data_18880
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18880
_Entry.PDB_ID 2M1U
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 18880
_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 10 10 HIS C C 10 176.040 176.040 176.268 -0.228 18880
2 1 1 . 1 1 11 11 SER N N 11 116.840 116.840 114.790 2.050 18880
3 1 1 . 1 1 11 11 SER HA H 11 4.430 4.430 4.417 0.013 18880
4 1 1 . 1 1 11 11 SER C C 11 174.630 174.630 174.840 -0.210 18880
5 1 1 . 1 1 11 11 SER CA C 11 58.350 58.350 60.964 -2.614 18880
6 1 1 . 1 1 11 11 SER CB C 11 64.120 64.120 63.493 0.627 18880
7 1 1 . 1 1 11 11 SER H H 11 8.360 8.360 8.478 -0.118 18880
8 1 1 . 1 1 12 12 SER N N 12 118.030 118.030 117.023 1.007 18880
9 1 1 . 1 1 12 12 SER HA H 12 4.440 4.440 4.568 -0.128 18880
10 1 1 . 1 1 12 12 SER C C 12 174.880 174.880 174.285 0.595 18880
11 1 1 . 1 1 12 12 SER CA C 12 58.680 58.680 58.179 0.501 18880
12 1 1 . 1 1 12 12 SER CB C 12 63.890 63.890 65.139 -1.249 18880
13 1 1 . 1 1 12 12 SER H H 12 8.490 8.490 7.700 0.790 18880
14 1 1 . 1 1 13 13 GLY N N 13 110.450 110.450 111.960 -1.510 18880
15 1 1 . 1 1 13 13 GLY C C 13 173.790 173.790 174.214 -0.424 18880
16 1 1 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.007 0.453 18880
17 1 1 . 1 1 13 13 GLY H H 13 8.390 8.390 8.612 -0.222 18880
18 1 1 . 1 1 14 14 LEU N N 14 121.310 121.310 122.650 -1.340 18880
19 1 1 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.057 0.283 18880
20 1 1 . 1 1 14 14 LEU C C 14 176.930 176.930 175.471 1.459 18880
21 1 1 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.407 -0.207 18880
22 1 1 . 1 1 14 14 LEU CB C 14 42.600 42.600 40.604 1.996 18880
23 1 1 . 1 1 14 14 LEU H H 14 8.020 8.020 8.072 -0.052 18880
24 1 1 . 1 1 15 15 VAL N N 15 121.550 121.550 120.716 0.834 18880
25 1 1 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.431 -0.061 18880
26 1 1 . 1 1 15 15 VAL CA C 15 59.720 59.720 60.070 -0.350 18880
27 1 1 . 1 1 15 15 VAL CB C 15 32.770 32.770 32.046 0.724 18880
28 1 1 . 1 1 15 15 VAL H H 15 8.030 8.030 7.921 0.109 18880
29 1 1 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.335 0.035 18880
30 1 1 . 1 1 16 16 PRO C C 16 176.720 176.720 176.342 0.378 18880
31 1 1 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.866 -1.216 18880
32 1 1 . 1 1 16 16 PRO CB C 16 32.240 32.240 31.798 0.442 18880
33 1 1 . 1 1 17 17 ARG N N 17 121.890 121.890 118.606 3.284 18880
34 1 1 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.056 0.224 18880
35 1 1 . 1 1 17 17 ARG C C 17 176.940 176.940 177.794 -0.854 18880
36 1 1 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.927 -0.567 18880
37 1 1 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.300 0.749 18880
38 1 1 . 1 1 17 17 ARG H H 17 8.450 8.450 7.431 1.019 18880
39 1 1 . 1 1 18 18 GLY N N 18 110.160 110.160 110.902 -0.742 18880
40 1 1 . 1 1 18 18 GLY C C 18 174.110 174.110 175.117 -1.007 18880
41 1 1 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.840 -0.450 18880
42 1 1 . 1 1 18 18 GLY H H 18 8.480 8.480 8.972 -0.492 18880
43 1 1 . 1 1 19 19 SER N N 19 115.500 115.500 119.002 -3.502 18880
44 1 1 . 1 1 19 19 SER HA H 19 4.400 4.400 4.690 -0.290 18880
45 1 1 . 1 1 19 19 SER C C 19 174.380 174.380 174.119 0.261 18880
46 1 1 . 1 1 19 19 SER CA C 19 58.610 58.610 58.220 0.390 18880
47 1 1 . 1 1 19 19 SER CB C 19 63.830 63.830 63.781 0.049 18880
48 1 1 . 1 1 19 19 SER H H 19 8.210 8.210 8.130 0.080 18880
49 1 1 . 1 1 20 20 HIS N N 20 120.770 120.770 121.085 -0.315 18880
50 1 1 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.642 -0.032 18880
51 1 1 . 1 1 20 20 HIS C C 20 174.870 174.870 175.817 -0.947 18880
52 1 1 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.154 -0.024 18880
53 1 1 . 1 1 20 20 HIS CB C 20 29.710 29.710 31.027 -1.317 18880
54 1 1 . 1 1 20 20 HIS H H 20 8.590 8.590 8.176 0.414 18880
55 1 1 . 1 1 21 21 MET N N 21 121.440 121.440 120.868 0.572 18880
56 1 1 . 1 1 21 21 MET HA H 21 4.470 4.470 4.408 0.062 18880
57 1 1 . 1 1 21 21 MET C C 21 176.030 176.030 176.350 -0.320 18880
58 1 1 . 1 1 21 21 MET CA C 21 55.490 55.490 55.504 -0.014 18880
59 1 1 . 1 1 21 21 MET CB C 21 33.170 33.170 31.308 1.862 18880
60 1 1 . 1 1 21 21 MET H H 21 8.310 8.310 8.354 -0.044 18880
61 1 1 . 1 1 22 22 SER N N 22 116.860 116.860 116.826 0.034 18880
62 1 1 . 1 1 22 22 SER HA H 22 4.430 4.430 4.626 -0.196 18880
63 1 1 . 1 1 22 22 SER C C 22 174.630 174.630 174.888 -0.258 18880
64 1 1 . 1 1 22 22 SER CA C 22 58.410 58.410 59.775 -1.365 18880
65 1 1 . 1 1 22 22 SER CB C 22 64.030 64.030 63.656 0.374 18880
66 1 1 . 1 1 22 22 SER H H 22 8.340 8.340 8.182 0.158 18880
67 1 1 . 1 1 23 23 ASP N N 23 122.660 122.660 121.149 1.511 18880
68 1 1 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.798 -0.248 18880
69 1 1 . 1 1 23 23 ASP C C 23 176.860 176.860 177.273 -0.413 18880
70 1 1 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.842 -0.512 18880
71 1 1 . 1 1 23 23 ASP CB C 23 41.000 41.000 41.703 -0.703 18880
72 1 1 . 1 1 23 23 ASP H H 23 8.540 8.540 8.440 0.100 18880
73 1 1 . 1 1 24 24 GLU N N 24 120.400 120.400 119.094 1.306 18880
74 1 1 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.071 0.069 18880
75 1 1 . 1 1 24 24 GLU C C 24 177.540 177.540 177.946 -0.406 18880
76 1 1 . 1 1 24 24 GLU CA C 24 58.360 58.360 59.164 -0.804 18880
77 1 1 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.314 0.437 18880
78 1 1 . 1 1 24 24 GLU H H 24 8.610 8.610 8.489 0.121 18880
79 1 1 . 1 1 25 25 LYS N N 25 120.390 120.390 117.475 2.915 18880
80 1 1 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.208 -0.018 18880
81 1 1 . 1 1 25 25 LYS C C 25 177.490 177.490 177.885 -0.395 18880
82 1 1 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.438 -0.328 18880
83 1 1 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.475 0.015 18880
84 1 1 . 1 1 25 25 LYS H H 25 8.210 8.210 8.282 -0.072 18880
85 1 1 . 1 1 26 26 THR N N 26 114.880 114.880 113.712 1.168 18880
86 1 1 . 1 1 26 26 THR HA H 26 4.040 4.040 4.095 -0.055 18880
87 1 1 . 1 1 26 26 THR C C 26 175.430 175.430 176.664 -1.234 18880
88 1 1 . 1 1 26 26 THR CA C 26 64.620 64.620 65.353 -0.733 18880
89 1 1 . 1 1 26 26 THR CB C 26 69.110 69.110 68.554 0.556 18880
90 1 1 . 1 1 26 26 THR H H 26 8.080 8.080 7.813 0.267 18880
91 1 1 . 1 1 27 27 GLN N N 27 120.940 120.940 119.727 1.213 18880
92 1 1 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.123 0.067 18880
93 1 1 . 1 1 27 27 GLN C C 27 177.280 177.280 177.623 -0.343 18880
94 1 1 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.489 -0.939 18880
95 1 1 . 1 1 27 27 GLN CB C 27 29.090 29.090 29.067 0.023 18880
96 1 1 . 1 1 27 27 GLN H H 27 8.240 8.240 8.175 0.065 18880
97 1 1 . 1 1 28 28 LEU N N 28 121.860 121.860 119.138 2.722 18880
98 1 1 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.236 -0.066 18880
99 1 1 . 1 1 28 28 LEU C C 28 177.750 177.750 177.737 0.013 18880
100 1 1 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.953 1.127 18880
101 1 1 . 1 1 28 28 LEU CB C 28 42.270 42.270 41.891 0.379 18880
102 1 1 . 1 1 28 28 LEU H H 28 7.950 7.950 7.234 0.716 18880
103 1 1 . 1 1 29 29 ILE N N 29 119.260 119.260 118.086 1.174 18880
104 1 1 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.743 0.157 18880
105 1 1 . 1 1 29 29 ILE C C 29 177.140 177.140 177.396 -0.256 18880
106 1 1 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.673 -0.373 18880
107 1 1 . 1 1 29 29 ILE CB C 29 38.280 38.280 37.089 1.191 18880
108 1 1 . 1 1 29 29 ILE H H 29 7.950 7.950 7.272 0.678 18880
109 1 1 . 1 1 30 30 GLU N N 30 120.500 120.500 118.624 1.876 18880
110 1 1 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.342 -0.292 18880
111 1 1 . 1 1 30 30 GLU C C 30 177.560 177.560 176.713 0.847 18880
112 1 1 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.972 0.118 18880
113 1 1 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.874 0.716 18880
114 1 1 . 1 1 30 30 GLU H H 30 8.220 8.220 7.983 0.237 18880
115 1 1 . 1 1 31 31 ALA N N 31 121.550 121.550 120.576 0.974 18880
116 1 1 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.303 -0.153 18880
117 1 1 . 1 1 31 31 ALA C C 31 178.550 178.550 178.785 -0.235 18880
118 1 1 . 1 1 31 31 ALA CA C 31 53.800 53.800 54.561 -0.761 18880
119 1 1 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.001 -0.371 18880
120 1 1 . 1 1 31 31 ALA H H 31 7.890 7.890 7.671 0.219 18880
121 1 1 . 1 1 32 32 PHE N N 32 117.240 117.240 114.553 2.687 18880
122 1 1 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.332 -0.032 18880
123 1 1 . 1 1 32 32 PHE C C 32 176.210 176.210 176.493 -0.283 18880
124 1 1 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.308 -0.968 18880
125 1 1 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.549 1.201 18880
126 1 1 . 1 1 32 32 PHE H H 32 7.930 7.930 6.984 0.946 18880
127 1 1 . 1 1 33 33 TYR N N 33 119.050 119.050 117.532 1.518 18880
128 1 1 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.712 -0.382 18880
129 1 1 . 1 1 33 33 TYR C C 33 175.680 175.680 174.894 0.786 18880
130 1 1 . 1 1 33 33 TYR CA C 33 58.920 58.920 56.564 2.356 18880
131 1 1 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.634 1.906 18880
132 1 1 . 1 1 33 33 TYR H H 33 7.950 7.950 7.192 0.758 18880
133 1 1 . 1 1 34 34 ASN N N 34 118.390 118.390 118.921 -0.531 18880
134 1 1 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.678 -0.048 18880
135 1 1 . 1 1 34 34 ASN C C 34 174.810 174.810 173.991 0.819 18880
136 1 1 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.788 -0.638 18880
137 1 1 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.109 -0.129 18880
138 1 1 . 1 1 34 34 ASN H H 34 7.960 7.960 8.340 -0.380 18880
139 1 1 . 1 1 35 35 PHE N N 35 120.670 120.670 118.761 1.909 18880
140 1 1 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.517 -0.067 18880
141 1 1 . 1 1 35 35 PHE C C 35 175.310 175.310 172.365 2.945 18880
142 1 1 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.508 -0.188 18880
143 1 1 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.294 0.126 18880
144 1 1 . 1 1 35 35 PHE H H 35 7.830 7.830 7.754 0.076 18880
145 1 1 . 1 1 36 36 ASP N N 36 122.400 122.400 119.398 3.002 18880
146 1 1 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.687 -0.097 18880
147 1 1 . 1 1 36 36 ASP C C 36 176.150 176.150 176.270 -0.120 18880
148 1 1 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.409 -0.339 18880
149 1 1 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.962 -0.642 18880
150 1 1 . 1 1 36 36 ASP H H 36 8.180 8.180 7.904 0.276 18880
151 1 1 . 1 1 37 37 GLY N N 37 108.560 108.560 108.533 0.027 18880
152 1 1 . 1 1 37 37 GLY C C 37 173.660 173.660 174.932 -1.272 18880
153 1 1 . 1 1 37 37 GLY CA C 37 45.610 45.610 46.091 -0.481 18880
154 1 1 . 1 1 37 37 GLY H H 37 7.680 7.680 8.150 -0.470 18880
155 1 1 . 1 1 38 38 ASP N N 38 120.010 120.010 118.971 1.039 18880
156 1 1 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.797 -0.197 18880
157 1 1 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.600 -0.340 18880
158 1 1 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.918 0.532 18880
159 1 1 . 1 1 38 38 ASP H H 38 8.220 8.220 8.133 0.087 18880
160 1 1 . 1 1 39 39 TYR N N 39 121.030 121.030 120.482 0.548 18880
161 1 1 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.749 -0.359 18880
162 1 1 . 1 1 39 39 TYR C C 39 175.290 175.290 175.142 0.148 18880
163 1 1 . 1 1 39 39 TYR CA C 39 58.200 58.200 57.964 0.236 18880
164 1 1 . 1 1 39 39 TYR CB C 39 39.170 39.170 40.801 -1.631 18880
165 1 1 . 1 1 39 39 TYR H H 39 8.090 8.090 8.051 0.039 18880
166 1 1 . 1 1 40 40 ASP N N 40 122.020 122.020 123.558 -1.538 18880
167 1 1 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.609 -0.009 18880
168 1 1 . 1 1 40 40 ASP C C 40 175.970 175.970 177.390 -1.420 18880
169 1 1 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.423 0.797 18880
170 1 1 . 1 1 40 40 ASP CB C 40 41.520 41.520 42.079 -0.559 18880
171 1 1 . 1 1 40 40 ASP H H 40 8.200 8.200 8.036 0.164 18880
172 1 1 . 1 1 41 41 GLY N N 41 108.330 108.330 108.285 0.045 18880
173 1 1 . 1 1 41 41 GLY C C 41 173.000 173.000 173.226 -0.226 18880
174 1 1 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.850 0.570 18880
175 1 1 . 1 1 41 41 GLY H H 41 7.830 7.830 8.425 -0.595 18880
176 1 1 . 1 1 42 42 PHE N N 42 118.600 118.600 120.493 -1.893 18880
177 1 1 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.959 0.301 18880
178 1 1 . 1 1 42 42 PHE C C 42 175.660 175.660 173.824 1.836 18880
179 1 1 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.973 -0.813 18880
180 1 1 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.745 -1.575 18880
181 1 1 . 1 1 42 42 PHE H H 42 8.150 8.150 7.525 0.625 18880
182 1 1 . 1 1 43 43 VAL N N 43 119.180 119.180 126.608 -7.428 18880
183 1 1 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.776 -0.106 18880
184 1 1 . 1 1 43 43 VAL C C 43 175.110 175.110 174.144 0.966 18880
185 1 1 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.770 0.850 18880
186 1 1 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.996 -3.116 18880
187 1 1 . 1 1 43 43 VAL H H 43 9.070 9.070 8.423 0.647 18880
188 1 1 . 1 1 44 44 SER N N 44 121.380 121.380 123.098 -1.718 18880
189 1 1 . 1 1 44 44 SER HA H 44 4.570 4.570 4.520 0.050 18880
190 1 1 . 1 1 44 44 SER C C 44 175.660 175.660 175.505 0.155 18880
191 1 1 . 1 1 44 44 SER CA C 44 57.720 57.720 58.056 -0.336 18880
192 1 1 . 1 1 44 44 SER CB C 44 63.690 63.690 63.633 0.057 18880
193 1 1 . 1 1 44 44 SER H H 44 9.140 9.140 8.772 0.368 18880
194 1 1 . 1 1 45 45 VAL N N 45 122.720 122.720 124.459 -1.739 18880
195 1 1 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.212 0.288 18880
196 1 1 . 1 1 45 45 VAL C C 45 177.240 177.240 177.627 -0.387 18880
197 1 1 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.580 -0.310 18880
198 1 1 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.912 0.538 18880
199 1 1 . 1 1 45 45 VAL H H 45 8.140 8.140 7.829 0.311 18880
200 1 1 . 1 1 46 46 GLU N N 46 118.990 118.990 119.649 -0.659 18880
201 1 1 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.777 0.203 18880
202 1 1 . 1 1 46 46 GLU C C 46 179.460 179.460 179.162 0.298 18880
203 1 1 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.916 -0.356 18880
204 1 1 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.911 0.249 18880
205 1 1 . 1 1 46 46 GLU H H 46 8.230 8.230 7.543 0.687 18880
206 1 1 . 1 1 47 47 GLU N N 47 120.120 120.120 119.207 0.913 18880
207 1 1 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.054 0.026 18880
208 1 1 . 1 1 47 47 GLU C C 47 179.170 179.170 178.821 0.349 18880
209 1 1 . 1 1 47 47 GLU CA C 47 58.890 58.890 59.221 -0.331 18880
210 1 1 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.331 0.489 18880
211 1 1 . 1 1 47 47 GLU H H 47 7.880 7.880 7.453 0.427 18880
212 1 1 . 1 1 48 48 PHE N N 48 120.830 120.830 120.524 0.306 18880
213 1 1 . 1 1 48 48 PHE HA H 48 4.190 4.190 3.918 0.272 18880
214 1 1 . 1 1 48 48 PHE C C 48 176.920 176.920 177.612 -0.692 18880
215 1 1 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.298 0.571 18880
216 1 1 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.686 0.574 18880
217 1 1 . 1 1 48 48 PHE H H 48 8.600 8.600 8.325 0.275 18880
218 1 1 . 1 1 49 49 ARG N N 49 118.470 118.470 119.055 -0.585 18880
219 1 1 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.054 -0.194 18880
220 1 1 . 1 1 49 49 ARG C C 49 178.090 178.090 178.784 -0.694 18880
221 1 1 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.382 -0.312 18880
222 1 1 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.866 0.274 18880
223 1 1 . 1 1 49 49 ARG H H 49 8.650 8.650 8.827 -0.177 18880
224 1 1 . 1 1 50 50 GLY N N 50 105.080 105.080 106.966 -1.886 18880
225 1 1 . 1 1 50 50 GLY C C 50 175.090 175.090 176.039 -0.949 18880
226 1 1 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.881 -0.201 18880
227 1 1 . 1 1 50 50 GLY H H 50 7.620 7.620 7.587 0.033 18880
228 1 1 . 1 1 51 51 ILE N N 51 121.440 121.440 122.103 -0.663 18880
229 1 1 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.599 0.231 18880
230 1 1 . 1 1 51 51 ILE C C 51 178.300 178.300 177.806 0.494 18880
231 1 1 . 1 1 51 51 ILE CA C 51 63.840 63.840 65.130 -1.290 18880
232 1 1 . 1 1 51 51 ILE CB C 51 38.310 38.310 37.851 0.459 18880
233 1 1 . 1 1 51 51 ILE H H 51 7.470 7.470 7.487 -0.017 18880
234 1 1 . 1 1 52 52 ILE N N 52 118.930 118.930 118.785 0.145 18880
235 1 1 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.634 0.106 18880
236 1 1 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.998 -0.238 18880
237 1 1 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.735 1.295 18880
238 1 1 . 1 1 52 52 ILE H H 52 7.790 7.790 8.352 -0.562 18880
239 1 1 . 1 1 53 53 ARG N N 53 120.140 120.140 118.791 1.349 18880
240 1 1 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.966 0.124 18880
241 1 1 . 1 1 53 53 ARG C C 53 177.380 177.380 177.582 -0.202 18880
242 1 1 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.447 0.663 18880
243 1 1 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.440 -0.860 18880
244 1 1 . 1 1 53 53 ARG H H 53 7.930 7.930 8.067 -0.137 18880
245 1 1 . 1 1 54 54 ASP N N 54 117.500 117.500 115.686 1.814 18880
246 1 1 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.820 -0.220 18880
247 1 1 . 1 1 54 54 ASP C C 54 176.930 176.930 175.960 0.970 18880
248 1 1 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.315 1.226 18880
249 1 1 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.717 -0.617 18880
250 1 1 . 1 1 54 54 ASP H H 54 7.870 7.870 7.625 0.245 18880
251 1 1 . 1 1 55 55 GLY N N 55 106.370 106.370 108.607 -2.237 18880
252 1 1 . 1 1 55 55 GLY C C 55 173.460 173.460 173.904 -0.444 18880
253 1 1 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.462 0.537 18880
254 1 1 . 1 1 55 55 GLY H H 55 7.880 7.880 7.859 0.021 18880
255 1 1 . 1 1 56 56 LEU N N 56 122.630 122.630 122.903 -0.273 18880
256 1 1 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.888 -0.118 18880
257 1 1 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.299 1.191 18880
258 1 1 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.806 0.314 18880
259 1 1 . 1 1 56 56 LEU H H 56 8.220 8.220 7.708 0.512 18880
260 1 1 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.377 0.203 18880
261 1 1 . 1 1 57 57 PRO C C 57 176.150 176.150 175.545 0.605 18880
262 1 1 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.133 -0.713 18880
263 1 1 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.077 -0.337 18880
264 1 1 . 1 1 58 58 MET N N 58 121.810 121.810 124.299 -2.489 18880
265 1 1 . 1 1 58 58 MET HA H 58 4.630 4.630 4.595 0.035 18880
266 1 1 . 1 1 58 58 MET C C 58 176.150 176.150 174.890 1.260 18880
267 1 1 . 1 1 58 58 MET CA C 58 55.560 55.560 54.063 1.497 18880
268 1 1 . 1 1 58 58 MET CB C 58 36.820 36.820 36.693 0.127 18880
269 1 1 . 1 1 58 58 MET H H 58 7.690 7.690 7.824 -0.134 18880
270 1 1 . 1 1 59 59 THR N N 59 114.180 114.180 115.139 -0.959 18880
271 1 1 . 1 1 59 59 THR HA H 59 4.450 4.450 4.512 -0.062 18880
272 1 1 . 1 1 59 59 THR C C 59 175.170 175.170 175.683 -0.513 18880
273 1 1 . 1 1 59 59 THR CA C 59 60.780 60.780 60.451 0.329 18880
274 1 1 . 1 1 59 59 THR CB C 59 71.060 71.060 69.969 1.091 18880
275 1 1 . 1 1 59 59 THR H H 59 8.940 8.940 8.175 0.765 18880
276 1 1 . 1 1 60 60 GLU N N 60 120.620 120.620 125.081 -4.461 18880
277 1 1 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.702 0.308 18880
278 1 1 . 1 1 60 60 GLU C C 60 179.010 179.010 178.125 0.885 18880
279 1 1 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.638 0.182 18880
280 1 1 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.505 0.545 18880
281 1 1 . 1 1 60 60 GLU H H 60 8.850 8.850 8.897 -0.047 18880
282 1 1 . 1 1 61 61 ALA N N 61 121.080 121.080 122.119 -1.039 18880
283 1 1 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.977 0.163 18880
284 1 1 . 1 1 61 61 ALA C C 61 180.350 180.350 178.559 1.791 18880
285 1 1 . 1 1 61 61 ALA CA C 61 55.090 55.090 54.139 0.951 18880
286 1 1 . 1 1 61 61 ALA CB C 61 18.210 18.210 18.096 0.114 18880
287 1 1 . 1 1 61 61 ALA H H 61 8.370 8.370 8.371 -0.001 18880
288 1 1 . 1 1 62 62 GLU N N 62 118.890 118.890 116.556 2.334 18880
289 1 1 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.704 0.296 18880
290 1 1 . 1 1 62 62 GLU C C 62 179.690 179.690 178.313 1.377 18880
291 1 1 . 1 1 62 62 GLU CA C 62 58.990 58.990 56.870 2.120 18880
292 1 1 . 1 1 62 62 GLU CB C 62 30.310 30.310 29.881 0.429 18880
293 1 1 . 1 1 62 62 GLU H H 62 7.680 7.680 7.810 -0.130 18880
294 1 1 . 1 1 63 63 ILE N N 63 122.340 122.340 119.923 2.417 18880
295 1 1 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.437 0.133 18880
296 1 1 . 1 1 63 63 ILE C C 63 177.260 177.260 178.014 -0.754 18880
297 1 1 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.365 1.525 18880
298 1 1 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.168 0.812 18880
299 1 1 . 1 1 63 63 ILE H H 63 8.420 8.420 8.057 0.363 18880
300 1 1 . 1 1 64 64 THR N N 64 116.970 116.970 117.114 -0.144 18880
301 1 1 . 1 1 64 64 THR HA H 64 3.940 3.940 4.001 -0.061 18880
302 1 1 . 1 1 64 64 THR C C 64 176.520 176.520 176.329 0.191 18880
303 1 1 . 1 1 64 64 THR CA C 64 67.060 67.060 67.677 -0.617 18880
304 1 1 . 1 1 64 64 THR CB C 64 68.750 68.750 68.353 0.397 18880
305 1 1 . 1 1 64 64 THR H H 64 8.310 8.310 8.398 -0.088 18880
306 1 1 . 1 1 65 65 GLU N N 65 120.760 120.760 120.862 -0.102 18880
307 1 1 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.132 -0.102 18880
308 1 1 . 1 1 65 65 GLU C C 65 175.830 175.830 179.040 -3.210 18880
309 1 1 . 1 1 65 65 GLU CA C 65 59.500 59.500 59.271 0.229 18880
310 1 1 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.506 0.264 18880
311 1 1 . 1 1 65 65 GLU H H 65 7.970 7.970 7.665 0.305 18880
312 1 1 . 1 1 66 66 PHE N N 66 120.940 120.940 117.956 2.984 18880
313 1 1 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.375 -0.135 18880
314 1 1 . 1 1 66 66 PHE C C 66 177.330 177.330 177.361 -0.031 18880
315 1 1 . 1 1 66 66 PHE CA C 66 61.200 61.200 57.428 3.772 18880
316 1 1 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.515 0.015 18880
317 1 1 . 1 1 66 66 PHE H H 66 8.100 8.100 7.372 0.728 18880
318 1 1 . 1 1 67 67 PHE N N 67 118.110 118.110 120.022 -1.912 18880
319 1 1 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.385 -0.435 18880
320 1 1 . 1 1 67 67 PHE C C 67 178.090 178.090 178.310 -0.220 18880
321 1 1 . 1 1 67 67 PHE CA C 67 61.200 61.200 60.034 1.166 18880
322 1 1 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.444 -0.194 18880
323 1 1 . 1 1 67 67 PHE H H 67 8.380 8.380 8.709 -0.329 18880
324 1 1 . 1 1 68 68 GLU N N 68 119.650 119.650 117.394 2.256 18880
325 1 1 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.352 -0.342 18880
326 1 1 . 1 1 68 68 GLU C C 68 177.910 177.910 177.410 0.500 18880
327 1 1 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.542 1.698 18880
328 1 1 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.275 0.095 18880
329 1 1 . 1 1 68 68 GLU H H 68 8.230 8.230 8.076 0.154 18880
330 1 1 . 1 1 69 69 ALA N N 69 119.090 119.090 120.722 -1.632 18880
331 1 1 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.312 -0.132 18880
332 1 1 . 1 1 69 69 ALA C C 69 179.030 179.030 178.712 0.318 18880
333 1 1 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.904 -0.304 18880
334 1 1 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.606 0.174 18880
335 1 1 . 1 1 69 69 ALA H H 69 7.340 7.340 7.699 -0.359 18880
336 1 1 . 1 1 70 70 ALA N N 70 118.670 118.670 120.146 -1.476 18880
337 1 1 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.303 -0.283 18880
338 1 1 . 1 1 70 70 ALA C C 70 176.820 176.820 177.328 -0.508 18880
339 1 1 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.723 0.367 18880
340 1 1 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.282 -0.672 18880
341 1 1 . 1 1 70 70 ALA H H 70 8.050 8.050 7.754 0.296 18880
342 1 1 . 1 1 71 71 ASP N N 71 116.780 116.780 118.730 -1.950 18880
343 1 1 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.168 0.052 18880
344 1 1 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.376 1.774 18880
345 1 1 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.110 -1.200 18880
346 1 1 . 1 1 71 71 ASP H H 71 8.010 8.010 7.651 0.359 18880
347 1 1 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.378 0.092 18880
348 1 1 . 1 1 72 72 PRO C C 72 177.970 177.970 177.481 0.489 18880
349 1 1 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.318 0.592 18880
350 1 1 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.421 -0.541 18880
351 1 1 . 1 1 73 73 ASN N N 73 114.930 114.930 116.661 -1.731 18880
352 1 1 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.603 0.277 18880
353 1 1 . 1 1 73 73 ASN C C 73 174.880 174.880 174.838 0.042 18880
354 1 1 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.773 -0.933 18880
355 1 1 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.933 -0.553 18880
356 1 1 . 1 1 73 73 ASN H H 73 9.030 9.030 8.112 0.918 18880
357 1 1 . 1 1 74 74 ASN N N 74 118.340 118.340 111.718 6.622 18880
358 1 1 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.603 -0.243 18880
359 1 1 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.257 0.333 18880
360 1 1 . 1 1 74 74 ASN CB C 74 37.160 37.160 37.035 0.125 18880
361 1 1 . 1 1 74 74 ASN H H 74 8.320 8.320 8.492 -0.172 18880
362 1 1 . 1 1 75 75 THR N N 75 113.450 113.450 113.774 -0.324 18880
363 1 1 . 1 1 75 75 THR HA H 75 4.210 4.210 4.263 -0.053 18880
364 1 1 . 1 1 75 75 THR CA C 75 63.410 63.410 63.340 0.070 18880
365 1 1 . 1 1 75 75 THR CB C 75 70.540 70.540 69.201 1.339 18880
366 1 1 . 1 1 75 75 THR H H 75 9.870 9.870 8.035 1.835 18880
367 1 1 . 1 1 76 76 GLY N N 76 111.810 111.810 108.308 3.502 18880
368 1 1 . 1 1 76 76 GLY C C 76 173.670 173.670 173.291 0.379 18880
369 1 1 . 1 1 76 76 GLY CA C 76 45.120 45.120 44.875 0.245 18880
370 1 1 . 1 1 76 76 GLY H H 76 10.250 10.250 8.050 2.200 18880
371 1 1 . 1 1 77 77 PHE N N 77 120.560 120.560 118.691 1.869 18880
372 1 1 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.007 0.143 18880
373 1 1 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.631 -0.451 18880
374 1 1 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.954 0.546 18880
375 1 1 . 1 1 77 77 PHE H H 77 8.110 8.110 7.977 0.133 18880
376 1 1 . 1 1 78 78 ILE N N 78 116.410 116.410 120.108 -3.698 18880
377 1 1 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.351 0.039 18880
378 1 1 . 1 1 78 78 ILE C C 78 174.770 174.770 173.627 1.143 18880
379 1 1 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.998 -0.808 18880
380 1 1 . 1 1 78 78 ILE CB C 78 41.180 41.180 42.859 -1.679 18880
381 1 1 . 1 1 78 78 ILE H H 78 8.930 8.930 7.875 1.055 18880
382 1 1 . 1 1 79 79 ASP N N 79 125.220 125.220 126.682 -1.462 18880
383 1 1 . 1 1 79 79 ASP HA H 79 4.500 4.500 3.932 0.568 18880
384 1 1 . 1 1 79 79 ASP C C 79 176.490 176.490 176.361 0.129 18880
385 1 1 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.084 0.227 18880
386 1 1 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.302 1.068 18880
387 1 1 . 1 1 79 79 ASP H H 79 8.610 8.610 8.668 -0.058 18880
388 1 1 . 1 1 80 80 TYR N N 80 125.760 125.760 127.876 -2.116 18880
389 1 1 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.082 -0.092 18880
390 1 1 . 1 1 80 80 TYR C C 80 177.140 177.140 176.842 0.298 18880
391 1 1 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.808 -1.228 18880
392 1 1 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.847 0.043 18880
393 1 1 . 1 1 80 80 TYR H H 80 8.460 8.460 8.324 0.136 18880
394 1 1 . 1 1 81 81 LYS N N 81 118.320 118.320 118.182 0.138 18880
395 1 1 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.949 -0.049 18880
396 1 1 . 1 1 81 81 LYS C C 81 179.090 179.090 178.556 0.534 18880
397 1 1 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.533 0.047 18880
398 1 1 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.936 -0.176 18880
399 1 1 . 1 1 81 81 LYS H H 81 8.410 8.410 8.081 0.329 18880
400 1 1 . 1 1 82 82 ALA N N 82 122.050 122.050 122.366 -0.316 18880
401 1 1 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.108 0.022 18880
402 1 1 . 1 1 82 82 ALA C C 82 179.740 179.740 179.280 0.460 18880
403 1 1 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.753 -0.233 18880
404 1 1 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.208 0.332 18880
405 1 1 . 1 1 82 82 ALA H H 82 7.770 7.770 7.746 0.024 18880
406 1 1 . 1 1 83 83 PHE N N 83 117.810 117.810 117.115 0.695 18880
407 1 1 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.218 0.072 18880
408 1 1 . 1 1 83 83 PHE C C 83 176.460 176.460 177.864 -1.404 18880
409 1 1 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.603 -0.574 18880
410 1 1 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.492 0.028 18880
411 1 1 . 1 1 83 83 PHE H H 83 7.780 7.780 7.818 -0.038 18880
412 1 1 . 1 1 84 84 ALA N N 84 121.530 121.530 122.679 -1.149 18880
413 1 1 . 1 1 84 84 ALA HA H 84 3.660 3.660 3.886 -0.226 18880
414 1 1 . 1 1 84 84 ALA C C 84 179.010 179.010 178.938 0.072 18880
415 1 1 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.755 0.275 18880
416 1 1 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.065 0.065 18880
417 1 1 . 1 1 84 84 ALA H H 84 8.290 8.290 8.488 -0.198 18880
418 1 1 . 1 1 85 85 ALA N N 85 117.720 117.720 118.660 -0.940 18880
419 1 1 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.042 0.038 18880
420 1 1 . 1 1 85 85 ALA C C 85 179.570 179.570 178.290 1.280 18880
421 1 1 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.335 0.035 18880
422 1 1 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.569 -0.279 18880
423 1 1 . 1 1 85 85 ALA H H 85 7.700 7.700 8.506 -0.806 18880
424 1 1 . 1 1 86 86 MET N N 86 116.570 116.570 116.356 0.214 18880
425 1 1 . 1 1 86 86 MET HA H 86 4.160 4.160 4.067 0.093 18880
426 1 1 . 1 1 86 86 MET C C 86 177.360 177.360 178.507 -1.147 18880
427 1 1 . 1 1 86 86 MET CA C 86 57.380 57.380 57.958 -0.578 18880
428 1 1 . 1 1 86 86 MET CB C 86 32.720 32.720 31.808 0.912 18880
429 1 1 . 1 1 86 86 MET H H 86 7.560 7.560 7.407 0.153 18880
430 1 1 . 1 1 87 87 LEU N N 87 119.090 119.090 117.366 1.724 18880
431 1 1 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.107 -0.137 18880
432 1 1 . 1 1 87 87 LEU C C 87 177.420 177.420 177.496 -0.076 18880
433 1 1 . 1 1 87 87 LEU CA C 87 56.290 56.290 56.475 -0.185 18880
434 1 1 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.671 0.609 18880
435 1 1 . 1 1 87 87 LEU H H 87 7.570 7.570 7.376 0.194 18880
436 1 1 . 1 1 88 88 TYR N N 88 117.060 117.060 115.485 1.575 18880
437 1 1 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.768 -0.178 18880
438 1 1 . 1 1 88 88 TYR C C 88 175.870 175.870 175.831 0.039 18880
439 1 1 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.325 2.515 18880
440 1 1 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.368 1.272 18880
441 1 1 . 1 1 88 88 TYR H H 88 7.740 7.740 7.479 0.261 18880
442 1 1 . 1 1 89 89 SER N N 89 115.980 115.980 117.372 -1.392 18880
443 1 1 . 1 1 89 89 SER HA H 89 4.440 4.440 4.491 -0.051 18880
444 1 1 . 1 1 89 89 SER C C 89 174.460 174.460 174.400 0.060 18880
445 1 1 . 1 1 89 89 SER CA C 89 58.350 58.350 59.050 -0.700 18880
446 1 1 . 1 1 89 89 SER CB C 89 63.990 63.990 61.438 2.552 18880
447 1 1 . 1 1 89 89 SER H H 89 7.880 7.880 8.341 -0.461 18880
448 1 1 . 1 1 90 90 VAL N N 90 120.910 120.910 119.755 1.155 18880
449 1 1 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.295 -0.155 18880
450 1 1 . 1 1 90 90 VAL C C 90 175.720 175.720 174.524 1.196 18880
451 1 1 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.879 0.391 18880
452 1 1 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.416 0.424 18880
453 1 1 . 1 1 90 90 VAL H H 90 8.020 8.020 7.722 0.298 18880
454 1 1 . 1 1 91 91 ASP N N 91 123.620 123.620 122.375 1.245 18880
455 1 1 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.818 -0.188 18880
456 1 1 . 1 1 91 91 ASP C C 91 176.000 176.000 175.532 0.468 18880
457 1 1 . 1 1 91 91 ASP CA C 91 54.510 54.510 53.750 0.760 18880
458 1 1 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.642 -0.202 18880
459 1 1 . 1 1 91 91 ASP H H 91 8.310 8.310 8.337 -0.027 18880
460 1 1 . 1 1 92 92 GLU N N 92 122.170 122.170 122.769 -0.599 18880
461 1 1 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.562 -0.202 18880
462 1 1 . 1 1 92 92 GLU C C 92 175.660 175.660 176.734 -1.074 18880
463 1 1 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.332 0.158 18880
464 1 1 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.757 3.093 18880
465 1 1 . 1 1 92 92 GLU H H 92 8.320 8.320 8.403 -0.083 18880
466 1 2 . 1 1 10 10 HIS C C 10 176.040 176.040 175.902 0.138 18880
467 1 2 . 1 1 11 11 SER N N 11 116.840 116.840 116.421 0.419 18880
468 1 2 . 1 1 11 11 SER HA H 11 4.430 4.430 4.152 0.278 18880
469 1 2 . 1 1 11 11 SER C C 11 174.630 174.630 174.234 0.396 18880
470 1 2 . 1 1 11 11 SER CA C 11 58.350 58.350 60.194 -1.844 18880
471 1 2 . 1 1 11 11 SER CB C 11 64.120 64.120 62.710 1.410 18880
472 1 2 . 1 1 11 11 SER H H 11 8.360 8.360 8.625 -0.265 18880
473 1 2 . 1 1 12 12 SER N N 12 118.030 118.030 119.476 -1.446 18880
474 1 2 . 1 1 12 12 SER HA H 12 4.440 4.440 4.683 -0.243 18880
475 1 2 . 1 1 12 12 SER C C 12 174.880 174.880 174.511 0.369 18880
476 1 2 . 1 1 12 12 SER CA C 12 58.680 58.680 57.844 0.836 18880
477 1 2 . 1 1 12 12 SER CB C 12 63.890 63.890 64.237 -0.347 18880
478 1 2 . 1 1 12 12 SER H H 12 8.490 8.490 8.387 0.103 18880
479 1 2 . 1 1 13 13 GLY N N 13 110.450 110.450 113.148 -2.698 18880
480 1 2 . 1 1 13 13 GLY C C 13 173.790 173.790 174.258 -0.468 18880
481 1 2 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.960 -0.500 18880
482 1 2 . 1 1 13 13 GLY H H 13 8.390 8.390 8.617 -0.227 18880
483 1 2 . 1 1 14 14 LEU N N 14 121.310 121.310 117.583 3.727 18880
484 1 2 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.674 -0.334 18880
485 1 2 . 1 1 14 14 LEU C C 14 176.930 176.930 175.354 1.576 18880
486 1 2 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.791 0.409 18880
487 1 2 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.633 -0.033 18880
488 1 2 . 1 1 14 14 LEU H H 14 8.020 8.020 7.939 0.081 18880
489 1 2 . 1 1 15 15 VAL N N 15 121.550 121.550 116.919 4.631 18880
490 1 2 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.504 -0.134 18880
491 1 2 . 1 1 15 15 VAL CA C 15 59.720 59.720 60.095 -0.375 18880
492 1 2 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.896 0.874 18880
493 1 2 . 1 1 15 15 VAL H H 15 8.030 8.030 7.895 0.135 18880
494 1 2 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.581 -0.211 18880
495 1 2 . 1 1 16 16 PRO C C 16 176.720 176.720 176.367 0.353 18880
496 1 2 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.397 -0.747 18880
497 1 2 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.816 -0.576 18880
498 1 2 . 1 1 17 17 ARG N N 17 121.890 121.890 120.599 1.291 18880
499 1 2 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.423 -0.143 18880
500 1 2 . 1 1 17 17 ARG C C 17 176.940 176.940 175.930 1.010 18880
501 1 2 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.342 0.018 18880
502 1 2 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.575 0.475 18880
503 1 2 . 1 1 17 17 ARG H H 17 8.450 8.450 8.793 -0.343 18880
504 1 2 . 1 1 18 18 GLY N N 18 110.160 110.160 109.831 0.329 18880
505 1 2 . 1 1 18 18 GLY C C 18 174.110 174.110 173.897 0.213 18880
506 1 2 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.753 0.637 18880
507 1 2 . 1 1 18 18 GLY H H 18 8.480 8.480 8.098 0.382 18880
508 1 2 . 1 1 19 19 SER N N 19 115.500 115.500 114.743 0.757 18880
509 1 2 . 1 1 19 19 SER HA H 19 4.400 4.400 4.160 0.240 18880
510 1 2 . 1 1 19 19 SER C C 19 174.380 174.380 173.512 0.868 18880
511 1 2 . 1 1 19 19 SER CA C 19 58.610 58.610 58.229 0.381 18880
512 1 2 . 1 1 19 19 SER CB C 19 63.830 63.830 62.834 0.996 18880
513 1 2 . 1 1 19 19 SER H H 19 8.210 8.210 8.631 -0.421 18880
514 1 2 . 1 1 20 20 HIS N N 20 120.770 120.770 117.552 3.218 18880
515 1 2 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.872 -0.262 18880
516 1 2 . 1 1 20 20 HIS C C 20 174.870 174.870 174.240 0.630 18880
517 1 2 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.623 0.507 18880
518 1 2 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.928 -0.218 18880
519 1 2 . 1 1 20 20 HIS H H 20 8.590 8.590 8.174 0.416 18880
520 1 2 . 1 1 21 21 MET N N 21 121.440 121.440 124.938 -3.498 18880
521 1 2 . 1 1 21 21 MET HA H 21 4.470 4.470 4.635 -0.165 18880
522 1 2 . 1 1 21 21 MET C C 21 176.030 176.030 175.309 0.721 18880
523 1 2 . 1 1 21 21 MET CA C 21 55.490 55.490 55.739 -0.249 18880
524 1 2 . 1 1 21 21 MET CB C 21 33.170 33.170 33.377 -0.207 18880
525 1 2 . 1 1 21 21 MET H H 21 8.310 8.310 8.591 -0.281 18880
526 1 2 . 1 1 22 22 SER N N 22 116.860 116.860 116.063 0.797 18880
527 1 2 . 1 1 22 22 SER HA H 22 4.430 4.430 4.565 -0.135 18880
528 1 2 . 1 1 22 22 SER C C 22 174.630 174.630 175.314 -0.684 18880
529 1 2 . 1 1 22 22 SER CA C 22 58.410 58.410 58.827 -0.417 18880
530 1 2 . 1 1 22 22 SER CB C 22 64.030 64.030 63.503 0.527 18880
531 1 2 . 1 1 22 22 SER H H 22 8.340 8.340 8.498 -0.158 18880
532 1 2 . 1 1 23 23 ASP N N 23 122.660 122.660 121.640 1.020 18880
533 1 2 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.513 0.037 18880
534 1 2 . 1 1 23 23 ASP C C 23 176.860 176.860 177.354 -0.494 18880
535 1 2 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.958 -0.628 18880
536 1 2 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.577 0.423 18880
537 1 2 . 1 1 23 23 ASP H H 23 8.540 8.540 8.532 0.008 18880
538 1 2 . 1 1 24 24 GLU N N 24 120.400 120.400 118.377 2.023 18880
539 1 2 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.126 0.014 18880
540 1 2 . 1 1 24 24 GLU C C 24 177.540 177.540 177.430 0.110 18880
541 1 2 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.539 -0.179 18880
542 1 2 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.597 0.153 18880
543 1 2 . 1 1 24 24 GLU H H 24 8.610 8.610 8.195 0.415 18880
544 1 2 . 1 1 25 25 LYS N N 25 120.390 120.390 117.871 2.519 18880
545 1 2 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.292 -0.102 18880
546 1 2 . 1 1 25 25 LYS C C 25 177.490 177.490 178.285 -0.795 18880
547 1 2 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.171 -0.061 18880
548 1 2 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.965 -0.475 18880
549 1 2 . 1 1 25 25 LYS H H 25 8.210 8.210 7.605 0.605 18880
550 1 2 . 1 1 26 26 THR N N 26 114.880 114.880 116.091 -1.211 18880
551 1 2 . 1 1 26 26 THR HA H 26 4.040 4.040 4.064 -0.024 18880
552 1 2 . 1 1 26 26 THR C C 26 175.430 175.430 176.927 -1.497 18880
553 1 2 . 1 1 26 26 THR CA C 26 64.620 64.620 65.962 -1.342 18880
554 1 2 . 1 1 26 26 THR CB C 26 69.110 69.110 68.478 0.632 18880
555 1 2 . 1 1 26 26 THR H H 26 8.080 8.080 7.488 0.592 18880
556 1 2 . 1 1 27 27 GLN N N 27 120.940 120.940 121.479 -0.539 18880
557 1 2 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.142 0.048 18880
558 1 2 . 1 1 27 27 GLN C C 27 177.280 177.280 177.508 -0.228 18880
559 1 2 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.842 -1.292 18880
560 1 2 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.478 0.612 18880
561 1 2 . 1 1 27 27 GLN H H 27 8.240 8.240 8.062 0.178 18880
562 1 2 . 1 1 28 28 LEU N N 28 121.860 121.860 118.723 3.137 18880
563 1 2 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.389 -0.219 18880
564 1 2 . 1 1 28 28 LEU C C 28 177.750 177.750 177.290 0.460 18880
565 1 2 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.245 1.835 18880
566 1 2 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.154 0.116 18880
567 1 2 . 1 1 28 28 LEU H H 28 7.950 7.950 7.977 -0.027 18880
568 1 2 . 1 1 29 29 ILE N N 29 119.260 119.260 119.404 -0.144 18880
569 1 2 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.085 -0.185 18880
570 1 2 . 1 1 29 29 ILE C C 29 177.140 177.140 178.038 -0.898 18880
571 1 2 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.621 -0.321 18880
572 1 2 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.659 1.621 18880
573 1 2 . 1 1 29 29 ILE H H 29 7.950 7.950 7.807 0.143 18880
574 1 2 . 1 1 30 30 GLU N N 30 120.500 120.500 120.542 -0.042 18880
575 1 2 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.326 -0.276 18880
576 1 2 . 1 1 30 30 GLU C C 30 177.560 177.560 176.525 1.035 18880
577 1 2 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.255 0.835 18880
578 1 2 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.918 0.672 18880
579 1 2 . 1 1 30 30 GLU H H 30 8.220 8.220 8.061 0.159 18880
580 1 2 . 1 1 31 31 ALA N N 31 121.550 121.550 119.439 2.111 18880
581 1 2 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.741 -0.591 18880
582 1 2 . 1 1 31 31 ALA C C 31 178.550 178.550 179.257 -0.707 18880
583 1 2 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.678 0.122 18880
584 1 2 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.223 -0.593 18880
585 1 2 . 1 1 31 31 ALA H H 31 7.890 7.890 7.580 0.310 18880
586 1 2 . 1 1 32 32 PHE N N 32 117.240 117.240 118.058 -0.818 18880
587 1 2 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.245 0.055 18880
588 1 2 . 1 1 32 32 PHE C C 32 176.210 176.210 177.007 -0.797 18880
589 1 2 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.415 -2.075 18880
590 1 2 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.044 0.706 18880
591 1 2 . 1 1 32 32 PHE H H 32 7.930 7.930 7.656 0.274 18880
592 1 2 . 1 1 33 33 TYR N N 33 119.050 119.050 116.672 2.378 18880
593 1 2 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.716 -0.386 18880
594 1 2 . 1 1 33 33 TYR C C 33 175.680 175.680 175.473 0.207 18880
595 1 2 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.932 0.988 18880
596 1 2 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.356 1.184 18880
597 1 2 . 1 1 33 33 TYR H H 33 7.950 7.950 8.544 -0.594 18880
598 1 2 . 1 1 34 34 ASN N N 34 118.390 118.390 117.634 0.756 18880
599 1 2 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.756 -0.126 18880
600 1 2 . 1 1 34 34 ASN C C 34 174.810 174.810 174.181 0.629 18880
601 1 2 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.267 -0.117 18880
602 1 2 . 1 1 34 34 ASN CB C 34 38.980 38.980 38.355 0.625 18880
603 1 2 . 1 1 34 34 ASN H H 34 7.960 7.960 8.190 -0.230 18880
604 1 2 . 1 1 35 35 PHE N N 35 120.670 120.670 118.627 2.043 18880
605 1 2 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.660 -0.210 18880
606 1 2 . 1 1 35 35 PHE C C 35 175.310 175.310 174.463 0.847 18880
607 1 2 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.330 -0.010 18880
608 1 2 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.483 -1.063 18880
609 1 2 . 1 1 35 35 PHE H H 35 7.830 7.830 8.008 -0.178 18880
610 1 2 . 1 1 36 36 ASP N N 36 122.400 122.400 120.724 1.676 18880
611 1 2 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.782 -0.192 18880
612 1 2 . 1 1 36 36 ASP C C 36 176.150 176.150 175.616 0.534 18880
613 1 2 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.484 -0.414 18880
614 1 2 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.920 0.400 18880
615 1 2 . 1 1 36 36 ASP H H 36 8.180 8.180 8.140 0.040 18880
616 1 2 . 1 1 37 37 GLY N N 37 108.560 108.560 107.319 1.241 18880
617 1 2 . 1 1 37 37 GLY C C 37 173.660 173.660 173.509 0.151 18880
618 1 2 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.776 -0.166 18880
619 1 2 . 1 1 37 37 GLY H H 37 7.680 7.680 8.047 -0.367 18880
620 1 2 . 1 1 38 38 ASP N N 38 120.010 120.010 119.482 0.528 18880
621 1 2 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.638 -0.038 18880
622 1 2 . 1 1 38 38 ASP CA C 38 54.260 54.260 52.339 1.921 18880
623 1 2 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.585 0.865 18880
624 1 2 . 1 1 38 38 ASP H H 38 8.220 8.220 8.181 0.039 18880
625 1 2 . 1 1 39 39 TYR N N 39 121.030 121.030 118.935 2.095 18880
626 1 2 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.094 0.296 18880
627 1 2 . 1 1 39 39 TYR C C 39 175.290 175.290 174.362 0.928 18880
628 1 2 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.515 -0.315 18880
629 1 2 . 1 1 39 39 TYR CB C 39 39.170 39.170 37.471 1.700 18880
630 1 2 . 1 1 39 39 TYR H H 39 8.090 8.090 7.968 0.122 18880
631 1 2 . 1 1 40 40 ASP N N 40 122.020 122.020 119.166 2.854 18880
632 1 2 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.407 0.193 18880
633 1 2 . 1 1 40 40 ASP C C 40 175.970 175.970 176.326 -0.356 18880
634 1 2 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.599 -0.379 18880
635 1 2 . 1 1 40 40 ASP CB C 40 41.520 41.520 40.981 0.539 18880
636 1 2 . 1 1 40 40 ASP H H 40 8.200 8.200 8.081 0.119 18880
637 1 2 . 1 1 41 41 GLY N N 41 108.330 108.330 105.193 3.137 18880
638 1 2 . 1 1 41 41 GLY C C 41 173.000 173.000 173.631 -0.631 18880
639 1 2 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.619 0.801 18880
640 1 2 . 1 1 41 41 GLY H H 41 7.830 7.830 8.134 -0.304 18880
641 1 2 . 1 1 42 42 PHE N N 42 118.600 118.600 119.900 -1.300 18880
642 1 2 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.443 0.817 18880
643 1 2 . 1 1 42 42 PHE C C 42 175.660 175.660 175.341 0.319 18880
644 1 2 . 1 1 42 42 PHE CA C 42 57.160 57.160 59.198 -2.038 18880
645 1 2 . 1 1 42 42 PHE CB C 42 41.170 41.170 39.199 1.971 18880
646 1 2 . 1 1 42 42 PHE H H 42 8.150 8.150 7.489 0.661 18880
647 1 2 . 1 1 43 43 VAL N N 43 119.180 119.180 123.971 -4.791 18880
648 1 2 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.395 0.275 18880
649 1 2 . 1 1 43 43 VAL C C 43 175.110 175.110 174.017 1.093 18880
650 1 2 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.993 0.627 18880
651 1 2 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.581 -2.701 18880
652 1 2 . 1 1 43 43 VAL H H 43 9.070 9.070 8.419 0.651 18880
653 1 2 . 1 1 44 44 SER N N 44 121.380 121.380 121.933 -0.553 18880
654 1 2 . 1 1 44 44 SER HA H 44 4.570 4.570 4.265 0.305 18880
655 1 2 . 1 1 44 44 SER C C 44 175.660 175.660 175.147 0.513 18880
656 1 2 . 1 1 44 44 SER CA C 44 57.720 57.720 56.479 1.241 18880
657 1 2 . 1 1 44 44 SER CB C 44 63.690 63.690 63.401 0.289 18880
658 1 2 . 1 1 44 44 SER H H 44 9.140 9.140 8.204 0.936 18880
659 1 2 . 1 1 45 45 VAL N N 45 122.720 122.720 123.698 -0.978 18880
660 1 2 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.214 0.286 18880
661 1 2 . 1 1 45 45 VAL C C 45 177.240 177.240 177.343 -0.103 18880
662 1 2 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.783 -0.513 18880
663 1 2 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.973 0.477 18880
664 1 2 . 1 1 45 45 VAL H H 45 8.140 8.140 8.444 -0.304 18880
665 1 2 . 1 1 46 46 GLU N N 46 118.990 118.990 118.310 0.680 18880
666 1 2 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.760 0.220 18880
667 1 2 . 1 1 46 46 GLU C C 46 179.460 179.460 179.221 0.239 18880
668 1 2 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.595 -0.035 18880
669 1 2 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.821 0.339 18880
670 1 2 . 1 1 46 46 GLU H H 46 8.230 8.230 7.440 0.790 18880
671 1 2 . 1 1 47 47 GLU N N 47 120.120 120.120 117.989 2.131 18880
672 1 2 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.213 -0.133 18880
673 1 2 . 1 1 47 47 GLU C C 47 179.170 179.170 178.557 0.613 18880
674 1 2 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.343 0.547 18880
675 1 2 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.649 0.171 18880
676 1 2 . 1 1 47 47 GLU H H 47 7.880 7.880 7.995 -0.115 18880
677 1 2 . 1 1 48 48 PHE N N 48 120.830 120.830 121.139 -0.309 18880
678 1 2 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.397 -0.207 18880
679 1 2 . 1 1 48 48 PHE C C 48 176.920 176.920 177.665 -0.745 18880
680 1 2 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.556 0.314 18880
681 1 2 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.265 -0.005 18880
682 1 2 . 1 1 48 48 PHE H H 48 8.600 8.600 8.208 0.392 18880
683 1 2 . 1 1 49 49 ARG N N 49 118.470 118.470 119.505 -1.035 18880
684 1 2 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.179 -0.319 18880
685 1 2 . 1 1 49 49 ARG C C 49 178.090 178.090 178.783 -0.693 18880
686 1 2 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.595 -0.525 18880
687 1 2 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.916 0.224 18880
688 1 2 . 1 1 49 49 ARG H H 49 8.650 8.650 9.024 -0.374 18880
689 1 2 . 1 1 50 50 GLY N N 50 105.080 105.080 105.618 -0.538 18880
690 1 2 . 1 1 50 50 GLY C C 50 175.090 175.090 175.843 -0.753 18880
691 1 2 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.856 -0.176 18880
692 1 2 . 1 1 50 50 GLY H H 50 7.620 7.620 8.143 -0.523 18880
693 1 2 . 1 1 51 51 ILE N N 51 121.440 121.440 121.788 -0.348 18880
694 1 2 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.905 -0.075 18880
695 1 2 . 1 1 51 51 ILE C C 51 178.300 178.300 177.544 0.756 18880
696 1 2 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.173 -0.333 18880
697 1 2 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.359 -0.049 18880
698 1 2 . 1 1 51 51 ILE H H 51 7.470 7.470 7.292 0.178 18880
699 1 2 . 1 1 52 52 ILE N N 52 118.930 118.930 119.428 -0.498 18880
700 1 2 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.895 -0.155 18880
701 1 2 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.326 0.434 18880
702 1 2 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.833 1.197 18880
703 1 2 . 1 1 52 52 ILE H H 52 7.790 7.790 8.462 -0.672 18880
704 1 2 . 1 1 53 53 ARG N N 53 120.140 120.140 118.755 1.385 18880
705 1 2 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.034 0.056 18880
706 1 2 . 1 1 53 53 ARG C C 53 177.380 177.380 177.397 -0.017 18880
707 1 2 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.276 0.834 18880
708 1 2 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.557 -0.977 18880
709 1 2 . 1 1 53 53 ARG H H 53 7.930 7.930 8.373 -0.443 18880
710 1 2 . 1 1 54 54 ASP N N 54 117.500 117.500 115.970 1.530 18880
711 1 2 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.885 -0.285 18880
712 1 2 . 1 1 54 54 ASP C C 54 176.930 176.930 176.050 0.880 18880
713 1 2 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.962 1.578 18880
714 1 2 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.518 -0.418 18880
715 1 2 . 1 1 54 54 ASP H H 54 7.870 7.870 7.944 -0.074 18880
716 1 2 . 1 1 55 55 GLY N N 55 106.370 106.370 108.644 -2.274 18880
717 1 2 . 1 1 55 55 GLY C C 55 173.460 173.460 173.983 -0.523 18880
718 1 2 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.543 0.457 18880
719 1 2 . 1 1 55 55 GLY H H 55 7.880 7.880 7.761 0.119 18880
720 1 2 . 1 1 56 56 LEU N N 56 122.630 122.630 122.269 0.361 18880
721 1 2 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.825 -0.055 18880
722 1 2 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.905 0.585 18880
723 1 2 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.730 0.390 18880
724 1 2 . 1 1 56 56 LEU H H 56 8.220 8.220 7.901 0.319 18880
725 1 2 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.523 0.057 18880
726 1 2 . 1 1 57 57 PRO C C 57 176.150 176.150 175.768 0.382 18880
727 1 2 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.223 -0.803 18880
728 1 2 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.572 -0.832 18880
729 1 2 . 1 1 58 58 MET N N 58 121.810 121.810 124.446 -2.636 18880
730 1 2 . 1 1 58 58 MET HA H 58 4.630 4.630 4.786 -0.156 18880
731 1 2 . 1 1 58 58 MET C C 58 176.150 176.150 174.960 1.190 18880
732 1 2 . 1 1 58 58 MET CA C 58 55.560 55.560 54.430 1.130 18880
733 1 2 . 1 1 58 58 MET CB C 58 36.820 36.820 37.356 -0.536 18880
734 1 2 . 1 1 58 58 MET H H 58 7.690 7.690 8.195 -0.505 18880
735 1 2 . 1 1 59 59 THR N N 59 114.180 114.180 116.268 -2.088 18880
736 1 2 . 1 1 59 59 THR HA H 59 4.450 4.450 4.487 -0.037 18880
737 1 2 . 1 1 59 59 THR C C 59 175.170 175.170 175.942 -0.772 18880
738 1 2 . 1 1 59 59 THR CA C 59 60.780 60.780 60.896 -0.116 18880
739 1 2 . 1 1 59 59 THR CB C 59 71.060 71.060 69.973 1.087 18880
740 1 2 . 1 1 59 59 THR H H 59 8.940 8.940 8.660 0.280 18880
741 1 2 . 1 1 60 60 GLU N N 60 120.620 120.620 125.618 -4.998 18880
742 1 2 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.754 0.256 18880
743 1 2 . 1 1 60 60 GLU C C 60 179.010 179.010 178.075 0.935 18880
744 1 2 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.729 0.091 18880
745 1 2 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.597 0.453 18880
746 1 2 . 1 1 60 60 GLU H H 60 8.850 8.850 8.961 -0.111 18880
747 1 2 . 1 1 61 61 ALA N N 61 121.080 121.080 123.212 -2.132 18880
748 1 2 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.875 0.265 18880
749 1 2 . 1 1 61 61 ALA C C 61 180.350 180.350 179.874 0.476 18880
750 1 2 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.400 -0.310 18880
751 1 2 . 1 1 61 61 ALA CB C 61 18.210 18.210 18.015 0.195 18880
752 1 2 . 1 1 61 61 ALA H H 61 8.370 8.370 8.488 -0.118 18880
753 1 2 . 1 1 62 62 GLU N N 62 118.890 118.890 119.107 -0.217 18880
754 1 2 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.508 0.492 18880
755 1 2 . 1 1 62 62 GLU C C 62 179.690 179.690 178.720 0.970 18880
756 1 2 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.537 0.453 18880
757 1 2 . 1 1 62 62 GLU CB C 62 30.310 30.310 29.016 1.294 18880
758 1 2 . 1 1 62 62 GLU H H 62 7.680 7.680 7.585 0.095 18880
759 1 2 . 1 1 63 63 ILE N N 63 122.340 122.340 119.942 2.398 18880
760 1 2 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.303 0.267 18880
761 1 2 . 1 1 63 63 ILE C C 63 177.260 177.260 178.258 -0.998 18880
762 1 2 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.814 1.076 18880
763 1 2 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.113 0.867 18880
764 1 2 . 1 1 63 63 ILE H H 63 8.420 8.420 7.744 0.676 18880
765 1 2 . 1 1 64 64 THR N N 64 116.970 116.970 115.773 1.197 18880
766 1 2 . 1 1 64 64 THR HA H 64 3.940 3.940 4.070 -0.130 18880
767 1 2 . 1 1 64 64 THR C C 64 176.520 176.520 176.754 -0.234 18880
768 1 2 . 1 1 64 64 THR CA C 64 67.060 67.060 67.623 -0.563 18880
769 1 2 . 1 1 64 64 THR CB C 64 68.750 68.750 68.398 0.352 18880
770 1 2 . 1 1 64 64 THR H H 64 8.310 8.310 8.590 -0.280 18880
771 1 2 . 1 1 65 65 GLU N N 65 120.760 120.760 119.783 0.977 18880
772 1 2 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.217 -0.187 18880
773 1 2 . 1 1 65 65 GLU C C 65 175.830 175.830 178.102 -2.272 18880
774 1 2 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.602 0.898 18880
775 1 2 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.644 0.126 18880
776 1 2 . 1 1 65 65 GLU H H 65 7.970 7.970 8.517 -0.547 18880
777 1 2 . 1 1 66 66 PHE N N 66 120.940 120.940 117.245 3.695 18880
778 1 2 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.465 -0.225 18880
779 1 2 . 1 1 66 66 PHE C C 66 177.330 177.330 176.845 0.485 18880
780 1 2 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.762 2.438 18880
781 1 2 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.168 -0.638 18880
782 1 2 . 1 1 66 66 PHE H H 66 8.100 8.100 7.821 0.279 18880
783 1 2 . 1 1 67 67 PHE N N 67 118.110 118.110 119.009 -0.899 18880
784 1 2 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.458 -0.508 18880
785 1 2 . 1 1 67 67 PHE C C 67 178.090 178.090 177.575 0.515 18880
786 1 2 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.893 1.307 18880
787 1 2 . 1 1 67 67 PHE CB C 67 38.250 38.250 39.251 -1.001 18880
788 1 2 . 1 1 67 67 PHE H H 67 8.380 8.380 8.486 -0.106 18880
789 1 2 . 1 1 68 68 GLU N N 68 119.650 119.650 119.184 0.466 18880
790 1 2 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.492 -0.482 18880
791 1 2 . 1 1 68 68 GLU C C 68 177.910 177.910 177.797 0.113 18880
792 1 2 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.506 0.734 18880
793 1 2 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.357 0.013 18880
794 1 2 . 1 1 68 68 GLU H H 68 8.230 8.230 8.317 -0.087 18880
795 1 2 . 1 1 69 69 ALA N N 69 119.090 119.090 121.040 -1.950 18880
796 1 2 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.255 -0.075 18880
797 1 2 . 1 1 69 69 ALA C C 69 179.030 179.030 177.970 1.060 18880
798 1 2 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.653 -0.053 18880
799 1 2 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.190 0.590 18880
800 1 2 . 1 1 69 69 ALA H H 69 7.340 7.340 8.042 -0.702 18880
801 1 2 . 1 1 70 70 ALA N N 70 118.670 118.670 122.308 -3.638 18880
802 1 2 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.349 -0.329 18880
803 1 2 . 1 1 70 70 ALA C C 70 176.820 176.820 177.498 -0.678 18880
804 1 2 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.802 0.288 18880
805 1 2 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.270 -0.660 18880
806 1 2 . 1 1 70 70 ALA H H 70 8.050 8.050 7.590 0.460 18880
807 1 2 . 1 1 71 71 ASP N N 71 116.780 116.780 118.020 -1.240 18880
808 1 2 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.110 0.110 18880
809 1 2 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.716 1.434 18880
810 1 2 . 1 1 71 71 ASP CB C 71 40.910 40.910 41.703 -0.793 18880
811 1 2 . 1 1 71 71 ASP H H 71 8.010 8.010 7.901 0.109 18880
812 1 2 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.408 0.062 18880
813 1 2 . 1 1 72 72 PRO C C 72 177.970 177.970 177.134 0.836 18880
814 1 2 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.574 0.336 18880
815 1 2 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.253 -0.373 18880
816 1 2 . 1 1 73 73 ASN N N 73 114.930 114.930 116.478 -1.548 18880
817 1 2 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.577 0.303 18880
818 1 2 . 1 1 73 73 ASN C C 73 174.880 174.880 175.232 -0.352 18880
819 1 2 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.919 -1.079 18880
820 1 2 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.435 -0.055 18880
821 1 2 . 1 1 73 73 ASN H H 73 9.030 9.030 8.342 0.688 18880
822 1 2 . 1 1 74 74 ASN N N 74 118.340 118.340 112.130 6.210 18880
823 1 2 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.887 -0.527 18880
824 1 2 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.948 0.642 18880
825 1 2 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.215 0.945 18880
826 1 2 . 1 1 74 74 ASN H H 74 8.320 8.320 8.376 -0.056 18880
827 1 2 . 1 1 75 75 THR N N 75 113.450 113.450 115.349 -1.899 18880
828 1 2 . 1 1 75 75 THR HA H 75 4.210 4.210 4.407 -0.197 18880
829 1 2 . 1 1 75 75 THR CA C 75 63.410 63.410 61.044 2.366 18880
830 1 2 . 1 1 75 75 THR CB C 75 70.540 70.540 68.566 1.974 18880
831 1 2 . 1 1 75 75 THR H H 75 9.870 9.870 7.963 1.907 18880
832 1 2 . 1 1 76 76 GLY N N 76 111.810 111.810 108.729 3.081 18880
833 1 2 . 1 1 76 76 GLY C C 76 173.670 173.670 173.534 0.136 18880
834 1 2 . 1 1 76 76 GLY CA C 76 45.120 45.120 46.114 -0.994 18880
835 1 2 . 1 1 76 76 GLY H H 76 10.250 10.250 8.110 2.140 18880
836 1 2 . 1 1 77 77 PHE N N 77 120.560 120.560 118.263 2.297 18880
837 1 2 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.170 -0.020 18880
838 1 2 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.363 -0.183 18880
839 1 2 . 1 1 77 77 PHE CB C 77 43.500 43.500 43.081 0.419 18880
840 1 2 . 1 1 77 77 PHE H H 77 8.110 8.110 7.508 0.602 18880
841 1 2 . 1 1 78 78 ILE N N 78 116.410 116.410 119.943 -3.533 18880
842 1 2 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.438 -0.048 18880
843 1 2 . 1 1 78 78 ILE C C 78 174.770 174.770 174.244 0.526 18880
844 1 2 . 1 1 78 78 ILE CA C 78 59.190 59.190 60.175 -0.985 18880
845 1 2 . 1 1 78 78 ILE CB C 78 41.180 41.180 42.393 -1.213 18880
846 1 2 . 1 1 78 78 ILE H H 78 8.930 8.930 8.163 0.767 18880
847 1 2 . 1 1 79 79 ASP N N 79 125.220 125.220 126.278 -1.058 18880
848 1 2 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.125 -0.625 18880
849 1 2 . 1 1 79 79 ASP C C 79 176.490 176.490 176.979 -0.489 18880
850 1 2 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.568 0.742 18880
851 1 2 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.683 0.687 18880
852 1 2 . 1 1 79 79 ASP H H 79 8.610 8.610 8.687 -0.077 18880
853 1 2 . 1 1 80 80 TYR N N 80 125.760 125.760 129.015 -3.255 18880
854 1 2 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.024 -0.034 18880
855 1 2 . 1 1 80 80 TYR C C 80 177.140 177.140 176.649 0.491 18880
856 1 2 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.064 -0.484 18880
857 1 2 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.323 0.567 18880
858 1 2 . 1 1 80 80 TYR H H 80 8.460 8.460 8.720 -0.260 18880
859 1 2 . 1 1 81 81 LYS N N 81 118.320 118.320 118.268 0.052 18880
860 1 2 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.847 0.053 18880
861 1 2 . 1 1 81 81 LYS C C 81 179.090 179.090 178.700 0.390 18880
862 1 2 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.756 -0.176 18880
863 1 2 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.933 -0.173 18880
864 1 2 . 1 1 81 81 LYS H H 81 8.410 8.410 8.366 0.044 18880
865 1 2 . 1 1 82 82 ALA N N 82 122.050 122.050 121.761 0.289 18880
866 1 2 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.183 -0.053 18880
867 1 2 . 1 1 82 82 ALA C C 82 179.740 179.740 179.431 0.309 18880
868 1 2 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.694 -0.174 18880
869 1 2 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.422 0.118 18880
870 1 2 . 1 1 82 82 ALA H H 82 7.770 7.770 8.003 -0.233 18880
871 1 2 . 1 1 83 83 PHE N N 83 117.810 117.810 116.641 1.169 18880
872 1 2 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.335 -0.045 18880
873 1 2 . 1 1 83 83 PHE C C 83 176.460 176.460 176.602 -0.142 18880
874 1 2 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.044 -0.014 18880
875 1 2 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.001 -0.480 18880
876 1 2 . 1 1 83 83 PHE H H 83 7.780 7.780 7.749 0.031 18880
877 1 2 . 1 1 84 84 ALA N N 84 121.530 121.530 121.553 -0.023 18880
878 1 2 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.045 -0.385 18880
879 1 2 . 1 1 84 84 ALA C C 84 179.010 179.010 178.595 0.415 18880
880 1 2 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.513 1.517 18880
881 1 2 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.339 -0.209 18880
882 1 2 . 1 1 84 84 ALA H H 84 8.290 8.290 8.201 0.089 18880
883 1 2 . 1 1 85 85 ALA N N 85 117.720 117.720 121.034 -3.314 18880
884 1 2 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.246 -0.166 18880
885 1 2 . 1 1 85 85 ALA C C 85 179.570 179.570 178.111 1.459 18880
886 1 2 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.261 0.109 18880
887 1 2 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.483 -0.193 18880
888 1 2 . 1 1 85 85 ALA H H 85 7.700 7.700 8.314 -0.614 18880
889 1 2 . 1 1 86 86 MET N N 86 116.570 116.570 116.178 0.392 18880
890 1 2 . 1 1 86 86 MET HA H 86 4.160 4.160 4.206 -0.046 18880
891 1 2 . 1 1 86 86 MET C C 86 177.360 177.360 176.865 0.495 18880
892 1 2 . 1 1 86 86 MET CA C 86 57.380 57.380 56.467 0.913 18880
893 1 2 . 1 1 86 86 MET CB C 86 32.720 32.720 33.179 -0.459 18880
894 1 2 . 1 1 86 86 MET H H 86 7.560 7.560 7.472 0.088 18880
895 1 2 . 1 1 87 87 LEU N N 87 119.090 119.090 116.186 2.904 18880
896 1 2 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.054 -0.084 18880
897 1 2 . 1 1 87 87 LEU C C 87 177.420 177.420 176.727 0.693 18880
898 1 2 . 1 1 87 87 LEU CA C 87 56.290 56.290 54.959 1.331 18880
899 1 2 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.767 0.513 18880
900 1 2 . 1 1 87 87 LEU H H 87 7.570 7.570 7.166 0.404 18880
901 1 2 . 1 1 88 88 TYR N N 88 117.060 117.060 114.778 2.282 18880
902 1 2 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.732 -0.142 18880
903 1 2 . 1 1 88 88 TYR C C 88 175.870 175.870 175.347 0.523 18880
904 1 2 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.293 2.547 18880
905 1 2 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.075 0.564 18880
906 1 2 . 1 1 88 88 TYR H H 88 7.740 7.740 7.122 0.618 18880
907 1 2 . 1 1 89 89 SER N N 89 115.980 115.980 115.674 0.306 18880
908 1 2 . 1 1 89 89 SER HA H 89 4.440 4.440 4.460 -0.020 18880
909 1 2 . 1 1 89 89 SER C C 89 174.460 174.460 174.535 -0.075 18880
910 1 2 . 1 1 89 89 SER CA C 89 58.350 58.350 59.676 -1.326 18880
911 1 2 . 1 1 89 89 SER CB C 89 63.990 63.990 63.220 0.770 18880
912 1 2 . 1 1 89 89 SER H H 89 7.880 7.880 7.771 0.109 18880
913 1 2 . 1 1 90 90 VAL N N 90 120.910 120.910 120.346 0.564 18880
914 1 2 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.321 -0.181 18880
915 1 2 . 1 1 90 90 VAL C C 90 175.720 175.720 174.160 1.560 18880
916 1 2 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.273 -0.003 18880
917 1 2 . 1 1 90 90 VAL CB C 90 32.840 32.840 30.774 2.066 18880
918 1 2 . 1 1 90 90 VAL H H 90 8.020 8.020 7.665 0.355 18880
919 1 2 . 1 1 91 91 ASP N N 91 123.620 123.620 119.907 3.713 18880
920 1 2 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.758 -0.128 18880
921 1 2 . 1 1 91 91 ASP C C 91 176.000 176.000 175.485 0.515 18880
922 1 2 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.451 0.059 18880
923 1 2 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.515 -0.075 18880
924 1 2 . 1 1 91 91 ASP H H 91 8.310 8.310 8.204 0.106 18880
925 1 2 . 1 1 92 92 GLU N N 92 122.170 122.170 119.852 2.318 18880
926 1 2 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.745 -0.385 18880
927 1 2 . 1 1 92 92 GLU C C 92 175.660 175.660 177.141 -1.481 18880
928 1 2 . 1 1 92 92 GLU CA C 92 56.490 56.490 55.601 0.889 18880
929 1 2 . 1 1 92 92 GLU CB C 92 32.850 32.850 31.853 0.997 18880
930 1 2 . 1 1 92 92 GLU H H 92 8.320 8.320 8.053 0.267 18880
931 1 3 . 1 1 10 10 HIS C C 10 176.040 176.040 174.370 1.670 18880
932 1 3 . 1 1 11 11 SER N N 11 116.840 116.840 114.146 2.694 18880
933 1 3 . 1 1 11 11 SER HA H 11 4.430 4.430 4.575 -0.145 18880
934 1 3 . 1 1 11 11 SER C C 11 174.630 174.630 174.200 0.430 18880
935 1 3 . 1 1 11 11 SER CA C 11 58.350 58.350 58.573 -0.223 18880
936 1 3 . 1 1 11 11 SER CB C 11 64.120 64.120 65.159 -1.038 18880
937 1 3 . 1 1 11 11 SER H H 11 8.360 8.360 8.173 0.187 18880
938 1 3 . 1 1 12 12 SER N N 12 118.030 118.030 117.349 0.681 18880
939 1 3 . 1 1 12 12 SER HA H 12 4.440 4.440 4.687 -0.247 18880
940 1 3 . 1 1 12 12 SER C C 12 174.880 174.880 174.426 0.454 18880
941 1 3 . 1 1 12 12 SER CA C 12 58.680 58.680 58.248 0.432 18880
942 1 3 . 1 1 12 12 SER CB C 12 63.890 63.890 64.495 -0.605 18880
943 1 3 . 1 1 12 12 SER H H 12 8.490 8.490 7.765 0.725 18880
944 1 3 . 1 1 13 13 GLY N N 13 110.450 110.450 111.770 -1.320 18880
945 1 3 . 1 1 13 13 GLY C C 13 173.790 173.790 174.970 -1.180 18880
946 1 3 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.520 -0.060 18880
947 1 3 . 1 1 13 13 GLY H H 13 8.390 8.390 8.530 -0.140 18880
948 1 3 . 1 1 14 14 LEU N N 14 121.310 121.310 124.135 -2.825 18880
949 1 3 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.379 -0.039 18880
950 1 3 . 1 1 14 14 LEU C C 14 176.930 176.930 176.494 0.436 18880
951 1 3 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.856 0.344 18880
952 1 3 . 1 1 14 14 LEU CB C 14 42.600 42.600 39.937 2.663 18880
953 1 3 . 1 1 14 14 LEU H H 14 8.020 8.020 8.167 -0.147 18880
954 1 3 . 1 1 15 15 VAL N N 15 121.550 121.550 121.021 0.529 18880
955 1 3 . 1 1 15 15 VAL HA H 15 4.370 4.370 3.773 0.597 18880
956 1 3 . 1 1 15 15 VAL CA C 15 59.720 59.720 61.801 -2.081 18880
957 1 3 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.251 1.519 18880
958 1 3 . 1 1 15 15 VAL H H 15 8.030 8.030 7.970 0.060 18880
959 1 3 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.374 -0.004 18880
960 1 3 . 1 1 16 16 PRO C C 16 176.720 176.720 176.625 0.095 18880
961 1 3 . 1 1 16 16 PRO CA C 16 62.650 62.650 62.654 -0.004 18880
962 1 3 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.547 -0.307 18880
963 1 3 . 1 1 17 17 ARG N N 17 121.890 121.890 120.248 1.642 18880
964 1 3 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.112 0.168 18880
965 1 3 . 1 1 17 17 ARG C C 17 176.940 176.940 177.191 -0.251 18880
966 1 3 . 1 1 17 17 ARG CA C 17 56.360 56.360 57.342 -0.982 18880
967 1 3 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.165 0.885 18880
968 1 3 . 1 1 17 17 ARG H H 17 8.450 8.450 8.474 -0.024 18880
969 1 3 . 1 1 18 18 GLY N N 18 110.160 110.160 105.177 4.983 18880
970 1 3 . 1 1 18 18 GLY C C 18 174.110 174.110 174.329 -0.219 18880
971 1 3 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.865 0.525 18880
972 1 3 . 1 1 18 18 GLY H H 18 8.480 8.480 8.181 0.299 18880
973 1 3 . 1 1 19 19 SER N N 19 115.500 115.500 115.540 -0.040 18880
974 1 3 . 1 1 19 19 SER HA H 19 4.400 4.400 4.474 -0.074 18880
975 1 3 . 1 1 19 19 SER C C 19 174.380 174.380 173.781 0.599 18880
976 1 3 . 1 1 19 19 SER CA C 19 58.610 58.610 58.779 -0.169 18880
977 1 3 . 1 1 19 19 SER CB C 19 63.830 63.830 63.647 0.183 18880
978 1 3 . 1 1 19 19 SER H H 19 8.210 8.210 8.622 -0.412 18880
979 1 3 . 1 1 20 20 HIS N N 20 120.770 120.770 118.159 2.611 18880
980 1 3 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.588 0.022 18880
981 1 3 . 1 1 20 20 HIS C C 20 174.870 174.870 173.447 1.423 18880
982 1 3 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.440 -0.310 18880
983 1 3 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.432 -0.722 18880
984 1 3 . 1 1 20 20 HIS H H 20 8.590 8.590 8.470 0.120 18880
985 1 3 . 1 1 21 21 MET N N 21 121.440 121.440 118.617 2.823 18880
986 1 3 . 1 1 21 21 MET HA H 21 4.470 4.470 4.586 -0.116 18880
987 1 3 . 1 1 21 21 MET C C 21 176.030 176.030 176.934 -0.904 18880
988 1 3 . 1 1 21 21 MET CA C 21 55.490 55.490 56.461 -0.971 18880
989 1 3 . 1 1 21 21 MET CB C 21 33.170 33.170 33.866 -0.696 18880
990 1 3 . 1 1 21 21 MET H H 21 8.310 8.310 7.989 0.321 18880
991 1 3 . 1 1 22 22 SER N N 22 116.860 116.860 113.941 2.919 18880
992 1 3 . 1 1 22 22 SER HA H 22 4.430 4.430 4.662 -0.232 18880
993 1 3 . 1 1 22 22 SER C C 22 174.630 174.630 175.131 -0.501 18880
994 1 3 . 1 1 22 22 SER CA C 22 58.410 58.410 57.585 0.825 18880
995 1 3 . 1 1 22 22 SER CB C 22 64.030 64.030 63.168 0.862 18880
996 1 3 . 1 1 22 22 SER H H 22 8.340 8.340 8.451 -0.111 18880
997 1 3 . 1 1 23 23 ASP N N 23 122.660 122.660 121.789 0.871 18880
998 1 3 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.575 -0.025 18880
999 1 3 . 1 1 23 23 ASP C C 23 176.860 176.860 177.407 -0.547 18880
1000 1 3 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.889 -0.559 18880
1001 1 3 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.342 0.658 18880
1002 1 3 . 1 1 23 23 ASP H H 23 8.540 8.540 8.501 0.039 18880
1003 1 3 . 1 1 24 24 GLU N N 24 120.400 120.400 118.544 1.856 18880
1004 1 3 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.124 0.016 18880
1005 1 3 . 1 1 24 24 GLU C C 24 177.540 177.540 177.273 0.267 18880
1006 1 3 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.472 -0.112 18880
1007 1 3 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.555 0.195 18880
1008 1 3 . 1 1 24 24 GLU H H 24 8.610 8.610 8.002 0.608 18880
1009 1 3 . 1 1 25 25 LYS N N 25 120.390 120.390 118.589 1.801 18880
1010 1 3 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.299 -0.109 18880
1011 1 3 . 1 1 25 25 LYS C C 25 177.490 177.490 178.402 -0.912 18880
1012 1 3 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.865 0.245 18880
1013 1 3 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.868 -0.378 18880
1014 1 3 . 1 1 25 25 LYS H H 25 8.210 8.210 7.569 0.641 18880
1015 1 3 . 1 1 26 26 THR N N 26 114.880 114.880 116.143 -1.263 18880
1016 1 3 . 1 1 26 26 THR HA H 26 4.040 4.040 4.115 -0.075 18880
1017 1 3 . 1 1 26 26 THR C C 26 175.430 175.430 177.037 -1.607 18880
1018 1 3 . 1 1 26 26 THR CA C 26 64.620 64.620 65.896 -1.276 18880
1019 1 3 . 1 1 26 26 THR CB C 26 69.110 69.110 68.526 0.584 18880
1020 1 3 . 1 1 26 26 THR H H 26 8.080 8.080 7.426 0.654 18880
1021 1 3 . 1 1 27 27 GLN N N 27 120.940 120.940 121.122 -0.182 18880
1022 1 3 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.134 0.056 18880
1023 1 3 . 1 1 27 27 GLN C C 27 177.280 177.280 177.524 -0.244 18880
1024 1 3 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.510 -0.960 18880
1025 1 3 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.460 0.630 18880
1026 1 3 . 1 1 27 27 GLN H H 27 8.240 8.240 7.967 0.273 18880
1027 1 3 . 1 1 28 28 LEU N N 28 121.860 121.860 118.854 3.006 18880
1028 1 3 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.458 -0.288 18880
1029 1 3 . 1 1 28 28 LEU C C 28 177.750 177.750 177.926 -0.176 18880
1030 1 3 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.482 1.598 18880
1031 1 3 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.641 -0.371 18880
1032 1 3 . 1 1 28 28 LEU H H 28 7.950 7.950 7.725 0.225 18880
1033 1 3 . 1 1 29 29 ILE N N 29 119.260 119.260 119.137 0.123 18880
1034 1 3 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.140 -0.240 18880
1035 1 3 . 1 1 29 29 ILE C C 29 177.140 177.140 177.969 -0.829 18880
1036 1 3 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.674 -0.374 18880
1037 1 3 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.976 1.304 18880
1038 1 3 . 1 1 29 29 ILE H H 29 7.950 7.950 7.919 0.031 18880
1039 1 3 . 1 1 30 30 GLU N N 30 120.500 120.500 119.289 1.211 18880
1040 1 3 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.337 -0.287 18880
1041 1 3 . 1 1 30 30 GLU C C 30 177.560 177.560 176.623 0.937 18880
1042 1 3 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.997 0.093 18880
1043 1 3 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.056 0.534 18880
1044 1 3 . 1 1 30 30 GLU H H 30 8.220 8.220 8.144 0.076 18880
1045 1 3 . 1 1 31 31 ALA N N 31 121.550 121.550 120.950 0.600 18880
1046 1 3 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.469 -0.319 18880
1047 1 3 . 1 1 31 31 ALA C C 31 178.550 178.550 178.679 -0.129 18880
1048 1 3 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.674 0.126 18880
1049 1 3 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.344 -0.714 18880
1050 1 3 . 1 1 31 31 ALA H H 31 7.890 7.890 7.801 0.089 18880
1051 1 3 . 1 1 32 32 PHE N N 32 117.240 117.240 118.586 -1.346 18880
1052 1 3 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.259 0.041 18880
1053 1 3 . 1 1 32 32 PHE C C 32 176.210 176.210 177.267 -1.057 18880
1054 1 3 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.019 -1.679 18880
1055 1 3 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.148 0.602 18880
1056 1 3 . 1 1 32 32 PHE H H 32 7.930 7.930 7.828 0.102 18880
1057 1 3 . 1 1 33 33 TYR N N 33 119.050 119.050 116.548 2.502 18880
1058 1 3 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.613 -0.283 18880
1059 1 3 . 1 1 33 33 TYR C C 33 175.680 175.680 175.659 0.021 18880
1060 1 3 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.179 0.741 18880
1061 1 3 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.496 1.044 18880
1062 1 3 . 1 1 33 33 TYR H H 33 7.950 7.950 8.329 -0.379 18880
1063 1 3 . 1 1 34 34 ASN N N 34 118.390 118.390 118.754 -0.364 18880
1064 1 3 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.844 -0.214 18880
1065 1 3 . 1 1 34 34 ASN C C 34 174.810 174.810 173.720 1.090 18880
1066 1 3 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.805 -0.655 18880
1067 1 3 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.733 -0.753 18880
1068 1 3 . 1 1 34 34 ASN H H 34 7.960 7.960 8.125 -0.165 18880
1069 1 3 . 1 1 35 35 PHE N N 35 120.670 120.670 119.369 1.301 18880
1070 1 3 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.550 -0.100 18880
1071 1 3 . 1 1 35 35 PHE C C 35 175.310 175.310 173.480 1.830 18880
1072 1 3 . 1 1 35 35 PHE CA C 35 58.320 58.320 57.972 0.348 18880
1073 1 3 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.114 -0.694 18880
1074 1 3 . 1 1 35 35 PHE H H 35 7.830 7.830 7.769 0.061 18880
1075 1 3 . 1 1 36 36 ASP N N 36 122.400 122.400 124.381 -1.981 18880
1076 1 3 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.552 0.038 18880
1077 1 3 . 1 1 36 36 ASP C C 36 176.150 176.150 176.496 -0.346 18880
1078 1 3 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.586 0.484 18880
1079 1 3 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.173 0.147 18880
1080 1 3 . 1 1 36 36 ASP H H 36 8.180 8.180 8.380 -0.200 18880
1081 1 3 . 1 1 37 37 GLY N N 37 108.560 108.560 108.513 0.047 18880
1082 1 3 . 1 1 37 37 GLY C C 37 173.660 173.660 174.089 -0.429 18880
1083 1 3 . 1 1 37 37 GLY CA C 37 45.610 45.610 44.892 0.718 18880
1084 1 3 . 1 1 37 37 GLY H H 37 7.680 7.680 7.488 0.192 18880
1085 1 3 . 1 1 38 38 ASP N N 38 120.010 120.010 119.242 0.768 18880
1086 1 3 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.458 0.142 18880
1087 1 3 . 1 1 38 38 ASP CA C 38 54.260 54.260 55.047 -0.787 18880
1088 1 3 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.756 1.694 18880
1089 1 3 . 1 1 38 38 ASP H H 38 8.220 8.220 8.467 -0.247 18880
1090 1 3 . 1 1 39 39 TYR N N 39 121.030 121.030 115.509 5.521 18880
1091 1 3 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.039 0.351 18880
1092 1 3 . 1 1 39 39 TYR C C 39 175.290 175.290 174.670 0.620 18880
