464 1 . 1 1 79 79 GLU CB C 79 34.400 34.400 34.084 0.316 25800
465 1 . 1 1 79 79 GLU H H 79 8.980 8.980 8.357 0.623 25800
466 1 . 1 1 80 80 VAL N N 80 121.300 121.300 121.982 -0.682 25800
467 1 . 1 1 80 80 VAL HA H 80 4.370 4.370 4.422 -0.052 25800
468 1 . 1 1 80 80 VAL CA C 80 61.000 61.000 58.690 2.310 25800
469 1 . 1 1 80 80 VAL CB C 80 32.100 32.100 33.191 -1.091 25800
470 1 . 1 1 80 80 VAL H H 80 8.410 8.410 8.428 -0.018 25800
471 1 . 1 1 81 81 PRO HA H 81 4.260 4.260 4.449 -0.189 25800
472 1 . 1 1 81 81 PRO C C 81 176.100 176.100 176.671 -0.571 25800
473 1 . 1 1 81 81 PRO CA C 81 63.100 63.100 64.051 -0.951 25800
474 1 . 1 1 81 81 PRO CB C 81 32.100 32.100 31.326 0.774 25800
475 1 . 1 1 82 82 PHE N N 82 122.200 122.200 116.555 5.645 25800
476 1 . 1 1 82 82 PHE HA H 82 4.290 4.290 4.592 -0.302 25800
477 1 . 1 1 82 82 PHE C C 82 175.300 175.300 175.482 -0.182 25800
478 1 . 1 1 82 82 PHE CA C 82 58.100 58.100 56.323 1.777 25800
479 1 . 1 1 82 82 PHE CB C 82 39.400 39.400 38.021 1.379 25800
480 1 . 1 1 82 82 PHE H H 82 8.150 8.150 7.742 0.408 25800
481 1 . 1 1 83 83 ASN N N 83 120.800 120.800 118.829 1.971 25800
482 1 . 1 1 83 83 ASN HA H 83 4.440 4.440 4.435 0.005 25800
483 1 . 1 1 83 83 ASN C C 83 174.100 174.100 174.663 -0.563 25800
484 1 . 1 1 83 83 ASN CA C 83 52.700 52.700 53.644 -0.944 25800
485 1 . 1 1 83 83 ASN CB C 83 38.700 38.700 37.796 0.904 25800
486 1 . 1 1 83 83 ASN H H 83 8.110 8.110 8.069 0.041 25800
487 1 . 1 1 84 84 ALA N N 84 123.700 123.700 121.859 1.841 25800
488 1 . 1 1 84 84 ALA HA H 84 4.080 4.080 4.506 -0.425 25800
489 1 . 1 1 84 84 ALA C C 84 177.100 177.100 176.798 0.302 25800
490 1 . 1 1 84 84 ALA CA C 84 52.400 52.400 52.282 0.118 25800
491 1 . 1 1 84 84 ALA CB C 84 19.100 19.100 20.299 -1.199 25800
492 1 . 1 1 84 84 ALA H H 84 8.020 8.020 8.080 -0.060 25800
493 1 . 1 1 85 85 ARG N N 85 120.200 120.200 119.849 0.351 25800
494 1 . 1 1 85 85 ARG HA H 85 4.150 4.150 4.355 -0.205 25800
495 1 . 1 1 85 85 ARG C C 85 175.200 175.200 175.553 -0.353 25800
496 1 . 1 1 85 85 ARG CA C 85 56.000 56.000 56.493 -0.493 25800
497 1 . 1 1 85 85 ARG CB C 85 30.800 30.800 30.359 0.441 25800
498 1 . 1 1 85 85 ARG H H 85 8.040 8.040 8.575 -0.535 25800
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