1093 1 3 . 1 1 39 39 TYR CA C 39 58.200 58.200 59.876 -1.676 18880
1094 1 3 . 1 1 39 39 TYR CB C 39 39.170 39.170 36.834 2.336 18880
1095 1 3 . 1 1 39 39 TYR H H 39 8.090 8.090 8.274 -0.184 18880
1096 1 3 . 1 1 40 40 ASP N N 40 122.020 122.020 120.359 1.661 18880
1097 1 3 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.643 -0.043 18880
1098 1 3 . 1 1 40 40 ASP C C 40 175.970 175.970 176.994 -1.024 18880
1099 1 3 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.559 -0.339 18880
1100 1 3 . 1 1 40 40 ASP CB C 40 41.520 41.520 42.094 -0.574 18880
1101 1 3 . 1 1 40 40 ASP H H 40 8.200 8.200 8.132 0.068 18880
1102 1 3 . 1 1 41 41 GLY N N 41 108.330 108.330 109.652 -1.322 18880
1103 1 3 . 1 1 41 41 GLY C C 41 173.000 173.000 173.517 -0.517 18880
1104 1 3 . 1 1 41 41 GLY CA C 41 45.420 45.420 45.473 -0.053 18880
1105 1 3 . 1 1 41 41 GLY H H 41 7.830 7.830 7.914 -0.084 18880
1106 1 3 . 1 1 42 42 PHE N N 42 118.600 118.600 118.611 -0.011 18880
1107 1 3 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.868 0.392 18880
1108 1 3 . 1 1 42 42 PHE C C 42 175.660 175.660 174.027 1.633 18880
1109 1 3 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.586 -0.426 18880
1110 1 3 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.148 -0.978 18880
1111 1 3 . 1 1 42 42 PHE H H 42 8.150 8.150 7.484 0.666 18880
1112 1 3 . 1 1 43 43 VAL N N 43 119.180 119.180 124.777 -5.597 18880
1113 1 3 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.535 0.135 18880
1114 1 3 . 1 1 43 43 VAL C C 43 175.110 175.110 174.788 0.322 18880
1115 1 3 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.278 0.342 18880
1116 1 3 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.483 -1.603 18880
1117 1 3 . 1 1 43 43 VAL H H 43 9.070 9.070 8.736 0.334 18880
1118 1 3 . 1 1 44 44 SER N N 44 121.380 121.380 123.339 -1.959 18880
1119 1 3 . 1 1 44 44 SER HA H 44 4.570 4.570 4.667 -0.097 18880
1120 1 3 . 1 1 44 44 SER C C 44 175.660 175.660 175.370 0.290 18880
1121 1 3 . 1 1 44 44 SER CA C 44 57.720 57.720 58.387 -0.667 18880
1122 1 3 . 1 1 44 44 SER CB C 44 63.690 63.690 64.134 -0.444 18880
1123 1 3 . 1 1 44 44 SER H H 44 9.140 9.140 8.717 0.423 18880
1124 1 3 . 1 1 45 45 VAL N N 45 122.720 122.720 120.218 2.502 18880
1125 1 3 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.290 0.210 18880
1126 1 3 . 1 1 45 45 VAL C C 45 177.240 177.240 177.608 -0.368 18880
1127 1 3 . 1 1 45 45 VAL CA C 45 66.270 66.270 65.497 0.773 18880
1128 1 3 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.899 0.551 18880
1129 1 3 . 1 1 45 45 VAL H H 45 8.140 8.140 8.619 -0.479 18880
1130 1 3 . 1 1 46 46 GLU N N 46 118.990 118.990 119.754 -0.764 18880
1131 1 3 . 1 1 46 46 GLU HA H 46 3.980 3.980 4.003 -0.023 18880
1132 1 3 . 1 1 46 46 GLU C C 46 179.460 179.460 178.612 0.848 18880
1133 1 3 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.296 0.264 18880
1134 1 3 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.221 -0.061 18880
1135 1 3 . 1 1 46 46 GLU H H 46 8.230 8.230 7.595 0.635 18880
1136 1 3 . 1 1 47 47 GLU N N 47 120.120 120.120 119.478 0.642 18880
1137 1 3 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.042 0.038 18880
1138 1 3 . 1 1 47 47 GLU C C 47 179.170 179.170 178.861 0.309 18880
1139 1 3 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.953 -0.063 18880
1140 1 3 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.520 0.300 18880
1141 1 3 . 1 1 47 47 GLU H H 47 7.880 7.880 7.604 0.276 18880
1142 1 3 . 1 1 48 48 PHE N N 48 120.830 120.830 118.628 2.202 18880
1143 1 3 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.129 0.061 18880
1144 1 3 . 1 1 48 48 PHE C C 48 176.920 176.920 177.702 -0.782 18880
1145 1 3 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.342 0.528 18880
1146 1 3 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.889 0.371 18880
1147 1 3 . 1 1 48 48 PHE H H 48 8.600 8.600 7.708 0.892 18880
1148 1 3 . 1 1 49 49 ARG N N 49 118.470 118.470 120.121 -1.651 18880
1149 1 3 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.101 -0.241 18880
1150 1 3 . 1 1 49 49 ARG C C 49 178.090 178.090 178.682 -0.592 18880
1151 1 3 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.259 -0.189 18880
1152 1 3 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.791 0.349 18880
1153 1 3 . 1 1 49 49 ARG H H 49 8.650 8.650 7.963 0.687 18880
1154 1 3 . 1 1 50 50 GLY N N 50 105.080 105.080 105.034 0.046 18880
1155 1 3 . 1 1 50 50 GLY C C 50 175.090 175.090 176.207 -1.117 18880
1156 1 3 . 1 1 50 50 GLY CA C 50 46.680 46.680 47.041 -0.360 18880
1157 1 3 . 1 1 50 50 GLY H H 50 7.620 7.620 7.960 -0.340 18880
1158 1 3 . 1 1 51 51 ILE N N 51 121.440 121.440 121.226 0.214 18880
1159 1 3 . 1 1 51 51 ILE HA H 51 3.830 3.830 4.125 -0.295 18880
1160 1 3 . 1 1 51 51 ILE C C 51 178.300 178.300 177.385 0.915 18880
1161 1 3 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.451 0.389 18880
1162 1 3 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.884 -0.574 18880
1163 1 3 . 1 1 51 51 ILE H H 51 7.470 7.470 7.331 0.139 18880
1164 1 3 . 1 1 52 52 ILE N N 52 118.930 118.930 119.520 -0.590 18880
1165 1 3 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.824 -0.084 18880
1166 1 3 . 1 1 52 52 ILE CA C 52 63.760 63.760 62.848 0.912 18880
1167 1 3 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.895 1.135 18880
1168 1 3 . 1 1 52 52 ILE H H 52 7.790 7.790 8.426 -0.636 18880
1169 1 3 . 1 1 53 53 ARG N N 53 120.140 120.140 119.555 0.585 18880
1170 1 3 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.969 0.121 18880
1171 1 3 . 1 1 53 53 ARG C C 53 177.380 177.380 177.137 0.243 18880
1172 1 3 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.273 0.837 18880
1173 1 3 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.590 -1.010 18880
1174 1 3 . 1 1 53 53 ARG H H 53 7.930 7.930 8.381 -0.451 18880
1175 1 3 . 1 1 54 54 ASP N N 54 117.500 117.500 116.262 1.238 18880
1176 1 3 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.849 -0.249 18880
1177 1 3 . 1 1 54 54 ASP C C 54 176.930 176.930 176.411 0.519 18880
1178 1 3 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.313 1.227 18880
1179 1 3 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.406 -0.306 18880
1180 1 3 . 1 1 54 54 ASP H H 54 7.870 7.870 8.212 -0.342 18880
1181 1 3 . 1 1 55 55 GLY N N 55 106.370 106.370 108.313 -1.943 18880
1182 1 3 . 1 1 55 55 GLY C C 55 173.460 173.460 173.927 -0.467 18880
1183 1 3 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.400 0.600 18880
1184 1 3 . 1 1 55 55 GLY H H 55 7.880 7.880 7.557 0.323 18880
1185 1 3 . 1 1 56 56 LEU N N 56 122.630 122.630 122.000 0.630 18880
1186 1 3 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.817 -0.047 18880
1187 1 3 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.326 1.164 18880
1188 1 3 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.849 0.271 18880
1189 1 3 . 1 1 56 56 LEU H H 56 8.220 8.220 7.905 0.315 18880
1190 1 3 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.498 0.082 18880
1191 1 3 . 1 1 57 57 PRO C C 57 176.150 176.150 175.809 0.341 18880
1192 1 3 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.524 -0.104 18880
1193 1 3 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.002 0.738 18880
1194 1 3 . 1 1 58 58 MET N N 58 121.810 121.810 121.295 0.515 18880
1195 1 3 . 1 1 58 58 MET HA H 58 4.630 4.630 4.443 0.187 18880
1196 1 3 . 1 1 58 58 MET C C 58 176.150 176.150 175.571 0.579 18880
1197 1 3 . 1 1 58 58 MET CA C 58 55.560 55.560 55.440 0.120 18880
1198 1 3 . 1 1 58 58 MET CB C 58 36.820 36.820 34.196 2.624 18880
1199 1 3 . 1 1 58 58 MET H H 58 7.690 7.690 7.893 -0.203 18880
1200 1 3 . 1 1 59 59 THR N N 59 114.180 114.180 114.609 -0.429 18880
1201 1 3 . 1 1 59 59 THR HA H 59 4.450 4.450 4.425 0.025 18880
1202 1 3 . 1 1 59 59 THR C C 59 175.170 175.170 175.701 -0.531 18880
1203 1 3 . 1 1 59 59 THR CA C 59 60.780 60.780 60.745 0.035 18880
1204 1 3 . 1 1 59 59 THR CB C 59 71.060 71.060 69.617 1.443 18880
1205 1 3 . 1 1 59 59 THR H H 59 8.940 8.940 8.153 0.786 18880
1206 1 3 . 1 1 60 60 GLU N N 60 120.620 120.620 125.107 -4.487 18880
1207 1 3 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.681 0.329 18880
1208 1 3 . 1 1 60 60 GLU C C 60 179.010 179.010 178.151 0.859 18880
1209 1 3 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.734 0.086 18880
1210 1 3 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.539 0.511 18880
1211 1 3 . 1 1 60 60 GLU H H 60 8.850 8.850 8.912 -0.062 18880
1212 1 3 . 1 1 61 61 ALA N N 61 121.080 121.080 122.333 -1.253 18880
1213 1 3 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.891 0.249 18880
1214 1 3 . 1 1 61 61 ALA C C 61 180.350 180.350 179.886 0.464 18880
1215 1 3 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.178 -0.088 18880
1216 1 3 . 1 1 61 61 ALA CB C 61 18.210 18.210 18.000 0.210 18880
1217 1 3 . 1 1 61 61 ALA H H 61 8.370 8.370 8.346 0.024 18880
1218 1 3 . 1 1 62 62 GLU N N 62 118.890 118.890 118.756 0.134 18880
1219 1 3 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.514 0.486 18880
1220 1 3 . 1 1 62 62 GLU C C 62 179.690 179.690 178.523 1.167 18880
1221 1 3 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.375 0.615 18880
1222 1 3 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.370 1.940 18880
1223 1 3 . 1 1 62 62 GLU H H 62 7.680 7.680 7.744 -0.064 18880
1224 1 3 . 1 1 63 63 ILE N N 63 122.340 122.340 119.865 2.475 18880
1225 1 3 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.195 0.375 18880
1226 1 3 . 1 1 63 63 ILE C C 63 177.260 177.260 178.202 -0.942 18880
1227 1 3 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.641 1.249 18880
1228 1 3 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.867 1.113 18880
1229 1 3 . 1 1 63 63 ILE H H 63 8.420 8.420 7.583 0.837 18880
1230 1 3 . 1 1 64 64 THR N N 64 116.970 116.970 116.054 0.916 18880
1231 1 3 . 1 1 64 64 THR HA H 64 3.940 3.940 3.920 0.020 18880
1232 1 3 . 1 1 64 64 THR C C 64 176.520 176.520 176.618 -0.098 18880
1233 1 3 . 1 1 64 64 THR CA C 64 67.060 67.060 67.404 -0.344 18880
1234 1 3 . 1 1 64 64 THR CB C 64 68.750 68.750 68.208 0.542 18880
1235 1 3 . 1 1 64 64 THR H H 64 8.310 8.310 8.393 -0.083 18880
1236 1 3 . 1 1 65 65 GLU N N 65 120.760 120.760 120.144 0.616 18880
1237 1 3 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.197 -0.167 18880
1238 1 3 . 1 1 65 65 GLU C C 65 175.830 175.830 178.816 -2.986 18880
1239 1 3 . 1 1 65 65 GLU CA C 65 59.500 59.500 59.133 0.367 18880
1240 1 3 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.490 0.280 18880
1241 1 3 . 1 1 65 65 GLU H H 65 7.970 7.970 8.528 -0.558 18880
1242 1 3 . 1 1 66 66 PHE N N 66 120.940 120.940 118.186 2.754 18880
1243 1 3 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.431 -0.191 18880
1244 1 3 . 1 1 66 66 PHE C C 66 177.330 177.330 177.257 0.073 18880
1245 1 3 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.714 2.486 18880
1246 1 3 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.380 -0.850 18880
1247 1 3 . 1 1 66 66 PHE H H 66 8.100 8.100 7.800 0.300 18880
1248 1 3 . 1 1 67 67 PHE N N 67 118.110 118.110 119.021 -0.911 18880
1249 1 3 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.430 -0.480 18880
1250 1 3 . 1 1 67 67 PHE C C 67 178.090 178.090 177.862 0.228 18880
1251 1 3 . 1 1 67 67 PHE CA C 67 61.200 61.200 58.863 2.337 18880
1252 1 3 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.483 -0.233 18880
1253 1 3 . 1 1 67 67 PHE H H 67 8.380 8.380 8.720 -0.340 18880
1254 1 3 . 1 1 68 68 GLU N N 68 119.650 119.650 117.763 1.887 18880
1255 1 3 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.389 -0.379 18880
1256 1 3 . 1 1 68 68 GLU C C 68 177.910 177.910 177.001 0.909 18880
1257 1 3 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.855 1.385 18880
1258 1 3 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.924 -0.554 18880
1259 1 3 . 1 1 68 68 GLU H H 68 8.230 8.230 8.360 -0.130 18880
1260 1 3 . 1 1 69 69 ALA N N 69 119.090 119.090 120.458 -1.368 18880
1261 1 3 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.438 -0.258 18880
1262 1 3 . 1 1 69 69 ALA C C 69 179.030 179.030 178.302 0.728 18880
1263 1 3 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.575 0.025 18880
1264 1 3 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.595 0.185 18880
1265 1 3 . 1 1 69 69 ALA H H 69 7.340 7.340 7.661 -0.321 18880
1266 1 3 . 1 1 70 70 ALA N N 70 118.670 118.670 119.886 -1.216 18880
1267 1 3 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.303 -0.283 18880
1268 1 3 . 1 1 70 70 ALA C C 70 176.820 176.820 176.551 0.269 18880
1269 1 3 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.720 0.370 18880
1270 1 3 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.341 -0.731 18880
1271 1 3 . 1 1 70 70 ALA H H 70 8.050 8.050 7.698 0.352 18880
1272 1 3 . 1 1 71 71 ASP N N 71 116.780 116.780 118.496 -1.716 18880
1273 1 3 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.096 0.124 18880
1274 1 3 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.319 1.831 18880
1275 1 3 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.291 -1.381 18880
1276 1 3 . 1 1 71 71 ASP H H 71 8.010 8.010 7.586 0.424 18880
1277 1 3 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.398 0.072 18880
1278 1 3 . 1 1 72 72 PRO C C 72 177.970 177.970 177.345 0.625 18880
1279 1 3 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.281 0.629 18880
1280 1 3 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.569 -0.689 18880
1281 1 3 . 1 1 73 73 ASN N N 73 114.930 114.930 115.594 -0.664 18880
1282 1 3 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.714 0.166 18880
1283 1 3 . 1 1 73 73 ASN C C 73 174.880 174.880 175.034 -0.154 18880
1284 1 3 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.114 -0.274 18880
1285 1 3 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.651 -0.271 18880
1286 1 3 . 1 1 73 73 ASN H H 73 9.030 9.030 8.147 0.883 18880
1287 1 3 . 1 1 74 74 ASN N N 74 118.340 118.340 113.913 4.427 18880
1288 1 3 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.435 -0.075 18880
1289 1 3 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.093 0.497 18880
1290 1 3 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.343 0.817 18880
1291 1 3 . 1 1 74 74 ASN H H 74 8.320 8.320 8.172 0.148 18880
1292 1 3 . 1 1 75 75 THR N N 75 113.450 113.450 113.804 -0.354 18880
1293 1 3 . 1 1 75 75 THR HA H 75 4.210 4.210 4.445 -0.235 18880
1294 1 3 . 1 1 75 75 THR CA C 75 63.410 63.410 60.630 2.780 18880
1295 1 3 . 1 1 75 75 THR CB C 75 70.540 70.540 68.686 1.854 18880
1296 1 3 . 1 1 75 75 THR H H 75 9.870 9.870 8.471 1.399 18880
1297 1 3 . 1 1 76 76 GLY N N 76 111.810 111.810 109.095 2.715 18880
1298 1 3 . 1 1 76 76 GLY C C 76 173.670 173.670 173.833 -0.163 18880
1299 1 3 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.957 -0.837 18880
1300 1 3 . 1 1 76 76 GLY H H 76 10.250 10.250 8.308 1.942 18880
1301 1 3 . 1 1 77 77 PHE N N 77 120.560 120.560 119.198 1.362 18880
1302 1 3 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.080 0.070 18880
1303 1 3 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.196 0.984 18880
1304 1 3 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.909 1.591 18880
1305 1 3 . 1 1 77 77 PHE H H 77 8.110 8.110 8.522 -0.412 18880
1306 1 3 . 1 1 78 78 ILE N N 78 116.410 116.410 125.035 -8.625 18880
1307 1 3 . 1 1 78 78 ILE HA H 78 4.390 4.390 3.905 0.485 18880
1308 1 3 . 1 1 78 78 ILE C C 78 174.770 174.770 174.230 0.540 18880
1309 1 3 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.387 -0.197 18880
1310 1 3 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.261 0.919 18880
1311 1 3 . 1 1 78 78 ILE H H 78 8.930 8.930 7.730 1.200 18880
1312 1 3 . 1 1 79 79 ASP N N 79 125.220 125.220 125.995 -0.775 18880
1313 1 3 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.897 -0.397 18880
1314 1 3 . 1 1 79 79 ASP C C 79 176.490 176.490 177.130 -0.640 18880
1315 1 3 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.262 0.048 18880
1316 1 3 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.297 1.073 18880
1317 1 3 . 1 1 79 79 ASP H H 79 8.610 8.610 8.542 0.068 18880
1318 1 3 . 1 1 80 80 TYR N N 80 125.760 125.760 128.274 -2.514 18880
1319 1 3 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.044 -0.054 18880
1320 1 3 . 1 1 80 80 TYR C C 80 177.140 177.140 176.675 0.465 18880
1321 1 3 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.159 -0.579 18880
1322 1 3 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.499 0.391 18880
1323 1 3 . 1 1 80 80 TYR H H 80 8.460 8.460 8.337 0.123 18880
1324 1 3 . 1 1 81 81 LYS N N 81 118.320 118.320 118.767 -0.447 18880
1325 1 3 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.761 0.139 18880
1326 1 3 . 1 1 81 81 LYS C C 81 179.090 179.090 178.439 0.651 18880
1327 1 3 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.556 0.024 18880
1328 1 3 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.762 -0.002 18880
1329 1 3 . 1 1 81 81 LYS H H 81 8.410 8.410 8.356 0.054 18880
1330 1 3 . 1 1 82 82 ALA N N 82 122.050 122.050 121.785 0.265 18880
1331 1 3 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.141 -0.011 18880
1332 1 3 . 1 1 82 82 ALA C C 82 179.740 179.740 179.563 0.177 18880
1333 1 3 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.757 -0.236 18880
1334 1 3 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.321 0.219 18880
1335 1 3 . 1 1 82 82 ALA H H 82 7.770 7.770 7.883 -0.113 18880
1336 1 3 . 1 1 83 83 PHE N N 83 117.810 117.810 117.048 0.762 18880
1337 1 3 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.469 -0.179 18880
1338 1 3 . 1 1 83 83 PHE C C 83 176.460 176.460 176.624 -0.164 18880
1339 1 3 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.733 0.296 18880
1340 1 3 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.891 -0.371 18880
1341 1 3 . 1 1 83 83 PHE H H 83 7.780 7.780 7.912 -0.132 18880
1342 1 3 . 1 1 84 84 ALA N N 84 121.530 121.530 121.951 -0.421 18880
1343 1 3 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.167 -0.507 18880
1344 1 3 . 1 1 84 84 ALA C C 84 179.010 179.010 178.929 0.081 18880
1345 1 3 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.964 1.066 18880
1346 1 3 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.130 0.000 18880
1347 1 3 . 1 1 84 84 ALA H H 84 8.290 8.290 8.282 0.008 18880
1348 1 3 . 1 1 85 85 ALA N N 85 117.720 117.720 120.042 -2.322 18880
1349 1 3 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.224 -0.144 18880
1350 1 3 . 1 1 85 85 ALA C C 85 179.570 179.570 178.284 1.286 18880
1351 1 3 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.329 0.041 18880
1352 1 3 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.337 -0.047 18880
1353 1 3 . 1 1 85 85 ALA H H 85 7.700 7.700 8.476 -0.776 18880
1354 1 3 . 1 1 86 86 MET N N 86 116.570 116.570 115.011 1.559 18880
1355 1 3 . 1 1 86 86 MET HA H 86 4.160 4.160 4.124 0.036 18880
1356 1 3 . 1 1 86 86 MET C C 86 177.360 177.360 178.350 -0.990 18880
1357 1 3 . 1 1 86 86 MET CA C 86 57.380 57.380 58.327 -0.946 18880
1358 1 3 . 1 1 86 86 MET CB C 86 32.720 32.720 32.506 0.214 18880
1359 1 3 . 1 1 86 86 MET H H 86 7.560 7.560 7.349 0.211 18880
1360 1 3 . 1 1 87 87 LEU N N 87 119.090 119.090 117.409 1.681 18880
1361 1 3 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.182 -0.212 18880
1362 1 3 . 1 1 87 87 LEU C C 87 177.420 177.420 177.226 0.194 18880
1363 1 3 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.756 0.534 18880
1364 1 3 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.806 0.474 18880
1365 1 3 . 1 1 87 87 LEU H H 87 7.570 7.570 7.553 0.017 18880
1366 1 3 . 1 1 88 88 TYR N N 88 117.060 117.060 115.983 1.077 18880
1367 1 3 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.655 -0.065 18880
1368 1 3 . 1 1 88 88 TYR C C 88 175.870 175.870 174.724 1.146 18880
1369 1 3 . 1 1 88 88 TYR CA C 88 57.840 57.840 56.214 1.626 18880
1370 1 3 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.543 0.097 18880
1371 1 3 . 1 1 88 88 TYR H H 88 7.740 7.740 7.418 0.322 18880
1372 1 3 . 1 1 89 89 SER N N 89 115.980 115.980 118.098 -2.118 18880
1373 1 3 . 1 1 89 89 SER HA H 89 4.440 4.440 4.436 0.004 18880
1374 1 3 . 1 1 89 89 SER C C 89 174.460 174.460 174.657 -0.197 18880
1375 1 3 . 1 1 89 89 SER CA C 89 58.350 58.350 59.858 -1.508 18880
1376 1 3 . 1 1 89 89 SER CB C 89 63.990 63.990 62.879 1.111 18880
1377 1 3 . 1 1 89 89 SER H H 89 7.880 7.880 7.715 0.165 18880
1378 1 3 . 1 1 90 90 VAL N N 90 120.910 120.910 125.047 -4.137 18880
1379 1 3 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.366 -0.226 18880
1380 1 3 . 1 1 90 90 VAL C C 90 175.720 175.720 173.977 1.743 18880
1381 1 3 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.528 -0.258 18880
1382 1 3 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.714 0.126 18880
1383 1 3 . 1 1 90 90 VAL H H 90 8.020 8.020 8.296 -0.276 18880
1384 1 3 . 1 1 91 91 ASP N N 91 123.620 123.620 121.013 2.607 18880
1385 1 3 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.787 -0.157 18880
1386 1 3 . 1 1 91 91 ASP C C 91 176.000 176.000 175.389 0.611 18880
1387 1 3 . 1 1 91 91 ASP CA C 91 54.510 54.510 53.952 0.558 18880
1388 1 3 . 1 1 91 91 ASP CB C 91 41.440 41.440 42.818 -1.378 18880
1389 1 3 . 1 1 91 91 ASP H H 91 8.310 8.310 7.803 0.507 18880
1390 1 3 . 1 1 92 92 GLU N N 92 122.170 122.170 120.049 2.121 18880
1391 1 3 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.471 -0.111 18880
1392 1 3 . 1 1 92 92 GLU C C 92 175.660 175.660 176.136 -0.476 18880
1393 1 3 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.352 0.138 18880
1394 1 3 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.794 3.056 18880
1395 1 3 . 1 1 92 92 GLU H H 92 8.320 8.320 8.567 -0.247 18880
1396 1 4 . 1 1 10 10 HIS C C 10 176.040 176.040 174.523 1.517 18880
1397 1 4 . 1 1 11 11 SER N N 11 116.840 116.840 114.771 2.069 18880
1398 1 4 . 1 1 11 11 SER HA H 11 4.430 4.430 4.664 -0.234 18880
1399 1 4 . 1 1 11 11 SER C C 11 174.630 174.630 173.800 0.830 18880
1400 1 4 . 1 1 11 11 SER CA C 11 58.350 58.350 58.019 0.331 18880
1401 1 4 . 1 1 11 11 SER CB C 11 64.120 64.120 64.023 0.097 18880
1402 1 4 . 1 1 11 11 SER H H 11 8.360 8.360 8.352 0.008 18880
1403 1 4 . 1 1 12 12 SER N N 12 118.030 118.030 115.731 2.299 18880
1404 1 4 . 1 1 12 12 SER HA H 12 4.440 4.440 4.171 0.269 18880
1405 1 4 . 1 1 12 12 SER C C 12 174.880 174.880 175.008 -0.128 18880
1406 1 4 . 1 1 12 12 SER CA C 12 58.680 58.680 59.762 -1.082 18880
1407 1 4 . 1 1 12 12 SER CB C 12 63.890 63.890 63.487 0.403 18880
1408 1 4 . 1 1 12 12 SER H H 12 8.490 8.490 8.492 -0.002 18880
1409 1 4 . 1 1 13 13 GLY N N 13 110.450 110.450 107.596 2.854 18880
1410 1 4 . 1 1 13 13 GLY C C 13 173.790 173.790 174.798 -1.008 18880
1411 1 4 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.937 0.523 18880
1412 1 4 . 1 1 13 13 GLY H H 13 8.390 8.390 8.379 0.011 18880
1413 1 4 . 1 1 14 14 LEU N N 14 121.310 121.310 122.109 -0.799 18880
1414 1 4 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.331 0.009 18880
1415 1 4 . 1 1 14 14 LEU C C 14 176.930 176.930 176.656 0.274 18880
1416 1 4 . 1 1 14 14 LEU CA C 14 55.200 55.200 56.606 -1.406 18880
1417 1 4 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.177 0.423 18880
1418 1 4 . 1 1 14 14 LEU H H 14 8.020 8.020 8.256 -0.236 18880
1419 1 4 . 1 1 15 15 VAL N N 15 121.550 121.550 112.519 9.031 18880
1420 1 4 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.508 -0.138 18880
1421 1 4 . 1 1 15 15 VAL CA C 15 59.720 59.720 59.187 0.533 18880
1422 1 4 . 1 1 15 15 VAL CB C 15 32.770 32.770 30.843 1.927 18880
1423 1 4 . 1 1 15 15 VAL H H 15 8.030 8.030 7.643 0.387 18880
1424 1 4 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.354 0.016 18880
1425 1 4 . 1 1 16 16 PRO C C 16 176.720 176.720 177.403 -0.683 18880
1426 1 4 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.469 -1.819 18880
1427 1 4 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.284 -0.044 18880
1428 1 4 . 1 1 17 17 ARG N N 17 121.890 121.890 116.877 5.013 18880
1429 1 4 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.288 -0.008 18880
1430 1 4 . 1 1 17 17 ARG C C 17 176.940 176.940 175.335 1.605 18880
1431 1 4 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.044 0.316 18880
1432 1 4 . 1 1 17 17 ARG CB C 17 31.050 31.050 29.865 1.185 18880
1433 1 4 . 1 1 17 17 ARG H H 17 8.450 8.450 8.022 0.428 18880
1434 1 4 . 1 1 18 18 GLY N N 18 110.160 110.160 109.502 0.658 18880
1435 1 4 . 1 1 18 18 GLY C C 18 174.110 174.110 173.537 0.573 18880
1436 1 4 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.264 0.126 18880
1437 1 4 . 1 1 18 18 GLY H H 18 8.480 8.480 8.103 0.377 18880
1438 1 4 . 1 1 19 19 SER N N 19 115.500 115.500 114.238 1.262 18880
1439 1 4 . 1 1 19 19 SER HA H 19 4.400 4.400 4.482 -0.082 18880
1440 1 4 . 1 1 19 19 SER C C 19 174.380 174.380 174.495 -0.115 18880
1441 1 4 . 1 1 19 19 SER CA C 19 58.610 58.610 57.949 0.661 18880
1442 1 4 . 1 1 19 19 SER CB C 19 63.830 63.830 64.002 -0.172 18880
1443 1 4 . 1 1 19 19 SER H H 19 8.210 8.210 8.033 0.177 18880
1444 1 4 . 1 1 20 20 HIS N N 20 120.770 120.770 126.362 -5.592 18880
1445 1 4 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.797 -0.187 18880
1446 1 4 . 1 1 20 20 HIS C C 20 174.870 174.870 174.914 -0.044 18880
1447 1 4 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.910 0.220 18880
1448 1 4 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.185 -0.475 18880
1449 1 4 . 1 1 20 20 HIS H H 20 8.590 8.590 8.851 -0.261 18880
1450 1 4 . 1 1 21 21 MET N N 21 121.440 121.440 118.103 3.337 18880
1451 1 4 . 1 1 21 21 MET HA H 21 4.470 4.470 4.909 -0.439 18880
1452 1 4 . 1 1 21 21 MET C C 21 176.030 176.030 175.972 0.058 18880
1453 1 4 . 1 1 21 21 MET CA C 21 55.490 55.490 55.856 -0.366 18880
1454 1 4 . 1 1 21 21 MET CB C 21 33.170 33.170 33.934 -0.764 18880
1455 1 4 . 1 1 21 21 MET H H 21 8.310 8.310 7.578 0.732 18880
1456 1 4 . 1 1 22 22 SER N N 22 116.860 116.860 116.049 0.811 18880
1457 1 4 . 1 1 22 22 SER HA H 22 4.430 4.430 4.566 -0.136 18880
1458 1 4 . 1 1 22 22 SER C C 22 174.630 174.630 175.303 -0.673 18880
1459 1 4 . 1 1 22 22 SER CA C 22 58.410 58.410 58.894 -0.484 18880
1460 1 4 . 1 1 22 22 SER CB C 22 64.030 64.030 63.843 0.187 18880
1461 1 4 . 1 1 22 22 SER H H 22 8.340 8.340 8.264 0.076 18880
1462 1 4 . 1 1 23 23 ASP N N 23 122.660 122.660 123.632 -0.972 18880
1463 1 4 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.534 0.016 18880
1464 1 4 . 1 1 23 23 ASP C C 23 176.860 176.860 177.615 -0.755 18880
1465 1 4 . 1 1 23 23 ASP CA C 23 55.330 55.330 56.291 -0.961 18880
1466 1 4 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.318 0.682 18880
1467 1 4 . 1 1 23 23 ASP H H 23 8.540 8.540 8.472 0.068 18880
1468 1 4 . 1 1 24 24 GLU N N 24 120.400 120.400 119.328 1.072 18880
1469 1 4 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.099 0.041 18880
1470 1 4 . 1 1 24 24 GLU C C 24 177.540 177.540 177.400 0.140 18880
1471 1 4 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.505 -0.145 18880
1472 1 4 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.265 0.485 18880
1473 1 4 . 1 1 24 24 GLU H H 24 8.610 8.610 8.145 0.465 18880
1474 1 4 . 1 1 25 25 LYS N N 25 120.390 120.390 119.669 0.721 18880
1475 1 4 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.234 -0.044 18880
1476 1 4 . 1 1 25 25 LYS C C 25 177.490 177.490 178.130 -0.640 18880
1477 1 4 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.287 -0.177 18880
1478 1 4 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.885 -0.395 18880
1479 1 4 . 1 1 25 25 LYS H H 25 8.210 8.210 7.758 0.452 18880
1480 1 4 . 1 1 26 26 THR N N 26 114.880 114.880 116.364 -1.484 18880
1481 1 4 . 1 1 26 26 THR HA H 26 4.040 4.040 4.067 -0.027 18880
1482 1 4 . 1 1 26 26 THR C C 26 175.430 175.430 177.220 -1.790 18880
1483 1 4 . 1 1 26 26 THR CA C 26 64.620 64.620 66.032 -1.413 18880
1484 1 4 . 1 1 26 26 THR CB C 26 69.110 69.110 68.282 0.828 18880
1485 1 4 . 1 1 26 26 THR H H 26 8.080 8.080 7.964 0.116 18880
1486 1 4 . 1 1 27 27 GLN N N 27 120.940 120.940 121.026 -0.086 18880
1487 1 4 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.104 0.086 18880
1488 1 4 . 1 1 27 27 GLN C C 27 177.280 177.280 177.591 -0.311 18880
1489 1 4 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.561 -1.011 18880
1490 1 4 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.455 0.635 18880
1491 1 4 . 1 1 27 27 GLN H H 27 8.240 8.240 7.904 0.336 18880
1492 1 4 . 1 1 28 28 LEU N N 28 121.860 121.860 119.265 2.595 18880
1493 1 4 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.428 -0.258 18880
1494 1 4 . 1 1 28 28 LEU C C 28 177.750 177.750 177.492 0.258 18880
1495 1 4 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.362 1.718 18880
1496 1 4 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.169 0.101 18880
1497 1 4 . 1 1 28 28 LEU H H 28 7.950 7.950 8.236 -0.286 18880
1498 1 4 . 1 1 29 29 ILE N N 29 119.260 119.260 119.347 -0.087 18880
1499 1 4 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.129 -0.229 18880
1500 1 4 . 1 1 29 29 ILE C C 29 177.140 177.140 177.374 -0.234 18880
1501 1 4 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.723 -0.423 18880
1502 1 4 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.966 1.314 18880
1503 1 4 . 1 1 29 29 ILE H H 29 7.950 7.950 7.698 0.252 18880
1504 1 4 . 1 1 30 30 GLU N N 30 120.500 120.500 117.883 2.617 18880
1505 1 4 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.264 -0.214 18880
1506 1 4 . 1 1 30 30 GLU C C 30 177.560 177.560 176.415 1.145 18880
1507 1 4 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.622 0.468 18880
1508 1 4 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.117 0.473 18880
1509 1 4 . 1 1 30 30 GLU H H 30 8.220 8.220 7.970 0.250 18880
1510 1 4 . 1 1 31 31 ALA N N 31 121.550 121.550 120.513 1.037 18880
1511 1 4 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.393 -0.243 18880
1512 1 4 . 1 1 31 31 ALA C C 31 178.550 178.550 179.331 -0.781 18880
1513 1 4 . 1 1 31 31 ALA CA C 31 53.800 53.800 54.374 -0.574 18880
1514 1 4 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.393 -0.763 18880
1515 1 4 . 1 1 31 31 ALA H H 31 7.890 7.890 7.534 0.356 18880
1516 1 4 . 1 1 32 32 PHE N N 32 117.240 117.240 117.237 0.003 18880
1517 1 4 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.330 -0.030 18880
1518 1 4 . 1 1 32 32 PHE C C 32 176.210 176.210 176.821 -0.611 18880
1519 1 4 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.774 -1.434 18880
1520 1 4 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.640 1.110 18880
1521 1 4 . 1 1 32 32 PHE H H 32 7.930 7.930 7.587 0.343 18880
1522 1 4 . 1 1 33 33 TYR N N 33 119.050 119.050 115.704 3.346 18880
1523 1 4 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.612 -0.282 18880
1524 1 4 . 1 1 33 33 TYR C C 33 175.680 175.680 175.574 0.106 18880
1525 1 4 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.081 0.838 18880
1526 1 4 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.128 1.412 18880
1527 1 4 . 1 1 33 33 TYR H H 33 7.950 7.950 8.096 -0.146 18880
1528 1 4 . 1 1 34 34 ASN N N 34 118.390 118.390 118.696 -0.306 18880
1529 1 4 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.881 -0.251 18880
1530 1 4 . 1 1 34 34 ASN C C 34 174.810 174.810 173.838 0.972 18880
1531 1 4 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.866 -0.716 18880
1532 1 4 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.889 -0.909 18880
1533 1 4 . 1 1 34 34 ASN H H 34 7.960 7.960 7.971 -0.011 18880
1534 1 4 . 1 1 35 35 PHE N N 35 120.670 120.670 121.295 -0.625 18880
1535 1 4 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.530 -0.080 18880
1536 1 4 . 1 1 35 35 PHE C C 35 175.310 175.310 173.747 1.563 18880
1537 1 4 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.057 0.263 18880
1538 1 4 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.643 -0.223 18880
1539 1 4 . 1 1 35 35 PHE H H 35 7.830 7.830 8.102 -0.272 18880
1540 1 4 . 1 1 36 36 ASP N N 36 122.400 122.400 121.459 0.941 18880
1541 1 4 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.362 0.228 18880
1542 1 4 . 1 1 36 36 ASP C C 36 176.150 176.150 177.012 -0.862 18880
1543 1 4 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.775 -0.705 18880
1544 1 4 . 1 1 36 36 ASP CB C 36 41.320 41.320 39.422 1.898 18880
1545 1 4 . 1 1 36 36 ASP H H 36 8.180 8.180 8.654 -0.474 18880
1546 1 4 . 1 1 37 37 GLY N N 37 108.560 108.560 107.551 1.009 18880
1547 1 4 . 1 1 37 37 GLY C C 37 173.660 173.660 174.001 -0.341 18880
1548 1 4 . 1 1 37 37 GLY CA C 37 45.610 45.610 46.590 -0.980 18880
1549 1 4 . 1 1 37 37 GLY H H 37 7.680 7.680 8.761 -1.081 18880
1550 1 4 . 1 1 38 38 ASP N N 38 120.010 120.010 114.873 5.137 18880
1551 1 4 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.648 -0.048 18880
1552 1 4 . 1 1 38 38 ASP CA C 38 54.260 54.260 53.361 0.899 18880
1553 1 4 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.995 1.455 18880
1554 1 4 . 1 1 38 38 ASP H H 38 8.220 8.220 8.019 0.201 18880
1555 1 4 . 1 1 39 39 TYR N N 39 121.030 121.030 120.347 0.683 18880
1556 1 4 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.441 -0.052 18880
1557 1 4 . 1 1 39 39 TYR C C 39 175.290 175.290 173.112 2.178 18880
1558 1 4 . 1 1 39 39 TYR CA C 39 58.200 58.200 57.955 0.245 18880
1559 1 4 . 1 1 39 39 TYR CB C 39 39.170 39.170 40.304 -1.134 18880
1560 1 4 . 1 1 39 39 TYR H H 39 8.090 8.090 7.622 0.468 18880
1561 1 4 . 1 1 40 40 ASP N N 40 122.020 122.020 120.745 1.275 18880
1562 1 4 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.504 0.096 18880
1563 1 4 . 1 1 40 40 ASP C C 40 175.970 175.970 174.545 1.425 18880
1564 1 4 . 1 1 40 40 ASP CA C 40 54.220 54.220 52.204 2.016 18880
1565 1 4 . 1 1 40 40 ASP CB C 40 41.520 41.520 42.384 -0.864 18880
1566 1 4 . 1 1 40 40 ASP H H 40 8.200 8.200 7.848 0.352 18880
1567 1 4 . 1 1 41 41 GLY N N 41 108.330 108.330 105.598 2.732 18880
1568 1 4 . 1 1 41 41 GLY C C 41 173.000 173.000 172.427 0.573 18880
1569 1 4 . 1 1 41 41 GLY CA C 41 45.420 45.420 45.308 0.112 18880
1570 1 4 . 1 1 41 41 GLY H H 41 7.830 7.830 7.724 0.106 18880
1571 1 4 . 1 1 42 42 PHE N N 42 118.600 118.600 120.040 -1.440 18880
1572 1 4 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.924 0.336 18880
1573 1 4 . 1 1 42 42 PHE C C 42 175.660 175.660 173.994 1.666 18880
1574 1 4 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.770 -0.610 18880
1575 1 4 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.406 -1.236 18880
1576 1 4 . 1 1 42 42 PHE H H 42 8.150 8.150 7.658 0.492 18880
1577 1 4 . 1 1 43 43 VAL N N 43 119.180 119.180 125.097 -5.917 18880
1578 1 4 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.561 0.109 18880
1579 1 4 . 1 1 43 43 VAL C C 43 175.110 175.110 174.232 0.878 18880
1580 1 4 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.648 -0.028 18880
1581 1 4 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.940 -2.060 18880
1582 1 4 . 1 1 43 43 VAL H H 43 9.070 9.070 8.632 0.438 18880
1583 1 4 . 1 1 44 44 SER N N 44 121.380 121.380 122.941 -1.561 18880
1584 1 4 . 1 1 44 44 SER HA H 44 4.570 4.570 4.836 -0.266 18880
1585 1 4 . 1 1 44 44 SER C C 44 175.660 175.660 175.613 0.047 18880
1586 1 4 . 1 1 44 44 SER CA C 44 57.720 57.720 57.625 0.095 18880
1587 1 4 . 1 1 44 44 SER CB C 44 63.690 63.690 64.582 -0.892 18880
1588 1 4 . 1 1 44 44 SER H H 44 9.140 9.140 8.678 0.462 18880
1589 1 4 . 1 1 45 45 VAL N N 45 122.720 122.720 125.029 -2.309 18880
1590 1 4 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.181 0.319 18880
1591 1 4 . 1 1 45 45 VAL C C 45 177.240 177.240 177.145 0.095 18880
1592 1 4 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.944 -0.674 18880
1593 1 4 . 1 1 45 45 VAL CB C 45 31.450 31.450 31.018 0.432 18880
1594 1 4 . 1 1 45 45 VAL H H 45 8.140 8.140 8.511 -0.371 18880
1595 1 4 . 1 1 46 46 GLU N N 46 118.990 118.990 117.173 1.817 18880
1596 1 4 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.770 0.210 18880
1597 1 4 . 1 1 46 46 GLU C C 46 179.460 179.460 179.085 0.375 18880
1598 1 4 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.251 0.309 18880
1599 1 4 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.883 0.277 18880
1600 1 4 . 1 1 46 46 GLU H H 46 8.230 8.230 7.659 0.571 18880
1601 1 4 . 1 1 47 47 GLU N N 47 120.120 120.120 118.677 1.443 18880
1602 1 4 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.198 -0.118 18880
1603 1 4 . 1 1 47 47 GLU C C 47 179.170 179.170 178.766 0.404 18880
1604 1 4 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.907 0.983 18880
1605 1 4 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.876 -0.056 18880
1606 1 4 . 1 1 47 47 GLU H H 47 7.880 7.880 7.589 0.291 18880
1607 1 4 . 1 1 48 48 PHE N N 48 120.830 120.830 121.032 -0.202 18880
1608 1 4 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.157 0.033 18880
1609 1 4 . 1 1 48 48 PHE C C 48 176.920 176.920 177.525 -0.605 18880
1610 1 4 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.102 0.768 18880
1611 1 4 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.970 0.290 18880
1612 1 4 . 1 1 48 48 PHE H H 48 8.600 8.600 8.233 0.367 18880
1613 1 4 . 1 1 49 49 ARG N N 49 118.470 118.470 119.027 -0.557 18880
1614 1 4 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.037 -0.177 18880
1615 1 4 . 1 1 49 49 ARG C C 49 178.090 178.090 178.630 -0.540 18880
1616 1 4 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.180 -0.110 18880
1617 1 4 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.764 0.376 18880
1618 1 4 . 1 1 49 49 ARG H H 49 8.650 8.650 8.859 -0.209 18880
1619 1 4 . 1 1 50 50 GLY N N 50 105.080 105.080 105.393 -0.313 18880
1620 1 4 . 1 1 50 50 GLY C C 50 175.090 175.090 175.786 -0.696 18880
1621 1 4 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.816 -0.135 18880
1622 1 4 . 1 1 50 50 GLY H H 50 7.620 7.620 8.030 -0.410 18880
1623 1 4 . 1 1 51 51 ILE N N 51 121.440 121.440 121.747 -0.307 18880
1624 1 4 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.950 -0.120 18880
1625 1 4 . 1 1 51 51 ILE C C 51 178.300 178.300 177.382 0.918 18880
1626 1 4 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.128 -0.288 18880
1627 1 4 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.399 -0.089 18880
1628 1 4 . 1 1 51 51 ILE H H 51 7.470 7.470 7.372 0.098 18880
1629 1 4 . 1 1 52 52 ILE N N 52 118.930 118.930 119.698 -0.768 18880
1630 1 4 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.794 -0.054 18880
1631 1 4 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.059 0.701 18880
1632 1 4 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.411 1.619 18880
1633 1 4 . 1 1 52 52 ILE H H 52 7.790 7.790 8.454 -0.664 18880
1634 1 4 . 1 1 53 53 ARG N N 53 120.140 120.140 118.312 1.828 18880
1635 1 4 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.051 0.039 18880
1636 1 4 . 1 1 53 53 ARG C C 53 177.380 177.380 177.418 -0.038 18880
1637 1 4 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.142 0.968 18880
1638 1 4 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.244 -0.664 18880
1639 1 4 . 1 1 53 53 ARG H H 53 7.930 7.930 8.277 -0.347 18880
1640 1 4 . 1 1 54 54 ASP N N 54 117.500 117.500 116.286 1.214 18880
1641 1 4 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.775 -0.175 18880
1642 1 4 . 1 1 54 54 ASP C C 54 176.930 176.930 176.498 0.432 18880
1643 1 4 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.916 1.624 18880
1644 1 4 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.529 -0.429 18880
1645 1 4 . 1 1 54 54 ASP H H 54 7.870 7.870 7.953 -0.083 18880
1646 1 4 . 1 1 55 55 GLY N N 55 106.370 106.370 107.827 -1.457 18880
1647 1 4 . 1 1 55 55 GLY C C 55 173.460 173.460 173.850 -0.390 18880
1648 1 4 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.538 0.463 18880
1649 1 4 . 1 1 55 55 GLY H H 55 7.880 7.880 7.688 0.192 18880
1650 1 4 . 1 1 56 56 LEU N N 56 122.630 122.630 121.832 0.798 18880
1651 1 4 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.814 -0.044 18880
1652 1 4 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.257 1.234 18880
1653 1 4 . 1 1 56 56 LEU CB C 56 43.120 43.120 43.017 0.103 18880
1654 1 4 . 1 1 56 56 LEU H H 56 8.220 8.220 7.801 0.419 18880
1655 1 4 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.427 0.153 18880
1656 1 4 . 1 1 57 57 PRO C C 57 176.150 176.150 175.449 0.701 18880
1657 1 4 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.092 -0.672 18880
1658 1 4 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.024 -0.284 18880
1659 1 4 . 1 1 58 58 MET N N 58 121.810 121.810 123.546 -1.736 18880
1660 1 4 . 1 1 58 58 MET HA H 58 4.630 4.630 4.599 0.031 18880
1661 1 4 . 1 1 58 58 MET C C 58 176.150 176.150 174.808 1.342 18880
1662 1 4 . 1 1 58 58 MET CA C 58 55.560 55.560 54.501 1.059 18880
1663 1 4 . 1 1 58 58 MET CB C 58 36.820 36.820 36.368 0.452 18880
1664 1 4 . 1 1 58 58 MET H H 58 7.690 7.690 7.790 -0.100 18880
1665 1 4 . 1 1 59 59 THR N N 59 114.180 114.180 115.313 -1.133 18880
1666 1 4 . 1 1 59 59 THR HA H 59 4.450 4.450 4.584 -0.134 18880
1667 1 4 . 1 1 59 59 THR C C 59 175.170 175.170 175.514 -0.344 18880
1668 1 4 . 1 1 59 59 THR CA C 59 60.780 60.780 60.523 0.257 18880
1669 1 4 . 1 1 59 59 THR CB C 59 71.060 71.060 70.489 0.571 18880
1670 1 4 . 1 1 59 59 THR H H 59 8.940 8.940 8.245 0.695 18880
1671 1 4 . 1 1 60 60 GLU N N 60 120.620 120.620 126.427 -5.807 18880
1672 1 4 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.811 0.199 18880
1673 1 4 . 1 1 60 60 GLU C C 60 179.010 179.010 178.220 0.790 18880
1674 1 4 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.582 0.238 18880
1675 1 4 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.587 0.463 18880
1676 1 4 . 1 1 60 60 GLU H H 60 8.850 8.850 9.016 -0.166 18880
1677 1 4 . 1 1 61 61 ALA N N 61 121.080 121.080 121.978 -0.898 18880
1678 1 4 . 1 1 61 61 ALA HA H 61 4.140 4.140 4.073 0.067 18880
1679 1 4 . 1 1 61 61 ALA C C 61 180.350 180.350 179.008 1.342 18880
1680 1 4 . 1 1 61 61 ALA CA C 61 55.090 55.090 54.315 0.775 18880
1681 1 4 . 1 1 61 61 ALA CB C 61 18.210 18.210 18.137 0.073 18880
1682 1 4 . 1 1 61 61 ALA H H 61 8.370 8.370 8.448 -0.078 18880
1683 1 4 . 1 1 62 62 GLU N N 62 118.890 118.890 118.857 0.033 18880
1684 1 4 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.898 0.102 18880
1685 1 4 . 1 1 62 62 GLU C C 62 179.690 179.690 177.528 2.162 18880
1686 1 4 . 1 1 62 62 GLU CA C 62 58.990 58.990 57.396 1.594 18880
1687 1 4 . 1 1 62 62 GLU CB C 62 30.310 30.310 29.913 0.397 18880
1688 1 4 . 1 1 62 62 GLU H H 62 7.680 7.680 7.892 -0.212 18880
1689 1 4 . 1 1 63 63 ILE N N 63 122.340 122.340 118.190 4.150 18880
1690 1 4 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.474 0.096 18880
1691 1 4 . 1 1 63 63 ILE C C 63 177.260 177.260 177.882 -0.622 18880
1692 1 4 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.045 1.845 18880
1693 1 4 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.830 0.150 18880
1694 1 4 . 1 1 63 63 ILE H H 63 8.420 8.420 8.027 0.393 18880
1695 1 4 . 1 1 64 64 THR N N 64 116.970 116.970 117.020 -0.050 18880
1696 1 4 . 1 1 64 64 THR HA H 64 3.940 3.940 4.170 -0.230 18880
1697 1 4 . 1 1 64 64 THR C C 64 176.520 176.520 176.660 -0.140 18880
1698 1 4 . 1 1 64 64 THR CA C 64 67.060 67.060 67.950 -0.890 18880
1699 1 4 . 1 1 64 64 THR CB C 64 68.750 68.750 68.423 0.327 18880
1700 1 4 . 1 1 64 64 THR H H 64 8.310 8.310 8.572 -0.262 18880
1701 1 4 . 1 1 65 65 GLU N N 65 120.760 120.760 120.916 -0.156 18880
1702 1 4 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.220 -0.190 18880
1703 1 4 . 1 1 65 65 GLU C C 65 175.830 175.830 178.241 -2.411 18880
1704 1 4 . 1 1 65 65 GLU CA C 65 59.500 59.500 59.169 0.331 18880
1705 1 4 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.439 0.331 18880
1706 1 4 . 1 1 65 65 GLU H H 65 7.970 7.970 7.693 0.277 18880
1707 1 4 . 1 1 66 66 PHE N N 66 120.940 120.940 116.757 4.183 18880
1708 1 4 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.518 -0.278 18880
1709 1 4 . 1 1 66 66 PHE C C 66 177.330 177.330 176.974 0.356 18880
1710 1 4 . 1 1 66 66 PHE CA C 66 61.200 61.200 59.270 1.931 18880
1711 1 4 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.129 -0.599 18880
1712 1 4 . 1 1 66 66 PHE H H 66 8.100 8.100 8.032 0.068 18880
1713 1 4 . 1 1 67 67 PHE N N 67 118.110 118.110 119.484 -1.374 18880
1714 1 4 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.368 -0.418 18880
1715 1 4 . 1 1 67 67 PHE C C 67 178.090 178.090 177.743 0.347 18880
1716 1 4 . 1 1 67 67 PHE CA C 67 61.200 61.200 60.327 0.873 18880
1717 1 4 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.820 -0.570 18880
1718 1 4 . 1 1 67 67 PHE H H 67 8.380 8.380 8.530 -0.150 18880
1719 1 4 . 1 1 68 68 GLU N N 68 119.650 119.650 117.730 1.920 18880
1720 1 4 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.330 -0.320 18880
1721 1 4 . 1 1 68 68 GLU C C 68 177.910 177.910 177.006 0.904 18880
1722 1 4 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.310 0.930 18880
1723 1 4 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.867 -0.497 18880
1724 1 4 . 1 1 68 68 GLU H H 68 8.230 8.230 8.014 0.216 18880
1725 1 4 . 1 1 69 69 ALA N N 69 119.090 119.090 120.872 -1.782 18880
1726 1 4 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.247 -0.067 18880
1727 1 4 . 1 1 69 69 ALA C C 69 179.030 179.030 178.242 0.788 18880
1728 1 4 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.839 -0.239 18880
1729 1 4 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.563 0.217 18880
1730 1 4 . 1 1 69 69 ALA H H 69 7.340 7.340 7.883 -0.543 18880
1731 1 4 . 1 1 70 70 ALA N N 70 118.670 118.670 119.200 -0.530 18880
1732 1 4 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.353 -0.333 18880
1733 1 4 . 1 1 70 70 ALA C C 70 176.820 176.820 177.269 -0.449 18880
1734 1 4 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.524 0.566 18880
1735 1 4 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.116 -0.506 18880
1736 1 4 . 1 1 70 70 ALA H H 70 8.050 8.050 7.527 0.523 18880
1737 1 4 . 1 1 71 71 ASP N N 71 116.780 116.780 117.795 -1.015 18880
1738 1 4 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.132 0.088 18880
1739 1 4 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.586 1.564 18880
1740 1 4 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.942 -2.032 18880
1741 1 4 . 1 1 71 71 ASP H H 71 8.010 8.010 7.487 0.523 18880
1742 1 4 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.448 0.022 18880
1743 1 4 . 1 1 72 72 PRO C C 72 177.970 177.970 176.542 1.428 18880
1744 1 4 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.409 0.501 18880
1745 1 4 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.452 -0.572 18880
1746 1 4 . 1 1 73 73 ASN N N 73 114.930 114.930 114.109 0.821 18880
1747 1 4 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.690 0.190 18880
1748 1 4 . 1 1 73 73 ASN C C 73 174.880 174.880 174.916 -0.036 18880
1749 1 4 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.520 -0.680 18880
1750 1 4 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.827 -0.447 18880
1751 1 4 . 1 1 73 73 ASN H H 73 9.030 9.030 8.301 0.729 18880
1752 1 4 . 1 1 74 74 ASN N N 74 118.340 118.340 114.209 4.131 18880
1753 1 4 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.509 -0.149 18880
1754 1 4 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.036 0.554 18880
1755 1 4 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.717 0.443 18880
1756 1 4 . 1 1 74 74 ASN H H 74 8.320 8.320 8.077 0.243 18880
1757 1 4 . 1 1 75 75 THR N N 75 113.450 113.450 115.717 -2.267 18880
1758 1 4 . 1 1 75 75 THR HA H 75 4.210 4.210 4.353 -0.143 18880
1759 1 4 . 1 1 75 75 THR CA C 75 63.410 63.410 61.344 2.066 18880
1760 1 4 . 1 1 75 75 THR CB C 75 70.540 70.540 67.658 2.882 18880
1761 1 4 . 1 1 75 75 THR H H 75 9.870 9.870 8.694 1.176 18880
1762 1 4 . 1 1 76 76 GLY N N 76 111.810 111.810 109.862 1.948 18880
1763 1 4 . 1 1 76 76 GLY C C 76 173.670 173.670 173.587 0.083 18880
1764 1 4 . 1 1 76 76 GLY CA C 76 45.120 45.120 46.084 -0.965 18880
1765 1 4 . 1 1 76 76 GLY H H 76 10.250 10.250 7.621 2.629 18880
1766 1 4 . 1 1 77 77 PHE N N 77 120.560 120.560 117.696 2.864 18880
1767 1 4 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.187 -0.037 18880
1768 1 4 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.878 0.302 18880
1769 1 4 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.727 0.773 18880
1770 1 4 . 1 1 77 77 PHE H H 77 8.110 8.110 7.341 0.769 18880
1771 1 4 . 1 1 78 78 ILE N N 78 116.410 116.410 119.819 -3.409 18880
1772 1 4 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.401 -0.011 18880
1773 1 4 . 1 1 78 78 ILE C C 78 174.770 174.770 174.256 0.514 18880
1774 1 4 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.854 -0.664 18880
1775 1 4 . 1 1 78 78 ILE CB C 78 41.180 41.180 42.295 -1.115 18880
1776 1 4 . 1 1 78 78 ILE H H 78 8.930 8.930 8.171 0.759 18880
1777 1 4 . 1 1 79 79 ASP N N 79 125.220 125.220 125.351 -0.131 18880
1778 1 4 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.300 0.200 18880
1779 1 4 . 1 1 79 79 ASP C C 79 176.490 176.490 176.285 0.205 18880
1780 1 4 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.570 0.740 18880
1781 1 4 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.382 0.988 18880
1782 1 4 . 1 1 79 79 ASP H H 79 8.610 8.610 8.692 -0.082 18880
1783 1 4 . 1 1 80 80 TYR N N 80 125.760 125.760 126.126 -0.366 18880
1784 1 4 . 1 1 80 80 TYR HA H 80 3.990 3.990 3.831 0.159 18880
1785 1 4 . 1 1 80 80 TYR C C 80 177.140 177.140 176.461 0.679 18880
1786 1 4 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.526 -0.946 18880
1787 1 4 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.548 0.342 18880
1788 1 4 . 1 1 80 80 TYR H H 80 8.460 8.460 7.527 0.933 18880
1789 1 4 . 1 1 81 81 LYS N N 81 118.320 118.320 118.529 -0.209 18880
1790 1 4 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.949 -0.049 18880
1791 1 4 . 1 1 81 81 LYS C C 81 179.090 179.090 178.477 0.613 18880
1792 1 4 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.667 -0.087 18880
1793 1 4 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.689 0.071 18880
1794 1 4 . 1 1 81 81 LYS H H 81 8.410 8.410 8.271 0.139 18880
1795 1 4 . 1 1 82 82 ALA N N 82 122.050 122.050 121.493 0.557 18880
1796 1 4 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.138 -0.008 18880
1797 1 4 . 1 1 82 82 ALA C C 82 179.740 179.740 178.960 0.780 18880
1798 1 4 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.613 -0.093 18880
1799 1 4 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.463 0.077 18880
1800 1 4 . 1 1 82 82 ALA H H 82 7.770 7.770 7.988 -0.218 18880
1801 1 4 . 1 1 83 83 PHE N N 83 117.810 117.810 117.063 0.747 18880
1802 1 4 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.372 -0.082 18880
1803 1 4 . 1 1 83 83 PHE C C 83 176.460 176.460 177.527 -1.067 18880
1804 1 4 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.196 -0.166 18880
1805 1 4 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.953 -0.433 18880
1806 1 4 . 1 1 83 83 PHE H H 83 7.780 7.780 7.828 -0.048 18880
1807 1 4 . 1 1 84 84 ALA N N 84 121.530 121.530 122.595 -1.065 18880
1808 1 4 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.126 -0.466 18880
1809 1 4 . 1 1 84 84 ALA C C 84 179.010 179.010 178.527 0.483 18880
1810 1 4 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.834 1.196 18880
1811 1 4 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.066 0.064 18880
1812 1 4 . 1 1 84 84 ALA H H 84 8.290 8.290 8.389 -0.099 18880
1813 1 4 . 1 1 85 85 ALA N N 85 117.720 117.720 120.598 -2.878 18880
1814 1 4 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.339 -0.259 18880
1815 1 4 . 1 1 85 85 ALA C C 85 179.570 179.570 178.344 1.226 18880
1816 1 4 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.214 0.156 18880
1817 1 4 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.394 -0.104 18880
1818 1 4 . 1 1 85 85 ALA H H 85 7.700 7.700 8.263 -0.563 18880
1819 1 4 . 1 1 86 86 MET N N 86 116.570 116.570 115.672 0.898 18880
1820 1 4 . 1 1 86 86 MET HA H 86 4.160 4.160 4.261 -0.101 18880
1821 1 4 . 1 1 86 86 MET C C 86 177.360 177.360 178.132 -0.772 18880
1822 1 4 . 1 1 86 86 MET CA C 86 57.380 57.380 57.993 -0.613 18880
1823 1 4 . 1 1 86 86 MET CB C 86 32.720 32.720 32.773 -0.053 18880
1824 1 4 . 1 1 86 86 MET H H 86 7.560 7.560 7.369 0.191 18880
1825 1 4 . 1 1 87 87 LEU N N 87 119.090 119.090 117.333 1.757 18880
1826 1 4 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.133 -0.163 18880
1827 1 4 . 1 1 87 87 LEU C C 87 177.420 177.420 177.203 0.217 18880
1828 1 4 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.537 0.753 18880
1829 1 4 . 1 1 87 87 LEU CB C 87 42.280 42.280 40.673 1.607 18880
1830 1 4 . 1 1 87 87 LEU H H 87 7.570 7.570 7.457 0.113 18880
1831 1 4 . 1 1 88 88 TYR N N 88 117.060 117.060 113.498 3.562 18880
1832 1 4 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.736 -0.146 18880
1833 1 4 . 1 1 88 88 TYR C C 88 175.870 175.870 175.635 0.235 18880
1834 1 4 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.812 2.028 18880
1835 1 4 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.049 0.591 18880
1836 1 4 . 1 1 88 88 TYR H H 88 7.740 7.740 7.183 0.557 18880
1837 1 4 . 1 1 89 89 SER N N 89 115.980 115.980 115.883 0.097 18880
1838 1 4 . 1 1 89 89 SER HA H 89 4.440 4.440 4.703 -0.263 18880
1839 1 4 . 1 1 89 89 SER C C 89 174.460 174.460 174.648 -0.188 18880
1840 1 4 . 1 1 89 89 SER CA C 89 58.350 58.350 58.355 -0.005 18880
1841 1 4 . 1 1 89 89 SER CB C 89 63.990 63.990 63.814 0.176 18880
1842 1 4 . 1 1 89 89 SER H H 89 7.880 7.880 8.029 -0.149 18880
1843 1 4 . 1 1 90 90 VAL N N 90 120.910 120.910 114.707 6.203 18880
1844 1 4 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.455 -0.315 18880
1845 1 4 . 1 1 90 90 VAL C C 90 175.720 175.720 175.139 0.581 18880
1846 1 4 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.734 0.536 18880
1847 1 4 . 1 1 90 90 VAL CB C 90 32.840 32.840 31.153 1.687 18880
1848 1 4 . 1 1 90 90 VAL H H 90 8.020 8.020 7.779 0.241 18880
1849 1 4 . 1 1 91 91 ASP N N 91 123.620 123.620 121.060 2.560 18880
1850 1 4 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.860 -0.230 18880
1851 1 4 . 1 1 91 91 ASP C C 91 176.000 176.000 175.550 0.450 18880
1852 1 4 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.638 -0.128 18880
1853 1 4 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.174 0.266 18880
1854 1 4 . 1 1 91 91 ASP H H 91 8.310 8.310 8.264 0.046 18880
1855 1 4 . 1 1 92 92 GLU N N 92 122.170 122.170 118.276 3.894 18880
1856 1 4 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.480 -0.120 18880
1857 1 4 . 1 1 92 92 GLU C C 92 175.660 175.660 176.387 -0.727 18880
1858 1 4 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.778 -0.288 18880
1859 1 4 . 1 1 92 92 GLU CB C 92 32.850 32.850 31.791 1.059 18880
1860 1 4 . 1 1 92 92 GLU H H 92 8.320 8.320 8.718 -0.398 18880
1861 1 5 . 1 1 10 10 HIS C C 10 176.040 176.040 174.276 1.764 18880
1862 1 5 . 1 1 11 11 SER N N 11 116.840 116.840 115.082 1.758 18880
1863 1 5 . 1 1 11 11 SER HA H 11 4.430 4.430 4.178 0.252 18880
1864 1 5 . 1 1 11 11 SER C C 11 174.630 174.630 175.665 -1.035 18880
1865 1 5 . 1 1 11 11 SER CA C 11 58.350 58.350 58.504 -0.154 18880
1866 1 5 . 1 1 11 11 SER CB C 11 64.120 64.120 63.889 0.231 18880
1867 1 5 . 1 1 11 11 SER H H 11 8.360 8.360 7.532 0.828 18880
1868 1 5 . 1 1 12 12 SER N N 12 118.030 118.030 118.494 -0.464 18880
1869 1 5 . 1 1 12 12 SER HA H 12 4.440 4.440 4.392 0.048 18880
1870 1 5 . 1 1 12 12 SER C C 12 174.880 174.880 175.381 -0.501 18880
1871 1 5 . 1 1 12 12 SER CA C 12 58.680 58.680 59.459 -0.779 18880
1872 1 5 . 1 1 12 12 SER CB C 12 63.890 63.890 63.511 0.379 18880
1873 1 5 . 1 1 12 12 SER H H 12 8.490 8.490 8.761 -0.271 18880
1874 1 5 . 1 1 13 13 GLY N N 13 110.450 110.450 109.994 0.456 18880
1875 1 5 . 1 1 13 13 GLY C C 13 173.790 173.790 173.605 0.185 18880
1876 1 5 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.437 1.023 18880
1877 1 5 . 1 1 13 13 GLY H H 13 8.390 8.390 8.326 0.064 18880
1878 1 5 . 1 1 14 14 LEU N N 14 121.310 121.310 118.832 2.478 18880
1879 1 5 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.121 0.219 18880
1880 1 5 . 1 1 14 14 LEU C C 14 176.930 176.930 177.228 -0.298 18880
1881 1 5 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.097 0.103 18880
1882 1 5 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.072 0.527 18880
1883 1 5 . 1 1 14 14 LEU H H 14 8.020 8.020 8.133 -0.113 18880
1884 1 5 . 1 1 15 15 VAL N N 15 121.550 121.550 118.074 3.476 18880
1885 1 5 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.171 0.199 18880
1886 1 5 . 1 1 15 15 VAL CA C 15 59.720 59.720 61.214 -1.494 18880
1887 1 5 . 1 1 15 15 VAL CB C 15 32.770 32.770 30.593 2.177 18880
1888 1 5 . 1 1 15 15 VAL H H 15 8.030 8.030 8.142 -0.112 18880
1889 1 5 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.322 0.048 18880
1890 1 5 . 1 1 16 16 PRO C C 16 176.720 176.720 176.009 0.711 18880
1891 1 5 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.339 -0.689 18880
1892 1 5 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.268 -0.028 18880
1893 1 5 . 1 1 17 17 ARG N N 17 121.890 121.890 120.597 1.293 18880
1894 1 5 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.189 0.091 18880
1895 1 5 . 1 1 17 17 ARG C C 17 176.940 176.940 177.465 -0.525 18880
1896 1 5 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.852 -0.492 18880
1897 1 5 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.108 0.942 18880
1898 1 5 . 1 1 17 17 ARG H H 17 8.450 8.450 8.379 0.071 18880
1899 1 5 . 1 1 18 18 GLY N N 18 110.160 110.160 111.554 -1.394 18880
1900 1 5 . 1 1 18 18 GLY C C 18 174.110 174.110 174.240 -0.130 18880
1901 1 5 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.960 0.430 18880
1902 1 5 . 1 1 18 18 GLY H H 18 8.480 8.480 8.634 -0.154 18880
1903 1 5 . 1 1 19 19 SER N N 19 115.500 115.500 116.594 -1.094 18880
1904 1 5 . 1 1 19 19 SER HA H 19 4.400 4.400 4.620 -0.220 18880
1905 1 5 . 1 1 19 19 SER C C 19 174.380 174.380 174.012 0.368 18880
1906 1 5 . 1 1 19 19 SER CA C 19 58.610 58.610 57.544 1.066 18880
1907 1 5 . 1 1 19 19 SER CB C 19 63.830 63.830 63.458 0.372 18880
1908 1 5 . 1 1 19 19 SER H H 19 8.210 8.210 7.632 0.578 18880
1909 1 5 . 1 1 20 20 HIS N N 20 120.770 120.770 121.983 -1.213 18880
1910 1 5 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.485 0.125 18880
1911 1 5 . 1 1 20 20 HIS C C 20 174.870 174.870 175.132 -0.262 18880
1912 1 5 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.942 0.188 18880
1913 1 5 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.028 -0.318 18880
1914 1 5 . 1 1 20 20 HIS H H 20 8.590 8.590 8.360 0.230 18880
1915 1 5 . 1 1 21 21 MET N N 21 121.440 121.440 121.366 0.074 18880
1916 1 5 . 1 1 21 21 MET HA H 21 4.470 4.470 4.334 0.136 18880
1917 1 5 . 1 1 21 21 MET C C 21 176.030 176.030 176.938 -0.908 18880
1918 1 5 . 1 1 21 21 MET CA C 21 55.490 55.490 56.367 -0.877 18880
1919 1 5 . 1 1 21 21 MET CB C 21 33.170 33.170 33.753 -0.583 18880
1920 1 5 . 1 1 21 21 MET H H 21 8.310 8.310 8.444 -0.134 18880
1921 1 5 . 1 1 22 22 SER N N 22 116.860 116.860 113.565 3.295 18880
1922 1 5 . 1 1 22 22 SER HA H 22 4.430 4.430 4.526 -0.096 18880
1923 1 5 . 1 1 22 22 SER C C 22 174.630 174.630 174.684 -0.054 18880
1924 1 5 . 1 1 22 22 SER CA C 22 58.410 58.410 59.248 -0.838 18880
1925 1 5 . 1 1 22 22 SER CB C 22 64.030 64.030 63.440 0.590 18880
1926 1 5 . 1 1 22 22 SER H H 22 8.340 8.340 8.586 -0.246 18880
1927 1 5 . 1 1 23 23 ASP N N 23 122.660 122.660 121.153 1.507 18880
1928 1 5 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.650 -0.100 18880
1929 1 5 . 1 1 23 23 ASP C C 23 176.860 176.860 177.170 -0.310 18880
1930 1 5 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.031 0.299 18880
1931 1 5 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.679 0.321 18880
1932 1 5 . 1 1 23 23 ASP H H 23 8.540 8.540 8.172 0.368 18880
1933 1 5 . 1 1 24 24 GLU N N 24 120.400 120.400 119.522 0.878 18880
1934 1 5 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.083 0.057 18880
1935 1 5 . 1 1 24 24 GLU C C 24 177.540 177.540 177.215 0.325 18880
1936 1 5 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.672 -0.312 18880
1937 1 5 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.469 0.281 18880
1938 1 5 . 1 1 24 24 GLU H H 24 8.610 8.610 8.025 0.585 18880
1939 1 5 . 1 1 25 25 LYS N N 25 120.390 120.390 117.451 2.939 18880
1940 1 5 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.261 -0.071 18880
1941 1 5 . 1 1 25 25 LYS C C 25 177.490 177.490 178.369 -0.879 18880
1942 1 5 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.508 0.602 18880
1943 1 5 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.638 -0.147 18880
1944 1 5 . 1 1 25 25 LYS H H 25 8.210 8.210 7.946 0.264 18880
1945 1 5 . 1 1 26 26 THR N N 26 114.880 114.880 115.654 -0.774 18880
1946 1 5 . 1 1 26 26 THR HA H 26 4.040 4.040 4.043 -0.003 18880
1947 1 5 . 1 1 26 26 THR C C 26 175.430 175.430 176.887 -1.457 18880
1948 1 5 . 1 1 26 26 THR CA C 26 64.620 64.620 65.791 -1.171 18880
1949 1 5 . 1 1 26 26 THR CB C 26 69.110 69.110 68.559 0.551 18880
1950 1 5 . 1 1 26 26 THR H H 26 8.080 8.080 7.395 0.685 18880
1951 1 5 . 1 1 27 27 GLN N N 27 120.940 120.940 121.130 -0.190 18880
1952 1 5 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.025 0.165 18880
1953 1 5 . 1 1 27 27 GLN C C 27 177.280 177.280 177.158 0.122 18880
1954 1 5 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.481 -0.931 18880
1955 1 5 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.481 0.609 18880
1956 1 5 . 1 1 27 27 GLN H H 27 8.240 8.240 7.767 0.473 18880
1957 1 5 . 1 1 28 28 LEU N N 28 121.860 121.860 118.424 3.436 18880
1958 1 5 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.294 -0.124 18880
1959 1 5 . 1 1 28 28 LEU C C 28 177.750 177.750 177.997 -0.247 18880
1960 1 5 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.571 1.510 18880
1961 1 5 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.414 -0.144 18880
1962 1 5 . 1 1 28 28 LEU H H 28 7.950 7.950 7.491 0.459 18880
1963 1 5 . 1 1 29 29 ILE N N 29 119.260 119.260 119.026 0.234 18880
1964 1 5 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.697 0.203 18880
1965 1 5 . 1 1 29 29 ILE C C 29 177.140 177.140 176.866 0.274 18880
1966 1 5 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.204 0.096 18880
1967 1 5 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.765 1.515 18880
1968 1 5 . 1 1 29 29 ILE H H 29 7.950 7.950 7.852 0.098 18880
1969 1 5 . 1 1 30 30 GLU N N 30 120.500 120.500 117.600 2.900 18880
1970 1 5 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.333 -0.283 18880
1971 1 5 . 1 1 30 30 GLU C C 30 177.560 177.560 176.827 0.733 18880
1972 1 5 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.673 0.416 18880
1973 1 5 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.605 0.985 18880
1974 1 5 . 1 1 30 30 GLU H H 30 8.220 8.220 7.935 0.285 18880
1975 1 5 . 1 1 31 31 ALA N N 31 121.550 121.550 121.316 0.234 18880
1976 1 5 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.396 -0.246 18880
1977 1 5 . 1 1 31 31 ALA C C 31 178.550 178.550 178.870 -0.320 18880
1978 1 5 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.933 -0.133 18880
1979 1 5 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.127 -0.497 18880
1980 1 5 . 1 1 31 31 ALA H H 31 7.890 7.890 7.591 0.299 18880
1981 1 5 . 1 1 32 32 PHE N N 32 117.240 117.240 118.056 -0.816 18880
1982 1 5 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.248 0.052 18880
1983 1 5 . 1 1 32 32 PHE C C 32 176.210 176.210 177.001 -0.791 18880
1984 1 5 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.946 -1.606 18880
1985 1 5 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.944 0.805 18880
1986 1 5 . 1 1 32 32 PHE H H 32 7.930 7.930 7.653 0.277 18880
1987 1 5 . 1 1 33 33 TYR N N 33 119.050 119.050 115.934 3.116 18880
1988 1 5 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.709 -0.379 18880
1989 1 5 . 1 1 33 33 TYR C C 33 175.680 175.680 175.588 0.092 18880
1990 1 5 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.301 1.619 18880
1991 1 5 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.147 1.393 18880
1992 1 5 . 1 1 33 33 TYR H H 33 7.950 7.950 7.670 0.280 18880
1993 1 5 . 1 1 34 34 ASN N N 34 118.390 118.390 118.667 -0.277 18880
1994 1 5 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.872 -0.242 18880
1995 1 5 . 1 1 34 34 ASN C C 34 174.810 174.810 173.727 1.083 18880
1996 1 5 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.618 -0.468 18880
1997 1 5 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.905 -0.925 18880
1998 1 5 . 1 1 34 34 ASN H H 34 7.960 7.960 7.866 0.094 18880
1999 1 5 . 1 1 35 35 PHE N N 35 120.670 120.670 119.043 1.627 18880
2000 1 5 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.699 -0.249 18880
2001 1 5 . 1 1 35 35 PHE C C 35 175.310 175.310 173.412 1.898 18880
2002 1 5 . 1 1 35 35 PHE CA C 35 58.320 58.320 57.724 0.596 18880
2003 1 5 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.045 -0.625 18880
2004 1 5 . 1 1 35 35 PHE H H 35 7.830 7.830 7.904 -0.074 18880
2005 1 5 . 1 1 36 36 ASP N N 36 122.400 122.400 121.417 0.983 18880
2006 1 5 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.563 0.027 18880
2007 1 5 . 1 1 36 36 ASP C C 36 176.150 176.150 175.739 0.411 18880
2008 1 5 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.173 -0.103 18880
2009 1 5 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.938 0.382 18880
2010 1 5 . 1 1 36 36 ASP H H 36 8.180 8.180 8.229 -0.049 18880
2011 1 5 . 1 1 37 37 GLY N N 37 108.560 108.560 106.627 1.933 18880
2012 1 5 . 1 1 37 37 GLY C C 37 173.660 173.660 173.201 0.459 18880
2013 1 5 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.682 -0.072 18880
2014 1 5 . 1 1 37 37 GLY H H 37 7.680 7.680 7.878 -0.198 18880
2015 1 5 . 1 1 38 38 ASP N N 38 120.010 120.010 119.805 0.205 18880
2016 1 5 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.354 0.246 18880
2017 1 5 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.018 0.242 18880
2018 1 5 . 1 1 38 38 ASP CB C 38 41.450 41.450 41.301 0.149 18880
2019 1 5 . 1 1 38 38 ASP H H 38 8.220 8.220 7.674 0.546 18880
2020 1 5 . 1 1 39 39 TYR N N 39 121.030 121.030 118.631 2.399 18880
2021 1 5 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.108 0.282 18880
2022 1 5 . 1 1 39 39 TYR C C 39 175.290 175.290 174.202 1.088 18880
2023 1 5 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.136 0.064 18880
2024 1 5 . 1 1 39 39 TYR CB C 39 39.170 39.170 38.145 1.025 18880
2025 1 5 . 1 1 39 39 TYR H H 39 8.090 8.090 7.915 0.175 18880
2026 1 5 . 1 1 40 40 ASP N N 40 122.020 122.020 121.113 0.907 18880
2027 1 5 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.556 0.044 18880
2028 1 5 . 1 1 40 40 ASP C C 40 175.970 175.970 176.728 -0.758 18880
2029 1 5 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.422 0.798 18880
2030 1 5 . 1 1 40 40 ASP CB C 40 41.520 41.520 43.856 -2.336 18880
2031 1 5 . 1 1 40 40 ASP H H 40 8.200 8.200 8.321 -0.121 18880
2032 1 5 . 1 1 41 41 GLY N N 41 108.330 108.330 112.375 -4.045 18880
2033 1 5 . 1 1 41 41 GLY C C 41 173.000 173.000 173.503 -0.503 18880
2034 1 5 . 1 1 41 41 GLY CA C 41 45.420 45.420 45.148 0.272 18880
2035 1 5 . 1 1 41 41 GLY H H 41 7.830 7.830 8.288 -0.458 18880
2036 1 5 . 1 1 42 42 PHE N N 42 118.600 118.600 125.202 -6.602 18880
2037 1 5 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.391 0.869 18880
2038 1 5 . 1 1 42 42 PHE C C 42 175.660 175.660 175.142 0.518 18880
2039 1 5 . 1 1 42 42 PHE CA C 42 57.160 57.160 59.438 -2.277 18880
2040 1 5 . 1 1 42 42 PHE CB C 42 41.170 41.170 39.569 1.601 18880
2041 1 5 . 1 1 42 42 PHE H H 42 8.150 8.150 8.051 0.099 18880
2042 1 5 . 1 1 43 43 VAL N N 43 119.180 119.180 127.760 -8.580 18880
2043 1 5 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.240 0.430 18880
2044 1 5 . 1 1 43 43 VAL C C 43 175.110 175.110 173.671 1.439 18880
2045 1 5 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.324 0.296 18880
2046 1 5 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.162 -2.282 18880
2047 1 5 . 1 1 43 43 VAL H H 43 9.070 9.070 7.964 1.106 18880
2048 1 5 . 1 1 44 44 SER N N 44 121.380 121.380 123.034 -1.654 18880
2049 1 5 . 1 1 44 44 SER HA H 44 4.570 4.570 4.159 0.411 18880
2050 1 5 . 1 1 44 44 SER C C 44 175.660 175.660 175.175 0.485 18880
2051 1 5 . 1 1 44 44 SER CA C 44 57.720 57.720 57.657 0.062 18880
2052 1 5 . 1 1 44 44 SER CB C 44 63.690 63.690 63.450 0.240 18880
2053 1 5 . 1 1 44 44 SER H H 44 9.140 9.140 8.380 0.760 18880
2054 1 5 . 1 1 45 45 VAL N N 45 122.720 122.720 123.736 -1.016 18880
2055 1 5 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.227 0.273 18880
2056 1 5 . 1 1 45 45 VAL C C 45 177.240 177.240 177.219 0.021 18880
2057 1 5 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.933 -0.663 18880
2058 1 5 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.762 0.688 18880
2059 1 5 . 1 1 45 45 VAL H H 45 8.140 8.140 8.347 -0.207 18880
2060 1 5 . 1 1 46 46 GLU N N 46 118.990 118.990 118.552 0.438 18880
2061 1 5 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.784 0.196 18880
2062 1 5 . 1 1 46 46 GLU C C 46 179.460 179.460 179.033 0.427 18880
2063 1 5 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.516 0.044 18880
2064 1 5 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.889 0.271 18880
2065 1 5 . 1 1 46 46 GLU H H 46 8.230 8.230 7.206 1.024 18880
2066 1 5 . 1 1 47 47 GLU N N 47 120.120 120.120 117.913 2.207 18880
2067 1 5 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.273 -0.193 18880
2068 1 5 . 1 1 47 47 GLU C C 47 179.170 179.170 178.719 0.451 18880
2069 1 5 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.462 1.428 18880
2070 1 5 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.248 0.572 18880
2071 1 5 . 1 1 47 47 GLU H H 47 7.880 7.880 8.048 -0.168 18880
2072 1 5 . 1 1 48 48 PHE N N 48 120.830 120.830 121.942 -1.112 18880
2073 1 5 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.181 0.009 18880
2074 1 5 . 1 1 48 48 PHE C C 48 176.920 176.920 177.454 -0.534 18880
2075 1 5 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.272 0.598 18880
2076 1 5 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.965 0.295 18880
2077 1 5 . 1 1 48 48 PHE H H 48 8.600 8.600 8.447 0.153 18880
2078 1 5 . 1 1 49 49 ARG N N 49 118.470 118.470 119.298 -0.828 18880
2079 1 5 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.076 -0.216 18880
2080 1 5 . 1 1 49 49 ARG C C 49 178.090 178.090 178.723 -0.633 18880
2081 1 5 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.441 -0.371 18880
2082 1 5 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.785 0.355 18880
2083 1 5 . 1 1 49 49 ARG H H 49 8.650 8.650 8.718 -0.068 18880
2084 1 5 . 1 1 50 50 GLY N N 50 105.080 105.080 105.881 -0.801 18880
2085 1 5 . 1 1 50 50 GLY C C 50 175.090 175.090 175.845 -0.755 18880
2086 1 5 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.862 -0.182 18880
2087 1 5 . 1 1 50 50 GLY H H 50 7.620 7.620 8.306 -0.686 18880
2088 1 5 . 1 1 51 51 ILE N N 51 121.440 121.440 121.357 0.083 18880
2089 1 5 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.901 -0.071 18880
2090 1 5 . 1 1 51 51 ILE C C 51 178.300 178.300 177.364 0.936 18880
2091 1 5 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.053 -0.213 18880
2092 1 5 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.474 -0.164 18880
2093 1 5 . 1 1 51 51 ILE H H 51 7.470 7.470 7.204 0.266 18880
2094 1 5 . 1 1 52 52 ILE N N 52 118.930 118.930 119.690 -0.760 18880
2095 1 5 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.805 -0.065 18880
2096 1 5 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.269 0.491 18880
2097 1 5 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.426 1.604 18880
2098 1 5 . 1 1 52 52 ILE H H 52 7.790 7.790 8.571 -0.781 18880
2099 1 5 . 1 1 53 53 ARG N N 53 120.140 120.140 119.776 0.364 18880
2100 1 5 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.004 0.086 18880
2101 1 5 . 1 1 53 53 ARG C C 53 177.380 177.380 177.029 0.351 18880
2102 1 5 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.398 0.712 18880
2103 1 5 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.423 -0.843 18880
2104 1 5 . 1 1 53 53 ARG H H 53 7.930 7.930 8.159 -0.229 18880
2105 1 5 . 1 1 54 54 ASP N N 54 117.500 117.500 115.400 2.100 18880
2106 1 5 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.786 -0.186 18880
2107 1 5 . 1 1 54 54 ASP C C 54 176.930 176.930 176.107 0.823 18880
2108 1 5 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.830 1.710 18880
2109 1 5 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.962 0.138 18880
2110 1 5 . 1 1 54 54 ASP H H 54 7.870 7.870 8.046 -0.176 18880
2111 1 5 . 1 1 55 55 GLY N N 55 106.370 106.370 108.307 -1.937 18880
2112 1 5 . 1 1 55 55 GLY C C 55 173.460 173.460 173.878 -0.418 18880
2113 1 5 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.459 0.541 18880
2114 1 5 . 1 1 55 55 GLY H H 55 7.880 7.880 7.813 0.067 18880
2115 1 5 . 1 1 56 56 LEU N N 56 122.630 122.630 121.612 1.018 18880
2116 1 5 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.800 -0.030 18880
2117 1 5 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.227 1.263 18880
2118 1 5 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.861 0.258 18880
2119 1 5 . 1 1 56 56 LEU H H 56 8.220 8.220 7.838 0.382 18880
2120 1 5 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.489 0.091 18880
2121 1 5 . 1 1 57 57 PRO C C 57 176.150 176.150 175.499 0.651 18880
2122 1 5 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.585 -0.165 18880
2123 1 5 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.073 0.667 18880
2124 1 5 . 1 1 58 58 MET N N 58 121.810 121.810 121.652 0.158 18880
2125 1 5 . 1 1 58 58 MET HA H 58 4.630 4.630 4.464 0.166 18880
2126 1 5 . 1 1 58 58 MET C C 58 176.150 176.150 175.348 0.802 18880
2127 1 5 . 1 1 58 58 MET CA C 58 55.560 55.560 55.222 0.338 18880
2128 1 5 . 1 1 58 58 MET CB C 58 36.820 36.820 34.305 2.515 18880
2129 1 5 . 1 1 58 58 MET H H 58 7.690 7.690 7.854 -0.164 18880
2130 1 5 . 1 1 59 59 THR N N 59 114.180 114.180 115.644 -1.464 18880
2131 1 5 . 1 1 59 59 THR HA H 59 4.450 4.450 4.412 0.038 18880
2132 1 5 . 1 1 59 59 THR C C 59 175.170 175.170 175.748 -0.578 18880
2133 1 5 . 1 1 59 59 THR CA C 59 60.780 60.780 60.430 0.350 18880
2134 1 5 . 1 1 59 59 THR CB C 59 71.060 71.060 69.585 1.475 18880
2135 1 5 . 1 1 59 59 THR H H 59 8.940 8.940 8.202 0.738 18880
2136 1 5 . 1 1 60 60 GLU N N 60 120.620 120.620 126.023 -5.403 18880
2137 1 5 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.688 0.322 18880
2138 1 5 . 1 1 60 60 GLU C C 60 179.010 179.010 178.087 0.923 18880
2139 1 5 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.717 0.103 18880
2140 1 5 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.662 0.388 18880
2141 1 5 . 1 1 60 60 GLU H H 60 8.850 8.850 8.915 -0.065 18880
2142 1 5 . 1 1 61 61 ALA N N 61 121.080 121.080 122.292 -1.212 18880
2143 1 5 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.948 0.192 18880
2144 1 5 . 1 1 61 61 ALA C C 61 180.350 180.350 180.008 0.342 18880
2145 1 5 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.179 -0.089 18880
2146 1 5 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.759 0.451 18880
2147 1 5 . 1 1 61 61 ALA H H 61 8.370 8.370 8.395 -0.025 18880
2148 1 5 . 1 1 62 62 GLU N N 62 118.890 118.890 118.885 0.005 18880
2149 1 5 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.542 0.458 18880
2150 1 5 . 1 1 62 62 GLU C C 62 179.690 179.690 178.627 1.063 18880
2151 1 5 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.253 0.737 18880
2152 1 5 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.261 2.049 18880
2153 1 5 . 1 1 62 62 GLU H H 62 7.680 7.680 7.673 0.007 18880
2154 1 5 . 1 1 63 63 ILE N N 63 122.340 122.340 119.892 2.448 18880
2155 1 5 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.238 0.332 18880
2156 1 5 . 1 1 63 63 ILE C C 63 177.260 177.260 178.236 -0.976 18880
2157 1 5 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.633 1.257 18880
2158 1 5 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.842 1.138 18880
2159 1 5 . 1 1 63 63 ILE H H 63 8.420 8.420 7.532 0.888 18880
2160 1 5 . 1 1 64 64 THR N N 64 116.970 116.970 116.385 0.585 18880
2161 1 5 . 1 1 64 64 THR HA H 64 3.940 3.940 3.989 -0.049 18880
2162 1 5 . 1 1 64 64 THR C C 64 176.520 176.520 177.023 -0.503 18880
2163 1 5 . 1 1 64 64 THR CA C 64 67.060 67.060 67.353 -0.293 18880
2164 1 5 . 1 1 64 64 THR CB C 64 68.750 68.750 68.361 0.389 18880
2165 1 5 . 1 1 64 64 THR H H 64 8.310 8.310 8.465 -0.155 18880
2166 1 5 . 1 1 65 65 GLU N N 65 120.760 120.760 119.931 0.829 18880
2167 1 5 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.195 -0.165 18880
2168 1 5 . 1 1 65 65 GLU C C 65 175.830 175.830 178.937 -3.107 18880
2169 1 5 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.953 0.547 18880
2170 1 5 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.439 0.331 18880
2171 1 5 . 1 1 65 65 GLU H H 65 7.970 7.970 8.620 -0.650 18880
2172 1 5 . 1 1 66 66 PHE N N 66 120.940 120.940 118.696 2.244 18880
2173 1 5 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.426 -0.186 18880
2174 1 5 . 1 1 66 66 PHE C C 66 177.330 177.330 177.011 0.319 18880
2175 1 5 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.167 3.033 18880
2176 1 5 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.891 -0.361 18880
2177 1 5 . 1 1 66 66 PHE H H 66 8.100 8.100 7.894 0.206 18880
2178 1 5 . 1 1 67 67 PHE N N 67 118.110 118.110 119.500 -1.390 18880
2179 1 5 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.319 -0.369 18880
2180 1 5 . 1 1 67 67 PHE C C 67 178.090 178.090 177.664 0.426 18880
2181 1 5 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.365 1.835 18880
2182 1 5 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.716 -0.466 18880
2183 1 5 . 1 1 67 67 PHE H H 67 8.380 8.380 8.696 -0.316 18880
2184 1 5 . 1 1 68 68 GLU N N 68 119.650 119.650 117.556 2.094 18880
2185 1 5 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.400 -0.390 18880
2186 1 5 . 1 1 68 68 GLU C C 68 177.910 177.910 176.834 1.076 18880
2187 1 5 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.734 1.506 18880
2188 1 5 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.595 -0.225 18880
2189 1 5 . 1 1 68 68 GLU H H 68 8.230 8.230 8.121 0.109 18880
2190 1 5 . 1 1 69 69 ALA N N 69 119.090 119.090 120.831 -1.741 18880
2191 1 5 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.433 -0.253 18880
2192 1 5 . 1 1 69 69 ALA C C 69 179.030 179.030 178.219 0.811 18880
2193 1 5 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.441 0.159 18880
2194 1 5 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.620 0.160 18880
2195 1 5 . 1 1 69 69 ALA H H 69 7.340 7.340 7.659 -0.319 18880
2196 1 5 . 1 1 70 70 ALA N N 70 118.670 118.670 119.981 -1.311 18880
2197 1 5 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.349 -0.329 18880
2198 1 5 . 1 1 70 70 ALA C C 70 176.820 176.820 176.528 0.292 18880
2199 1 5 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.471 0.619 18880
2200 1 5 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.538 -0.928 18880
2201 1 5 . 1 1 70 70 ALA H H 70 8.050 8.050 7.729 0.321 18880
2202 1 5 . 1 1 71 71 ASP N N 71 116.780 116.780 118.202 -1.422 18880
2203 1 5 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.037 0.183 18880
2204 1 5 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.377 1.773 18880
2205 1 5 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.735 -1.825 18880
2206 1 5 . 1 1 71 71 ASP H H 71 8.010 8.010 7.527 0.483 18880
2207 1 5 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.395 0.075 18880
2208 1 5 . 1 1 72 72 PRO C C 72 177.970 177.970 177.518 0.452 18880
2209 1 5 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.319 0.592 18880
2210 1 5 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.508 -0.628 18880
2211 1 5 . 1 1 73 73 ASN N N 73 114.930 114.930 116.846 -1.916 18880
2212 1 5 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.568 0.312 18880
2213 1 5 . 1 1 73 73 ASN C C 73 174.880 174.880 174.809 0.071 18880
2214 1 5 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.906 -1.066 18880
2215 1 5 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.870 -0.490 18880
2216 1 5 . 1 1 73 73 ASN H H 73 9.030 9.030 8.539 0.491 18880
2217 1 5 . 1 1 74 74 ASN N N 74 118.340 118.340 111.262 7.078 18880
2218 1 5 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.615 -0.255 18880
2219 1 5 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.089 0.501 18880
2220 1 5 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.624 0.536 18880
2221 1 5 . 1 1 74 74 ASN H H 74 8.320 8.320 8.475 -0.155 18880
2222 1 5 . 1 1 75 75 THR N N 75 113.450 113.450 110.205 3.245 18880
2223 1 5 . 1 1 75 75 THR HA H 75 4.210 4.210 4.292 -0.082 18880
2224 1 5 . 1 1 75 75 THR CA C 75 63.410 63.410 63.782 -0.373 18880
2225 1 5 . 1 1 75 75 THR CB C 75 70.540 70.540 69.748 0.792 18880
2226 1 5 . 1 1 75 75 THR H H 75 9.870 9.870 8.458 1.412 18880
2227 1 5 . 1 1 76 76 GLY N N 76 111.810 111.810 109.720 2.090 18880
2228 1 5 . 1 1 76 76 GLY C C 76 173.670 173.670 172.540 1.130 18880
2229 1 5 . 1 1 76 76 GLY CA C 76 45.120 45.120 44.513 0.607 18880
2230 1 5 . 1 1 76 76 GLY H H 76 10.250 10.250 8.057 2.193 18880
2231 1 5 . 1 1 77 77 PHE N N 77 120.560 120.560 118.551 2.009 18880
2232 1 5 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.725 0.425 18880
2233 1 5 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.719 0.461 18880
2234 1 5 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.411 1.089 18880
2235 1 5 . 1 1 77 77 PHE H H 77 8.110 8.110 7.535 0.575 18880
2236 1 5 . 1 1 78 78 ILE N N 78 116.410 116.410 119.160 -2.750 18880
2237 1 5 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.327 0.063 18880
2238 1 5 . 1 1 78 78 ILE C C 78 174.770 174.770 174.490 0.280 18880
2239 1 5 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.720 -0.530 18880
2240 1 5 . 1 1 78 78 ILE CB C 78 41.180 41.180 41.425 -0.245 18880
2241 1 5 . 1 1 78 78 ILE H H 78 8.930 8.930 7.925 1.005 18880
2242 1 5 . 1 1 79 79 ASP N N 79 125.220 125.220 125.613 -0.393 18880
2243 1 5 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.865 -0.365 18880
2244 1 5 . 1 1 79 79 ASP C C 79 176.490 176.490 177.338 -0.848 18880
2245 1 5 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.884 -0.574 18880
2246 1 5 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.111 1.259 18880
2247 1 5 . 1 1 79 79 ASP H H 79 8.610 8.610 8.891 -0.281 18880
2248 1 5 . 1 1 80 80 TYR N N 80 125.760 125.760 129.275 -3.515 18880
2249 1 5 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.059 -0.069 18880
2250 1 5 . 1 1 80 80 TYR C C 80 177.140 177.140 176.738 0.402 18880
2251 1 5 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.097 -0.517 18880
2252 1 5 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.586 0.304 18880
2253 1 5 . 1 1 80 80 TYR H H 80 8.460 8.460 8.566 -0.106 18880
2254 1 5 . 1 1 81 81 LYS N N 81 118.320 118.320 118.591 -0.271 18880
2255 1 5 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.877 0.023 18880
2256 1 5 . 1 1 81 81 LYS C C 81 179.090 179.090 178.855 0.235 18880
2257 1 5 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.801 -0.221 18880
2258 1 5 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.681 0.079 18880
2259 1 5 . 1 1 81 81 LYS H H 81 8.410 8.410 8.447 -0.037 18880
2260 1 5 . 1 1 82 82 ALA N N 82 122.050 122.050 121.691 0.359 18880
2261 1 5 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.196 -0.066 18880
2262 1 5 . 1 1 82 82 ALA C C 82 179.740 179.740 179.237 0.503 18880
2263 1 5 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.736 -0.216 18880
2264 1 5 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.438 0.102 18880
2265 1 5 . 1 1 82 82 ALA H H 82 7.770 7.770 8.022 -0.252 18880
2266 1 5 . 1 1 83 83 PHE N N 83 117.810 117.810 116.418 1.392 18880
2267 1 5 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.622 -0.332 18880
2268 1 5 . 1 1 83 83 PHE C C 83 176.460 176.460 177.753 -1.293 18880
2269 1 5 . 1 1 83 83 PHE CA C 83 60.030 60.030 58.934 1.096 18880
2270 1 5 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.338 -0.818 18880
2271 1 5 . 1 1 83 83 PHE H H 83 7.780 7.780 7.606 0.174 18880
2272 1 5 . 1 1 84 84 ALA N N 84 121.530 121.530 122.794 -1.264 18880
2273 1 5 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.187 -0.527 18880
2274 1 5 . 1 1 84 84 ALA C C 84 179.010 179.010 178.608 0.402 18880
2275 1 5 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.943 1.087 18880
2276 1 5 . 1 1 84 84 ALA CB C 84 18.130 18.130 17.892 0.238 18880
2277 1 5 . 1 1 84 84 ALA H H 84 8.290 8.290 8.524 -0.234 18880
2278 1 5 . 1 1 85 85 ALA N N 85 117.720 117.720 120.120 -2.400 18880
2279 1 5 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.252 -0.172 18880
2280 1 5 . 1 1 85 85 ALA C C 85 179.570 179.570 178.570 1.000 18880
2281 1 5 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.334 0.036 18880
2282 1 5 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.427 -0.137 18880
2283 1 5 . 1 1 85 85 ALA H H 85 7.700 7.700 8.471 -0.771 18880
2284 1 5 . 1 1 86 86 MET N N 86 116.570 116.570 116.687 -0.117 18880
2285 1 5 . 1 1 86 86 MET HA H 86 4.160 4.160 4.176 -0.016 18880
2286 1 5 . 1 1 86 86 MET C C 86 177.360 177.360 178.165 -0.805 18880
2287 1 5 . 1 1 86 86 MET CA C 86 57.380 57.380 58.350 -0.970 18880
2288 1 5 . 1 1 86 86 MET CB C 86 32.720 32.720 32.627 0.093 18880
2289 1 5 . 1 1 86 86 MET H H 86 7.560 7.560 7.509 0.051 18880
2290 1 5 . 1 1 87 87 LEU N N 87 119.090 119.090 117.995 1.095 18880
2291 1 5 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.100 -0.130 18880
2292 1 5 . 1 1 87 87 LEU C C 87 177.420 177.420 177.022 0.398 18880
2293 1 5 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.954 0.336 18880
2294 1 5 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.479 0.801 18880
2295 1 5 . 1 1 87 87 LEU H H 87 7.570 7.570 7.525 0.045 18880
2296 1 5 . 1 1 88 88 TYR N N 88 117.060 117.060 115.519 1.541 18880
2297 1 5 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.742 -0.152 18880
2298 1 5 . 1 1 88 88 TYR C C 88 175.870 175.870 175.180 0.690 18880
2299 1 5 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.543 2.297 18880
2300 1 5 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.797 0.842 18880
2301 1 5 . 1 1 88 88 TYR H H 88 7.740 7.740 7.329 0.411 18880
2302 1 5 . 1 1 89 89 SER N N 89 115.980 115.980 117.631 -1.651 18880
2303 1 5 . 1 1 89 89 SER HA H 89 4.440 4.440 4.483 -0.043 18880
2304 1 5 . 1 1 89 89 SER C C 89 174.460 174.460 174.487 -0.027 18880
2305 1 5 . 1 1 89 89 SER CA C 89 58.350 58.350 59.196 -0.846 18880
2306 1 5 . 1 1 89 89 SER CB C 89 63.990 63.990 61.618 2.372 18880
2307 1 5 . 1 1 89 89 SER H H 89 7.880 7.880 7.822 0.058 18880
2308 1 5 . 1 1 90 90 VAL N N 90 120.910 120.910 121.543 -0.633 18880
2309 1 5 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.315 -0.175 18880
2310 1 5 . 1 1 90 90 VAL C C 90 175.720 175.720 174.318 1.402 18880
2311 1 5 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.281 -0.010 18880
2312 1 5 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.336 0.504 18880
2313 1 5 . 1 1 90 90 VAL H H 90 8.020 8.020 7.851 0.169 18880
2314 1 5 . 1 1 91 91 ASP N N 91 123.620 123.620 119.120 4.500 18880
2315 1 5 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.652 -0.022 18880
2316 1 5 . 1 1 91 91 ASP C C 91 176.000 176.000 174.900 1.100 18880
2317 1 5 . 1 1 91 91 ASP CA C 91 54.510 54.510 53.443 1.067 18880
2318 1 5 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.688 -0.248 18880
2319 1 5 . 1 1 91 91 ASP H H 91 8.310 8.310 7.946 0.364 18880
2320 1 5 . 1 1 92 92 GLU N N 92 122.170 122.170 122.638 -0.468 18880
2321 1 5 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.549 -0.189 18880
2322 1 5 . 1 1 92 92 GLU C C 92 175.660 175.660 176.554 -0.894 18880
2323 1 5 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.426 0.064 18880
2324 1 5 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.563 2.287 18880
2325 1 5 . 1 1 92 92 GLU H H 92 8.320 8.320 8.546 -0.226 18880
2326 1 6 . 1 1 10 10 HIS C C 10 176.040 176.040 174.378 1.662 18880
2327 1 6 . 1 1 11 11 SER N N 11 116.840 116.840 115.737 1.103 18880
2328 1 6 . 1 1 11 11 SER HA H 11 4.430 4.430 4.510 -0.080 18880
2329 1 6 . 1 1 11 11 SER C C 11 174.630 174.630 173.484 1.146 18880
2330 1 6 . 1 1 11 11 SER CA C 11 58.350 58.350 58.124 0.226 18880
2331 1 6 . 1 1 11 11 SER CB C 11 64.120 64.120 63.732 0.388 18880
2332 1 6 . 1 1 11 11 SER H H 11 8.360 8.360 8.183 0.177 18880
2333 1 6 . 1 1 12 12 SER N N 12 118.030 118.030 118.589 -0.559 18880
2334 1 6 . 1 1 12 12 SER HA H 12 4.440 4.440 4.333 0.107 18880
2335 1 6 . 1 1 12 12 SER C C 12 174.880 174.880 175.581 -0.701 18880
2336 1 6 . 1 1 12 12 SER CA C 12 58.680 58.680 58.487 0.193 18880
2337 1 6 . 1 1 12 12 SER CB C 12 63.890 63.890 63.281 0.609 18880
2338 1 6 . 1 1 12 12 SER H H 12 8.490 8.490 8.293 0.197 18880
2339 1 6 . 1 1 13 13 GLY N N 13 110.450 110.450 113.033 -2.583 18880
2340 1 6 . 1 1 13 13 GLY C C 13 173.790 173.790 174.649 -0.859 18880
2341 1 6 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.923 0.537 18880
2342 1 6 . 1 1 13 13 GLY H H 13 8.390 8.390 8.614 -0.224 18880
2343 1 6 . 1 1 14 14 LEU N N 14 121.310 121.310 120.945 0.365 18880
2344 1 6 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.449 -0.109 18880
2345 1 6 . 1 1 14 14 LEU C C 14 176.930 176.930 175.540 1.390 18880
2346 1 6 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.995 0.205 18880
2347 1 6 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.385 0.215 18880
2348 1 6 . 1 1 14 14 LEU H H 14 8.020 8.020 7.568 0.452 18880
2349 1 6 . 1 1 15 15 VAL N N 15 121.550 121.550 113.515 8.035 18880
2350 1 6 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.436 -0.066 18880
2351 1 6 . 1 1 15 15 VAL CA C 15 59.720 59.720 58.256 1.464 18880
2352 1 6 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.332 1.438 18880
2353 1 6 . 1 1 15 15 VAL H H 15 8.030 8.030 7.434 0.596 18880
2354 1 6 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.270 0.100 18880
2355 1 6 . 1 1 16 16 PRO C C 16 176.720 176.720 176.500 0.220 18880
2356 1 6 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.275 -1.625 18880
2357 1 6 . 1 1 16 16 PRO CB C 16 32.240 32.240 31.649 0.591 18880
2358 1 6 . 1 1 17 17 ARG N N 17 121.890 121.890 120.238 1.652 18880
2359 1 6 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.261 0.019 18880
2360 1 6 . 1 1 17 17 ARG C C 17 176.940 176.940 177.291 -0.351 18880
2361 1 6 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.353 0.007 18880
2362 1 6 . 1 1 17 17 ARG CB C 17 31.050 31.050 29.721 1.329 18880
2363 1 6 . 1 1 17 17 ARG H H 17 8.450 8.450 7.848 0.602 18880
2364 1 6 . 1 1 18 18 GLY N N 18 110.160 110.160 110.951 -0.791 18880
2365 1 6 . 1 1 18 18 GLY C C 18 174.110 174.110 173.967 0.143 18880
2366 1 6 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.020 0.370 18880
2367 1 6 . 1 1 18 18 GLY H H 18 8.480 8.480 8.676 -0.196 18880
2368 1 6 . 1 1 19 19 SER N N 19 115.500 115.500 116.491 -0.991 18880
2369 1 6 . 1 1 19 19 SER HA H 19 4.400 4.400 4.444 -0.044 18880
2370 1 6 . 1 1 19 19 SER C C 19 174.380 174.380 174.379 0.001 18880
2371 1 6 . 1 1 19 19 SER CA C 19 58.610 58.610 57.928 0.681 18880
2372 1 6 . 1 1 19 19 SER CB C 19 63.830 63.830 64.325 -0.495 18880
2373 1 6 . 1 1 19 19 SER H H 19 8.210 8.210 7.616 0.594 18880
2374 1 6 . 1 1 20 20 HIS N N 20 120.770 120.770 118.869 1.901 18880
2375 1 6 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.275 0.335 18880
2376 1 6 . 1 1 20 20 HIS C C 20 174.870 174.870 173.402 1.468 18880
2377 1 6 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.812 -0.682 18880
2378 1 6 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.247 0.463 18880
2379 1 6 . 1 1 20 20 HIS H H 20 8.590 8.590 8.512 0.078 18880
2380 1 6 . 1 1 21 21 MET N N 21 121.440 121.440 121.797 -0.357 18880
2381 1 6 . 1 1 21 21 MET HA H 21 4.470 4.470 4.772 -0.302 18880
2382 1 6 . 1 1 21 21 MET C C 21 176.030 176.030 176.396 -0.366 18880
2383 1 6 . 1 1 21 21 MET CA C 21 55.490 55.490 54.741 0.749 18880
2384 1 6 . 1 1 21 21 MET CB C 21 33.170 33.170 34.880 -1.710 18880
2385 1 6 . 1 1 21 21 MET H H 21 8.310 8.310 7.885 0.425 18880
2386 1 6 . 1 1 22 22 SER N N 22 116.860 116.860 115.430 1.430 18880
2387 1 6 . 1 1 22 22 SER HA H 22 4.430 4.430 4.601 -0.171 18880
2388 1 6 . 1 1 22 22 SER C C 22 174.630 174.630 174.284 0.346 18880
2389 1 6 . 1 1 22 22 SER CA C 22 58.410 58.410 59.490 -1.080 18880
2390 1 6 . 1 1 22 22 SER CB C 22 64.030 64.030 63.564 0.466 18880
2391 1 6 . 1 1 22 22 SER H H 22 8.340 8.340 8.622 -0.282 18880
2392 1 6 . 1 1 23 23 ASP N N 23 122.660 122.660 121.658 1.002 18880
2393 1 6 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.728 -0.178 18880
2394 1 6 . 1 1 23 23 ASP C C 23 176.860 176.860 177.519 -0.659 18880
2395 1 6 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.161 0.169 18880
2396 1 6 . 1 1 23 23 ASP CB C 23 41.000 41.000 41.077 -0.077 18880
2397 1 6 . 1 1 23 23 ASP H H 23 8.540 8.540 8.335 0.205 18880
2398 1 6 . 1 1 24 24 GLU N N 24 120.400 120.400 118.784 1.616 18880
2399 1 6 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.075 0.065 18880
2400 1 6 . 1 1 24 24 GLU C C 24 177.540 177.540 177.255 0.285 18880
2401 1 6 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.559 -0.199 18880
2402 1 6 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.038 0.712 18880
2403 1 6 . 1 1 24 24 GLU H H 24 8.610 8.610 8.192 0.418 18880
2404 1 6 . 1 1 25 25 LYS N N 25 120.390 120.390 118.754 1.636 18880
2405 1 6 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.252 -0.062 18880
2406 1 6 . 1 1 25 25 LYS C C 25 177.490 177.490 178.204 -0.714 18880
2407 1 6 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.763 0.347 18880
2408 1 6 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.641 -0.151 18880
2409 1 6 . 1 1 25 25 LYS H H 25 8.210 8.210 7.910 0.300 18880
2410 1 6 . 1 1 26 26 THR N N 26 114.880 114.880 115.696 -0.816 18880
2411 1 6 . 1 1 26 26 THR HA H 26 4.040 4.040 4.079 -0.039 18880
2412 1 6 . 1 1 26 26 THR C C 26 175.430 175.430 176.820 -1.390 18880
2413 1 6 . 1 1 26 26 THR CA C 26 64.620 64.620 65.770 -1.150 18880
2414 1 6 . 1 1 26 26 THR CB C 26 69.110 69.110 68.527 0.583 18880
2415 1 6 . 1 1 26 26 THR H H 26 8.080 8.080 7.417 0.663 18880
2416 1 6 . 1 1 27 27 GLN N N 27 120.940 120.940 122.100 -1.160 18880
2417 1 6 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.109 0.081 18880
2418 1 6 . 1 1 27 27 GLN C C 27 177.280 177.280 177.507 -0.227 18880
2419 1 6 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.692 -1.142 18880
2420 1 6 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.500 0.590 18880
2421 1 6 . 1 1 27 27 GLN H H 27 8.240 8.240 7.864 0.376 18880
2422 1 6 . 1 1 28 28 LEU N N 28 121.860 121.860 118.296 3.564 18880
2423 1 6 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.390 -0.220 18880
2424 1 6 . 1 1 28 28 LEU C C 28 177.750 177.750 177.707 0.043 18880
2425 1 6 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.464 1.616 18880
2426 1 6 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.560 -0.290 18880
2427 1 6 . 1 1 28 28 LEU H H 28 7.950 7.950 7.537 0.413 18880
2428 1 6 . 1 1 29 29 ILE N N 29 119.260 119.260 119.461 -0.201 18880
2429 1 6 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.950 -0.050 18880
2430 1 6 . 1 1 29 29 ILE C C 29 177.140 177.140 177.724 -0.584 18880
2431 1 6 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.544 -0.244 18880
2432 1 6 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.805 1.475 18880
2433 1 6 . 1 1 29 29 ILE H H 29 7.950 7.950 7.954 -0.004 18880
2434 1 6 . 1 1 30 30 GLU N N 30 120.500 120.500 120.050 0.450 18880
2435 1 6 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.284 -0.234 18880
2436 1 6 . 1 1 30 30 GLU C C 30 177.560 177.560 176.525 1.035 18880
2437 1 6 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.673 0.417 18880
2438 1 6 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.311 0.279 18880
2439 1 6 . 1 1 30 30 GLU H H 30 8.220 8.220 8.059 0.161 18880
2440 1 6 . 1 1 31 31 ALA N N 31 121.550 121.550 120.437 1.113 18880
2441 1 6 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.423 -0.273 18880
2442 1 6 . 1 1 31 31 ALA C C 31 178.550 178.550 178.640 -0.090 18880
2443 1 6 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.657 0.143 18880
2444 1 6 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.418 -0.788 18880
2445 1 6 . 1 1 31 31 ALA H H 31 7.890 7.890 7.629 0.261 18880
2446 1 6 . 1 1 32 32 PHE N N 32 117.240 117.240 119.282 -2.042 18880
2447 1 6 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.147 0.153 18880
2448 1 6 . 1 1 32 32 PHE C C 32 176.210 176.210 175.970 0.240 18880
2449 1 6 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.326 -1.986 18880
2450 1 6 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.368 0.382 18880
2451 1 6 . 1 1 32 32 PHE H H 32 7.930 7.930 7.816 0.114 18880
2452 1 6 . 1 1 33 33 TYR N N 33 119.050 119.050 114.810 4.240 18880
2453 1 6 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.655 -0.325 18880
2454 1 6 . 1 1 33 33 TYR C C 33 175.680 175.680 175.132 0.548 18880
2455 1 6 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.704 1.216 18880
2456 1 6 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.728 1.812 18880
2457 1 6 . 1 1 33 33 TYR H H 33 7.950 7.950 8.375 -0.425 18880
2458 1 6 . 1 1 34 34 ASN N N 34 118.390 118.390 118.021 0.369 18880
2459 1 6 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.767 -0.137 18880
2460 1 6 . 1 1 34 34 ASN C C 34 174.810 174.810 173.564 1.246 18880
2461 1 6 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.577 -0.427 18880
2462 1 6 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.537 -0.557 18880
2463 1 6 . 1 1 34 34 ASN H H 34 7.960 7.960 7.556 0.404 18880
2464 1 6 . 1 1 35 35 PHE N N 35 120.670 120.670 119.002 1.668 18880
2465 1 6 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.569 -0.119 18880
2466 1 6 . 1 1 35 35 PHE C C 35 175.310 175.310 172.676 2.634 18880
2467 1 6 . 1 1 35 35 PHE CA C 35 58.320 58.320 57.255 1.065 18880
2468 1 6 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.159 -0.739 18880
2469 1 6 . 1 1 35 35 PHE H H 35 7.830 7.830 7.841 -0.011 18880
2470 1 6 . 1 1 36 36 ASP N N 36 122.400 122.400 118.864 3.536 18880
2471 1 6 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.500 0.090 18880
2472 1 6 . 1 1 36 36 ASP C C 36 176.150 176.150 177.367 -1.217 18880
2473 1 6 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.177 0.893 18880
2474 1 6 . 1 1 36 36 ASP CB C 36 41.320 41.320 39.793 1.527 18880
2475 1 6 . 1 1 36 36 ASP H H 36 8.180 8.180 8.030 0.150 18880
2476 1 6 . 1 1 37 37 GLY N N 37 108.560 108.560 107.921 0.639 18880
2477 1 6 . 1 1 37 37 GLY C C 37 173.660 173.660 174.996 -1.336 18880
2478 1 6 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.889 -0.279 18880
2479 1 6 . 1 1 37 37 GLY H H 37 7.680 7.680 8.433 -0.753 18880
2480 1 6 . 1 1 38 38 ASP N N 38 120.010 120.010 118.252 1.758 18880
2481 1 6 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.728 -0.128 18880
2482 1 6 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.230 0.030 18880
2483 1 6 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.796 0.654 18880
2484 1 6 . 1 1 38 38 ASP H H 38 8.220 8.220 7.937 0.283 18880
2485 1 6 . 1 1 39 39 TYR N N 39 121.030 121.030 117.778 3.252 18880
2486 1 6 . 1 1 39 39 TYR HA H 39 4.390 4.390 3.834 0.556 18880
2487 1 6 . 1 1 39 39 TYR C C 39 175.290 175.290 176.070 -0.780 18880
2488 1 6 . 1 1 39 39 TYR CA C 39 58.200 58.200 60.558 -2.358 18880
2489 1 6 . 1 1 39 39 TYR CB C 39 39.170 39.170 37.105 2.065 18880
2490 1 6 . 1 1 39 39 TYR H H 39 8.090 8.090 8.262 -0.172 18880
2491 1 6 . 1 1 40 40 ASP N N 40 122.020 122.020 119.175 2.845 18880
2492 1 6 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.372 0.228 18880
2493 1 6 . 1 1 40 40 ASP C C 40 175.970 175.970 175.626 0.344 18880
2494 1 6 . 1 1 40 40 ASP CA C 40 54.220 54.220 55.429 -1.209 18880
2495 1 6 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.226 0.294 18880
2496 1 6 . 1 1 40 40 ASP H H 40 8.200 8.200 8.317 -0.117 18880
2497 1 6 . 1 1 41 41 GLY N N 41 108.330 108.330 105.553 2.777 18880
2498 1 6 . 1 1 41 41 GLY C C 41 173.000 173.000 172.665 0.335 18880
2499 1 6 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.682 0.737 18880
2500 1 6 . 1 1 41 41 GLY H H 41 7.830 7.830 8.170 -0.340 18880
2501 1 6 . 1 1 42 42 PHE N N 42 118.600 118.600 121.062 -2.462 18880
2502 1 6 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.370 0.890 18880
2503 1 6 . 1 1 42 42 PHE C C 42 175.660 175.660 174.736 0.924 18880
2504 1 6 . 1 1 42 42 PHE CA C 42 57.160 57.160 59.926 -2.766 18880
2505 1 6 . 1 1 42 42 PHE CB C 42 41.170 41.170 40.181 0.989 18880
2506 1 6 . 1 1 42 42 PHE H H 42 8.150 8.150 7.791 0.359 18880
2507 1 6 . 1 1 43 43 VAL N N 43 119.180 119.180 121.851 -2.671 18880
2508 1 6 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.121 0.549 18880
2509 1 6 . 1 1 43 43 VAL C C 43 175.110 175.110 173.565 1.545 18880
2510 1 6 . 1 1 43 43 VAL CA C 43 60.620 60.620 61.501 -0.881 18880
2511 1 6 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.878 -1.998 18880
2512 1 6 . 1 1 43 43 VAL H H 43 9.070 9.070 7.185 1.885 18880
2513 1 6 . 1 1 44 44 SER N N 44 121.380 121.380 122.870 -1.490 18880
2514 1 6 . 1 1 44 44 SER HA H 44 4.570 4.570 4.068 0.502 18880
2515 1 6 . 1 1 44 44 SER C C 44 175.660 175.660 175.389 0.271 18880
2516 1 6 . 1 1 44 44 SER CA C 44 57.720 57.720 57.784 -0.064 18880
2517 1 6 . 1 1 44 44 SER CB C 44 63.690 63.690 62.998 0.692 18880
2518 1 6 . 1 1 44 44 SER H H 44 9.140 9.140 8.252 0.888 18880
2519 1 6 . 1 1 45 45 VAL N N 45 122.720 122.720 124.955 -2.235 18880
2520 1 6 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.303 0.197 18880
2521 1 6 . 1 1 45 45 VAL C C 45 177.240 177.240 177.229 0.011 18880
2522 1 6 . 1 1 45 45 VAL CA C 45 66.270 66.270 67.206 -0.936 18880
2523 1 6 . 1 1 45 45 VAL CB C 45 31.450 31.450 31.012 0.438 18880
2524 1 6 . 1 1 45 45 VAL H H 45 8.140 8.140 8.307 -0.167 18880
2525 1 6 . 1 1 46 46 GLU N N 46 118.990 118.990 117.302 1.688 18880
2526 1 6 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.838 0.142 18880
2527 1 6 . 1 1 46 46 GLU C C 46 179.460 179.460 179.029 0.431 18880
2528 1 6 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.265 0.295 18880
2529 1 6 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.078 0.083 18880
2530 1 6 . 1 1 46 46 GLU H H 46 8.230 8.230 7.728 0.502 18880
2531 1 6 . 1 1 47 47 GLU N N 47 120.120 120.120 118.341 1.779 18880
2532 1 6 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.223 -0.143 18880
2533 1 6 . 1 1 47 47 GLU C C 47 179.170 179.170 178.469 0.701 18880
2534 1 6 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.863 1.027 18880
2535 1 6 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.741 0.079 18880
2536 1 6 . 1 1 47 47 GLU H H 47 7.880 7.880 7.454 0.426 18880
2537 1 6 . 1 1 48 48 PHE N N 48 120.830 120.830 121.158 -0.328 18880
2538 1 6 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.288 -0.098 18880
2539 1 6 . 1 1 48 48 PHE C C 48 176.920 176.920 177.602 -0.682 18880
2540 1 6 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.435 0.434 18880
2541 1 6 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.196 0.064 18880
2542 1 6 . 1 1 48 48 PHE H H 48 8.600 8.600 8.294 0.306 18880
2543 1 6 . 1 1 49 49 ARG N N 49 118.470 118.470 119.206 -0.736 18880
2544 1 6 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.117 -0.257 18880
2545 1 6 . 1 1 49 49 ARG C C 49 178.090 178.090 178.668 -0.578 18880
2546 1 6 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.467 -0.397 18880
2547 1 6 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.805 0.335 18880
2548 1 6 . 1 1 49 49 ARG H H 49 8.650 8.650 8.681 -0.031 18880
2549 1 6 . 1 1 50 50 GLY N N 50 105.080 105.080 105.399 -0.319 18880
2550 1 6 . 1 1 50 50 GLY C C 50 175.090 175.090 175.859 -0.769 18880
2551 1 6 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.801 -0.121 18880
2552 1 6 . 1 1 50 50 GLY H H 50 7.620 7.620 8.511 -0.891 18880
2553 1 6 . 1 1 51 51 ILE N N 51 121.440 121.440 120.586 0.854 18880
2554 1 6 . 1 1 51 51 ILE HA H 51 3.830 3.830 4.037 -0.207 18880
2555 1 6 . 1 1 51 51 ILE C C 51 178.300 178.300 177.011 1.289 18880
2556 1 6 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.370 0.470 18880
2557 1 6 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.581 -0.271 18880
2558 1 6 . 1 1 51 51 ILE H H 51 7.470 7.470 7.536 -0.066 18880
2559 1 6 . 1 1 52 52 ILE N N 52 118.930 118.930 118.852 0.078 18880
2560 1 6 . 1 1 52 52 ILE HA H 52 3.740 3.740 4.019 -0.279 18880
2561 1 6 . 1 1 52 52 ILE CA C 52 63.760 63.760 61.663 2.098 18880
2562 1 6 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.392 0.638 18880
2563 1 6 . 1 1 52 52 ILE H H 52 7.790 7.790 7.817 -0.027 18880
2564 1 6 . 1 1 53 53 ARG N N 53 120.140 120.140 118.376 1.764 18880
2565 1 6 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.085 0.005 18880
2566 1 6 . 1 1 53 53 ARG C C 53 177.380 177.380 177.459 -0.079 18880
2567 1 6 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.085 1.025 18880
2568 1 6 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.477 -0.897 18880
2569 1 6 . 1 1 53 53 ARG H H 53 7.930 7.930 8.405 -0.475 18880
2570 1 6 . 1 1 54 54 ASP N N 54 117.500 117.500 116.583 0.917 18880
2571 1 6 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.761 -0.161 18880
2572 1 6 . 1 1 54 54 ASP C C 54 176.930 176.930 176.430 0.500 18880
2573 1 6 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.089 1.451 18880
2574 1 6 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.336 -0.236 18880
2575 1 6 . 1 1 54 54 ASP H H 54 7.870 7.870 7.689 0.181 18880
2576 1 6 . 1 1 55 55 GLY N N 55 106.370 106.370 107.788 -1.418 18880
2577 1 6 . 1 1 55 55 GLY C C 55 173.460 173.460 173.914 -0.454 18880
2578 1 6 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.410 0.590 18880
2579 1 6 . 1 1 55 55 GLY H H 55 7.880 7.880 8.140 -0.260 18880
2580 1 6 . 1 1 56 56 LEU N N 56 122.630 122.630 122.461 0.169 18880
2581 1 6 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.948 -0.178 18880
2582 1 6 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.886 0.604 18880
2583 1 6 . 1 1 56 56 LEU CB C 56 43.120 43.120 43.031 0.089 18880
2584 1 6 . 1 1 56 56 LEU H H 56 8.220 8.220 8.018 0.202 18880
2585 1 6 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.532 0.048 18880
2586 1 6 . 1 1 57 57 PRO C C 57 176.150 176.150 175.895 0.255 18880
2587 1 6 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.226 -0.806 18880
2588 1 6 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.738 -0.998 18880
2589 1 6 . 1 1 58 58 MET N N 58 121.810 121.810 123.997 -2.187 18880
2590 1 6 . 1 1 58 58 MET HA H 58 4.630 4.630 4.656 -0.026 18880
2591 1 6 . 1 1 58 58 MET C C 58 176.150 176.150 174.532 1.618 18880
2592 1 6 . 1 1 58 58 MET CA C 58 55.560 55.560 54.623 0.937 18880
2593 1 6 . 1 1 58 58 MET CB C 58 36.820 36.820 36.759 0.061 18880
2594 1 6 . 1 1 58 58 MET H H 58 7.690 7.690 8.278 -0.588 18880
2595 1 6 . 1 1 59 59 THR N N 59 114.180 114.180 114.782 -0.602 18880
2596 1 6 . 1 1 59 59 THR HA H 59 4.450 4.450 4.591 -0.141 18880
2597 1 6 . 1 1 59 59 THR C C 59 175.170 175.170 175.982 -0.812 18880
2598 1 6 . 1 1 59 59 THR CA C 59 60.780 60.780 61.476 -0.696 18880
2599 1 6 . 1 1 59 59 THR CB C 59 71.060 71.060 69.625 1.435 18880
2600 1 6 . 1 1 59 59 THR H H 59 8.940 8.940 8.369 0.571 18880
2601 1 6 . 1 1 60 60 GLU N N 60 120.620 120.620 125.679 -5.059 18880
2602 1 6 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.825 0.185 18880
2603 1 6 . 1 1 60 60 GLU C C 60 179.010 179.010 178.177 0.833 18880
2604 1 6 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.730 0.090 18880
2605 1 6 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.648 0.402 18880
2606 1 6 . 1 1 60 60 GLU H H 60 8.850 8.850 9.015 -0.165 18880
2607 1 6 . 1 1 61 61 ALA N N 61 121.080 121.080 122.739 -1.659 18880
2608 1 6 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.896 0.244 18880
2609 1 6 . 1 1 61 61 ALA C C 61 180.350 180.350 179.947 0.403 18880
2610 1 6 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.331 -0.241 18880
2611 1 6 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.984 0.226 18880
2612 1 6 . 1 1 61 61 ALA H H 61 8.370 8.370 8.483 -0.113 18880
2613 1 6 . 1 1 62 62 GLU N N 62 118.890 118.890 118.828 0.062 18880
2614 1 6 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.796 0.204 18880
2615 1 6 . 1 1 62 62 GLU C C 62 179.690 179.690 179.015 0.675 18880
2616 1 6 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.737 0.253 18880
2617 1 6 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.870 1.440 18880
2618 1 6 . 1 1 62 62 GLU H H 62 7.680 7.680 7.812 -0.132 18880
2619 1 6 . 1 1 63 63 ILE N N 63 122.340 122.340 120.081 2.259 18880
2620 1 6 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.622 -0.052 18880
2621 1 6 . 1 1 63 63 ILE C C 63 177.260 177.260 178.568 -1.308 18880
2622 1 6 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.930 0.960 18880
2623 1 6 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.262 0.718 18880
2624 1 6 . 1 1 63 63 ILE H H 63 8.420 8.420 7.993 0.427 18880
2625 1 6 . 1 1 64 64 THR N N 64 116.970 116.970 115.993 0.977 18880
2626 1 6 . 1 1 64 64 THR HA H 64 3.940 3.940 4.093 -0.153 18880
2627 1 6 . 1 1 64 64 THR C C 64 176.520 176.520 176.841 -0.321 18880
2628 1 6 . 1 1 64 64 THR CA C 64 67.060 67.060 67.328 -0.268 18880
2629 1 6 . 1 1 64 64 THR CB C 64 68.750 68.750 68.416 0.334 18880
2630 1 6 . 1 1 64 64 THR H H 64 8.310 8.310 8.632 -0.322 18880
2631 1 6 . 1 1 65 65 GLU N N 65 120.760 120.760 120.167 0.593 18880
2632 1 6 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.104 -0.074 18880
2633 1 6 . 1 1 65 65 GLU C C 65 175.830 175.830 178.023 -2.193 18880
2634 1 6 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.561 0.939 18880
2635 1 6 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.089 0.681 18880
2636 1 6 . 1 1 65 65 GLU H H 65 7.970 7.970 8.502 -0.532 18880
2637 1 6 . 1 1 66 66 PHE N N 66 120.940 120.940 117.868 3.072 18880
2638 1 6 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.502 -0.262 18880
2639 1 6 . 1 1 66 66 PHE C C 66 177.330 177.330 177.194 0.136 18880
2640 1 6 . 1 1 66 66 PHE CA C 66 61.200 61.200 59.327 1.873 18880
2641 1 6 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.491 -0.961 18880
2642 1 6 . 1 1 66 66 PHE H H 66 8.100 8.100 7.765 0.335 18880
2643 1 6 . 1 1 67 67 PHE N N 67 118.110 118.110 119.766 -1.656 18880
2644 1 6 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.176 -0.226 18880
2645 1 6 . 1 1 67 67 PHE C C 67 178.090 178.090 177.761 0.329 18880
2646 1 6 . 1 1 67 67 PHE CA C 67 61.200 61.200 60.289 0.911 18880
2647 1 6 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.723 -0.473 18880
2648 1 6 . 1 1 67 67 PHE H H 67 8.380 8.380 8.696 -0.316 18880
2649 1 6 . 1 1 68 68 GLU N N 68 119.650 119.650 117.730 1.920 18880
2650 1 6 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.268 -0.258 18880
2651 1 6 . 1 1 68 68 GLU C C 68 177.910 177.910 176.851 1.059 18880
2652 1 6 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.350 0.890 18880
2653 1 6 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.898 -0.528 18880
2654 1 6 . 1 1 68 68 GLU H H 68 8.230 8.230 7.983 0.247 18880
2655 1 6 . 1 1 69 69 ALA N N 69 119.090 119.090 120.188 -1.098 18880
2656 1 6 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.413 -0.233 18880
2657 1 6 . 1 1 69 69 ALA C C 69 179.030 179.030 178.308 0.722 18880
2658 1 6 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.668 -0.068 18880
2659 1 6 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.737 0.043 18880
2660 1 6 . 1 1 69 69 ALA H H 69 7.340 7.340 7.816 -0.476 18880
2661 1 6 . 1 1 70 70 ALA N N 70 118.670 118.670 119.621 -0.951 18880
2662 1 6 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.424 -0.404 18880
2663 1 6 . 1 1 70 70 ALA C C 70 176.820 176.820 176.548 0.272 18880
2664 1 6 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.523 0.567 18880
2665 1 6 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.270 -0.660 18880
2666 1 6 . 1 1 70 70 ALA H H 70 8.050 8.050 7.918 0.133 18880
2667 1 6 . 1 1 71 71 ASP N N 71 116.780 116.780 117.586 -0.806 18880
2668 1 6 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.163 0.057 18880
2669 1 6 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.377 1.773 18880
2670 1 6 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.739 -1.829 18880
2671 1 6 . 1 1 71 71 ASP H H 71 8.010 8.010 7.560 0.450 18880
2672 1 6 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.370 0.100 18880
2673 1 6 . 1 1 72 72 PRO C C 72 177.970 177.970 177.497 0.473 18880
2674 1 6 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.948 -0.038 18880
2675 1 6 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.592 -0.712 18880
2676 1 6 . 1 1 73 73 ASN N N 73 114.930 114.930 117.506 -2.576 18880
2677 1 6 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.520 0.360 18880
2678 1 6 . 1 1 73 73 ASN C C 73 174.880 174.880 175.360 -0.480 18880
2679 1 6 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.952 -1.112 18880
2680 1 6 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.427 -0.047 18880
2681 1 6 . 1 1 73 73 ASN H H 73 9.030 9.030 8.328 0.702 18880
2682 1 6 . 1 1 74 74 ASN N N 74 118.340 118.340 112.202 6.138 18880
2683 1 6 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.583 -0.223 18880
2684 1 6 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.958 0.632 18880
2685 1 6 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.339 0.821 18880
2686 1 6 . 1 1 74 74 ASN H H 74 8.320 8.320 8.672 -0.352 18880
2687 1 6 . 1 1 75 75 THR N N 75 113.450 113.450 110.909 2.541 18880
2688 1 6 . 1 1 75 75 THR HA H 75 4.210 4.210 4.534 -0.324 18880
2689 1 6 . 1 1 75 75 THR CA C 75 63.410 63.410 60.552 2.858 18880
2690 1 6 . 1 1 75 75 THR CB C 75 70.540 70.540 68.713 1.827 18880
2691 1 6 . 1 1 75 75 THR H H 75 9.870 9.870 8.579 1.291 18880
2692 1 6 . 1 1 76 76 GLY N N 76 111.810 111.810 109.178 2.632 18880
2693 1 6 . 1 1 76 76 GLY C C 76 173.670 173.670 174.131 -0.461 18880
2694 1 6 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.841 -0.721 18880
2695 1 6 . 1 1 76 76 GLY H H 76 10.250 10.250 8.528 1.722 18880
2696 1 6 . 1 1 77 77 PHE N N 77 120.560 120.560 118.777 1.783 18880
2697 1 6 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.937 0.213 18880
2698 1 6 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.074 0.106 18880
2699 1 6 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.905 1.595 18880
2700 1 6 . 1 1 77 77 PHE H H 77 8.110 8.110 7.663 0.447 18880
2701 1 6 . 1 1 78 78 ILE N N 78 116.410 116.410 122.546 -6.136 18880
2702 1 6 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.302 0.088 18880
2703 1 6 . 1 1 78 78 ILE C C 78 174.770 174.770 174.015 0.755 18880
2704 1 6 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.752 -0.562 18880
2705 1 6 . 1 1 78 78 ILE CB C 78 41.180 41.180 41.619 -0.439 18880
2706 1 6 . 1 1 78 78 ILE H H 78 8.930 8.930 7.725 1.205 18880
2707 1 6 . 1 1 79 79 ASP N N 79 125.220 125.220 126.603 -1.383 18880
2708 1 6 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.001 -0.501 18880
2709 1 6 . 1 1 79 79 ASP C C 79 176.490 176.490 176.835 -0.345 18880
2710 1 6 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.679 -0.369 18880
2711 1 6 . 1 1 79 79 ASP CB C 79 41.370 41.370 41.195 0.175 18880
2712 1 6 . 1 1 79 79 ASP H H 79 8.610 8.610 8.775 -0.165 18880
2713 1 6 . 1 1 80 80 TYR N N 80 125.760 125.760 127.514 -1.754 18880
2714 1 6 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.028 -0.038 18880
2715 1 6 . 1 1 80 80 TYR C C 80 177.140 177.140 176.760 0.380 18880
2716 1 6 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.914 -1.334 18880
2717 1 6 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.758 0.132 18880
2718 1 6 . 1 1 80 80 TYR H H 80 8.460 8.460 8.232 0.228 18880
2719 1 6 . 1 1 81 81 LYS N N 81 118.320 118.320 118.378 -0.058 18880
2720 1 6 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.937 -0.037 18880
2721 1 6 . 1 1 81 81 LYS C C 81 179.090 179.090 178.356 0.734 18880
2722 1 6 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.887 -0.307 18880
2723 1 6 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.709 0.052 18880
2724 1 6 . 1 1 81 81 LYS H H 81 8.410 8.410 8.356 0.054 18880
2725 1 6 . 1 1 82 82 ALA N N 82 122.050 122.050 121.757 0.293 18880
2726 1 6 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.235 -0.105 18880
2727 1 6 . 1 1 82 82 ALA C C 82 179.740 179.740 179.377 0.363 18880
2728 1 6 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.679 -0.159 18880
2729 1 6 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.418 0.122 18880
2730 1 6 . 1 1 82 82 ALA H H 82 7.770 7.770 7.926 -0.156 18880
2731 1 6 . 1 1 83 83 PHE N N 83 117.810 117.810 116.976 0.834 18880
2732 1 6 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.252 0.038 18880
2733 1 6 . 1 1 83 83 PHE C C 83 176.460 176.460 176.581 -0.121 18880
2734 1 6 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.254 0.776 18880
2735 1 6 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.871 -0.351 18880
2736 1 6 . 1 1 83 83 PHE H H 83 7.780 7.780 7.652 0.128 18880
2737 1 6 . 1 1 84 84 ALA N N 84 121.530 121.530 122.161 -0.631 18880
2738 1 6 . 1 1 84 84 ALA HA H 84 3.660 3.660 3.843 -0.183 18880
2739 1 6 . 1 1 84 84 ALA C C 84 179.010 179.010 178.671 0.339 18880
2740 1 6 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.827 1.203 18880
2741 1 6 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.075 0.055 18880
2742 1 6 . 1 1 84 84 ALA H H 84 8.290 8.290 8.195 0.095 18880
2743 1 6 . 1 1 85 85 ALA N N 85 117.720 117.720 120.084 -2.364 18880
2744 1 6 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.199 -0.119 18880
2745 1 6 . 1 1 85 85 ALA C C 85 179.570 179.570 177.896 1.674 18880
2746 1 6 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.429 -0.059 18880
2747 1 6 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.565 -0.275 18880
2748 1 6 . 1 1 85 85 ALA H H 85 7.700 7.700 8.244 -0.544 18880
2749 1 6 . 1 1 86 86 MET N N 86 116.570 116.570 116.218 0.352 18880
2750 1 6 . 1 1 86 86 MET HA H 86 4.160 4.160 4.197 -0.037 18880
2751 1 6 . 1 1 86 86 MET C C 86 177.360 177.360 177.618 -0.258 18880
2752 1 6 . 1 1 86 86 MET CA C 86 57.380 57.380 57.277 0.103 18880
2753 1 6 . 1 1 86 86 MET CB C 86 32.720 32.720 32.554 0.166 18880
2754 1 6 . 1 1 86 86 MET H H 86 7.560 7.560 7.319 0.241 18880
2755 1 6 . 1 1 87 87 LEU N N 87 119.090 119.090 118.022 1.068 18880
2756 1 6 . 1 1 87 87 LEU HA H 87 3.970 3.970 3.989 -0.019 18880
2757 1 6 . 1 1 87 87 LEU C C 87 177.420 177.420 177.076 0.344 18880
2758 1 6 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.706 0.584 18880
2759 1 6 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.465 0.815 18880
2760 1 6 . 1 1 87 87 LEU H H 87 7.570 7.570 7.169 0.401 18880
2761 1 6 . 1 1 88 88 TYR N N 88 117.060 117.060 114.430 2.630 18880
2762 1 6 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.735 -0.145 18880
2763 1 6 . 1 1 88 88 TYR C C 88 175.870 175.870 174.987 0.883 18880
2764 1 6 . 1 1 88 88 TYR CA C 88 57.840 57.840 54.459 3.381 18880
2765 1 6 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.405 1.235 18880
2766 1 6 . 1 1 88 88 TYR H H 88 7.740 7.740 7.190 0.550 18880
2767 1 6 . 1 1 89 89 SER N N 89 115.980 115.980 118.929 -2.949 18880
2768 1 6 . 1 1 89 89 SER HA H 89 4.440 4.440 4.541 -0.101 18880
2769 1 6 . 1 1 89 89 SER C C 89 174.460 174.460 174.282 0.178 18880
2770 1 6 . 1 1 89 89 SER CA C 89 58.350 58.350 58.630 -0.280 18880
2771 1 6 . 1 1 89 89 SER CB C 89 63.990 63.990 61.700 2.290 18880
2772 1 6 . 1 1 89 89 SER H H 89 7.880 7.880 7.864 0.016 18880
2773 1 6 . 1 1 90 90 VAL N N 90 120.910 120.910 125.136 -4.226 18880
2774 1 6 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.328 -0.188 18880
2775 1 6 . 1 1 90 90 VAL C C 90 175.720 175.720 174.891 0.829 18880
2776 1 6 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.501 0.769 18880
2777 1 6 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.613 0.227 18880
2778 1 6 . 1 1 90 90 VAL H H 90 8.020 8.020 7.610 0.410 18880
2779 1 6 . 1 1 91 91 ASP N N 91 123.620 123.620 123.280 0.340 18880
2780 1 6 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.849 -0.219 18880
2781 1 6 . 1 1 91 91 ASP C C 91 176.000 176.000 175.899 0.101 18880
2782 1 6 . 1 1 91 91 ASP CA C 91 54.510 54.510 53.542 0.968 18880
2783 1 6 . 1 1 91 91 ASP CB C 91 41.440 41.440 40.690 0.750 18880
2784 1 6 . 1 1 91 91 ASP H H 91 8.310 8.310 8.325 -0.015 18880
2785 1 6 . 1 1 92 92 GLU N N 92 122.170 122.170 121.755 0.415 18880
2786 1 6 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.252 0.108 18880
2787 1 6 . 1 1 92 92 GLU C C 92 175.660 175.660 176.428 -0.768 18880
2788 1 6 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.738 -0.248 18880
2789 1 6 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.932 2.918 18880
2790 1 6 . 1 1 92 92 GLU H H 92 8.320 8.320 8.490 -0.170 18880
2791 1 7 . 1 1 10 10 HIS C C 10 176.040 176.040 174.252 1.788 18880
2792 1 7 . 1 1 11 11 SER N N 11 116.840 116.840 119.814 -2.974 18880
2793 1 7 . 1 1 11 11 SER HA H 11 4.430 4.430 4.534 -0.104 18880
2794 1 7 . 1 1 11 11 SER C C 11 174.630 174.630 174.732 -0.102 18880
2795 1 7 . 1 1 11 11 SER CA C 11 58.350 58.350 58.095 0.255 18880
2796 1 7 . 1 1 11 11 SER CB C 11 64.120 64.120 62.937 1.183 18880
2797 1 7 . 1 1 11 11 SER H H 11 8.360 8.360 8.645 -0.285 18880
2798 1 7 . 1 1 12 12 SER N N 12 118.030 118.030 120.916 -2.886 18880
2799 1 7 . 1 1 12 12 SER HA H 12 4.440 4.440 4.337 0.103 18880
2800 1 7 . 1 1 12 12 SER C C 12 174.880 174.880 174.214 0.666 18880
2801 1 7 . 1 1 12 12 SER CA C 12 58.680 58.680 58.349 0.331 18880
2802 1 7 . 1 1 12 12 SER CB C 12 63.890 63.890 63.331 0.559 18880
2803 1 7 . 1 1 12 12 SER H H 12 8.490 8.490 7.901 0.589 18880
2804 1 7 . 1 1 13 13 GLY N N 13 110.450 110.450 111.076 -0.626 18880
2805 1 7 . 1 1 13 13 GLY C C 13 173.790 173.790 174.715 -0.925 18880
2806 1 7 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.076 0.384 18880
2807 1 7 . 1 1 13 13 GLY H H 13 8.390 8.390 8.256 0.134 18880
2808 1 7 . 1 1 14 14 LEU N N 14 121.310 121.310 123.574 -2.264 18880
2809 1 7 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.603 -0.263 18880
2810 1 7 . 1 1 14 14 LEU C C 14 176.930 176.930 176.633 0.297 18880
2811 1 7 . 1 1 14 14 LEU CA C 14 55.200 55.200 56.107 -0.907 18880
2812 1 7 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.398 0.202 18880
2813 1 7 . 1 1 14 14 LEU H H 14 8.020 8.020 8.325 -0.305 18880
2814 1 7 . 1 1 15 15 VAL N N 15 121.550 121.550 112.552 8.998 18880
2815 1 7 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.443 -0.073 18880
2816 1 7 . 1 1 15 15 VAL CA C 15 59.720 59.720 59.895 -0.175 18880
2817 1 7 . 1 1 15 15 VAL CB C 15 32.770 32.770 32.354 0.416 18880
2818 1 7 . 1 1 15 15 VAL H H 15 8.030 8.030 7.423 0.607 18880
2819 1 7 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.344 0.026 18880
2820 1 7 . 1 1 16 16 PRO C C 16 176.720 176.720 177.715 -0.995 18880
2821 1 7 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.816 -2.166 18880
2822 1 7 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.148 0.092 18880
2823 1 7 . 1 1 17 17 ARG N N 17 121.890 121.890 118.495 3.395 18880
2824 1 7 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.318 -0.038 18880
2825 1 7 . 1 1 17 17 ARG C C 17 176.940 176.940 177.594 -0.654 18880
2826 1 7 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.474 -0.113 18880
2827 1 7 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.665 0.385 18880
2828 1 7 . 1 1 17 17 ARG H H 17 8.450 8.450 8.429 0.021 18880
2829 1 7 . 1 1 18 18 GLY N N 18 110.160 110.160 105.661 4.499 18880
2830 1 7 . 1 1 18 18 GLY C C 18 174.110 174.110 173.668 0.442 18880
2831 1 7 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.744 0.646 18880
2832 1 7 . 1 1 18 18 GLY H H 18 8.480 8.480 8.031 0.449 18880
2833 1 7 . 1 1 19 19 SER N N 19 115.500 115.500 113.817 1.683 18880
2834 1 7 . 1 1 19 19 SER HA H 19 4.400 4.400 4.504 -0.104 18880
2835 1 7 . 1 1 19 19 SER C C 19 174.380 174.380 173.656 0.724 18880
2836 1 7 . 1 1 19 19 SER CA C 19 58.610 58.610 58.527 0.083 18880
2837 1 7 . 1 1 19 19 SER CB C 19 63.830 63.830 63.857 -0.027 18880
2838 1 7 . 1 1 19 19 SER H H 19 8.210 8.210 8.122 0.088 18880
2839 1 7 . 1 1 20 20 HIS N N 20 120.770 120.770 122.383 -1.613 18880
2840 1 7 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.627 -0.017 18880
2841 1 7 . 1 1 20 20 HIS C C 20 174.870 174.870 174.278 0.592 18880
2842 1 7 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.166 -0.036 18880
2843 1 7 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.254 -0.544 18880
2844 1 7 . 1 1 20 20 HIS H H 20 8.590 8.590 8.260 0.330 18880
2845 1 7 . 1 1 21 21 MET N N 21 121.440 121.440 122.479 -1.039 18880
2846 1 7 . 1 1 21 21 MET HA H 21 4.470 4.470 4.693 -0.223 18880
2847 1 7 . 1 1 21 21 MET C C 21 176.030 176.030 176.318 -0.288 18880
2848 1 7 . 1 1 21 21 MET CA C 21 55.490 55.490 55.385 0.106 18880
2849 1 7 . 1 1 21 21 MET CB C 21 33.170 33.170 33.623 -0.453 18880
2850 1 7 . 1 1 21 21 MET H H 21 8.310 8.310 8.615 -0.305 18880
2851 1 7 . 1 1 22 22 SER N N 22 116.860 116.860 115.470 1.390 18880
2852 1 7 . 1 1 22 22 SER HA H 22 4.430 4.430 4.528 -0.098 18880
2853 1 7 . 1 1 22 22 SER C C 22 174.630 174.630 174.501 0.129 18880
2854 1 7 . 1 1 22 22 SER CA C 22 58.410 58.410 58.950 -0.540 18880
2855 1 7 . 1 1 22 22 SER CB C 22 64.030 64.030 63.451 0.579 18880
2856 1 7 . 1 1 22 22 SER H H 22 8.340 8.340 8.611 -0.271 18880
2857 1 7 . 1 1 23 23 ASP N N 23 122.660 122.660 120.692 1.968 18880
2858 1 7 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.797 -0.247 18880
2859 1 7 . 1 1 23 23 ASP C C 23 176.860 176.860 177.610 -0.750 18880
2860 1 7 . 1 1 23 23 ASP CA C 23 55.330 55.330 54.737 0.593 18880
2861 1 7 . 1 1 23 23 ASP CB C 23 41.000 41.000 41.178 -0.178 18880
2862 1 7 . 1 1 23 23 ASP H H 23 8.540 8.540 8.318 0.222 18880
2863 1 7 . 1 1 24 24 GLU N N 24 120.400 120.400 118.969 1.431 18880
2864 1 7 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.112 0.028 18880
2865 1 7 . 1 1 24 24 GLU C C 24 177.540 177.540 177.824 -0.284 18880
2866 1 7 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.700 -0.340 18880
2867 1 7 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.318 0.432 18880
2868 1 7 . 1 1 24 24 GLU H H 24 8.610 8.610 8.623 -0.013 18880
2869 1 7 . 1 1 25 25 LYS N N 25 120.390 120.390 117.564 2.826 18880
2870 1 7 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.347 -0.157 18880
2871 1 7 . 1 1 25 25 LYS C C 25 177.490 177.490 178.416 -0.926 18880
2872 1 7 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.975 0.135 18880
2873 1 7 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.682 -0.192 18880
2874 1 7 . 1 1 25 25 LYS H H 25 8.210 8.210 8.121 0.089 18880
2875 1 7 . 1 1 26 26 THR N N 26 114.880 114.880 115.906 -1.026 18880
2876 1 7 . 1 1 26 26 THR HA H 26 4.040 4.040 4.128 -0.088 18880
2877 1 7 . 1 1 26 26 THR C C 26 175.430 175.430 176.654 -1.224 18880
2878 1 7 . 1 1 26 26 THR CA C 26 64.620 64.620 65.749 -1.129 18880
2879 1 7 . 1 1 26 26 THR CB C 26 69.110 69.110 68.592 0.518 18880
2880 1 7 . 1 1 26 26 THR H H 26 8.080 8.080 7.551 0.529 18880
2881 1 7 . 1 1 27 27 GLN N N 27 120.940 120.940 122.589 -1.649 18880
2882 1 7 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.141 0.049 18880
2883 1 7 . 1 1 27 27 GLN C C 27 177.280 177.280 177.280 0.000 18880
2884 1 7 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.511 -0.961 18880
2885 1 7 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.490 0.600 18880
2886 1 7 . 1 1 27 27 GLN H H 27 8.240 8.240 7.888 0.352 18880
2887 1 7 . 1 1 28 28 LEU N N 28 121.860 121.860 118.468 3.392 18880
2888 1 7 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.371 -0.201 18880
2889 1 7 . 1 1 28 28 LEU C C 28 177.750 177.750 177.842 -0.092 18880
2890 1 7 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.206 1.874 18880
2891 1 7 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.579 -0.309 18880
2892 1 7 . 1 1 28 28 LEU H H 28 7.950 7.950 7.509 0.441 18880
2893 1 7 . 1 1 29 29 ILE N N 29 119.260 119.260 118.945 0.315 18880
2894 1 7 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.252 -0.352 18880
2895 1 7 . 1 1 29 29 ILE C C 29 177.140 177.140 177.707 -0.567 18880
2896 1 7 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.604 -0.304 18880
2897 1 7 . 1 1 29 29 ILE CB C 29 38.280 38.280 37.038 1.242 18880
2898 1 7 . 1 1 29 29 ILE H H 29 7.950 7.950 7.990 -0.040 18880
2899 1 7 . 1 1 30 30 GLU N N 30 120.500 120.500 118.864 1.636 18880
2900 1 7 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.433 -0.383 18880
2901 1 7 . 1 1 30 30 GLU C C 30 177.560 177.560 176.426 1.134 18880
2902 1 7 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.968 0.122 18880
2903 1 7 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.771 0.819 18880
2904 1 7 . 1 1 30 30 GLU H H 30 8.220 8.220 8.049 0.171 18880
2905 1 7 . 1 1 31 31 ALA N N 31 121.550 121.550 120.141 1.409 18880
2906 1 7 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.320 -0.170 18880
2907 1 7 . 1 1 31 31 ALA C C 31 178.550 178.550 178.538 0.012 18880
2908 1 7 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.449 0.351 18880
2909 1 7 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.253 -0.623 18880
2910 1 7 . 1 1 31 31 ALA H H 31 7.890 7.890 7.454 0.436 18880
2911 1 7 . 1 1 32 32 PHE N N 32 117.240 117.240 117.498 -0.258 18880
2912 1 7 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.151 0.149 18880
2913 1 7 . 1 1 32 32 PHE C C 32 176.210 176.210 176.653 -0.443 18880
2914 1 7 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.344 -2.004 18880
2915 1 7 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.627 1.123 18880
2916 1 7 . 1 1 32 32 PHE H H 32 7.930 7.930 7.360 0.570 18880
2917 1 7 . 1 1 33 33 TYR N N 33 119.050 119.050 115.515 3.535 18880
2918 1 7 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.853 -0.523 18880
2919 1 7 . 1 1 33 33 TYR C C 33 175.680 175.680 175.724 -0.044 18880
2920 1 7 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.826 1.094 18880
2921 1 7 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.874 1.665 18880
2922 1 7 . 1 1 33 33 TYR H H 33 7.950 7.950 7.873 0.077 18880
2923 1 7 . 1 1 34 34 ASN N N 34 118.390 118.390 118.508 -0.118 18880
2924 1 7 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.910 -0.280 18880
2925 1 7 . 1 1 34 34 ASN C C 34 174.810 174.810 173.469 1.341 18880
2926 1 7 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.543 -0.393 18880
2927 1 7 . 1 1 34 34 ASN CB C 34 38.980 38.980 40.144 -1.164 18880
2928 1 7 . 1 1 34 34 ASN H H 34 7.960 7.960 7.879 0.081 18880
2929 1 7 . 1 1 35 35 PHE N N 35 120.670 120.670 119.407 1.263 18880
2930 1 7 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.501 -0.051 18880
2931 1 7 . 1 1 35 35 PHE C C 35 175.310 175.310 172.426 2.884 18880
2932 1 7 . 1 1 35 35 PHE CA C 35 58.320 58.320 57.410 0.910 18880
2933 1 7 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.674 -0.254 18880
2934 1 7 . 1 1 35 35 PHE H H 35 7.830 7.830 7.840 -0.010 18880
2935 1 7 . 1 1 36 36 ASP N N 36 122.400 122.400 120.128 2.272 18880
2936 1 7 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.603 -0.013 18880
2937 1 7 . 1 1 36 36 ASP C C 36 176.150 176.150 176.199 -0.049 18880
2938 1 7 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.524 0.546 18880
2939 1 7 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.868 0.452 18880
2940 1 7 . 1 1 36 36 ASP H H 36 8.180 8.180 8.047 0.133 18880
2941 1 7 . 1 1 37 37 GLY N N 37 108.560 108.560 109.658 -1.098 18880
2942 1 7 . 1 1 37 37 GLY C C 37 173.660 173.660 173.915 -0.255 18880
2943 1 7 . 1 1 37 37 GLY CA C 37 45.610 45.610 44.657 0.953 18880
2944 1 7 . 1 1 37 37 GLY H H 37 7.680 7.680 8.072 -0.392 18880
2945 1 7 . 1 1 38 38 ASP N N 38 120.010 120.010 118.215 1.795 18880
2946 1 7 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.330 0.270 18880
2947 1 7 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.898 -0.638 18880
2948 1 7 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.852 1.598 18880
2949 1 7 . 1 1 38 38 ASP H H 38 8.220 8.220 8.223 -0.003 18880
2950 1 7 . 1 1 39 39 TYR N N 39 121.030 121.030 122.132 -1.102 18880
2951 1 7 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.475 -0.085 18880
2952 1 7 . 1 1 39 39 TYR C C 39 175.290 175.290 175.338 -0.048 18880
2953 1 7 . 1 1 39 39 TYR CA C 39 58.200 58.200 59.019 -0.819 18880
2954 1 7 . 1 1 39 39 TYR CB C 39 39.170 39.170 39.467 -0.297 18880
2955 1 7 . 1 1 39 39 TYR H H 39 8.090 8.090 8.395 -0.305 18880
2956 1 7 . 1 1 40 40 ASP N N 40 122.020 122.020 116.276 5.744 18880
2957 1 7 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.538 0.062 18880
2958 1 7 . 1 1 40 40 ASP C C 40 175.970 175.970 175.810 0.160 18880
2959 1 7 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.499 0.721 18880
2960 1 7 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.682 -0.162 18880
2961 1 7 . 1 1 40 40 ASP H H 40 8.200 8.200 7.778 0.422 18880
2962 1 7 . 1 1 41 41 GLY N N 41 108.330 108.330 104.828 3.502 18880
2963 1 7 . 1 1 41 41 GLY C C 41 173.000 173.000 173.770 -0.770 18880
2964 1 7 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.204 1.216 18880
2965 1 7 . 1 1 41 41 GLY H H 41 7.830 7.830 8.083 -0.253 18880
2966 1 7 . 1 1 42 42 PHE N N 42 118.600 118.600 120.292 -1.692 18880
2967 1 7 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.465 0.795 18880
2968 1 7 . 1 1 42 42 PHE C C 42 175.660 175.660 175.433 0.227 18880
2969 1 7 . 1 1 42 42 PHE CA C 42 57.160 57.160 58.582 -1.422 18880
2970 1 7 . 1 1 42 42 PHE CB C 42 41.170 41.170 39.261 1.909 18880
2971 1 7 . 1 1 42 42 PHE H H 42 8.150 8.150 7.451 0.699 18880
2972 1 7 . 1 1 43 43 VAL N N 43 119.180 119.180 126.302 -7.122 18880
2973 1 7 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.357 0.313 18880
2974 1 7 . 1 1 43 43 VAL C C 43 175.110 175.110 174.607 0.503 18880
2975 1 7 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.483 0.138 18880
2976 1 7 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.316 -1.436 18880
2977 1 7 . 1 1 43 43 VAL H H 43 9.070 9.070 8.654 0.416 18880
2978 1 7 . 1 1 44 44 SER N N 44 121.380 121.380 123.074 -1.694 18880
2979 1 7 . 1 1 44 44 SER HA H 44 4.570 4.570 4.305 0.265 18880
2980 1 7 . 1 1 44 44 SER C C 44 175.660 175.660 175.269 0.391 18880
2981 1 7 . 1 1 44 44 SER CA C 44 57.720 57.720 57.857 -0.137 18880
2982 1 7 . 1 1 44 44 SER CB C 44 63.690 63.690 63.377 0.313 18880
2983 1 7 . 1 1 44 44 SER H H 44 9.140 9.140 8.382 0.758 18880
2984 1 7 . 1 1 45 45 VAL N N 45 122.720 122.720 122.928 -0.208 18880
2985 1 7 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.172 0.328 18880
2986 1 7 . 1 1 45 45 VAL C C 45 177.240 177.240 177.414 -0.174 18880
2987 1 7 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.671 -0.401 18880
2988 1 7 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.929 0.521 18880
2989 1 7 . 1 1 45 45 VAL H H 45 8.140 8.140 8.209 -0.069 18880
2990 1 7 . 1 1 46 46 GLU N N 46 118.990 118.990 118.792 0.198 18880
2991 1 7 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.705 0.275 18880
2992 1 7 . 1 1 46 46 GLU C C 46 179.460 179.460 179.137 0.323 18880
2993 1 7 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.571 -0.010 18880
2994 1 7 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.790 0.370 18880
2995 1 7 . 1 1 46 46 GLU H H 46 8.230 8.230 7.164 1.066 18880
2996 1 7 . 1 1 47 47 GLU N N 47 120.120 120.120 117.923 2.197 18880
2997 1 7 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.099 -0.019 18880
2998 1 7 . 1 1 47 47 GLU C C 47 179.170 179.170 178.780 0.390 18880
2999 1 7 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.361 0.529 18880
3000 1 7 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.458 0.362 18880
3001 1 7 . 1 1 47 47 GLU H H 47 7.880 7.880 8.118 -0.238 18880
3002 1 7 . 1 1 48 48 PHE N N 48 120.830 120.830 120.941 -0.111 18880
3003 1 7 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.126 0.064 18880
3004 1 7 . 1 1 48 48 PHE C C 48 176.920 176.920 177.346 -0.426 18880
3005 1 7 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.145 0.725 18880
3006 1 7 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.931 0.329 18880
3007 1 7 . 1 1 48 48 PHE H H 48 8.600 8.600 8.116 0.484 18880
3008 1 7 . 1 1 49 49 ARG N N 49 118.470 118.470 118.812 -0.342 18880
3009 1 7 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.094 -0.234 18880
3010 1 7 . 1 1 49 49 ARG C C 49 178.090 178.090 178.712 -0.622 18880
3011 1 7 . 1 1 49 49 ARG CA C 49 60.070 60.070 58.453 1.617 18880
3012 1 7 . 1 1 49 49 ARG CB C 49 30.140 30.140 28.779 1.361 18880
3013 1 7 . 1 1 49 49 ARG H H 49 8.650 8.650 8.457 0.193 18880
3014 1 7 . 1 1 50 50 GLY N N 50 105.080 105.080 105.926 -0.846 18880
3015 1 7 . 1 1 50 50 GLY C C 50 175.090 175.090 176.167 -1.077 18880
3016 1 7 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.873 -0.193 18880
3017 1 7 . 1 1 50 50 GLY H H 50 7.620 7.620 8.291 -0.671 18880
3018 1 7 . 1 1 51 51 ILE N N 51 121.440 121.440 120.152 1.288 18880
3019 1 7 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.915 -0.085 18880
3020 1 7 . 1 1 51 51 ILE C C 51 178.300 178.300 176.534 1.766 18880
3021 1 7 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.301 0.539 18880
3022 1 7 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.199 0.111 18880
3023 1 7 . 1 1 51 51 ILE H H 51 7.470 7.470 7.169 0.301 18880
3024 1 7 . 1 1 52 52 ILE N N 52 118.930 118.930 119.622 -0.692 18880
3025 1 7 . 1 1 52 52 ILE HA H 52 3.740 3.740 4.036 -0.296 18880
3026 1 7 . 1 1 52 52 ILE CA C 52 63.760 63.760 61.987 1.773 18880
3027 1 7 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.048 0.982 18880
3028 1 7 . 1 1 52 52 ILE H H 52 7.790 7.790 7.957 -0.167 18880
3029 1 7 . 1 1 53 53 ARG N N 53 120.140 120.140 121.507 -1.367 18880
3030 1 7 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.026 0.064 18880
3031 1 7 . 1 1 53 53 ARG C C 53 177.380 177.380 177.180 0.200 18880
3032 1 7 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.517 0.593 18880
3033 1 7 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.428 -0.848 18880
3034 1 7 . 1 1 53 53 ARG H H 53 7.930 7.930 8.462 -0.532 18880
3035 1 7 . 1 1 54 54 ASP N N 54 117.500 117.500 116.886 0.614 18880
3036 1 7 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.842 -0.242 18880
3037 1 7 . 1 1 54 54 ASP C C 54 176.930 176.930 175.742 1.188 18880
3038 1 7 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.240 1.300 18880
3039 1 7 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.863 -0.763 18880
3040 1 7 . 1 1 54 54 ASP H H 54 7.870 7.870 7.828 0.042 18880
3041 1 7 . 1 1 55 55 GLY N N 55 106.370 106.370 108.701 -2.331 18880
3042 1 7 . 1 1 55 55 GLY C C 55 173.460 173.460 173.850 -0.390 18880
3043 1 7 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.308 0.692 18880
3044 1 7 . 1 1 55 55 GLY H H 55 7.880 7.880 7.478 0.402 18880
3045 1 7 . 1 1 56 56 LEU N N 56 122.630 122.630 121.883 0.747 18880
3046 1 7 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.824 -0.054 18880
3047 1 7 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.711 0.779 18880
3048 1 7 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.432 0.688 18880
3049 1 7 . 1 1 56 56 LEU H H 56 8.220 8.220 7.955 0.265 18880
3050 1 7 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.469 0.111 18880
3051 1 7 . 1 1 57 57 PRO C C 57 176.150 176.150 175.834 0.316 18880
3052 1 7 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.502 -0.082 18880
3053 1 7 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.170 0.570 18880
3054 1 7 . 1 1 58 58 MET N N 58 121.810 121.810 121.221 0.589 18880
3055 1 7 . 1 1 58 58 MET HA H 58 4.630 4.630 4.427 0.203 18880
3056 1 7 . 1 1 58 58 MET C C 58 176.150 176.150 175.605 0.545 18880
3057 1 7 . 1 1 58 58 MET CA C 58 55.560 55.560 55.567 -0.007 18880
3058 1 7 . 1 1 58 58 MET CB C 58 36.820 36.820 34.091 2.729 18880
3059 1 7 . 1 1 58 58 MET H H 58 7.690 7.690 7.794 -0.104 18880
3060 1 7 . 1 1 59 59 THR N N 59 114.180 114.180 114.695 -0.515 18880
3061 1 7 . 1 1 59 59 THR HA H 59 4.450 4.450 4.399 0.051 18880
3062 1 7 . 1 1 59 59 THR C C 59 175.170 175.170 175.656 -0.486 18880
3063 1 7 . 1 1 59 59 THR CA C 59 60.780 60.780 60.649 0.131 18880
3064 1 7 . 1 1 59 59 THR CB C 59 71.060 71.060 69.597 1.463 18880
3065 1 7 . 1 1 59 59 THR H H 59 8.940 8.940 8.150 0.790 18880
3066 1 7 . 1 1 60 60 GLU N N 60 120.620 120.620 125.709 -5.089 18880
3067 1 7 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.710 0.300 18880
3068 1 7 . 1 1 60 60 GLU C C 60 179.010 179.010 178.117 0.893 18880
3069 1 7 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.703 0.117 18880
3070 1 7 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.652 0.398 18880
3071 1 7 . 1 1 60 60 GLU H H 60 8.850 8.850 8.905 -0.055 18880
3072 1 7 . 1 1 61 61 ALA N N 61 121.080 121.080 122.523 -1.443 18880
3073 1 7 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.898 0.242 18880
3074 1 7 . 1 1 61 61 ALA C C 61 180.350 180.350 179.947 0.403 18880
3075 1 7 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.283 -0.193 18880
3076 1 7 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.996 0.214 18880
3077 1 7 . 1 1 61 61 ALA H H 61 8.370 8.370 8.436 -0.066 18880
3078 1 7 . 1 1 62 62 GLU N N 62 118.890 118.890 118.699 0.191 18880
3079 1 7 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.540 0.460 18880
3080 1 7 . 1 1 62 62 GLU C C 62 179.690 179.690 178.547 1.143 18880
3081 1 7 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.392 0.598 18880
3082 1 7 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.412 1.898 18880
3083 1 7 . 1 1 62 62 GLU H H 62 7.680 7.680 7.708 -0.028 18880
3084 1 7 . 1 1 63 63 ILE N N 63 122.340 122.340 119.860 2.480 18880
3085 1 7 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.240 0.330 18880
3086 1 7 . 1 1 63 63 ILE C C 63 177.260 177.260 178.343 -1.083 18880
3087 1 7 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.698 1.192 18880
3088 1 7 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.014 0.966 18880
3089 1 7 . 1 1 63 63 ILE H H 63 8.420 8.420 7.660 0.760 18880
3090 1 7 . 1 1 64 64 THR N N 64 116.970 116.970 115.783 1.187 18880
3091 1 7 . 1 1 64 64 THR HA H 64 3.940 3.940 4.006 -0.066 18880
3092 1 7 . 1 1 64 64 THR C C 64 176.520 176.520 176.872 -0.352 18880
3093 1 7 . 1 1 64 64 THR CA C 64 67.060 67.060 67.242 -0.182 18880
3094 1 7 . 1 1 64 64 THR CB C 64 68.750 68.750 68.391 0.359 18880
3095 1 7 . 1 1 64 64 THR H H 64 8.310 8.310 8.510 -0.200 18880
3096 1 7 . 1 1 65 65 GLU N N 65 120.760 120.760 120.141 0.619 18880
3097 1 7 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.233 -0.203 18880
3098 1 7 . 1 1 65 65 GLU C C 65 175.830 175.830 178.905 -3.075 18880
3099 1 7 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.974 0.526 18880
3100 1 7 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.417 0.353 18880
3101 1 7 . 1 1 65 65 GLU H H 65 7.970 7.970 8.559 -0.589 18880
3102 1 7 . 1 1 66 66 PHE N N 66 120.940 120.940 118.126 2.814 18880
3103 1 7 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.367 -0.127 18880
3104 1 7 . 1 1 66 66 PHE C C 66 177.330 177.330 176.731 0.599 18880
3105 1 7 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.464 2.736 18880
3106 1 7 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.001 -0.471 18880
3107 1 7 . 1 1 66 66 PHE H H 66 8.100 8.100 7.836 0.264 18880
3108 1 7 . 1 1 67 67 PHE N N 67 118.110 118.110 118.887 -0.777 18880
3109 1 7 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.494 -0.544 18880
3110 1 7 . 1 1 67 67 PHE C C 67 178.090 178.090 177.844 0.246 18880
3111 1 7 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.579 1.621 18880
3112 1 7 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.858 -0.609 18880
3113 1 7 . 1 1 67 67 PHE H H 67 8.380 8.380 8.578 -0.198 18880
3114 1 7 . 1 1 68 68 GLU N N 68 119.650 119.650 118.273 1.377 18880
3115 1 7 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.325 -0.315 18880
3116 1 7 . 1 1 68 68 GLU C C 68 177.910 177.910 177.376 0.534 18880
3117 1 7 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.394 0.846 18880
3118 1 7 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.741 -0.371 18880
3119 1 7 . 1 1 68 68 GLU H H 68 8.230 8.230 8.278 -0.048 18880
3120 1 7 . 1 1 69 69 ALA N N 69 119.090 119.090 120.792 -1.702 18880
3121 1 7 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.234 -0.054 18880
3122 1 7 . 1 1 69 69 ALA C C 69 179.030 179.030 178.287 0.743 18880
3123 1 7 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.892 -0.292 18880
3124 1 7 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.595 0.185 18880
3125 1 7 . 1 1 69 69 ALA H H 69 7.340 7.340 7.674 -0.334 18880
3126 1 7 . 1 1 70 70 ALA N N 70 118.670 118.670 119.370 -0.700 18880
3127 1 7 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.378 -0.358 18880
3128 1 7 . 1 1 70 70 ALA C C 70 176.820 176.820 176.493 0.327 18880
3129 1 7 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.442 0.648 18880
3130 1 7 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.581 -0.971 18880
3131 1 7 . 1 1 70 70 ALA H H 70 8.050 8.050 7.833 0.217 18880
3132 1 7 . 1 1 71 71 ASP N N 71 116.780 116.780 118.324 -1.544 18880
3133 1 7 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.160 0.060 18880
3134 1 7 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.462 1.688 18880
3135 1 7 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.957 -2.047 18880
3136 1 7 . 1 1 71 71 ASP H H 71 8.010 8.010 7.599 0.411 18880
3137 1 7 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.443 0.027 18880
3138 1 7 . 1 1 72 72 PRO C C 72 177.970 177.970 177.490 0.480 18880
3139 1 7 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.497 0.413 18880
3140 1 7 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.440 -0.560 18880
3141 1 7 . 1 1 73 73 ASN N N 73 114.930 114.930 116.724 -1.794 18880
3142 1 7 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.551 0.329 18880
3143 1 7 . 1 1 73 73 ASN C C 73 174.880 174.880 174.943 -0.063 18880
3144 1 7 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.980 -1.140 18880
3145 1 7 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.744 -0.364 18880
3146 1 7 . 1 1 73 73 ASN H H 73 9.030 9.030 8.483 0.547 18880
3147 1 7 . 1 1 74 74 ASN N N 74 118.340 118.340 111.733 6.607 18880
3148 1 7 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.582 -0.222 18880
3149 1 7 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.119 0.471 18880
3150 1 7 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.131 1.029 18880
3151 1 7 . 1 1 74 74 ASN H H 74 8.320 8.320 8.381 -0.061 18880
3152 1 7 . 1 1 75 75 THR N N 75 113.450 113.450 114.374 -0.924 18880
3153 1 7 . 1 1 75 75 THR HA H 75 4.210 4.210 4.237 -0.027 18880
3154 1 7 . 1 1 75 75 THR CA C 75 63.410 63.410 64.124 -0.714 18880
3155 1 7 . 1 1 75 75 THR CB C 75 70.540 70.540 69.521 1.019 18880
3156 1 7 . 1 1 75 75 THR H H 75 9.870 9.870 8.213 1.657 18880
3157 1 7 . 1 1 76 76 GLY N N 76 111.810 111.810 108.031 3.779 18880
3158 1 7 . 1 1 76 76 GLY C C 76 173.670 173.670 172.937 0.733 18880
3159 1 7 . 1 1 76 76 GLY CA C 76 45.120 45.120 44.708 0.412 18880
3160 1 7 . 1 1 76 76 GLY H H 76 10.250 10.250 8.153 2.097 18880
3161 1 7 . 1 1 77 77 PHE N N 77 120.560 120.560 118.824 1.736 18880
3162 1 7 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.844 0.306 18880
3163 1 7 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.875 0.305 18880
3164 1 7 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.486 1.014 18880
3165 1 7 . 1 1 77 77 PHE H H 77 8.110 8.110 7.651 0.459 18880
3166 1 7 . 1 1 78 78 ILE N N 78 116.410 116.410 120.131 -3.721 18880
3167 1 7 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.332 0.058 18880
3168 1 7 . 1 1 78 78 ILE C C 78 174.770 174.770 174.610 0.160 18880
3169 1 7 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.863 -0.673 18880
3170 1 7 . 1 1 78 78 ILE CB C 78 41.180 41.180 41.745 -0.565 18880
3171 1 7 . 1 1 78 78 ILE H H 78 8.930 8.930 8.206 0.724 18880
3172 1 7 . 1 1 79 79 ASP N N 79 125.220 125.220 126.056 -0.836 18880
3173 1 7 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.986 -0.486 18880
3174 1 7 . 1 1 79 79 ASP C C 79 176.490 176.490 177.220 -0.730 18880
3175 1 7 . 1 1 79 79 ASP CA C 79 53.310 53.310 54.639 -1.329 18880
3176 1 7 . 1 1 79 79 ASP CB C 79 41.370 41.370 41.044 0.326 18880
3177 1 7 . 1 1 79 79 ASP H H 79 8.610 8.610 8.924 -0.314 18880
3178 1 7 . 1 1 80 80 TYR N N 80 125.760 125.760 129.148 -3.388 18880
3179 1 7 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.097 -0.107 18880
3180 1 7 . 1 1 80 80 TYR C C 80 177.140 177.140 176.807 0.333 18880
3181 1 7 . 1 1 80 80 TYR CA C 80 61.580 61.580 61.691 -0.111 18880
3182 1 7 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.442 0.448 18880
3183 1 7 . 1 1 80 80 TYR H H 80 8.460 8.460 8.933 -0.473 18880
3184 1 7 . 1 1 81 81 LYS N N 81 118.320 118.320 118.002 0.318 18880
3185 1 7 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.839 0.061 18880
3186 1 7 . 1 1 81 81 LYS C C 81 179.090 179.090 178.851 0.239 18880
3187 1 7 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.568 0.012 18880
3188 1 7 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.763 -0.003 18880
3189 1 7 . 1 1 81 81 LYS H H 81 8.410 8.410 8.483 -0.073 18880
3190 1 7 . 1 1 82 82 ALA N N 82 122.050 122.050 121.614 0.436 18880
3191 1 7 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.188 -0.058 18880
3192 1 7 . 1 1 82 82 ALA C C 82 179.740 179.740 179.492 0.248 18880
3193 1 7 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.777 -0.257 18880
3194 1 7 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.328 0.212 18880
3195 1 7 . 1 1 82 82 ALA H H 82 7.770 7.770 8.129 -0.359 18880
3196 1 7 . 1 1 83 83 PHE N N 83 117.810 117.810 116.883 0.927 18880
3197 1 7 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.408 -0.118 18880
3198 1 7 . 1 1 83 83 PHE C C 83 176.460 176.460 177.709 -1.249 18880
3199 1 7 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.822 0.208 18880
3200 1 7 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.062 -0.541 18880
3201 1 7 . 1 1 83 83 PHE H H 83 7.780 7.780 7.589 0.191 18880
3202 1 7 . 1 1 84 84 ALA N N 84 121.530 121.530 122.617 -1.087 18880
3203 1 7 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.120 -0.460 18880
3204 1 7 . 1 1 84 84 ALA C C 84 179.010 179.010 179.131 -0.121 18880
3205 1 7 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.239 0.791 18880
3206 1 7 . 1 1 84 84 ALA CB C 84 18.130 18.130 17.838 0.292 18880
3207 1 7 . 1 1 84 84 ALA H H 84 8.290 8.290 8.559 -0.269 18880
3208 1 7 . 1 1 85 85 ALA N N 85 117.720 117.720 121.229 -3.509 18880
3209 1 7 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.345 -0.265 18880
3210 1 7 . 1 1 85 85 ALA C C 85 179.570 179.570 178.391 1.179 18880
3211 1 7 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.154 0.216 18880
3212 1 7 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.457 -0.167 18880
3213 1 7 . 1 1 85 85 ALA H H 85 7.700 7.700 8.351 -0.651 18880
3214 1 7 . 1 1 86 86 MET N N 86 116.570 116.570 115.044 1.526 18880
3215 1 7 . 1 1 86 86 MET HA H 86 4.160 4.160 4.154 0.006 18880
3216 1 7 . 1 1 86 86 MET C C 86 177.360 177.360 176.893 0.467 18880
3217 1 7 . 1 1 86 86 MET CA C 86 57.380 57.380 56.754 0.626 18880
3218 1 7 . 1 1 86 86 MET CB C 86 32.720 32.720 32.559 0.161 18880
3219 1 7 . 1 1 86 86 MET H H 86 7.560 7.560 7.331 0.229 18880
3220 1 7 . 1 1 87 87 LEU N N 87 119.090 119.090 115.813 3.277 18880
3221 1 7 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.131 -0.161 18880
3222 1 7 . 1 1 87 87 LEU C C 87 177.420 177.420 176.397 1.023 18880
3223 1 7 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.103 1.187 18880
3224 1 7 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.246 0.034 18880
3225 1 7 . 1 1 87 87 LEU H H 87 7.570 7.570 7.255 0.315 18880
3226 1 7 . 1 1 88 88 TYR N N 88 117.060 117.060 116.031 1.029 18880
3227 1 7 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.664 -0.074 18880
3228 1 7 . 1 1 88 88 TYR C C 88 175.870 175.870 174.669 1.201 18880
3229 1 7 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.105 2.735 18880
3230 1 7 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.118 0.522 18880
3231 1 7 . 1 1 88 88 TYR H H 88 7.740 7.740 7.198 0.542 18880
3232 1 7 . 1 1 89 89 SER N N 89 115.980 115.980 117.269 -1.289 18880
3233 1 7 . 1 1 89 89 SER HA H 89 4.440 4.440 4.616 -0.176 18880
3234 1 7 . 1 1 89 89 SER C C 89 174.460 174.460 175.198 -0.738 18880
3235 1 7 . 1 1 89 89 SER CA C 89 58.350 58.350 58.743 -0.393 18880
3236 1 7 . 1 1 89 89 SER CB C 89 63.990 63.990 62.775 1.215 18880
3237 1 7 . 1 1 89 89 SER H H 89 7.880 7.880 7.790 0.090 18880
3238 1 7 . 1 1 90 90 VAL N N 90 120.910 120.910 123.684 -2.774 18880
3239 1 7 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.220 -0.080 18880
3240 1 7 . 1 1 90 90 VAL C C 90 175.720 175.720 175.206 0.514 18880
3241 1 7 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.660 0.610 18880
3242 1 7 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.639 0.201 18880
3243 1 7 . 1 1 90 90 VAL H H 90 8.020 8.020 7.841 0.179 18880
3244 1 7 . 1 1 91 91 ASP N N 91 123.620 123.620 121.640 1.980 18880
3245 1 7 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.521 0.109 18880
3246 1 7 . 1 1 91 91 ASP C C 91 176.000 176.000 176.668 -0.668 18880
3247 1 7 . 1 1 91 91 ASP CA C 91 54.510 54.510 55.418 -0.908 18880
3248 1 7 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.559 -0.119 18880
3249 1 7 . 1 1 91 91 ASP H H 91 8.310 8.310 7.684 0.626 18880
3250 1 7 . 1 1 92 92 GLU N N 92 122.170 122.170 123.534 -1.364 18880
3251 1 7 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.199 0.161 18880
3252 1 7 . 1 1 92 92 GLU C C 92 175.660 175.660 176.534 -0.874 18880
3253 1 7 . 1 1 92 92 GLU CA C 92 56.490 56.490 57.783 -1.293 18880
3254 1 7 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.991 2.859 18880
3255 1 7 . 1 1 92 92 GLU H H 92 8.320 8.320 8.914 -0.594 18880
3256 1 8 . 1 1 10 10 HIS C C 10 176.040 176.040 174.366 1.674 18880
3257 1 8 . 1 1 11 11 SER N N 11 116.840 116.840 114.108 2.732 18880
3258 1 8 . 1 1 11 11 SER HA H 11 4.430 4.430 4.576 -0.146 18880
3259 1 8 . 1 1 11 11 SER C C 11 174.630 174.630 173.144 1.486 18880
3260 1 8 . 1 1 11 11 SER CA C 11 58.350 58.350 57.809 0.541 18880
3261 1 8 . 1 1 11 11 SER CB C 11 64.120 64.120 64.303 -0.183 18880
3262 1 8 . 1 1 11 11 SER H H 11 8.360 8.360 8.163 0.197 18880
3263 1 8 . 1 1 12 12 SER N N 12 118.030 118.030 116.432 1.598 18880
3264 1 8 . 1 1 12 12 SER HA H 12 4.440 4.440 4.250 0.190 18880
3265 1 8 . 1 1 12 12 SER C C 12 174.880 174.880 174.117 0.763 18880
3266 1 8 . 1 1 12 12 SER CA C 12 58.680 58.680 58.550 0.130 18880
3267 1 8 . 1 1 12 12 SER CB C 12 63.890 63.890 63.274 0.616 18880
3268 1 8 . 1 1 12 12 SER H H 12 8.490 8.490 8.429 0.061 18880
3269 1 8 . 1 1 13 13 GLY N N 13 110.450 110.450 108.983 1.467 18880
3270 1 8 . 1 1 13 13 GLY C C 13 173.790 173.790 173.294 0.496 18880
3271 1 8 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.019 0.441 18880
3272 1 8 . 1 1 13 13 GLY H H 13 8.390 8.390 8.411 -0.021 18880
3273 1 8 . 1 1 14 14 LEU N N 14 121.310 121.310 120.118 1.192 18880
3274 1 8 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.683 -0.343 18880
3275 1 8 . 1 1 14 14 LEU C C 14 176.930 176.930 176.041 0.889 18880
3276 1 8 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.233 -0.033 18880
3277 1 8 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.210 0.390 18880
3278 1 8 . 1 1 14 14 LEU H H 14 8.020 8.020 8.550 -0.530 18880
3279 1 8 . 1 1 15 15 VAL N N 15 121.550 121.550 118.339 3.211 18880
3280 1 8 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.616 -0.246 18880
3281 1 8 . 1 1 15 15 VAL CA C 15 59.720 59.720 58.930 0.790 18880
3282 1 8 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.208 1.562 18880
3283 1 8 . 1 1 15 15 VAL H H 15 8.030 8.030 7.643 0.387 18880
3284 1 8 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.284 0.086 18880
3285 1 8 . 1 1 16 16 PRO C C 16 176.720 176.720 176.994 -0.274 18880
3286 1 8 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.381 -1.731 18880
3287 1 8 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.045 0.195 18880
3288 1 8 . 1 1 17 17 ARG N N 17 121.890 121.890 119.186 2.704 18880
3289 1 8 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.380 -0.100 18880
3290 1 8 . 1 1 17 17 ARG C C 17 176.940 176.940 176.122 0.818 18880
3291 1 8 . 1 1 17 17 ARG CA C 17 56.360 56.360 55.608 0.752 18880
3292 1 8 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.498 0.552 18880
3293 1 8 . 1 1 17 17 ARG H H 17 8.450 8.450 7.816 0.634 18880
3294 1 8 . 1 1 18 18 GLY N N 18 110.160 110.160 110.836 -0.676 18880
3295 1 8 . 1 1 18 18 GLY C C 18 174.110 174.110 174.049 0.061 18880
3296 1 8 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.890 0.500 18880
3297 1 8 . 1 1 18 18 GLY H H 18 8.480 8.480 8.495 -0.015 18880
3298 1 8 . 1 1 19 19 SER N N 19 115.500 115.500 116.394 -0.894 18880
3299 1 8 . 1 1 19 19 SER HA H 19 4.400 4.400 4.595 -0.195 18880
3300 1 8 . 1 1 19 19 SER C C 19 174.380 174.380 174.295 0.085 18880
3301 1 8 . 1 1 19 19 SER CA C 19 58.610 58.610 57.392 1.218 18880
3302 1 8 . 1 1 19 19 SER CB C 19 63.830 63.830 62.882 0.948 18880
3303 1 8 . 1 1 19 19 SER H H 19 8.210 8.210 8.065 0.145 18880
3304 1 8 . 1 1 20 20 HIS N N 20 120.770 120.770 121.722 -0.952 18880
3305 1 8 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.718 -0.108 18880
3306 1 8 . 1 1 20 20 HIS C C 20 174.870 174.870 174.352 0.518 18880
3307 1 8 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.391 0.739 18880
3308 1 8 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.502 0.208 18880
3309 1 8 . 1 1 20 20 HIS H H 20 8.590 8.590 8.406 0.184 18880
3310 1 8 . 1 1 21 21 MET N N 21 121.440 121.440 119.558 1.882 18880
3311 1 8 . 1 1 21 21 MET HA H 21 4.470 4.470 4.554 -0.084 18880
3312 1 8 . 1 1 21 21 MET C C 21 176.030 176.030 176.678 -0.648 18880
3313 1 8 . 1 1 21 21 MET CA C 21 55.490 55.490 54.408 1.082 18880
3314 1 8 . 1 1 21 21 MET CB C 21 33.170 33.170 34.376 -1.206 18880
3315 1 8 . 1 1 21 21 MET H H 21 8.310 8.310 7.539 0.771 18880
3316 1 8 . 1 1 22 22 SER N N 22 116.860 116.860 116.245 0.615 18880
3317 1 8 . 1 1 22 22 SER HA H 22 4.430 4.430 4.608 -0.178 18880
3318 1 8 . 1 1 22 22 SER C C 22 174.630 174.630 174.597 0.033 18880
3319 1 8 . 1 1 22 22 SER CA C 22 58.410 58.410 59.019 -0.609 18880
3320 1 8 . 1 1 22 22 SER CB C 22 64.030 64.030 63.487 0.543 18880
3321 1 8 . 1 1 22 22 SER H H 22 8.340 8.340 8.537 -0.197 18880
3322 1 8 . 1 1 23 23 ASP N N 23 122.660 122.660 120.802 1.858 18880
3323 1 8 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.708 -0.158 18880
3324 1 8 . 1 1 23 23 ASP C C 23 176.860 176.860 177.664 -0.804 18880
3325 1 8 . 1 1 23 23 ASP CA C 23 55.330 55.330 54.930 0.400 18880
3326 1 8 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.917 0.083 18880
3327 1 8 . 1 1 23 23 ASP H H 23 8.540 8.540 8.348 0.192 18880
3328 1 8 . 1 1 24 24 GLU N N 24 120.400 120.400 119.927 0.473 18880
3329 1 8 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.099 0.041 18880
3330 1 8 . 1 1 24 24 GLU C C 24 177.540 177.540 177.208 0.332 18880
3331 1 8 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.500 -0.140 18880
3332 1 8 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.116 0.634 18880
3333 1 8 . 1 1 24 24 GLU H H 24 8.610 8.610 8.143 0.467 18880
3334 1 8 . 1 1 25 25 LYS N N 25 120.390 120.390 119.445 0.945 18880
3335 1 8 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.183 0.007 18880
3336 1 8 . 1 1 25 25 LYS C C 25 177.490 177.490 178.089 -0.599 18880
3337 1 8 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.769 -0.659 18880
3338 1 8 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.453 0.037 18880
3339 1 8 . 1 1 25 25 LYS H H 25 8.210 8.210 8.096 0.114 18880
3340 1 8 . 1 1 26 26 THR N N 26 114.880 114.880 115.909 -1.029 18880
3341 1 8 . 1 1 26 26 THR HA H 26 4.040 4.040 4.008 0.032 18880
3342 1 8 . 1 1 26 26 THR C C 26 175.430 175.430 176.773 -1.343 18880
3343 1 8 . 1 1 26 26 THR CA C 26 64.620 64.620 66.027 -1.407 18880
3344 1 8 . 1 1 26 26 THR CB C 26 69.110 69.110 68.367 0.743 18880
3345 1 8 . 1 1 26 26 THR H H 26 8.080 8.080 7.399 0.681 18880
3346 1 8 . 1 1 27 27 GLN N N 27 120.940 120.940 122.116 -1.176 18880
3347 1 8 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.112 0.078 18880
3348 1 8 . 1 1 27 27 GLN C C 27 177.280 177.280 177.184 0.096 18880
3349 1 8 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.467 -0.917 18880
3350 1 8 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.648 0.443 18880
3351 1 8 . 1 1 27 27 GLN H H 27 8.240 8.240 7.938 0.302 18880
3352 1 8 . 1 1 28 28 LEU N N 28 121.860 121.860 119.799 2.061 18880
3353 1 8 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.413 -0.243 18880
3354 1 8 . 1 1 28 28 LEU C C 28 177.750 177.750 177.847 -0.097 18880
3355 1 8 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.878 1.202 18880
3356 1 8 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.237 0.033 18880
3357 1 8 . 1 1 28 28 LEU H H 28 7.950 7.950 8.059 -0.109 18880
3358 1 8 . 1 1 29 29 ILE N N 29 119.260 119.260 118.493 0.767 18880
3359 1 8 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.930 -0.030 18880
3360 1 8 . 1 1 29 29 ILE C C 29 177.140 177.140 177.518 -0.378 18880
3361 1 8 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.077 0.223 18880
3362 1 8 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.863 1.417 18880
3363 1 8 . 1 1 29 29 ILE H H 29 7.950 7.950 7.795 0.155 18880
3364 1 8 . 1 1 30 30 GLU N N 30 120.500 120.500 119.785 0.715 18880
3365 1 8 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.311 -0.261 18880
3366 1 8 . 1 1 30 30 GLU C C 30 177.560 177.560 176.778 0.782 18880
3367 1 8 . 1 1 30 30 GLU CA C 30 58.090 58.090 58.080 0.010 18880
3368 1 8 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.931 0.659 18880
3369 1 8 . 1 1 30 30 GLU H H 30 8.220 8.220 8.108 0.112 18880
3370 1 8 . 1 1 31 31 ALA N N 31 121.550 121.550 121.747 -0.197 18880
3371 1 8 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.401 -0.251 18880
3372 1 8 . 1 1 31 31 ALA C C 31 178.550 178.550 178.318 0.232 18880
3373 1 8 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.703 0.097 18880
3374 1 8 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.319 -0.689 18880
3375 1 8 . 1 1 31 31 ALA H H 31 7.890 7.890 8.002 -0.112 18880
3376 1 8 . 1 1 32 32 PHE N N 32 117.240 117.240 119.586 -2.346 18880
3377 1 8 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.270 0.030 18880
3378 1 8 . 1 1 32 32 PHE C C 32 176.210 176.210 176.459 -0.249 18880
3379 1 8 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.619 -2.279 18880
3380 1 8 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.658 0.092 18880
3381 1 8 . 1 1 32 32 PHE H H 32 7.930 7.930 7.807 0.123 18880
3382 1 8 . 1 1 33 33 TYR N N 33 119.050 119.050 116.872 2.178 18880
3383 1 8 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.680 -0.350 18880
3384 1 8 . 1 1 33 33 TYR C C 33 175.680 175.680 175.489 0.191 18880
3385 1 8 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.272 0.648 18880
3386 1 8 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.418 1.122 18880
3387 1 8 . 1 1 33 33 TYR H H 33 7.950 7.950 8.322 -0.372 18880
3388 1 8 . 1 1 34 34 ASN N N 34 118.390 118.390 118.834 -0.444 18880
3389 1 8 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.820 -0.190 18880
3390 1 8 . 1 1 34 34 ASN C C 34 174.810 174.810 174.149 0.661 18880
3391 1 8 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.709 -0.559 18880
3392 1 8 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.998 -1.018 18880
3393 1 8 . 1 1 34 34 ASN H H 34 7.960 7.960 7.843 0.117 18880
3394 1 8 . 1 1 35 35 PHE N N 35 120.670 120.670 120.726 -0.056 18880
3395 1 8 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.455 -0.005 18880
3396 1 8 . 1 1 35 35 PHE C C 35 175.310 175.310 172.755 2.555 18880
3397 1 8 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.701 -0.381 18880
3398 1 8 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.583 -0.163 18880
3399 1 8 . 1 1 35 35 PHE H H 35 7.830 7.830 7.935 -0.105 18880
3400 1 8 . 1 1 36 36 ASP N N 36 122.400 122.400 125.821 -3.421 18880
3401 1 8 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.330 0.260 18880
3402 1 8 . 1 1 36 36 ASP C C 36 176.150 176.150 175.637 0.513 18880
3403 1 8 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.413 -0.343 18880
3404 1 8 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.370 -0.050 18880
3405 1 8 . 1 1 36 36 ASP H H 36 8.180 8.180 8.096 0.084 18880
3406 1 8 . 1 1 37 37 GLY N N 37 108.560 108.560 108.818 -0.258 18880
3407 1 8 . 1 1 37 37 GLY C C 37 173.660 173.660 174.167 -0.507 18880
3408 1 8 . 1 1 37 37 GLY CA C 37 45.610 45.610 44.763 0.847 18880
3409 1 8 . 1 1 37 37 GLY H H 37 7.680 7.680 7.547 0.133 18880
3410 1 8 . 1 1 38 38 ASP N N 38 120.010 120.010 117.208 2.802 18880
3411 1 8 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.273 0.327 18880
3412 1 8 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.354 -0.094 18880
3413 1 8 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.053 1.397 18880
3414 1 8 . 1 1 38 38 ASP H H 38 8.220 8.220 8.171 0.049 18880
3415 1 8 . 1 1 39 39 TYR N N 39 121.030 121.030 119.173 1.857 18880
3416 1 8 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.292 0.098 18880
3417 1 8 . 1 1 39 39 TYR C C 39 175.290 175.290 176.356 -1.066 18880
3418 1 8 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.995 -0.795 18880
3419 1 8 . 1 1 39 39 TYR CB C 39 39.170 39.170 39.475 -0.305 18880
3420 1 8 . 1 1 39 39 TYR H H 39 8.090 8.090 7.711 0.379 18880
3421 1 8 . 1 1 40 40 ASP N N 40 122.020 122.020 120.907 1.113 18880
3422 1 8 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.568 0.032 18880
3423 1 8 . 1 1 40 40 ASP C C 40 175.970 175.970 176.389 -0.419 18880
3424 1 8 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.654 0.566 18880
3425 1 8 . 1 1 40 40 ASP CB C 40 41.520 41.520 40.277 1.243 18880
3426 1 8 . 1 1 40 40 ASP H H 40 8.200 8.200 7.981 0.219 18880
3427 1 8 . 1 1 41 41 GLY N N 41 108.330 108.330 107.618 0.712 18880
3428 1 8 . 1 1 41 41 GLY C C 41 173.000 173.000 172.688 0.312 18880
3429 1 8 . 1 1 41 41 GLY CA C 41 45.420 45.420 45.346 0.074 18880
3430 1 8 . 1 1 41 41 GLY H H 41 7.830 7.830 8.136 -0.306 18880
3431 1 8 . 1 1 42 42 PHE N N 42 118.600 118.600 118.293 0.307 18880
3432 1 8 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.925 0.335 18880
3433 1 8 . 1 1 42 42 PHE C C 42 175.660 175.660 173.980 1.680 18880
3434 1 8 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.257 -0.097 18880
3435 1 8 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.404 -1.234 18880
3436 1 8 . 1 1 42 42 PHE H H 42 8.150 8.150 7.629 0.521 18880
3437 1 8 . 1 1 43 43 VAL N N 43 119.180 119.180 124.727 -5.547 18880
3438 1 8 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.446 0.224 18880
3439 1 8 . 1 1 43 43 VAL C C 43 175.110 175.110 174.387 0.723 18880
3440 1 8 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.763 0.857 18880
3441 1 8 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.316 -2.436 18880
3442 1 8 . 1 1 43 43 VAL H H 43 9.070 9.070 8.812 0.258 18880
3443 1 8 . 1 1 44 44 SER N N 44 121.380 121.380 123.329 -1.949 18880
3444 1 8 . 1 1 44 44 SER HA H 44 4.570 4.570 4.749 -0.179 18880
3445 1 8 . 1 1 44 44 SER C C 44 175.660 175.660 175.507 0.153 18880
3446 1 8 . 1 1 44 44 SER CA C 44 57.720 57.720 57.869 -0.149 18880
3447 1 8 . 1 1 44 44 SER CB C 44 63.690 63.690 64.344 -0.654 18880
3448 1 8 . 1 1 44 44 SER H H 44 9.140 9.140 8.542 0.598 18880
3449 1 8 . 1 1 45 45 VAL N N 45 122.720 122.720 122.183 0.537 18880
3450 1 8 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.342 0.158 18880
3451 1 8 . 1 1 45 45 VAL C C 45 177.240 177.240 177.583 -0.343 18880
3452 1 8 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.694 -0.424 18880
3453 1 8 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.990 0.460 18880
3454 1 8 . 1 1 45 45 VAL H H 45 8.140 8.140 8.590 -0.450 18880
3455 1 8 . 1 1 46 46 GLU N N 46 118.990 118.990 119.070 -0.080 18880
3456 1 8 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.891 0.089 18880
3457 1 8 . 1 1 46 46 GLU C C 46 179.460 179.460 179.140 0.320 18880
3458 1 8 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.636 -0.076 18880
3459 1 8 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.089 0.071 18880
3460 1 8 . 1 1 46 46 GLU H H 46 8.230 8.230 7.562 0.668 18880
3461 1 8 . 1 1 47 47 GLU N N 47 120.120 120.120 117.715 2.405 18880
3462 1 8 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.287 -0.207 18880
3463 1 8 . 1 1 47 47 GLU C C 47 179.170 179.170 178.607 0.563 18880
3464 1 8 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.648 1.242 18880
3465 1 8 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.335 0.485 18880
3466 1 8 . 1 1 47 47 GLU H H 47 7.880 7.880 8.221 -0.341 18880
3467 1 8 . 1 1 48 48 PHE N N 48 120.830 120.830 122.116 -1.286 18880
3468 1 8 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.150 0.040 18880
3469 1 8 . 1 1 48 48 PHE C C 48 176.920 176.920 177.373 -0.453 18880
3470 1 8 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.589 0.281 18880
3471 1 8 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.823 0.437 18880
3472 1 8 . 1 1 48 48 PHE H H 48 8.600 8.600 8.285 0.315 18880
3473 1 8 . 1 1 49 49 ARG N N 49 118.470 118.470 119.001 -0.531 18880
3474 1 8 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.129 -0.269 18880
3475 1 8 . 1 1 49 49 ARG C C 49 178.090 178.090 178.801 -0.711 18880
3476 1 8 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.388 -0.318 18880
3477 1 8 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.747 0.393 18880
3478 1 8 . 1 1 49 49 ARG H H 49 8.650 8.650 8.908 -0.258 18880
3479 1 8 . 1 1 50 50 GLY N N 50 105.080 105.080 105.216 -0.136 18880
3480 1 8 . 1 1 50 50 GLY C C 50 175.090 175.090 175.449 -0.359 18880
3481 1 8 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.728 -0.048 18880
3482 1 8 . 1 1 50 50 GLY H H 50 7.620 7.620 8.443 -0.823 18880
3483 1 8 . 1 1 51 51 ILE N N 51 121.440 121.440 120.065 1.375 18880
3484 1 8 . 1 1 51 51 ILE HA H 51 3.830 3.830 4.239 -0.409 18880
3485 1 8 . 1 1 51 51 ILE C C 51 178.300 178.300 176.790 1.510 18880
3486 1 8 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.041 0.799 18880
3487 1 8 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.912 -0.602 18880
3488 1 8 . 1 1 51 51 ILE H H 51 7.470 7.470 7.564 -0.094 18880
3489 1 8 . 1 1 52 52 ILE N N 52 118.930 118.930 120.053 -1.123 18880
3490 1 8 . 1 1 52 52 ILE HA H 52 3.740 3.740 4.146 -0.406 18880
3491 1 8 . 1 1 52 52 ILE CA C 52 63.760 63.760 62.416 1.345 18880
3492 1 8 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.056 0.974 18880
3493 1 8 . 1 1 52 52 ILE H H 52 7.790 7.790 8.272 -0.482 18880
3494 1 8 . 1 1 53 53 ARG N N 53 120.140 120.140 121.916 -1.776 18880
3495 1 8 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.948 0.142 18880
3496 1 8 . 1 1 53 53 ARG C C 53 177.380 177.380 176.922 0.458 18880
3497 1 8 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.953 0.157 18880
3498 1 8 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.350 -0.770 18880
3499 1 8 . 1 1 53 53 ARG H H 53 7.930 7.930 8.514 -0.584 18880
3500 1 8 . 1 1 54 54 ASP N N 54 117.500 117.500 116.553 0.947 18880
3501 1 8 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.699 -0.099 18880
3502 1 8 . 1 1 54 54 ASP C C 54 176.930 176.930 176.090 0.840 18880
3503 1 8 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.980 1.560 18880
3504 1 8 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.595 0.505 18880
3505 1 8 . 1 1 54 54 ASP H H 54 7.870 7.870 8.286 -0.416 18880
3506 1 8 . 1 1 55 55 GLY N N 55 106.370 106.370 107.643 -1.273 18880
3507 1 8 . 1 1 55 55 GLY C C 55 173.460 173.460 173.860 -0.400 18880
3508 1 8 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.306 0.694 18880
3509 1 8 . 1 1 55 55 GLY H H 55 7.880 7.880 7.453 0.427 18880
3510 1 8 . 1 1 56 56 LEU N N 56 122.630 122.630 124.203 -1.573 18880
3511 1 8 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.788 -0.018 18880
3512 1 8 . 1 1 56 56 LEU CA C 56 52.490 52.490 52.560 -0.070 18880
3513 1 8 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.079 1.041 18880
3514 1 8 . 1 1 56 56 LEU H H 56 8.220 8.220 7.831 0.389 18880
3515 1 8 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.472 0.108 18880
3516 1 8 . 1 1 57 57 PRO C C 57 176.150 176.150 175.602 0.548 18880
3517 1 8 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.793 -0.373 18880
3518 1 8 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.744 -1.004 18880
3519 1 8 . 1 1 58 58 MET N N 58 121.810 121.810 125.070 -3.260 18880
3520 1 8 . 1 1 58 58 MET HA H 58 4.630 4.630 4.725 -0.095 18880
3521 1 8 . 1 1 58 58 MET C C 58 176.150 176.150 174.945 1.205 18880
3522 1 8 . 1 1 58 58 MET CA C 58 55.560 55.560 54.220 1.340 18880
3523 1 8 . 1 1 58 58 MET CB C 58 36.820 36.820 37.392 -0.572 18880
3524 1 8 . 1 1 58 58 MET H H 58 7.690 7.690 8.215 -0.525 18880
3525 1 8 . 1 1 59 59 THR N N 59 114.180 114.180 115.686 -1.506 18880
3526 1 8 . 1 1 59 59 THR HA H 59 4.450 4.450 4.458 -0.008 18880
3527 1 8 . 1 1 59 59 THR C C 59 175.170 175.170 175.858 -0.688 18880
3528 1 8 . 1 1 59 59 THR CA C 59 60.780 60.780 61.024 -0.244 18880
3529 1 8 . 1 1 59 59 THR CB C 59 71.060 71.060 69.721 1.339 18880
3530 1 8 . 1 1 59 59 THR H H 59 8.940 8.940 9.133 -0.193 18880
3531 1 8 . 1 1 60 60 GLU N N 60 120.620 120.620 125.402 -4.782 18880
3532 1 8 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.694 0.316 18880
3533 1 8 . 1 1 60 60 GLU C C 60 179.010 179.010 178.164 0.846 18880
3534 1 8 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.757 0.063 18880
3535 1 8 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.544 0.506 18880
3536 1 8 . 1 1 60 60 GLU H H 60 8.850 8.850 8.911 -0.061 18880
3537 1 8 . 1 1 61 61 ALA N N 61 121.080 121.080 122.275 -1.195 18880
3538 1 8 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.954 0.186 18880
3539 1 8 . 1 1 61 61 ALA C C 61 180.350 180.350 179.836 0.514 18880
3540 1 8 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.053 0.037 18880
3541 1 8 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.704 0.506 18880
3542 1 8 . 1 1 61 61 ALA H H 61 8.370 8.370 8.357 0.013 18880
3543 1 8 . 1 1 62 62 GLU N N 62 118.890 118.890 118.942 -0.052 18880
3544 1 8 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.396 0.604 18880
3545 1 8 . 1 1 62 62 GLU C C 62 179.690 179.690 178.562 1.128 18880
3546 1 8 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.551 0.439 18880
3547 1 8 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.879 1.431 18880
3548 1 8 . 1 1 62 62 GLU H H 62 7.680 7.680 7.729 -0.049 18880
3549 1 8 . 1 1 63 63 ILE N N 63 122.340 122.340 119.811 2.529 18880
3550 1 8 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.215 0.355 18880
3551 1 8 . 1 1 63 63 ILE C C 63 177.260 177.260 178.107 -0.847 18880
3552 1 8 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.684 1.206 18880
3553 1 8 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.941 1.039 18880
3554 1 8 . 1 1 63 63 ILE H H 63 8.420 8.420 7.474 0.946 18880
3555 1 8 . 1 1 64 64 THR N N 64 116.970 116.970 116.084 0.886 18880
3556 1 8 . 1 1 64 64 THR HA H 64 3.940 3.940 3.925 0.015 18880
3557 1 8 . 1 1 64 64 THR C C 64 176.520 176.520 177.063 -0.543 18880
3558 1 8 . 1 1 64 64 THR CA C 64 67.060 67.060 67.128 -0.068 18880
3559 1 8 . 1 1 64 64 THR CB C 64 68.750 68.750 68.299 0.452 18880
3560 1 8 . 1 1 64 64 THR H H 64 8.310 8.310 8.472 -0.162 18880
3561 1 8 . 1 1 65 65 GLU N N 65 120.760 120.760 119.497 1.263 18880
3562 1 8 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.190 -0.160 18880
3563 1 8 . 1 1 65 65 GLU C C 65 175.830 175.830 179.075 -3.245 18880
3564 1 8 . 1 1 65 65 GLU CA C 65 59.500 59.500 59.013 0.487 18880
3565 1 8 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.390 0.380 18880
3566 1 8 . 1 1 65 65 GLU H H 65 7.970 7.970 8.728 -0.758 18880
3567 1 8 . 1 1 66 66 PHE N N 66 120.940 120.940 119.238 1.702 18880
3568 1 8 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.440 -0.200 18880
3569 1 8 . 1 1 66 66 PHE C C 66 177.330 177.330 177.539 -0.209 18880
3570 1 8 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.593 2.607 18880
3571 1 8 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.880 -0.350 18880
3572 1 8 . 1 1 66 66 PHE H H 66 8.100 8.100 7.871 0.229 18880
3573 1 8 . 1 1 67 67 PHE N N 67 118.110 118.110 119.273 -1.163 18880
3574 1 8 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.398 -0.448 18880
3575 1 8 . 1 1 67 67 PHE C C 67 178.090 178.090 177.285 0.805 18880
3576 1 8 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.005 2.195 18880
3577 1 8 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.503 -0.253 18880
3578 1 8 . 1 1 67 67 PHE H H 67 8.380 8.380 8.617 -0.236 18880
3579 1 8 . 1 1 68 68 GLU N N 68 119.650 119.650 116.971 2.679 18880
3580 1 8 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.340 -0.330 18880
3581 1 8 . 1 1 68 68 GLU C C 68 177.910 177.910 176.978 0.932 18880
3582 1 8 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.749 1.491 18880
3583 1 8 . 1 1 68 68 GLU CB C 68 29.370 29.370 30.017 -0.646 18880
3584 1 8 . 1 1 68 68 GLU H H 68 8.230 8.230 8.049 0.181 18880
3585 1 8 . 1 1 69 69 ALA N N 69 119.090 119.090 120.223 -1.133 18880
3586 1 8 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.416 -0.236 18880
3587 1 8 . 1 1 69 69 ALA C C 69 179.030 179.030 178.403 0.627 18880
3588 1 8 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.447 0.153 18880
3589 1 8 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.697 0.083 18880
3590 1 8 . 1 1 69 69 ALA H H 69 7.340 7.340 7.693 -0.353 18880
3591 1 8 . 1 1 70 70 ALA N N 70 118.670 118.670 119.878 -1.208 18880
3592 1 8 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.268 -0.248 18880
3593 1 8 . 1 1 70 70 ALA C C 70 176.820 176.820 176.436 0.384 18880
3594 1 8 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.684 0.406 18880
3595 1 8 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.259 -0.649 18880
3596 1 8 . 1 1 70 70 ALA H H 70 8.050 8.050 7.768 0.282 18880
3597 1 8 . 1 1 71 71 ASP N N 71 116.780 116.780 117.806 -1.026 18880
3598 1 8 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.012 0.208 18880
3599 1 8 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.587 1.562 18880
3600 1 8 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.003 -2.093 18880
3601 1 8 . 1 1 71 71 ASP H H 71 8.010 8.010 7.536 0.474 18880
3602 1 8 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.404 0.066 18880
3603 1 8 . 1 1 72 72 PRO C C 72 177.970 177.970 177.483 0.487 18880
3604 1 8 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.459 0.451 18880
3605 1 8 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.624 -0.744 18880
3606 1 8 . 1 1 73 73 ASN N N 73 114.930 114.930 115.669 -0.739 18880
3607 1 8 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.669 0.211 18880
3608 1 8 . 1 1 73 73 ASN C C 73 174.880 174.880 174.403 0.477 18880
3609 1 8 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.280 -0.440 18880
3610 1 8 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.580 -0.200 18880
3611 1 8 . 1 1 73 73 ASN H H 73 9.030 9.030 8.204 0.826 18880
3612 1 8 . 1 1 74 74 ASN N N 74 118.340 118.340 113.673 4.667 18880
3613 1 8 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.502 -0.142 18880
3614 1 8 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.981 0.609 18880
3615 1 8 . 1 1 74 74 ASN CB C 74 37.160 37.160 37.000 0.160 18880
3616 1 8 . 1 1 74 74 ASN H H 74 8.320 8.320 8.021 0.299 18880
3617 1 8 . 1 1 75 75 THR N N 75 113.450 113.450 115.746 -2.296 18880
3618 1 8 . 1 1 75 75 THR HA H 75 4.210 4.210 4.432 -0.222 18880
3619 1 8 . 1 1 75 75 THR CA C 75 63.410 63.410 60.722 2.688 18880
3620 1 8 . 1 1 75 75 THR CB C 75 70.540 70.540 67.530 3.010 18880
3621 1 8 . 1 1 75 75 THR H H 75 9.870 9.870 8.051 1.819 18880
3622 1 8 . 1 1 76 76 GLY N N 76 111.810 111.810 109.673 2.137 18880
3623 1 8 . 1 1 76 76 GLY C C 76 173.670 173.670 173.499 0.171 18880
3624 1 8 . 1 1 76 76 GLY CA C 76 45.120 45.120 46.132 -1.012 18880
3625 1 8 . 1 1 76 76 GLY H H 76 10.250 10.250 7.683 2.567 18880
3626 1 8 . 1 1 77 77 PHE N N 77 120.560 120.560 118.805 1.755 18880
3627 1 8 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.043 0.107 18880
3628 1 8 . 1 1 77 77 PHE CA C 77 57.180 57.180 55.901 1.279 18880
3629 1 8 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.656 1.844 18880
3630 1 8 . 1 1 77 77 PHE H H 77 8.110 8.110 7.582 0.528 18880
3631 1 8 . 1 1 78 78 ILE N N 78 116.410 116.410 125.117 -8.707 18880
3632 1 8 . 1 1 78 78 ILE HA H 78 4.390 4.390 3.921 0.469 18880
3633 1 8 . 1 1 78 78 ILE C C 78 174.770 174.770 174.194 0.576 18880
3634 1 8 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.715 -0.525 18880
3635 1 8 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.347 0.833 18880
3636 1 8 . 1 1 78 78 ILE H H 78 8.930 8.930 7.793 1.137 18880
3637 1 8 . 1 1 79 79 ASP N N 79 125.220 125.220 125.112 0.108 18880
3638 1 8 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.946 -0.446 18880
3639 1 8 . 1 1 79 79 ASP C C 79 176.490 176.490 176.953 -0.463 18880
3640 1 8 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.379 0.931 18880
3641 1 8 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.672 0.698 18880
3642 1 8 . 1 1 79 79 ASP H H 79 8.610 8.610 8.544 0.066 18880
3643 1 8 . 1 1 80 80 TYR N N 80 125.760 125.760 128.929 -3.169 18880
3644 1 8 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.101 -0.111 18880
3645 1 8 . 1 1 80 80 TYR C C 80 177.140 177.140 176.693 0.447 18880
3646 1 8 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.400 -0.820 18880
3647 1 8 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.635 0.255 18880
3648 1 8 . 1 1 80 80 TYR H H 80 8.460 8.460 8.632 -0.172 18880
3649 1 8 . 1 1 81 81 LYS N N 81 118.320 118.320 118.250 0.070 18880
3650 1 8 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.912 -0.012 18880
3651 1 8 . 1 1 81 81 LYS C C 81 179.090 179.090 178.542 0.548 18880
3652 1 8 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.612 -0.032 18880
3653 1 8 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.585 0.175 18880
3654 1 8 . 1 1 81 81 LYS H H 81 8.410 8.410 8.479 -0.069 18880
3655 1 8 . 1 1 82 82 ALA N N 82 122.050 122.050 121.853 0.197 18880
3656 1 8 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.146 -0.016 18880
3657 1 8 . 1 1 82 82 ALA C C 82 179.740 179.740 179.700 0.040 18880
3658 1 8 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.757 -0.237 18880
3659 1 8 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.130 0.410 18880
3660 1 8 . 1 1 82 82 ALA H H 82 7.770 7.770 8.023 -0.253 18880
3661 1 8 . 1 1 83 83 PHE N N 83 117.810 117.810 116.936 0.874 18880
3662 1 8 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.404 -0.114 18880
3663 1 8 . 1 1 83 83 PHE C C 83 176.460 176.460 176.415 0.045 18880
3664 1 8 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.614 0.416 18880
3665 1 8 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.760 -0.240 18880
3666 1 8 . 1 1 83 83 PHE H H 83 7.780 7.780 7.884 -0.104 18880
3667 1 8 . 1 1 84 84 ALA N N 84 121.530 121.530 121.556 -0.026 18880
3668 1 8 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.076 -0.416 18880
3669 1 8 . 1 1 84 84 ALA C C 84 179.010 179.010 179.369 -0.359 18880
3670 1 8 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.071 0.959 18880
3671 1 8 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.297 -0.167 18880
3672 1 8 . 1 1 84 84 ALA H H 84 8.290 8.290 8.205 0.085 18880
3673 1 8 . 1 1 85 85 ALA N N 85 117.720 117.720 121.540 -3.820 18880
3674 1 8 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.292 -0.212 18880
3675 1 8 . 1 1 85 85 ALA C C 85 179.570 179.570 178.217 1.353 18880
3676 1 8 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.238 0.132 18880
3677 1 8 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.327 -0.037 18880
3678 1 8 . 1 1 85 85 ALA H H 85 7.700 7.700 8.417 -0.717 18880
3679 1 8 . 1 1 86 86 MET N N 86 116.570 116.570 116.605 -0.035 18880
3680 1 8 . 1 1 86 86 MET HA H 86 4.160 4.160 4.187 -0.027 18880
3681 1 8 . 1 1 86 86 MET C C 86 177.360 177.360 176.958 0.402 18880
3682 1 8 . 1 1 86 86 MET CA C 86 57.380 57.380 57.220 0.160 18880
3683 1 8 . 1 1 86 86 MET CB C 86 32.720 32.720 31.933 0.787 18880
3684 1 8 . 1 1 86 86 MET H H 86 7.560 7.560 7.393 0.167 18880
3685 1 8 . 1 1 87 87 LEU N N 87 119.090 119.090 116.926 2.164 18880
3686 1 8 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.173 -0.203 18880
3687 1 8 . 1 1 87 87 LEU C C 87 177.420 177.420 176.892 0.528 18880
3688 1 8 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.414 0.876 18880
3689 1 8 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.468 -0.188 18880
3690 1 8 . 1 1 87 87 LEU H H 87 7.570 7.570 7.216 0.354 18880
3691 1 8 . 1 1 88 88 TYR N N 88 117.060 117.060 115.066 1.994 18880
3692 1 8 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.684 -0.094 18880
3693 1 8 . 1 1 88 88 TYR C C 88 175.870 175.870 175.413 0.457 18880
3694 1 8 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.029 2.811 18880
3695 1 8 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.612 0.028 18880
3696 1 8 . 1 1 88 88 TYR H H 88 7.740 7.740 7.070 0.670 18880
3697 1 8 . 1 1 89 89 SER N N 89 115.980 115.980 118.779 -2.799 18880
3698 1 8 . 1 1 89 89 SER HA H 89 4.440 4.440 4.395 0.045 18880
3699 1 8 . 1 1 89 89 SER C C 89 174.460 174.460 174.650 -0.190 18880
3700 1 8 . 1 1 89 89 SER CA C 89 58.350 58.350 59.555 -1.205 18880
3701 1 8 . 1 1 89 89 SER CB C 89 63.990 63.990 61.960 2.030 18880
3702 1 8 . 1 1 89 89 SER H H 89 7.880 7.880 8.221 -0.341 18880
3703 1 8 . 1 1 90 90 VAL N N 90 120.910 120.910 124.070 -3.160 18880
3704 1 8 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.315 -0.175 18880
3705 1 8 . 1 1 90 90 VAL C C 90 175.720 175.720 174.771 0.949 18880
3706 1 8 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.184 0.086 18880
3707 1 8 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.278 0.562 18880
3708 1 8 . 1 1 90 90 VAL H H 90 8.020 8.020 8.284 -0.264 18880
3709 1 8 . 1 1 91 91 ASP N N 91 123.620 123.620 121.748 1.872 18880
3710 1 8 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.852 -0.222 18880
3711 1 8 . 1 1 91 91 ASP C C 91 176.000 176.000 176.663 -0.663 18880
3712 1 8 . 1 1 91 91 ASP CA C 91 54.510 54.510 52.935 1.575 18880
3713 1 8 . 1 1 91 91 ASP CB C 91 41.440 41.440 43.059 -1.619 18880
3714 1 8 . 1 1 91 91 ASP H H 91 8.310 8.310 7.637 0.673 18880
3715 1 8 . 1 1 92 92 GLU N N 92 122.170 122.170 119.076 3.094 18880
3716 1 8 . 1 1 92 92 GLU HA H 92 4.360 4.360 3.969 0.391 18880
3717 1 8 . 1 1 92 92 GLU C C 92 175.660 175.660 176.692 -1.032 18880
3718 1 8 . 1 1 92 92 GLU CA C 92 56.490 56.490 58.114 -1.624 18880
3719 1 8 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.634 3.216 18880
3720 1 8 . 1 1 92 92 GLU H H 92 8.320 8.320 8.716 -0.396 18880
3721 1 9 . 1 1 10 10 HIS C C 10 176.040 176.040 175.284 0.756 18880
3722 1 9 . 1 1 11 11 SER N N 11 116.840 116.840 114.905 1.935 18880
3723 1 9 . 1 1 11 11 SER HA H 11 4.430 4.430 4.190 0.240 18880
3724 1 9 . 1 1 11 11 SER C C 11 174.630 174.630 173.623 1.007 18880
3725 1 9 . 1 1 11 11 SER CA C 11 58.350 58.350 57.829 0.521 18880
3726 1 9 . 1 1 11 11 SER CB C 11 64.120 64.120 64.005 0.115 18880
3727 1 9 . 1 1 11 11 SER H H 11 8.360 8.360 7.621 0.739 18880
3728 1 9 . 1 1 12 12 SER N N 12 118.030 118.030 117.041 0.989 18880
3729 1 9 . 1 1 12 12 SER HA H 12 4.440 4.440 4.802 -0.362 18880
3730 1 9 . 1 1 12 12 SER C C 12 174.880 174.880 174.269 0.611 18880
3731 1 9 . 1 1 12 12 SER CA C 12 58.680 58.680 57.667 1.013 18880
3732 1 9 . 1 1 12 12 SER CB C 12 63.890 63.890 63.530 0.360 18880
3733 1 9 . 1 1 12 12 SER H H 12 8.490 8.490 8.541 -0.051 18880
3734 1 9 . 1 1 13 13 GLY N N 13 110.450 110.450 113.677 -3.227 18880
3735 1 9 . 1 1 13 13 GLY C C 13 173.790 173.790 174.465 -0.675 18880
3736 1 9 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.910 -0.450 18880
3737 1 9 . 1 1 13 13 GLY H H 13 8.390 8.390 8.638 -0.248 18880
3738 1 9 . 1 1 14 14 LEU N N 14 121.310 121.310 122.128 -0.818 18880
3739 1 9 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.426 -0.086 18880
3740 1 9 . 1 1 14 14 LEU C C 14 176.930 176.930 176.658 0.272 18880
3741 1 9 . 1 1 14 14 LEU CA C 14 55.200 55.200 56.359 -1.159 18880
3742 1 9 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.901 -0.301 18880
3743 1 9 . 1 1 14 14 LEU H H 14 8.020 8.020 8.126 -0.106 18880
3744 1 9 . 1 1 15 15 VAL N N 15 121.550 121.550 114.346 7.204 18880
3745 1 9 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.537 -0.167 18880
3746 1 9 . 1 1 15 15 VAL CA C 15 59.720 59.720 59.206 0.514 18880
3747 1 9 . 1 1 15 15 VAL CB C 15 32.770 32.770 32.352 0.418 18880
3748 1 9 . 1 1 15 15 VAL H H 15 8.030 8.030 7.602 0.428 18880
3749 1 9 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.363 0.007 18880
3750 1 9 . 1 1 16 16 PRO C C 16 176.720 176.720 176.031 0.689 18880
3751 1 9 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.281 -0.631 18880
3752 1 9 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.060 0.180 18880
3753 1 9 . 1 1 17 17 ARG N N 17 121.890 121.890 116.036 5.854 18880
3754 1 9 . 1 1 17 17 ARG HA H 17 4.280 4.280 3.968 0.312 18880
3755 1 9 . 1 1 17 17 ARG C C 17 176.940 176.940 175.296 1.644 18880
3756 1 9 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.728 -0.368 18880
3757 1 9 . 1 1 17 17 ARG CB C 17 31.050 31.050 29.474 1.576 18880
3758 1 9 . 1 1 17 17 ARG H H 17 8.450 8.450 8.449 0.001 18880
3759 1 9 . 1 1 18 18 GLY N N 18 110.160 110.160 108.705 1.455 18880
3760 1 9 . 1 1 18 18 GLY C C 18 174.110 174.110 173.173 0.937 18880
3761 1 9 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.437 0.953 18880
3762 1 9 . 1 1 18 18 GLY H H 18 8.480 8.480 7.990 0.490 18880
3763 1 9 . 1 1 19 19 SER N N 19 115.500 115.500 117.429 -1.929 18880
3764 1 9 . 1 1 19 19 SER HA H 19 4.400 4.400 5.249 -0.849 18880
3765 1 9 . 1 1 19 19 SER C C 19 174.380 174.380 173.793 0.587 18880
3766 1 9 . 1 1 19 19 SER CA C 19 58.610 58.610 57.192 1.418 18880
3767 1 9 . 1 1 19 19 SER CB C 19 63.830 63.830 65.462 -1.631 18880
3768 1 9 . 1 1 19 19 SER H H 19 8.210 8.210 8.604 -0.394 18880
3769 1 9 . 1 1 20 20 HIS N N 20 120.770 120.770 117.827 2.943 18880
3770 1 9 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.667 -0.057 18880
3771 1 9 . 1 1 20 20 HIS C C 20 174.870 174.870 173.978 0.892 18880
3772 1 9 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.846 0.284 18880
3773 1 9 . 1 1 20 20 HIS CB C 20 29.710 29.710 31.213 -1.503 18880
3774 1 9 . 1 1 20 20 HIS H H 20 8.590 8.590 8.473 0.117 18880
3775 1 9 . 1 1 21 21 MET N N 21 121.440 121.440 122.169 -0.729 18880
3776 1 9 . 1 1 21 21 MET HA H 21 4.470 4.470 4.530 -0.060 18880
3777 1 9 . 1 1 21 21 MET C C 21 176.030 176.030 176.829 -0.799 18880
3778 1 9 . 1 1 21 21 MET CA C 21 55.490 55.490 56.372 -0.882 18880
3779 1 9 . 1 1 21 21 MET CB C 21 33.170 33.170 33.455 -0.285 18880
3780 1 9 . 1 1 21 21 MET H H 21 8.310 8.310 8.775 -0.465 18880
3781 1 9 . 1 1 22 22 SER N N 22 116.860 116.860 115.099 1.761 18880
3782 1 9 . 1 1 22 22 SER HA H 22 4.430 4.430 4.614 -0.184 18880
3783 1 9 . 1 1 22 22 SER C C 22 174.630 174.630 174.235 0.395 18880
3784 1 9 . 1 1 22 22 SER CA C 22 58.410 58.410 58.611 -0.201 18880
3785 1 9 . 1 1 22 22 SER CB C 22 64.030 64.030 63.618 0.412 18880
3786 1 9 . 1 1 22 22 SER H H 22 8.340 8.340 8.638 -0.298 18880
3787 1 9 . 1 1 23 23 ASP N N 23 122.660 122.660 122.701 -0.041 18880
3788 1 9 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.736 -0.186 18880
3789 1 9 . 1 1 23 23 ASP C C 23 176.860 176.860 177.312 -0.452 18880
3790 1 9 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.486 -0.156 18880
3791 1 9 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.637 0.363 18880
3792 1 9 . 1 1 23 23 ASP H H 23 8.540 8.540 8.339 0.201 18880
3793 1 9 . 1 1 24 24 GLU N N 24 120.400 120.400 117.596 2.804 18880
3794 1 9 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.260 -0.120 18880
3795 1 9 . 1 1 24 24 GLU C C 24 177.540 177.540 177.571 -0.031 18880
3796 1 9 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.293 0.067 18880
3797 1 9 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.309 0.441 18880
3798 1 9 . 1 1 24 24 GLU H H 24 8.610 8.610 8.419 0.191 18880
3799 1 9 . 1 1 25 25 LYS N N 25 120.390 120.390 117.953 2.437 18880
3800 1 9 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.178 0.012 18880
3801 1 9 . 1 1 25 25 LYS C C 25 177.490 177.490 177.916 -0.426 18880
3802 1 9 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.363 -0.253 18880
3803 1 9 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.669 -0.179 18880
3804 1 9 . 1 1 25 25 LYS H H 25 8.210 8.210 7.822 0.388 18880
3805 1 9 . 1 1 26 26 THR N N 26 114.880 114.880 115.899 -1.019 18880
3806 1 9 . 1 1 26 26 THR HA H 26 4.040 4.040 4.146 -0.106 18880
3807 1 9 . 1 1 26 26 THR C C 26 175.430 175.430 177.019 -1.589 18880
3808 1 9 . 1 1 26 26 THR CA C 26 64.620 64.620 65.677 -1.056 18880
3809 1 9 . 1 1 26 26 THR CB C 26 69.110 69.110 68.565 0.545 18880
3810 1 9 . 1 1 26 26 THR H H 26 8.080 8.080 7.486 0.594 18880
3811 1 9 . 1 1 27 27 GLN N N 27 120.940 120.940 121.151 -0.211 18880
3812 1 9 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.123 0.067 18880
3813 1 9 . 1 1 27 27 GLN C C 27 177.280 177.280 177.510 -0.230 18880
3814 1 9 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.809 -1.260 18880
3815 1 9 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.445 0.645 18880
3816 1 9 . 1 1 27 27 GLN H H 27 8.240 8.240 7.883 0.357 18880
3817 1 9 . 1 1 28 28 LEU N N 28 121.860 121.860 119.325 2.535 18880
3818 1 9 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.378 -0.208 18880
3819 1 9 . 1 1 28 28 LEU C C 28 177.750 177.750 177.704 0.046 18880
3820 1 9 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.581 1.499 18880
3821 1 9 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.564 -0.294 18880
3822 1 9 . 1 1 28 28 LEU H H 28 7.950 7.950 7.528 0.422 18880
3823 1 9 . 1 1 29 29 ILE N N 29 119.260 119.260 119.341 -0.081 18880
3824 1 9 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.245 -0.345 18880
3825 1 9 . 1 1 29 29 ILE C C 29 177.140 177.140 177.550 -0.410 18880
3826 1 9 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.422 -0.122 18880
3827 1 9 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.990 1.290 18880
3828 1 9 . 1 1 29 29 ILE H H 29 7.950 7.950 8.025 -0.075 18880
3829 1 9 . 1 1 30 30 GLU N N 30 120.500 120.500 119.762 0.738 18880
3830 1 9 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.433 -0.383 18880
3831 1 9 . 1 1 30 30 GLU C C 30 177.560 177.560 176.701 0.859 18880
3832 1 9 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.475 0.615 18880
3833 1 9 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.539 0.051 18880
3834 1 9 . 1 1 30 30 GLU H H 30 8.220 8.220 8.144 0.076 18880
3835 1 9 . 1 1 31 31 ALA N N 31 121.550 121.550 120.892 0.658 18880
3836 1 9 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.443 -0.293 18880
3837 1 9 . 1 1 31 31 ALA C C 31 178.550 178.550 179.148 -0.598 18880
3838 1 9 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.956 -0.156 18880
3839 1 9 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.565 -0.935 18880
3840 1 9 . 1 1 31 31 ALA H H 31 7.890 7.890 7.938 -0.048 18880
3841 1 9 . 1 1 32 32 PHE N N 32 117.240 117.240 118.161 -0.921 18880
3842 1 9 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.173 0.127 18880
3843 1 9 . 1 1 32 32 PHE C C 32 176.210 176.210 176.764 -0.554 18880
3844 1 9 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.582 -2.242 18880
3845 1 9 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.797 0.953 18880
3846 1 9 . 1 1 32 32 PHE H H 32 7.930 7.930 7.913 0.017 18880
3847 1 9 . 1 1 33 33 TYR N N 33 119.050 119.050 115.093 3.957 18880
3848 1 9 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.670 -0.340 18880
3849 1 9 . 1 1 33 33 TYR C C 33 175.680 175.680 175.513 0.167 18880
3850 1 9 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.314 0.606 18880
3851 1 9 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.312 1.228 18880
3852 1 9 . 1 1 33 33 TYR H H 33 7.950 7.950 8.342 -0.392 18880
3853 1 9 . 1 1 34 34 ASN N N 34 118.390 118.390 118.681 -0.291 18880
3854 1 9 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.838 -0.208 18880
3855 1 9 . 1 1 34 34 ASN C C 34 174.810 174.810 173.912 0.898 18880
3856 1 9 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.898 -0.748 18880
3857 1 9 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.773 -0.793 18880
3858 1 9 . 1 1 34 34 ASN H H 34 7.960 7.960 8.086 -0.126 18880
3859 1 9 . 1 1 35 35 PHE N N 35 120.670 120.670 120.377 0.293 18880
3860 1 9 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.495 -0.045 18880
3861 1 9 . 1 1 35 35 PHE C C 35 175.310 175.310 172.898 2.412 18880
3862 1 9 . 1 1 35 35 PHE CA C 35 58.320 58.320 57.763 0.557 18880
3863 1 9 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.506 -0.086 18880
3864 1 9 . 1 1 35 35 PHE H H 35 7.830 7.830 7.968 -0.138 18880
3865 1 9 . 1 1 36 36 ASP N N 36 122.400 122.400 119.689 2.711 18880
3866 1 9 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.624 -0.034 18880
3867 1 9 . 1 1 36 36 ASP C C 36 176.150 176.150 176.311 -0.161 18880
3868 1 9 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.077 0.993 18880
3869 1 9 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.598 0.722 18880
3870 1 9 . 1 1 36 36 ASP H H 36 8.180 8.180 7.896 0.284 18880
3871 1 9 . 1 1 37 37 GLY N N 37 108.560 108.560 108.699 -0.139 18880
3872 1 9 . 1 1 37 37 GLY C C 37 173.660 173.660 174.333 -0.673 18880
3873 1 9 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.787 -0.177 18880
3874 1 9 . 1 1 37 37 GLY H H 37 7.680 7.680 8.368 -0.688 18880
3875 1 9 . 1 1 38 38 ASP N N 38 120.010 120.010 117.149 2.861 18880
3876 1 9 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.694 -0.094 18880
3877 1 9 . 1 1 38 38 ASP CA C 38 54.260 54.260 53.603 0.657 18880
3878 1 9 . 1 1 38 38 ASP CB C 38 41.450 41.450 41.380 0.070 18880
3879 1 9 . 1 1 38 38 ASP H H 38 8.220 8.220 8.370 -0.150 18880
3880 1 9 . 1 1 39 39 TYR N N 39 121.030 121.030 122.213 -1.183 18880
3881 1 9 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.514 -0.124 18880
3882 1 9 . 1 1 39 39 TYR C C 39 175.290 175.290 174.044 1.246 18880
3883 1 9 . 1 1 39 39 TYR CA C 39 58.200 58.200 57.675 0.525 18880
3884 1 9 . 1 1 39 39 TYR CB C 39 39.170 39.170 39.121 0.049 18880
3885 1 9 . 1 1 39 39 TYR H H 39 8.090 8.090 7.967 0.123 18880
3886 1 9 . 1 1 40 40 ASP N N 40 122.020 122.020 118.762 3.258 18880
3887 1 9 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.329 0.271 18880
3888 1 9 . 1 1 40 40 ASP C C 40 175.970 175.970 175.818 0.152 18880
3889 1 9 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.723 -0.503 18880
3890 1 9 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.356 0.164 18880
3891 1 9 . 1 1 40 40 ASP H H 40 8.200 8.200 7.889 0.311 18880
3892 1 9 . 1 1 41 41 GLY N N 41 108.330 108.330 104.915 3.415 18880
3893 1 9 . 1 1 41 41 GLY C C 41 173.000 173.000 173.630 -0.630 18880
3894 1 9 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.084 1.337 18880
3895 1 9 . 1 1 41 41 GLY H H 41 7.830 7.830 8.084 -0.254 18880
3896 1 9 . 1 1 42 42 PHE N N 42 118.600 118.600 122.482 -3.882 18880
3897 1 9 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.359 0.901 18880
3898 1 9 . 1 1 42 42 PHE C C 42 175.660 175.660 174.773 0.887 18880
3899 1 9 . 1 1 42 42 PHE CA C 42 57.160 57.160 59.505 -2.345 18880
3900 1 9 . 1 1 42 42 PHE CB C 42 41.170 41.170 39.413 1.757 18880
3901 1 9 . 1 1 42 42 PHE H H 42 8.150 8.150 7.612 0.538 18880
3902 1 9 . 1 1 43 43 VAL N N 43 119.180 119.180 128.093 -8.913 18880
3903 1 9 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.321 0.349 18880
3904 1 9 . 1 1 43 43 VAL C C 43 175.110 175.110 173.975 1.135 18880
3905 1 9 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.136 0.484 18880
3906 1 9 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.268 -2.388 18880
3907 1 9 . 1 1 43 43 VAL H H 43 9.070 9.070 7.963 1.107 18880
3908 1 9 . 1 1 44 44 SER N N 44 121.380 121.380 123.055 -1.675 18880
3909 1 9 . 1 1 44 44 SER HA H 44 4.570 4.570 4.432 0.138 18880
3910 1 9 . 1 1 44 44 SER C C 44 175.660 175.660 175.475 0.185 18880
3911 1 9 . 1 1 44 44 SER CA C 44 57.720 57.720 57.879 -0.159 18880
3912 1 9 . 1 1 44 44 SER CB C 44 63.690 63.690 63.875 -0.185 18880
3913 1 9 . 1 1 44 44 SER H H 44 9.140 9.140 8.521 0.619 18880
3914 1 9 . 1 1 45 45 VAL N N 45 122.720 122.720 122.102 0.618 18880
3915 1 9 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.486 0.014 18880
3916 1 9 . 1 1 45 45 VAL C C 45 177.240 177.240 177.401 -0.161 18880
3917 1 9 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.052 0.218 18880
3918 1 9 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.761 0.689 18880
3919 1 9 . 1 1 45 45 VAL H H 45 8.140 8.140 8.731 -0.591 18880
3920 1 9 . 1 1 46 46 GLU N N 46 118.990 118.990 119.240 -0.250 18880
3921 1 9 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.932 0.048 18880
3922 1 9 . 1 1 46 46 GLU C C 46 179.460 179.460 178.793 0.667 18880
3923 1 9 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.419 0.141 18880
3924 1 9 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.258 -0.098 18880
3925 1 9 . 1 1 46 46 GLU H H 46 8.230 8.230 7.655 0.575 18880
3926 1 9 . 1 1 47 47 GLU N N 47 120.120 120.120 119.091 1.029 18880
3927 1 9 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.034 0.046 18880
3928 1 9 . 1 1 47 47 GLU C C 47 179.170 179.170 179.011 0.159 18880
3929 1 9 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.407 0.483 18880
3930 1 9 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.105 0.715 18880
3931 1 9 . 1 1 47 47 GLU H H 47 7.880 7.880 7.742 0.138 18880
3932 1 9 . 1 1 48 48 PHE N N 48 120.830 120.830 119.604 1.226 18880
3933 1 9 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.206 -0.016 18880
3934 1 9 . 1 1 48 48 PHE C C 48 176.920 176.920 177.524 -0.604 18880
3935 1 9 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.857 0.013 18880
3936 1 9 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.987 0.273 18880
3937 1 9 . 1 1 48 48 PHE H H 48 8.600 8.600 8.149 0.451 18880
3938 1 9 . 1 1 49 49 ARG N N 49 118.470 118.470 119.543 -1.073 18880
3939 1 9 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.118 -0.258 18880
3940 1 9 . 1 1 49 49 ARG C C 49 178.090 178.090 178.717 -0.627 18880
3941 1 9 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.270 -0.200 18880
3942 1 9 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.862 0.278 18880
3943 1 9 . 1 1 49 49 ARG H H 49 8.650 8.650 7.933 0.717 18880
3944 1 9 . 1 1 50 50 GLY N N 50 105.080 105.080 106.041 -0.961 18880
3945 1 9 . 1 1 50 50 GLY C C 50 175.090 175.090 175.926 -0.836 18880
3946 1 9 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.960 -0.280 18880
3947 1 9 . 1 1 50 50 GLY H H 50 7.620 7.620 7.895 -0.275 18880
3948 1 9 . 1 1 51 51 ILE N N 51 121.440 121.440 121.706 -0.266 18880
3949 1 9 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.845 -0.015 18880
3950 1 9 . 1 1 51 51 ILE C C 51 178.300 178.300 177.312 0.988 18880
3951 1 9 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.099 -0.259 18880
3952 1 9 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.104 0.206 18880
3953 1 9 . 1 1 51 51 ILE H H 51 7.470 7.470 7.111 0.359 18880
3954 1 9 . 1 1 52 52 ILE N N 52 118.930 118.930 119.187 -0.257 18880
3955 1 9 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.790 -0.050 18880
3956 1 9 . 1 1 52 52 ILE CA C 52 63.760 63.760 62.852 0.908 18880
3957 1 9 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.806 1.224 18880
3958 1 9 . 1 1 52 52 ILE H H 52 7.790 7.790 8.032 -0.242 18880
3959 1 9 . 1 1 53 53 ARG N N 53 120.140 120.140 118.479 1.661 18880
3960 1 9 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.012 0.078 18880
3961 1 9 . 1 1 53 53 ARG C C 53 177.380 177.380 177.416 -0.036 18880
3962 1 9 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.280 0.830 18880
3963 1 9 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.452 -0.872 18880
3964 1 9 . 1 1 53 53 ARG H H 53 7.930 7.930 8.317 -0.387 18880
3965 1 9 . 1 1 54 54 ASP N N 54 117.500 117.500 116.105 1.395 18880
3966 1 9 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.784 -0.184 18880
3967 1 9 . 1 1 54 54 ASP C C 54 176.930 176.930 176.539 0.391 18880
3968 1 9 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.871 1.669 18880
3969 1 9 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.211 -0.111 18880
3970 1 9 . 1 1 54 54 ASP H H 54 7.870 7.870 7.791 0.079 18880
3971 1 9 . 1 1 55 55 GLY N N 55 106.370 106.370 108.015 -1.645 18880
3972 1 9 . 1 1 55 55 GLY C C 55 173.460 173.460 173.794 -0.334 18880
3973 1 9 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.252 0.748 18880
3974 1 9 . 1 1 55 55 GLY H H 55 7.880 7.880 7.535 0.345 18880
3975 1 9 . 1 1 56 56 LEU N N 56 122.630 122.630 121.298 1.332 18880
3976 1 9 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.822 -0.053 18880
3977 1 9 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.445 1.045 18880
3978 1 9 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.896 0.224 18880
3979 1 9 . 1 1 56 56 LEU H H 56 8.220 8.220 7.789 0.431 18880
3980 1 9 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.529 0.051 18880
3981 1 9 . 1 1 57 57 PRO C C 57 176.150 176.150 175.616 0.534 18880
3982 1 9 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.521 -0.101 18880
3983 1 9 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.136 0.604 18880
3984 1 9 . 1 1 58 58 MET N N 58 121.810 121.810 121.549 0.261 18880
3985 1 9 . 1 1 58 58 MET HA H 58 4.630 4.630 4.528 0.102 18880
3986 1 9 . 1 1 58 58 MET C C 58 176.150 176.150 175.623 0.527 18880
3987 1 9 . 1 1 58 58 MET CA C 58 55.560 55.560 55.408 0.152 18880
3988 1 9 . 1 1 58 58 MET CB C 58 36.820 36.820 34.296 2.524 18880
3989 1 9 . 1 1 58 58 MET H H 58 7.690 7.690 7.796 -0.106 18880
3990 1 9 . 1 1 59 59 THR N N 59 114.180 114.180 115.656 -1.476 18880
3991 1 9 . 1 1 59 59 THR HA H 59 4.450 4.450 4.396 0.054 18880
3992 1 9 . 1 1 59 59 THR C C 59 175.170 175.170 175.873 -0.703 18880
3993 1 9 . 1 1 59 59 THR CA C 59 60.780 60.780 61.664 -0.884 18880
3994 1 9 . 1 1 59 59 THR CB C 59 71.060 71.060 69.711 1.349 18880
3995 1 9 . 1 1 59 59 THR H H 59 8.940 8.940 8.268 0.672 18880
3996 1 9 . 1 1 60 60 GLU N N 60 120.620 120.620 127.347 -6.727 18880
3997 1 9 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.780 0.230 18880
3998 1 9 . 1 1 60 60 GLU C C 60 179.010 179.010 177.929 1.081 18880
3999 1 9 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.926 -0.106 18880
4000 1 9 . 1 1 60 60 GLU CB C 60 29.050 29.050 29.087 -0.037 18880
4001 1 9 . 1 1 60 60 GLU H H 60 8.850 8.850 8.972 -0.122 18880
4002 1 9 . 1 1 61 61 ALA N N 61 121.080 121.080 122.166 -1.086 18880
4003 1 9 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.877 0.263 18880
4004 1 9 . 1 1 61 61 ALA C C 61 180.350 180.350 179.856 0.494 18880
4005 1 9 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.185 -0.095 18880
4006 1 9 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.948 0.262 18880
4007 1 9 . 1 1 61 61 ALA H H 61 8.370 8.370 8.402 -0.032 18880
4008 1 9 . 1 1 62 62 GLU N N 62 118.890 118.890 118.853 0.037 18880
4009 1 9 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.703 0.297 18880
4010 1 9 . 1 1 62 62 GLU C C 62 179.690 179.690 179.072 0.618 18880
4011 1 9 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.598 0.392 18880
4012 1 9 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.950 1.360 18880
4013 1 9 . 1 1 62 62 GLU H H 62 7.680 7.680 7.736 -0.056 18880
4014 1 9 . 1 1 63 63 ILE N N 63 122.340 122.340 120.348 1.992 18880
4015 1 9 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.513 0.057 18880
4016 1 9 . 1 1 63 63 ILE C C 63 177.260 177.260 178.350 -1.090 18880
4017 1 9 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.910 0.980 18880
4018 1 9 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.964 1.016 18880
4019 1 9 . 1 1 63 63 ILE H H 63 8.420 8.420 7.698 0.722 18880
4020 1 9 . 1 1 64 64 THR N N 64 116.970 116.970 116.454 0.516 18880
4021 1 9 . 1 1 64 64 THR HA H 64 3.940 3.940 4.104 -0.164 18880
4022 1 9 . 1 1 64 64 THR C C 64 176.520 176.520 176.522 -0.002 18880
4023 1 9 . 1 1 64 64 THR CA C 64 67.060 67.060 67.829 -0.769 18880
4024 1 9 . 1 1 64 64 THR CB C 64 68.750 68.750 68.302 0.448 18880
4025 1 9 . 1 1 64 64 THR H H 64 8.310 8.310 8.580 -0.270 18880
4026 1 9 . 1 1 65 65 GLU N N 65 120.760 120.760 119.945 0.815 18880
4027 1 9 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.059 -0.029 18880
4028 1 9 . 1 1 65 65 GLU C C 65 175.830 175.830 178.458 -2.628 18880
4029 1 9 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.686 0.814 18880
4030 1 9 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.359 0.411 18880
4031 1 9 . 1 1 65 65 GLU H H 65 7.970 7.970 8.442 -0.472 18880
4032 1 9 . 1 1 66 66 PHE N N 66 120.940 120.940 117.949 2.991 18880
4033 1 9 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.366 -0.126 18880
4034 1 9 . 1 1 66 66 PHE C C 66 177.330 177.330 177.069 0.261 18880
4035 1 9 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.738 2.462 18880
4036 1 9 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.138 -0.608 18880
4037 1 9 . 1 1 66 66 PHE H H 66 8.100 8.100 7.604 0.496 18880
4038 1 9 . 1 1 67 67 PHE N N 67 118.110 118.110 120.142 -2.032 18880
4039 1 9 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.294 -0.344 18880
4040 1 9 . 1 1 67 67 PHE C C 67 178.090 178.090 177.957 0.133 18880
4041 1 9 . 1 1 67 67 PHE CA C 67 61.200 61.200 60.454 0.746 18880
4042 1 9 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.691 -0.441 18880
4043 1 9 . 1 1 67 67 PHE H H 67 8.380 8.380 8.716 -0.336 18880
4044 1 9 . 1 1 68 68 GLU N N 68 119.650 119.650 117.159 2.491 18880
4045 1 9 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.256 -0.246 18880
4046 1 9 . 1 1 68 68 GLU C C 68 177.910 177.910 177.215 0.695 18880
4047 1 9 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.712 1.528 18880
4048 1 9 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.386 -0.016 18880
4049 1 9 . 1 1 68 68 GLU H H 68 8.230 8.230 8.083 0.147 18880
4050 1 9 . 1 1 69 69 ALA N N 69 119.090 119.090 120.454 -1.364 18880
4051 1 9 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.306 -0.126 18880
4052 1 9 . 1 1 69 69 ALA C C 69 179.030 179.030 178.466 0.564 18880
4053 1 9 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.691 -0.091 18880
4054 1 9 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.812 -0.032 18880
4055 1 9 . 1 1 69 69 ALA H H 69 7.340 7.340 7.703 -0.363 18880
4056 1 9 . 1 1 70 70 ALA N N 70 118.670 118.670 120.243 -1.573 18880
4057 1 9 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.419 -0.399 18880
4058 1 9 . 1 1 70 70 ALA C C 70 176.820 176.820 177.181 -0.361 18880
4059 1 9 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.689 0.401 18880
4060 1 9 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.311 -0.701 18880
4061 1 9 . 1 1 70 70 ALA H H 70 8.050 8.050 7.743 0.307 18880
4062 1 9 . 1 1 71 71 ASP N N 71 116.780 116.780 118.151 -1.371 18880
4063 1 9 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.152 0.068 18880
4064 1 9 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.820 1.330 18880
4065 1 9 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.030 -2.120 18880
4066 1 9 . 1 1 71 71 ASP H H 71 8.010 8.010 7.611 0.399 18880
4067 1 9 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.360 0.110 18880
4068 1 9 . 1 1 72 72 PRO C C 72 177.970 177.970 177.221 0.749 18880
4069 1 9 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.558 0.352 18880
4070 1 9 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.327 -0.447 18880
4071 1 9 . 1 1 73 73 ASN N N 73 114.930 114.930 115.168 -0.238 18880
4072 1 9 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.667 0.213 18880
4073 1 9 . 1 1 73 73 ASN C C 73 174.880 174.880 174.430 0.450 18880
4074 1 9 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.699 -0.859 18880
4075 1 9 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.722 -0.342 18880
4076 1 9 . 1 1 73 73 ASN H H 73 9.030 9.030 8.390 0.640 18880
4077 1 9 . 1 1 74 74 ASN N N 74 118.340 118.340 114.766 3.574 18880
4078 1 9 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.501 -0.141 18880
4079 1 9 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.872 0.718 18880
4080 1 9 . 1 1 74 74 ASN CB C 74 37.160 37.160 37.122 0.038 18880
4081 1 9 . 1 1 74 74 ASN H H 74 8.320 8.320 8.620 -0.300 18880
4082 1 9 . 1 1 75 75 THR N N 75 113.450 113.450 115.802 -2.352 18880
4083 1 9 . 1 1 75 75 THR HA H 75 4.210 4.210 4.261 -0.051 18880
4084 1 9 . 1 1 75 75 THR CA C 75 63.410 63.410 60.786 2.624 18880
4085 1 9 . 1 1 75 75 THR CB C 75 70.540 70.540 67.477 3.063 18880
4086 1 9 . 1 1 75 75 THR H H 75 9.870 9.870 8.572 1.298 18880
4087 1 9 . 1 1 76 76 GLY N N 76 111.810 111.810 109.637 2.173 18880
4088 1 9 . 1 1 76 76 GLY C C 76 173.670 173.670 173.701 -0.031 18880
4089 1 9 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.855 -0.736 18880
4090 1 9 . 1 1 76 76 GLY H H 76 10.250 10.250 7.465 2.785 18880
4091 1 9 . 1 1 77 77 PHE N N 77 120.560 120.560 117.639 2.921 18880
4092 1 9 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.877 0.273 18880
4093 1 9 . 1 1 77 77 PHE CA C 77 57.180 57.180 55.594 1.585 18880
4094 1 9 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.838 1.662 18880
4095 1 9 . 1 1 77 77 PHE H H 77 8.110 8.110 7.247 0.863 18880
4096 1 9 . 1 1 78 78 ILE N N 78 116.410 116.410 121.741 -5.331 18880
4097 1 9 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.250 0.140 18880
4098 1 9 . 1 1 78 78 ILE C C 78 174.770 174.770 174.615 0.155 18880
4099 1 9 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.969 -0.779 18880
4100 1 9 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.291 0.889 18880
4101 1 9 . 1 1 78 78 ILE H H 78 8.930 8.930 7.836 1.094 18880
4102 1 9 . 1 1 79 79 ASP N N 79 125.220 125.220 125.098 0.122 18880
4103 1 9 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.886 -0.386 18880
4104 1 9 . 1 1 79 79 ASP C C 79 176.490 176.490 177.085 -0.595 18880
4105 1 9 . 1 1 79 79 ASP CA C 79 53.310 53.310 51.770 1.540 18880
4106 1 9 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.708 0.662 18880
4107 1 9 . 1 1 79 79 ASP H H 79 8.610 8.610 8.655 -0.045 18880
4108 1 9 . 1 1 80 80 TYR N N 80 125.760 125.760 129.374 -3.614 18880
4109 1 9 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.099 -0.109 18880
4110 1 9 . 1 1 80 80 TYR C C 80 177.140 177.140 176.773 0.367 18880
4111 1 9 . 1 1 80 80 TYR CA C 80 61.580 61.580 61.740 -0.160 18880
4112 1 9 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.646 0.244 18880
4113 1 9 . 1 1 80 80 TYR H H 80 8.460 8.460 8.663 -0.203 18880
4114 1 9 . 1 1 81 81 LYS N N 81 118.320 118.320 117.962 0.358 18880
4115 1 9 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.852 0.048 18880
4116 1 9 . 1 1 81 81 LYS C C 81 179.090 179.090 178.527 0.563 18880
4117 1 9 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.256 0.324 18880
4118 1 9 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.951 -0.191 18880
4119 1 9 . 1 1 81 81 LYS H H 81 8.410 8.410 7.944 0.466 18880
4120 1 9 . 1 1 82 82 ALA N N 82 122.050 122.050 121.611 0.439 18880
4121 1 9 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.175 -0.044 18880
4122 1 9 . 1 1 82 82 ALA C C 82 179.740 179.740 179.470 0.270 18880
4123 1 9 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.625 -0.105 18880
4124 1 9 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.251 0.289 18880
4125 1 9 . 1 1 82 82 ALA H H 82 7.770 7.770 8.231 -0.461 18880
4126 1 9 . 1 1 83 83 PHE N N 83 117.810 117.810 116.982 0.828 18880
4127 1 9 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.267 0.023 18880
4128 1 9 . 1 1 83 83 PHE C C 83 176.460 176.460 176.716 -0.256 18880
4129 1 9 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.244 -0.214 18880
4130 1 9 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.003 -0.483 18880
4131 1 9 . 1 1 83 83 PHE H H 83 7.780 7.780 7.785 -0.005 18880
4132 1 9 . 1 1 84 84 ALA N N 84 121.530 121.530 121.695 -0.165 18880
4133 1 9 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.038 -0.378 18880
4134 1 9 . 1 1 84 84 ALA C C 84 179.010 179.010 179.401 -0.391 18880
4135 1 9 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.116 0.914 18880
4136 1 9 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.124 0.006 18880
4137 1 9 . 1 1 84 84 ALA H H 84 8.290 8.290 8.230 0.060 18880
4138 1 9 . 1 1 85 85 ALA N N 85 117.720 117.720 120.163 -2.443 18880
4139 1 9 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.111 -0.031 18880
4140 1 9 . 1 1 85 85 ALA C C 85 179.570 179.570 177.903 1.667 18880
4141 1 9 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.137 0.233 18880
4142 1 9 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.675 -0.385 18880
4143 1 9 . 1 1 85 85 ALA H H 85 7.700 7.700 8.453 -0.753 18880
4144 1 9 . 1 1 86 86 MET N N 86 116.570 116.570 114.161 2.409 18880
4145 1 9 . 1 1 86 86 MET HA H 86 4.160 4.160 4.189 -0.029 18880
4146 1 9 . 1 1 86 86 MET C C 86 177.360 177.360 177.522 -0.162 18880
4147 1 9 . 1 1 86 86 MET CA C 86 57.380 57.380 57.599 -0.219 18880
4148 1 9 . 1 1 86 86 MET CB C 86 32.720 32.720 32.158 0.562 18880
4149 1 9 . 1 1 86 86 MET H H 86 7.560 7.560 7.958 -0.398 18880
4150 1 9 . 1 1 87 87 LEU N N 87 119.090 119.090 116.255 2.835 18880
4151 1 9 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.113 -0.143 18880
4152 1 9 . 1 1 87 87 LEU C C 87 177.420 177.420 176.377 1.043 18880
4153 1 9 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.175 1.115 18880
4154 1 9 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.130 0.150 18880
4155 1 9 . 1 1 87 87 LEU H H 87 7.570 7.570 7.209 0.361 18880
4156 1 9 . 1 1 88 88 TYR N N 88 117.060 117.060 115.569 1.491 18880
4157 1 9 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.647 -0.057 18880
4158 1 9 . 1 1 88 88 TYR C C 88 175.870 175.870 174.739 1.131 18880
4159 1 9 . 1 1 88 88 TYR CA C 88 57.840 57.840 54.745 3.095 18880
4160 1 9 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.790 0.850 18880
4161 1 9 . 1 1 88 88 TYR H H 88 7.740 7.740 7.148 0.592 18880
4162 1 9 . 1 1 89 89 SER N N 89 115.980 115.980 117.312 -1.332 18880
4163 1 9 . 1 1 89 89 SER HA H 89 4.440 4.440 4.434 0.006 18880
4164 1 9 . 1 1 89 89 SER C C 89 174.460 174.460 175.095 -0.635 18880
4165 1 9 . 1 1 89 89 SER CA C 89 58.350 58.350 59.263 -0.913 18880
4166 1 9 . 1 1 89 89 SER CB C 89 63.990 63.990 62.708 1.282 18880
4167 1 9 . 1 1 89 89 SER H H 89 7.880 7.880 8.021 -0.141 18880
4168 1 9 . 1 1 90 90 VAL N N 90 120.910 120.910 118.606 2.304 18880
4169 1 9 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.452 -0.312 18880
4170 1 9 . 1 1 90 90 VAL C C 90 175.720 175.720 174.315 1.405 18880
4171 1 9 . 1 1 90 90 VAL CA C 90 62.270 62.270 60.948 1.322 18880
4172 1 9 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.402 0.438 18880
4173 1 9 . 1 1 90 90 VAL H H 90 8.020 8.020 7.770 0.250 18880
4174 1 9 . 1 1 91 91 ASP N N 91 123.620 123.620 118.103 5.517 18880
4175 1 9 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.824 -0.194 18880
4176 1 9 . 1 1 91 91 ASP C C 91 176.000 176.000 175.185 0.815 18880
4177 1 9 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.025 0.485 18880
4178 1 9 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.891 -0.451 18880
4179 1 9 . 1 1 91 91 ASP H H 91 8.310 8.310 8.061 0.249 18880
4180 1 9 . 1 1 92 92 GLU N N 92 122.170 122.170 122.503 -0.333 18880
4181 1 9 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.498 -0.138 18880
4182 1 9 . 1 1 92 92 GLU C C 92 175.660 175.660 176.071 -0.411 18880
4183 1 9 . 1 1 92 92 GLU CA C 92 56.490 56.490 55.782 0.708 18880
4184 1 9 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.730 2.120 18880
4185 1 9 . 1 1 92 92 GLU H H 92 8.320 8.320 8.333 -0.013 18880
4186 1 10 . 1 1 10 10 HIS C C 10 176.040 176.040 175.607 0.433 18880
4187 1 10 . 1 1 11 11 SER N N 11 116.840 116.840 109.486 7.354 18880
4188 1 10 . 1 1 11 11 SER HA H 11 4.430 4.430 4.447 -0.017 18880
4189 1 10 . 1 1 11 11 SER C C 11 174.630 174.630 174.245 0.385 18880
4190 1 10 . 1 1 11 11 SER CA C 11 58.350 58.350 58.566 -0.217 18880
4191 1 10 . 1 1 11 11 SER CB C 11 64.120 64.120 63.635 0.485 18880
4192 1 10 . 1 1 11 11 SER H H 11 8.360 8.360 8.258 0.102 18880
4193 1 10 . 1 1 12 12 SER N N 12 118.030 118.030 115.711 2.319 18880
4194 1 10 . 1 1 12 12 SER HA H 12 4.440 4.440 4.614 -0.174 18880
4195 1 10 . 1 1 12 12 SER C C 12 174.880 174.880 173.803 1.077 18880
4196 1 10 . 1 1 12 12 SER CA C 12 58.680 58.680 59.080 -0.400 18880
4197 1 10 . 1 1 12 12 SER CB C 12 63.890 63.890 64.548 -0.658 18880
4198 1 10 . 1 1 12 12 SER H H 12 8.490 8.490 8.389 0.101 18880
4199 1 10 . 1 1 13 13 GLY N N 13 110.450 110.450 111.123 -0.673 18880
4200 1 10 . 1 1 13 13 GLY C C 13 173.790 173.790 174.521 -0.731 18880
4201 1 10 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.012 0.448 18880
4202 1 10 . 1 1 13 13 GLY H H 13 8.390 8.390 7.955 0.435 18880
4203 1 10 . 1 1 14 14 LEU N N 14 121.310 121.310 126.767 -5.457 18880
4204 1 10 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.419 -0.079 18880
4205 1 10 . 1 1 14 14 LEU C C 14 176.930 176.930 177.579 -0.649 18880
4206 1 10 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.933 -0.733 18880
4207 1 10 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.029 0.571 18880
4208 1 10 . 1 1 14 14 LEU H H 14 8.020 8.020 8.567 -0.547 18880
4209 1 10 . 1 1 15 15 VAL N N 15 121.550 121.550 116.979 4.571 18880
4210 1 10 . 1 1 15 15 VAL HA H 15 4.370 4.370 3.880 0.490 18880
4211 1 10 . 1 1 15 15 VAL CA C 15 59.720 59.720 61.836 -2.116 18880
4212 1 10 . 1 1 15 15 VAL CB C 15 32.770 32.770 30.190 2.580 18880
4213 1 10 . 1 1 15 15 VAL H H 15 8.030 8.030 8.117 -0.087 18880
4214 1 10 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.466 -0.096 18880
4215 1 10 . 1 1 16 16 PRO C C 16 176.720 176.720 177.954 -1.234 18880
4216 1 10 . 1 1 16 16 PRO CA C 16 62.650 62.650 62.904 -0.254 18880
4217 1 10 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.334 -0.094 18880
4218 1 10 . 1 1 17 17 ARG N N 17 121.890 121.890 114.909 6.981 18880
4219 1 10 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.019 0.261 18880
4220 1 10 . 1 1 17 17 ARG C C 17 176.940 176.940 176.566 0.374 18880
4221 1 10 . 1 1 17 17 ARG CA C 17 56.360 56.360 57.771 -1.411 18880
4222 1 10 . 1 1 17 17 ARG CB C 17 31.050 31.050 28.512 2.538 18880
4223 1 10 . 1 1 17 17 ARG H H 17 8.450 8.450 8.752 -0.302 18880
4224 1 10 . 1 1 18 18 GLY N N 18 110.160 110.160 111.095 -0.935 18880
4225 1 10 . 1 1 18 18 GLY C C 18 174.110 174.110 173.867 0.243 18880
4226 1 10 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.281 0.109 18880
4227 1 10 . 1 1 18 18 GLY H H 18 8.480 8.480 8.214 0.266 18880
4228 1 10 . 1 1 19 19 SER N N 19 115.500 115.500 117.347 -1.847 18880
4229 1 10 . 1 1 19 19 SER HA H 19 4.400 4.400 4.563 -0.163 18880
4230 1 10 . 1 1 19 19 SER C C 19 174.380 174.380 174.875 -0.495 18880
4231 1 10 . 1 1 19 19 SER CA C 19 58.610 58.610 57.772 0.839 18880
4232 1 10 . 1 1 19 19 SER CB C 19 63.830 63.830 64.155 -0.325 18880
4233 1 10 . 1 1 19 19 SER H H 19 8.210 8.210 8.103 0.107 18880
4234 1 10 . 1 1 20 20 HIS N N 20 120.770 120.770 119.492 1.278 18880
4235 1 10 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.808 -0.198 18880
4236 1 10 . 1 1 20 20 HIS C C 20 174.870 174.870 176.188 -1.318 18880
4237 1 10 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.970 -0.840 18880
4238 1 10 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.816 -1.106 18880
4239 1 10 . 1 1 20 20 HIS H H 20 8.590 8.590 8.617 -0.027 18880
4240 1 10 . 1 1 21 21 MET N N 21 121.440 121.440 120.522 0.918 18880
4241 1 10 . 1 1 21 21 MET HA H 21 4.470 4.470 4.493 -0.023 18880
4242 1 10 . 1 1 21 21 MET C C 21 176.030 176.030 176.033 -0.003 18880
4243 1 10 . 1 1 21 21 MET CA C 21 55.490 55.490 56.208 -0.718 18880
4244 1 10 . 1 1 21 21 MET CB C 21 33.170 33.170 31.815 1.355 18880
4245 1 10 . 1 1 21 21 MET H H 21 8.310 8.310 8.138 0.172 18880
4246 1 10 . 1 1 22 22 SER N N 22 116.860 116.860 118.757 -1.897 18880
4247 1 10 . 1 1 22 22 SER HA H 22 4.430 4.430 4.519 -0.089 18880
4248 1 10 . 1 1 22 22 SER C C 22 174.630 174.630 175.429 -0.799 18880
4249 1 10 . 1 1 22 22 SER CA C 22 58.410 58.410 57.951 0.459 18880
4250 1 10 . 1 1 22 22 SER CB C 22 64.030 64.030 63.139 0.891 18880
4251 1 10 . 1 1 22 22 SER H H 22 8.340 8.340 8.791 -0.451 18880
4252 1 10 . 1 1 23 23 ASP N N 23 122.660 122.660 122.279 0.381 18880
4253 1 10 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.590 -0.040 18880
4254 1 10 . 1 1 23 23 ASP C C 23 176.860 176.860 177.507 -0.647 18880
4255 1 10 . 1 1 23 23 ASP CA C 23 55.330 55.330 56.263 -0.933 18880
4256 1 10 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.434 0.566 18880
4257 1 10 . 1 1 23 23 ASP H H 23 8.540 8.540 8.492 0.048 18880
4258 1 10 . 1 1 24 24 GLU N N 24 120.400 120.400 117.842 2.558 18880
4259 1 10 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.092 0.048 18880
4260 1 10 . 1 1 24 24 GLU C C 24 177.540 177.540 177.373 0.167 18880
4261 1 10 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.222 0.138 18880
4262 1 10 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.191 0.559 18880
4263 1 10 . 1 1 24 24 GLU H H 24 8.610 8.610 8.431 0.179 18880
4264 1 10 . 1 1 25 25 LYS N N 25 120.390 120.390 117.817 2.573 18880
4265 1 10 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.288 -0.098 18880
4266 1 10 . 1 1 25 25 LYS C C 25 177.490 177.490 178.416 -0.926 18880
4267 1 10 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.054 0.056 18880
4268 1 10 . 1 1 25 25 LYS CB C 25 32.490 32.490 33.170 -0.680 18880
4269 1 10 . 1 1 25 25 LYS H H 25 8.210 8.210 7.526 0.684 18880
4270 1 10 . 1 1 26 26 THR N N 26 114.880 114.880 116.245 -1.365 18880
4271 1 10 . 1 1 26 26 THR HA H 26 4.040 4.040 4.141 -0.101 18880
4272 1 10 . 1 1 26 26 THR C C 26 175.430 175.430 176.578 -1.148 18880
4273 1 10 . 1 1 26 26 THR CA C 26 64.620 64.620 65.835 -1.215 18880
4274 1 10 . 1 1 26 26 THR CB C 26 69.110 69.110 68.503 0.607 18880
4275 1 10 . 1 1 26 26 THR H H 26 8.080 8.080 7.662 0.418 18880
4276 1 10 . 1 1 27 27 GLN N N 27 120.940 120.940 121.792 -0.852 18880
4277 1 10 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.111 0.079 18880
4278 1 10 . 1 1 27 27 GLN C C 27 177.280 177.280 177.458 -0.178 18880
4279 1 10 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.454 -0.904 18880
4280 1 10 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.612 0.478 18880
4281 1 10 . 1 1 27 27 GLN H H 27 8.240 8.240 7.882 0.358 18880
4282 1 10 . 1 1 28 28 LEU N N 28 121.860 121.860 119.208 2.652 18880
4283 1 10 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.328 -0.158 18880
4284 1 10 . 1 1 28 28 LEU C C 28 177.750 177.750 177.795 -0.045 18880
4285 1 10 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.701 1.379 18880
4286 1 10 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.582 -0.312 18880
4287 1 10 . 1 1 28 28 LEU H H 28 7.950 7.950 7.504 0.446 18880
4288 1 10 . 1 1 29 29 ILE N N 29 119.260 119.260 119.254 0.006 18880
4289 1 10 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.020 -0.120 18880
4290 1 10 . 1 1 29 29 ILE C C 29 177.140 177.140 177.476 -0.336 18880
4291 1 10 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.244 0.056 18880
4292 1 10 . 1 1 29 29 ILE CB C 29 38.280 38.280 37.038 1.242 18880
4293 1 10 . 1 1 29 29 ILE H H 29 7.950 7.950 7.994 -0.044 18880
4294 1 10 . 1 1 30 30 GLU N N 30 120.500 120.500 119.967 0.533 18880
4295 1 10 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.411 -0.361 18880
4296 1 10 . 1 1 30 30 GLU C C 30 177.560 177.560 176.592 0.968 18880
4297 1 10 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.713 0.377 18880
4298 1 10 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.396 0.194 18880
4299 1 10 . 1 1 30 30 GLU H H 30 8.220 8.220 8.070 0.150 18880
4300 1 10 . 1 1 31 31 ALA N N 31 121.550 121.550 121.061 0.489 18880
4301 1 10 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.305 -0.155 18880
4302 1 10 . 1 1 31 31 ALA C C 31 178.550 178.550 178.832 -0.282 18880
4303 1 10 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.797 0.003 18880
4304 1 10 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.184 -0.554 18880
4305 1 10 . 1 1 31 31 ALA H H 31 7.890 7.890 7.602 0.288 18880
4306 1 10 . 1 1 32 32 PHE N N 32 117.240 117.240 117.954 -0.714 18880
4307 1 10 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.223 0.077 18880
4308 1 10 . 1 1 32 32 PHE C C 32 176.210 176.210 177.044 -0.834 18880
4309 1 10 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.712 -1.372 18880
4310 1 10 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.744 1.006 18880
4311 1 10 . 1 1 32 32 PHE H H 32 7.930 7.930 7.545 0.385 18880
4312 1 10 . 1 1 33 33 TYR N N 33 119.050 119.050 115.519 3.531 18880
4313 1 10 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.663 -0.333 18880
4314 1 10 . 1 1 33 33 TYR C C 33 175.680 175.680 175.672 0.008 18880
4315 1 10 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.403 0.517 18880
4316 1 10 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.465 1.075 18880
4317 1 10 . 1 1 33 33 TYR H H 33 7.950 7.950 8.241 -0.291 18880
4318 1 10 . 1 1 34 34 ASN N N 34 118.390 118.390 118.941 -0.551 18880
4319 1 10 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.866 -0.236 18880
4320 1 10 . 1 1 34 34 ASN C C 34 174.810 174.810 174.013 0.797 18880
4321 1 10 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.690 -0.540 18880
4322 1 10 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.894 -0.914 18880
4323 1 10 . 1 1 34 34 ASN H H 34 7.960 7.960 8.001 -0.041 18880
4324 1 10 . 1 1 35 35 PHE N N 35 120.670 120.670 119.901 0.769 18880
4325 1 10 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.501 -0.051 18880
4326 1 10 . 1 1 35 35 PHE C C 35 175.310 175.310 173.482 1.828 18880
4327 1 10 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.420 -0.101 18880
4328 1 10 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.127 -0.707 18880
4329 1 10 . 1 1 35 35 PHE H H 35 7.830 7.830 7.892 -0.062 18880
4330 1 10 . 1 1 36 36 ASP N N 36 122.400 122.400 122.397 0.003 18880
4331 1 10 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.807 -0.217 18880
4332 1 10 . 1 1 36 36 ASP C C 36 176.150 176.150 175.689 0.461 18880
4333 1 10 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.178 0.892 18880
4334 1 10 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.259 0.061 18880
4335 1 10 . 1 1 36 36 ASP H H 36 8.180 8.180 8.441 -0.261 18880
4336 1 10 . 1 1 37 37 GLY N N 37 108.560 108.560 108.180 0.380 18880
4337 1 10 . 1 1 37 37 GLY C C 37 173.660 173.660 173.593 0.067 18880
4338 1 10 . 1 1 37 37 GLY CA C 37 45.610 45.610 44.553 1.056 18880
4339 1 10 . 1 1 37 37 GLY H H 37 7.680 7.680 6.928 0.752 18880
4340 1 10 . 1 1 38 38 ASP N N 38 120.010 120.010 118.725 1.285 18880
4341 1 10 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.158 0.442 18880
4342 1 10 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.379 -0.119 18880
4343 1 10 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.305 2.145 18880
4344 1 10 . 1 1 38 38 ASP H H 38 8.220 8.220 7.748 0.472 18880
4345 1 10 . 1 1 39 39 TYR N N 39 121.030 121.030 116.550 4.480 18880
4346 1 10 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.182 0.208 18880
4347 1 10 . 1 1 39 39 TYR C C 39 175.290 175.290 177.640 -2.350 18880
4348 1 10 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.808 -0.608 18880
4349 1 10 . 1 1 39 39 TYR CB C 39 39.170 39.170 36.886 2.284 18880
4350 1 10 . 1 1 39 39 TYR H H 39 8.090 8.090 7.200 0.890 18880
4351 1 10 . 1 1 40 40 ASP N N 40 122.020 122.020 121.680 0.340 18880
4352 1 10 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.581 0.019 18880
4353 1 10 . 1 1 40 40 ASP C C 40 175.970 175.970 177.307 -1.337 18880
4354 1 10 . 1 1 40 40 ASP CA C 40 54.220 54.220 55.026 -0.806 18880
4355 1 10 . 1 1 40 40 ASP CB C 40 41.520 41.520 40.981 0.539 18880
4356 1 10 . 1 1 40 40 ASP H H 40 8.200 8.200 8.481 -0.281 18880
4357 1 10 . 1 1 41 41 GLY N N 41 108.330 108.330 105.057 3.273 18880
4358 1 10 . 1 1 41 41 GLY C C 41 173.000 173.000 172.533 0.467 18880
4359 1 10 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.797 0.623 18880
4360 1 10 . 1 1 41 41 GLY H H 41 7.830 7.830 8.196 -0.366 18880
4361 1 10 . 1 1 42 42 PHE N N 42 118.600 118.600 118.221 0.379 18880
4362 1 10 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.983 0.277 18880
4363 1 10 . 1 1 42 42 PHE C C 42 175.660 175.660 174.318 1.342 18880
4364 1 10 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.131 0.029 18880
4365 1 10 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.212 -1.042 18880
4366 1 10 . 1 1 42 42 PHE H H 42 8.150 8.150 7.747 0.403 18880
4367 1 10 . 1 1 43 43 VAL N N 43 119.180 119.180 125.608 -6.428 18880
4368 1 10 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.554 0.116 18880
4369 1 10 . 1 1 43 43 VAL C C 43 175.110 175.110 174.872 0.238 18880
4370 1 10 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.972 0.648 18880
4371 1 10 . 1 1 43 43 VAL CB C 43 32.880 32.880 33.947 -1.067 18880
4372 1 10 . 1 1 43 43 VAL H H 43 9.070 9.070 8.633 0.437 18880
4373 1 10 . 1 1 44 44 SER N N 44 121.380 121.380 124.111 -2.731 18880
4374 1 10 . 1 1 44 44 SER HA H 44 4.570 4.570 4.084 0.486 18880
4375 1 10 . 1 1 44 44 SER C C 44 175.660 175.660 175.290 0.370 18880
4376 1 10 . 1 1 44 44 SER CA C 44 57.720 57.720 57.645 0.075 18880
4377 1 10 . 1 1 44 44 SER CB C 44 63.690 63.690 63.233 0.456 18880
4378 1 10 . 1 1 44 44 SER H H 44 9.140 9.140 8.537 0.603 18880
4379 1 10 . 1 1 45 45 VAL N N 45 122.720 122.720 122.931 -0.211 18880
4380 1 10 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.223 0.277 18880
4381 1 10 . 1 1 45 45 VAL C C 45 177.240 177.240 177.470 -0.230 18880
4382 1 10 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.728 -0.458 18880
4383 1 10 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.856 0.594 18880
4384 1 10 . 1 1 45 45 VAL H H 45 8.140 8.140 8.329 -0.189 18880
4385 1 10 . 1 1 46 46 GLU N N 46 118.990 118.990 118.666 0.324 18880
4386 1 10 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.778 0.202 18880
4387 1 10 . 1 1 46 46 GLU C C 46 179.460 179.460 179.113 0.347 18880
4388 1 10 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.658 -0.098 18880
4389 1 10 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.754 0.406 18880
4390 1 10 . 1 1 46 46 GLU H H 46 8.230 8.230 7.406 0.824 18880
4391 1 10 . 1 1 47 47 GLU N N 47 120.120 120.120 118.340 1.780 18880
4392 1 10 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.192 -0.112 18880
4393 1 10 . 1 1 47 47 GLU C C 47 179.170 179.170 178.623 0.547 18880
4394 1 10 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.148 0.742 18880
4395 1 10 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.746 0.074 18880
4396 1 10 . 1 1 47 47 GLU H H 47 7.880 7.880 7.988 -0.108 18880
4397 1 10 . 1 1 48 48 PHE N N 48 120.830 120.830 120.857 -0.027 18880
4398 1 10 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.217 -0.027 18880
4399 1 10 . 1 1 48 48 PHE C C 48 176.920 176.920 177.601 -0.681 18880
4400 1 10 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.407 0.463 18880
4401 1 10 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.941 0.318 18880
4402 1 10 . 1 1 48 48 PHE H H 48 8.600 8.600 8.150 0.450 18880
4403 1 10 . 1 1 49 49 ARG N N 49 118.470 118.470 119.455 -0.985 18880
4404 1 10 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.083 -0.223 18880
4405 1 10 . 1 1 49 49 ARG C C 49 178.090 178.090 178.754 -0.664 18880
4406 1 10 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.447 -0.377 18880
4407 1 10 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.803 0.337 18880
4408 1 10 . 1 1 49 49 ARG H H 49 8.650 8.650 9.015 -0.365 18880
4409 1 10 . 1 1 50 50 GLY N N 50 105.080 105.080 105.415 -0.335 18880
4410 1 10 . 1 1 50 50 GLY C C 50 175.090 175.090 175.790 -0.700 18880
4411 1 10 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.864 -0.184 18880
4412 1 10 . 1 1 50 50 GLY H H 50 7.620 7.620 7.993 -0.373 18880
4413 1 10 . 1 1 51 51 ILE N N 51 121.440 121.440 121.292 0.148 18880
4414 1 10 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.929 -0.099 18880
4415 1 10 . 1 1 51 51 ILE C C 51 178.300 178.300 177.188 1.112 18880
4416 1 10 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.012 -0.172 18880
4417 1 10 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.626 -0.315 18880
4418 1 10 . 1 1 51 51 ILE H H 51 7.470 7.470 7.386 0.084 18880
4419 1 10 . 1 1 52 52 ILE N N 52 118.930 118.930 119.427 -0.497 18880
4420 1 10 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.725 0.015 18880
4421 1 10 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.191 0.569 18880
4422 1 10 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.735 1.295 18880
4423 1 10 . 1 1 52 52 ILE H H 52 7.790 7.790 8.520 -0.730 18880
4424 1 10 . 1 1 53 53 ARG N N 53 120.140 120.140 119.523 0.617 18880
4425 1 10 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.951 0.139 18880
4426 1 10 . 1 1 53 53 ARG C C 53 177.380 177.380 177.125 0.255 18880
4427 1 10 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.328 0.782 18880
4428 1 10 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.549 -0.970 18880
4429 1 10 . 1 1 53 53 ARG H H 53 7.930 7.930 8.234 -0.304 18880
4430 1 10 . 1 1 54 54 ASP N N 54 117.500 117.500 115.474 2.026 18880
4431 1 10 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.733 -0.133 18880
4432 1 10 . 1 1 54 54 ASP C C 54 176.930 176.930 176.105 0.825 18880
4433 1 10 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.634 1.906 18880
4434 1 10 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.727 0.373 18880
4435 1 10 . 1 1 54 54 ASP H H 54 7.870 7.870 8.117 -0.247 18880
4436 1 10 . 1 1 55 55 GLY N N 55 106.370 106.370 108.228 -1.858 18880
4437 1 10 . 1 1 55 55 GLY C C 55 173.460 173.460 173.919 -0.459 18880
4438 1 10 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.450 0.550 18880
4439 1 10 . 1 1 55 55 GLY H H 55 7.880 7.880 7.836 0.044 18880
4440 1 10 . 1 1 56 56 LEU N N 56 122.630 122.630 122.392 0.238 18880
4441 1 10 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.716 0.054 18880
4442 1 10 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.406 1.084 18880
4443 1 10 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.719 0.401 18880
4444 1 10 . 1 1 56 56 LEU H H 56 8.220 8.220 7.802 0.418 18880
4445 1 10 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.472 0.108 18880
4446 1 10 . 1 1 57 57 PRO C C 57 176.150 176.150 175.565 0.585 18880
4447 1 10 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.121 -0.701 18880
4448 1 10 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.639 -0.898 18880
4449 1 10 . 1 1 58 58 MET N N 58 121.810 121.810 124.027 -2.217 18880
4450 1 10 . 1 1 58 58 MET HA H 58 4.630 4.630 4.553 0.077 18880
4451 1 10 . 1 1 58 58 MET C C 58 176.150 176.150 174.430 1.720 18880
4452 1 10 . 1 1 58 58 MET CA C 58 55.560 55.560 54.471 1.089 18880
4453 1 10 . 1 1 58 58 MET CB C 58 36.820 36.820 36.794 0.027 18880
4454 1 10 . 1 1 58 58 MET H H 58 7.690 7.690 8.118 -0.428 18880
4455 1 10 . 1 1 59 59 THR N N 59 114.180 114.180 114.654 -0.474 18880
4456 1 10 . 1 1 59 59 THR HA H 59 4.450 4.450 4.503 -0.053 18880
4457 1 10 . 1 1 59 59 THR C C 59 175.170 175.170 175.885 -0.715 18880
4458 1 10 . 1 1 59 59 THR CA C 59 60.780 60.780 60.685 0.095 18880
4459 1 10 . 1 1 59 59 THR CB C 59 71.060 71.060 69.552 1.508 18880
4460 1 10 . 1 1 59 59 THR H H 59 8.940 8.940 8.215 0.725 18880
4461 1 10 . 1 1 60 60 GLU N N 60 120.620 120.620 125.016 -4.396 18880
4462 1 10 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.710 0.300 18880
4463 1 10 . 1 1 60 60 GLU C C 60 179.010 179.010 178.089 0.921 18880
4464 1 10 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.421 0.399 18880
4465 1 10 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.542 0.508 18880
4466 1 10 . 1 1 60 60 GLU H H 60 8.850 8.850 8.926 -0.076 18880
4467 1 10 . 1 1 61 61 ALA N N 61 121.080 121.080 122.187 -1.107 18880
4468 1 10 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.952 0.188 18880
4469 1 10 . 1 1 61 61 ALA C C 61 180.350 180.350 180.020 0.330 18880
4470 1 10 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.156 -0.066 18880
4471 1 10 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.772 0.438 18880
4472 1 10 . 1 1 61 61 ALA H H 61 8.370 8.370 8.392 -0.022 18880
4473 1 10 . 1 1 62 62 GLU N N 62 118.890 118.890 118.824 0.066 18880
4474 1 10 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.524 0.476 18880
4475 1 10 . 1 1 62 62 GLU C C 62 179.690 179.690 178.655 1.035 18880
4476 1 10 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.328 0.662 18880
4477 1 10 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.452 1.858 18880
4478 1 10 . 1 1 62 62 GLU H H 62 7.680 7.680 7.601 0.079 18880
4479 1 10 . 1 1 63 63 ILE N N 63 122.340 122.340 119.830 2.510 18880
4480 1 10 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.205 0.365 18880
4481 1 10 . 1 1 63 63 ILE C C 63 177.260 177.260 178.247 -0.987 18880
4482 1 10 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.618 1.272 18880
4483 1 10 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.923 1.057 18880
4484 1 10 . 1 1 63 63 ILE H H 63 8.420 8.420 7.579 0.841 18880
4485 1 10 . 1 1 64 64 THR N N 64 116.970 116.970 115.459 1.511 18880
4486 1 10 . 1 1 64 64 THR HA H 64 3.940 3.940 3.910 0.030 18880
4487 1 10 . 1 1 64 64 THR C C 64 176.520 176.520 176.763 -0.243 18880
4488 1 10 . 1 1 64 64 THR CA C 64 67.060 67.060 67.302 -0.242 18880
4489 1 10 . 1 1 64 64 THR CB C 64 68.750 68.750 68.348 0.402 18880
4490 1 10 . 1 1 64 64 THR H H 64 8.310 8.310 8.451 -0.141 18880
4491 1 10 . 1 1 65 65 GLU N N 65 120.760 120.760 119.733 1.027 18880
4492 1 10 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.170 -0.140 18880
4493 1 10 . 1 1 65 65 GLU C C 65 175.830 175.830 178.411 -2.581 18880
4494 1 10 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.639 0.861 18880
4495 1 10 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.531 0.239 18880
4496 1 10 . 1 1 65 65 GLU H H 65 7.970 7.970 8.571 -0.601 18880
4497 1 10 . 1 1 66 66 PHE N N 66 120.940 120.940 118.199 2.741 18880
4498 1 10 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.413 -0.173 18880
4499 1 10 . 1 1 66 66 PHE C C 66 177.330 177.330 177.359 -0.029 18880
4500 1 10 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.532 2.668 18880
4501 1 10 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.160 -0.630 18880
4502 1 10 . 1 1 66 66 PHE H H 66 8.100 8.100 7.836 0.264 18880
4503 1 10 . 1 1 67 67 PHE N N 67 118.110 118.110 119.394 -1.284 18880
4504 1 10 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.430 -0.480 18880
4505 1 10 . 1 1 67 67 PHE C C 67 178.090 178.090 177.232 0.858 18880
4506 1 10 . 1 1 67 67 PHE CA C 67 61.200 61.200 58.953 2.247 18880
4507 1 10 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.538 -0.289 18880
4508 1 10 . 1 1 67 67 PHE H H 67 8.380 8.380 8.575 -0.195 18880
4509 1 10 . 1 1 68 68 GLU N N 68 119.650 119.650 117.137 2.513 18880
4510 1 10 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.357 -0.347 18880
4511 1 10 . 1 1 68 68 GLU C C 68 177.910 177.910 176.827 1.083 18880
4512 1 10 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.867 1.373 18880
4513 1 10 . 1 1 68 68 GLU CB C 68 29.370 29.370 30.261 -0.891 18880
4514 1 10 . 1 1 68 68 GLU H H 68 8.230 8.230 8.070 0.160 18880
4515 1 10 . 1 1 69 69 ALA N N 69 119.090 119.090 120.245 -1.155 18880
4516 1 10 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.453 -0.273 18880
4517 1 10 . 1 1 69 69 ALA C C 69 179.030 179.030 178.307 0.723 18880
4518 1 10 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.391 0.209 18880
4519 1 10 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.709 0.071 18880
4520 1 10 . 1 1 69 69 ALA H H 69 7.340 7.340 7.750 -0.410 18880
4521 1 10 . 1 1 70 70 ALA N N 70 118.670 118.670 120.157 -1.487 18880
4522 1 10 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.323 -0.303 18880
4523 1 10 . 1 1 70 70 ALA C C 70 176.820 176.820 176.723 0.097 18880
4524 1 10 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.718 0.372 18880
4525 1 10 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.255 -0.645 18880
4526 1 10 . 1 1 70 70 ALA H H 70 8.050 8.050 7.821 0.229 18880
4527 1 10 . 1 1 71 71 ASP N N 71 116.780 116.780 117.479 -0.699 18880
4528 1 10 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.146 0.074 18880
4529 1 10 . 1 1 71 71 ASP CA C 71 52.150 52.150 51.033 1.117 18880
4530 1 10 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.385 -2.475 18880
4531 1 10 . 1 1 71 71 ASP H H 71 8.010 8.010 7.612 0.398 18880
4532 1 10 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.411 0.059 18880
4533 1 10 . 1 1 72 72 PRO C C 72 177.970 177.970 177.080 0.890 18880
4534 1 10 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.659 0.251 18880
4535 1 10 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.387 -0.507 18880
4536 1 10 . 1 1 73 73 ASN N N 73 114.930 114.930 115.074 -0.144 18880
4537 1 10 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.670 0.210 18880
4538 1 10 . 1 1 73 73 ASN C C 73 174.880 174.880 174.582 0.298 18880
4539 1 10 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.253 -0.413 18880
4540 1 10 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.691 -0.311 18880
4541 1 10 . 1 1 73 73 ASN H H 73 9.030 9.030 8.331 0.699 18880
4542 1 10 . 1 1 74 74 ASN N N 74 118.340 118.340 114.132 4.208 18880
4543 1 10 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.500 -0.140 18880
4544 1 10 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.097 0.493 18880
4545 1 10 . 1 1 74 74 ASN CB C 74 37.160 37.160 37.132 0.028 18880
4546 1 10 . 1 1 74 74 ASN H H 74 8.320 8.320 8.215 0.105 18880
4547 1 10 . 1 1 75 75 THR N N 75 113.450 113.450 116.057 -2.607 18880
4548 1 10 . 1 1 75 75 THR HA H 75 4.210 4.210 4.460 -0.250 18880
4549 1 10 . 1 1 75 75 THR CA C 75 63.410 63.410 60.895 2.515 18880
4550 1 10 . 1 1 75 75 THR CB C 75 70.540 70.540 67.539 3.001 18880
4551 1 10 . 1 1 75 75 THR H H 75 9.870 9.870 8.039 1.831 18880
4552 1 10 . 1 1 76 76 GLY N N 76 111.810 111.810 109.421 2.389 18880
4553 1 10 . 1 1 76 76 GLY C C 76 173.670 173.670 173.701 -0.031 18880
4554 1 10 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.968 -0.848 18880
4555 1 10 . 1 1 76 76 GLY H H 76 10.250 10.250 7.688 2.562 18880
4556 1 10 . 1 1 77 77 PHE N N 77 120.560 120.560 117.931 2.629 18880
4557 1 10 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.943 0.207 18880
4558 1 10 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.337 -0.158 18880
4559 1 10 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.771 0.729 18880
4560 1 10 . 1 1 77 77 PHE H H 77 8.110 8.110 7.483 0.627 18880
4561 1 10 . 1 1 78 78 ILE N N 78 116.410 116.410 120.949 -4.539 18880
4562 1 10 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.395 -0.005 18880
4563 1 10 . 1 1 78 78 ILE C C 78 174.770 174.770 174.377 0.393 18880
4564 1 10 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.757 -0.567 18880
4565 1 10 . 1 1 78 78 ILE CB C 78 41.180 41.180 41.614 -0.433 18880
4566 1 10 . 1 1 78 78 ILE H H 78 8.930 8.930 8.112 0.818 18880
4567 1 10 . 1 1 79 79 ASP N N 79 125.220 125.220 125.318 -0.098 18880
4568 1 10 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.082 -0.582 18880
4569 1 10 . 1 1 79 79 ASP C C 79 176.490 176.490 177.130 -0.640 18880
4570 1 10 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.132 0.178 18880
4571 1 10 . 1 1 79 79 ASP CB C 79 41.370 41.370 41.306 0.064 18880
4572 1 10 . 1 1 79 79 ASP H H 79 8.610 8.610 8.850 -0.240 18880
4573 1 10 . 1 1 80 80 TYR N N 80 125.760 125.760 127.735 -1.975 18880
4574 1 10 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.074 -0.084 18880
4575 1 10 . 1 1 80 80 TYR C C 80 177.140 177.140 176.872 0.268 18880
4576 1 10 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.529 -0.949 18880
4577 1 10 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.565 0.325 18880
4578 1 10 . 1 1 80 80 TYR H H 80 8.460 8.460 8.542 -0.082 18880
4579 1 10 . 1 1 81 81 LYS N N 81 118.320 118.320 118.405 -0.085 18880
4580 1 10 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.975 -0.075 18880
4581 1 10 . 1 1 81 81 LYS C C 81 179.090 179.090 178.593 0.497 18880
4582 1 10 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.648 -0.068 18880
4583 1 10 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.709 0.051 18880
4584 1 10 . 1 1 81 81 LYS H H 81 8.410 8.410 8.086 0.324 18880
4585 1 10 . 1 1 82 82 ALA N N 82 122.050 122.050 121.618 0.432 18880
4586 1 10 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.170 -0.040 18880
4587 1 10 . 1 1 82 82 ALA C C 82 179.740 179.740 179.615 0.125 18880
4588 1 10 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.775 -0.255 18880
4589 1 10 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.327 0.213 18880
4590 1 10 . 1 1 82 82 ALA H H 82 7.770 7.770 7.904 -0.134 18880
4591 1 10 . 1 1 83 83 PHE N N 83 117.810 117.810 116.651 1.159 18880
4592 1 10 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.453 -0.163 18880
4593 1 10 . 1 1 83 83 PHE C C 83 176.460 176.460 176.700 -0.240 18880
4594 1 10 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.243 0.787 18880
4595 1 10 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.212 -0.691 18880
4596 1 10 . 1 1 83 83 PHE H H 83 7.780 7.780 7.869 -0.089 18880
4597 1 10 . 1 1 84 84 ALA N N 84 121.530 121.530 121.752 -0.222 18880
4598 1 10 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.175 -0.515 18880
4599 1 10 . 1 1 84 84 ALA C C 84 179.010 179.010 178.821 0.189 18880
4600 1 10 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.918 1.112 18880
4601 1 10 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.634 -0.504 18880
4602 1 10 . 1 1 84 84 ALA H H 84 8.290 8.290 8.271 0.019 18880
4603 1 10 . 1 1 85 85 ALA N N 85 117.720 117.720 120.377 -2.657 18880
4604 1 10 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.243 -0.163 18880
4605 1 10 . 1 1 85 85 ALA C C 85 179.570 179.570 178.409 1.161 18880
4606 1 10 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.604 -0.234 18880
4607 1 10 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.425 -0.135 18880
4608 1 10 . 1 1 85 85 ALA H H 85 7.700 7.700 8.572 -0.872 18880
4609 1 10 . 1 1 86 86 MET N N 86 116.570 116.570 114.836 1.734 18880
4610 1 10 . 1 1 86 86 MET HA H 86 4.160 4.160 4.162 -0.002 18880
4611 1 10 . 1 1 86 86 MET C C 86 177.360 177.360 177.425 -0.065 18880
4612 1 10 . 1 1 86 86 MET CA C 86 57.380 57.380 57.574 -0.194 18880
4613 1 10 . 1 1 86 86 MET CB C 86 32.720 32.720 32.592 0.129 18880
4614 1 10 . 1 1 86 86 MET H H 86 7.560 7.560 7.469 0.091 18880
4615 1 10 . 1 1 87 87 LEU N N 87 119.090 119.090 116.843 2.247 18880
4616 1 10 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.285 -0.315 18880
4617 1 10 . 1 1 87 87 LEU C C 87 177.420 177.420 176.664 0.756 18880
4618 1 10 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.041 1.249 18880
4619 1 10 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.636 -0.356 18880
4620 1 10 . 1 1 87 87 LEU H H 87 7.570 7.570 7.182 0.388 18880
4621 1 10 . 1 1 88 88 TYR N N 88 117.060 117.060 116.037 1.023 18880
4622 1 10 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.776 -0.186 18880
4623 1 10 . 1 1 88 88 TYR C C 88 175.870 175.870 175.300 0.570 18880
4624 1 10 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.315 2.526 18880
4625 1 10 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.647 0.993 18880
4626 1 10 . 1 1 88 88 TYR H H 88 7.740 7.740 7.300 0.440 18880
4627 1 10 . 1 1 89 89 SER N N 89 115.980 115.980 118.796 -2.816 18880
4628 1 10 . 1 1 89 89 SER HA H 89 4.440 4.440 4.382 0.058 18880
4629 1 10 . 1 1 89 89 SER C C 89 174.460 174.460 174.934 -0.474 18880
4630 1 10 . 1 1 89 89 SER CA C 89 58.350 58.350 59.012 -0.662 18880
4631 1 10 . 1 1 89 89 SER CB C 89 63.990 63.990 62.249 1.741 18880
4632 1 10 . 1 1 89 89 SER H H 89 7.880 7.880 8.140 -0.260 18880
4633 1 10 . 1 1 90 90 VAL N N 90 120.910 120.910 119.055 1.855 18880
4634 1 10 . 1 1 90 90 VAL HA H 90 4.140 4.140 3.759 0.381 18880
4635 1 10 . 1 1 90 90 VAL C C 90 175.720 175.720 174.316 1.404 18880
4636 1 10 . 1 1 90 90 VAL CA C 90 62.270 62.270 63.153 -0.883 18880
4637 1 10 . 1 1 90 90 VAL CB C 90 32.840 32.840 30.155 2.685 18880
4638 1 10 . 1 1 90 90 VAL H H 90 8.020 8.020 8.411 -0.391 18880
4639 1 10 . 1 1 91 91 ASP N N 91 123.620 123.620 119.363 4.257 18880
4640 1 10 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.590 0.040 18880
4641 1 10 . 1 1 91 91 ASP C C 91 176.000 176.000 176.612 -0.612 18880
4642 1 10 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.319 0.191 18880
4643 1 10 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.342 0.098 18880
4644 1 10 . 1 1 91 91 ASP H H 91 8.310 8.310 8.006 0.304 18880
4645 1 10 . 1 1 92 92 GLU N N 92 122.170 122.170 120.469 1.701 18880
4646 1 10 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.367 -0.007 18880
4647 1 10 . 1 1 92 92 GLU C C 92 175.660 175.660 176.798 -1.138 18880
4648 1 10 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.823 -0.333 18880
4649 1 10 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.611 2.239 18880
4650 1 10 . 1 1 92 92 GLU H H 92 8.320 8.320 8.507 -0.187 18880
4651 1 11 . 1 1 10 10 HIS C C 10 176.040 176.040 175.874 0.166 18880
4652 1 11 . 1 1 11 11 SER N N 11 116.840 116.840 110.636 6.204 18880
4653 1 11 . 1 1 11 11 SER HA H 11 4.430 4.430 4.434 -0.004 18880
4654 1 11 . 1 1 11 11 SER C C 11 174.630 174.630 173.513 1.117 18880
4655 1 11 . 1 1 11 11 SER CA C 11 58.350 58.350 58.278 0.072 18880
4656 1 11 . 1 1 11 11 SER CB C 11 64.120 64.120 63.334 0.786 18880
4657 1 11 . 1 1 11 11 SER H H 11 8.360 8.360 7.784 0.576 18880
4658 1 11 . 1 1 12 12 SER N N 12 118.030 118.030 114.994 3.036 18880
4659 1 11 . 1 1 12 12 SER HA H 12 4.440 4.440 4.244 0.196 18880
4660 1 11 . 1 1 12 12 SER C C 12 174.880 174.880 174.195 0.685 18880
4661 1 11 . 1 1 12 12 SER CA C 12 58.680 58.680 58.642 0.039 18880
4662 1 11 . 1 1 12 12 SER CB C 12 63.890 63.890 63.472 0.418 18880
4663 1 11 . 1 1 12 12 SER H H 12 8.490 8.490 8.070 0.420 18880
4664 1 11 . 1 1 13 13 GLY N N 13 110.450 110.450 108.376 2.074 18880
4665 1 11 . 1 1 13 13 GLY C C 13 173.790 173.790 173.600 0.190 18880
4666 1 11 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.205 0.255 18880
4667 1 11 . 1 1 13 13 GLY H H 13 8.390 8.390 8.335 0.055 18880
4668 1 11 . 1 1 14 14 LEU N N 14 121.310 121.310 123.112 -1.802 18880
4669 1 11 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.346 -0.006 18880
4670 1 11 . 1 1 14 14 LEU C C 14 176.930 176.930 177.025 -0.095 18880
4671 1 11 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.622 0.578 18880
4672 1 11 . 1 1 14 14 LEU CB C 14 42.600 42.600 43.022 -0.422 18880
4673 1 11 . 1 1 14 14 LEU H H 14 8.020 8.020 8.068 -0.048 18880
4674 1 11 . 1 1 15 15 VAL N N 15 121.550 121.550 125.288 -3.738 18880
4675 1 11 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.072 0.298 18880
4676 1 11 . 1 1 15 15 VAL CA C 15 59.720 59.720 61.890 -2.170 18880
4677 1 11 . 1 1 15 15 VAL CB C 15 32.770 32.770 32.863 -0.093 18880
4678 1 11 . 1 1 15 15 VAL H H 15 8.030 8.030 8.649 -0.619 18880
4679 1 11 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.373 -0.003 18880
4680 1 11 . 1 1 16 16 PRO C C 16 176.720 176.720 176.829 -0.109 18880
4681 1 11 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.505 -1.855 18880
4682 1 11 . 1 1 16 16 PRO CB C 16 32.240 32.240 31.879 0.361 18880
4683 1 11 . 1 1 17 17 ARG N N 17 121.890 121.890 116.707 5.183 18880
4684 1 11 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.413 -0.133 18880
4685 1 11 . 1 1 17 17 ARG C C 17 176.940 176.940 175.276 1.664 18880
4686 1 11 . 1 1 17 17 ARG CA C 17 56.360 56.360 55.354 1.006 18880
4687 1 11 . 1 1 17 17 ARG CB C 17 31.050 31.050 31.862 -0.812 18880
4688 1 11 . 1 1 17 17 ARG H H 17 8.450 8.450 7.712 0.738 18880
4689 1 11 . 1 1 18 18 GLY N N 18 110.160 110.160 109.816 0.344 18880
4690 1 11 . 1 1 18 18 GLY C C 18 174.110 174.110 174.628 -0.518 18880
4691 1 11 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.085 0.305 18880
4692 1 11 . 1 1 18 18 GLY H H 18 8.480 8.480 8.450 0.030 18880
4693 1 11 . 1 1 19 19 SER N N 19 115.500 115.500 118.250 -2.750 18880
4694 1 11 . 1 1 19 19 SER HA H 19 4.400 4.400 4.250 0.150 18880
4695 1 11 . 1 1 19 19 SER C C 19 174.380 174.380 174.763 -0.383 18880
4696 1 11 . 1 1 19 19 SER CA C 19 58.610 58.610 58.458 0.152 18880
4697 1 11 . 1 1 19 19 SER CB C 19 63.830 63.830 64.020 -0.190 18880
4698 1 11 . 1 1 19 19 SER H H 19 8.210 8.210 8.093 0.117 18880
4699 1 11 . 1 1 20 20 HIS N N 20 120.770 120.770 119.693 1.077 18880
4700 1 11 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.686 -0.076 18880
4701 1 11 . 1 1 20 20 HIS C C 20 174.870 174.870 173.886 0.984 18880
4702 1 11 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.140 0.990 18880
4703 1 11 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.614 0.096 18880
4704 1 11 . 1 1 20 20 HIS H H 20 8.590 8.590 8.206 0.384 18880
4705 1 11 . 1 1 21 21 MET N N 21 121.440 121.440 121.316 0.124 18880
4706 1 11 . 1 1 21 21 MET HA H 21 4.470 4.470 4.768 -0.298 18880
4707 1 11 . 1 1 21 21 MET C C 21 176.030 176.030 176.115 -0.085 18880
4708 1 11 . 1 1 21 21 MET CA C 21 55.490 55.490 55.160 0.330 18880
4709 1 11 . 1 1 21 21 MET CB C 21 33.170 33.170 33.147 0.023 18880
4710 1 11 . 1 1 21 21 MET H H 21 8.310 8.310 7.585 0.725 18880
4711 1 11 . 1 1 22 22 SER N N 22 116.860 116.860 120.537 -3.677 18880
4712 1 11 . 1 1 22 22 SER HA H 22 4.430 4.430 4.534 -0.104 18880
4713 1 11 . 1 1 22 22 SER C C 22 174.630 174.630 174.985 -0.355 18880
4714 1 11 . 1 1 22 22 SER CA C 22 58.410 58.410 58.322 0.088 18880
4715 1 11 . 1 1 22 22 SER CB C 22 64.030 64.030 63.163 0.867 18880
4716 1 11 . 1 1 22 22 SER H H 22 8.340 8.340 8.852 -0.512 18880
4717 1 11 . 1 1 23 23 ASP N N 23 122.660 122.660 123.597 -0.937 18880
4718 1 11 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.560 -0.010 18880
4719 1 11 . 1 1 23 23 ASP C C 23 176.860 176.860 177.830 -0.970 18880
4720 1 11 . 1 1 23 23 ASP CA C 23 55.330 55.330 56.161 -0.831 18880
4721 1 11 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.075 0.925 18880
4722 1 11 . 1 1 23 23 ASP H H 23 8.540 8.540 8.699 -0.159 18880
4723 1 11 . 1 1 24 24 GLU N N 24 120.400 120.400 119.623 0.777 18880
4724 1 11 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.114 0.026 18880
4725 1 11 . 1 1 24 24 GLU C C 24 177.540 177.540 177.486 0.054 18880
4726 1 11 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.357 0.003 18880
4727 1 11 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.605 0.145 18880
4728 1 11 . 1 1 24 24 GLU H H 24 8.610 8.610 7.758 0.852 18880
4729 1 11 . 1 1 25 25 LYS N N 25 120.390 120.390 118.020 2.370 18880
4730 1 11 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.285 -0.095 18880
4731 1 11 . 1 1 25 25 LYS C C 25 177.490 177.490 178.353 -0.863 18880
4732 1 11 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.156 -0.046 18880
4733 1 11 . 1 1 25 25 LYS CB C 25 32.490 32.490 33.035 -0.545 18880
4734 1 11 . 1 1 25 25 LYS H H 25 8.210 8.210 7.476 0.734 18880
4735 1 11 . 1 1 26 26 THR N N 26 114.880 114.880 115.502 -0.622 18880
4736 1 11 . 1 1 26 26 THR HA H 26 4.040 4.040 4.129 -0.089 18880
4737 1 11 . 1 1 26 26 THR C C 26 175.430 175.430 176.665 -1.235 18880
4738 1 11 . 1 1 26 26 THR CA C 26 64.620 64.620 65.724 -1.104 18880
4739 1 11 . 1 1 26 26 THR CB C 26 69.110 69.110 68.574 0.536 18880
4740 1 11 . 1 1 26 26 THR H H 26 8.080 8.080 7.504 0.576 18880
4741 1 11 . 1 1 27 27 GLN N N 27 120.940 120.940 122.671 -1.731 18880
4742 1 11 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.112 0.078 18880
4743 1 11 . 1 1 27 27 GLN C C 27 177.280 177.280 177.168 0.112 18880
4744 1 11 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.443 -0.893 18880
4745 1 11 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.522 0.568 18880
4746 1 11 . 1 1 27 27 GLN H H 27 8.240 8.240 7.872 0.368 18880
4747 1 11 . 1 1 28 28 LEU N N 28 121.860 121.860 118.173 3.687 18880
4748 1 11 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.388 -0.218 18880
4749 1 11 . 1 1 28 28 LEU C C 28 177.750 177.750 177.790 -0.040 18880
4750 1 11 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.448 1.632 18880
4751 1 11 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.594 -0.325 18880
4752 1 11 . 1 1 28 28 LEU H H 28 7.950 7.950 7.480 0.470 18880
4753 1 11 . 1 1 29 29 ILE N N 29 119.260 119.260 118.906 0.354 18880
4754 1 11 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.935 -0.035 18880
4755 1 11 . 1 1 29 29 ILE C C 29 177.140 177.140 177.822 -0.682 18880
4756 1 11 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.476 -0.176 18880
4757 1 11 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.987 1.293 18880
4758 1 11 . 1 1 29 29 ILE H H 29 7.950 7.950 7.972 -0.022 18880
4759 1 11 . 1 1 30 30 GLU N N 30 120.500 120.500 119.009 1.491 18880
4760 1 11 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.417 -0.367 18880
4761 1 11 . 1 1 30 30 GLU C C 30 177.560 177.560 176.314 1.246 18880
4762 1 11 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.953 0.137 18880
4763 1 11 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.957 0.633 18880
4764 1 11 . 1 1 30 30 GLU H H 30 8.220 8.220 8.033 0.187 18880
4765 1 11 . 1 1 31 31 ALA N N 31 121.550 121.550 120.042 1.508 18880
4766 1 11 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.293 -0.143 18880
4767 1 11 . 1 1 31 31 ALA C C 31 178.550 178.550 178.703 -0.153 18880
4768 1 11 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.686 0.114 18880
4769 1 11 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.210 -0.580 18880
4770 1 11 . 1 1 31 31 ALA H H 31 7.890 7.890 7.451 0.439 18880
4771 1 11 . 1 1 32 32 PHE N N 32 117.240 117.240 117.669 -0.429 18880
4772 1 11 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.170 0.130 18880
4773 1 11 . 1 1 32 32 PHE C C 32 176.210 176.210 176.628 -0.418 18880
4774 1 11 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.632 -1.292 18880
4775 1 11 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.568 1.182 18880
4776 1 11 . 1 1 32 32 PHE H H 32 7.930 7.930 7.376 0.554 18880
4777 1 11 . 1 1 33 33 TYR N N 33 119.050 119.050 115.079 3.971 18880
4778 1 11 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.629 -0.299 18880
4779 1 11 . 1 1 33 33 TYR C C 33 175.680 175.680 175.550 0.130 18880
4780 1 11 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.701 1.219 18880
4781 1 11 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.759 1.781 18880
4782 1 11 . 1 1 33 33 TYR H H 33 7.950 7.950 7.866 0.084 18880
4783 1 11 . 1 1 34 34 ASN N N 34 118.390 118.390 117.905 0.485 18880
4784 1 11 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.957 -0.327 18880
4785 1 11 . 1 1 34 34 ASN C C 34 174.810 174.810 174.438 0.372 18880
4786 1 11 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.592 -0.442 18880
4787 1 11 . 1 1 34 34 ASN CB C 34 38.980 38.980 40.134 -1.154 18880
4788 1 11 . 1 1 34 34 ASN H H 34 7.960 7.960 7.836 0.124 18880
4789 1 11 . 1 1 35 35 PHE N N 35 120.670 120.670 119.326 1.344 18880
4790 1 11 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.550 -0.100 18880
4791 1 11 . 1 1 35 35 PHE C C 35 175.310 175.310 173.183 2.127 18880
4792 1 11 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.331 -0.011 18880
4793 1 11 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.749 -0.329 18880
4794 1 11 . 1 1 35 35 PHE H H 35 7.830 7.830 7.904 -0.074 18880
4795 1 11 . 1 1 36 36 ASP N N 36 122.400 122.400 121.169 1.231 18880
4796 1 11 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.710 -0.120 18880
4797 1 11 . 1 1 36 36 ASP C C 36 176.150 176.150 176.776 -0.626 18880
4798 1 11 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.483 0.587 18880
4799 1 11 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.757 0.563 18880
4800 1 11 . 1 1 36 36 ASP H H 36 8.180 8.180 8.169 0.011 18880
4801 1 11 . 1 1 37 37 GLY N N 37 108.560 108.560 108.254 0.306 18880
4802 1 11 . 1 1 37 37 GLY C C 37 173.660 173.660 173.972 -0.312 18880
4803 1 11 . 1 1 37 37 GLY CA C 37 45.610 45.610 44.806 0.804 18880
4804 1 11 . 1 1 37 37 GLY H H 37 7.680 7.680 7.953 -0.273 18880
4805 1 11 . 1 1 38 38 ASP N N 38 120.010 120.010 118.762 1.248 18880
4806 1 11 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.140 0.460 18880
4807 1 11 . 1 1 38 38 ASP CA C 38 54.260 54.260 55.188 -0.928 18880
4808 1 11 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.917 1.533 18880
4809 1 11 . 1 1 38 38 ASP H H 38 8.220 8.220 8.067 0.153 18880
4810 1 11 . 1 1 39 39 TYR N N 39 121.030 121.030 120.412 0.618 18880
4811 1 11 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.584 -0.194 18880
4812 1 11 . 1 1 39 39 TYR C C 39 175.290 175.290 174.918 0.372 18880
4813 1 11 . 1 1 39 39 TYR CA C 39 58.200 58.200 56.945 1.255 18880
4814 1 11 . 1 1 39 39 TYR CB C 39 39.170 39.170 41.390 -2.220 18880
4815 1 11 . 1 1 39 39 TYR H H 39 8.090 8.090 7.927 0.163 18880
4816 1 11 . 1 1 40 40 ASP N N 40 122.020 122.020 122.259 -0.239 18880
4817 1 11 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.561 0.039 18880
4818 1 11 . 1 1 40 40 ASP C C 40 175.970 175.970 176.211 -0.241 18880
4819 1 11 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.221 -0.001 18880
4820 1 11 . 1 1 40 40 ASP CB C 40 41.520 41.520 42.320 -0.800 18880
4821 1 11 . 1 1 40 40 ASP H H 40 8.200 8.200 8.427 -0.227 18880
4822 1 11 . 1 1 41 41 GLY N N 41 108.330 108.330 106.693 1.637 18880
4823 1 11 . 1 1 41 41 GLY C C 41 173.000 173.000 173.270 -0.270 18880
4824 1 11 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.666 0.754 18880
4825 1 11 . 1 1 41 41 GLY H H 41 7.830 7.830 8.445 -0.615 18880
4826 1 11 . 1 1 42 42 PHE N N 42 118.600 118.600 120.832 -2.232 18880
4827 1 11 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.467 0.793 18880
4828 1 11 . 1 1 42 42 PHE C C 42 175.660 175.660 174.671 0.989 18880
4829 1 11 . 1 1 42 42 PHE CA C 42 57.160 57.160 59.030 -1.870 18880
4830 1 11 . 1 1 42 42 PHE CB C 42 41.170 41.170 39.548 1.622 18880
4831 1 11 . 1 1 42 42 PHE H H 42 8.150 8.150 7.517 0.633 18880
4832 1 11 . 1 1 43 43 VAL N N 43 119.180 119.180 127.667 -8.487 18880
4833 1 11 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.031 0.639 18880
4834 1 11 . 1 1 43 43 VAL C C 43 175.110 175.110 173.295 1.815 18880
4835 1 11 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.714 0.906 18880
4836 1 11 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.376 -2.496 18880
4837 1 11 . 1 1 43 43 VAL H H 43 9.070 9.070 7.966 1.104 18880
4838 1 11 . 1 1 44 44 SER N N 44 121.380 121.380 121.516 -0.136 18880
4839 1 11 . 1 1 44 44 SER HA H 44 4.570 4.570 3.996 0.574 18880
4840 1 11 . 1 1 44 44 SER C C 44 175.660 175.660 174.969 0.691 18880
4841 1 11 . 1 1 44 44 SER CA C 44 57.720 57.720 56.509 1.211 18880
4842 1 11 . 1 1 44 44 SER CB C 44 63.690 63.690 63.252 0.438 18880
4843 1 11 . 1 1 44 44 SER H H 44 9.140 9.140 7.983 1.157 18880
4844 1 11 . 1 1 45 45 VAL N N 45 122.720 122.720 123.985 -1.265 18880
4845 1 11 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.141 0.359 18880
4846 1 11 . 1 1 45 45 VAL C C 45 177.240 177.240 177.252 -0.012 18880
4847 1 11 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.662 -0.392 18880
4848 1 11 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.933 0.517 18880
4849 1 11 . 1 1 45 45 VAL H H 45 8.140 8.140 8.173 -0.033 18880
4850 1 11 . 1 1 46 46 GLU N N 46 118.990 118.990 117.594 1.396 18880
4851 1 11 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.724 0.256 18880
4852 1 11 . 1 1 46 46 GLU C C 46 179.460 179.460 179.103 0.357 18880
4853 1 11 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.238 0.322 18880
4854 1 11 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.828 0.332 18880
4855 1 11 . 1 1 46 46 GLU H H 46 8.230 8.230 7.459 0.771 18880
4856 1 11 . 1 1 47 47 GLU N N 47 120.120 120.120 118.178 1.942 18880
4857 1 11 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.107 -0.027 18880
4858 1 11 . 1 1 47 47 GLU C C 47 179.170 179.170 178.529 0.641 18880
4859 1 11 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.617 1.273 18880
4860 1 11 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.713 0.107 18880
4861 1 11 . 1 1 47 47 GLU H H 47 7.880 7.880 7.141 0.739 18880
4862 1 11 . 1 1 48 48 PHE N N 48 120.830 120.830 120.928 -0.098 18880
4863 1 11 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.088 0.102 18880
4864 1 11 . 1 1 48 48 PHE C C 48 176.920 176.920 177.383 -0.463 18880
4865 1 11 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.526 0.344 18880
4866 1 11 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.973 0.287 18880
4867 1 11 . 1 1 48 48 PHE H H 48 8.600 8.600 8.036 0.564 18880
4868 1 11 . 1 1 49 49 ARG N N 49 118.470 118.470 118.825 -0.355 18880
4869 1 11 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.071 -0.211 18880
4870 1 11 . 1 1 49 49 ARG C C 49 178.090 178.090 178.566 -0.476 18880
4871 1 11 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.226 -0.156 18880
4872 1 11 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.660 0.480 18880
4873 1 11 . 1 1 49 49 ARG H H 49 8.650 8.650 8.840 -0.190 18880
4874 1 11 . 1 1 50 50 GLY N N 50 105.080 105.080 105.603 -0.523 18880
4875 1 11 . 1 1 50 50 GLY C C 50 175.090 175.090 175.856 -0.766 18880
4876 1 11 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.772 -0.092 18880
4877 1 11 . 1 1 50 50 GLY H H 50 7.620 7.620 8.234 -0.614 18880
4878 1 11 . 1 1 51 51 ILE N N 51 121.440 121.440 121.745 -0.305 18880
4879 1 11 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.893 -0.063 18880
4880 1 11 . 1 1 51 51 ILE C C 51 178.300 178.300 177.364 0.936 18880
4881 1 11 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.142 -0.302 18880
4882 1 11 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.320 -0.010 18880
4883 1 11 . 1 1 51 51 ILE H H 51 7.470 7.470 7.302 0.168 18880
4884 1 11 . 1 1 52 52 ILE N N 52 118.930 118.930 118.853 0.077 18880
4885 1 11 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.826 -0.086 18880
4886 1 11 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.507 0.253 18880
4887 1 11 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.627 1.403 18880
4888 1 11 . 1 1 52 52 ILE H H 52 7.790 7.790 8.474 -0.684 18880
4889 1 11 . 1 1 53 53 ARG N N 53 120.140 120.140 120.279 -0.139 18880
4890 1 11 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.023 0.067 18880
4891 1 11 . 1 1 53 53 ARG C C 53 177.380 177.380 176.942 0.438 18880
4892 1 11 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.470 0.640 18880
4893 1 11 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.455 -0.875 18880
4894 1 11 . 1 1 53 53 ARG H H 53 7.930 7.930 8.458 -0.528 18880
4895 1 11 . 1 1 54 54 ASP N N 54 117.500 117.500 117.085 0.415 18880
4896 1 11 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.861 -0.261 18880
4897 1 11 . 1 1 54 54 ASP C C 54 176.930 176.930 175.771 1.159 18880
4898 1 11 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.154 1.386 18880
4899 1 11 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.544 -0.444 18880
4900 1 11 . 1 1 54 54 ASP H H 54 7.870 7.870 7.818 0.052 18880
4901 1 11 . 1 1 55 55 GLY N N 55 106.370 106.370 108.290 -1.920 18880
4902 1 11 . 1 1 55 55 GLY C C 55 173.460 173.460 173.782 -0.322 18880
4903 1 11 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.226 0.774 18880
4904 1 11 . 1 1 55 55 GLY H H 55 7.880 7.880 7.340 0.540 18880
4905 1 11 . 1 1 56 56 LEU N N 56 122.630 122.630 122.505 0.125 18880
4906 1 11 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.811 -0.041 18880
4907 1 11 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.597 0.893 18880
4908 1 11 . 1 1 56 56 LEU CB C 56 43.120 43.120 43.093 0.027 18880
4909 1 11 . 1 1 56 56 LEU H H 56 8.220 8.220 7.858 0.362 18880
4910 1 11 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.455 0.125 18880
4911 1 11 . 1 1 57 57 PRO C C 57 176.150 176.150 175.601 0.549 18880
4912 1 11 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.968 -0.548 18880
4913 1 11 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.701 -0.961 18880
4914 1 11 . 1 1 58 58 MET N N 58 121.810 121.810 124.475 -2.665 18880
4915 1 11 . 1 1 58 58 MET HA H 58 4.630 4.630 4.735 -0.105 18880
4916 1 11 . 1 1 58 58 MET C C 58 176.150 176.150 174.993 1.157 18880
4917 1 11 . 1 1 58 58 MET CA C 58 55.560 55.560 54.371 1.189 18880
4918 1 11 . 1 1 58 58 MET CB C 58 36.820 36.820 37.307 -0.487 18880
4919 1 11 . 1 1 58 58 MET H H 58 7.690 7.690 8.065 -0.375 18880
4920 1 11 . 1 1 59 59 THR N N 59 114.180 114.180 116.533 -2.353 18880
4921 1 11 . 1 1 59 59 THR HA H 59 4.450 4.450 4.428 0.022 18880
4922 1 11 . 1 1 59 59 THR C C 59 175.170 175.170 175.994 -0.824 18880
4923 1 11 . 1 1 59 59 THR CA C 59 60.780 60.780 60.675 0.105 18880
4924 1 11 . 1 1 59 59 THR CB C 59 71.060 71.060 69.697 1.363 18880
4925 1 11 . 1 1 59 59 THR H H 59 8.940 8.940 9.044 -0.104 18880
4926 1 11 . 1 1 60 60 GLU N N 60 120.620 120.620 125.545 -4.925 18880
4927 1 11 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.735 0.275 18880
4928 1 11 . 1 1 60 60 GLU C C 60 179.010 179.010 178.006 1.004 18880
4929 1 11 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.960 -0.140 18880
4930 1 11 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.430 0.620 18880
4931 1 11 . 1 1 60 60 GLU H H 60 8.850 8.850 8.957 -0.107 18880
4932 1 11 . 1 1 61 61 ALA N N 61 121.080 121.080 123.057 -1.977 18880
4933 1 11 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.920 0.220 18880
4934 1 11 . 1 1 61 61 ALA C C 61 180.350 180.350 179.871 0.479 18880
4935 1 11 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.204 -0.114 18880
4936 1 11 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.980 0.230 18880
4937 1 11 . 1 1 61 61 ALA H H 61 8.370 8.370 8.380 -0.010 18880
4938 1 11 . 1 1 62 62 GLU N N 62 118.890 118.890 118.961 -0.071 18880
4939 1 11 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.424 0.576 18880
4940 1 11 . 1 1 62 62 GLU C C 62 179.690 179.690 178.597 1.093 18880
4941 1 11 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.572 0.418 18880
4942 1 11 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.922 1.388 18880
4943 1 11 . 1 1 62 62 GLU H H 62 7.680 7.680 7.739 -0.059 18880
4944 1 11 . 1 1 63 63 ILE N N 63 122.340 122.340 119.780 2.560 18880
4945 1 11 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.241 0.329 18880
4946 1 11 . 1 1 63 63 ILE C C 63 177.260 177.260 178.183 -0.923 18880
4947 1 11 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.688 1.202 18880
4948 1 11 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.023 0.957 18880
4949 1 11 . 1 1 63 63 ILE H H 63 8.420 8.420 7.529 0.891 18880
4950 1 11 . 1 1 64 64 THR N N 64 116.970 116.970 116.168 0.802 18880
4951 1 11 . 1 1 64 64 THR HA H 64 3.940 3.940 4.028 -0.088 18880
4952 1 11 . 1 1 64 64 THR C C 64 176.520 176.520 177.075 -0.555 18880
4953 1 11 . 1 1 64 64 THR CA C 64 67.060 67.060 67.204 -0.144 18880
4954 1 11 . 1 1 64 64 THR CB C 64 68.750 68.750 68.315 0.435 18880
4955 1 11 . 1 1 64 64 THR H H 64 8.310 8.310 8.540 -0.230 18880
4956 1 11 . 1 1 65 65 GLU N N 65 120.760 120.760 119.187 1.573 18880
4957 1 11 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.209 -0.179 18880
4958 1 11 . 1 1 65 65 GLU C C 65 175.830 175.830 178.761 -2.931 18880
4959 1 11 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.865 0.635 18880
4960 1 11 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.371 0.399 18880
4961 1 11 . 1 1 65 65 GLU H H 65 7.970 7.970 8.704 -0.734 18880
4962 1 11 . 1 1 66 66 PHE N N 66 120.940 120.940 118.463 2.477 18880
4963 1 11 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.402 -0.162 18880
4964 1 11 . 1 1 66 66 PHE C C 66 177.330 177.330 177.053 0.277 18880
4965 1 11 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.123 3.077 18880
4966 1 11 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.970 -0.440 18880
4967 1 11 . 1 1 66 66 PHE H H 66 8.100 8.100 7.935 0.165 18880
4968 1 11 . 1 1 67 67 PHE N N 67 118.110 118.110 118.927 -0.817 18880
4969 1 11 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.414 -0.464 18880
4970 1 11 . 1 1 67 67 PHE C C 67 178.090 178.090 177.716 0.374 18880
4971 1 11 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.650 1.550 18880
4972 1 11 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.830 -0.580 18880
4973 1 11 . 1 1 67 67 PHE H H 67 8.380 8.380 8.500 -0.120 18880
4974 1 11 . 1 1 68 68 GLU N N 68 119.650 119.650 117.845 1.805 18880
4975 1 11 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.308 -0.298 18880
4976 1 11 . 1 1 68 68 GLU C C 68 177.910 177.910 177.098 0.812 18880
4977 1 11 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.104 1.136 18880
4978 1 11 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.849 -0.479 18880
4979 1 11 . 1 1 68 68 GLU H H 68 8.230 8.230 8.055 0.175 18880
4980 1 11 . 1 1 69 69 ALA N N 69 119.090 119.090 120.871 -1.781 18880
4981 1 11 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.264 -0.084 18880
4982 1 11 . 1 1 69 69 ALA C C 69 179.030 179.030 178.333 0.697 18880
4983 1 11 . 1 1 69 69 ALA CA C 69 53.600 53.600 54.033 -0.433 18880
4984 1 11 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.496 0.284 18880
4985 1 11 . 1 1 69 69 ALA H H 69 7.340 7.340 7.788 -0.448 18880
4986 1 11 . 1 1 70 70 ALA N N 70 118.670 118.670 119.044 -0.374 18880
4987 1 11 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.399 -0.379 18880
4988 1 11 . 1 1 70 70 ALA C C 70 176.820 176.820 177.064 -0.244 18880
4989 1 11 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.426 0.664 18880
4990 1 11 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.347 -0.737 18880
4991 1 11 . 1 1 70 70 ALA H H 70 8.050 8.050 7.914 0.136 18880
4992 1 11 . 1 1 71 71 ASP N N 71 116.780 116.780 118.723 -1.943 18880
4993 1 11 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.235 -0.015 18880
4994 1 11 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.770 1.380 18880
4995 1 11 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.127 -2.217 18880
4996 1 11 . 1 1 71 71 ASP H H 71 8.010 8.010 7.495 0.515 18880
4997 1 11 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.396 0.074 18880
4998 1 11 . 1 1 72 72 PRO C C 72 177.970 177.970 177.397 0.573 18880
4999 1 11 . 1 1 72 72 PRO CA C 72 64.910 64.910 65.115 -0.205 18880
5000 1 11 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.436 -0.556 18880
5001 1 11 . 1 1 73 73 ASN N N 73 114.930 114.930 117.274 -2.344 18880
5002 1 11 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.508 0.372 18880
5003 1 11 . 1 1 73 73 ASN C C 73 174.880 174.880 174.930 -0.050 18880
5004 1 11 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.469 -0.629 18880
5005 1 11 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.359 0.021 18880
5006 1 11 . 1 1 73 73 ASN H H 73 9.030 9.030 8.593 0.437 18880
5007 1 11 . 1 1 74 74 ASN N N 74 118.340 118.340 113.689 4.651 18880
5008 1 11 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.622 -0.262 18880
5009 1 11 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.995 0.596 18880
5010 1 11 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.358 0.802 18880
5011 1 11 . 1 1 74 74 ASN H H 74 8.320 8.320 8.294 0.026 18880
5012 1 11 . 1 1 75 75 THR N N 75 113.450 113.450 112.104 1.346 18880
5013 1 11 . 1 1 75 75 THR HA H 75 4.210 4.210 4.535 -0.325 18880
5014 1 11 . 1 1 75 75 THR CA C 75 63.410 63.410 61.004 2.406 18880
5015 1 11 . 1 1 75 75 THR CB C 75 70.540 70.540 68.967 1.573 18880
5016 1 11 . 1 1 75 75 THR H H 75 9.870 9.870 8.923 0.947 18880
5017 1 11 . 1 1 76 76 GLY N N 76 111.810 111.810 108.425 3.385 18880
5018 1 11 . 1 1 76 76 GLY C C 76 173.670 173.670 173.457 0.213 18880
5019 1 11 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.429 -0.309 18880
5020 1 11 . 1 1 76 76 GLY H H 76 10.250 10.250 8.528 1.722 18880
5021 1 11 . 1 1 77 77 PHE N N 77 120.560 120.560 118.089 2.471 18880
5022 1 11 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.855 0.295 18880
5023 1 11 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.353 -0.173 18880
5024 1 11 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.410 1.090 18880
5025 1 11 . 1 1 77 77 PHE H H 77 8.110 8.110 7.469 0.641 18880
5026 1 11 . 1 1 78 78 ILE N N 78 116.410 116.410 122.754 -6.344 18880
5027 1 11 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.356 0.034 18880
5028 1 11 . 1 1 78 78 ILE C C 78 174.770 174.770 174.898 -0.128 18880
5029 1 11 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.803 -0.613 18880
5030 1 11 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.470 0.710 18880
5031 1 11 . 1 1 78 78 ILE H H 78 8.930 8.930 7.716 1.214 18880
5032 1 11 . 1 1 79 79 ASP N N 79 125.220 125.220 126.182 -0.962 18880
5033 1 11 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.192 -0.692 18880
5034 1 11 . 1 1 79 79 ASP C C 79 176.490 176.490 176.712 -0.222 18880
5035 1 11 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.063 0.247 18880
5036 1 11 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.493 0.877 18880
5037 1 11 . 1 1 79 79 ASP H H 79 8.610 8.610 8.644 -0.034 18880
5038 1 11 . 1 1 80 80 TYR N N 80 125.760 125.760 128.673 -2.913 18880
5039 1 11 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.091 -0.101 18880
5040 1 11 . 1 1 80 80 TYR C C 80 177.140 177.140 176.680 0.460 18880
5041 1 11 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.323 -0.743 18880
5042 1 11 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.629 0.261 18880
5043 1 11 . 1 1 80 80 TYR H H 80 8.460 8.460 8.864 -0.404 18880
5044 1 11 . 1 1 81 81 LYS N N 81 118.320 118.320 117.921 0.399 18880
5045 1 11 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.936 -0.036 18880
5046 1 11 . 1 1 81 81 LYS C C 81 179.090 179.090 178.733 0.357 18880
5047 1 11 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.742 -0.162 18880
5048 1 11 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.955 -0.195 18880
5049 1 11 . 1 1 81 81 LYS H H 81 8.410 8.410 8.591 -0.181 18880
5050 1 11 . 1 1 82 82 ALA N N 82 122.050 122.050 121.809 0.241 18880
5051 1 11 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.203 -0.073 18880
5052 1 11 . 1 1 82 82 ALA C C 82 179.740 179.740 179.513 0.227 18880
5053 1 11 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.685 -0.165 18880
5054 1 11 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.310 0.230 18880
5055 1 11 . 1 1 82 82 ALA H H 82 7.770 7.770 8.067 -0.297 18880
5056 1 11 . 1 1 83 83 PHE N N 83 117.810 117.810 117.002 0.808 18880
5057 1 11 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.311 -0.021 18880
5058 1 11 . 1 1 83 83 PHE C C 83 176.460 176.460 176.784 -0.324 18880
5059 1 11 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.446 -0.416 18880
5060 1 11 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.046 -0.526 18880
5061 1 11 . 1 1 83 83 PHE H H 83 7.780 7.780 7.828 -0.048 18880
5062 1 11 . 1 1 84 84 ALA N N 84 121.530 121.530 122.093 -0.563 18880
5063 1 11 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.044 -0.384 18880
5064 1 11 . 1 1 84 84 ALA C C 84 179.010 179.010 178.877 0.133 18880
5065 1 11 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.089 0.941 18880
5066 1 11 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.168 -0.038 18880
5067 1 11 . 1 1 84 84 ALA H H 84 8.290 8.290 8.284 0.006 18880
5068 1 11 . 1 1 85 85 ALA N N 85 117.720 117.720 120.593 -2.873 18880
5069 1 11 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.322 -0.242 18880
5070 1 11 . 1 1 85 85 ALA C C 85 179.570 179.570 178.412 1.158 18880
5071 1 11 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.338 0.032 18880
5072 1 11 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.386 -0.096 18880
5073 1 11 . 1 1 85 85 ALA H H 85 7.700 7.700 8.355 -0.655 18880
5074 1 11 . 1 1 86 86 MET N N 86 116.570 116.570 116.765 -0.195 18880
5075 1 11 . 1 1 86 86 MET HA H 86 4.160 4.160 4.108 0.052 18880
5076 1 11 . 1 1 86 86 MET C C 86 177.360 177.360 178.207 -0.847 18880
5077 1 11 . 1 1 86 86 MET CA C 86 57.380 57.380 58.423 -1.043 18880
5078 1 11 . 1 1 86 86 MET CB C 86 32.720 32.720 32.452 0.269 18880
5079 1 11 . 1 1 86 86 MET H H 86 7.560 7.560 7.361 0.199 18880
5080 1 11 . 1 1 87 87 LEU N N 87 119.090 119.090 116.881 2.209 18880
5081 1 11 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.039 -0.069 18880
5082 1 11 . 1 1 87 87 LEU C C 87 177.420 177.420 177.191 0.229 18880
5083 1 11 . 1 1 87 87 LEU CA C 87 56.290 56.290 56.209 0.081 18880
5084 1 11 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.392 0.888 18880
5085 1 11 . 1 1 87 87 LEU H H 87 7.570 7.570 7.418 0.152 18880
5086 1 11 . 1 1 88 88 TYR N N 88 117.060 117.060 115.488 1.572 18880
5087 1 11 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.704 -0.114 18880
5088 1 11 . 1 1 88 88 TYR C C 88 175.870 175.870 175.913 -0.043 18880
5089 1 11 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.564 2.276 18880
5090 1 11 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.910 0.730 18880
5091 1 11 . 1 1 88 88 TYR H H 88 7.740 7.740 7.414 0.326 18880
5092 1 11 . 1 1 89 89 SER N N 89 115.980 115.980 116.737 -0.757 18880
5093 1 11 . 1 1 89 89 SER HA H 89 4.440 4.440 4.527 -0.087 18880
5094 1 11 . 1 1 89 89 SER C C 89 174.460 174.460 174.341 0.119 18880
5095 1 11 . 1 1 89 89 SER CA C 89 58.350 58.350 57.708 0.642 18880
5096 1 11 . 1 1 89 89 SER CB C 89 63.990 63.990 63.223 0.767 18880
5097 1 11 . 1 1 89 89 SER H H 89 7.880 7.880 7.856 0.024 18880
5098 1 11 . 1 1 90 90 VAL N N 90 120.910 120.910 116.474 4.436 18880
5099 1 11 . 1 1 90 90 VAL HA H 90 4.140 4.140 3.768 0.372 18880
5100 1 11 . 1 1 90 90 VAL C C 90 175.720 175.720 175.347 0.373 18880
5101 1 11 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.603 -0.333 18880
5102 1 11 . 1 1 90 90 VAL CB C 90 32.840 32.840 29.467 3.373 18880
5103 1 11 . 1 1 90 90 VAL H H 90 8.020 8.020 7.940 0.080 18880
5104 1 11 . 1 1 91 91 ASP N N 91 123.620 123.620 118.951 4.669 18880
5105 1 11 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.642 -0.012 18880
5106 1 11 . 1 1 91 91 ASP C C 91 176.000 176.000 176.152 -0.152 18880
5107 1 11 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.609 -0.099 18880
5108 1 11 . 1 1 91 91 ASP CB C 91 41.440 41.440 42.264 -0.825 18880
5109 1 11 . 1 1 91 91 ASP H H 91 8.310 8.310 8.361 -0.051 18880
5110 1 11 . 1 1 92 92 GLU N N 92 122.170 122.170 121.522 0.648 18880
5111 1 11 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.529 -0.169 18880
5112 1 11 . 1 1 92 92 GLU C C 92 175.660 175.660 175.938 -0.278 18880
5113 1 11 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.579 -0.089 18880
5114 1 11 . 1 1 92 92 GLU CB C 92 32.850 32.850 31.435 1.415 18880
5115 1 11 . 1 1 92 92 GLU H H 92 8.320 8.320 8.611 -0.291 18880
5116 1 12 . 1 1 10 10 HIS C C 10 176.040 176.040 174.647 1.393 18880
5117 1 12 . 1 1 11 11 SER N N 11 116.840 116.840 116.200 0.640 18880
5118 1 12 . 1 1 11 11 SER HA H 11 4.430 4.430 4.713 -0.283 18880
5119 1 12 . 1 1 11 11 SER C C 11 174.630 174.630 173.685 0.945 18880
5120 1 12 . 1 1 11 11 SER CA C 11 58.350 58.350 58.128 0.222 18880
5121 1 12 . 1 1 11 11 SER CB C 11 64.120 64.120 64.138 -0.018 18880
5122 1 12 . 1 1 11 11 SER H H 11 8.360 8.360 8.498 -0.138 18880
5123 1 12 . 1 1 12 12 SER N N 12 118.030 118.030 120.179 -2.149 18880
5124 1 12 . 1 1 12 12 SER HA H 12 4.440 4.440 4.643 -0.203 18880
5125 1 12 . 1 1 12 12 SER C C 12 174.880 174.880 174.500 0.380 18880
5126 1 12 . 1 1 12 12 SER CA C 12 58.680 58.680 57.966 0.714 18880
5127 1 12 . 1 1 12 12 SER CB C 12 63.890 63.890 64.481 -0.591 18880
5128 1 12 . 1 1 12 12 SER H H 12 8.490 8.490 8.277 0.213 18880
5129 1 12 . 1 1 13 13 GLY N N 13 110.450 110.450 111.538 -1.088 18880
5130 1 12 . 1 1 13 13 GLY C C 13 173.790 173.790 173.412 0.378 18880
5131 1 12 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.827 0.633 18880
5132 1 12 . 1 1 13 13 GLY H H 13 8.390 8.390 8.429 -0.039 18880
5133 1 12 . 1 1 14 14 LEU N N 14 121.310 121.310 121.299 0.011 18880
5134 1 12 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.675 -0.335 18880
5135 1 12 . 1 1 14 14 LEU C C 14 176.930 176.930 177.330 -0.400 18880
5136 1 12 . 1 1 14 14 LEU CA C 14 55.200 55.200 53.981 1.219 18880
5137 1 12 . 1 1 14 14 LEU CB C 14 42.600 42.600 43.407 -0.807 18880
5138 1 12 . 1 1 14 14 LEU H H 14 8.020 8.020 7.986 0.034 18880
5139 1 12 . 1 1 15 15 VAL N N 15 121.550 121.550 118.087 3.463 18880
5140 1 12 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.071 0.299 18880
5141 1 12 . 1 1 15 15 VAL CA C 15 59.720 59.720 63.627 -3.908 18880
5142 1 12 . 1 1 15 15 VAL CB C 15 32.770 32.770 30.232 2.538 18880
5143 1 12 . 1 1 15 15 VAL H H 15 8.030 8.030 8.173 -0.143 18880
5144 1 12 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.289 0.081 18880
5145 1 12 . 1 1 16 16 PRO C C 16 176.720 176.720 176.196 0.524 18880
5146 1 12 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.169 -0.519 18880
5147 1 12 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.030 0.210 18880
5148 1 12 . 1 1 17 17 ARG N N 17 121.890 121.890 118.491 3.399 18880
5149 1 12 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.126 0.154 18880
5150 1 12 . 1 1 17 17 ARG C C 17 176.940 176.940 176.671 0.269 18880
5151 1 12 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.145 0.215 18880
5152 1 12 . 1 1 17 17 ARG CB C 17 31.050 31.050 29.577 1.473 18880
5153 1 12 . 1 1 17 17 ARG H H 17 8.450 8.450 8.415 0.035 18880
5154 1 12 . 1 1 18 18 GLY N N 18 110.160 110.160 110.799 -0.639 18880
5155 1 12 . 1 1 18 18 GLY C C 18 174.110 174.110 174.463 -0.353 18880
5156 1 12 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.133 0.257 18880
5157 1 12 . 1 1 18 18 GLY H H 18 8.480 8.480 8.252 0.228 18880
5158 1 12 . 1 1 19 19 SER N N 19 115.500 115.500 115.032 0.468 18880
5159 1 12 . 1 1 19 19 SER HA H 19 4.400 4.400 4.695 -0.295 18880
5160 1 12 . 1 1 19 19 SER C C 19 174.380 174.380 173.992 0.388 18880
5161 1 12 . 1 1 19 19 SER CA C 19 58.610 58.610 57.923 0.687 18880
5162 1 12 . 1 1 19 19 SER CB C 19 63.830 63.830 62.728 1.102 18880
5163 1 12 . 1 1 19 19 SER H H 19 8.210 8.210 8.237 -0.027 18880
5164 1 12 . 1 1 20 20 HIS N N 20 120.770 120.770 124.416 -3.646 18880
5165 1 12 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.512 0.098 18880
5166 1 12 . 1 1 20 20 HIS C C 20 174.870 174.870 175.097 -0.227 18880
5167 1 12 . 1 1 20 20 HIS CA C 20 56.130 56.130 57.234 -1.104 18880
5168 1 12 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.196 -0.486 18880
5169 1 12 . 1 1 20 20 HIS H H 20 8.590 8.590 8.552 0.038 18880
5170 1 12 . 1 1 21 21 MET N N 21 121.440 121.440 116.979 4.461 18880
5171 1 12 . 1 1 21 21 MET HA H 21 4.470 4.470 4.591 -0.121 18880
5172 1 12 . 1 1 21 21 MET C C 21 176.030 176.030 175.258 0.772 18880
5173 1 12 . 1 1 21 21 MET CA C 21 55.490 55.490 55.177 0.313 18880
5174 1 12 . 1 1 21 21 MET CB C 21 33.170 33.170 34.335 -1.165 18880
5175 1 12 . 1 1 21 21 MET H H 21 8.310 8.310 7.902 0.408 18880
5176 1 12 . 1 1 22 22 SER N N 22 116.860 116.860 116.123 0.737 18880
5177 1 12 . 1 1 22 22 SER HA H 22 4.430 4.430 4.616 -0.186 18880
5178 1 12 . 1 1 22 22 SER C C 22 174.630 174.630 174.953 -0.323 18880
5179 1 12 . 1 1 22 22 SER CA C 22 58.410 58.410 59.138 -0.728 18880
5180 1 12 . 1 1 22 22 SER CB C 22 64.030 64.030 63.192 0.838 18880
5181 1 12 . 1 1 22 22 SER H H 22 8.340 8.340 8.630 -0.290 18880
5182 1 12 . 1 1 23 23 ASP N N 23 122.660 122.660 121.946 0.714 18880
5183 1 12 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.558 -0.008 18880
5184 1 12 . 1 1 23 23 ASP C C 23 176.860 176.860 177.791 -0.931 18880
5185 1 12 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.725 -0.395 18880
5186 1 12 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.246 0.754 18880
5187 1 12 . 1 1 23 23 ASP H H 23 8.540 8.540 8.557 -0.017 18880
5188 1 12 . 1 1 24 24 GLU N N 24 120.400 120.400 118.861 1.539 18880
5189 1 12 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.073 0.067 18880
5190 1 12 . 1 1 24 24 GLU C C 24 177.540 177.540 177.285 0.255 18880
5191 1 12 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.485 -0.125 18880
5192 1 12 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.168 0.582 18880
5193 1 12 . 1 1 24 24 GLU H H 24 8.610 8.610 7.895 0.715 18880
5194 1 12 . 1 1 25 25 LYS N N 25 120.390 120.390 118.879 1.511 18880
5195 1 12 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.278 -0.088 18880
5196 1 12 . 1 1 25 25 LYS C C 25 177.490 177.490 178.206 -0.716 18880
5197 1 12 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.212 -0.101 18880
5198 1 12 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.956 -0.466 18880
5199 1 12 . 1 1 25 25 LYS H H 25 8.210 8.210 7.626 0.584 18880
5200 1 12 . 1 1 26 26 THR N N 26 114.880 114.880 116.093 -1.213 18880
5201 1 12 . 1 1 26 26 THR HA H 26 4.040 4.040 4.108 -0.068 18880
5202 1 12 . 1 1 26 26 THR C C 26 175.430 175.430 176.986 -1.556 18880
5203 1 12 . 1 1 26 26 THR CA C 26 64.620 64.620 65.826 -1.206 18880
5204 1 12 . 1 1 26 26 THR CB C 26 69.110 69.110 68.547 0.563 18880
5205 1 12 . 1 1 26 26 THR H H 26 8.080 8.080 7.453 0.627 18880
5206 1 12 . 1 1 27 27 GLN N N 27 120.940 120.940 120.850 0.090 18880
5207 1 12 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.093 0.097 18880
5208 1 12 . 1 1 27 27 GLN C C 27 177.280 177.280 177.648 -0.368 18880
5209 1 12 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.724 -1.174 18880
5210 1 12 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.320 0.770 18880
5211 1 12 . 1 1 27 27 GLN H H 27 8.240 8.240 7.880 0.360 18880
5212 1 12 . 1 1 28 28 LEU N N 28 121.860 121.860 119.070 2.790 18880
5213 1 12 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.319 -0.149 18880
5214 1 12 . 1 1 28 28 LEU C C 28 177.750 177.750 177.836 -0.086 18880
5215 1 12 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.647 1.433 18880
5216 1 12 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.563 -0.293 18880
5217 1 12 . 1 1 28 28 LEU H H 28 7.950 7.950 7.461 0.489 18880
5218 1 12 . 1 1 29 29 ILE N N 29 119.260 119.260 119.222 0.038 18880
5219 1 12 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.895 0.005 18880
5220 1 12 . 1 1 29 29 ILE C C 29 177.140 177.140 177.096 0.044 18880
5221 1 12 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.313 -0.013 18880
5222 1 12 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.871 1.409 18880
5223 1 12 . 1 1 29 29 ILE H H 29 7.950 7.950 7.911 0.039 18880
5224 1 12 . 1 1 30 30 GLU N N 30 120.500 120.500 118.175 2.325 18880
5225 1 12 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.320 -0.270 18880
5226 1 12 . 1 1 30 30 GLU C C 30 177.560 177.560 176.388 1.172 18880
5227 1 12 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.764 0.326 18880
5228 1 12 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.172 0.417 18880
5229 1 12 . 1 1 30 30 GLU H H 30 8.220 8.220 7.951 0.269 18880
5230 1 12 . 1 1 31 31 ALA N N 31 121.550 121.550 121.230 0.320 18880
5231 1 12 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.205 -0.055 18880
5232 1 12 . 1 1 31 31 ALA C C 31 178.550 178.550 178.970 -0.420 18880
5233 1 12 . 1 1 31 31 ALA CA C 31 53.800 53.800 54.502 -0.702 18880
5234 1 12 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.018 -0.388 18880
5235 1 12 . 1 1 31 31 ALA H H 31 7.890 7.890 7.370 0.520 18880
5236 1 12 . 1 1 32 32 PHE N N 32 117.240 117.240 116.892 0.348 18880
5237 1 12 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.213 0.087 18880
5238 1 12 . 1 1 32 32 PHE C C 32 176.210 176.210 176.766 -0.556 18880
5239 1 12 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.764 -1.424 18880
5240 1 12 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.730 1.020 18880
5241 1 12 . 1 1 32 32 PHE H H 32 7.930 7.930 7.621 0.309 18880
5242 1 12 . 1 1 33 33 TYR N N 33 119.050 119.050 116.087 2.963 18880
5243 1 12 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.720 -0.390 18880
5244 1 12 . 1 1 33 33 TYR C C 33 175.680 175.680 175.567 0.113 18880
5245 1 12 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.346 1.574 18880
5246 1 12 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.924 1.616 18880
5247 1 12 . 1 1 33 33 TYR H H 33 7.950 7.950 7.639 0.311 18880
5248 1 12 . 1 1 34 34 ASN N N 34 118.390 118.390 118.828 -0.438 18880
5249 1 12 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.891 -0.261 18880
5250 1 12 . 1 1 34 34 ASN C C 34 174.810 174.810 173.699 1.111 18880
5251 1 12 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.526 -0.376 18880
5252 1 12 . 1 1 34 34 ASN CB C 34 38.980 38.980 40.577 -1.597 18880
5253 1 12 . 1 1 34 34 ASN H H 34 7.960 7.960 7.837 0.123 18880
5254 1 12 . 1 1 35 35 PHE N N 35 120.670 120.670 120.391 0.279 18880
5255 1 12 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.538 -0.088 18880
5256 1 12 . 1 1 35 35 PHE C C 35 175.310 175.310 173.109 2.201 18880
5257 1 12 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.309 0.010 18880
5258 1 12 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.284 -0.864 18880
5259 1 12 . 1 1 35 35 PHE H H 35 7.830 7.830 7.938 -0.108 18880
5260 1 12 . 1 1 36 36 ASP N N 36 122.400 122.400 122.081 0.319 18880
5261 1 12 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.728 -0.138 18880
5262 1 12 . 1 1 36 36 ASP C C 36 176.150 176.150 175.864 0.286 18880
5263 1 12 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.199 0.871 18880
5264 1 12 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.994 0.326 18880
5265 1 12 . 1 1 36 36 ASP H H 36 8.180 8.180 8.356 -0.176 18880
5266 1 12 . 1 1 37 37 GLY N N 37 108.560 108.560 108.758 -0.198 18880
5267 1 12 . 1 1 37 37 GLY C C 37 173.660 173.660 173.851 -0.191 18880
5268 1 12 . 1 1 37 37 GLY CA C 37 45.610 45.610 44.613 0.997 18880
5269 1 12 . 1 1 37 37 GLY H H 37 7.680 7.680 7.422 0.258 18880
5270 1 12 . 1 1 38 38 ASP N N 38 120.010 120.010 118.890 1.120 18880
5271 1 12 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.309 0.291 18880
5272 1 12 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.926 -0.666 18880
5273 1 12 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.518 1.932 18880
5274 1 12 . 1 1 38 38 ASP H H 38 8.220 8.220 8.156 0.064 18880
5275 1 12 . 1 1 39 39 TYR N N 39 121.030 121.030 120.513 0.517 18880
5276 1 12 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.621 -0.231 18880
5277 1 12 . 1 1 39 39 TYR C C 39 175.290 175.290 176.101 -0.811 18880
5278 1 12 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.267 -0.067 18880
5279 1 12 . 1 1 39 39 TYR CB C 39 39.170 39.170 40.038 -0.868 18880
5280 1 12 . 1 1 39 39 TYR H H 39 8.090 8.090 8.199 -0.109 18880
5281 1 12 . 1 1 40 40 ASP N N 40 122.020 122.020 123.562 -1.542 18880
5282 1 12 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.515 0.085 18880
5283 1 12 . 1 1 40 40 ASP C C 40 175.970 175.970 176.677 -0.707 18880
5284 1 12 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.591 0.629 18880
5285 1 12 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.328 0.193 18880
5286 1 12 . 1 1 40 40 ASP H H 40 8.200 8.200 8.081 0.119 18880
5287 1 12 . 1 1 41 41 GLY N N 41 108.330 108.330 105.149 3.181 18880
5288 1 12 . 1 1 41 41 GLY C C 41 173.000 173.000 172.083 0.917 18880
5289 1 12 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.461 0.959 18880
5290 1 12 . 1 1 41 41 GLY H H 41 7.830 7.830 8.429 -0.599 18880
5291 1 12 . 1 1 42 42 PHE N N 42 118.600 118.600 118.216 0.384 18880
5292 1 12 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.896 0.364 18880
5293 1 12 . 1 1 42 42 PHE C C 42 175.660 175.660 174.294 1.366 18880
5294 1 12 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.591 -0.431 18880
5295 1 12 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.450 -1.280 18880
5296 1 12 . 1 1 42 42 PHE H H 42 8.150 8.150 7.223 0.927 18880
5297 1 12 . 1 1 43 43 VAL N N 43 119.180 119.180 123.272 -4.092 18880
5298 1 12 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.525 0.145 18880
5299 1 12 . 1 1 43 43 VAL C C 43 175.110 175.110 173.763 1.347 18880
5300 1 12 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.899 0.721 18880
5301 1 12 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.883 -3.003 18880
5302 1 12 . 1 1 43 43 VAL H H 43 9.070 9.070 8.695 0.375 18880
5303 1 12 . 1 1 44 44 SER N N 44 121.380 121.380 122.056 -0.676 18880
5304 1 12 . 1 1 44 44 SER HA H 44 4.570 4.570 3.852 0.718 18880
5305 1 12 . 1 1 44 44 SER C C 44 175.660 175.660 175.179 0.481 18880
5306 1 12 . 1 1 44 44 SER CA C 44 57.720 57.720 56.300 1.420 18880
5307 1 12 . 1 1 44 44 SER CB C 44 63.690 63.690 63.415 0.275 18880
5308 1 12 . 1 1 44 44 SER H H 44 9.140 9.140 8.328 0.812 18880
5309 1 12 . 1 1 45 45 VAL N N 45 122.720 122.720 123.664 -0.944 18880
5310 1 12 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.169 0.331 18880
5311 1 12 . 1 1 45 45 VAL C C 45 177.240 177.240 177.437 -0.197 18880
5312 1 12 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.587 -0.317 18880
5313 1 12 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.882 0.568 18880
5314 1 12 . 1 1 45 45 VAL H H 45 8.140 8.140 8.423 -0.283 18880
5315 1 12 . 1 1 46 46 GLU N N 46 118.990 118.990 117.706 1.284 18880
5316 1 12 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.847 0.133 18880
5317 1 12 . 1 1 46 46 GLU C C 46 179.460 179.460 179.120 0.340 18880
5318 1 12 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.322 0.238 18880
5319 1 12 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.961 0.199 18880
5320 1 12 . 1 1 46 46 GLU H H 46 8.230 8.230 7.647 0.583 18880
5321 1 12 . 1 1 47 47 GLU N N 47 120.120 120.120 118.704 1.416 18880
5322 1 12 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.181 -0.101 18880
5323 1 12 . 1 1 47 47 GLU C C 47 179.170 179.170 178.520 0.650 18880
5324 1 12 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.931 0.959 18880
5325 1 12 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.761 0.059 18880
5326 1 12 . 1 1 47 47 GLU H H 47 7.880 7.880 7.277 0.603 18880
5327 1 12 . 1 1 48 48 PHE N N 48 120.830 120.830 121.010 -0.180 18880
5328 1 12 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.045 0.145 18880
5329 1 12 . 1 1 48 48 PHE C C 48 176.920 176.920 177.515 -0.595 18880
5330 1 12 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.767 0.102 18880
5331 1 12 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.924 0.336 18880
5332 1 12 . 1 1 48 48 PHE H H 48 8.600 8.600 8.286 0.314 18880
5333 1 12 . 1 1 49 49 ARG N N 49 118.470 118.470 118.832 -0.362 18880
5334 1 12 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.051 -0.191 18880
5335 1 12 . 1 1 49 49 ARG C C 49 178.090 178.090 178.781 -0.691 18880
5336 1 12 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.342 -0.272 18880
5337 1 12 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.774 0.366 18880
5338 1 12 . 1 1 49 49 ARG H H 49 8.650 8.650 8.664 -0.014 18880
5339 1 12 . 1 1 50 50 GLY N N 50 105.080 105.080 105.877 -0.797 18880
5340 1 12 . 1 1 50 50 GLY C C 50 175.090 175.090 175.656 -0.566 18880
5341 1 12 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.786 -0.106 18880
5342 1 12 . 1 1 50 50 GLY H H 50 7.620 7.620 8.195 -0.575 18880
5343 1 12 . 1 1 51 51 ILE N N 51 121.440 121.440 120.997 0.443 18880
5344 1 12 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.807 0.023 18880
5345 1 12 . 1 1 51 51 ILE C C 51 178.300 178.300 177.448 0.852 18880
5346 1 12 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.082 -0.242 18880
5347 1 12 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.293 0.017 18880
5348 1 12 . 1 1 51 51 ILE H H 51 7.470 7.470 7.076 0.394 18880
5349 1 12 . 1 1 52 52 ILE N N 52 118.930 118.930 120.227 -1.297 18880
5350 1 12 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.643 0.097 18880
5351 1 12 . 1 1 52 52 ILE CA C 52 63.760 63.760 64.768 -1.008 18880
5352 1 12 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.905 0.125 18880
5353 1 12 . 1 1 52 52 ILE H H 52 7.790 7.790 8.652 -0.862 18880
5354 1 12 . 1 1 53 53 ARG N N 53 120.140 120.140 119.878 0.262 18880
5355 1 12 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.922 0.168 18880
5356 1 12 . 1 1 53 53 ARG C C 53 177.380 177.380 177.480 -0.100 18880
5357 1 12 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.912 0.198 18880
5358 1 12 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.159 -0.579 18880
5359 1 12 . 1 1 53 53 ARG H H 53 7.930 7.930 8.130 -0.200 18880
5360 1 12 . 1 1 54 54 ASP N N 54 117.500 117.500 116.159 1.341 18880
5361 1 12 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.685 -0.085 18880
5362 1 12 . 1 1 54 54 ASP C C 54 176.930 176.930 176.266 0.664 18880
5363 1 12 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.306 1.234 18880
5364 1 12 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.805 0.295 18880
5365 1 12 . 1 1 54 54 ASP H H 54 7.870 7.870 8.014 -0.144 18880
5366 1 12 . 1 1 55 55 GLY N N 55 106.370 106.370 107.621 -1.251 18880
5367 1 12 . 1 1 55 55 GLY C C 55 173.460 173.460 173.816 -0.356 18880
5368 1 12 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.482 0.518 18880
5369 1 12 . 1 1 55 55 GLY H H 55 7.880 7.880 7.451 0.429 18880
5370 1 12 . 1 1 56 56 LEU N N 56 122.630 122.630 120.936 1.694 18880
5371 1 12 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.855 -0.085 18880
5372 1 12 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.608 0.883 18880
5373 1 12 . 1 1 56 56 LEU CB C 56 43.120 43.120 44.468 -1.348 18880
5374 1 12 . 1 1 56 56 LEU H H 56 8.220 8.220 7.727 0.493 18880
5375 1 12 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.482 0.098 18880
5376 1 12 . 1 1 57 57 PRO C C 57 176.150 176.150 175.536 0.614 18880
5377 1 12 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.647 -0.227 18880
5378 1 12 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.123 0.617 18880
5379 1 12 . 1 1 58 58 MET N N 58 121.810 121.810 120.997 0.813 18880
5380 1 12 . 1 1 58 58 MET HA H 58 4.630 4.630 4.432 0.198 18880
5381 1 12 . 1 1 58 58 MET C C 58 176.150 176.150 175.487 0.663 18880
5382 1 12 . 1 1 58 58 MET CA C 58 55.560 55.560 55.223 0.337 18880
5383 1 12 . 1 1 58 58 MET CB C 58 36.820 36.820 34.187 2.633 18880
5384 1 12 . 1 1 58 58 MET H H 58 7.690 7.690 7.845 -0.155 18880
5385 1 12 . 1 1 59 59 THR N N 59 114.180 114.180 115.216 -1.036 18880
5386 1 12 . 1 1 59 59 THR HA H 59 4.450 4.450 4.484 -0.034 18880
5387 1 12 . 1 1 59 59 THR C C 59 175.170 175.170 175.738 -0.568 18880
5388 1 12 . 1 1 59 59 THR CA C 59 60.780 60.780 60.709 0.071 18880
5389 1 12 . 1 1 59 59 THR CB C 59 71.060 71.060 70.032 1.028 18880
5390 1 12 . 1 1 59 59 THR H H 59 8.940 8.940 8.119 0.821 18880
5391 1 12 . 1 1 60 60 GLU N N 60 120.620 120.620 126.917 -6.297 18880
5392 1 12 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.671 0.339 18880
5393 1 12 . 1 1 60 60 GLU C C 60 179.010 179.010 177.744 1.266 18880
5394 1 12 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.716 0.104 18880
5395 1 12 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.927 0.123 18880
5396 1 12 . 1 1 60 60 GLU H H 60 8.850 8.850 8.979 -0.129 18880
5397 1 12 . 1 1 61 61 ALA N N 61 121.080 121.080 122.165 -1.085 18880
5398 1 12 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.871 0.269 18880
5399 1 12 . 1 1 61 61 ALA C C 61 180.350 180.350 179.853 0.497 18880
5400 1 12 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.225 -0.135 18880
5401 1 12 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.911 0.299 18880
5402 1 12 . 1 1 61 61 ALA H H 61 8.370 8.370 8.387 -0.017 18880
5403 1 12 . 1 1 62 62 GLU N N 62 118.890 118.890 118.649 0.241 18880
5404 1 12 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.501 0.499 18880
5405 1 12 . 1 1 62 62 GLU C C 62 179.690 179.690 178.521 1.169 18880
5406 1 12 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.355 0.635 18880
5407 1 12 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.347 1.963 18880
5408 1 12 . 1 1 62 62 GLU H H 62 7.680 7.680 7.769 -0.089 18880
5409 1 12 . 1 1 63 63 ILE N N 63 122.340 122.340 119.907 2.433 18880
5410 1 12 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.237 0.333 18880
5411 1 12 . 1 1 63 63 ILE C C 63 177.260 177.260 178.155 -0.895 18880
5412 1 12 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.564 1.326 18880
5413 1 12 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.793 1.187 18880
5414 1 12 . 1 1 63 63 ILE H H 63 8.420 8.420 7.467 0.953 18880
5415 1 12 . 1 1 64 64 THR N N 64 116.970 116.970 115.662 1.308 18880
5416 1 12 . 1 1 64 64 THR HA H 64 3.940 3.940 3.866 0.074 18880
5417 1 12 . 1 1 64 64 THR C C 64 176.520 176.520 176.750 -0.230 18880
5418 1 12 . 1 1 64 64 THR CA C 64 67.060 67.060 67.375 -0.315 18880
5419 1 12 . 1 1 64 64 THR CB C 64 68.750 68.750 68.356 0.395 18880
5420 1 12 . 1 1 64 64 THR H H 64 8.310 8.310 8.361 -0.051 18880
5421 1 12 . 1 1 65 65 GLU N N 65 120.760 120.760 120.011 0.749 18880
5422 1 12 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.168 -0.138 18880
5423 1 12 . 1 1 65 65 GLU C C 65 175.830 175.830 178.600 -2.770 18880
5424 1 12 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.920 0.580 18880
5425 1 12 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.625 0.145 18880
5426 1 12 . 1 1 65 65 GLU H H 65 7.970 7.970 8.502 -0.532 18880
5427 1 12 . 1 1 66 66 PHE N N 66 120.940 120.940 117.699 3.241 18880
5428 1 12 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.432 -0.192 18880
5429 1 12 . 1 1 66 66 PHE C C 66 177.330 177.330 177.287 0.043 18880
5430 1 12 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.230 2.970 18880
5431 1 12 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.383 -0.853 18880
5432 1 12 . 1 1 66 66 PHE H H 66 8.100 8.100 7.757 0.343 18880
5433 1 12 . 1 1 67 67 PHE N N 67 118.110 118.110 119.533 -1.423 18880
5434 1 12 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.337 -0.387 18880
5435 1 12 . 1 1 67 67 PHE C C 67 178.090 178.090 177.808 0.282 18880
5436 1 12 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.048 2.151 18880
5437 1 12 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.543 -0.293 18880
5438 1 12 . 1 1 67 67 PHE H H 67 8.380 8.380 8.721 -0.341 18880
5439 1 12 . 1 1 68 68 GLU N N 68 119.650 119.650 117.871 1.779 18880
5440 1 12 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.365 -0.355 18880
5441 1 12 . 1 1 68 68 GLU C C 68 177.910 177.910 176.825 1.085 18880
5442 1 12 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.031 1.209 18880
5443 1 12 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.542 -0.172 18880
5444 1 12 . 1 1 68 68 GLU H H 68 8.230 8.230 8.149 0.081 18880
5445 1 12 . 1 1 69 69 ALA N N 69 119.090 119.090 120.485 -1.395 18880
5446 1 12 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.312 -0.132 18880
5447 1 12 . 1 1 69 69 ALA C C 69 179.030 179.030 178.197 0.833 18880
5448 1 12 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.364 0.236 18880
5449 1 12 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.768 0.012 18880
5450 1 12 . 1 1 69 69 ALA H H 69 7.340 7.340 7.608 -0.268 18880
5451 1 12 . 1 1 70 70 ALA N N 70 118.670 118.670 120.013 -1.343 18880
5452 1 12 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.362 -0.342 18880
5453 1 12 . 1 1 70 70 ALA C C 70 176.820 176.820 176.731 0.089 18880
5454 1 12 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.691 0.399 18880
5455 1 12 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.485 -0.875 18880
5456 1 12 . 1 1 70 70 ALA H H 70 8.050 8.050 7.770 0.280 18880
5457 1 12 . 1 1 71 71 ASP N N 71 116.780 116.780 118.787 -2.007 18880
5458 1 12 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.174 0.046 18880
5459 1 12 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.474 1.677 18880
5460 1 12 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.240 -2.330 18880
5461 1 12 . 1 1 71 71 ASP H H 71 8.010 8.010 7.549 0.461 18880
5462 1 12 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.397 0.073 18880
5463 1 12 . 1 1 72 72 PRO C C 72 177.970 177.970 177.705 0.265 18880
5464 1 12 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.600 0.310 18880
5465 1 12 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.616 -0.736 18880
5466 1 12 . 1 1 73 73 ASN N N 73 114.930 114.930 115.957 -1.027 18880
5467 1 12 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.678 0.202 18880
5468 1 12 . 1 1 73 73 ASN C C 73 174.880 174.880 174.765 0.115 18880
5469 1 12 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.477 -0.638 18880
5470 1 12 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.772 -0.392 18880
5471 1 12 . 1 1 73 73 ASN H H 73 9.030 9.030 8.163 0.867 18880
5472 1 12 . 1 1 74 74 ASN N N 74 118.340 118.340 113.777 4.563 18880
5473 1 12 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.445 -0.085 18880
5474 1 12 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.984 0.605 18880
5475 1 12 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.094 1.066 18880
5476 1 12 . 1 1 74 74 ASN H H 74 8.320 8.320 8.462 -0.142 18880
5477 1 12 . 1 1 75 75 THR N N 75 113.450 113.450 110.483 2.967 18880
5478 1 12 . 1 1 75 75 THR HA H 75 4.210 4.210 4.530 -0.320 18880
5479 1 12 . 1 1 75 75 THR CA C 75 63.410 63.410 61.266 2.144 18880
5480 1 12 . 1 1 75 75 THR CB C 75 70.540 70.540 69.343 1.197 18880
5481 1 12 . 1 1 75 75 THR H H 75 9.870 9.870 8.241 1.629 18880
5482 1 12 . 1 1 76 76 GLY N N 76 111.810 111.810 109.040 2.770 18880
5483 1 12 . 1 1 76 76 GLY C C 76 173.670 173.670 173.653 0.017 18880
5484 1 12 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.520 -0.400 18880
5485 1 12 . 1 1 76 76 GLY H H 76 10.250 10.250 8.506 1.744 18880
5486 1 12 . 1 1 77 77 PHE N N 77 120.560 120.560 118.695 1.865 18880
5487 1 12 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.911 0.239 18880
5488 1 12 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.635 -0.455 18880
5489 1 12 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.403 1.097 18880
5490 1 12 . 1 1 77 77 PHE H H 77 8.110 8.110 7.820 0.290 18880
5491 1 12 . 1 1 78 78 ILE N N 78 116.410 116.410 123.728 -7.318 18880
5492 1 12 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.320 0.070 18880
5493 1 12 . 1 1 78 78 ILE C C 78 174.770 174.770 174.743 0.027 18880
5494 1 12 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.932 -0.742 18880
5495 1 12 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.392 0.788 18880
5496 1 12 . 1 1 78 78 ILE H H 78 8.930 8.930 7.910 1.020 18880
5497 1 12 . 1 1 79 79 ASP N N 79 125.220 125.220 125.933 -0.713 18880
5498 1 12 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.181 -0.681 18880
5499 1 12 . 1 1 79 79 ASP C C 79 176.490 176.490 176.852 -0.362 18880
5500 1 12 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.037 0.273 18880
5501 1 12 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.416 0.954 18880
5502 1 12 . 1 1 79 79 ASP H H 79 8.610 8.610 8.836 -0.226 18880
5503 1 12 . 1 1 80 80 TYR N N 80 125.760 125.760 127.197 -1.437 18880
5504 1 12 . 1 1 80 80 TYR HA H 80 3.990 3.990 3.970 0.019 18880
5505 1 12 . 1 1 80 80 TYR C C 80 177.140 177.140 176.597 0.543 18880
5506 1 12 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.789 -1.209 18880
5507 1 12 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.675 0.215 18880
5508 1 12 . 1 1 80 80 TYR H H 80 8.460 8.460 8.485 -0.025 18880
5509 1 12 . 1 1 81 81 LYS N N 81 118.320 118.320 118.743 -0.423 18880
5510 1 12 . 1 1 81 81 LYS HA H 81 3.900 3.900 4.029 -0.129 18880
5511 1 12 . 1 1 81 81 LYS C C 81 179.090 179.090 178.581 0.509 18880
5512 1 12 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.922 -0.342 18880
5513 1 12 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.502 0.258 18880
5514 1 12 . 1 1 81 81 LYS H H 81 8.410 8.410 8.509 -0.099 18880
5515 1 12 . 1 1 82 82 ALA N N 82 122.050 122.050 122.095 -0.045 18880
5516 1 12 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.207 -0.077 18880
5517 1 12 . 1 1 82 82 ALA C C 82 179.740 179.740 179.011 0.729 18880
5518 1 12 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.757 -0.237 18880
5519 1 12 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.442 0.098 18880
5520 1 12 . 1 1 82 82 ALA H H 82 7.770 7.770 8.008 -0.238 18880
5521 1 12 . 1 1 83 83 PHE N N 83 117.810 117.810 116.464 1.346 18880
5522 1 12 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.422 -0.132 18880
5523 1 12 . 1 1 83 83 PHE C C 83 176.460 176.460 176.249 0.211 18880
5524 1 12 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.047 -0.017 18880
5525 1 12 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.145 -0.625 18880
5526 1 12 . 1 1 83 83 PHE H H 83 7.780 7.780 7.865 -0.085 18880
5527 1 12 . 1 1 84 84 ALA N N 84 121.530 121.530 122.180 -0.650 18880
5528 1 12 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.057 -0.397 18880
5529 1 12 . 1 1 84 84 ALA C C 84 179.010 179.010 178.886 0.124 18880
5530 1 12 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.112 0.918 18880
5531 1 12 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.349 -0.219 18880
5532 1 12 . 1 1 84 84 ALA H H 84 8.290 8.290 8.309 -0.019 18880
5533 1 12 . 1 1 85 85 ALA N N 85 117.720 117.720 120.256 -2.536 18880
5534 1 12 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.282 -0.202 18880
5535 1 12 . 1 1 85 85 ALA C C 85 179.570 179.570 179.311 0.259 18880
5536 1 12 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.749 -0.379 18880
5537 1 12 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.444 -0.154 18880
5538 1 12 . 1 1 85 85 ALA H H 85 7.700 7.700 8.724 -1.024 18880
5539 1 12 . 1 1 86 86 MET N N 86 116.570 116.570 116.452 0.118 18880
5540 1 12 . 1 1 86 86 MET HA H 86 4.160 4.160 4.134 0.026 18880
5541 1 12 . 1 1 86 86 MET C C 86 177.360 177.360 178.242 -0.882 18880
5542 1 12 . 1 1 86 86 MET CA C 86 57.380 57.380 58.618 -1.238 18880
5543 1 12 . 1 1 86 86 MET CB C 86 32.720 32.720 32.272 0.448 18880
5544 1 12 . 1 1 86 86 MET H H 86 7.560 7.560 7.362 0.198 18880
5545 1 12 . 1 1 87 87 LEU N N 87 119.090 119.090 117.615 1.475 18880
5546 1 12 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.007 -0.037 18880
5547 1 12 . 1 1 87 87 LEU C C 87 177.420 177.420 176.747 0.673 18880
5548 1 12 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.761 0.529 18880
5549 1 12 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.856 0.424 18880
5550 1 12 . 1 1 87 87 LEU H H 87 7.570 7.570 7.208 0.362 18880
5551 1 12 . 1 1 88 88 TYR N N 88 117.060 117.060 113.456 3.604 18880
5552 1 12 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.746 -0.156 18880
5553 1 12 . 1 1 88 88 TYR C C 88 175.870 175.870 175.076 0.794 18880
5554 1 12 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.011 2.829 18880
5555 1 12 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.047 0.593 18880
5556 1 12 . 1 1 88 88 TYR H H 88 7.740 7.740 7.131 0.609 18880
5557 1 12 . 1 1 89 89 SER N N 89 115.980 115.980 119.593 -3.613 18880
5558 1 12 . 1 1 89 89 SER HA H 89 4.440 4.440 4.475 -0.035 18880
5559 1 12 . 1 1 89 89 SER C C 89 174.460 174.460 174.530 -0.070 18880
5560 1 12 . 1 1 89 89 SER CA C 89 58.350 58.350 59.886 -1.536 18880
5561 1 12 . 1 1 89 89 SER CB C 89 63.990 63.990 62.561 1.429 18880
5562 1 12 . 1 1 89 89 SER H H 89 7.880 7.880 7.944 -0.064 18880
5563 1 12 . 1 1 90 90 VAL N N 90 120.910 120.910 118.969 1.941 18880
5564 1 12 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.426 -0.286 18880
5565 1 12 . 1 1 90 90 VAL C C 90 175.720 175.720 174.538 1.182 18880
5566 1 12 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.634 0.636 18880
5567 1 12 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.232 0.608 18880
5568 1 12 . 1 1 90 90 VAL H H 90 8.020 8.020 7.937 0.083 18880
5569 1 12 . 1 1 91 91 ASP N N 91 123.620 123.620 121.056 2.564 18880
5570 1 12 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.691 -0.061 18880
5571 1 12 . 1 1 91 91 ASP C C 91 176.000 176.000 175.451 0.549 18880
5572 1 12 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.014 0.496 18880
5573 1 12 . 1 1 91 91 ASP CB C 91 41.440 41.440 43.216 -1.776 18880
5574 1 12 . 1 1 91 91 ASP H H 91 8.310 8.310 7.609 0.701 18880
5575 1 12 . 1 1 92 92 GLU N N 92 122.170 122.170 120.750 1.420 18880
5576 1 12 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.404 -0.044 18880
5577 1 12 . 1 1 92 92 GLU C C 92 175.660 175.660 176.429 -0.769 18880
5578 1 12 . 1 1 92 92 GLU CA C 92 56.490 56.490 57.552 -1.062 18880
5579 1 12 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.513 2.337 18880
5580 1 12 . 1 1 92 92 GLU H H 92 8.320 8.320 8.624 -0.304 18880
5581 1 13 . 1 1 10 10 HIS C C 10 176.040 176.040 174.930 1.110 18880
5582 1 13 . 1 1 11 11 SER N N 11 116.840 116.840 117.879 -1.039 18880
5583 1 13 . 1 1 11 11 SER HA H 11 4.430 4.430 4.435 -0.005 18880
5584 1 13 . 1 1 11 11 SER C C 11 174.630 174.630 174.527 0.103 18880
5585 1 13 . 1 1 11 11 SER CA C 11 58.350 58.350 58.620 -0.270 18880
5586 1 13 . 1 1 11 11 SER CB C 11 64.120 64.120 63.771 0.349 18880
5587 1 13 . 1 1 11 11 SER H H 11 8.360 8.360 8.417 -0.057 18880
5588 1 13 . 1 1 12 12 SER N N 12 118.030 118.030 116.245 1.785 18880
5589 1 13 . 1 1 12 12 SER HA H 12 4.440 4.440 4.182 0.258 18880
5590 1 13 . 1 1 12 12 SER C C 12 174.880 174.880 174.091 0.789 18880
5591 1 13 . 1 1 12 12 SER CA C 12 58.680 58.680 58.226 0.454 18880
5592 1 13 . 1 1 12 12 SER CB C 12 63.890 63.890 61.579 2.311 18880
5593 1 13 . 1 1 12 12 SER H H 12 8.490 8.490 8.204 0.286 18880
5594 1 13 . 1 1 13 13 GLY N N 13 110.450 110.450 108.812 1.638 18880
5595 1 13 . 1 1 13 13 GLY C C 13 173.790 173.790 173.950 -0.160 18880
5596 1 13 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.917 0.543 18880
5597 1 13 . 1 1 13 13 GLY H H 13 8.390 8.390 7.783 0.607 18880
5598 1 13 . 1 1 14 14 LEU N N 14 121.310 121.310 122.266 -0.956 18880
5599 1 13 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.617 -0.277 18880
5600 1 13 . 1 1 14 14 LEU C C 14 176.930 176.930 175.986 0.944 18880
5601 1 13 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.513 0.687 18880
5602 1 13 . 1 1 14 14 LEU CB C 14 42.600 42.600 41.892 0.708 18880
5603 1 13 . 1 1 14 14 LEU H H 14 8.020 8.020 7.542 0.478 18880
5604 1 13 . 1 1 15 15 VAL N N 15 121.550 121.550 118.000 3.550 18880
5605 1 13 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.242 0.128 18880
5606 1 13 . 1 1 15 15 VAL CA C 15 59.720 59.720 60.816 -1.096 18880
5607 1 13 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.048 1.722 18880
5608 1 13 . 1 1 15 15 VAL H H 15 8.030 8.030 7.657 0.373 18880
5609 1 13 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.293 0.077 18880
5610 1 13 . 1 1 16 16 PRO C C 16 176.720 176.720 177.181 -0.461 18880
5611 1 13 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.879 -2.229 18880
5612 1 13 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.018 0.222 18880
5613 1 13 . 1 1 17 17 ARG N N 17 121.890 121.890 115.097 6.793 18880
5614 1 13 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.367 -0.087 18880
5615 1 13 . 1 1 17 17 ARG C C 17 176.940 176.940 176.936 0.004 18880
5616 1 13 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.048 0.312 18880
5617 1 13 . 1 1 17 17 ARG CB C 17 31.050 31.050 31.794 -0.744 18880
5618 1 13 . 1 1 17 17 ARG H H 17 8.450 8.450 7.914 0.536 18880
5619 1 13 . 1 1 18 18 GLY N N 18 110.160 110.160 107.958 2.202 18880
5620 1 13 . 1 1 18 18 GLY C C 18 174.110 174.110 173.872 0.238 18880
5621 1 13 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.259 0.131 18880
5622 1 13 . 1 1 18 18 GLY H H 18 8.480 8.480 8.185 0.295 18880
5623 1 13 . 1 1 19 19 SER N N 19 115.500 115.500 117.599 -2.099 18880
5624 1 13 . 1 1 19 19 SER HA H 19 4.400 4.400 4.618 -0.218 18880
5625 1 13 . 1 1 19 19 SER C C 19 174.380 174.380 174.225 0.155 18880
5626 1 13 . 1 1 19 19 SER CA C 19 58.610 58.610 57.513 1.097 18880
5627 1 13 . 1 1 19 19 SER CB C 19 63.830 63.830 63.799 0.031 18880
5628 1 13 . 1 1 19 19 SER H H 19 8.210 8.210 7.917 0.293 18880
5629 1 13 . 1 1 20 20 HIS N N 20 120.770 120.770 125.903 -5.133 18880
5630 1 13 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.498 0.112 18880
5631 1 13 . 1 1 20 20 HIS C C 20 174.870 174.870 176.240 -1.370 18880
5632 1 13 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.874 -0.744 18880
5633 1 13 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.549 -0.840 18880
5634 1 13 . 1 1 20 20 HIS H H 20 8.590 8.590 8.738 -0.148 18880
5635 1 13 . 1 1 21 21 MET N N 21 121.440 121.440 119.845 1.595 18880
5636 1 13 . 1 1 21 21 MET HA H 21 4.470 4.470 4.574 -0.104 18880
5637 1 13 . 1 1 21 21 MET C C 21 176.030 176.030 175.975 0.055 18880
5638 1 13 . 1 1 21 21 MET CA C 21 55.490 55.490 55.262 0.228 18880
5639 1 13 . 1 1 21 21 MET CB C 21 33.170 33.170 31.668 1.502 18880
5640 1 13 . 1 1 21 21 MET H H 21 8.310 8.310 8.463 -0.153 18880
5641 1 13 . 1 1 22 22 SER N N 22 116.860 116.860 115.106 1.754 18880
5642 1 13 . 1 1 22 22 SER HA H 22 4.430 4.430 4.511 -0.081 18880
5643 1 13 . 1 1 22 22 SER C C 22 174.630 174.630 174.617 0.013 18880
5644 1 13 . 1 1 22 22 SER CA C 22 58.410 58.410 58.935 -0.525 18880
5645 1 13 . 1 1 22 22 SER CB C 22 64.030 64.030 63.540 0.490 18880
5646 1 13 . 1 1 22 22 SER H H 22 8.340 8.340 8.205 0.135 18880
5647 1 13 . 1 1 23 23 ASP N N 23 122.660 122.660 121.308 1.352 18880
5648 1 13 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.632 -0.082 18880
5649 1 13 . 1 1 23 23 ASP C C 23 176.860 176.860 177.303 -0.443 18880
5650 1 13 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.598 -0.268 18880
5651 1 13 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.892 0.108 18880
5652 1 13 . 1 1 23 23 ASP H H 23 8.540 8.540 8.134 0.406 18880
5653 1 13 . 1 1 24 24 GLU N N 24 120.400 120.400 117.507 2.893 18880
5654 1 13 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.091 0.049 18880
5655 1 13 . 1 1 24 24 GLU C C 24 177.540 177.540 177.570 -0.030 18880
5656 1 13 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.411 -0.051 18880
5657 1 13 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.172 0.578 18880
5658 1 13 . 1 1 24 24 GLU H H 24 8.610 8.610 8.259 0.351 18880
5659 1 13 . 1 1 25 25 LYS N N 25 120.390 120.390 118.430 1.960 18880
5660 1 13 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.327 -0.137 18880
5661 1 13 . 1 1 25 25 LYS C C 25 177.490 177.490 178.201 -0.711 18880
5662 1 13 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.948 0.162 18880
5663 1 13 . 1 1 25 25 LYS CB C 25 32.490 32.490 33.029 -0.539 18880
5664 1 13 . 1 1 25 25 LYS H H 25 8.210 8.210 7.617 0.593 18880
5665 1 13 . 1 1 26 26 THR N N 26 114.880 114.880 116.331 -1.451 18880
5666 1 13 . 1 1 26 26 THR HA H 26 4.040 4.040 4.099 -0.059 18880
5667 1 13 . 1 1 26 26 THR C C 26 175.430 175.430 176.784 -1.354 18880
5668 1 13 . 1 1 26 26 THR CA C 26 64.620 64.620 65.784 -1.164 18880
5669 1 13 . 1 1 26 26 THR CB C 26 69.110 69.110 68.571 0.539 18880
5670 1 13 . 1 1 26 26 THR H H 26 8.080 8.080 7.617 0.463 18880
5671 1 13 . 1 1 27 27 GLN N N 27 120.940 120.940 121.561 -0.621 18880
5672 1 13 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.055 0.135 18880
5673 1 13 . 1 1 27 27 GLN C C 27 177.280 177.280 176.886 0.394 18880
5674 1 13 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.499 -0.949 18880
5675 1 13 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.573 0.517 18880
5676 1 13 . 1 1 27 27 GLN H H 27 8.240 8.240 7.818 0.422 18880
5677 1 13 . 1 1 28 28 LEU N N 28 121.860 121.860 117.856 4.004 18880
5678 1 13 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.334 -0.164 18880
5679 1 13 . 1 1 28 28 LEU C C 28 177.750 177.750 178.147 -0.397 18880
5680 1 13 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.614 1.466 18880
5681 1 13 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.474 -0.204 18880
5682 1 13 . 1 1 28 28 LEU H H 28 7.950 7.950 7.505 0.445 18880
5683 1 13 . 1 1 29 29 ILE N N 29 119.260 119.260 119.294 -0.034 18880
5684 1 13 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.820 0.080 18880
5685 1 13 . 1 1 29 29 ILE C C 29 177.140 177.140 177.778 -0.638 18880
5686 1 13 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.550 -0.250 18880
5687 1 13 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.933 1.347 18880
5688 1 13 . 1 1 29 29 ILE H H 29 7.950 7.950 7.911 0.039 18880
5689 1 13 . 1 1 30 30 GLU N N 30 120.500 120.500 119.002 1.498 18880
5690 1 13 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.347 -0.297 18880
5691 1 13 . 1 1 30 30 GLU C C 30 177.560 177.560 176.583 0.977 18880
5692 1 13 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.990 0.100 18880
5693 1 13 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.052 0.538 18880
5694 1 13 . 1 1 30 30 GLU H H 30 8.220 8.220 8.022 0.198 18880
5695 1 13 . 1 1 31 31 ALA N N 31 121.550 121.550 120.594 0.956 18880
5696 1 13 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.432 -0.282 18880
5697 1 13 . 1 1 31 31 ALA C C 31 178.550 178.550 179.145 -0.595 18880
5698 1 13 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.886 -0.087 18880
5699 1 13 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.215 -0.585 18880
5700 1 13 . 1 1 31 31 ALA H H 31 7.890 7.890 7.543 0.347 18880
5701 1 13 . 1 1 32 32 PHE N N 32 117.240 117.240 118.013 -0.773 18880
5702 1 13 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.272 0.028 18880
5703 1 13 . 1 1 32 32 PHE C C 32 176.210 176.210 176.366 -0.156 18880
5704 1 13 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.446 -1.106 18880
5705 1 13 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.730 1.020 18880
5706 1 13 . 1 1 32 32 PHE H H 32 7.930 7.930 7.489 0.441 18880
5707 1 13 . 1 1 33 33 TYR N N 33 119.050 119.050 114.579 4.471 18880
5708 1 13 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.661 -0.331 18880
5709 1 13 . 1 1 33 33 TYR C C 33 175.680 175.680 175.636 0.044 18880
5710 1 13 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.530 1.390 18880
5711 1 13 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.596 0.944 18880
5712 1 13 . 1 1 33 33 TYR H H 33 7.950 7.950 8.197 -0.247 18880
5713 1 13 . 1 1 34 34 ASN N N 34 118.390 118.390 118.517 -0.127 18880
5714 1 13 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.817 -0.187 18880
5715 1 13 . 1 1 34 34 ASN C C 34 174.810 174.810 173.821 0.989 18880
5716 1 13 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.958 -0.808 18880
5717 1 13 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.311 -0.331 18880
5718 1 13 . 1 1 34 34 ASN H H 34 7.960 7.960 8.030 -0.070 18880
5719 1 13 . 1 1 35 35 PHE N N 35 120.670 120.670 119.908 0.762 18880
5720 1 13 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.677 -0.227 18880
5721 1 13 . 1 1 35 35 PHE C C 35 175.310 175.310 174.671 0.639 18880
5722 1 13 . 1 1 35 35 PHE CA C 35 58.320 58.320 57.160 1.159 18880
5723 1 13 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.214 -0.794 18880
5724 1 13 . 1 1 35 35 PHE H H 35 7.830 7.830 8.338 -0.508 18880
5725 1 13 . 1 1 36 36 ASP N N 36 122.400 122.400 121.412 0.988 18880
5726 1 13 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.391 0.199 18880
5727 1 13 . 1 1 36 36 ASP C C 36 176.150 176.150 176.784 -0.634 18880
5728 1 13 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.842 -0.772 18880
5729 1 13 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.352 0.968 18880
5730 1 13 . 1 1 36 36 ASP H H 36 8.180 8.180 8.638 -0.458 18880
5731 1 13 . 1 1 37 37 GLY N N 37 108.560 108.560 104.438 4.122 18880
5732 1 13 . 1 1 37 37 GLY C C 37 173.660 173.660 174.363 -0.703 18880
5733 1 13 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.944 -0.334 18880
5734 1 13 . 1 1 37 37 GLY H H 37 7.680 7.680 8.783 -1.103 18880
5735 1 13 . 1 1 38 38 ASP N N 38 120.010 120.010 116.336 3.674 18880
5736 1 13 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.099 0.501 18880
5737 1 13 . 1 1 38 38 ASP CA C 38 54.260 54.260 55.253 -0.993 18880
5738 1 13 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.052 2.398 18880
5739 1 13 . 1 1 38 38 ASP H H 38 8.220 8.220 8.022 0.198 18880
5740 1 13 . 1 1 39 39 TYR N N 39 121.030 121.030 119.484 1.546 18880
5741 1 13 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.166 0.224 18880
5742 1 13 . 1 1 39 39 TYR C C 39 175.290 175.290 176.294 -1.004 18880
5743 1 13 . 1 1 39 39 TYR CA C 39 58.200 58.200 61.194 -2.994 18880
5744 1 13 . 1 1 39 39 TYR CB C 39 39.170 39.170 39.308 -0.138 18880
5745 1 13 . 1 1 39 39 TYR H H 39 8.090 8.090 7.855 0.235 18880
5746 1 13 . 1 1 40 40 ASP N N 40 122.020 122.020 115.808 6.212 18880
5747 1 13 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.677 -0.077 18880
5748 1 13 . 1 1 40 40 ASP C C 40 175.970 175.970 175.816 0.154 18880
5749 1 13 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.400 0.820 18880
5750 1 13 . 1 1 40 40 ASP CB C 40 41.520 41.520 43.060 -1.540 18880
5751 1 13 . 1 1 40 40 ASP H H 40 8.200 8.200 8.196 0.004 18880
5752 1 13 . 1 1 41 41 GLY N N 41 108.330 108.330 106.469 1.861 18880
5753 1 13 . 1 1 41 41 GLY C C 41 173.000 173.000 172.377 0.623 18880
5754 1 13 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.239 1.181 18880
5755 1 13 . 1 1 41 41 GLY H H 41 7.830 7.830 8.229 -0.399 18880
5756 1 13 . 1 1 42 42 PHE N N 42 118.600 118.600 118.290 0.310 18880
5757 1 13 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.833 0.427 18880
5758 1 13 . 1 1 42 42 PHE C C 42 175.660 175.660 174.072 1.588 18880
5759 1 13 . 1 1 42 42 PHE CA C 42 57.160 57.160 56.770 0.390 18880
5760 1 13 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.199 -1.029 18880
5761 1 13 . 1 1 42 42 PHE H H 42 8.150 8.150 7.283 0.867 18880
5762 1 13 . 1 1 43 43 VAL N N 43 119.180 119.180 124.579 -5.399 18880
5763 1 13 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.409 0.261 18880
5764 1 13 . 1 1 43 43 VAL C C 43 175.110 175.110 174.241 0.869 18880
5765 1 13 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.189 0.431 18880
5766 1 13 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.469 -1.589 18880
5767 1 13 . 1 1 43 43 VAL H H 43 9.070 9.070 8.717 0.353 18880
5768 1 13 . 1 1 44 44 SER N N 44 121.380 121.380 123.576 -2.196 18880
5769 1 13 . 1 1 44 44 SER HA H 44 4.570 4.570 4.092 0.478 18880
5770 1 13 . 1 1 44 44 SER C C 44 175.660 175.660 175.198 0.462 18880
5771 1 13 . 1 1 44 44 SER CA C 44 57.720 57.720 57.386 0.334 18880
5772 1 13 . 1 1 44 44 SER CB C 44 63.690 63.690 62.994 0.696 18880
5773 1 13 . 1 1 44 44 SER H H 44 9.140 9.140 8.561 0.579 18880
5774 1 13 . 1 1 45 45 VAL N N 45 122.720 122.720 122.831 -0.111 18880
5775 1 13 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.298 0.202 18880
5776 1 13 . 1 1 45 45 VAL C C 45 177.240 177.240 177.357 -0.117 18880
5777 1 13 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.764 -0.494 18880
5778 1 13 . 1 1 45 45 VAL CB C 45 31.450 31.450 31.019 0.431 18880
5779 1 13 . 1 1 45 45 VAL H H 45 8.140 8.140 8.486 -0.346 18880
5780 1 13 . 1 1 46 46 GLU N N 46 118.990 118.990 118.749 0.241 18880
5781 1 13 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.836 0.144 18880
5782 1 13 . 1 1 46 46 GLU C C 46 179.460 179.460 179.133 0.327 18880
5783 1 13 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.621 -0.061 18880
5784 1 13 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.861 0.299 18880
5785 1 13 . 1 1 46 46 GLU H H 46 8.230 8.230 7.496 0.734 18880
5786 1 13 . 1 1 47 47 GLU N N 47 120.120 120.120 118.273 1.847 18880
5787 1 13 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.175 -0.095 18880
5788 1 13 . 1 1 47 47 GLU C C 47 179.170 179.170 178.510 0.660 18880
5789 1 13 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.970 0.920 18880
5790 1 13 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.713 0.107 18880
5791 1 13 . 1 1 47 47 GLU H H 47 7.880 7.880 8.001 -0.121 18880
5792 1 13 . 1 1 48 48 PHE N N 48 120.830 120.830 121.402 -0.572 18880
5793 1 13 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.097 0.093 18880
5794 1 13 . 1 1 48 48 PHE C C 48 176.920 176.920 177.477 -0.557 18880
5795 1 13 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.668 0.202 18880
5796 1 13 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.931 0.329 18880
5797 1 13 . 1 1 48 48 PHE H H 48 8.600 8.600 8.080 0.520 18880
5798 1 13 . 1 1 49 49 ARG N N 49 118.470 118.470 119.480 -1.010 18880
5799 1 13 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.099 -0.239 18880
5800 1 13 . 1 1 49 49 ARG C C 49 178.090 178.090 178.789 -0.699 18880
5801 1 13 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.565 -0.495 18880
5802 1 13 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.897 0.243 18880
5803 1 13 . 1 1 49 49 ARG H H 49 8.650 8.650 8.915 -0.265 18880
5804 1 13 . 1 1 50 50 GLY N N 50 105.080 105.080 105.665 -0.585 18880
5805 1 13 . 1 1 50 50 GLY C C 50 175.090 175.090 175.817 -0.727 18880
5806 1 13 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.847 -0.167 18880
5807 1 13 . 1 1 50 50 GLY H H 50 7.620 7.620 8.072 -0.452 18880
5808 1 13 . 1 1 51 51 ILE N N 51 121.440 121.440 121.430 0.010 18880
5809 1 13 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.971 -0.141 18880
5810 1 13 . 1 1 51 51 ILE C C 51 178.300 178.300 177.594 0.706 18880
5811 1 13 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.666 0.174 18880
5812 1 13 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.605 -0.295 18880
5813 1 13 . 1 1 51 51 ILE H H 51 7.470 7.470 7.259 0.211 18880
5814 1 13 . 1 1 52 52 ILE N N 52 118.930 118.930 119.860 -0.930 18880
5815 1 13 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.784 -0.044 18880
5816 1 13 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.120 0.640 18880
5817 1 13 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.571 1.459 18880
5818 1 13 . 1 1 52 52 ILE H H 52 7.790 7.790 8.610 -0.820 18880
5819 1 13 . 1 1 53 53 ARG N N 53 120.140 120.140 120.173 -0.033 18880
5820 1 13 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.007 0.083 18880
5821 1 13 . 1 1 53 53 ARG C C 53 177.380 177.380 176.887 0.493 18880
5822 1 13 . 1 1 53 53 ARG CA C 53 60.110 60.110 58.671 1.439 18880
5823 1 13 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.282 -0.702 18880
5824 1 13 . 1 1 53 53 ARG H H 53 7.930 7.930 8.171 -0.241 18880
5825 1 13 . 1 1 54 54 ASP N N 54 117.500 117.500 115.837 1.663 18880
5826 1 13 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.773 -0.173 18880
5827 1 13 . 1 1 54 54 ASP C C 54 176.930 176.930 176.174 0.756 18880
5828 1 13 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.202 1.338 18880
5829 1 13 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.309 -0.209 18880
5830 1 13 . 1 1 54 54 ASP H H 54 7.870 7.870 8.094 -0.224 18880
5831 1 13 . 1 1 55 55 GLY N N 55 106.370 106.370 108.375 -2.005 18880
5832 1 13 . 1 1 55 55 GLY C C 55 173.460 173.460 173.775 -0.315 18880
5833 1 13 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.540 0.460 18880
5834 1 13 . 1 1 55 55 GLY H H 55 7.880 7.880 7.708 0.172 18880
5835 1 13 . 1 1 56 56 LEU N N 56 122.630 122.630 122.269 0.361 18880
5836 1 13 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.814 -0.044 18880
5837 1 13 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.357 1.133 18880
5838 1 13 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.075 1.045 18880
5839 1 13 . 1 1 56 56 LEU H H 56 8.220 8.220 7.892 0.328 18880
5840 1 13 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.497 0.083 18880
5841 1 13 . 1 1 57 57 PRO C C 57 176.150 176.150 175.509 0.641 18880
5842 1 13 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.804 -0.384 18880
5843 1 13 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.126 0.614 18880
5844 1 13 . 1 1 58 58 MET N N 58 121.810 121.810 122.739 -0.929 18880
5845 1 13 . 1 1 58 58 MET HA H 58 4.630 4.630 4.523 0.107 18880
5846 1 13 . 1 1 58 58 MET C C 58 176.150 176.150 175.330 0.820 18880
5847 1 13 . 1 1 58 58 MET CA C 58 55.560 55.560 54.825 0.735 18880
5848 1 13 . 1 1 58 58 MET CB C 58 36.820 36.820 35.185 1.635 18880
5849 1 13 . 1 1 58 58 MET H H 58 7.690 7.690 7.903 -0.213 18880
5850 1 13 . 1 1 59 59 THR N N 59 114.180 114.180 115.798 -1.618 18880
5851 1 13 . 1 1 59 59 THR HA H 59 4.450 4.450 4.419 0.031 18880
5852 1 13 . 1 1 59 59 THR C C 59 175.170 175.170 175.746 -0.576 18880
5853 1 13 . 1 1 59 59 THR CA C 59 60.780 60.780 60.136 0.643 18880
5854 1 13 . 1 1 59 59 THR CB C 59 71.060 71.060 69.633 1.427 18880
5855 1 13 . 1 1 59 59 THR H H 59 8.940 8.940 8.247 0.693 18880
5856 1 13 . 1 1 60 60 GLU N N 60 120.620 120.620 125.094 -4.474 18880
5857 1 13 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.703 0.307 18880
5858 1 13 . 1 1 60 60 GLU C C 60 179.010 179.010 177.979 1.031 18880
5859 1 13 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.943 -0.123 18880
5860 1 13 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.412 0.638 18880
5861 1 13 . 1 1 60 60 GLU H H 60 8.850 8.850 8.946 -0.096 18880
5862 1 13 . 1 1 61 61 ALA N N 61 121.080 121.080 122.334 -1.254 18880
5863 1 13 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.975 0.165 18880
5864 1 13 . 1 1 61 61 ALA C C 61 180.350 180.350 180.114 0.236 18880
5865 1 13 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.264 -0.174 18880
5866 1 13 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.901 0.309 18880
5867 1 13 . 1 1 61 61 ALA H H 61 8.370 8.370 8.405 -0.035 18880
5868 1 13 . 1 1 62 62 GLU N N 62 118.890 118.890 118.981 -0.091 18880
5869 1 13 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.527 0.473 18880
5870 1 13 . 1 1 62 62 GLU C C 62 179.690 179.690 178.652 1.038 18880
5871 1 13 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.284 0.706 18880
5872 1 13 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.371 1.939 18880
5873 1 13 . 1 1 62 62 GLU H H 62 7.680 7.680 7.684 -0.004 18880
5874 1 13 . 1 1 63 63 ILE N N 63 122.340 122.340 119.880 2.460 18880
5875 1 13 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.228 0.342 18880
5876 1 13 . 1 1 63 63 ILE C C 63 177.260 177.260 178.224 -0.964 18880
5877 1 13 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.664 1.226 18880
5878 1 13 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.893 1.087 18880
5879 1 13 . 1 1 63 63 ILE H H 63 8.420 8.420 7.598 0.822 18880
5880 1 13 . 1 1 64 64 THR N N 64 116.970 116.970 115.564 1.406 18880
5881 1 13 . 1 1 64 64 THR HA H 64 3.940 3.940 3.873 0.067 18880
5882 1 13 . 1 1 64 64 THR C C 64 176.520 176.520 176.759 -0.239 18880
5883 1 13 . 1 1 64 64 THR CA C 64 67.060 67.060 67.281 -0.221 18880
5884 1 13 . 1 1 64 64 THR CB C 64 68.750 68.750 68.333 0.417 18880
5885 1 13 . 1 1 64 64 THR H H 64 8.310 8.310 8.393 -0.083 18880
5886 1 13 . 1 1 65 65 GLU N N 65 120.760 120.760 119.986 0.774 18880
5887 1 13 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.181 -0.151 18880
5888 1 13 . 1 1 65 65 GLU C C 65 175.830 175.830 178.793 -2.963 18880
5889 1 13 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.903 0.597 18880
5890 1 13 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.633 0.137 18880
5891 1 13 . 1 1 65 65 GLU H H 65 7.970 7.970 8.497 -0.527 18880
5892 1 13 . 1 1 66 66 PHE N N 66 120.940 120.940 118.088 2.852 18880
5893 1 13 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.475 -0.235 18880
5894 1 13 . 1 1 66 66 PHE C C 66 177.330 177.330 177.498 -0.168 18880
5895 1 13 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.831 2.369 18880
5896 1 13 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.252 -0.722 18880
5897 1 13 . 1 1 66 66 PHE H H 66 8.100 8.100 7.765 0.335 18880
5898 1 13 . 1 1 67 67 PHE N N 67 118.110 118.110 119.338 -1.228 18880
5899 1 13 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.460 -0.510 18880
5900 1 13 . 1 1 67 67 PHE C C 67 178.090 178.090 178.063 0.027 18880
5901 1 13 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.045 2.155 18880
5902 1 13 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.503 -0.253 18880
5903 1 13 . 1 1 67 67 PHE H H 67 8.380 8.380 8.770 -0.390 18880
5904 1 13 . 1 1 68 68 GLU N N 68 119.650 119.650 118.302 1.348 18880
5905 1 13 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.631 -0.621 18880
5906 1 13 . 1 1 68 68 GLU C C 68 177.910 177.910 177.147 0.763 18880
5907 1 13 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.688 1.552 18880
5908 1 13 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.749 -0.379 18880
5909 1 13 . 1 1 68 68 GLU H H 68 8.230 8.230 8.250 -0.020 18880
5910 1 13 . 1 1 69 69 ALA N N 69 119.090 119.090 120.149 -1.059 18880
5911 1 13 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.469 -0.289 18880
5912 1 13 . 1 1 69 69 ALA C C 69 179.030 179.030 178.332 0.698 18880
5913 1 13 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.390 0.210 18880
5914 1 13 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.749 0.031 18880
5915 1 13 . 1 1 69 69 ALA H H 69 7.340 7.340 7.730 -0.390 18880
5916 1 13 . 1 1 70 70 ALA N N 70 118.670 118.670 120.185 -1.515 18880
5917 1 13 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.372 -0.352 18880
5918 1 13 . 1 1 70 70 ALA C C 70 176.820 176.820 176.791 0.029 18880
5919 1 13 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.684 0.406 18880
5920 1 13 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.403 -0.793 18880
5921 1 13 . 1 1 70 70 ALA H H 70 8.050 8.050 7.808 0.242 18880
5922 1 13 . 1 1 71 71 ASP N N 71 116.780 116.780 117.324 -0.544 18880
5923 1 13 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.142 0.078 18880
5924 1 13 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.485 1.665 18880
5925 1 13 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.808 -1.898 18880
5926 1 13 . 1 1 71 71 ASP H H 71 8.010 8.010 7.619 0.391 18880
5927 1 13 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.393 0.077 18880
5928 1 13 . 1 1 72 72 PRO C C 72 177.970 177.970 177.375 0.595 18880
5929 1 13 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.535 0.375 18880
5930 1 13 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.445 -0.565 18880
5931 1 13 . 1 1 73 73 ASN N N 73 114.930 114.930 116.837 -1.907 18880
5932 1 13 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.594 0.286 18880
5933 1 13 . 1 1 73 73 ASN C C 73 174.880 174.880 174.907 -0.027 18880
5934 1 13 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.622 -0.782 18880
5935 1 13 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.750 -0.370 18880
5936 1 13 . 1 1 73 73 ASN H H 73 9.030 9.030 8.678 0.352 18880
5937 1 13 . 1 1 74 74 ASN N N 74 118.340 118.340 112.819 5.521 18880
5938 1 13 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.597 -0.237 18880
5939 1 13 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.011 0.579 18880
5940 1 13 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.121 1.039 18880
5941 1 13 . 1 1 74 74 ASN H H 74 8.320 8.320 8.526 -0.206 18880
5942 1 13 . 1 1 75 75 THR N N 75 113.450 113.450 110.845 2.605 18880
5943 1 13 . 1 1 75 75 THR HA H 75 4.210 4.210 4.469 -0.259 18880
5944 1 13 . 1 1 75 75 THR CA C 75 63.410 63.410 61.115 2.295 18880
5945 1 13 . 1 1 75 75 THR CB C 75 70.540 70.540 68.614 1.926 18880
5946 1 13 . 1 1 75 75 THR H H 75 9.870 9.870 8.956 0.914 18880
5947 1 13 . 1 1 76 76 GLY N N 76 111.810 111.810 108.786 3.024 18880
5948 1 13 . 1 1 76 76 GLY C C 76 173.670 173.670 173.739 -0.069 18880
5949 1 13 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.545 -0.425 18880
5950 1 13 . 1 1 76 76 GLY H H 76 10.250 10.250 8.609 1.641 18880
5951 1 13 . 1 1 77 77 PHE N N 77 120.560 120.560 118.541 2.019 18880
5952 1 13 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.903 0.247 18880
5953 1 13 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.218 -0.038 18880
5954 1 13 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.287 1.213 18880
5955 1 13 . 1 1 77 77 PHE H H 77 8.110 8.110 7.687 0.423 18880
5956 1 13 . 1 1 78 78 ILE N N 78 116.410 116.410 122.775 -6.365 18880
5957 1 13 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.320 0.070 18880
5958 1 13 . 1 1 78 78 ILE C C 78 174.770 174.770 174.799 -0.029 18880
5959 1 13 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.894 -0.704 18880
5960 1 13 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.605 0.575 18880
5961 1 13 . 1 1 78 78 ILE H H 78 8.930 8.930 7.966 0.964 18880
5962 1 13 . 1 1 79 79 ASP N N 79 125.220 125.220 125.924 -0.704 18880
5963 1 13 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.165 -0.665 18880
5964 1 13 . 1 1 79 79 ASP C C 79 176.490 176.490 176.738 -0.248 18880
5965 1 13 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.229 0.081 18880
5966 1 13 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.431 0.938 18880
5967 1 13 . 1 1 79 79 ASP H H 79 8.610 8.610 8.847 -0.237 18880
5968 1 13 . 1 1 80 80 TYR N N 80 125.760 125.760 127.902 -2.142 18880
5969 1 13 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.045 -0.055 18880
5970 1 13 . 1 1 80 80 TYR C C 80 177.140 177.140 176.684 0.456 18880
5971 1 13 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.866 -1.286 18880
5972 1 13 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.699 0.191 18880
5973 1 13 . 1 1 80 80 TYR H H 80 8.460 8.460 8.594 -0.134 18880
5974 1 13 . 1 1 81 81 LYS N N 81 118.320 118.320 118.413 -0.093 18880
5975 1 13 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.931 -0.031 18880
5976 1 13 . 1 1 81 81 LYS C C 81 179.090 179.090 178.504 0.586 18880
5977 1 13 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.646 -0.066 18880
5978 1 13 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.806 -0.046 18880
5979 1 13 . 1 1 81 81 LYS H H 81 8.410 8.410 8.431 -0.021 18880
5980 1 13 . 1 1 82 82 ALA N N 82 122.050 122.050 121.181 0.869 18880
5981 1 13 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.137 -0.007 18880
5982 1 13 . 1 1 82 82 ALA C C 82 179.740 179.740 179.199 0.541 18880
5983 1 13 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.759 -0.239 18880
5984 1 13 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.396 0.144 18880
5985 1 13 . 1 1 82 82 ALA H H 82 7.770 7.770 8.081 -0.311 18880
5986 1 13 . 1 1 83 83 PHE N N 83 117.810 117.810 116.752 1.058 18880
5987 1 13 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.487 -0.197 18880
5988 1 13 . 1 1 83 83 PHE C C 83 176.460 176.460 176.767 -0.307 18880
5989 1 13 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.490 0.540 18880
5990 1 13 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.162 -0.642 18880
5991 1 13 . 1 1 83 83 PHE H H 83 7.780 7.780 7.958 -0.178 18880
5992 1 13 . 1 1 84 84 ALA N N 84 121.530 121.530 121.430 0.100 18880
5993 1 13 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.197 -0.537 18880
5994 1 13 . 1 1 84 84 ALA C C 84 179.010 179.010 179.225 -0.215 18880
5995 1 13 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.794 1.236 18880
5996 1 13 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.216 -0.087 18880
5997 1 13 . 1 1 84 84 ALA H H 84 8.290 8.290 8.177 0.113 18880
5998 1 13 . 1 1 85 85 ALA N N 85 117.720 117.720 121.016 -3.296 18880
5999 1 13 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.197 -0.117 18880
6000 1 13 . 1 1 85 85 ALA C C 85 179.570 179.570 178.964 0.606 18880
6001 1 13 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.548 -0.178 18880
6002 1 13 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.204 0.086 18880
6003 1 13 . 1 1 85 85 ALA H H 85 7.700 7.700 8.686 -0.986 18880
6004 1 13 . 1 1 86 86 MET N N 86 116.570 116.570 116.990 -0.420 18880
6005 1 13 . 1 1 86 86 MET HA H 86 4.160 4.160 4.122 0.038 18880
6006 1 13 . 1 1 86 86 MET C C 86 177.360 177.360 177.969 -0.609 18880
6007 1 13 . 1 1 86 86 MET CA C 86 57.380 57.380 58.975 -1.595 18880
6008 1 13 . 1 1 86 86 MET CB C 86 32.720 32.720 32.354 0.366 18880
6009 1 13 . 1 1 86 86 MET H H 86 7.560 7.560 7.594 -0.034 18880
6010 1 13 . 1 1 87 87 LEU N N 87 119.090 119.090 116.600 2.490 18880
6011 1 13 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.317 -0.347 18880
6012 1 13 . 1 1 87 87 LEU C C 87 177.420 177.420 177.078 0.342 18880
6013 1 13 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.596 0.694 18880
6014 1 13 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.288 -0.008 18880
6015 1 13 . 1 1 87 87 LEU H H 87 7.570 7.570 7.639 -0.069 18880
6016 1 13 . 1 1 88 88 TYR N N 88 117.060 117.060 115.202 1.858 18880
6017 1 13 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.710 -0.120 18880
6018 1 13 . 1 1 88 88 TYR C C 88 175.870 175.870 175.071 0.799 18880
6019 1 13 . 1 1 88 88 TYR CA C 88 57.840 57.840 56.094 1.746 18880
6020 1 13 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.562 0.078 18880
6021 1 13 . 1 1 88 88 TYR H H 88 7.740 7.740 7.411 0.329 18880
6022 1 13 . 1 1 89 89 SER N N 89 115.980 115.980 118.848 -2.868 18880
6023 1 13 . 1 1 89 89 SER HA H 89 4.440 4.440 4.536 -0.096 18880
6024 1 13 . 1 1 89 89 SER C C 89 174.460 174.460 174.440 0.020 18880
6025 1 13 . 1 1 89 89 SER CA C 89 58.350 58.350 58.259 0.091 18880
6026 1 13 . 1 1 89 89 SER CB C 89 63.990 63.990 62.243 1.747 18880
6027 1 13 . 1 1 89 89 SER H H 89 7.880 7.880 7.933 -0.053 18880
6028 1 13 . 1 1 90 90 VAL N N 90 120.910 120.910 118.294 2.616 18880
6029 1 13 . 1 1 90 90 VAL HA H 90 4.140 4.140 3.668 0.472 18880
6030 1 13 . 1 1 90 90 VAL C C 90 175.720 175.720 174.375 1.345 18880
6031 1 13 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.967 -0.697 18880
6032 1 13 . 1 1 90 90 VAL CB C 90 32.840 32.840 30.451 2.389 18880
6033 1 13 . 1 1 90 90 VAL H H 90 8.020 8.020 7.865 0.155 18880
6034 1 13 . 1 1 91 91 ASP N N 91 123.620 123.620 119.509 4.111 18880
6035 1 13 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.491 0.139 18880
6036 1 13 . 1 1 91 91 ASP C C 91 176.000 176.000 176.218 -0.218 18880
6037 1 13 . 1 1 91 91 ASP CA C 91 54.510 54.510 55.144 -0.634 18880
6038 1 13 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.885 -0.445 18880
6039 1 13 . 1 1 91 91 ASP H H 91 8.310 8.310 7.828 0.482 18880
6040 1 13 . 1 1 92 92 GLU N N 92 122.170 122.170 120.770 1.400 18880
6041 1 13 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.248 0.112 18880
6042 1 13 . 1 1 92 92 GLU C C 92 175.660 175.660 176.265 -0.605 18880
6043 1 13 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.581 -0.091 18880
6044 1 13 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.715 3.135 18880
6045 1 13 . 1 1 92 92 GLU H H 92 8.320 8.320 8.683 -0.363 18880
6046 1 14 . 1 1 10 10 HIS C C 10 176.040 176.040 174.180 1.860 18880
6047 1 14 . 1 1 11 11 SER N N 11 116.840 116.840 117.475 -0.635 18880
6048 1 14 . 1 1 11 11 SER HA H 11 4.430 4.430 4.580 -0.150 18880
6049 1 14 . 1 1 11 11 SER C C 11 174.630 174.630 173.265 1.365 18880
6050 1 14 . 1 1 11 11 SER CA C 11 58.350 58.350 57.737 0.613 18880
6051 1 14 . 1 1 11 11 SER CB C 11 64.120 64.120 64.675 -0.555 18880
6052 1 14 . 1 1 11 11 SER H H 11 8.360 8.360 8.566 -0.206 18880
6053 1 14 . 1 1 12 12 SER N N 12 118.030 118.030 116.433 1.597 18880
6054 1 14 . 1 1 12 12 SER HA H 12 4.440 4.440 4.674 -0.234 18880
6055 1 14 . 1 1 12 12 SER C C 12 174.880 174.880 175.177 -0.297 18880
6056 1 14 . 1 1 12 12 SER CA C 12 58.680 58.680 58.321 0.360 18880
6057 1 14 . 1 1 12 12 SER CB C 12 63.890 63.890 64.409 -0.519 18880
6058 1 14 . 1 1 12 12 SER H H 12 8.490 8.490 8.443 0.047 18880
6059 1 14 . 1 1 13 13 GLY N N 13 110.450 110.450 112.741 -2.291 18880
6060 1 14 . 1 1 13 13 GLY C C 13 173.790 173.790 173.883 -0.093 18880
6061 1 14 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.763 0.697 18880
6062 1 14 . 1 1 13 13 GLY H H 13 8.390 8.390 8.594 -0.204 18880
6063 1 14 . 1 1 14 14 LEU N N 14 121.310 121.310 123.041 -1.731 18880
6064 1 14 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.494 -0.154 18880
6065 1 14 . 1 1 14 14 LEU C C 14 176.930 176.930 176.498 0.432 18880
6066 1 14 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.319 -0.119 18880
6067 1 14 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.811 -0.211 18880
6068 1 14 . 1 1 14 14 LEU H H 14 8.020 8.020 7.830 0.190 18880
6069 1 14 . 1 1 15 15 VAL N N 15 121.550 121.550 127.127 -5.577 18880
6070 1 14 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.431 -0.061 18880
6071 1 14 . 1 1 15 15 VAL CA C 15 59.720 59.720 59.261 0.459 18880
6072 1 14 . 1 1 15 15 VAL CB C 15 32.770 32.770 33.290 -0.520 18880
6073 1 14 . 1 1 15 15 VAL H H 15 8.030 8.030 8.313 -0.283 18880
6074 1 14 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.511 -0.141 18880
6075 1 14 . 1 1 16 16 PRO C C 16 176.720 176.720 176.353 0.367 18880
6076 1 14 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.283 -0.633 18880
6077 1 14 . 1 1 16 16 PRO CB C 16 32.240 32.240 31.731 0.509 18880
6078 1 14 . 1 1 17 17 ARG N N 17 121.890 121.890 124.625 -2.735 18880
6079 1 14 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.555 -0.275 18880
6080 1 14 . 1 1 17 17 ARG C C 17 176.940 176.940 176.699 0.241 18880
6081 1 14 . 1 1 17 17 ARG CA C 17 56.360 56.360 55.540 0.820 18880
6082 1 14 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.846 0.204 18880
6083 1 14 . 1 1 17 17 ARG H H 17 8.450 8.450 8.407 0.043 18880
6084 1 14 . 1 1 18 18 GLY N N 18 110.160 110.160 111.481 -1.321 18880
6085 1 14 . 1 1 18 18 GLY C C 18 174.110 174.110 174.205 -0.095 18880
6086 1 14 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.429 0.961 18880
6087 1 14 . 1 1 18 18 GLY H H 18 8.480 8.480 8.646 -0.166 18880
6088 1 14 . 1 1 19 19 SER N N 19 115.500 115.500 114.875 0.625 18880
6089 1 14 . 1 1 19 19 SER HA H 19 4.400 4.400 3.939 0.461 18880
6090 1 14 . 1 1 19 19 SER C C 19 174.380 174.380 173.809 0.571 18880
6091 1 14 . 1 1 19 19 SER CA C 19 58.610 58.610 58.311 0.299 18880
6092 1 14 . 1 1 19 19 SER CB C 19 63.830 63.830 62.945 0.885 18880
6093 1 14 . 1 1 19 19 SER H H 19 8.210 8.210 8.210 -0.000 18880
6094 1 14 . 1 1 20 20 HIS N N 20 120.770 120.770 121.004 -0.234 18880
6095 1 14 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.629 -0.019 18880
6096 1 14 . 1 1 20 20 HIS C C 20 174.870 174.870 175.564 -0.694 18880
6097 1 14 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.599 0.531 18880
6098 1 14 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.235 -0.526 18880
6099 1 14 . 1 1 20 20 HIS H H 20 8.590 8.590 7.840 0.750 18880
6100 1 14 . 1 1 21 21 MET N N 21 121.440 121.440 118.715 2.725 18880
6101 1 14 . 1 1 21 21 MET HA H 21 4.470 4.470 4.319 0.151 18880
6102 1 14 . 1 1 21 21 MET C C 21 176.030 176.030 176.696 -0.666 18880
6103 1 14 . 1 1 21 21 MET CA C 21 55.490 55.490 56.037 -0.547 18880
6104 1 14 . 1 1 21 21 MET CB C 21 33.170 33.170 30.835 2.335 18880
6105 1 14 . 1 1 21 21 MET H H 21 8.310 8.310 8.373 -0.063 18880
6106 1 14 . 1 1 22 22 SER N N 22 116.860 116.860 113.803 3.057 18880
6107 1 14 . 1 1 22 22 SER HA H 22 4.430 4.430 4.540 -0.110 18880
6108 1 14 . 1 1 22 22 SER C C 22 174.630 174.630 175.337 -0.707 18880
6109 1 14 . 1 1 22 22 SER CA C 22 58.410 58.410 59.208 -0.798 18880
6110 1 14 . 1 1 22 22 SER CB C 22 64.030 64.030 64.089 -0.059 18880
6111 1 14 . 1 1 22 22 SER H H 22 8.340 8.340 8.116 0.224 18880
6112 1 14 . 1 1 23 23 ASP N N 23 122.660 122.660 123.653 -0.993 18880
6113 1 14 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.487 0.063 18880
6114 1 14 . 1 1 23 23 ASP C C 23 176.860 176.860 177.443 -0.583 18880
6115 1 14 . 1 1 23 23 ASP CA C 23 55.330 55.330 56.955 -1.625 18880
6116 1 14 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.374 0.626 18880
6117 1 14 . 1 1 23 23 ASP H H 23 8.540 8.540 8.520 0.020 18880
6118 1 14 . 1 1 24 24 GLU N N 24 120.400 120.400 118.730 1.670 18880
6119 1 14 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.101 0.039 18880
6120 1 14 . 1 1 24 24 GLU C C 24 177.540 177.540 177.336 0.204 18880
6121 1 14 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.318 0.042 18880
6122 1 14 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.586 0.164 18880
6123 1 14 . 1 1 24 24 GLU H H 24 8.610 8.610 8.064 0.546 18880
6124 1 14 . 1 1 25 25 LYS N N 25 120.390 120.390 118.471 1.919 18880
6125 1 14 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.270 -0.080 18880
6126 1 14 . 1 1 25 25 LYS C C 25 177.490 177.490 178.278 -0.788 18880
6127 1 14 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.630 -0.520 18880
6128 1 14 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.840 -0.350 18880
6129 1 14 . 1 1 25 25 LYS H H 25 8.210 8.210 7.573 0.637 18880
6130 1 14 . 1 1 26 26 THR N N 26 114.880 114.880 115.528 -0.648 18880
6131 1 14 . 1 1 26 26 THR HA H 26 4.040 4.040 4.016 0.024 18880
6132 1 14 . 1 1 26 26 THR C C 26 175.430 175.430 177.052 -1.622 18880
6133 1 14 . 1 1 26 26 THR CA C 26 64.620 64.620 65.873 -1.253 18880
6134 1 14 . 1 1 26 26 THR CB C 26 69.110 69.110 68.316 0.794 18880
6135 1 14 . 1 1 26 26 THR H H 26 8.080 8.080 7.432 0.648 18880
6136 1 14 . 1 1 27 27 GLN N N 27 120.940 120.940 121.056 -0.116 18880
6137 1 14 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.104 0.086 18880
6138 1 14 . 1 1 27 27 GLN C C 27 177.280 177.280 177.708 -0.428 18880
6139 1 14 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.329 -0.779 18880
6140 1 14 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.256 0.834 18880
6141 1 14 . 1 1 27 27 GLN H H 27 8.240 8.240 7.970 0.270 18880
6142 1 14 . 1 1 28 28 LEU N N 28 121.860 121.860 119.959 1.901 18880
6143 1 14 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.403 -0.233 18880
6144 1 14 . 1 1 28 28 LEU C C 28 177.750 177.750 177.395 0.355 18880
6145 1 14 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.787 1.293 18880
6146 1 14 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.321 -0.051 18880
6147 1 14 . 1 1 28 28 LEU H H 28 7.950 7.950 8.275 -0.325 18880
6148 1 14 . 1 1 29 29 ILE N N 29 119.260 119.260 118.795 0.465 18880
6149 1 14 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.989 -0.089 18880
6150 1 14 . 1 1 29 29 ILE C C 29 177.140 177.140 177.607 -0.467 18880
6151 1 14 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.093 0.207 18880
6152 1 14 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.863 1.417 18880
6153 1 14 . 1 1 29 29 ILE H H 29 7.950 7.950 7.921 0.029 18880
6154 1 14 . 1 1 30 30 GLU N N 30 120.500 120.500 119.721 0.779 18880
6155 1 14 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.308 -0.258 18880
6156 1 14 . 1 1 30 30 GLU C C 30 177.560 177.560 176.809 0.751 18880
6157 1 14 . 1 1 30 30 GLU CA C 30 58.090 58.090 58.309 -0.219 18880
6158 1 14 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.880 0.710 18880
6159 1 14 . 1 1 30 30 GLU H H 30 8.220 8.220 8.097 0.123 18880
6160 1 14 . 1 1 31 31 ALA N N 31 121.550 121.550 121.755 -0.205 18880
6161 1 14 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.372 -0.222 18880
6162 1 14 . 1 1 31 31 ALA C C 31 178.550 178.550 178.420 0.130 18880
6163 1 14 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.760 0.040 18880
6164 1 14 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.224 -0.594 18880
6165 1 14 . 1 1 31 31 ALA H H 31 7.890 7.890 8.018 -0.128 18880
6166 1 14 . 1 1 32 32 PHE N N 32 117.240 117.240 119.776 -2.536 18880
6167 1 14 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.279 0.021 18880
6168 1 14 . 1 1 32 32 PHE C C 32 176.210 176.210 176.748 -0.538 18880
6169 1 14 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.503 -1.163 18880
6170 1 14 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.398 0.352 18880
6171 1 14 . 1 1 32 32 PHE H H 32 7.930 7.930 7.814 0.116 18880
6172 1 14 . 1 1 33 33 TYR N N 33 119.050 119.050 116.189 2.861 18880
6173 1 14 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.666 -0.336 18880
6174 1 14 . 1 1 33 33 TYR C C 33 175.680 175.680 175.335 0.345 18880
6175 1 14 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.557 0.363 18880
6176 1 14 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.578 0.963 18880
6177 1 14 . 1 1 33 33 TYR H H 33 7.950 7.950 8.600 -0.650 18880
6178 1 14 . 1 1 34 34 ASN N N 34 118.390 118.390 118.702 -0.312 18880
6179 1 14 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.885 -0.255 18880
6180 1 14 . 1 1 34 34 ASN C C 34 174.810 174.810 173.723 1.087 18880
6181 1 14 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.780 -0.630 18880
6182 1 14 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.739 -0.759 18880
6183 1 14 . 1 1 34 34 ASN H H 34 7.960 7.960 8.010 -0.050 18880
6184 1 14 . 1 1 35 35 PHE N N 35 120.670 120.670 119.000 1.670 18880
6185 1 14 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.638 -0.188 18880
6186 1 14 . 1 1 35 35 PHE C C 35 175.310 175.310 173.182 2.128 18880
6187 1 14 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.231 0.089 18880
6188 1 14 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.024 -0.604 18880
6189 1 14 . 1 1 35 35 PHE H H 35 7.830 7.830 7.995 -0.165 18880
6190 1 14 . 1 1 36 36 ASP N N 36 122.400 122.400 119.584 2.816 18880
6191 1 14 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.649 -0.059 18880
6192 1 14 . 1 1 36 36 ASP C C 36 176.150 176.150 176.061 0.089 18880
6193 1 14 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.191 -0.121 18880
6194 1 14 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.131 0.189 18880
6195 1 14 . 1 1 36 36 ASP H H 36 8.180 8.180 8.098 0.082 18880
6196 1 14 . 1 1 37 37 GLY N N 37 108.560 108.560 108.006 0.554 18880
6197 1 14 . 1 1 37 37 GLY C C 37 173.660 173.660 174.715 -1.055 18880
6198 1 14 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.784 -0.174 18880
6199 1 14 . 1 1 37 37 GLY H H 37 7.680 7.680 8.645 -0.965 18880
6200 1 14 . 1 1 38 38 ASP N N 38 120.010 120.010 120.059 -0.049 18880
6201 1 14 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.766 -0.166 18880
6202 1 14 . 1 1 38 38 ASP CA C 38 54.260 54.260 53.526 0.733 18880
6203 1 14 . 1 1 38 38 ASP CB C 38 41.450 41.450 41.273 0.177 18880
6204 1 14 . 1 1 38 38 ASP H H 38 8.220 8.220 8.230 -0.010 18880
6205 1 14 . 1 1 39 39 TYR N N 39 121.030 121.030 117.421 3.609 18880
6206 1 14 . 1 1 39 39 TYR HA H 39 4.390 4.390 3.993 0.397 18880
6207 1 14 . 1 1 39 39 TYR C C 39 175.290 175.290 174.649 0.641 18880
6208 1 14 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.256 -0.056 18880
6209 1 14 . 1 1 39 39 TYR CB C 39 39.170 39.170 38.046 1.124 18880
6210 1 14 . 1 1 39 39 TYR H H 39 8.090 8.090 7.985 0.105 18880
6211 1 14 . 1 1 40 40 ASP N N 40 122.020 122.020 122.306 -0.286 18880
6212 1 14 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.578 0.022 18880
6213 1 14 . 1 1 40 40 ASP C C 40 175.970 175.970 175.014 0.956 18880
6214 1 14 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.650 0.570 18880
6215 1 14 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.628 -0.108 18880
6216 1 14 . 1 1 40 40 ASP H H 40 8.200 8.200 8.290 -0.090 18880
6217 1 14 . 1 1 41 41 GLY N N 41 108.330 108.330 107.017 1.313 18880
6218 1 14 . 1 1 41 41 GLY C C 41 173.000 173.000 171.909 1.091 18880
6219 1 14 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.057 1.363 18880
6220 1 14 . 1 1 41 41 GLY H H 41 7.830 7.830 8.154 -0.324 18880
6221 1 14 . 1 1 42 42 PHE N N 42 118.600 118.600 118.108 0.492 18880
6222 1 14 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.866 0.394 18880
6223 1 14 . 1 1 42 42 PHE C C 42 175.660 175.660 173.821 1.839 18880
6224 1 14 . 1 1 42 42 PHE CA C 42 57.160 57.160 56.488 0.672 18880
6225 1 14 . 1 1 42 42 PHE CB C 42 41.170 41.170 41.590 -0.420 18880
6226 1 14 . 1 1 42 42 PHE H H 42 8.150 8.150 7.244 0.906 18880
6227 1 14 . 1 1 43 43 VAL N N 43 119.180 119.180 123.435 -4.255 18880
6228 1 14 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.715 -0.045 18880
6229 1 14 . 1 1 43 43 VAL C C 43 175.110 175.110 173.925 1.185 18880
6230 1 14 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.786 0.834 18880
6231 1 14 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.755 -2.875 18880
6232 1 14 . 1 1 43 43 VAL H H 43 9.070 9.070 9.109 -0.039 18880
6233 1 14 . 1 1 44 44 SER N N 44 121.380 121.380 119.533 1.847 18880
6234 1 14 . 1 1 44 44 SER HA H 44 4.570 4.570 4.835 -0.265 18880
6235 1 14 . 1 1 44 44 SER C C 44 175.660 175.660 175.457 0.203 18880
6236 1 14 . 1 1 44 44 SER CA C 44 57.720 57.720 56.717 1.003 18880
6237 1 14 . 1 1 44 44 SER CB C 44 63.690 63.690 65.691 -2.001 18880
6238 1 14 . 1 1 44 44 SER H H 44 9.140 9.140 8.379 0.761 18880
6239 1 14 . 1 1 45 45 VAL N N 45 122.720 122.720 123.838 -1.118 18880
6240 1 14 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.211 0.289 18880
6241 1 14 . 1 1 45 45 VAL C C 45 177.240 177.240 177.257 -0.017 18880
6242 1 14 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.657 -0.388 18880
6243 1 14 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.867 0.583 18880
6244 1 14 . 1 1 45 45 VAL H H 45 8.140 8.140 8.583 -0.443 18880
6245 1 14 . 1 1 46 46 GLU N N 46 118.990 118.990 117.534 1.456 18880
6246 1 14 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.795 0.185 18880
6247 1 14 . 1 1 46 46 GLU C C 46 179.460 179.460 178.989 0.471 18880
6248 1 14 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.311 0.249 18880
6249 1 14 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.873 0.287 18880
6250 1 14 . 1 1 46 46 GLU H H 46 8.230 8.230 7.450 0.780 18880
6251 1 14 . 1 1 47 47 GLU N N 47 120.120 120.120 117.599 2.521 18880
6252 1 14 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.331 -0.251 18880
6253 1 14 . 1 1 47 47 GLU C C 47 179.170 179.170 178.679 0.491 18880
6254 1 14 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.327 1.563 18880
6255 1 14 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.810 0.010 18880
6256 1 14 . 1 1 47 47 GLU H H 47 7.880 7.880 7.370 0.510 18880
6257 1 14 . 1 1 48 48 PHE N N 48 120.830 120.830 122.235 -1.405 18880
6258 1 14 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.190 -0.000 18880
6259 1 14 . 1 1 48 48 PHE C C 48 176.920 176.920 177.478 -0.558 18880
6260 1 14 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.203 0.667 18880
6261 1 14 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.078 0.182 18880
6262 1 14 . 1 1 48 48 PHE H H 48 8.600 8.600 8.645 -0.045 18880
6263 1 14 . 1 1 49 49 ARG N N 49 118.470 118.470 118.890 -0.420 18880
6264 1 14 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.120 -0.260 18880
6265 1 14 . 1 1 49 49 ARG C C 49 178.090 178.090 178.576 -0.486 18880
6266 1 14 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.324 -0.254 18880
6267 1 14 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.922 0.218 18880
6268 1 14 . 1 1 49 49 ARG H H 49 8.650 8.650 8.823 -0.173 18880
6269 1 14 . 1 1 50 50 GLY N N 50 105.080 105.080 105.974 -0.894 18880
6270 1 14 . 1 1 50 50 GLY C C 50 175.090 175.090 176.339 -1.249 18880
6271 1 14 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.910 -0.230 18880
6272 1 14 . 1 1 50 50 GLY H H 50 7.620 7.620 8.652 -1.032 18880
6273 1 14 . 1 1 51 51 ILE N N 51 121.440 121.440 120.319 1.121 18880
6274 1 14 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.949 -0.119 18880
6275 1 14 . 1 1 51 51 ILE C C 51 178.300 178.300 176.686 1.614 18880
6276 1 14 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.639 0.201 18880
6277 1 14 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.188 0.122 18880
6278 1 14 . 1 1 51 51 ILE H H 51 7.470 7.470 7.235 0.235 18880
6279 1 14 . 1 1 52 52 ILE N N 52 118.930 118.930 120.185 -1.255 18880
6280 1 14 . 1 1 52 52 ILE HA H 52 3.740 3.740 4.025 -0.285 18880
6281 1 14 . 1 1 52 52 ILE CA C 52 63.760 63.760 62.930 0.830 18880
6282 1 14 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.092 0.938 18880
6283 1 14 . 1 1 52 52 ILE H H 52 7.790 7.790 7.764 0.026 18880
6284 1 14 . 1 1 53 53 ARG N N 53 120.140 120.140 119.464 0.676 18880
6285 1 14 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.119 -0.029 18880
6286 1 14 . 1 1 53 53 ARG C C 53 177.380 177.380 177.402 -0.022 18880
6287 1 14 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.234 0.876 18880
6288 1 14 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.171 -0.591 18880
6289 1 14 . 1 1 53 53 ARG H H 53 7.930 7.930 8.644 -0.714 18880
6290 1 14 . 1 1 54 54 ASP N N 54 117.500 117.500 116.585 0.915 18880
6291 1 14 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.855 -0.255 18880
6292 1 14 . 1 1 54 54 ASP C C 54 176.930 176.930 176.045 0.885 18880
6293 1 14 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.433 2.107 18880
6294 1 14 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.574 -0.474 18880
6295 1 14 . 1 1 54 54 ASP H H 54 7.870 7.870 7.730 0.140 18880
6296 1 14 . 1 1 55 55 GLY N N 55 106.370 106.370 108.295 -1.925 18880
6297 1 14 . 1 1 55 55 GLY C C 55 173.460 173.460 173.724 -0.264 18880
6298 1 14 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.326 0.674 18880
6299 1 14 . 1 1 55 55 GLY H H 55 7.880 7.880 7.700 0.180 18880
6300 1 14 . 1 1 56 56 LEU N N 56 122.630 122.630 123.413 -0.783 18880
6301 1 14 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.775 -0.005 18880
6302 1 14 . 1 1 56 56 LEU CA C 56 52.490 52.490 52.510 -0.020 18880
6303 1 14 . 1 1 56 56 LEU CB C 56 43.120 43.120 41.962 1.158 18880
6304 1 14 . 1 1 56 56 LEU H H 56 8.220 8.220 7.727 0.493 18880
6305 1 14 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.492 0.088 18880
6306 1 14 . 1 1 57 57 PRO C C 57 176.150 176.150 175.781 0.369 18880
6307 1 14 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.052 -0.632 18880
6308 1 14 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.900 -1.160 18880
6309 1 14 . 1 1 58 58 MET N N 58 121.810 121.810 124.219 -2.409 18880
6310 1 14 . 1 1 58 58 MET HA H 58 4.630 4.630 4.805 -0.175 18880
6311 1 14 . 1 1 58 58 MET C C 58 176.150 176.150 175.005 1.145 18880
6312 1 14 . 1 1 58 58 MET CA C 58 55.560 55.560 54.455 1.105 18880
6313 1 14 . 1 1 58 58 MET CB C 58 36.820 36.820 37.221 -0.401 18880
6314 1 14 . 1 1 58 58 MET H H 58 7.690 7.690 8.269 -0.579 18880
6315 1 14 . 1 1 59 59 THR N N 59 114.180 114.180 116.284 -2.104 18880
6316 1 14 . 1 1 59 59 THR HA H 59 4.450 4.450 4.419 0.031 18880
6317 1 14 . 1 1 59 59 THR C C 59 175.170 175.170 175.969 -0.799 18880
6318 1 14 . 1 1 59 59 THR CA C 59 60.780 60.780 61.223 -0.443 18880
6319 1 14 . 1 1 59 59 THR CB C 59 71.060 71.060 69.875 1.185 18880
6320 1 14 . 1 1 59 59 THR H H 59 8.940 8.940 9.026 -0.086 18880
6321 1 14 . 1 1 60 60 GLU N N 60 120.620 120.620 125.156 -4.536 18880
6322 1 14 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.739 0.271 18880
6323 1 14 . 1 1 60 60 GLU C C 60 179.010 179.010 178.105 0.905 18880
6324 1 14 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.506 0.314 18880
6325 1 14 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.544 0.506 18880
6326 1 14 . 1 1 60 60 GLU H H 60 8.850 8.850 8.915 -0.065 18880
6327 1 14 . 1 1 61 61 ALA N N 61 121.080 121.080 122.417 -1.337 18880
6328 1 14 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.967 0.173 18880
6329 1 14 . 1 1 61 61 ALA C C 61 180.350 180.350 179.899 0.451 18880
6330 1 14 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.126 -0.036 18880
6331 1 14 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.721 0.489 18880
6332 1 14 . 1 1 61 61 ALA H H 61 8.370 8.370 8.398 -0.028 18880
6333 1 14 . 1 1 62 62 GLU N N 62 118.890 118.890 118.943 -0.053 18880
6334 1 14 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.448 0.552 18880
6335 1 14 . 1 1 62 62 GLU C C 62 179.690 179.690 178.592 1.098 18880
6336 1 14 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.579 0.411 18880
6337 1 14 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.885 1.425 18880
6338 1 14 . 1 1 62 62 GLU H H 62 7.680 7.680 7.727 -0.047 18880
6339 1 14 . 1 1 63 63 ILE N N 63 122.340 122.340 119.912 2.428 18880
6340 1 14 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.224 0.346 18880
6341 1 14 . 1 1 63 63 ILE C C 63 177.260 177.260 178.269 -1.009 18880
6342 1 14 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.827 1.063 18880
6343 1 14 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.164 0.816 18880
6344 1 14 . 1 1 63 63 ILE H H 63 8.420 8.420 7.530 0.890 18880
6345 1 14 . 1 1 64 64 THR N N 64 116.970 116.970 116.568 0.402 18880
6346 1 14 . 1 1 64 64 THR HA H 64 3.940 3.940 4.031 -0.091 18880
6347 1 14 . 1 1 64 64 THR C C 64 176.520 176.520 176.863 -0.343 18880
6348 1 14 . 1 1 64 64 THR CA C 64 67.060 67.060 67.280 -0.220 18880
6349 1 14 . 1 1 64 64 THR CB C 64 68.750 68.750 68.224 0.526 18880
6350 1 14 . 1 1 64 64 THR H H 64 8.310 8.310 8.539 -0.229 18880
6351 1 14 . 1 1 65 65 GLU N N 65 120.760 120.760 119.697 1.063 18880
6352 1 14 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.217 -0.187 18880
6353 1 14 . 1 1 65 65 GLU C C 65 175.830 175.830 179.131 -3.301 18880
6354 1 14 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.906 0.594 18880
6355 1 14 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.222 0.548 18880
6356 1 14 . 1 1 65 65 GLU H H 65 7.970 7.970 8.811 -0.841 18880
6357 1 14 . 1 1 66 66 PHE N N 66 120.940 120.940 118.924 2.016 18880
6358 1 14 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.392 -0.152 18880
6359 1 14 . 1 1 66 66 PHE C C 66 177.330 177.330 176.835 0.495 18880
6360 1 14 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.446 2.754 18880
6361 1 14 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.720 -0.190 18880
6362 1 14 . 1 1 66 66 PHE H H 66 8.100 8.100 7.874 0.226 18880
6363 1 14 . 1 1 67 67 PHE N N 67 118.110 118.110 118.077 0.033 18880
6364 1 14 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.472 -0.522 18880
6365 1 14 . 1 1 67 67 PHE C C 67 178.090 178.090 177.686 0.404 18880
6366 1 14 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.188 2.012 18880
6367 1 14 . 1 1 67 67 PHE CB C 67 38.250 38.250 39.036 -0.786 18880
6368 1 14 . 1 1 67 67 PHE H H 67 8.380 8.380 8.409 -0.029 18880
6369 1 14 . 1 1 68 68 GLU N N 68 119.650 119.650 118.340 1.310 18880
6370 1 14 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.585 -0.575 18880
6371 1 14 . 1 1 68 68 GLU C C 68 177.910 177.910 177.142 0.768 18880
6372 1 14 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.707 1.533 18880
6373 1 14 . 1 1 68 68 GLU CB C 68 29.370 29.370 30.041 -0.671 18880
6374 1 14 . 1 1 68 68 GLU H H 68 8.230 8.230 8.593 -0.363 18880
6375 1 14 . 1 1 69 69 ALA N N 69 119.090 119.090 120.798 -1.708 18880
6376 1 14 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.402 -0.222 18880
6377 1 14 . 1 1 69 69 ALA C C 69 179.030 179.030 178.316 0.714 18880
6378 1 14 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.901 -0.301 18880
6379 1 14 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.724 0.056 18880
6380 1 14 . 1 1 69 69 ALA H H 69 7.340 7.340 7.723 -0.383 18880
6381 1 14 . 1 1 70 70 ALA N N 70 118.670 118.670 119.512 -0.842 18880
6382 1 14 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.334 -0.314 18880
6383 1 14 . 1 1 70 70 ALA C C 70 176.820 176.820 176.531 0.289 18880
6384 1 14 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.468 0.622 18880
6385 1 14 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.199 -0.589 18880
6386 1 14 . 1 1 70 70 ALA H H 70 8.050 8.050 7.833 0.217 18880
6387 1 14 . 1 1 71 71 ASP N N 71 116.780 116.780 117.840 -1.060 18880
6388 1 14 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.070 0.150 18880
6389 1 14 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.384 1.766 18880
6390 1 14 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.777 -1.867 18880
6391 1 14 . 1 1 71 71 ASP H H 71 8.010 8.010 7.537 0.473 18880
6392 1 14 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.403 0.067 18880
6393 1 14 . 1 1 72 72 PRO C C 72 177.970 177.970 177.548 0.422 18880
6394 1 14 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.321 0.589 18880
6395 1 14 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.541 -0.662 18880
6396 1 14 . 1 1 73 73 ASN N N 73 114.930 114.930 116.623 -1.693 18880
6397 1 14 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.573 0.307 18880
6398 1 14 . 1 1 73 73 ASN C C 73 174.880 174.880 174.761 0.119 18880
6399 1 14 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.744 -0.904 18880
6400 1 14 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.848 -0.468 18880
6401 1 14 . 1 1 73 73 ASN H H 73 9.030 9.030 8.443 0.587 18880
6402 1 14 . 1 1 74 74 ASN N N 74 118.340 118.340 111.919 6.421 18880
6403 1 14 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.602 -0.242 18880
6404 1 14 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.007 0.583 18880
6405 1 14 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.197 0.963 18880
6406 1 14 . 1 1 74 74 ASN H H 74 8.320 8.320 8.606 -0.286 18880
6407 1 14 . 1 1 75 75 THR N N 75 113.450 113.450 110.027 3.423 18880
6408 1 14 . 1 1 75 75 THR HA H 75 4.210 4.210 4.329 -0.119 18880
6409 1 14 . 1 1 75 75 THR CA C 75 63.410 63.410 64.073 -0.664 18880
6410 1 14 . 1 1 75 75 THR CB C 75 70.540 70.540 69.876 0.664 18880
6411 1 14 . 1 1 75 75 THR H H 75 9.870 9.870 8.511 1.359 18880
6412 1 14 . 1 1 76 76 GLY N N 76 111.810 111.810 109.653 2.157 18880
6413 1 14 . 1 1 76 76 GLY C C 76 173.670 173.670 172.528 1.142 18880
6414 1 14 . 1 1 76 76 GLY CA C 76 45.120 45.120 44.517 0.603 18880
6415 1 14 . 1 1 76 76 GLY H H 76 10.250 10.250 8.049 2.201 18880
6416 1 14 . 1 1 77 77 PHE N N 77 120.560 120.560 118.441 2.119 18880
6417 1 14 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.835 0.315 18880
6418 1 14 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.869 0.311 18880
6419 1 14 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.651 1.849 18880
6420 1 14 . 1 1 77 77 PHE H H 77 8.110 8.110 7.474 0.636 18880
6421 1 14 . 1 1 78 78 ILE N N 78 116.410 116.410 121.631 -5.221 18880
6422 1 14 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.351 0.039 18880
6423 1 14 . 1 1 78 78 ILE C C 78 174.770 174.770 175.365 -0.595 18880
6424 1 14 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.614 -0.424 18880
6425 1 14 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.345 0.835 18880
6426 1 14 . 1 1 78 78 ILE H H 78 8.930 8.930 8.056 0.874 18880
6427 1 14 . 1 1 79 79 ASP N N 79 125.220 125.220 126.005 -0.785 18880
6428 1 14 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.940 -0.440 18880
6429 1 14 . 1 1 79 79 ASP C C 79 176.490 176.490 177.182 -0.692 18880
6430 1 14 . 1 1 79 79 ASP CA C 79 53.310 53.310 54.177 -0.867 18880
6431 1 14 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.564 0.806 18880
6432 1 14 . 1 1 79 79 ASP H H 79 8.610 8.610 8.645 -0.035 18880
6433 1 14 . 1 1 80 80 TYR N N 80 125.760 125.760 126.956 -1.196 18880
6434 1 14 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.039 -0.049 18880
6435 1 14 . 1 1 80 80 TYR C C 80 177.140 177.140 176.609 0.531 18880
6436 1 14 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.507 -0.927 18880
6437 1 14 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.574 0.316 18880
6438 1 14 . 1 1 80 80 TYR H H 80 8.460 8.460 8.587 -0.127 18880
6439 1 14 . 1 1 81 81 LYS N N 81 118.320 118.320 118.528 -0.208 18880
6440 1 14 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.904 -0.004 18880
6441 1 14 . 1 1 81 81 LYS C C 81 179.090 179.090 178.516 0.574 18880
6442 1 14 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.629 -0.049 18880
6443 1 14 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.765 -0.004 18880
6444 1 14 . 1 1 81 81 LYS H H 81 8.410 8.410 8.406 0.004 18880
6445 1 14 . 1 1 82 82 ALA N N 82 122.050 122.050 121.657 0.393 18880
6446 1 14 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.204 -0.074 18880
6447 1 14 . 1 1 82 82 ALA C C 82 179.740 179.740 179.323 0.417 18880
6448 1 14 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.730 -0.210 18880
6449 1 14 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.393 0.147 18880
6450 1 14 . 1 1 82 82 ALA H H 82 7.770 7.770 8.137 -0.367 18880
6451 1 14 . 1 1 83 83 PHE N N 83 117.810 117.810 116.680 1.130 18880
6452 1 14 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.328 -0.038 18880
6453 1 14 . 1 1 83 83 PHE C C 83 176.460 176.460 176.672 -0.212 18880
6454 1 14 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.245 0.785 18880
6455 1 14 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.995 -0.475 18880
6456 1 14 . 1 1 83 83 PHE H H 83 7.780 7.780 7.534 0.246 18880
6457 1 14 . 1 1 84 84 ALA N N 84 121.530 121.530 122.081 -0.551 18880
6458 1 14 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.154 -0.494 18880
6459 1 14 . 1 1 84 84 ALA C C 84 179.010 179.010 178.795 0.215 18880
6460 1 14 . 1 1 84 84 ALA CA C 84 55.030 55.030 53.880 1.150 18880
6461 1 14 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.328 -0.198 18880
6462 1 14 . 1 1 84 84 ALA H H 84 8.290 8.290 8.238 0.052 18880
6463 1 14 . 1 1 85 85 ALA N N 85 117.720 117.720 120.521 -2.801 18880
6464 1 14 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.195 -0.115 18880
6465 1 14 . 1 1 85 85 ALA C C 85 179.570 179.570 178.096 1.474 18880
6466 1 14 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.537 -0.167 18880
6467 1 14 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.639 -0.349 18880
6468 1 14 . 1 1 85 85 ALA H H 85 7.700 7.700 8.549 -0.849 18880
6469 1 14 . 1 1 86 86 MET N N 86 116.570 116.570 115.803 0.767 18880
6470 1 14 . 1 1 86 86 MET HA H 86 4.160 4.160 4.233 -0.073 18880
6471 1 14 . 1 1 86 86 MET C C 86 177.360 177.360 177.760 -0.400 18880
6472 1 14 . 1 1 86 86 MET CA C 86 57.380 57.380 57.480 -0.100 18880
6473 1 14 . 1 1 86 86 MET CB C 86 32.720 32.720 32.652 0.068 18880
6474 1 14 . 1 1 86 86 MET H H 86 7.560 7.560 7.575 -0.015 18880
6475 1 14 . 1 1 87 87 LEU N N 87 119.090 119.090 117.233 1.857 18880
6476 1 14 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.166 -0.196 18880
6477 1 14 . 1 1 87 87 LEU C C 87 177.420 177.420 177.197 0.223 18880
6478 1 14 . 1 1 87 87 LEU CA C 87 56.290 56.290 56.051 0.239 18880
6479 1 14 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.233 0.047 18880
6480 1 14 . 1 1 87 87 LEU H H 87 7.570 7.570 7.521 0.049 18880
6481 1 14 . 1 1 88 88 TYR N N 88 117.060 117.060 115.045 2.015 18880
6482 1 14 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.740 -0.150 18880
6483 1 14 . 1 1 88 88 TYR C C 88 175.870 175.870 175.054 0.816 18880
6484 1 14 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.602 2.238 18880
6485 1 14 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.228 0.411 18880
6486 1 14 . 1 1 88 88 TYR H H 88 7.740 7.740 7.513 0.227 18880
6487 1 14 . 1 1 89 89 SER N N 89 115.980 115.980 119.887 -3.907 18880
6488 1 14 . 1 1 89 89 SER HA H 89 4.440 4.440 4.451 -0.011 18880
6489 1 14 . 1 1 89 89 SER C C 89 174.460 174.460 174.629 -0.169 18880
6490 1 14 . 1 1 89 89 SER CA C 89 58.350 58.350 59.349 -0.999 18880
6491 1 14 . 1 1 89 89 SER CB C 89 63.990 63.990 61.597 2.393 18880
6492 1 14 . 1 1 89 89 SER H H 89 7.880 7.880 7.884 -0.004 18880
6493 1 14 . 1 1 90 90 VAL N N 90 120.910 120.910 120.755 0.155 18880
6494 1 14 . 1 1 90 90 VAL HA H 90 4.140 4.140 3.681 0.459 18880
6495 1 14 . 1 1 90 90 VAL C C 90 175.720 175.720 175.185 0.535 18880
6496 1 14 . 1 1 90 90 VAL CA C 90 62.270 62.270 63.739 -1.470 18880
6497 1 14 . 1 1 90 90 VAL CB C 90 32.840 32.840 30.320 2.520 18880
6498 1 14 . 1 1 90 90 VAL H H 90 8.020 8.020 8.757 -0.737 18880
6499 1 14 . 1 1 91 91 ASP N N 91 123.620 123.620 113.815 9.805 18880
6500 1 14 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.180 0.450 18880
6501 1 14 . 1 1 91 91 ASP C C 91 176.000 176.000 175.470 0.530 18880
6502 1 14 . 1 1 91 91 ASP CA C 91 54.510 54.510 55.367 -0.858 18880
6503 1 14 . 1 1 91 91 ASP CB C 91 41.440 41.440 39.723 1.717 18880
6504 1 14 . 1 1 91 91 ASP H H 91 8.310 8.310 8.481 -0.171 18880
6505 1 14 . 1 1 92 92 GLU N N 92 122.170 122.170 116.137 6.033 18880
6506 1 14 . 1 1 92 92 GLU HA H 92 4.360 4.360 3.943 0.417 18880
6507 1 14 . 1 1 92 92 GLU C C 92 175.660 175.660 176.012 -0.352 18880
6508 1 14 . 1 1 92 92 GLU CA C 92 56.490 56.490 57.690 -1.200 18880
6509 1 14 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.036 2.814 18880
6510 1 14 . 1 1 92 92 GLU H H 92 8.320 8.320 7.800 0.520 18880
6511 1 15 . 1 1 10 10 HIS C C 10 176.040 176.040 175.526 0.514 18880
6512 1 15 . 1 1 11 11 SER N N 11 116.840 116.840 115.996 0.844 18880
6513 1 15 . 1 1 11 11 SER HA H 11 4.430 4.430 4.622 -0.192 18880
6514 1 15 . 1 1 11 11 SER C C 11 174.630 174.630 175.409 -0.779 18880
6515 1 15 . 1 1 11 11 SER CA C 11 58.350 58.350 59.018 -0.668 18880
6516 1 15 . 1 1 11 11 SER CB C 11 64.120 64.120 64.496 -0.376 18880
6517 1 15 . 1 1 11 11 SER H H 11 8.360 8.360 8.525 -0.165 18880
6518 1 15 . 1 1 12 12 SER N N 12 118.030 118.030 118.728 -0.698 18880
6519 1 15 . 1 1 12 12 SER HA H 12 4.440 4.440 4.679 -0.239 18880
6520 1 15 . 1 1 12 12 SER C C 12 174.880 174.880 173.608 1.272 18880
6521 1 15 . 1 1 12 12 SER CA C 12 58.680 58.680 58.951 -0.271 18880
6522 1 15 . 1 1 12 12 SER CB C 12 63.890 63.890 63.306 0.584 18880
6523 1 15 . 1 1 12 12 SER H H 12 8.490 8.490 8.311 0.179 18880
6524 1 15 . 1 1 13 13 GLY N N 13 110.450 110.450 110.673 -0.223 18880
6525 1 15 . 1 1 13 13 GLY C C 13 173.790 173.790 172.964 0.826 18880
6526 1 15 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.162 0.298 18880
6527 1 15 . 1 1 13 13 GLY H H 13 8.390 8.390 8.145 0.245 18880
6528 1 15 . 1 1 14 14 LEU N N 14 121.310 121.310 123.620 -2.310 18880
6529 1 15 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.259 0.081 18880
6530 1 15 . 1 1 14 14 LEU C C 14 176.930 176.930 176.799 0.131 18880
6531 1 15 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.246 -0.046 18880
6532 1 15 . 1 1 14 14 LEU CB C 14 42.600 42.600 41.914 0.686 18880
6533 1 15 . 1 1 14 14 LEU H H 14 8.020 8.020 8.540 -0.520 18880
6534 1 15 . 1 1 15 15 VAL N N 15 121.550 121.550 124.620 -3.070 18880
6535 1 15 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.145 0.225 18880
6536 1 15 . 1 1 15 15 VAL CA C 15 59.720 59.720 62.347 -2.627 18880
6537 1 15 . 1 1 15 15 VAL CB C 15 32.770 32.770 29.516 3.254 18880
6538 1 15 . 1 1 15 15 VAL H H 15 8.030 8.030 7.897 0.133 18880
6539 1 15 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.387 -0.017 18880
6540 1 15 . 1 1 16 16 PRO C C 16 176.720 176.720 176.113 0.607 18880
6541 1 15 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.023 -0.373 18880
6542 1 15 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.114 0.126 18880
6543 1 15 . 1 1 17 17 ARG N N 17 121.890 121.890 120.088 1.802 18880
6544 1 15 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.413 -0.133 18880
6545 1 15 . 1 1 17 17 ARG C C 17 176.940 176.940 176.011 0.929 18880
6546 1 15 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.100 0.260 18880
6547 1 15 . 1 1 17 17 ARG CB C 17 31.050 31.050 31.145 -0.095 18880
6548 1 15 . 1 1 17 17 ARG H H 17 8.450 8.450 8.451 -0.001 18880
6549 1 15 . 1 1 18 18 GLY N N 18 110.160 110.160 113.227 -3.067 18880
6550 1 15 . 1 1 18 18 GLY C C 18 174.110 174.110 173.435 0.675 18880
6551 1 15 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.172 0.218 18880
6552 1 15 . 1 1 18 18 GLY H H 18 8.480 8.480 8.747 -0.267 18880
6553 1 15 . 1 1 19 19 SER N N 19 115.500 115.500 114.410 1.090 18880
6554 1 15 . 1 1 19 19 SER HA H 19 4.400 4.400 4.705 -0.305 18880
6555 1 15 . 1 1 19 19 SER C C 19 174.380 174.380 173.645 0.735 18880
6556 1 15 . 1 1 19 19 SER CA C 19 58.610 58.610 57.962 0.648 18880
6557 1 15 . 1 1 19 19 SER CB C 19 63.830 63.830 64.668 -0.838 18880
6558 1 15 . 1 1 19 19 SER H H 19 8.210 8.210 8.243 -0.033 18880
6559 1 15 . 1 1 20 20 HIS N N 20 120.770 120.770 121.599 -0.829 18880
6560 1 15 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.682 -0.072 18880
6561 1 15 . 1 1 20 20 HIS C C 20 174.870 174.870 175.931 -1.061 18880
6562 1 15 . 1 1 20 20 HIS CA C 20 56.130 56.130 57.700 -1.570 18880
6563 1 15 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.361 -0.651 18880
6564 1 15 . 1 1 20 20 HIS H H 20 8.590 8.590 8.108 0.482 18880
6565 1 15 . 1 1 21 21 MET N N 21 121.440 121.440 119.421 2.019 18880
6566 1 15 . 1 1 21 21 MET HA H 21 4.470 4.470 4.599 -0.129 18880
6567 1 15 . 1 1 21 21 MET C C 21 176.030 176.030 176.115 -0.085 18880
6568 1 15 . 1 1 21 21 MET CA C 21 55.490 55.490 55.518 -0.028 18880
6569 1 15 . 1 1 21 21 MET CB C 21 33.170 33.170 32.567 0.603 18880
6570 1 15 . 1 1 21 21 MET H H 21 8.310 8.310 8.162 0.148 18880
6571 1 15 . 1 1 22 22 SER N N 22 116.860 116.860 115.335 1.525 18880
6572 1 15 . 1 1 22 22 SER HA H 22 4.430 4.430 4.478 -0.048 18880
6573 1 15 . 1 1 22 22 SER C C 22 174.630 174.630 174.414 0.216 18880
6574 1 15 . 1 1 22 22 SER CA C 22 58.410 58.410 58.173 0.237 18880
6575 1 15 . 1 1 22 22 SER CB C 22 64.030 64.030 62.810 1.220 18880
6576 1 15 . 1 1 22 22 SER H H 22 8.340 8.340 8.214 0.126 18880
6577 1 15 . 1 1 23 23 ASP N N 23 122.660 122.660 121.386 1.274 18880
6578 1 15 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.848 -0.298 18880
6579 1 15 . 1 1 23 23 ASP C C 23 176.860 176.860 177.291 -0.431 18880
6580 1 15 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.715 -0.385 18880
6581 1 15 . 1 1 23 23 ASP CB C 23 41.000 41.000 41.588 -0.588 18880
6582 1 15 . 1 1 23 23 ASP H H 23 8.540 8.540 8.436 0.104 18880
6583 1 15 . 1 1 24 24 GLU N N 24 120.400 120.400 119.916 0.484 18880
6584 1 15 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.140 0.000 18880
6585 1 15 . 1 1 24 24 GLU C C 24 177.540 177.540 177.347 0.193 18880
6586 1 15 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.556 -0.195 18880
6587 1 15 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.059 0.691 18880
6588 1 15 . 1 1 24 24 GLU H H 24 8.610 8.610 8.449 0.161 18880
6589 1 15 . 1 1 25 25 LYS N N 25 120.390 120.390 117.378 3.012 18880
6590 1 15 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.289 -0.099 18880
6591 1 15 . 1 1 25 25 LYS C C 25 177.490 177.490 178.346 -0.856 18880
6592 1 15 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.017 0.093 18880
6593 1 15 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.746 -0.256 18880
6594 1 15 . 1 1 25 25 LYS H H 25 8.210 8.210 8.095 0.115 18880
6595 1 15 . 1 1 26 26 THR N N 26 114.880 114.880 116.104 -1.224 18880
6596 1 15 . 1 1 26 26 THR HA H 26 4.040 4.040 4.143 -0.103 18880
6597 1 15 . 1 1 26 26 THR C C 26 175.430 175.430 176.843 -1.413 18880
6598 1 15 . 1 1 26 26 THR CA C 26 64.620 64.620 65.749 -1.128 18880
6599 1 15 . 1 1 26 26 THR CB C 26 69.110 69.110 68.583 0.527 18880
6600 1 15 . 1 1 26 26 THR H H 26 8.080 8.080 7.519 0.561 18880
6601 1 15 . 1 1 27 27 GLN N N 27 120.940 120.940 121.852 -0.912 18880
6602 1 15 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.111 0.079 18880
6603 1 15 . 1 1 27 27 GLN C C 27 177.280 177.280 177.535 -0.255 18880
6604 1 15 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.619 -1.069 18880
6605 1 15 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.578 0.512 18880
6606 1 15 . 1 1 27 27 GLN H H 27 8.240 8.240 7.850 0.390 18880
6607 1 15 . 1 1 28 28 LEU N N 28 121.860 121.860 119.116 2.744 18880
6608 1 15 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.332 -0.162 18880
6609 1 15 . 1 1 28 28 LEU C C 28 177.750 177.750 177.705 0.045 18880
6610 1 15 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.599 1.481 18880
6611 1 15 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.523 -0.253 18880
6612 1 15 . 1 1 28 28 LEU H H 28 7.950 7.950 7.494 0.456 18880
6613 1 15 . 1 1 29 29 ILE N N 29 119.260 119.260 119.145 0.115 18880
6614 1 15 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.112 -0.211 18880
6615 1 15 . 1 1 29 29 ILE C C 29 177.140 177.140 177.728 -0.588 18880
6616 1 15 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.575 -0.275 18880
6617 1 15 . 1 1 29 29 ILE CB C 29 38.280 38.280 37.013 1.267 18880
6618 1 15 . 1 1 29 29 ILE H H 29 7.950 7.950 7.974 -0.024 18880
6619 1 15 . 1 1 30 30 GLU N N 30 120.500 120.500 120.093 0.407 18880
6620 1 15 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.421 -0.371 18880
6621 1 15 . 1 1 30 30 GLU C C 30 177.560 177.560 176.540 1.020 18880
6622 1 15 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.625 0.465 18880
6623 1 15 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.366 0.224 18880
6624 1 15 . 1 1 30 30 GLU H H 30 8.220 8.220 8.075 0.145 18880
6625 1 15 . 1 1 31 31 ALA N N 31 121.550 121.550 119.637 1.913 18880
6626 1 15 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.586 -0.436 18880
6627 1 15 . 1 1 31 31 ALA C C 31 178.550 178.550 178.809 -0.259 18880
6628 1 15 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.617 0.183 18880
6629 1 15 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.459 -0.829 18880
6630 1 15 . 1 1 31 31 ALA H H 31 7.890 7.890 7.526 0.364 18880
6631 1 15 . 1 1 32 32 PHE N N 32 117.240 117.240 117.187 0.053 18880
6632 1 15 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.118 0.182 18880
6633 1 15 . 1 1 32 32 PHE C C 32 176.210 176.210 175.925 0.285 18880
6634 1 15 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.215 -1.875 18880
6635 1 15 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.758 0.992 18880
6636 1 15 . 1 1 32 32 PHE H H 32 7.930 7.930 7.505 0.425 18880
6637 1 15 . 1 1 33 33 TYR N N 33 119.050 119.050 116.388 2.662 18880
6638 1 15 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.622 -0.292 18880
6639 1 15 . 1 1 33 33 TYR C C 33 175.680 175.680 175.446 0.234 18880
6640 1 15 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.580 1.340 18880
6641 1 15 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.931 1.609 18880
6642 1 15 . 1 1 33 33 TYR H H 33 7.950 7.950 8.332 -0.382 18880
6643 1 15 . 1 1 34 34 ASN N N 34 118.390 118.390 117.666 0.724 18880
6644 1 15 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.772 -0.142 18880
6645 1 15 . 1 1 34 34 ASN C C 34 174.810 174.810 174.276 0.534 18880
6646 1 15 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.273 -0.122 18880
6647 1 15 . 1 1 34 34 ASN CB C 34 38.980 38.980 37.982 0.998 18880
6648 1 15 . 1 1 34 34 ASN H H 34 7.960 7.960 7.923 0.037 18880
6649 1 15 . 1 1 35 35 PHE N N 35 120.670 120.670 120.773 -0.103 18880
6650 1 15 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.642 -0.192 18880
6651 1 15 . 1 1 35 35 PHE C C 35 175.310 175.310 174.070 1.240 18880
6652 1 15 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.270 0.050 18880
6653 1 15 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.073 -0.653 18880
6654 1 15 . 1 1 35 35 PHE H H 35 7.830 7.830 7.879 -0.049 18880
6655 1 15 . 1 1 36 36 ASP N N 36 122.400 122.400 122.043 0.357 18880
6656 1 15 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.391 0.199 18880
6657 1 15 . 1 1 36 36 ASP C C 36 176.150 176.150 176.131 0.019 18880
6658 1 15 . 1 1 36 36 ASP CA C 36 54.070 54.070 55.068 -0.998 18880
6659 1 15 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.333 0.987 18880
6660 1 15 . 1 1 36 36 ASP H H 36 8.180 8.180 8.600 -0.420 18880
6661 1 15 . 1 1 37 37 GLY N N 37 108.560 108.560 105.810 2.750 18880
6662 1 15 . 1 1 37 37 GLY C C 37 173.660 173.660 174.626 -0.966 18880
6663 1 15 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.480 0.130 18880
6664 1 15 . 1 1 37 37 GLY H H 37 7.680 7.680 8.405 -0.725 18880
6665 1 15 . 1 1 38 38 ASP N N 38 120.010 120.010 116.230 3.780 18880
6666 1 15 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.363 0.237 18880
6667 1 15 . 1 1 38 38 ASP CA C 38 54.260 54.260 55.693 -1.433 18880
6668 1 15 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.105 1.345 18880
6669 1 15 . 1 1 38 38 ASP H H 38 8.220 8.220 8.408 -0.188 18880
6670 1 15 . 1 1 39 39 TYR N N 39 121.030 121.030 120.639 0.391 18880
6671 1 15 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.702 -0.312 18880
6672 1 15 . 1 1 39 39 TYR C C 39 175.290 175.290 173.933 1.357 18880
6673 1 15 . 1 1 39 39 TYR CA C 39 58.200 58.200 57.913 0.287 18880
6674 1 15 . 1 1 39 39 TYR CB C 39 39.170 39.170 39.181 -0.011 18880
6675 1 15 . 1 1 39 39 TYR H H 39 8.090 8.090 7.677 0.413 18880
6676 1 15 . 1 1 40 40 ASP N N 40 122.020 122.020 124.361 -2.341 18880
6677 1 15 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.637 -0.037 18880
6678 1 15 . 1 1 40 40 ASP C C 40 175.970 175.970 174.856 1.114 18880
6679 1 15 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.147 0.073 18880
6680 1 15 . 1 1 40 40 ASP CB C 40 41.520 41.520 42.836 -1.316 18880
6681 1 15 . 1 1 40 40 ASP H H 40 8.200 8.200 7.959 0.241 18880
6682 1 15 . 1 1 41 41 GLY N N 41 108.330 108.330 109.501 -1.171 18880
6683 1 15 . 1 1 41 41 GLY C C 41 173.000 173.000 172.795 0.205 18880
6684 1 15 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.586 0.834 18880
6685 1 15 . 1 1 41 41 GLY H H 41 7.830 7.830 8.204 -0.374 18880
6686 1 15 . 1 1 42 42 PHE N N 42 118.600 118.600 119.056 -0.456 18880
6687 1 15 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.868 0.392 18880
6688 1 15 . 1 1 42 42 PHE C C 42 175.660 175.660 174.020 1.640 18880
6689 1 15 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.163 -0.003 18880
6690 1 15 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.173 -1.003 18880
6691 1 15 . 1 1 42 42 PHE H H 42 8.150 8.150 7.434 0.716 18880
6692 1 15 . 1 1 43 43 VAL N N 43 119.180 119.180 123.272 -4.092 18880
6693 1 15 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.641 0.029 18880
6694 1 15 . 1 1 43 43 VAL C C 43 175.110 175.110 174.212 0.898 18880
6695 1 15 . 1 1 43 43 VAL CA C 43 60.620 60.620 59.454 1.166 18880
6696 1 15 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.979 -3.099 18880
6697 1 15 . 1 1 43 43 VAL H H 43 9.070 9.070 8.762 0.308 18880
6698 1 15 . 1 1 44 44 SER N N 44 121.380 121.380 120.845 0.535 18880
6699 1 15 . 1 1 44 44 SER HA H 44 4.570 4.570 4.887 -0.317 18880
6700 1 15 . 1 1 44 44 SER C C 44 175.660 175.660 175.448 0.212 18880
6701 1 15 . 1 1 44 44 SER CA C 44 57.720 57.720 57.191 0.529 18880
6702 1 15 . 1 1 44 44 SER CB C 44 63.690 63.690 64.984 -1.294 18880
6703 1 15 . 1 1 44 44 SER H H 44 9.140 9.140 8.474 0.666 18880
6704 1 15 . 1 1 45 45 VAL N N 45 122.720 122.720 122.466 0.254 18880
6705 1 15 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.414 0.086 18880
6706 1 15 . 1 1 45 45 VAL C C 45 177.240 177.240 177.560 -0.320 18880
6707 1 15 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.326 -0.056 18880
6708 1 15 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.925 0.525 18880
6709 1 15 . 1 1 45 45 VAL H H 45 8.140 8.140 8.694 -0.554 18880
6710 1 15 . 1 1 46 46 GLU N N 46 118.990 118.990 119.374 -0.384 18880
6711 1 15 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.898 0.082 18880
6712 1 15 . 1 1 46 46 GLU C C 46 179.460 179.460 178.643 0.817 18880
6713 1 15 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.580 -0.020 18880
6714 1 15 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.074 0.086 18880
6715 1 15 . 1 1 46 46 GLU H H 46 8.230 8.230 7.677 0.553 18880
6716 1 15 . 1 1 47 47 GLU N N 47 120.120 120.120 119.472 0.648 18880
6717 1 15 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.058 0.022 18880
6718 1 15 . 1 1 47 47 GLU C C 47 179.170 179.170 179.103 0.067 18880
6719 1 15 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.949 -0.059 18880
6720 1 15 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.515 0.305 18880
6721 1 15 . 1 1 47 47 GLU H H 47 7.880 7.880 7.563 0.317 18880
6722 1 15 . 1 1 48 48 PHE N N 48 120.830 120.830 119.237 1.593 18880
6723 1 15 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.409 -0.219 18880
6724 1 15 . 1 1 48 48 PHE C C 48 176.920 176.920 177.710 -0.790 18880
6725 1 15 . 1 1 48 48 PHE CA C 48 60.870 60.870 61.195 -0.325 18880
6726 1 15 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.127 0.133 18880
6727 1 15 . 1 1 48 48 PHE H H 48 8.600 8.600 8.079 0.521 18880
6728 1 15 . 1 1 49 49 ARG N N 49 118.470 118.470 119.200 -0.730 18880
6729 1 15 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.221 -0.361 18880
6730 1 15 . 1 1 49 49 ARG C C 49 178.090 178.090 178.762 -0.672 18880
6731 1 15 . 1 1 49 49 ARG CA C 49 60.070 60.070 59.994 0.076 18880
6732 1 15 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.769 0.371 18880
6733 1 15 . 1 1 49 49 ARG H H 49 8.650 8.650 7.915 0.735 18880
6734 1 15 . 1 1 50 50 GLY N N 50 105.080 105.080 106.217 -1.137 18880
6735 1 15 . 1 1 50 50 GLY C C 50 175.090 175.090 175.936 -0.846 18880
6736 1 15 . 1 1 50 50 GLY CA C 50 46.680 46.680 47.028 -0.348 18880
6737 1 15 . 1 1 50 50 GLY H H 50 7.620 7.620 7.964 -0.344 18880
6738 1 15 . 1 1 51 51 ILE N N 51 121.440 121.440 121.368 0.072 18880
6739 1 15 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.875 -0.045 18880
6740 1 15 . 1 1 51 51 ILE C C 51 178.300 178.300 177.336 0.964 18880
6741 1 15 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.386 -0.546 18880
6742 1 15 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.549 -0.239 18880
6743 1 15 . 1 1 51 51 ILE H H 51 7.470 7.470 7.206 0.264 18880
6744 1 15 . 1 1 52 52 ILE N N 52 118.930 118.930 119.154 -0.224 18880
6745 1 15 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.855 -0.115 18880
6746 1 15 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.264 0.496 18880
6747 1 15 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.761 1.270 18880
6748 1 15 . 1 1 52 52 ILE H H 52 7.790 7.790 8.406 -0.616 18880
6749 1 15 . 1 1 53 53 ARG N N 53 120.140 120.140 119.558 0.582 18880
6750 1 15 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.008 0.082 18880
6751 1 15 . 1 1 53 53 ARG C C 53 177.380 177.380 176.978 0.402 18880
6752 1 15 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.295 0.815 18880
6753 1 15 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.534 -0.954 18880
6754 1 15 . 1 1 53 53 ARG H H 53 7.930 7.930 8.330 -0.400 18880
6755 1 15 . 1 1 54 54 ASP N N 54 117.500 117.500 115.259 2.241 18880
6756 1 15 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.784 -0.184 18880
6757 1 15 . 1 1 54 54 ASP C C 54 176.930 176.930 176.310 0.620 18880
6758 1 15 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.817 1.723 18880
6759 1 15 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.991 0.109 18880
6760 1 15 . 1 1 54 54 ASP H H 54 7.870 7.870 8.112 -0.242 18880
6761 1 15 . 1 1 55 55 GLY N N 55 106.370 106.370 107.832 -1.462 18880
6762 1 15 . 1 1 55 55 GLY C C 55 173.460 173.460 173.862 -0.402 18880
6763 1 15 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.543 0.457 18880
6764 1 15 . 1 1 55 55 GLY H H 55 7.880 7.880 7.785 0.095 18880
6765 1 15 . 1 1 56 56 LEU N N 56 122.630 122.630 122.115 0.515 18880
6766 1 15 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.775 -0.005 18880
6767 1 15 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.274 1.216 18880
6768 1 15 . 1 1 56 56 LEU CB C 56 43.120 43.120 43.156 -0.036 18880
6769 1 15 . 1 1 56 56 LEU H H 56 8.220 8.220 7.881 0.339 18880
6770 1 15 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.506 0.074 18880
6771 1 15 . 1 1 57 57 PRO C C 57 176.150 176.150 175.735 0.415 18880
6772 1 15 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.193 -0.773 18880
6773 1 15 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.625 -0.885 18880
6774 1 15 . 1 1 58 58 MET N N 58 121.810 121.810 124.110 -2.300 18880
6775 1 15 . 1 1 58 58 MET HA H 58 4.630 4.630 4.585 0.045 18880
6776 1 15 . 1 1 58 58 MET C C 58 176.150 176.150 174.516 1.634 18880
6777 1 15 . 1 1 58 58 MET CA C 58 55.560 55.560 54.502 1.058 18880
6778 1 15 . 1 1 58 58 MET CB C 58 36.820 36.820 36.731 0.089 18880
6779 1 15 . 1 1 58 58 MET H H 58 7.690 7.690 8.210 -0.520 18880
6780 1 15 . 1 1 59 59 THR N N 59 114.180 114.180 114.701 -0.521 18880
6781 1 15 . 1 1 59 59 THR HA H 59 4.450 4.450 4.517 -0.067 18880
6782 1 15 . 1 1 59 59 THR C C 59 175.170 175.170 175.914 -0.744 18880
6783 1 15 . 1 1 59 59 THR CA C 59 60.780 60.780 61.341 -0.561 18880
6784 1 15 . 1 1 59 59 THR CB C 59 71.060 71.060 69.626 1.434 18880
6785 1 15 . 1 1 59 59 THR H H 59 8.940 8.940 8.256 0.684 18880
6786 1 15 . 1 1 60 60 GLU N N 60 120.620 120.620 125.314 -4.694 18880
6787 1 15 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.772 0.238 18880
6788 1 15 . 1 1 60 60 GLU C C 60 179.010 179.010 178.131 0.879 18880
6789 1 15 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.592 0.228 18880
6790 1 15 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.587 0.463 18880
6791 1 15 . 1 1 60 60 GLU H H 60 8.850 8.850 8.962 -0.112 18880
6792 1 15 . 1 1 61 61 ALA N N 61 121.080 121.080 122.198 -1.118 18880
6793 1 15 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.977 0.163 18880
6794 1 15 . 1 1 61 61 ALA C C 61 180.350 180.350 180.050 0.300 18880
6795 1 15 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.182 -0.092 18880
6796 1 15 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.790 0.420 18880
6797 1 15 . 1 1 61 61 ALA H H 61 8.370 8.370 8.419 -0.049 18880
6798 1 15 . 1 1 62 62 GLU N N 62 118.890 118.890 118.697 0.193 18880
6799 1 15 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.519 0.481 18880
6800 1 15 . 1 1 62 62 GLU C C 62 179.690 179.690 178.551 1.139 18880
6801 1 15 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.391 0.599 18880
6802 1 15 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.418 1.892 18880
6803 1 15 . 1 1 62 62 GLU H H 62 7.680 7.680 7.730 -0.050 18880
6804 1 15 . 1 1 63 63 ILE N N 63 122.340 122.340 119.886 2.454 18880
6805 1 15 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.282 0.288 18880
6806 1 15 . 1 1 63 63 ILE C C 63 177.260 177.260 178.362 -1.102 18880
6807 1 15 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.704 1.186 18880
6808 1 15 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.055 0.925 18880
6809 1 15 . 1 1 63 63 ILE H H 63 8.420 8.420 7.665 0.755 18880
6810 1 15 . 1 1 64 64 THR N N 64 116.970 116.970 116.125 0.845 18880
6811 1 15 . 1 1 64 64 THR HA H 64 3.940 3.940 4.099 -0.159 18880
6812 1 15 . 1 1 64 64 THR C C 64 176.520 176.520 176.661 -0.141 18880
6813 1 15 . 1 1 64 64 THR CA C 64 67.060 67.060 67.562 -0.502 18880
6814 1 15 . 1 1 64 64 THR CB C 64 68.750 68.750 68.286 0.464 18880
6815 1 15 . 1 1 64 64 THR H H 64 8.310 8.310 8.540 -0.230 18880
6816 1 15 . 1 1 65 65 GLU N N 65 120.760 120.760 120.110 0.650 18880
6817 1 15 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.211 -0.181 18880
6818 1 15 . 1 1 65 65 GLU C C 65 175.830 175.830 178.831 -3.001 18880
6819 1 15 . 1 1 65 65 GLU CA C 65 59.500 59.500 59.115 0.385 18880
6820 1 15 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.514 0.256 18880
6821 1 15 . 1 1 65 65 GLU H H 65 7.970 7.970 8.547 -0.577 18880
6822 1 15 . 1 1 66 66 PHE N N 66 120.940 120.940 118.005 2.935 18880
6823 1 15 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.327 -0.087 18880
6824 1 15 . 1 1 66 66 PHE C C 66 177.330 177.330 176.772 0.558 18880
6825 1 15 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.138 3.062 18880
6826 1 15 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.002 -0.472 18880
6827 1 15 . 1 1 66 66 PHE H H 66 8.100 8.100 7.811 0.289 18880
6828 1 15 . 1 1 67 67 PHE N N 67 118.110 118.110 119.451 -1.341 18880
6829 1 15 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.362 -0.412 18880
6830 1 15 . 1 1 67 67 PHE C C 67 178.090 178.090 177.822 0.268 18880
6831 1 15 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.875 1.325 18880
6832 1 15 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.785 -0.535 18880
6833 1 15 . 1 1 67 67 PHE H H 67 8.380 8.380 8.637 -0.257 18880
6834 1 15 . 1 1 68 68 GLU N N 68 119.650 119.650 117.567 2.083 18880
6835 1 15 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.387 -0.377 18880
6836 1 15 . 1 1 68 68 GLU C C 68 177.910 177.910 176.997 0.913 18880
6837 1 15 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.530 1.710 18880
6838 1 15 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.743 -0.373 18880
6839 1 15 . 1 1 68 68 GLU H H 68 8.230 8.230 8.061 0.169 18880
6840 1 15 . 1 1 69 69 ALA N N 69 119.090 119.090 120.613 -1.523 18880
6841 1 15 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.325 -0.145 18880
6842 1 15 . 1 1 69 69 ALA C C 69 179.030 179.030 178.412 0.618 18880
6843 1 15 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.697 -0.097 18880
6844 1 15 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.518 0.262 18880
6845 1 15 . 1 1 69 69 ALA H H 69 7.340 7.340 7.697 -0.357 18880
6846 1 15 . 1 1 70 70 ALA N N 70 118.670 118.670 119.862 -1.192 18880
6847 1 15 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.287 -0.267 18880
6848 1 15 . 1 1 70 70 ALA C C 70 176.820 176.820 177.047 -0.227 18880
6849 1 15 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.581 0.509 18880
6850 1 15 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.172 -0.561 18880
6851 1 15 . 1 1 70 70 ALA H H 70 8.050 8.050 7.781 0.269 18880
6852 1 15 . 1 1 71 71 ASP N N 71 116.780 116.780 118.153 -1.373 18880
6853 1 15 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.079 0.141 18880
6854 1 15 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.689 1.461 18880
6855 1 15 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.933 -2.023 18880
6856 1 15 . 1 1 71 71 ASP H H 71 8.010 8.010 7.592 0.418 18880
6857 1 15 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.363 0.107 18880
6858 1 15 . 1 1 72 72 PRO C C 72 177.970 177.970 176.977 0.993 18880
6859 1 15 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.433 0.478 18880
6860 1 15 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.332 -0.452 18880
6861 1 15 . 1 1 73 73 ASN N N 73 114.930 114.930 116.062 -1.132 18880
6862 1 15 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.646 0.234 18880
6863 1 15 . 1 1 73 73 ASN C C 73 174.880 174.880 174.769 0.111 18880
6864 1 15 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.453 -0.613 18880
6865 1 15 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.541 -0.161 18880
6866 1 15 . 1 1 73 73 ASN H H 73 9.030 9.030 8.349 0.681 18880
6867 1 15 . 1 1 74 74 ASN N N 74 118.340 118.340 112.830 5.510 18880
6868 1 15 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.575 -0.215 18880
6869 1 15 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.978 0.612 18880
6870 1 15 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.283 0.876 18880
6871 1 15 . 1 1 74 74 ASN H H 74 8.320 8.320 8.445 -0.125 18880
6872 1 15 . 1 1 75 75 THR N N 75 113.450 113.450 115.488 -2.038 18880
6873 1 15 . 1 1 75 75 THR HA H 75 4.210 4.210 4.459 -0.249 18880
6874 1 15 . 1 1 75 75 THR CA C 75 63.410 63.410 60.704 2.706 18880
6875 1 15 . 1 1 75 75 THR CB C 75 70.540 70.540 67.957 2.583 18880
6876 1 15 . 1 1 75 75 THR H H 75 9.870 9.870 8.338 1.532 18880
6877 1 15 . 1 1 76 76 GLY N N 76 111.810 111.810 109.807 2.003 18880
6878 1 15 . 1 1 76 76 GLY C C 76 173.670 173.670 173.346 0.324 18880
6879 1 15 . 1 1 76 76 GLY CA C 76 45.120 45.120 46.068 -0.948 18880
6880 1 15 . 1 1 76 76 GLY H H 76 10.250 10.250 7.638 2.612 18880
6881 1 15 . 1 1 77 77 PHE N N 77 120.560 120.560 118.244 2.316 18880
6882 1 15 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.072 0.079 18880
6883 1 15 . 1 1 77 77 PHE CA C 77 57.180 57.180 55.857 1.323 18880
6884 1 15 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.733 1.767 18880
6885 1 15 . 1 1 77 77 PHE H H 77 8.110 8.110 7.349 0.761 18880
6886 1 15 . 1 1 78 78 ILE N N 78 116.410 116.410 125.125 -8.715 18880
6887 1 15 . 1 1 78 78 ILE HA H 78 4.390 4.390 3.972 0.418 18880
6888 1 15 . 1 1 78 78 ILE C C 78 174.770 174.770 174.259 0.511 18880
6889 1 15 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.637 -0.447 18880
6890 1 15 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.453 0.727 18880
6891 1 15 . 1 1 78 78 ILE H H 78 8.930 8.930 7.681 1.249 18880
6892 1 15 . 1 1 79 79 ASP N N 79 125.220 125.220 125.751 -0.531 18880
6893 1 15 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.831 -0.331 18880
6894 1 15 . 1 1 79 79 ASP C C 79 176.490 176.490 176.879 -0.389 18880
6895 1 15 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.532 0.778 18880
6896 1 15 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.484 0.885 18880
6897 1 15 . 1 1 79 79 ASP H H 79 8.610 8.610 8.324 0.286 18880
6898 1 15 . 1 1 80 80 TYR N N 80 125.760 125.760 128.038 -2.278 18880
6899 1 15 . 1 1 80 80 TYR HA H 80 3.990 3.990 3.983 0.007 18880
6900 1 15 . 1 1 80 80 TYR C C 80 177.140 177.140 176.335 0.805 18880
6901 1 15 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.416 -0.836 18880
6902 1 15 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.558 0.332 18880
6903 1 15 . 1 1 80 80 TYR H H 80 8.460 8.460 8.477 -0.017 18880
6904 1 15 . 1 1 81 81 LYS N N 81 118.320 118.320 118.206 0.114 18880
6905 1 15 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.995 -0.095 18880
6906 1 15 . 1 1 81 81 LYS C C 81 179.090 179.090 178.698 0.392 18880
6907 1 15 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.248 0.332 18880
6908 1 15 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.346 0.413 18880
6909 1 15 . 1 1 81 81 LYS H H 81 8.410 8.410 8.458 -0.048 18880
6910 1 15 . 1 1 82 82 ALA N N 82 122.050 122.050 121.618 0.432 18880
6911 1 15 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.158 -0.028 18880
6912 1 15 . 1 1 82 82 ALA C C 82 179.740 179.740 179.764 -0.024 18880
6913 1 15 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.690 -0.170 18880
6914 1 15 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.221 0.319 18880
6915 1 15 . 1 1 82 82 ALA H H 82 7.770 7.770 7.991 -0.221 18880
6916 1 15 . 1 1 83 83 PHE N N 83 117.810 117.810 117.301 0.509 18880
6917 1 15 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.239 0.051 18880
6918 1 15 . 1 1 83 83 PHE C C 83 176.460 176.460 177.474 -1.014 18880
6919 1 15 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.173 -0.143 18880
6920 1 15 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.617 -0.097 18880
6921 1 15 . 1 1 83 83 PHE H H 83 7.780 7.780 7.787 -0.007 18880
6922 1 15 . 1 1 84 84 ALA N N 84 121.530 121.530 121.989 -0.459 18880
6923 1 15 . 1 1 84 84 ALA HA H 84 3.660 3.660 3.993 -0.333 18880
6924 1 15 . 1 1 84 84 ALA C C 84 179.010 179.010 178.953 0.057 18880
6925 1 15 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.033 0.997 18880
6926 1 15 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.131 -0.001 18880
6927 1 15 . 1 1 84 84 ALA H H 84 8.290 8.290 8.346 -0.056 18880
6928 1 15 . 1 1 85 85 ALA N N 85 117.720 117.720 121.014 -3.294 18880
6929 1 15 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.246 -0.166 18880
6930 1 15 . 1 1 85 85 ALA C C 85 179.570 179.570 178.767 0.803 18880
6931 1 15 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.512 -0.142 18880
6932 1 15 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.304 -0.014 18880
6933 1 15 . 1 1 85 85 ALA H H 85 7.700 7.700 8.716 -1.016 18880
6934 1 15 . 1 1 86 86 MET N N 86 116.570 116.570 117.299 -0.729 18880
6935 1 15 . 1 1 86 86 MET HA H 86 4.160 4.160 4.183 -0.023 18880
6936 1 15 . 1 1 86 86 MET C C 86 177.360 177.360 177.276 0.084 18880
6937 1 15 . 1 1 86 86 MET CA C 86 57.380 57.380 57.015 0.365 18880
6938 1 15 . 1 1 86 86 MET CB C 86 32.720 32.720 32.688 0.032 18880
6939 1 15 . 1 1 86 86 MET H H 86 7.560 7.560 7.414 0.146 18880
6940 1 15 . 1 1 87 87 LEU N N 87 119.090 119.090 117.459 1.631 18880
6941 1 15 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.097 -0.127 18880
6942 1 15 . 1 1 87 87 LEU C C 87 177.420 177.420 176.591 0.829 18880
6943 1 15 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.056 1.234 18880
6944 1 15 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.236 0.044 18880
6945 1 15 . 1 1 87 87 LEU H H 87 7.570 7.570 7.070 0.500 18880
6946 1 15 . 1 1 88 88 TYR N N 88 117.060 117.060 114.782 2.278 18880
6947 1 15 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.693 -0.103 18880
6948 1 15 . 1 1 88 88 TYR C C 88 175.870 175.870 175.277 0.593 18880
6949 1 15 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.136 2.704 18880
6950 1 15 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.107 0.533 18880
6951 1 15 . 1 1 88 88 TYR H H 88 7.740 7.740 7.100 0.640 18880
6952 1 15 . 1 1 89 89 SER N N 89 115.980 115.980 116.493 -0.513 18880
6953 1 15 . 1 1 89 89 SER HA H 89 4.440 4.440 4.595 -0.155 18880
6954 1 15 . 1 1 89 89 SER C C 89 174.460 174.460 174.930 -0.470 18880
6955 1 15 . 1 1 89 89 SER CA C 89 58.350 58.350 58.748 -0.399 18880
6956 1 15 . 1 1 89 89 SER CB C 89 63.990 63.990 63.168 0.822 18880
6957 1 15 . 1 1 89 89 SER H H 89 7.880 7.880 8.179 -0.299 18880
6958 1 15 . 1 1 90 90 VAL N N 90 120.910 120.910 116.288 4.622 18880
6959 1 15 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.449 -0.309 18880
6960 1 15 . 1 1 90 90 VAL C C 90 175.720 175.720 175.387 0.333 18880
6961 1 15 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.611 0.659 18880
6962 1 15 . 1 1 90 90 VAL CB C 90 32.840 32.840 31.368 1.472 18880
6963 1 15 . 1 1 90 90 VAL H H 90 8.020 8.020 7.725 0.295 18880
6964 1 15 . 1 1 91 91 ASP N N 91 123.620 123.620 119.085 4.535 18880
6965 1 15 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.323 0.307 18880
6966 1 15 . 1 1 91 91 ASP C C 91 176.000 176.000 175.611 0.389 18880
6967 1 15 . 1 1 91 91 ASP CA C 91 54.510 54.510 55.940 -1.430 18880
6968 1 15 . 1 1 91 91 ASP CB C 91 41.440 41.440 39.871 1.569 18880
6969 1 15 . 1 1 91 91 ASP H H 91 8.310 8.310 8.666 -0.356 18880
6970 1 15 . 1 1 92 92 GLU N N 92 122.170 122.170 116.929 5.241 18880
6971 1 15 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.440 -0.080 18880
6972 1 15 . 1 1 92 92 GLU C C 92 175.660 175.660 176.378 -0.718 18880
6973 1 15 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.427 0.063 18880
6974 1 15 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.687 2.163 18880
6975 1 15 . 1 1 92 92 GLU H H 92 8.320 8.320 8.293 0.027 18880
6976 1 16 . 1 1 10 10 HIS C C 10 176.040 176.040 174.364 1.676 18880
6977 1 16 . 1 1 11 11 SER N N 11 116.840 116.840 118.981 -2.141 18880
6978 1 16 . 1 1 11 11 SER HA H 11 4.430 4.430 4.488 -0.058 18880
6979 1 16 . 1 1 11 11 SER C C 11 174.630 174.630 174.399 0.231 18880
6980 1 16 . 1 1 11 11 SER CA C 11 58.350 58.350 58.507 -0.157 18880
6981 1 16 . 1 1 11 11 SER CB C 11 64.120 64.120 64.663 -0.543 18880
6982 1 16 . 1 1 11 11 SER H H 11 8.360 8.360 8.220 0.140 18880
6983 1 16 . 1 1 12 12 SER N N 12 118.030 118.030 116.328 1.702 18880
6984 1 16 . 1 1 12 12 SER HA H 12 4.440 4.440 4.521 -0.081 18880
6985 1 16 . 1 1 12 12 SER C C 12 174.880 174.880 173.994 0.886 18880
6986 1 16 . 1 1 12 12 SER CA C 12 58.680 58.680 58.288 0.392 18880
6987 1 16 . 1 1 12 12 SER CB C 12 63.890 63.890 63.555 0.335 18880
6988 1 16 . 1 1 12 12 SER H H 12 8.490 8.490 7.826 0.664 18880
6989 1 16 . 1 1 13 13 GLY N N 13 110.450 110.450 110.556 -0.106 18880
6990 1 16 . 1 1 13 13 GLY C C 13 173.790 173.790 175.797 -2.007 18880
6991 1 16 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.008 0.452 18880
6992 1 16 . 1 1 13 13 GLY H H 13 8.390 8.390 8.243 0.147 18880
6993 1 16 . 1 1 14 14 LEU N N 14 121.310 121.310 121.902 -0.592 18880
6994 1 16 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.269 0.071 18880
6995 1 16 . 1 1 14 14 LEU C C 14 176.930 176.930 176.609 0.321 18880
6996 1 16 . 1 1 14 14 LEU CA C 14 55.200 55.200 56.837 -1.637 18880
6997 1 16 . 1 1 14 14 LEU CB C 14 42.600 42.600 41.791 0.809 18880
6998 1 16 . 1 1 14 14 LEU H H 14 8.020 8.020 7.880 0.140 18880
6999 1 16 . 1 1 15 15 VAL N N 15 121.550 121.550 111.623 9.927 18880
7000 1 16 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.520 -0.150 18880
7001 1 16 . 1 1 15 15 VAL CA C 15 59.720 59.720 59.061 0.659 18880
7002 1 16 . 1 1 15 15 VAL CB C 15 32.770 32.770 32.046 0.724 18880
7003 1 16 . 1 1 15 15 VAL H H 15 8.030 8.030 7.464 0.566 18880
7004 1 16 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.363 0.007 18880
7005 1 16 . 1 1 16 16 PRO C C 16 176.720 176.720 176.977 -0.257 18880
7006 1 16 . 1 1 16 16 PRO CA C 16 62.650 62.650 65.194 -2.544 18880
7007 1 16 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.460 -0.220 18880
7008 1 16 . 1 1 17 17 ARG N N 17 121.890 121.890 113.958 7.932 18880
7009 1 16 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.280 0.000 18880
7010 1 16 . 1 1 17 17 ARG C C 17 176.940 176.940 175.129 1.811 18880
7011 1 16 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.649 -0.289 18880
7012 1 16 . 1 1 17 17 ARG CB C 17 31.050 31.050 31.427 -0.377 18880
7013 1 16 . 1 1 17 17 ARG H H 17 8.450 8.450 8.149 0.301 18880
7014 1 16 . 1 1 18 18 GLY N N 18 110.160 110.160 108.556 1.604 18880
7015 1 16 . 1 1 18 18 GLY C C 18 174.110 174.110 173.570 0.540 18880
7016 1 16 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.051 0.339 18880
7017 1 16 . 1 1 18 18 GLY H H 18 8.480 8.480 7.859 0.621 18880
7018 1 16 . 1 1 19 19 SER N N 19 115.500 115.500 116.674 -1.174 18880
7019 1 16 . 1 1 19 19 SER HA H 19 4.400 4.400 4.379 0.021 18880
7020 1 16 . 1 1 19 19 SER C C 19 174.380 174.380 174.370 0.010 18880
7021 1 16 . 1 1 19 19 SER CA C 19 58.610 58.610 58.402 0.208 18880
7022 1 16 . 1 1 19 19 SER CB C 19 63.830 63.830 63.946 -0.116 18880
7023 1 16 . 1 1 19 19 SER H H 19 8.210 8.210 8.178 0.032 18880
7024 1 16 . 1 1 20 20 HIS N N 20 120.770 120.770 120.938 -0.168 18880
7025 1 16 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.430 0.180 18880
7026 1 16 . 1 1 20 20 HIS C C 20 174.870 174.870 175.600 -0.730 18880
7027 1 16 . 1 1 20 20 HIS CA C 20 56.130 56.130 57.938 -1.808 18880
7028 1 16 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.248 -0.538 18880
7029 1 16 . 1 1 20 20 HIS H H 20 8.590 8.590 8.401 0.189 18880
7030 1 16 . 1 1 21 21 MET N N 21 121.440 121.440 115.439 6.001 18880
7031 1 16 . 1 1 21 21 MET HA H 21 4.470 4.470 4.616 -0.146 18880
7032 1 16 . 1 1 21 21 MET C C 21 176.030 176.030 176.601 -0.571 18880
7033 1 16 . 1 1 21 21 MET CA C 21 55.490 55.490 55.925 -0.435 18880
7034 1 16 . 1 1 21 21 MET CB C 21 33.170 33.170 32.780 0.390 18880
7035 1 16 . 1 1 21 21 MET H H 21 8.310 8.310 8.306 0.004 18880
7036 1 16 . 1 1 22 22 SER N N 22 116.860 116.860 115.525 1.335 18880
7037 1 16 . 1 1 22 22 SER HA H 22 4.430 4.430 4.576 -0.146 18880
7038 1 16 . 1 1 22 22 SER C C 22 174.630 174.630 175.268 -0.638 18880
7039 1 16 . 1 1 22 22 SER CA C 22 58.410 58.410 58.862 -0.452 18880
7040 1 16 . 1 1 22 22 SER CB C 22 64.030 64.030 63.640 0.390 18880
7041 1 16 . 1 1 22 22 SER H H 22 8.340 8.340 8.218 0.122 18880
7042 1 16 . 1 1 23 23 ASP N N 23 122.660 122.660 122.338 0.322 18880
7043 1 16 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.632 -0.082 18880
7044 1 16 . 1 1 23 23 ASP C C 23 176.860 176.860 177.152 -0.292 18880
7045 1 16 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.339 -0.009 18880
7046 1 16 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.786 0.214 18880
7047 1 16 . 1 1 23 23 ASP H H 23 8.540 8.540 8.386 0.154 18880
7048 1 16 . 1 1 24 24 GLU N N 24 120.400 120.400 118.324 2.076 18880
7049 1 16 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.018 0.122 18880
7050 1 16 . 1 1 24 24 GLU C C 24 177.540 177.540 177.080 0.460 18880
7051 1 16 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.540 -0.180 18880
7052 1 16 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.551 0.199 18880
7053 1 16 . 1 1 24 24 GLU H H 24 8.610 8.610 8.497 0.113 18880
7054 1 16 . 1 1 25 25 LYS N N 25 120.390 120.390 116.389 4.001 18880
7055 1 16 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.291 -0.101 18880
7056 1 16 . 1 1 25 25 LYS C C 25 177.490 177.490 178.504 -1.014 18880
7057 1 16 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.801 0.309 18880
7058 1 16 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.866 -0.376 18880
7059 1 16 . 1 1 25 25 LYS H H 25 8.210 8.210 7.779 0.431 18880
7060 1 16 . 1 1 26 26 THR N N 26 114.880 114.880 116.369 -1.489 18880
7061 1 16 . 1 1 26 26 THR HA H 26 4.040 4.040 4.125 -0.085 18880
7062 1 16 . 1 1 26 26 THR C C 26 175.430 175.430 176.814 -1.384 18880
7063 1 16 . 1 1 26 26 THR CA C 26 64.620 64.620 65.570 -0.950 18880
7064 1 16 . 1 1 26 26 THR CB C 26 69.110 69.110 68.675 0.435 18880
7065 1 16 . 1 1 26 26 THR H H 26 8.080 8.080 7.789 0.291 18880
7066 1 16 . 1 1 27 27 GLN N N 27 120.940 120.940 121.979 -1.039 18880
7067 1 16 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.110 0.080 18880
7068 1 16 . 1 1 27 27 GLN C C 27 177.280 177.280 177.430 -0.150 18880
7069 1 16 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.518 -0.968 18880
7070 1 16 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.398 0.692 18880
7071 1 16 . 1 1 27 27 GLN H H 27 8.240 8.240 7.898 0.342 18880
7072 1 16 . 1 1 28 28 LEU N N 28 121.860 121.860 118.747 3.113 18880
7073 1 16 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.375 -0.205 18880
7074 1 16 . 1 1 28 28 LEU C C 28 177.750 177.750 177.819 -0.069 18880
7075 1 16 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.501 1.579 18880
7076 1 16 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.533 -0.263 18880
7077 1 16 . 1 1 28 28 LEU H H 28 7.950 7.950 7.415 0.535 18880
7078 1 16 . 1 1 29 29 ILE N N 29 119.260 119.260 119.481 -0.221 18880
7079 1 16 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.077 -0.177 18880
7080 1 16 . 1 1 29 29 ILE C C 29 177.140 177.140 177.873 -0.733 18880
7081 1 16 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.727 -0.427 18880
7082 1 16 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.880 1.399 18880
7083 1 16 . 1 1 29 29 ILE H H 29 7.950 7.950 7.915 0.035 18880
7084 1 16 . 1 1 30 30 GLU N N 30 120.500 120.500 118.944 1.556 18880
7085 1 16 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.309 -0.259 18880
7086 1 16 . 1 1 30 30 GLU C C 30 177.560 177.560 176.558 1.002 18880
7087 1 16 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.896 0.194 18880
7088 1 16 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.085 0.505 18880
7089 1 16 . 1 1 30 30 GLU H H 30 8.220 8.220 8.067 0.153 18880
7090 1 16 . 1 1 31 31 ALA N N 31 121.550 121.550 119.876 1.674 18880
7091 1 16 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.706 -0.556 18880
7092 1 16 . 1 1 31 31 ALA C C 31 178.550 178.550 178.783 -0.233 18880
7093 1 16 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.525 0.275 18880
7094 1 16 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.508 -0.878 18880
7095 1 16 . 1 1 31 31 ALA H H 31 7.890 7.890 7.761 0.129 18880
7096 1 16 . 1 1 32 32 PHE N N 32 117.240 117.240 118.239 -0.999 18880
7097 1 16 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.201 0.099 18880
7098 1 16 . 1 1 32 32 PHE C C 32 176.210 176.210 176.551 -0.341 18880
7099 1 16 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.649 -2.309 18880
7100 1 16 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.097 0.653 18880
7101 1 16 . 1 1 32 32 PHE H H 32 7.930 7.930 7.924 0.006 18880
7102 1 16 . 1 1 33 33 TYR N N 33 119.050 119.050 114.398 4.652 18880
7103 1 16 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.677 -0.347 18880
7104 1 16 . 1 1 33 33 TYR C C 33 175.680 175.680 175.553 0.127 18880
7105 1 16 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.440 1.480 18880
7106 1 16 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.162 1.378 18880
7107 1 16 . 1 1 33 33 TYR H H 33 7.950 7.950 8.494 -0.544 18880
7108 1 16 . 1 1 34 34 ASN N N 34 118.390 118.390 116.390 2.000 18880
7109 1 16 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.800 -0.170 18880
7110 1 16 . 1 1 34 34 ASN C C 34 174.810 174.810 174.500 0.310 18880
7111 1 16 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.476 -0.326 18880
7112 1 16 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.202 -0.222 18880
7113 1 16 . 1 1 34 34 ASN H H 34 7.960 7.960 8.041 -0.081 18880
7114 1 16 . 1 1 35 35 PHE N N 35 120.670 120.670 120.367 0.303 18880
7115 1 16 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.510 -0.060 18880
7116 1 16 . 1 1 35 35 PHE C C 35 175.310 175.310 173.153 2.157 18880
7117 1 16 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.367 -0.047 18880
7118 1 16 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.844 -0.424 18880
7119 1 16 . 1 1 35 35 PHE H H 35 7.830 7.830 7.874 -0.044 18880
7120 1 16 . 1 1 36 36 ASP N N 36 122.400 122.400 119.273 3.127 18880
7121 1 16 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.531 0.059 18880
7122 1 16 . 1 1 36 36 ASP C C 36 176.150 176.150 177.137 -0.987 18880
7123 1 16 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.090 0.980 18880
7124 1 16 . 1 1 36 36 ASP CB C 36 41.320 41.320 39.817 1.503 18880
7125 1 16 . 1 1 36 36 ASP H H 36 8.180 8.180 7.901 0.279 18880
7126 1 16 . 1 1 37 37 GLY N N 37 108.560 108.560 109.360 -0.800 18880
7127 1 16 . 1 1 37 37 GLY C C 37 173.660 173.660 174.686 -1.026 18880
7128 1 16 . 1 1 37 37 GLY CA C 37 45.610 45.610 46.256 -0.646 18880
7129 1 16 . 1 1 37 37 GLY H H 37 7.680 7.680 8.260 -0.580 18880
7130 1 16 . 1 1 38 38 ASP N N 38 120.010 120.010 118.087 1.923 18880
7131 1 16 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.341 0.259 18880
7132 1 16 . 1 1 38 38 ASP CA C 38 54.260 54.260 53.647 0.613 18880
7133 1 16 . 1 1 38 38 ASP CB C 38 41.450 41.450 39.703 1.747 18880
7134 1 16 . 1 1 38 38 ASP H H 38 8.220 8.220 8.053 0.167 18880
7135 1 16 . 1 1 39 39 TYR N N 39 121.030 121.030 117.088 3.942 18880
7136 1 16 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.040 0.350 18880
7137 1 16 . 1 1 39 39 TYR C C 39 175.290 175.290 174.670 0.620 18880
7138 1 16 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.832 -0.632 18880
7139 1 16 . 1 1 39 39 TYR CB C 39 39.170 39.170 36.993 2.177 18880
7140 1 16 . 1 1 39 39 TYR H H 39 8.090 8.090 7.976 0.114 18880
7141 1 16 . 1 1 40 40 ASP N N 40 122.020 122.020 122.359 -0.339 18880
7142 1 16 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.569 0.031 18880
7143 1 16 . 1 1 40 40 ASP C C 40 175.970 175.970 176.078 -0.108 18880
7144 1 16 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.162 0.058 18880
7145 1 16 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.907 -0.387 18880
7146 1 16 . 1 1 40 40 ASP H H 40 8.200 8.200 8.206 -0.006 18880
7147 1 16 . 1 1 41 41 GLY N N 41 108.330 108.330 109.803 -1.473 18880
7148 1 16 . 1 1 41 41 GLY C C 41 173.000 173.000 173.114 -0.114 18880
7149 1 16 . 1 1 41 41 GLY CA C 41 45.420 45.420 45.229 0.191 18880
7150 1 16 . 1 1 41 41 GLY H H 41 7.830 7.830 8.525 -0.695 18880
7151 1 16 . 1 1 42 42 PHE N N 42 118.600 118.600 119.060 -0.460 18880
7152 1 16 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.911 0.349 18880
7153 1 16 . 1 1 42 42 PHE C C 42 175.660 175.660 173.576 2.084 18880
7154 1 16 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.441 -0.281 18880
7155 1 16 . 1 1 42 42 PHE CB C 42 41.170 41.170 41.845 -0.675 18880
7156 1 16 . 1 1 42 42 PHE H H 42 8.150 8.150 7.459 0.691 18880
7157 1 16 . 1 1 43 43 VAL N N 43 119.180 119.180 127.216 -8.036 18880
7158 1 16 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.512 0.158 18880
7159 1 16 . 1 1 43 43 VAL C C 43 175.110 175.110 173.834 1.276 18880
7160 1 16 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.043 0.577 18880
7161 1 16 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.855 -1.974 18880
7162 1 16 . 1 1 43 43 VAL H H 43 9.070 9.070 8.084 0.986 18880
7163 1 16 . 1 1 44 44 SER N N 44 121.380 121.380 121.227 0.153 18880
7164 1 16 . 1 1 44 44 SER HA H 44 4.570 4.570 4.458 0.112 18880
7165 1 16 . 1 1 44 44 SER C C 44 175.660 175.660 175.300 0.360 18880
7166 1 16 . 1 1 44 44 SER CA C 44 57.720 57.720 56.596 1.124 18880
7167 1 16 . 1 1 44 44 SER CB C 44 63.690 63.690 64.166 -0.476 18880
7168 1 16 . 1 1 44 44 SER H H 44 9.140 9.140 8.206 0.934 18880
7169 1 16 . 1 1 45 45 VAL N N 45 122.720 122.720 124.328 -1.608 18880
7170 1 16 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.312 0.188 18880
7171 1 16 . 1 1 45 45 VAL C C 45 177.240 177.240 177.331 -0.091 18880
7172 1 16 . 1 1 45 45 VAL CA C 45 66.270 66.270 67.211 -0.941 18880
7173 1 16 . 1 1 45 45 VAL CB C 45 31.450 31.450 31.035 0.415 18880
7174 1 16 . 1 1 45 45 VAL H H 45 8.140 8.140 8.346 -0.206 18880
7175 1 16 . 1 1 46 46 GLU N N 46 118.990 118.990 117.357 1.633 18880
7176 1 16 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.852 0.128 18880
7177 1 16 . 1 1 46 46 GLU C C 46 179.460 179.460 179.190 0.270 18880
7178 1 16 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.450 0.110 18880
7179 1 16 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.011 0.149 18880
7180 1 16 . 1 1 46 46 GLU H H 46 8.230 8.230 7.817 0.413 18880
7181 1 16 . 1 1 47 47 GLU N N 47 120.120 120.120 118.158 1.962 18880
7182 1 16 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.222 -0.142 18880
7183 1 16 . 1 1 47 47 GLU C C 47 179.170 179.170 178.757 0.413 18880
7184 1 16 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.606 1.284 18880
7185 1 16 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.361 0.459 18880
7186 1 16 . 1 1 47 47 GLU H H 47 7.880 7.880 7.615 0.265 18880
7187 1 16 . 1 1 48 48 PHE N N 48 120.830 120.830 121.749 -0.919 18880
7188 1 16 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.247 -0.057 18880
7189 1 16 . 1 1 48 48 PHE C C 48 176.920 176.920 177.507 -0.587 18880
7190 1 16 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.284 0.586 18880
7191 1 16 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.001 0.259 18880
7192 1 16 . 1 1 48 48 PHE H H 48 8.600 8.600 8.350 0.250 18880
7193 1 16 . 1 1 49 49 ARG N N 49 118.470 118.470 119.436 -0.966 18880
7194 1 16 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.104 -0.244 18880
7195 1 16 . 1 1 49 49 ARG C C 49 178.090 178.090 178.775 -0.685 18880
7196 1 16 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.464 -0.394 18880
7197 1 16 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.830 0.310 18880
7198 1 16 . 1 1 49 49 ARG H H 49 8.650 8.650 8.988 -0.338 18880
7199 1 16 . 1 1 50 50 GLY N N 50 105.080 105.080 105.847 -0.767 18880
7200 1 16 . 1 1 50 50 GLY C C 50 175.090 175.090 175.856 -0.766 18880
7201 1 16 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.895 -0.215 18880
7202 1 16 . 1 1 50 50 GLY H H 50 7.620 7.620 8.009 -0.389 18880
7203 1 16 . 1 1 51 51 ILE N N 51 121.440 121.440 121.796 -0.356 18880
7204 1 16 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.947 -0.117 18880
7205 1 16 . 1 1 51 51 ILE C C 51 178.300 178.300 177.526 0.774 18880
7206 1 16 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.215 -0.375 18880
7207 1 16 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.372 -0.062 18880
7208 1 16 . 1 1 51 51 ILE H H 51 7.470 7.470 7.205 0.265 18880
7209 1 16 . 1 1 52 52 ILE N N 52 118.930 118.930 119.430 -0.500 18880
7210 1 16 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.791 -0.051 18880
7211 1 16 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.061 0.699 18880
7212 1 16 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.420 1.610 18880
7213 1 16 . 1 1 52 52 ILE H H 52 7.790 7.790 8.341 -0.551 18880
7214 1 16 . 1 1 53 53 ARG N N 53 120.140 120.140 119.718 0.422 18880
7215 1 16 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.981 0.109 18880
7216 1 16 . 1 1 53 53 ARG C C 53 177.380 177.380 176.973 0.407 18880
7217 1 16 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.778 0.332 18880
7218 1 16 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.567 -0.987 18880
7219 1 16 . 1 1 53 53 ARG H H 53 7.930 7.930 8.067 -0.137 18880
7220 1 16 . 1 1 54 54 ASP N N 54 117.500 117.500 114.970 2.530 18880
7221 1 16 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.754 -0.154 18880
7222 1 16 . 1 1 54 54 ASP C C 54 176.930 176.930 176.268 0.662 18880
7223 1 16 . 1 1 54 54 ASP CA C 54 55.540 55.540 53.790 1.750 18880
7224 1 16 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.936 0.164 18880
7225 1 16 . 1 1 54 54 ASP H H 54 7.870 7.870 8.081 -0.211 18880
7226 1 16 . 1 1 55 55 GLY N N 55 106.370 106.370 107.880 -1.510 18880
7227 1 16 . 1 1 55 55 GLY C C 55 173.460 173.460 173.807 -0.347 18880
7228 1 16 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.466 0.534 18880
7229 1 16 . 1 1 55 55 GLY H H 55 7.880 7.880 7.830 0.050 18880
7230 1 16 . 1 1 56 56 LEU N N 56 122.630 122.630 121.314 1.316 18880
7231 1 16 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.774 -0.004 18880
7232 1 16 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.219 1.271 18880
7233 1 16 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.855 0.265 18880
7234 1 16 . 1 1 56 56 LEU H H 56 8.220 8.220 7.787 0.433 18880
7235 1 16 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.458 0.122 18880
7236 1 16 . 1 1 57 57 PRO C C 57 176.150 176.150 175.453 0.697 18880
7237 1 16 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.972 -0.553 18880
7238 1 16 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.538 0.202 18880
7239 1 16 . 1 1 58 58 MET N N 58 121.810 121.810 123.237 -1.427 18880
7240 1 16 . 1 1 58 58 MET HA H 58 4.630 4.630 4.639 -0.009 18880
7241 1 16 . 1 1 58 58 MET C C 58 176.150 176.150 174.780 1.370 18880
7242 1 16 . 1 1 58 58 MET CA C 58 55.560 55.560 54.518 1.042 18880
7243 1 16 . 1 1 58 58 MET CB C 58 36.820 36.820 36.103 0.716 18880
7244 1 16 . 1 1 58 58 MET H H 58 7.690 7.690 7.807 -0.117 18880
7245 1 16 . 1 1 59 59 THR N N 59 114.180 114.180 114.252 -0.072 18880
7246 1 16 . 1 1 59 59 THR HA H 59 4.450 4.450 4.535 -0.085 18880
7247 1 16 . 1 1 59 59 THR C C 59 175.170 175.170 175.612 -0.442 18880
7248 1 16 . 1 1 59 59 THR CA C 59 60.780 60.780 60.428 0.352 18880
7249 1 16 . 1 1 59 59 THR CB C 59 71.060 71.060 70.343 0.717 18880
7250 1 16 . 1 1 59 59 THR H H 59 8.940 8.940 8.181 0.759 18880
7251 1 16 . 1 1 60 60 GLU N N 60 120.620 120.620 127.678 -7.058 18880
7252 1 16 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.755 0.255 18880
7253 1 16 . 1 1 60 60 GLU C C 60 179.010 179.010 177.933 1.077 18880
7254 1 16 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.669 0.151 18880
7255 1 16 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.890 0.160 18880
7256 1 16 . 1 1 60 60 GLU H H 60 8.850 8.850 9.011 -0.161 18880
7257 1 16 . 1 1 61 61 ALA N N 61 121.080 121.080 122.200 -1.120 18880
7258 1 16 . 1 1 61 61 ALA HA H 61 4.140 4.140 4.093 0.047 18880
7259 1 16 . 1 1 61 61 ALA C C 61 180.350 180.350 179.128 1.222 18880
7260 1 16 . 1 1 61 61 ALA CA C 61 55.090 55.090 54.575 0.515 18880
7261 1 16 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.959 0.251 18880
7262 1 16 . 1 1 61 61 ALA H H 61 8.370 8.370 8.346 0.024 18880
7263 1 16 . 1 1 62 62 GLU N N 62 118.890 118.890 116.489 2.401 18880
7264 1 16 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.885 0.115 18880
7265 1 16 . 1 1 62 62 GLU C C 62 179.690 179.690 178.140 1.550 18880
7266 1 16 . 1 1 62 62 GLU CA C 62 58.990 58.990 56.871 2.119 18880
7267 1 16 . 1 1 62 62 GLU CB C 62 30.310 30.310 29.707 0.603 18880
7268 1 16 . 1 1 62 62 GLU H H 62 7.680 7.680 8.056 -0.376 18880
7269 1 16 . 1 1 63 63 ILE N N 63 122.340 122.340 118.790 3.550 18880
7270 1 16 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.423 0.147 18880
7271 1 16 . 1 1 63 63 ILE C C 63 177.260 177.260 178.087 -0.827 18880
7272 1 16 . 1 1 63 63 ILE CA C 63 65.890 65.890 63.839 2.051 18880
7273 1 16 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.393 0.587 18880
7274 1 16 . 1 1 63 63 ILE H H 63 8.420 8.420 7.848 0.572 18880
7275 1 16 . 1 1 64 64 THR N N 64 116.970 116.970 117.101 -0.131 18880
7276 1 16 . 1 1 64 64 THR HA H 64 3.940 3.940 4.193 -0.253 18880
7277 1 16 . 1 1 64 64 THR C C 64 176.520 176.520 176.435 0.085 18880
7278 1 16 . 1 1 64 64 THR CA C 64 67.060 67.060 68.044 -0.984 18880
7279 1 16 . 1 1 64 64 THR CB C 64 68.750 68.750 68.350 0.400 18880
7280 1 16 . 1 1 64 64 THR H H 64 8.310 8.310 8.635 -0.325 18880
7281 1 16 . 1 1 65 65 GLU N N 65 120.760 120.760 120.668 0.092 18880
7282 1 16 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.197 -0.167 18880
7283 1 16 . 1 1 65 65 GLU C C 65 175.830 175.830 178.637 -2.807 18880
7284 1 16 . 1 1 65 65 GLU CA C 65 59.500 59.500 59.240 0.260 18880
7285 1 16 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.571 0.199 18880
7286 1 16 . 1 1 65 65 GLU H H 65 7.970 7.970 7.735 0.235 18880
7287 1 16 . 1 1 66 66 PHE N N 66 120.940 120.940 117.061 3.879 18880
7288 1 16 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.470 -0.230 18880
7289 1 16 . 1 1 66 66 PHE C C 66 177.330 177.330 176.951 0.379 18880
7290 1 16 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.849 2.351 18880
7291 1 16 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.824 -0.294 18880
7292 1 16 . 1 1 66 66 PHE H H 66 8.100 8.100 7.434 0.666 18880
7293 1 16 . 1 1 67 67 PHE N N 67 118.110 118.110 119.396 -1.286 18880
7294 1 16 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.351 -0.401 18880
7295 1 16 . 1 1 67 67 PHE C C 67 178.090 178.090 177.876 0.214 18880
7296 1 16 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.837 1.363 18880
7297 1 16 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.729 -0.479 18880
7298 1 16 . 1 1 67 67 PHE H H 67 8.380 8.380 8.428 -0.048 18880
7299 1 16 . 1 1 68 68 GLU N N 68 119.650 119.650 118.399 1.251 18880
7300 1 16 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.213 -0.203 18880
7301 1 16 . 1 1 68 68 GLU C C 68 177.910 177.910 177.668 0.242 18880
7302 1 16 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.663 0.577 18880
7303 1 16 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.373 -0.003 18880
7304 1 16 . 1 1 68 68 GLU H H 68 8.230 8.230 8.083 0.147 18880
7305 1 16 . 1 1 69 69 ALA N N 69 119.090 119.090 120.416 -1.326 18880
7306 1 16 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.303 -0.123 18880
7307 1 16 . 1 1 69 69 ALA C C 69 179.030 179.030 178.428 0.602 18880
7308 1 16 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.862 -0.262 18880
7309 1 16 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.258 0.522 18880
7310 1 16 . 1 1 69 69 ALA H H 69 7.340 7.340 7.863 -0.523 18880
7311 1 16 . 1 1 70 70 ALA N N 70 118.670 118.670 119.893 -1.223 18880
7312 1 16 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.318 -0.298 18880
7313 1 16 . 1 1 70 70 ALA C C 70 176.820 176.820 176.867 -0.047 18880
7314 1 16 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.500 0.590 18880
7315 1 16 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.297 -0.687 18880
7316 1 16 . 1 1 70 70 ALA H H 70 8.050 8.050 7.754 0.296 18880
7317 1 16 . 1 1 71 71 ASP N N 71 116.780 116.780 118.283 -1.503 18880
7318 1 16 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.173 0.047 18880
7319 1 16 . 1 1 71 71 ASP CA C 71 52.150 52.150 51.044 1.106 18880
7320 1 16 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.098 -2.188 18880
7321 1 16 . 1 1 71 71 ASP H H 71 8.010 8.010 7.629 0.381 18880
7322 1 16 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.521 -0.051 18880
7323 1 16 . 1 1 72 72 PRO C C 72 177.970 177.970 176.665 1.305 18880
7324 1 16 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.443 0.467 18880
7325 1 16 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.349 -0.469 18880
7326 1 16 . 1 1 73 73 ASN N N 73 114.930 114.930 114.269 0.661 18880
7327 1 16 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.598 0.282 18880
7328 1 16 . 1 1 73 73 ASN C C 73 174.880 174.880 175.190 -0.310 18880
7329 1 16 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.837 -0.998 18880
7330 1 16 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.610 -0.230 18880
7331 1 16 . 1 1 73 73 ASN H H 73 9.030 9.030 8.290 0.740 18880
7332 1 16 . 1 1 74 74 ASN N N 74 118.340 118.340 113.284 5.056 18880
7333 1 16 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.465 -0.105 18880
7334 1 16 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.958 0.632 18880
7335 1 16 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.121 1.039 18880
7336 1 16 . 1 1 74 74 ASN H H 74 8.320 8.320 8.470 -0.150 18880
7337 1 16 . 1 1 75 75 THR N N 75 113.450 113.450 113.767 -0.317 18880
7338 1 16 . 1 1 75 75 THR HA H 75 4.210 4.210 4.384 -0.174 18880
7339 1 16 . 1 1 75 75 THR CA C 75 63.410 63.410 61.951 1.459 18880
7340 1 16 . 1 1 75 75 THR CB C 75 70.540 70.540 68.806 1.734 18880
7341 1 16 . 1 1 75 75 THR H H 75 9.870 9.870 9.014 0.856 18880
7342 1 16 . 1 1 76 76 GLY N N 76 111.810 111.810 108.146 3.664 18880
7343 1 16 . 1 1 76 76 GLY C C 76 173.670 173.670 173.416 0.254 18880
7344 1 16 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.810 -0.690 18880
7345 1 16 . 1 1 76 76 GLY H H 76 10.250 10.250 8.311 1.939 18880
7346 1 16 . 1 1 77 77 PHE N N 77 120.560 120.560 117.621 2.939 18880
7347 1 16 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.071 0.079 18880
7348 1 16 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.037 1.143 18880
7349 1 16 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.751 0.749 18880
7350 1 16 . 1 1 77 77 PHE H H 77 8.110 8.110 7.894 0.216 18880
7351 1 16 . 1 1 78 78 ILE N N 78 116.410 116.410 116.431 -0.021 18880
7352 1 16 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.249 0.141 18880
7353 1 16 . 1 1 78 78 ILE C C 78 174.770 174.770 173.522 1.248 18880
7354 1 16 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.993 -0.803 18880
7355 1 16 . 1 1 78 78 ILE CB C 78 41.180 41.180 42.631 -1.451 18880
7356 1 16 . 1 1 78 78 ILE H H 78 8.930 8.930 7.834 1.096 18880
7357 1 16 . 1 1 79 79 ASP N N 79 125.220 125.220 123.500 1.720 18880
7358 1 16 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.649 -0.149 18880
7359 1 16 . 1 1 79 79 ASP C C 79 176.490 176.490 176.750 -0.260 18880
7360 1 16 . 1 1 79 79 ASP CA C 79 53.310 53.310 51.503 1.807 18880
7361 1 16 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.633 0.737 18880
7362 1 16 . 1 1 79 79 ASP H H 79 8.610 8.610 8.634 -0.024 18880
7363 1 16 . 1 1 80 80 TYR N N 80 125.760 125.760 128.821 -3.061 18880
7364 1 16 . 1 1 80 80 TYR HA H 80 3.990 3.990 3.977 0.013 18880
7365 1 16 . 1 1 80 80 TYR C C 80 177.140 177.140 176.943 0.197 18880
7366 1 16 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.556 -0.976 18880
7367 1 16 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.820 0.070 18880
7368 1 16 . 1 1 80 80 TYR H H 80 8.460 8.460 8.330 0.130 18880
7369 1 16 . 1 1 81 81 LYS N N 81 118.320 118.320 118.474 -0.154 18880
7370 1 16 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.995 -0.095 18880
7371 1 16 . 1 1 81 81 LYS C C 81 179.090 179.090 178.515 0.575 18880
7372 1 16 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.675 -0.094 18880
7373 1 16 . 1 1 81 81 LYS CB C 81 31.760 31.760 32.174 -0.414 18880
7374 1 16 . 1 1 81 81 LYS H H 81 8.410 8.410 8.023 0.387 18880
7375 1 16 . 1 1 82 82 ALA N N 82 122.050 122.050 121.514 0.536 18880
7376 1 16 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.139 -0.009 18880
7377 1 16 . 1 1 82 82 ALA C C 82 179.740 179.740 179.165 0.575 18880
7378 1 16 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.688 -0.168 18880
7379 1 16 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.331 0.209 18880
7380 1 16 . 1 1 82 82 ALA H H 82 7.770 7.770 8.073 -0.303 18880
7381 1 16 . 1 1 83 83 PHE N N 83 117.810 117.810 117.255 0.555 18880
7382 1 16 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.418 -0.128 18880
7383 1 16 . 1 1 83 83 PHE C C 83 176.460 176.460 177.694 -1.234 18880
7384 1 16 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.442 0.588 18880
7385 1 16 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.982 -0.462 18880
7386 1 16 . 1 1 83 83 PHE H H 83 7.780 7.780 7.880 -0.100 18880
7387 1 16 . 1 1 84 84 ALA N N 84 121.530 121.530 122.492 -0.962 18880
7388 1 16 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.089 -0.429 18880
7389 1 16 . 1 1 84 84 ALA C C 84 179.010 179.010 178.999 0.011 18880
7390 1 16 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.064 0.966 18880
7391 1 16 . 1 1 84 84 ALA CB C 84 18.130 18.130 17.945 0.185 18880
7392 1 16 . 1 1 84 84 ALA H H 84 8.290 8.290 8.412 -0.122 18880
7393 1 16 . 1 1 85 85 ALA N N 85 117.720 117.720 120.717 -2.997 18880
7394 1 16 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.294 -0.214 18880
7395 1 16 . 1 1 85 85 ALA C C 85 179.570 179.570 178.161 1.409 18880
7396 1 16 . 1 1 85 85 ALA CA C 85 54.370 54.370 53.826 0.544 18880
7397 1 16 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.655 -0.365 18880
7398 1 16 . 1 1 85 85 ALA H H 85 7.700 7.700 8.152 -0.452 18880
7399 1 16 . 1 1 86 86 MET N N 86 116.570 116.570 116.692 -0.122 18880
7400 1 16 . 1 1 86 86 MET HA H 86 4.160 4.160 4.250 -0.090 18880
7401 1 16 . 1 1 86 86 MET C C 86 177.360 177.360 177.604 -0.244 18880
7402 1 16 . 1 1 86 86 MET CA C 86 57.380 57.380 56.910 0.470 18880
7403 1 16 . 1 1 86 86 MET CB C 86 32.720 32.720 32.762 -0.042 18880
7404 1 16 . 1 1 86 86 MET H H 86 7.560 7.560 7.401 0.160 18880
7405 1 16 . 1 1 87 87 LEU N N 87 119.090 119.090 116.726 2.364 18880
7406 1 16 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.073 -0.103 18880
7407 1 16 . 1 1 87 87 LEU C C 87 177.420 177.420 176.692 0.728 18880
7408 1 16 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.035 1.255 18880
7409 1 16 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.120 0.160 18880
7410 1 16 . 1 1 87 87 LEU H H 87 7.570 7.570 7.185 0.385 18880
7411 1 16 . 1 1 88 88 TYR N N 88 117.060 117.060 113.927 3.133 18880
7412 1 16 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.806 -0.216 18880
7413 1 16 . 1 1 88 88 TYR C C 88 175.870 175.870 175.222 0.648 18880
7414 1 16 . 1 1 88 88 TYR CA C 88 57.840 57.840 54.681 3.159 18880
7415 1 16 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.411 0.229 18880
7416 1 16 . 1 1 88 88 TYR H H 88 7.740 7.740 7.138 0.602 18880
7417 1 16 . 1 1 89 89 SER N N 89 115.980 115.980 119.136 -3.156 18880
7418 1 16 . 1 1 89 89 SER HA H 89 4.440 4.440 4.472 -0.032 18880
7419 1 16 . 1 1 89 89 SER C C 89 174.460 174.460 174.476 -0.016 18880
7420 1 16 . 1 1 89 89 SER CA C 89 58.350 58.350 59.424 -1.074 18880
7421 1 16 . 1 1 89 89 SER CB C 89 63.990 63.990 61.793 2.197 18880
7422 1 16 . 1 1 89 89 SER H H 89 7.880 7.880 8.230 -0.350 18880
7423 1 16 . 1 1 90 90 VAL N N 90 120.910 120.910 118.791 2.119 18880
7424 1 16 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.354 -0.214 18880
7425 1 16 . 1 1 90 90 VAL C C 90 175.720 175.720 174.521 1.199 18880
7426 1 16 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.981 0.289 18880
7427 1 16 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.746 0.094 18880
7428 1 16 . 1 1 90 90 VAL H H 90 8.020 8.020 8.091 -0.071 18880
7429 1 16 . 1 1 91 91 ASP N N 91 123.620 123.620 123.476 0.144 18880
7430 1 16 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.459 0.171 18880
7431 1 16 . 1 1 91 91 ASP C C 91 176.000 176.000 175.426 0.574 18880
7432 1 16 . 1 1 91 91 ASP CA C 91 54.510 54.510 55.028 -0.518 18880
7433 1 16 . 1 1 91 91 ASP CB C 91 41.440 41.440 40.649 0.791 18880
7434 1 16 . 1 1 91 91 ASP H H 91 8.310 8.310 8.950 -0.640 18880
7435 1 16 . 1 1 92 92 GLU N N 92 122.170 122.170 120.363 1.807 18880
7436 1 16 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.394 -0.034 18880
7437 1 16 . 1 1 92 92 GLU C C 92 175.660 175.660 175.517 0.143 18880
7438 1 16 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.616 -0.126 18880
7439 1 16 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.974 1.876 18880
7440 1 16 . 1 1 92 92 GLU H H 92 8.320 8.320 8.429 -0.109 18880
7441 1 17 . 1 1 10 10 HIS C C 10 176.040 176.040 175.080 0.960 18880
7442 1 17 . 1 1 11 11 SER N N 11 116.840 116.840 117.088 -0.248 18880
7443 1 17 . 1 1 11 11 SER HA H 11 4.430 4.430 4.585 -0.155 18880
7444 1 17 . 1 1 11 11 SER C C 11 174.630 174.630 174.349 0.281 18880
7445 1 17 . 1 1 11 11 SER CA C 11 58.350 58.350 58.605 -0.256 18880
7446 1 17 . 1 1 11 11 SER CB C 11 64.120 64.120 62.046 2.074 18880
7447 1 17 . 1 1 11 11 SER H H 11 8.360 8.360 8.259 0.101 18880
7448 1 17 . 1 1 12 12 SER N N 12 118.030 118.030 120.396 -2.366 18880
7449 1 17 . 1 1 12 12 SER HA H 12 4.440 4.440 4.633 -0.193 18880
7450 1 17 . 1 1 12 12 SER C C 12 174.880 174.880 174.043 0.837 18880
7451 1 17 . 1 1 12 12 SER CA C 12 58.680 58.680 57.851 0.829 18880
7452 1 17 . 1 1 12 12 SER CB C 12 63.890 63.890 63.403 0.487 18880
7453 1 17 . 1 1 12 12 SER H H 12 8.490 8.490 8.207 0.283 18880
7454 1 17 . 1 1 13 13 GLY N N 13 110.450 110.450 109.708 0.742 18880
7455 1 17 . 1 1 13 13 GLY C C 13 173.790 173.790 172.828 0.962 18880
7456 1 17 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.528 -0.068 18880
7457 1 17 . 1 1 13 13 GLY H H 13 8.390 8.390 7.322 1.068 18880
7458 1 17 . 1 1 14 14 LEU N N 14 121.310 121.310 118.978 2.332 18880
7459 1 17 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.128 0.212 18880
7460 1 17 . 1 1 14 14 LEU C C 14 176.930 176.930 175.370 1.560 18880
7461 1 17 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.611 -0.411 18880
7462 1 17 . 1 1 14 14 LEU CB C 14 42.600 42.600 41.847 0.753 18880
7463 1 17 . 1 1 14 14 LEU H H 14 8.020 8.020 8.062 -0.042 18880
7464 1 17 . 1 1 15 15 VAL N N 15 121.550 121.550 117.829 3.721 18880
7465 1 17 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.305 0.065 18880
7466 1 17 . 1 1 15 15 VAL CA C 15 59.720 59.720 60.451 -0.731 18880
7467 1 17 . 1 1 15 15 VAL CB C 15 32.770 32.770 32.875 -0.105 18880
7468 1 17 . 1 1 15 15 VAL H H 15 8.030 8.030 7.559 0.471 18880
7469 1 17 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.381 -0.011 18880
7470 1 17 . 1 1 16 16 PRO C C 16 176.720 176.720 176.345 0.375 18880
7471 1 17 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.036 -0.386 18880
7472 1 17 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.241 -0.001 18880
7473 1 17 . 1 1 17 17 ARG N N 17 121.890 121.890 122.499 -0.609 18880
7474 1 17 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.078 0.202 18880
7475 1 17 . 1 1 17 17 ARG C C 17 176.940 176.940 176.607 0.333 18880
7476 1 17 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.221 0.139 18880
7477 1 17 . 1 1 17 17 ARG CB C 17 31.050 31.050 29.947 1.103 18880
7478 1 17 . 1 1 17 17 ARG H H 17 8.450 8.450 8.370 0.080 18880
7479 1 17 . 1 1 18 18 GLY N N 18 110.160 110.160 110.295 -0.135 18880
7480 1 17 . 1 1 18 18 GLY C C 18 174.110 174.110 175.026 -0.916 18880
7481 1 17 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.473 0.917 18880
7482 1 17 . 1 1 18 18 GLY H H 18 8.480 8.480 8.105 0.375 18880
7483 1 17 . 1 1 19 19 SER N N 19 115.500 115.500 115.409 0.091 18880
7484 1 17 . 1 1 19 19 SER HA H 19 4.400 4.400 4.139 0.261 18880
7485 1 17 . 1 1 19 19 SER C C 19 174.380 174.380 175.809 -1.429 18880
7486 1 17 . 1 1 19 19 SER CA C 19 58.610 58.610 60.432 -1.822 18880
7487 1 17 . 1 1 19 19 SER CB C 19 63.830 63.830 63.082 0.748 18880
7488 1 17 . 1 1 19 19 SER H H 19 8.210 8.210 8.247 -0.037 18880
7489 1 17 . 1 1 20 20 HIS N N 20 120.770 120.770 118.202 2.568 18880
7490 1 17 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.138 0.472 18880
7491 1 17 . 1 1 20 20 HIS C C 20 174.870 174.870 174.827 0.043 18880
7492 1 17 . 1 1 20 20 HIS CA C 20 56.130 56.130 57.210 -1.080 18880
7493 1 17 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.450 0.260 18880
7494 1 17 . 1 1 20 20 HIS H H 20 8.590 8.590 8.161 0.429 18880
7495 1 17 . 1 1 21 21 MET N N 21 121.440 121.440 118.998 2.442 18880
7496 1 17 . 1 1 21 21 MET HA H 21 4.470 4.470 4.334 0.136 18880
7497 1 17 . 1 1 21 21 MET C C 21 176.030 176.030 175.757 0.273 18880
7498 1 17 . 1 1 21 21 MET CA C 21 55.490 55.490 55.807 -0.317 18880
7499 1 17 . 1 1 21 21 MET CB C 21 33.170 33.170 32.939 0.231 18880
7500 1 17 . 1 1 21 21 MET H H 21 8.310 8.310 8.415 -0.105 18880
7501 1 17 . 1 1 22 22 SER N N 22 116.860 116.860 119.604 -2.744 18880
7502 1 17 . 1 1 22 22 SER HA H 22 4.430 4.430 4.515 -0.085 18880
7503 1 17 . 1 1 22 22 SER C C 22 174.630 174.630 174.908 -0.278 18880
7504 1 17 . 1 1 22 22 SER CA C 22 58.410 58.410 58.137 0.273 18880
7505 1 17 . 1 1 22 22 SER CB C 22 64.030 64.030 62.984 1.046 18880
7506 1 17 . 1 1 22 22 SER H H 22 8.340 8.340 8.650 -0.310 18880
7507 1 17 . 1 1 23 23 ASP N N 23 122.660 122.660 121.846 0.814 18880
7508 1 17 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.531 0.019 18880
7509 1 17 . 1 1 23 23 ASP C C 23 176.860 176.860 177.855 -0.995 18880
7510 1 17 . 1 1 23 23 ASP CA C 23 55.330 55.330 56.041 -0.711 18880
7511 1 17 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.294 0.706 18880
7512 1 17 . 1 1 23 23 ASP H H 23 8.540 8.540 8.537 0.003 18880
7513 1 17 . 1 1 24 24 GLU N N 24 120.400 120.400 119.208 1.192 18880
7514 1 17 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.093 0.047 18880
7515 1 17 . 1 1 24 24 GLU C C 24 177.540 177.540 177.120 0.420 18880
7516 1 17 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.342 0.018 18880
7517 1 17 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.401 0.349 18880
7518 1 17 . 1 1 24 24 GLU H H 24 8.610 8.610 8.253 0.357 18880
7519 1 17 . 1 1 25 25 LYS N N 25 120.390 120.390 117.182 3.208 18880
7520 1 17 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.295 -0.105 18880
7521 1 17 . 1 1 25 25 LYS C C 25 177.490 177.490 178.553 -1.063 18880
7522 1 17 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.184 -0.075 18880
7523 1 17 . 1 1 25 25 LYS CB C 25 32.490 32.490 33.057 -0.567 18880
7524 1 17 . 1 1 25 25 LYS H H 25 8.210 8.210 7.427 0.783 18880
7525 1 17 . 1 1 26 26 THR N N 26 114.880 114.880 116.012 -1.132 18880
7526 1 17 . 1 1 26 26 THR HA H 26 4.040 4.040 4.077 -0.037 18880
7527 1 17 . 1 1 26 26 THR C C 26 175.430 175.430 176.996 -1.566 18880
7528 1 17 . 1 1 26 26 THR CA C 26 64.620 64.620 65.745 -1.125 18880
7529 1 17 . 1 1 26 26 THR CB C 26 69.110 69.110 68.568 0.542 18880
7530 1 17 . 1 1 26 26 THR H H 26 8.080 8.080 7.479 0.601 18880
7531 1 17 . 1 1 27 27 GLN N N 27 120.940 120.940 120.465 0.475 18880
7532 1 17 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.101 0.089 18880
7533 1 17 . 1 1 27 27 GLN C C 27 177.280 177.280 177.660 -0.380 18880
7534 1 17 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.097 -0.547 18880
7535 1 17 . 1 1 27 27 GLN CB C 27 29.090 29.090 27.866 1.224 18880
7536 1 17 . 1 1 27 27 GLN H H 27 8.240 8.240 7.956 0.284 18880
7537 1 17 . 1 1 28 28 LEU N N 28 121.860 121.860 119.000 2.860 18880
7538 1 17 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.416 -0.246 18880
7539 1 17 . 1 1 28 28 LEU C C 28 177.750 177.750 177.833 -0.083 18880
7540 1 17 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.447 1.633 18880
7541 1 17 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.605 -0.335 18880
7542 1 17 . 1 1 28 28 LEU H H 28 7.950 7.950 7.469 0.481 18880
7543 1 17 . 1 1 29 29 ILE N N 29 119.260 119.260 119.509 -0.249 18880
7544 1 17 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.864 0.036 18880
7545 1 17 . 1 1 29 29 ILE C C 29 177.140 177.140 177.808 -0.668 18880
7546 1 17 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.670 -0.370 18880
7547 1 17 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.790 1.490 18880
7548 1 17 . 1 1 29 29 ILE H H 29 7.950 7.950 7.771 0.179 18880
7549 1 17 . 1 1 30 30 GLU N N 30 120.500 120.500 118.709 1.791 18880
7550 1 17 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.304 -0.254 18880
7551 1 17 . 1 1 30 30 GLU C C 30 177.560 177.560 176.721 0.839 18880
7552 1 17 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.813 0.277 18880
7553 1 17 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.850 0.740 18880
7554 1 17 . 1 1 30 30 GLU H H 30 8.220 8.220 8.100 0.120 18880
7555 1 17 . 1 1 31 31 ALA N N 31 121.550 121.550 120.885 0.665 18880
7556 1 17 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.445 -0.295 18880
7557 1 17 . 1 1 31 31 ALA C C 31 178.550 178.550 178.799 -0.249 18880
7558 1 17 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.780 0.020 18880
7559 1 17 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.483 -0.853 18880
7560 1 17 . 1 1 31 31 ALA H H 31 7.890 7.890 8.001 -0.111 18880
7561 1 17 . 1 1 32 32 PHE N N 32 117.240 117.240 118.572 -1.332 18880
7562 1 17 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.253 0.047 18880
7563 1 17 . 1 1 32 32 PHE C C 32 176.210 176.210 176.949 -0.739 18880
7564 1 17 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.858 -1.518 18880
7565 1 17 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.849 0.901 18880
7566 1 17 . 1 1 32 32 PHE H H 32 7.930 7.930 8.043 -0.113 18880
7567 1 17 . 1 1 33 33 TYR N N 33 119.050 119.050 116.599 2.451 18880
7568 1 17 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.561 -0.231 18880
7569 1 17 . 1 1 33 33 TYR C C 33 175.680 175.680 175.556 0.124 18880
7570 1 17 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.410 0.509 18880
7571 1 17 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.287 1.253 18880
7572 1 17 . 1 1 33 33 TYR H H 33 7.950 7.950 8.389 -0.439 18880
7573 1 17 . 1 1 34 34 ASN N N 34 118.390 118.390 118.343 0.047 18880
7574 1 17 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.880 -0.250 18880
7575 1 17 . 1 1 34 34 ASN C C 34 174.810 174.810 174.003 0.807 18880
7576 1 17 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.659 -0.509 18880
7577 1 17 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.903 -0.923 18880
7578 1 17 . 1 1 34 34 ASN H H 34 7.960 7.960 7.988 -0.028 18880
7579 1 17 . 1 1 35 35 PHE N N 35 120.670 120.670 118.300 2.370 18880
7580 1 17 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.566 -0.116 18880
7581 1 17 . 1 1 35 35 PHE C C 35 175.310 175.310 173.692 1.618 18880
7582 1 17 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.587 -0.267 18880
7583 1 17 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.894 -0.474 18880
7584 1 17 . 1 1 35 35 PHE H H 35 7.830 7.830 7.686 0.144 18880
7585 1 17 . 1 1 36 36 ASP N N 36 122.400 122.400 121.203 1.197 18880
7586 1 17 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.532 0.058 18880
7587 1 17 . 1 1 36 36 ASP C C 36 176.150 176.150 175.546 0.604 18880
7588 1 17 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.233 -0.163 18880
7589 1 17 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.102 0.218 18880
7590 1 17 . 1 1 36 36 ASP H H 36 8.180 8.180 8.051 0.129 18880
7591 1 17 . 1 1 37 37 GLY N N 37 108.560 108.560 107.403 1.157 18880
7592 1 17 . 1 1 37 37 GLY C C 37 173.660 173.660 173.463 0.197 18880
7593 1 17 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.615 -0.005 18880
7594 1 17 . 1 1 37 37 GLY H H 37 7.680 7.680 7.978 -0.298 18880
7595 1 17 . 1 1 38 38 ASP N N 38 120.010 120.010 120.090 -0.080 18880
7596 1 17 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.668 -0.068 18880
7597 1 17 . 1 1 38 38 ASP CA C 38 54.260 54.260 53.289 0.970 18880
7598 1 17 . 1 1 38 38 ASP CB C 38 41.450 41.450 41.111 0.339 18880
7599 1 17 . 1 1 38 38 ASP H H 38 8.220 8.220 8.062 0.158 18880
7600 1 17 . 1 1 39 39 TYR N N 39 121.030 121.030 118.803 2.227 18880
7601 1 17 . 1 1 39 39 TYR HA H 39 4.390 4.390 3.945 0.445 18880
7602 1 17 . 1 1 39 39 TYR C C 39 175.290 175.290 175.433 -0.143 18880
7603 1 17 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.797 -0.597 18880
7604 1 17 . 1 1 39 39 TYR CB C 39 39.170 39.170 37.999 1.171 18880
7605 1 17 . 1 1 39 39 TYR H H 39 8.090 8.090 7.478 0.612 18880
7606 1 17 . 1 1 40 40 ASP N N 40 122.020 122.020 117.112 4.908 18880
7607 1 17 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.489 0.111 18880
7608 1 17 . 1 1 40 40 ASP C C 40 175.970 175.970 175.374 0.596 18880
7609 1 17 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.831 -0.611 18880
7610 1 17 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.357 0.163 18880
7611 1 17 . 1 1 40 40 ASP H H 40 8.200 8.200 8.477 -0.277 18880
7612 1 17 . 1 1 41 41 GLY N N 41 108.330 108.330 106.010 2.320 18880
7613 1 17 . 1 1 41 41 GLY C C 41 173.000 173.000 173.081 -0.081 18880
7614 1 17 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.721 0.699 18880
7615 1 17 . 1 1 41 41 GLY H H 41 7.830 7.830 8.324 -0.494 18880
7616 1 17 . 1 1 42 42 PHE N N 42 118.600 118.600 120.007 -1.407 18880
7617 1 17 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.844 0.416 18880
7618 1 17 . 1 1 42 42 PHE C C 42 175.660 175.660 174.113 1.547 18880
7619 1 17 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.615 -0.455 18880
7620 1 17 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.245 -1.075 18880
7621 1 17 . 1 1 42 42 PHE H H 42 8.150 8.150 7.618 0.532 18880
7622 1 17 . 1 1 43 43 VAL N N 43 119.180 119.180 125.051 -5.871 18880
7623 1 17 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.600 0.070 18880
7624 1 17 . 1 1 43 43 VAL C C 43 175.110 175.110 174.741 0.369 18880
7625 1 17 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.048 0.572 18880
7626 1 17 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.685 -1.805 18880
7627 1 17 . 1 1 43 43 VAL H H 43 9.070 9.070 8.739 0.331 18880
7628 1 17 . 1 1 44 44 SER N N 44 121.380 121.380 123.816 -2.436 18880
7629 1 17 . 1 1 44 44 SER HA H 44 4.570 4.570 4.406 0.164 18880
7630 1 17 . 1 1 44 44 SER C C 44 175.660 175.660 175.454 0.206 18880
7631 1 17 . 1 1 44 44 SER CA C 44 57.720 57.720 58.180 -0.460 18880
7632 1 17 . 1 1 44 44 SER CB C 44 63.690 63.690 63.327 0.363 18880
7633 1 17 . 1 1 44 44 SER H H 44 9.140 9.140 8.831 0.309 18880
7634 1 17 . 1 1 45 45 VAL N N 45 122.720 122.720 122.925 -0.205 18880
7635 1 17 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.381 0.119 18880
7636 1 17 . 1 1 45 45 VAL C C 45 177.240 177.240 177.208 0.032 18880
7637 1 17 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.259 0.011 18880
7638 1 17 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.576 0.874 18880
7639 1 17 . 1 1 45 45 VAL H H 45 8.140 8.140 8.285 -0.145 18880
7640 1 17 . 1 1 46 46 GLU N N 46 118.990 118.990 119.341 -0.351 18880
7641 1 17 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.758 0.222 18880
7642 1 17 . 1 1 46 46 GLU C C 46 179.460 179.460 178.634 0.826 18880
7643 1 17 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.778 -0.218 18880
7644 1 17 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.582 0.578 18880
7645 1 17 . 1 1 46 46 GLU H H 46 8.230 8.230 7.226 1.004 18880
7646 1 17 . 1 1 47 47 GLU N N 47 120.120 120.120 119.848 0.272 18880
7647 1 17 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.075 0.005 18880
7648 1 17 . 1 1 47 47 GLU C C 47 179.170 179.170 178.972 0.198 18880
7649 1 17 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.903 -0.013 18880
7650 1 17 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.492 0.328 18880
7651 1 17 . 1 1 47 47 GLU H H 47 7.880 7.880 8.191 -0.311 18880
7652 1 17 . 1 1 48 48 PHE N N 48 120.830 120.830 118.641 2.189 18880
7653 1 17 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.214 -0.024 18880
7654 1 17 . 1 1 48 48 PHE C C 48 176.920 176.920 177.655 -0.735 18880
7655 1 17 . 1 1 48 48 PHE CA C 48 60.870 60.870 61.122 -0.252 18880
7656 1 17 . 1 1 48 48 PHE CB C 48 39.260 39.260 38.985 0.275 18880
7657 1 17 . 1 1 48 48 PHE H H 48 8.600 8.600 8.032 0.568 18880
7658 1 17 . 1 1 49 49 ARG N N 49 118.470 118.470 119.522 -1.052 18880
7659 1 17 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.170 -0.310 18880
7660 1 17 . 1 1 49 49 ARG C C 49 178.090 178.090 178.754 -0.664 18880
7661 1 17 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.148 -0.078 18880
7662 1 17 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.877 0.263 18880
7663 1 17 . 1 1 49 49 ARG H H 49 8.650 8.650 7.820 0.830 18880
7664 1 17 . 1 1 50 50 GLY N N 50 105.080 105.080 106.044 -0.964 18880
7665 1 17 . 1 1 50 50 GLY C C 50 175.090 175.090 175.874 -0.784 18880
7666 1 17 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.988 -0.308 18880
7667 1 17 . 1 1 50 50 GLY H H 50 7.620 7.620 7.874 -0.254 18880
7668 1 17 . 1 1 51 51 ILE N N 51 121.440 121.440 121.742 -0.302 18880
7669 1 17 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.892 -0.062 18880
7670 1 17 . 1 1 51 51 ILE C C 51 178.300 178.300 177.499 0.801 18880
7671 1 17 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.241 -0.401 18880
7672 1 17 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.229 0.081 18880
7673 1 17 . 1 1 51 51 ILE H H 51 7.470 7.470 7.125 0.345 18880
7674 1 17 . 1 1 52 52 ILE N N 52 118.930 118.930 119.008 -0.078 18880
7675 1 17 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.755 -0.015 18880
7676 1 17 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.020 0.740 18880
7677 1 17 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.717 1.313 18880
7678 1 17 . 1 1 52 52 ILE H H 52 7.790 7.790 8.252 -0.462 18880
7679 1 17 . 1 1 53 53 ARG N N 53 120.140 120.140 119.663 0.477 18880
7680 1 17 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.950 0.140 18880
7681 1 17 . 1 1 53 53 ARG C C 53 177.380 177.380 176.839 0.541 18880
7682 1 17 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.263 0.847 18880
7683 1 17 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.626 -1.046 18880
7684 1 17 . 1 1 53 53 ARG H H 53 7.930 7.930 8.220 -0.290 18880
7685 1 17 . 1 1 54 54 ASP N N 54 117.500 117.500 115.431 2.069 18880
7686 1 17 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.810 -0.210 18880
7687 1 17 . 1 1 54 54 ASP C C 54 176.930 176.930 176.163 0.767 18880
7688 1 17 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.120 1.420 18880
7689 1 17 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.074 0.026 18880
7690 1 17 . 1 1 54 54 ASP H H 54 7.870 7.870 8.148 -0.278 18880
7691 1 17 . 1 1 55 55 GLY N N 55 106.370 106.370 108.133 -1.763 18880
7692 1 17 . 1 1 55 55 GLY C C 55 173.460 173.460 173.828 -0.368 18880
7693 1 17 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.584 0.416 18880
7694 1 17 . 1 1 55 55 GLY H H 55 7.880 7.880 7.785 0.095 18880
7695 1 17 . 1 1 56 56 LEU N N 56 122.630 122.630 121.495 1.135 18880
7696 1 17 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.754 0.016 18880
7697 1 17 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.578 0.912 18880
7698 1 17 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.683 0.437 18880
7699 1 17 . 1 1 56 56 LEU H H 56 8.220 8.220 7.740 0.480 18880
7700 1 17 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.496 0.084 18880
7701 1 17 . 1 1 57 57 PRO C C 57 176.150 176.150 175.800 0.350 18880
7702 1 17 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.233 -0.813 18880
7703 1 17 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.553 -0.813 18880
7704 1 17 . 1 1 58 58 MET N N 58 121.810 121.810 124.413 -2.603 18880
7705 1 17 . 1 1 58 58 MET HA H 58 4.630 4.630 4.565 0.065 18880
7706 1 17 . 1 1 58 58 MET C C 58 176.150 176.150 174.395 1.755 18880
7707 1 17 . 1 1 58 58 MET CA C 58 55.560 55.560 54.251 1.309 18880
7708 1 17 . 1 1 58 58 MET CB C 58 36.820 36.820 36.720 0.100 18880
7709 1 17 . 1 1 58 58 MET H H 58 7.690 7.690 8.103 -0.413 18880
7710 1 17 . 1 1 59 59 THR N N 59 114.180 114.180 114.493 -0.313 18880
7711 1 17 . 1 1 59 59 THR HA H 59 4.450 4.450 4.424 0.026 18880
7712 1 17 . 1 1 59 59 THR C C 59 175.170 175.170 175.871 -0.701 18880
7713 1 17 . 1 1 59 59 THR CA C 59 60.780 60.780 61.059 -0.279 18880
7714 1 17 . 1 1 59 59 THR CB C 59 71.060 71.060 69.334 1.726 18880
7715 1 17 . 1 1 59 59 THR H H 59 8.940 8.940 8.254 0.686 18880
7716 1 17 . 1 1 60 60 GLU N N 60 120.620 120.620 125.332 -4.712 18880
7717 1 17 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.727 0.283 18880
7718 1 17 . 1 1 60 60 GLU C C 60 179.010 179.010 178.025 0.985 18880
7719 1 17 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.710 0.110 18880
7720 1 17 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.653 0.397 18880
7721 1 17 . 1 1 60 60 GLU H H 60 8.850 8.850 8.921 -0.071 18880
7722 1 17 . 1 1 61 61 ALA N N 61 121.080 121.080 122.379 -1.299 18880
7723 1 17 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.972 0.168 18880
7724 1 17 . 1 1 61 61 ALA C C 61 180.350 180.350 180.064 0.286 18880
7725 1 17 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.260 -0.170 18880
7726 1 17 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.814 0.395 18880
7727 1 17 . 1 1 61 61 ALA H H 61 8.370 8.370 8.428 -0.058 18880
7728 1 17 . 1 1 62 62 GLU N N 62 118.890 118.890 118.709 0.181 18880
7729 1 17 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.513 0.487 18880
7730 1 17 . 1 1 62 62 GLU C C 62 179.690 179.690 178.560 1.130 18880
7731 1 17 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.439 0.551 18880
7732 1 17 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.394 1.916 18880
7733 1 17 . 1 1 62 62 GLU H H 62 7.680 7.680 7.775 -0.095 18880
7734 1 17 . 1 1 63 63 ILE N N 63 122.340 122.340 119.817 2.523 18880
7735 1 17 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.273 0.297 18880
7736 1 17 . 1 1 63 63 ILE C C 63 177.260 177.260 178.354 -1.094 18880
7737 1 17 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.679 1.211 18880
7738 1 17 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.028 0.952 18880
7739 1 17 . 1 1 63 63 ILE H H 63 8.420 8.420 7.659 0.761 18880
7740 1 17 . 1 1 64 64 THR N N 64 116.970 116.970 116.225 0.745 18880
7741 1 17 . 1 1 64 64 THR HA H 64 3.940 3.940 4.051 -0.111 18880
7742 1 17 . 1 1 64 64 THR C C 64 176.520 176.520 177.081 -0.561 18880
7743 1 17 . 1 1 64 64 THR CA C 64 67.060 67.060 67.274 -0.214 18880
7744 1 17 . 1 1 64 64 THR CB C 64 68.750 68.750 68.353 0.397 18880
7745 1 17 . 1 1 64 64 THR H H 64 8.310 8.310 8.588 -0.278 18880
7746 1 17 . 1 1 65 65 GLU N N 65 120.760 120.760 119.468 1.292 18880
7747 1 17 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.216 -0.186 18880
7748 1 17 . 1 1 65 65 GLU C C 65 175.830 175.830 178.989 -3.159 18880
7749 1 17 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.988 0.512 18880
7750 1 17 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.416 0.354 18880
7751 1 17 . 1 1 65 65 GLU H H 65 7.970 7.970 8.709 -0.739 18880
7752 1 17 . 1 1 66 66 PHE N N 66 120.940 120.940 118.672 2.268 18880
7753 1 17 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.382 -0.142 18880
7754 1 17 . 1 1 66 66 PHE C C 66 177.330 177.330 177.077 0.253 18880
7755 1 17 . 1 1 66 66 PHE CA C 66 61.200 61.200 57.946 3.255 18880
7756 1 17 . 1 1 66 66 PHE CB C 66 38.530 38.530 38.703 -0.173 18880
7757 1 17 . 1 1 66 66 PHE H H 66 8.100 8.100 7.984 0.116 18880
7758 1 17 . 1 1 67 67 PHE N N 67 118.110 118.110 119.322 -1.212 18880
7759 1 17 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.363 -0.413 18880
7760 1 17 . 1 1 67 67 PHE C C 67 178.090 178.090 177.516 0.574 18880
7761 1 17 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.414 1.786 18880
7762 1 17 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.941 -0.691 18880
7763 1 17 . 1 1 67 67 PHE H H 67 8.380 8.380 8.561 -0.181 18880
7764 1 17 . 1 1 68 68 GLU N N 68 119.650 119.650 117.649 2.001 18880
7765 1 17 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.718 -0.708 18880
7766 1 17 . 1 1 68 68 GLU C C 68 177.910 177.910 177.023 0.887 18880
7767 1 17 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.451 1.789 18880
7768 1 17 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.703 -0.334 18880
7769 1 17 . 1 1 68 68 GLU H H 68 8.230 8.230 8.096 0.134 18880
7770 1 17 . 1 1 69 69 ALA N N 69 119.090 119.090 120.924 -1.834 18880
7771 1 17 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.275 -0.095 18880
7772 1 17 . 1 1 69 69 ALA C C 69 179.030 179.030 178.267 0.763 18880
7773 1 17 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.552 0.048 18880
7774 1 17 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.767 0.013 18880
7775 1 17 . 1 1 69 69 ALA H H 69 7.340 7.340 7.683 -0.343 18880
7776 1 17 . 1 1 70 70 ALA N N 70 118.670 118.670 120.648 -1.978 18880
7777 1 17 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.381 -0.361 18880
7778 1 17 . 1 1 70 70 ALA C C 70 176.820 176.820 177.058 -0.238 18880
7779 1 17 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.750 0.340 18880
7780 1 17 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.194 -0.584 18880
7781 1 17 . 1 1 70 70 ALA H H 70 8.050 8.050 7.913 0.137 18880
7782 1 17 . 1 1 71 71 ASP N N 71 116.780 116.780 117.109 -0.329 18880
7783 1 17 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.111 0.109 18880
7784 1 17 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.468 1.682 18880
7785 1 17 . 1 1 71 71 ASP CB C 71 40.910 40.910 41.269 -0.359 18880
7786 1 17 . 1 1 71 71 ASP H H 71 8.010 8.010 7.667 0.343 18880
7787 1 17 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.329 0.141 18880
7788 1 17 . 1 1 72 72 PRO C C 72 177.970 177.970 177.448 0.522 18880
7789 1 17 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.640 0.270 18880
7790 1 17 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.298 -0.418 18880
7791 1 17 . 1 1 73 73 ASN N N 73 114.930 114.930 117.287 -2.357 18880
7792 1 17 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.570 0.310 18880
7793 1 17 . 1 1 73 73 ASN C C 73 174.880 174.880 174.850 0.030 18880
7794 1 17 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.940 -1.099 18880
7795 1 17 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.213 0.167 18880
7796 1 17 . 1 1 73 73 ASN H H 73 9.030 9.030 8.487 0.543 18880
7797 1 17 . 1 1 74 74 ASN N N 74 118.340 118.340 112.151 6.189 18880
7798 1 17 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.938 -0.578 18880
7799 1 17 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.954 0.636 18880
7800 1 17 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.975 0.185 18880
7801 1 17 . 1 1 74 74 ASN H H 74 8.320 8.320 8.520 -0.200 18880
7802 1 17 . 1 1 75 75 THR N N 75 113.450 113.450 113.474 -0.024 18880
7803 1 17 . 1 1 75 75 THR HA H 75 4.210 4.210 4.221 -0.011 18880
7804 1 17 . 1 1 75 75 THR CA C 75 63.410 63.410 63.449 -0.039 18880
7805 1 17 . 1 1 75 75 THR CB C 75 70.540 70.540 69.166 1.374 18880
7806 1 17 . 1 1 75 75 THR H H 75 9.870 9.870 7.902 1.968 18880
7807 1 17 . 1 1 76 76 GLY N N 76 111.810 111.810 108.134 3.676 18880
7808 1 17 . 1 1 76 76 GLY C C 76 173.670 173.670 173.055 0.615 18880
7809 1 17 . 1 1 76 76 GLY CA C 76 45.120 45.120 44.710 0.410 18880
7810 1 17 . 1 1 76 76 GLY H H 76 10.250 10.250 7.817 2.433 18880
7811 1 17 . 1 1 77 77 PHE N N 77 120.560 120.560 118.859 1.701 18880
7812 1 17 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.971 0.179 18880
7813 1 17 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.115 0.065 18880
7814 1 17 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.127 1.373 18880
7815 1 17 . 1 1 77 77 PHE H H 77 8.110 8.110 7.595 0.515 18880
7816 1 17 . 1 1 78 78 ILE N N 78 116.410 116.410 123.226 -6.816 18880
7817 1 17 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.381 0.009 18880
7818 1 17 . 1 1 78 78 ILE C C 78 174.770 174.770 175.274 -0.504 18880
7819 1 17 . 1 1 78 78 ILE CA C 78 59.190 59.190 60.141 -0.951 18880
7820 1 17 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.130 1.050 18880
7821 1 17 . 1 1 78 78 ILE H H 78 8.930 8.930 8.029 0.901 18880
7822 1 17 . 1 1 79 79 ASP N N 79 125.220 125.220 127.038 -1.818 18880
7823 1 17 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.131 -0.631 18880
7824 1 17 . 1 1 79 79 ASP C C 79 176.490 176.490 176.644 -0.154 18880
7825 1 17 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.433 -0.123 18880
7826 1 17 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.215 1.155 18880
7827 1 17 . 1 1 79 79 ASP H H 79 8.610 8.610 8.722 -0.112 18880
7828 1 17 . 1 1 80 80 TYR N N 80 125.760 125.760 128.009 -2.249 18880
7829 1 17 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.030 -0.040 18880
7830 1 17 . 1 1 80 80 TYR C C 80 177.140 177.140 176.567 0.573 18880
7831 1 17 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.718 -1.139 18880
7832 1 17 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.584 0.305 18880
7833 1 17 . 1 1 80 80 TYR H H 80 8.460 8.460 8.063 0.397 18880
7834 1 17 . 1 1 81 81 LYS N N 81 118.320 118.320 118.101 0.219 18880
7835 1 17 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.947 -0.047 18880
7836 1 17 . 1 1 81 81 LYS C C 81 179.090 179.090 178.601 0.489 18880
7837 1 17 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.458 0.122 18880
7838 1 17 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.541 0.219 18880
7839 1 17 . 1 1 81 81 LYS H H 81 8.410 8.410 8.228 0.182 18880
7840 1 17 . 1 1 82 82 ALA N N 82 122.050 122.050 121.525 0.525 18880
7841 1 17 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.191 -0.061 18880
7842 1 17 . 1 1 82 82 ALA C C 82 179.740 179.740 179.569 0.171 18880
7843 1 17 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.697 -0.177 18880
7844 1 17 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.316 0.225 18880
7845 1 17 . 1 1 82 82 ALA H H 82 7.770 7.770 8.014 -0.244 18880
7846 1 17 . 1 1 83 83 PHE N N 83 117.810 117.810 117.039 0.771 18880
7847 1 17 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.447 -0.157 18880
7848 1 17 . 1 1 83 83 PHE C C 83 176.460 176.460 176.990 -0.530 18880
7849 1 17 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.066 -0.036 18880
7850 1 17 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.133 -0.613 18880
7851 1 17 . 1 1 83 83 PHE H H 83 7.780 7.780 7.804 -0.024 18880
7852 1 17 . 1 1 84 84 ALA N N 84 121.530 121.530 122.222 -0.692 18880
7853 1 17 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.160 -0.500 18880
7854 1 17 . 1 1 84 84 ALA C C 84 179.010 179.010 178.986 0.024 18880
7855 1 17 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.036 0.994 18880
7856 1 17 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.127 0.003 18880
7857 1 17 . 1 1 84 84 ALA H H 84 8.290 8.290 8.400 -0.110 18880
7858 1 17 . 1 1 85 85 ALA N N 85 117.720 117.720 121.555 -3.835 18880
7859 1 17 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.250 -0.170 18880
7860 1 17 . 1 1 85 85 ALA C C 85 179.570 179.570 178.578 0.992 18880
7861 1 17 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.489 -0.119 18880
7862 1 17 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.510 -0.220 18880
7863 1 17 . 1 1 85 85 ALA H H 85 7.700 7.700 8.604 -0.904 18880
7864 1 17 . 1 1 86 86 MET N N 86 116.570 116.570 114.714 1.856 18880
7865 1 17 . 1 1 86 86 MET HA H 86 4.160 4.160 4.139 0.021 18880
7866 1 17 . 1 1 86 86 MET C C 86 177.360 177.360 176.938 0.422 18880
7867 1 17 . 1 1 86 86 MET CA C 86 57.380 57.380 56.837 0.543 18880
7868 1 17 . 1 1 86 86 MET CB C 86 32.720 32.720 32.439 0.281 18880
7869 1 17 . 1 1 86 86 MET H H 86 7.560 7.560 7.590 -0.030 18880
7870 1 17 . 1 1 87 87 LEU N N 87 119.090 119.090 115.561 3.529 18880
7871 1 17 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.073 -0.103 18880
7872 1 17 . 1 1 87 87 LEU C C 87 177.420 177.420 177.087 0.333 18880
7873 1 17 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.132 1.158 18880
7874 1 17 . 1 1 87 87 LEU CB C 87 42.280 42.280 41.881 0.399 18880
7875 1 17 . 1 1 87 87 LEU H H 87 7.570 7.570 7.197 0.373 18880
7876 1 17 . 1 1 88 88 TYR N N 88 117.060 117.060 116.010 1.050 18880
7877 1 17 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.725 -0.135 18880
7878 1 17 . 1 1 88 88 TYR C C 88 175.870 175.870 174.900 0.970 18880
7879 1 17 . 1 1 88 88 TYR CA C 88 57.840 57.840 54.976 2.864 18880
7880 1 17 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.749 0.891 18880
7881 1 17 . 1 1 88 88 TYR H H 88 7.740 7.740 7.228 0.512 18880
7882 1 17 . 1 1 89 89 SER N N 89 115.980 115.980 118.609 -2.629 18880
7883 1 17 . 1 1 89 89 SER HA H 89 4.440 4.440 4.567 -0.127 18880
7884 1 17 . 1 1 89 89 SER C C 89 174.460 174.460 174.402 0.058 18880
7885 1 17 . 1 1 89 89 SER CA C 89 58.350 58.350 59.184 -0.834 18880
7886 1 17 . 1 1 89 89 SER CB C 89 63.990 63.990 62.090 1.900 18880
7887 1 17 . 1 1 89 89 SER H H 89 7.880 7.880 8.216 -0.336 18880
7888 1 17 . 1 1 90 90 VAL N N 90 120.910 120.910 124.121 -3.211 18880
7889 1 17 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.135 0.005 18880
7890 1 17 . 1 1 90 90 VAL C C 90 175.720 175.720 175.387 0.333 18880
7891 1 17 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.771 0.499 18880
7892 1 17 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.526 0.314 18880
7893 1 17 . 1 1 90 90 VAL H H 90 8.020 8.020 7.744 0.276 18880
7894 1 17 . 1 1 91 91 ASP N N 91 123.620 123.620 122.910 0.710 18880
7895 1 17 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.564 0.066 18880
7896 1 17 . 1 1 91 91 ASP C C 91 176.000 176.000 176.349 -0.349 18880
7897 1 17 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.228 0.282 18880
7898 1 17 . 1 1 91 91 ASP CB C 91 41.440 41.440 42.283 -0.843 18880
7899 1 17 . 1 1 91 91 ASP H H 91 8.310 8.310 8.090 0.220 18880
7900 1 17 . 1 1 92 92 GLU N N 92 122.170 122.170 120.769 1.401 18880
7901 1 17 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.265 0.095 18880
7902 1 17 . 1 1 92 92 GLU C C 92 175.660 175.660 176.429 -0.769 18880
7903 1 17 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.837 -0.347 18880
7904 1 17 . 1 1 92 92 GLU CB C 92 32.850 32.850 29.953 2.897 18880
7905 1 17 . 1 1 92 92 GLU H H 92 8.320 8.320 8.402 -0.082 18880
7906 1 18 . 1 1 10 10 HIS C C 10 176.040 176.040 175.304 0.736 18880
7907 1 18 . 1 1 11 11 SER N N 11 116.840 116.840 117.603 -0.763 18880
7908 1 18 . 1 1 11 11 SER HA H 11 4.430 4.430 4.527 -0.097 18880
7909 1 18 . 1 1 11 11 SER C C 11 174.630 174.630 173.829 0.801 18880
7910 1 18 . 1 1 11 11 SER CA C 11 58.350 58.350 58.051 0.299 18880
7911 1 18 . 1 1 11 11 SER CB C 11 64.120 64.120 63.803 0.317 18880
7912 1 18 . 1 1 11 11 SER H H 11 8.360 8.360 8.565 -0.205 18880
7913 1 18 . 1 1 12 12 SER N N 12 118.030 118.030 117.432 0.598 18880
7914 1 18 . 1 1 12 12 SER HA H 12 4.440 4.440 4.329 0.111 18880
7915 1 18 . 1 1 12 12 SER C C 12 174.880 174.880 174.712 0.168 18880
7916 1 18 . 1 1 12 12 SER CA C 12 58.680 58.680 58.813 -0.133 18880
7917 1 18 . 1 1 12 12 SER CB C 12 63.890 63.890 63.858 0.032 18880
7918 1 18 . 1 1 12 12 SER H H 12 8.490 8.490 8.310 0.180 18880
7919 1 18 . 1 1 13 13 GLY N N 13 110.450 110.450 113.473 -3.023 18880
7920 1 18 . 1 1 13 13 GLY C C 13 173.790 173.790 173.407 0.383 18880
7921 1 18 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.918 0.542 18880
7922 1 18 . 1 1 13 13 GLY H H 13 8.390 8.390 8.775 -0.385 18880
7923 1 18 . 1 1 14 14 LEU N N 14 121.310 121.310 125.320 -4.010 18880
7924 1 18 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.601 -0.261 18880
7925 1 18 . 1 1 14 14 LEU C C 14 176.930 176.930 176.446 0.484 18880
7926 1 18 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.797 -0.597 18880
7927 1 18 . 1 1 14 14 LEU CB C 14 42.600 42.600 43.978 -1.378 18880
7928 1 18 . 1 1 14 14 LEU H H 14 8.020 8.020 8.395 -0.375 18880
7929 1 18 . 1 1 15 15 VAL N N 15 121.550 121.550 120.339 1.211 18880
7930 1 18 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.315 0.055 18880
7931 1 18 . 1 1 15 15 VAL CA C 15 59.720 59.720 61.088 -1.368 18880
7932 1 18 . 1 1 15 15 VAL CB C 15 32.770 32.770 33.033 -0.263 18880
7933 1 18 . 1 1 15 15 VAL H H 15 8.030 8.030 7.932 0.098 18880
7934 1 18 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.618 -0.248 18880
7935 1 18 . 1 1 16 16 PRO C C 16 176.720 176.720 176.103 0.617 18880
7936 1 18 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.479 -0.829 18880
7937 1 18 . 1 1 16 16 PRO CB C 16 32.240 32.240 31.782 0.458 18880
7938 1 18 . 1 1 17 17 ARG N N 17 121.890 121.890 123.558 -1.668 18880
7939 1 18 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.614 -0.334 18880
7940 1 18 . 1 1 17 17 ARG C C 17 176.940 176.940 176.338 0.602 18880
7941 1 18 . 1 1 17 17 ARG CA C 17 56.360 56.360 54.906 1.454 18880
7942 1 18 . 1 1 17 17 ARG CB C 17 31.050 31.050 32.295 -1.245 18880
7943 1 18 . 1 1 17 17 ARG H H 17 8.450 8.450 8.487 -0.037 18880
7944 1 18 . 1 1 18 18 GLY N N 18 110.160 110.160 108.944 1.216 18880
7945 1 18 . 1 1 18 18 GLY C C 18 174.110 174.110 174.595 -0.485 18880
7946 1 18 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.740 0.650 18880
7947 1 18 . 1 1 18 18 GLY H H 18 8.480 8.480 8.356 0.124 18880
7948 1 18 . 1 1 19 19 SER N N 19 115.500 115.500 113.565 1.935 18880
7949 1 18 . 1 1 19 19 SER HA H 19 4.400 4.400 4.253 0.147 18880
7950 1 18 . 1 1 19 19 SER C C 19 174.380 174.380 174.350 0.030 18880
7951 1 18 . 1 1 19 19 SER CA C 19 58.610 58.610 58.381 0.229 18880
7952 1 18 . 1 1 19 19 SER CB C 19 63.830 63.830 63.658 0.172 18880
7953 1 18 . 1 1 19 19 SER H H 19 8.210 8.210 8.320 -0.110 18880
7954 1 18 . 1 1 20 20 HIS N N 20 120.770 120.770 122.529 -1.759 18880
7955 1 18 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.499 0.111 18880
7956 1 18 . 1 1 20 20 HIS C C 20 174.870 174.870 175.759 -0.889 18880
7957 1 18 . 1 1 20 20 HIS CA C 20 56.130 56.130 57.349 -1.220 18880
7958 1 18 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.379 -0.669 18880
7959 1 18 . 1 1 20 20 HIS H H 20 8.590 8.590 8.504 0.086 18880
7960 1 18 . 1 1 21 21 MET N N 21 121.440 121.440 116.108 5.332 18880
7961 1 18 . 1 1 21 21 MET HA H 21 4.470 4.470 4.661 -0.191 18880
7962 1 18 . 1 1 21 21 MET C C 21 176.030 176.030 175.723 0.307 18880
7963 1 18 . 1 1 21 21 MET CA C 21 55.490 55.490 55.416 0.074 18880
7964 1 18 . 1 1 21 21 MET CB C 21 33.170 33.170 34.925 -1.755 18880
7965 1 18 . 1 1 21 21 MET H H 21 8.310 8.310 7.920 0.390 18880
7966 1 18 . 1 1 22 22 SER N N 22 116.860 116.860 117.631 -0.771 18880
7967 1 18 . 1 1 22 22 SER HA H 22 4.430 4.430 4.724 -0.294 18880
7968 1 18 . 1 1 22 22 SER C C 22 174.630 174.630 174.980 -0.350 18880
7969 1 18 . 1 1 22 22 SER CA C 22 58.410 58.410 58.615 -0.205 18880
7970 1 18 . 1 1 22 22 SER CB C 22 64.030 64.030 63.484 0.546 18880
7971 1 18 . 1 1 22 22 SER H H 22 8.340 8.340 8.727 -0.387 18880
7972 1 18 . 1 1 23 23 ASP N N 23 122.660 122.660 121.381 1.279 18880
7973 1 18 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.588 -0.038 18880
7974 1 18 . 1 1 23 23 ASP C C 23 176.860 176.860 177.567 -0.707 18880
7975 1 18 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.850 -0.520 18880
7976 1 18 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.449 0.551 18880
7977 1 18 . 1 1 23 23 ASP H H 23 8.540 8.540 8.408 0.132 18880
7978 1 18 . 1 1 24 24 GLU N N 24 120.400 120.400 118.522 1.878 18880
7979 1 18 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.401 -0.261 18880
7980 1 18 . 1 1 24 24 GLU C C 24 177.540 177.540 177.732 -0.192 18880
7981 1 18 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.386 -0.026 18880
7982 1 18 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.729 0.021 18880
7983 1 18 . 1 1 24 24 GLU H H 24 8.610 8.610 8.060 0.550 18880
7984 1 18 . 1 1 25 25 LYS N N 25 120.390 120.390 118.110 2.280 18880
7985 1 18 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.298 -0.108 18880
7986 1 18 . 1 1 25 25 LYS C C 25 177.490 177.490 178.318 -0.828 18880
7987 1 18 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.026 0.083 18880
7988 1 18 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.914 -0.424 18880
7989 1 18 . 1 1 25 25 LYS H H 25 8.210 8.210 7.555 0.655 18880
7990 1 18 . 1 1 26 26 THR N N 26 114.880 114.880 116.142 -1.262 18880
7991 1 18 . 1 1 26 26 THR HA H 26 4.040 4.040 4.162 -0.122 18880
7992 1 18 . 1 1 26 26 THR C C 26 175.430 175.430 177.039 -1.609 18880
7993 1 18 . 1 1 26 26 THR CA C 26 64.620 64.620 65.854 -1.234 18880
7994 1 18 . 1 1 26 26 THR CB C 26 69.110 69.110 68.566 0.545 18880
7995 1 18 . 1 1 26 26 THR H H 26 8.080 8.080 7.479 0.601 18880
7996 1 18 . 1 1 27 27 GLN N N 27 120.940 120.940 121.440 -0.500 18880
7997 1 18 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.138 0.052 18880
7998 1 18 . 1 1 27 27 GLN C C 27 177.280 177.280 177.715 -0.435 18880
7999 1 18 . 1 1 27 27 GLN CA C 27 57.550 57.550 59.009 -1.459 18880
8000 1 18 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.309 0.781 18880
8001 1 18 . 1 1 27 27 GLN H H 27 8.240 8.240 7.930 0.310 18880
8002 1 18 . 1 1 28 28 LEU N N 28 121.860 121.860 119.145 2.715 18880
8003 1 18 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.363 -0.193 18880
8004 1 18 . 1 1 28 28 LEU C C 28 177.750 177.750 177.586 0.164 18880
8005 1 18 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.599 1.481 18880
8006 1 18 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.520 -0.250 18880
8007 1 18 . 1 1 28 28 LEU H H 28 7.950 7.950 7.546 0.404 18880
8008 1 18 . 1 1 29 29 ILE N N 29 119.260 119.260 119.065 0.195 18880
8009 1 18 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.054 -0.154 18880
8010 1 18 . 1 1 29 29 ILE C C 29 177.140 177.140 177.474 -0.334 18880
8011 1 18 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.075 0.225 18880
8012 1 18 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.986 1.294 18880
8013 1 18 . 1 1 29 29 ILE H H 29 7.950 7.950 8.084 -0.134 18880
8014 1 18 . 1 1 30 30 GLU N N 30 120.500 120.500 119.146 1.354 18880
8015 1 18 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.465 -0.415 18880
8016 1 18 . 1 1 30 30 GLU C C 30 177.560 177.560 176.611 0.949 18880
8017 1 18 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.894 0.196 18880
8018 1 18 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.100 0.490 18880
8019 1 18 . 1 1 30 30 GLU H H 30 8.220 8.220 8.100 0.120 18880
8020 1 18 . 1 1 31 31 ALA N N 31 121.550 121.550 120.593 0.957 18880
8021 1 18 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.408 -0.258 18880
8022 1 18 . 1 1 31 31 ALA C C 31 178.550 178.550 178.860 -0.310 18880
8023 1 18 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.746 0.054 18880
8024 1 18 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.450 -0.820 18880
8025 1 18 . 1 1 31 31 ALA H H 31 7.890 7.890 7.691 0.199 18880
8026 1 18 . 1 1 32 32 PHE N N 32 117.240 117.240 118.783 -1.543 18880
8027 1 18 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.194 0.106 18880
8028 1 18 . 1 1 32 32 PHE C C 32 176.210 176.210 176.997 -0.787 18880
8029 1 18 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.135 -1.795 18880
8030 1 18 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.999 0.750 18880
8031 1 18 . 1 1 32 32 PHE H H 32 7.930 7.930 7.646 0.284 18880
8032 1 18 . 1 1 33 33 TYR N N 33 119.050 119.050 116.087 2.963 18880
8033 1 18 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.629 -0.299 18880
8034 1 18 . 1 1 33 33 TYR C C 33 175.680 175.680 175.659 0.021 18880
8035 1 18 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.126 0.794 18880
8036 1 18 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.384 1.156 18880
8037 1 18 . 1 1 33 33 TYR H H 33 7.950 7.950 8.066 -0.116 18880
8038 1 18 . 1 1 34 34 ASN N N 34 118.390 118.390 119.039 -0.649 18880
8039 1 18 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.884 -0.254 18880
8040 1 18 . 1 1 34 34 ASN C C 34 174.810 174.810 173.920 0.890 18880
8041 1 18 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.679 -0.529 18880
8042 1 18 . 1 1 34 34 ASN CB C 34 38.980 38.980 40.055 -1.075 18880
8043 1 18 . 1 1 34 34 ASN H H 34 7.960 7.960 7.942 0.018 18880
8044 1 18 . 1 1 35 35 PHE N N 35 120.670 120.670 119.887 0.783 18880
8045 1 18 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.509 -0.059 18880
8046 1 18 . 1 1 35 35 PHE C C 35 175.310 175.310 173.106 2.204 18880
8047 1 18 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.209 0.111 18880
8048 1 18 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.732 -0.312 18880
8049 1 18 . 1 1 35 35 PHE H H 35 7.830 7.830 7.874 -0.044 18880
8050 1 18 . 1 1 36 36 ASP N N 36 122.400 122.400 124.888 -2.488 18880
8051 1 18 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.487 0.103 18880
8052 1 18 . 1 1 36 36 ASP C C 36 176.150 176.150 175.833 0.317 18880
8053 1 18 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.195 -0.125 18880
8054 1 18 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.001 0.319 18880
8055 1 18 . 1 1 36 36 ASP H H 36 8.180 8.180 8.212 -0.032 18880
8056 1 18 . 1 1 37 37 GLY N N 37 108.560 108.560 108.622 -0.062 18880
8057 1 18 . 1 1 37 37 GLY C C 37 173.660 173.660 174.406 -0.746 18880
8058 1 18 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.534 0.076 18880
8059 1 18 . 1 1 37 37 GLY H H 37 7.680 7.680 8.147 -0.467 18880
8060 1 18 . 1 1 38 38 ASP N N 38 120.010 120.010 118.479 1.531 18880
8061 1 18 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.631 -0.031 18880
8062 1 18 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.882 -0.622 18880
8063 1 18 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.596 0.854 18880
8064 1 18 . 1 1 38 38 ASP H H 38 8.220 8.220 8.043 0.177 18880
8065 1 18 . 1 1 39 39 TYR N N 39 121.030 121.030 121.789 -0.759 18880
8066 1 18 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.614 -0.224 18880
8067 1 18 . 1 1 39 39 TYR C C 39 175.290 175.290 175.451 -0.161 18880
8068 1 18 . 1 1 39 39 TYR CA C 39 58.200 58.200 56.487 1.713 18880
8069 1 18 . 1 1 39 39 TYR CB C 39 39.170 39.170 38.456 0.714 18880
8070 1 18 . 1 1 39 39 TYR H H 39 8.090 8.090 7.977 0.113 18880
8071 1 18 . 1 1 40 40 ASP N N 40 122.020 122.020 119.501 2.519 18880
8072 1 18 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.225 0.375 18880
8073 1 18 . 1 1 40 40 ASP C C 40 175.970 175.970 177.016 -1.046 18880
8074 1 18 . 1 1 40 40 ASP CA C 40 54.220 54.220 55.036 -0.816 18880
8075 1 18 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.102 0.418 18880
8076 1 18 . 1 1 40 40 ASP H H 40 8.200 8.200 8.186 0.014 18880
8077 1 18 . 1 1 41 41 GLY N N 41 108.330 108.330 104.936 3.394 18880
8078 1 18 . 1 1 41 41 GLY C C 41 173.000 173.000 173.857 -0.857 18880
8079 1 18 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.575 0.844 18880
8080 1 18 . 1 1 41 41 GLY H H 41 7.830 7.830 8.028 -0.198 18880
8081 1 18 . 1 1 42 42 PHE N N 42 118.600 118.600 123.642 -5.042 18880
8082 1 18 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.383 0.877 18880
8083 1 18 . 1 1 42 42 PHE C C 42 175.660 175.660 175.130 0.530 18880
8084 1 18 . 1 1 42 42 PHE CA C 42 57.160 57.160 59.385 -2.225 18880
8085 1 18 . 1 1 42 42 PHE CB C 42 41.170 41.170 39.630 1.540 18880
8086 1 18 . 1 1 42 42 PHE H H 42 8.150 8.150 7.896 0.254 18880
8087 1 18 . 1 1 43 43 VAL N N 43 119.180 119.180 129.308 -10.128 18880
8088 1 18 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.510 0.160 18880
8089 1 18 . 1 1 43 43 VAL C C 43 175.110 175.110 173.928 1.182 18880
8090 1 18 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.383 0.237 18880
8091 1 18 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.306 -1.426 18880
8092 1 18 . 1 1 43 43 VAL H H 43 9.070 9.070 8.035 1.035 18880
8093 1 18 . 1 1 44 44 SER N N 44 121.380 121.380 122.591 -1.211 18880
8094 1 18 . 1 1 44 44 SER HA H 44 4.570 4.570 4.285 0.285 18880
8095 1 18 . 1 1 44 44 SER C C 44 175.660 175.660 175.699 -0.039 18880
8096 1 18 . 1 1 44 44 SER CA C 44 57.720 57.720 58.691 -0.971 18880
8097 1 18 . 1 1 44 44 SER CB C 44 63.690 63.690 64.298 -0.608 18880
8098 1 18 . 1 1 44 44 SER H H 44 9.140 9.140 8.520 0.620 18880
8099 1 18 . 1 1 45 45 VAL N N 45 122.720 122.720 124.343 -1.623 18880
8100 1 18 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.340 0.160 18880
8101 1 18 . 1 1 45 45 VAL C C 45 177.240 177.240 177.496 -0.256 18880
8102 1 18 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.876 -0.606 18880
8103 1 18 . 1 1 45 45 VAL CB C 45 31.450 31.450 31.209 0.241 18880
8104 1 18 . 1 1 45 45 VAL H H 45 8.140 8.140 8.639 -0.499 18880
8105 1 18 . 1 1 46 46 GLU N N 46 118.990 118.990 117.482 1.508 18880
8106 1 18 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.825 0.155 18880
8107 1 18 . 1 1 46 46 GLU C C 46 179.460 179.460 179.133 0.327 18880
8108 1 18 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.298 0.262 18880
8109 1 18 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.128 0.031 18880
8110 1 18 . 1 1 46 46 GLU H H 46 8.230 8.230 7.706 0.524 18880
8111 1 18 . 1 1 47 47 GLU N N 47 120.120 120.120 118.578 1.542 18880
8112 1 18 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.219 -0.139 18880
8113 1 18 . 1 1 47 47 GLU C C 47 179.170 179.170 178.433 0.737 18880
8114 1 18 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.139 0.751 18880
8115 1 18 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.595 0.225 18880
8116 1 18 . 1 1 47 47 GLU H H 47 7.880 7.880 7.412 0.468 18880
8117 1 18 . 1 1 48 48 PHE N N 48 120.830 120.830 120.800 0.030 18880
8118 1 18 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.121 0.069 18880
8119 1 18 . 1 1 48 48 PHE C C 48 176.920 176.920 177.531 -0.611 18880
8120 1 18 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.583 0.287 18880
8121 1 18 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.097 0.163 18880
8122 1 18 . 1 1 48 48 PHE H H 48 8.600 8.600 8.174 0.426 18880
8123 1 18 . 1 1 49 49 ARG N N 49 118.470 118.470 119.704 -1.234 18880
8124 1 18 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.095 -0.235 18880
8125 1 18 . 1 1 49 49 ARG C C 49 178.090 178.090 178.694 -0.604 18880
8126 1 18 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.665 -0.595 18880
8127 1 18 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.673 0.467 18880
8128 1 18 . 1 1 49 49 ARG H H 49 8.650 8.650 8.204 0.446 18880
8129 1 18 . 1 1 50 50 GLY N N 50 105.080 105.080 105.724 -0.644 18880
8130 1 18 . 1 1 50 50 GLY C C 50 175.090 175.090 176.156 -1.066 18880
8131 1 18 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.695 -0.015 18880
8132 1 18 . 1 1 50 50 GLY H H 50 7.620 7.620 8.348 -0.728 18880
8133 1 18 . 1 1 51 51 ILE N N 51 121.440 121.440 120.404 1.036 18880
8134 1 18 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.808 0.022 18880
8135 1 18 . 1 1 51 51 ILE C C 51 178.300 178.300 176.449 1.851 18880
8136 1 18 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.470 0.370 18880
8137 1 18 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.078 0.232 18880
8138 1 18 . 1 1 51 51 ILE H H 51 7.470 7.470 7.315 0.155 18880
8139 1 18 . 1 1 52 52 ILE N N 52 118.930 118.930 119.783 -0.853 18880
8140 1 18 . 1 1 52 52 ILE HA H 52 3.740 3.740 4.034 -0.294 18880
8141 1 18 . 1 1 52 52 ILE CA C 52 63.760 63.760 62.882 0.878 18880
8142 1 18 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.068 0.962 18880
8143 1 18 . 1 1 52 52 ILE H H 52 7.790 7.790 7.652 0.138 18880
8144 1 18 . 1 1 53 53 ARG N N 53 120.140 120.140 120.597 -0.457 18880
8145 1 18 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.087 0.003 18880
8146 1 18 . 1 1 53 53 ARG C C 53 177.380 177.380 176.915 0.465 18880
8147 1 18 . 1 1 53 53 ARG CA C 53 60.110 60.110 58.928 1.181 18880
8148 1 18 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.086 -0.506 18880
8149 1 18 . 1 1 53 53 ARG H H 53 7.930 7.930 8.649 -0.719 18880
8150 1 18 . 1 1 54 54 ASP N N 54 117.500 117.500 117.474 0.026 18880
8151 1 18 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.855 -0.255 18880
8152 1 18 . 1 1 54 54 ASP C C 54 176.930 176.930 175.528 1.402 18880
8153 1 18 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.383 1.157 18880
8154 1 18 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.908 -0.808 18880
8155 1 18 . 1 1 54 54 ASP H H 54 7.870 7.870 7.692 0.178 18880
8156 1 18 . 1 1 55 55 GLY N N 55 106.370 106.370 107.753 -1.383 18880
8157 1 18 . 1 1 55 55 GLY C C 55 173.460 173.460 173.603 -0.143 18880
8158 1 18 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.361 0.639 18880
8159 1 18 . 1 1 55 55 GLY H H 55 7.880 7.880 7.942 -0.062 18880
8160 1 18 . 1 1 56 56 LEU N N 56 122.630 122.630 121.992 0.638 18880
8161 1 18 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.905 -0.135 18880
8162 1 18 . 1 1 56 56 LEU CA C 56 52.490 52.490 52.005 0.485 18880
8163 1 18 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.067 1.053 18880
8164 1 18 . 1 1 56 56 LEU H H 56 8.220 8.220 7.939 0.281 18880
8165 1 18 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.496 0.084 18880
8166 1 18 . 1 1 57 57 PRO C C 57 176.150 176.150 175.585 0.565 18880
8167 1 18 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.692 -0.272 18880
8168 1 18 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.211 0.529 18880
8169 1 18 . 1 1 58 58 MET N N 58 121.810 121.810 121.997 -0.187 18880
8170 1 18 . 1 1 58 58 MET HA H 58 4.630 4.630 4.460 0.170 18880
8171 1 18 . 1 1 58 58 MET C C 58 176.150 176.150 176.150 0.000 18880
8172 1 18 . 1 1 58 58 MET CA C 58 55.560 55.560 55.281 0.279 18880
8173 1 18 . 1 1 58 58 MET CB C 58 36.820 36.820 34.444 2.377 18880
8174 1 18 . 1 1 58 58 MET H H 58 7.690 7.690 7.939 -0.249 18880
8175 1 18 . 1 1 59 59 THR N N 59 114.180 114.180 116.497 -2.317 18880
8176 1 18 . 1 1 59 59 THR HA H 59 4.450 4.450 4.555 -0.105 18880
8177 1 18 . 1 1 59 59 THR C C 59 175.170 175.170 175.875 -0.705 18880
8178 1 18 . 1 1 59 59 THR CA C 59 60.780 60.780 61.304 -0.524 18880
8179 1 18 . 1 1 59 59 THR CB C 59 71.060 71.060 70.251 0.809 18880
8180 1 18 . 1 1 59 59 THR H H 59 8.940 8.940 8.344 0.596 18880
8181 1 18 . 1 1 60 60 GLU N N 60 120.620 120.620 128.035 -7.415 18880
8182 1 18 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.808 0.202 18880
8183 1 18 . 1 1 60 60 GLU C C 60 179.010 179.010 177.913 1.097 18880
8184 1 18 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.849 -0.029 18880
8185 1 18 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.863 0.187 18880
8186 1 18 . 1 1 60 60 GLU H H 60 8.850 8.850 9.029 -0.179 18880
8187 1 18 . 1 1 61 61 ALA N N 61 121.080 121.080 122.182 -1.102 18880
8188 1 18 . 1 1 61 61 ALA HA H 61 4.140 4.140 4.060 0.080 18880
8189 1 18 . 1 1 61 61 ALA C C 61 180.350 180.350 178.972 1.378 18880
8190 1 18 . 1 1 61 61 ALA CA C 61 55.090 55.090 54.361 0.729 18880
8191 1 18 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.901 0.309 18880
8192 1 18 . 1 1 61 61 ALA H H 61 8.370 8.370 8.369 0.001 18880
8193 1 18 . 1 1 62 62 GLU N N 62 118.890 118.890 116.590 2.300 18880
8194 1 18 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.983 0.017 18880
8195 1 18 . 1 1 62 62 GLU C C 62 179.690 179.690 178.646 1.044 18880
8196 1 18 . 1 1 62 62 GLU CA C 62 58.990 58.990 57.707 1.283 18880
8197 1 18 . 1 1 62 62 GLU CB C 62 30.310 30.310 30.371 -0.061 18880
8198 1 18 . 1 1 62 62 GLU H H 62 7.680 7.680 8.070 -0.390 18880
8199 1 18 . 1 1 63 63 ILE N N 63 122.340 122.340 119.452 2.888 18880
8200 1 18 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.680 -0.110 18880
8201 1 18 . 1 1 63 63 ILE C C 63 177.260 177.260 177.986 -0.726 18880
8202 1 18 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.019 1.871 18880
8203 1 18 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.426 0.554 18880
8204 1 18 . 1 1 63 63 ILE H H 63 8.420 8.420 7.934 0.486 18880
8205 1 18 . 1 1 64 64 THR N N 64 116.970 116.970 116.903 0.067 18880
8206 1 18 . 1 1 64 64 THR HA H 64 3.940 3.940 4.177 -0.237 18880
8207 1 18 . 1 1 64 64 THR C C 64 176.520 176.520 176.431 0.089 18880
8208 1 18 . 1 1 64 64 THR CA C 64 67.060 67.060 67.985 -0.925 18880
8209 1 18 . 1 1 64 64 THR CB C 64 68.750 68.750 68.428 0.322 18880
8210 1 18 . 1 1 64 64 THR H H 64 8.310 8.310 8.629 -0.319 18880
8211 1 18 . 1 1 65 65 GLU N N 65 120.760 120.760 120.929 -0.169 18880
8212 1 18 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.072 -0.042 18880
8213 1 18 . 1 1 65 65 GLU C C 65 175.830 175.830 177.786 -1.956 18880
8214 1 18 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.844 0.656 18880
8215 1 18 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.307 0.463 18880
8216 1 18 . 1 1 65 65 GLU H H 65 7.970 7.970 7.727 0.243 18880
8217 1 18 . 1 1 66 66 PHE N N 66 120.940 120.940 116.623 4.317 18880
8218 1 18 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.372 -0.132 18880
8219 1 18 . 1 1 66 66 PHE C C 66 177.330 177.330 176.593 0.737 18880
8220 1 18 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.709 2.491 18880
8221 1 18 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.230 -0.700 18880
8222 1 18 . 1 1 66 66 PHE H H 66 8.100 8.100 7.285 0.815 18880
8223 1 18 . 1 1 67 67 PHE N N 67 118.110 118.110 119.730 -1.620 18880
8224 1 18 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.273 -0.323 18880
8225 1 18 . 1 1 67 67 PHE C C 67 178.090 178.090 177.668 0.422 18880
8226 1 18 . 1 1 67 67 PHE CA C 67 61.200 61.200 60.254 0.946 18880
8227 1 18 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.907 -0.657 18880
8228 1 18 . 1 1 67 67 PHE H H 67 8.380 8.380 8.418 -0.038 18880
8229 1 18 . 1 1 68 68 GLU N N 68 119.650 119.650 118.082 1.568 18880
8230 1 18 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.213 -0.203 18880
8231 1 18 . 1 1 68 68 GLU C C 68 177.910 177.910 177.212 0.698 18880
8232 1 18 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.520 0.720 18880
8233 1 18 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.398 -0.028 18880
8234 1 18 . 1 1 68 68 GLU H H 68 8.230 8.230 8.201 0.029 18880
8235 1 18 . 1 1 69 69 ALA N N 69 119.090 119.090 121.131 -2.041 18880
8236 1 18 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.294 -0.114 18880
8237 1 18 . 1 1 69 69 ALA C C 69 179.030 179.030 178.188 0.842 18880
8238 1 18 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.703 -0.103 18880
8239 1 18 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.398 0.382 18880
8240 1 18 . 1 1 69 69 ALA H H 69 7.340 7.340 8.003 -0.663 18880
8241 1 18 . 1 1 70 70 ALA N N 70 118.670 118.670 119.867 -1.197 18880
8242 1 18 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.423 -0.403 18880
8243 1 18 . 1 1 70 70 ALA C C 70 176.820 176.820 177.486 -0.666 18880
8244 1 18 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.577 0.513 18880
8245 1 18 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.418 -0.808 18880
8246 1 18 . 1 1 70 70 ALA H H 70 8.050 8.050 7.486 0.564 18880
8247 1 18 . 1 1 71 71 ASP N N 71 116.780 116.780 118.779 -1.999 18880
8248 1 18 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.191 0.029 18880
8249 1 18 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.947 1.203 18880
8250 1 18 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.135 -2.225 18880
8251 1 18 . 1 1 71 71 ASP H H 71 8.010 8.010 7.519 0.491 18880
8252 1 18 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.484 -0.014 18880
8253 1 18 . 1 1 72 72 PRO C C 72 177.970 177.970 176.511 1.459 18880
8254 1 18 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.394 0.516 18880
8255 1 18 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.481 -0.601 18880
8256 1 18 . 1 1 73 73 ASN N N 73 114.930 114.930 116.077 -1.147 18880
8257 1 18 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.651 0.229 18880
8258 1 18 . 1 1 73 73 ASN C C 73 174.880 174.880 175.103 -0.223 18880
8259 1 18 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.493 -0.653 18880
8260 1 18 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.758 -0.378 18880
8261 1 18 . 1 1 73 73 ASN H H 73 9.030 9.030 8.233 0.797 18880
8262 1 18 . 1 1 74 74 ASN N N 74 118.340 118.340 112.558 5.782 18880
8263 1 18 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.538 -0.178 18880
8264 1 18 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.015 0.575 18880
8265 1 18 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.636 0.524 18880
8266 1 18 . 1 1 74 74 ASN H H 74 8.320 8.320 8.437 -0.117 18880
8267 1 18 . 1 1 75 75 THR N N 75 113.450 113.450 115.261 -1.811 18880
8268 1 18 . 1 1 75 75 THR HA H 75 4.210 4.210 4.230 -0.020 18880
8269 1 18 . 1 1 75 75 THR CA C 75 63.410 63.410 60.251 3.159 18880
8270 1 18 . 1 1 75 75 THR CB C 75 70.540 70.540 67.651 2.889 18880
8271 1 18 . 1 1 75 75 THR H H 75 9.870 9.870 7.939 1.931 18880
8272 1 18 . 1 1 76 76 GLY N N 76 111.810 111.810 109.215 2.595 18880
8273 1 18 . 1 1 76 76 GLY C C 76 173.670 173.670 173.697 -0.027 18880
8274 1 18 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.853 -0.733 18880
8275 1 18 . 1 1 76 76 GLY H H 76 10.250 10.250 7.397 2.853 18880
8276 1 18 . 1 1 77 77 PHE N N 77 120.560 120.560 117.449 3.111 18880
8277 1 18 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.810 0.340 18880
8278 1 18 . 1 1 77 77 PHE CA C 77 57.180 57.180 55.922 1.258 18880
8279 1 18 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.154 1.347 18880
8280 1 18 . 1 1 77 77 PHE H H 77 8.110 8.110 7.183 0.927 18880
8281 1 18 . 1 1 78 78 ILE N N 78 116.410 116.410 120.163 -3.753 18880
8282 1 18 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.304 0.086 18880
8283 1 18 . 1 1 78 78 ILE C C 78 174.770 174.770 174.387 0.383 18880
8284 1 18 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.648 -0.458 18880
8285 1 18 . 1 1 78 78 ILE CB C 78 41.180 41.180 41.755 -0.575 18880
8286 1 18 . 1 1 78 78 ILE H H 78 8.930 8.930 8.010 0.920 18880
8287 1 18 . 1 1 79 79 ASP N N 79 125.220 125.220 125.792 -0.572 18880
8288 1 18 . 1 1 79 79 ASP HA H 79 4.500 4.500 5.049 -0.549 18880
8289 1 18 . 1 1 79 79 ASP C C 79 176.490 176.490 176.754 -0.264 18880
8290 1 18 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.888 0.422 18880
8291 1 18 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.408 0.962 18880
8292 1 18 . 1 1 79 79 ASP H H 79 8.610 8.610 8.631 -0.021 18880
8293 1 18 . 1 1 80 80 TYR N N 80 125.760 125.760 128.995 -3.235 18880
8294 1 18 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.051 -0.061 18880
8295 1 18 . 1 1 80 80 TYR C C 80 177.140 177.140 176.619 0.521 18880
8296 1 18 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.311 -0.731 18880
8297 1 18 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.633 0.257 18880
8298 1 18 . 1 1 80 80 TYR H H 80 8.460 8.460 8.598 -0.138 18880
8299 1 18 . 1 1 81 81 LYS N N 81 118.320 118.320 117.846 0.474 18880
8300 1 18 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.994 -0.094 18880
8301 1 18 . 1 1 81 81 LYS C C 81 179.090 179.090 178.922 0.168 18880
8302 1 18 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.322 0.258 18880
8303 1 18 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.620 0.140 18880
8304 1 18 . 1 1 81 81 LYS H H 81 8.410 8.410 8.600 -0.190 18880
8305 1 18 . 1 1 82 82 ALA N N 82 122.050 122.050 121.870 0.180 18880
8306 1 18 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.195 -0.065 18880
8307 1 18 . 1 1 82 82 ALA C C 82 179.740 179.740 179.584 0.156 18880
8308 1 18 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.703 -0.183 18880
8309 1 18 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.288 0.252 18880
8310 1 18 . 1 1 82 82 ALA H H 82 7.770 7.770 8.004 -0.234 18880
8311 1 18 . 1 1 83 83 PHE N N 83 117.810 117.810 116.936 0.874 18880
8312 1 18 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.234 0.056 18880
8313 1 18 . 1 1 83 83 PHE C C 83 176.460 176.460 176.694 -0.234 18880
8314 1 18 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.252 -0.223 18880
8315 1 18 . 1 1 83 83 PHE CB C 83 39.520 39.520 40.115 -0.595 18880
8316 1 18 . 1 1 83 83 PHE H H 83 7.780 7.780 7.812 -0.032 18880
8317 1 18 . 1 1 84 84 ALA N N 84 121.530 121.530 122.084 -0.554 18880
8318 1 18 . 1 1 84 84 ALA HA H 84 3.660 3.660 3.829 -0.169 18880
8319 1 18 . 1 1 84 84 ALA C C 84 179.010 179.010 178.797 0.213 18880
8320 1 18 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.061 0.969 18880
8321 1 18 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.112 0.018 18880
8322 1 18 . 1 1 84 84 ALA H H 84 8.290 8.290 8.303 -0.013 18880
8323 1 18 . 1 1 85 85 ALA N N 85 117.720 117.720 120.038 -2.318 18880
8324 1 18 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.240 -0.160 18880
8325 1 18 . 1 1 85 85 ALA C C 85 179.570 179.570 179.405 0.165 18880
8326 1 18 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.711 -0.341 18880
8327 1 18 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.511 -0.221 18880
8328 1 18 . 1 1 85 85 ALA H H 85 7.700 7.700 8.678 -0.978 18880
8329 1 18 . 1 1 86 86 MET N N 86 116.570 116.570 115.575 0.995 18880
8330 1 18 . 1 1 86 86 MET HA H 86 4.160 4.160 4.180 -0.020 18880
8331 1 18 . 1 1 86 86 MET C C 86 177.360 177.360 176.796 0.564 18880
8332 1 18 . 1 1 86 86 MET CA C 86 57.380 57.380 57.154 0.226 18880
8333 1 18 . 1 1 86 86 MET CB C 86 32.720 32.720 32.088 0.632 18880
8334 1 18 . 1 1 86 86 MET H H 86 7.560 7.560 7.307 0.253 18880
8335 1 18 . 1 1 87 87 LEU N N 87 119.090 119.090 116.129 2.961 18880
8336 1 18 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.065 -0.095 18880
8337 1 18 . 1 1 87 87 LEU C C 87 177.420 177.420 176.318 1.102 18880
8338 1 18 . 1 1 87 87 LEU CA C 87 56.290 56.290 54.697 1.593 18880
8339 1 18 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.039 0.241 18880
8340 1 18 . 1 1 87 87 LEU H H 87 7.570 7.570 6.933 0.637 18880
8341 1 18 . 1 1 88 88 TYR N N 88 117.060 117.060 115.600 1.460 18880
8342 1 18 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.692 -0.102 18880
8343 1 18 . 1 1 88 88 TYR C C 88 175.870 175.870 175.524 0.346 18880
8344 1 18 . 1 1 88 88 TYR CA C 88 57.840 57.840 54.422 3.418 18880
8345 1 18 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.851 0.789 18880
8346 1 18 . 1 1 88 88 TYR H H 88 7.740 7.740 7.116 0.624 18880
8347 1 18 . 1 1 89 89 SER N N 89 115.980 115.980 115.277 0.703 18880
8348 1 18 . 1 1 89 89 SER HA H 89 4.440 4.440 4.133 0.307 18880
8349 1 18 . 1 1 89 89 SER C C 89 174.460 174.460 173.916 0.544 18880
8350 1 18 . 1 1 89 89 SER CA C 89 58.350 58.350 59.949 -1.599 18880
8351 1 18 . 1 1 89 89 SER CB C 89 63.990 63.990 62.133 1.857 18880
8352 1 18 . 1 1 89 89 SER H H 89 7.880 7.880 8.312 -0.432 18880
8353 1 18 . 1 1 90 90 VAL N N 90 120.910 120.910 114.692 6.218 18880
8354 1 18 . 1 1 90 90 VAL HA H 90 4.140 4.140 3.792 0.348 18880
8355 1 18 . 1 1 90 90 VAL C C 90 175.720 175.720 174.939 0.781 18880
8356 1 18 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.919 -0.649 18880
8357 1 18 . 1 1 90 90 VAL CB C 90 32.840 32.840 30.165 2.675 18880
8358 1 18 . 1 1 90 90 VAL H H 90 8.020 8.020 8.024 -0.004 18880
8359 1 18 . 1 1 91 91 ASP N N 91 123.620 123.620 118.832 4.788 18880
8360 1 18 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.390 0.240 18880
8361 1 18 . 1 1 91 91 ASP C C 91 176.000 176.000 175.235 0.765 18880
8362 1 18 . 1 1 91 91 ASP CA C 91 54.510 54.510 55.649 -1.139 18880
8363 1 18 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.513 -0.073 18880
8364 1 18 . 1 1 91 91 ASP H H 91 8.310 8.310 8.219 0.091 18880
8365 1 18 . 1 1 92 92 GLU N N 92 122.170 122.170 124.101 -1.931 18880
8366 1 18 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.578 -0.218 18880
8367 1 18 . 1 1 92 92 GLU C C 92 175.660 175.660 175.428 0.232 18880
8368 1 18 . 1 1 92 92 GLU CA C 92 56.490 56.490 55.769 0.721 18880
8369 1 18 . 1 1 92 92 GLU CB C 92 32.850 32.850 31.876 0.974 18880
8370 1 18 . 1 1 92 92 GLU H H 92 8.320 8.320 8.501 -0.181 18880
8371 1 19 . 1 1 10 10 HIS C C 10 176.040 176.040 174.408 1.632 18880
8372 1 19 . 1 1 11 11 SER N N 11 116.840 116.840 116.839 0.001 18880
8373 1 19 . 1 1 11 11 SER HA H 11 4.430 4.430 4.433 -0.003 18880
8374 1 19 . 1 1 11 11 SER C C 11 174.630 174.630 173.999 0.631 18880
8375 1 19 . 1 1 11 11 SER CA C 11 58.350 58.350 58.343 0.007 18880
8376 1 19 . 1 1 11 11 SER CB C 11 64.120 64.120 63.855 0.265 18880
8377 1 19 . 1 1 11 11 SER H H 11 8.360 8.360 8.381 -0.021 18880
8378 1 19 . 1 1 12 12 SER N N 12 118.030 118.030 117.830 0.200 18880
8379 1 19 . 1 1 12 12 SER HA H 12 4.440 4.440 4.577 -0.137 18880
8380 1 19 . 1 1 12 12 SER C C 12 174.880 174.880 174.015 0.865 18880
8381 1 19 . 1 1 12 12 SER CA C 12 58.680 58.680 58.782 -0.102 18880
8382 1 19 . 1 1 12 12 SER CB C 12 63.890 63.890 64.217 -0.327 18880
8383 1 19 . 1 1 12 12 SER H H 12 8.490 8.490 8.419 0.071 18880
8384 1 19 . 1 1 13 13 GLY N N 13 110.450 110.450 109.508 0.942 18880
8385 1 19 . 1 1 13 13 GLY C C 13 173.790 173.790 173.322 0.468 18880
8386 1 19 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.267 0.193 18880
8387 1 19 . 1 1 13 13 GLY H H 13 8.390 8.390 8.348 0.042 18880
8388 1 19 . 1 1 14 14 LEU N N 14 121.310 121.310 120.838 0.472 18880
8389 1 19 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.748 -0.408 18880
8390 1 19 . 1 1 14 14 LEU C C 14 176.930 176.930 175.797 1.133 18880
8391 1 19 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.638 0.562 18880
8392 1 19 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.315 0.285 18880
8393 1 19 . 1 1 14 14 LEU H H 14 8.020 8.020 7.877 0.143 18880
8394 1 19 . 1 1 15 15 VAL N N 15 121.550 121.550 120.028 1.522 18880
8395 1 19 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.120 0.250 18880
8396 1 19 . 1 1 15 15 VAL CA C 15 59.720 59.720 62.930 -3.210 18880
8397 1 19 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.981 0.789 18880
8398 1 19 . 1 1 15 15 VAL H H 15 8.030 8.030 7.988 0.042 18880
8399 1 19 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.264 0.106 18880
8400 1 19 . 1 1 16 16 PRO C C 16 176.720 176.720 176.819 -0.099 18880
8401 1 19 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.076 -1.426 18880
8402 1 19 . 1 1 16 16 PRO CB C 16 32.240 32.240 31.781 0.459 18880
8403 1 19 . 1 1 17 17 ARG N N 17 121.890 121.890 119.665 2.225 18880
8404 1 19 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.012 0.268 18880
8405 1 19 . 1 1 17 17 ARG C C 17 176.940 176.940 176.284 0.656 18880
8406 1 19 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.857 -0.497 18880
8407 1 19 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.268 0.782 18880
8408 1 19 . 1 1 17 17 ARG H H 17 8.450 8.450 7.880 0.570 18880
8409 1 19 . 1 1 18 18 GLY N N 18 110.160 110.160 112.233 -2.073 18880
8410 1 19 . 1 1 18 18 GLY C C 18 174.110 174.110 173.091 1.019 18880
8411 1 19 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.480 0.910 18880
8412 1 19 . 1 1 18 18 GLY H H 18 8.480 8.480 8.176 0.304 18880
8413 1 19 . 1 1 19 19 SER N N 19 115.500 115.500 117.545 -2.045 18880
8414 1 19 . 1 1 19 19 SER HA H 19 4.400 4.400 4.580 -0.180 18880
8415 1 19 . 1 1 19 19 SER C C 19 174.380 174.380 172.985 1.395 18880
8416 1 19 . 1 1 19 19 SER CA C 19 58.610 58.610 57.253 1.357 18880
8417 1 19 . 1 1 19 19 SER CB C 19 63.830 63.830 64.227 -0.397 18880
8418 1 19 . 1 1 19 19 SER H H 19 8.210 8.210 7.795 0.415 18880
8419 1 19 . 1 1 20 20 HIS N N 20 120.770 120.770 118.894 1.876 18880
8420 1 19 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.415 0.195 18880
8421 1 19 . 1 1 20 20 HIS C C 20 174.870 174.870 174.389 0.481 18880
8422 1 19 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.562 -0.432 18880
8423 1 19 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.586 0.124 18880
8424 1 19 . 1 1 20 20 HIS H H 20 8.590 8.590 8.666 -0.076 18880
8425 1 19 . 1 1 21 21 MET N N 21 121.440 121.440 124.560 -3.120 18880
8426 1 19 . 1 1 21 21 MET HA H 21 4.470 4.470 4.734 -0.264 18880
8427 1 19 . 1 1 21 21 MET C C 21 176.030 176.030 176.455 -0.425 18880
8428 1 19 . 1 1 21 21 MET CA C 21 55.490 55.490 54.418 1.072 18880
8429 1 19 . 1 1 21 21 MET CB C 21 33.170 33.170 31.307 1.863 18880
8430 1 19 . 1 1 21 21 MET H H 21 8.310 8.310 8.520 -0.210 18880
8431 1 19 . 1 1 22 22 SER N N 22 116.860 116.860 117.492 -0.632 18880
8432 1 19 . 1 1 22 22 SER HA H 22 4.430 4.430 4.623 -0.193 18880
8433 1 19 . 1 1 22 22 SER C C 22 174.630 174.630 175.312 -0.682 18880
8434 1 19 . 1 1 22 22 SER CA C 22 58.410 58.410 59.015 -0.605 18880
8435 1 19 . 1 1 22 22 SER CB C 22 64.030 64.030 64.000 0.030 18880
8436 1 19 . 1 1 22 22 SER H H 22 8.340 8.340 8.619 -0.279 18880
8437 1 19 . 1 1 23 23 ASP N N 23 122.660 122.660 122.556 0.104 18880
8438 1 19 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.491 0.059 18880
8439 1 19 . 1 1 23 23 ASP C C 23 176.860 176.860 177.715 -0.855 18880
8440 1 19 . 1 1 23 23 ASP CA C 23 55.330 55.330 56.257 -0.927 18880
8441 1 19 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.651 0.349 18880
8442 1 19 . 1 1 23 23 ASP H H 23 8.540 8.540 8.562 -0.021 18880
8443 1 19 . 1 1 24 24 GLU N N 24 120.400 120.400 119.153 1.247 18880
8444 1 19 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.095 0.045 18880
8445 1 19 . 1 1 24 24 GLU C C 24 177.540 177.540 177.288 0.252 18880
8446 1 19 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.516 -0.156 18880
8447 1 19 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.514 0.236 18880
8448 1 19 . 1 1 24 24 GLU H H 24 8.610 8.610 8.424 0.186 18880
8449 1 19 . 1 1 25 25 LYS N N 25 120.390 120.390 116.845 3.545 18880
8450 1 19 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.306 -0.116 18880
8451 1 19 . 1 1 25 25 LYS C C 25 177.490 177.490 178.377 -0.887 18880
8452 1 19 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.194 -0.084 18880
8453 1 19 . 1 1 25 25 LYS CB C 25 32.490 32.490 33.037 -0.547 18880
8454 1 19 . 1 1 25 25 LYS H H 25 8.210 8.210 7.495 0.715 18880
8455 1 19 . 1 1 26 26 THR N N 26 114.880 114.880 116.015 -1.135 18880
8456 1 19 . 1 1 26 26 THR HA H 26 4.040 4.040 4.114 -0.074 18880
8457 1 19 . 1 1 26 26 THR C C 26 175.430 175.430 176.988 -1.558 18880
8458 1 19 . 1 1 26 26 THR CA C 26 64.620 64.620 65.774 -1.154 18880
8459 1 19 . 1 1 26 26 THR CB C 26 69.110 69.110 68.586 0.524 18880
8460 1 19 . 1 1 26 26 THR H H 26 8.080 8.080 7.483 0.597 18880
8461 1 19 . 1 1 27 27 GLN N N 27 120.940 120.940 120.460 0.480 18880
8462 1 19 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.027 0.163 18880
8463 1 19 . 1 1 27 27 GLN C C 27 177.280 177.280 176.999 0.281 18880
8464 1 19 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.551 -1.001 18880
8465 1 19 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.355 0.735 18880
8466 1 19 . 1 1 27 27 GLN H H 27 8.240 8.240 7.819 0.421 18880
8467 1 19 . 1 1 28 28 LEU N N 28 121.860 121.860 117.826 4.034 18880
8468 1 19 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.395 -0.225 18880
8469 1 19 . 1 1 28 28 LEU C C 28 177.750 177.750 178.418 -0.668 18880
8470 1 19 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.543 1.537 18880
8471 1 19 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.611 -0.341 18880
8472 1 19 . 1 1 28 28 LEU H H 28 7.950 7.950 7.403 0.547 18880
8473 1 19 . 1 1 29 29 ILE N N 29 119.260 119.260 119.017 0.243 18880
8474 1 19 . 1 1 29 29 ILE HA H 29 3.900 3.900 4.058 -0.158 18880
8475 1 19 . 1 1 29 29 ILE C C 29 177.140 177.140 177.447 -0.307 18880
8476 1 19 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.074 0.226 18880
8477 1 19 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.903 1.377 18880
8478 1 19 . 1 1 29 29 ILE H H 29 7.950 7.950 8.041 -0.091 18880
8479 1 19 . 1 1 30 30 GLU N N 30 120.500 120.500 118.737 1.763 18880
8480 1 19 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.358 -0.308 18880
8481 1 19 . 1 1 30 30 GLU C C 30 177.560 177.560 176.674 0.886 18880
8482 1 19 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.859 0.231 18880
8483 1 19 . 1 1 30 30 GLU CB C 30 29.590 29.590 28.739 0.851 18880
8484 1 19 . 1 1 30 30 GLU H H 30 8.220 8.220 8.088 0.132 18880
8485 1 19 . 1 1 31 31 ALA N N 31 121.550 121.550 120.596 0.954 18880
8486 1 19 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.464 -0.314 18880
8487 1 19 . 1 1 31 31 ALA C C 31 178.550 178.550 179.065 -0.515 18880
8488 1 19 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.840 -0.040 18880
8489 1 19 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.571 -0.941 18880
8490 1 19 . 1 1 31 31 ALA H H 31 7.890 7.890 7.794 0.096 18880
8491 1 19 . 1 1 32 32 PHE N N 32 117.240 117.240 118.034 -0.794 18880
8492 1 19 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.227 0.073 18880
8493 1 19 . 1 1 32 32 PHE C C 32 176.210 176.210 176.817 -0.607 18880
8494 1 19 . 1 1 32 32 PHE CA C 32 59.340 59.340 61.488 -2.148 18880
8495 1 19 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.032 0.718 18880
8496 1 19 . 1 1 32 32 PHE H H 32 7.930 7.930 7.951 -0.021 18880
8497 1 19 . 1 1 33 33 TYR N N 33 119.050 119.050 116.420 2.630 18880
8498 1 19 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.629 -0.299 18880
8499 1 19 . 1 1 33 33 TYR C C 33 175.680 175.680 175.478 0.202 18880
8500 1 19 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.860 1.060 18880
8501 1 19 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.120 1.420 18880
8502 1 19 . 1 1 33 33 TYR H H 33 7.950 7.950 8.390 -0.440 18880
8503 1 19 . 1 1 34 34 ASN N N 34 118.390 118.390 118.909 -0.519 18880
8504 1 19 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.873 -0.243 18880
8505 1 19 . 1 1 34 34 ASN C C 34 174.810 174.810 173.863 0.947 18880
8506 1 19 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.753 -0.603 18880
8507 1 19 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.824 -0.844 18880
8508 1 19 . 1 1 34 34 ASN H H 34 7.960 7.960 7.870 0.090 18880
8509 1 19 . 1 1 35 35 PHE N N 35 120.670 120.670 120.295 0.375 18880
8510 1 19 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.611 -0.161 18880
8511 1 19 . 1 1 35 35 PHE C C 35 175.310 175.310 173.503 1.807 18880
8512 1 19 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.574 -0.254 18880
8513 1 19 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.052 -0.632 18880
8514 1 19 . 1 1 35 35 PHE H H 35 7.830 7.830 8.011 -0.181 18880
8515 1 19 . 1 1 36 36 ASP N N 36 122.400 122.400 122.611 -0.211 18880
8516 1 19 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.654 -0.064 18880
8517 1 19 . 1 1 36 36 ASP C C 36 176.150 176.150 176.932 -0.782 18880
8518 1 19 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.397 0.673 18880
8519 1 19 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.025 0.295 18880
8520 1 19 . 1 1 36 36 ASP H H 36 8.180 8.180 8.305 -0.125 18880
8521 1 19 . 1 1 37 37 GLY N N 37 108.560 108.560 108.728 -0.168 18880
8522 1 19 . 1 1 37 37 GLY C C 37 173.660 173.660 175.138 -1.478 18880
8523 1 19 . 1 1 37 37 GLY CA C 37 45.610 45.610 46.001 -0.391 18880
8524 1 19 . 1 1 37 37 GLY H H 37 7.680 7.680 7.917 -0.237 18880
8525 1 19 . 1 1 38 38 ASP N N 38 120.010 120.010 118.207 1.803 18880
8526 1 19 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.636 -0.036 18880
8527 1 19 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.157 0.103 18880
8528 1 19 . 1 1 38 38 ASP CB C 38 41.450 41.450 41.136 0.314 18880
8529 1 19 . 1 1 38 38 ASP H H 38 8.220 8.220 8.164 0.056 18880
8530 1 19 . 1 1 39 39 TYR N N 39 121.030 121.030 119.731 1.299 18880
8531 1 19 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.051 0.339 18880
8532 1 19 . 1 1 39 39 TYR C C 39 175.290 175.290 173.808 1.482 18880
8533 1 19 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.735 -0.535 18880
8534 1 19 . 1 1 39 39 TYR CB C 39 39.170 39.170 37.776 1.394 18880
8535 1 19 . 1 1 39 39 TYR H H 39 8.090 8.090 8.278 -0.188 18880
8536 1 19 . 1 1 40 40 ASP N N 40 122.020 122.020 121.998 0.022 18880
8537 1 19 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.644 -0.044 18880
8538 1 19 . 1 1 40 40 ASP C C 40 175.970 175.970 175.971 -0.001 18880
8539 1 19 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.904 0.316 18880
8540 1 19 . 1 1 40 40 ASP CB C 40 41.520 41.520 42.539 -1.019 18880
8541 1 19 . 1 1 40 40 ASP H H 40 8.200 8.200 7.830 0.370 18880
8542 1 19 . 1 1 41 41 GLY N N 41 108.330 108.330 108.385 -0.055 18880
8543 1 19 . 1 1 41 41 GLY C C 41 173.000 173.000 174.005 -1.005 18880
8544 1 19 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.935 0.485 18880
8545 1 19 . 1 1 41 41 GLY H H 41 7.830 7.830 8.490 -0.660 18880
8546 1 19 . 1 1 42 42 PHE N N 42 118.600 118.600 119.431 -0.831 18880
8547 1 19 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.852 0.408 18880
8548 1 19 . 1 1 42 42 PHE C C 42 175.660 175.660 174.045 1.615 18880
8549 1 19 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.625 -0.465 18880
8550 1 19 . 1 1 42 42 PHE CB C 42 41.170 41.170 42.100 -0.930 18880
8551 1 19 . 1 1 42 42 PHE H H 42 8.150 8.150 7.647 0.503 18880
8552 1 19 . 1 1 43 43 VAL N N 43 119.180 119.180 125.221 -6.041 18880
8553 1 19 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.438 0.232 18880
8554 1 19 . 1 1 43 43 VAL C C 43 175.110 175.110 174.521 0.589 18880
8555 1 19 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.519 0.101 18880
8556 1 19 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.954 -2.074 18880
8557 1 19 . 1 1 43 43 VAL H H 43 9.070 9.070 8.359 0.711 18880
8558 1 19 . 1 1 44 44 SER N N 44 121.380 121.380 123.126 -1.746 18880
8559 1 19 . 1 1 44 44 SER HA H 44 4.570 4.570 4.207 0.363 18880
8560 1 19 . 1 1 44 44 SER C C 44 175.660 175.660 175.126 0.534 18880
8561 1 19 . 1 1 44 44 SER CA C 44 57.720 57.720 57.802 -0.082 18880
8562 1 19 . 1 1 44 44 SER CB C 44 63.690 63.690 62.939 0.751 18880
8563 1 19 . 1 1 44 44 SER H H 44 9.140 9.140 8.467 0.673 18880
8564 1 19 . 1 1 45 45 VAL N N 45 122.720 122.720 123.316 -0.596 18880
8565 1 19 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.207 0.293 18880
8566 1 19 . 1 1 45 45 VAL C C 45 177.240 177.240 177.323 -0.083 18880
8567 1 19 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.947 -0.677 18880
8568 1 19 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.853 0.597 18880
8569 1 19 . 1 1 45 45 VAL H H 45 8.140 8.140 8.271 -0.131 18880
8570 1 19 . 1 1 46 46 GLU N N 46 118.990 118.990 119.091 -0.101 18880
8571 1 19 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.761 0.219 18880
8572 1 19 . 1 1 46 46 GLU C C 46 179.460 179.460 179.153 0.307 18880
8573 1 19 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.620 -0.060 18880
8574 1 19 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.843 0.317 18880
8575 1 19 . 1 1 46 46 GLU H H 46 8.230 8.230 7.331 0.899 18880
8576 1 19 . 1 1 47 47 GLU N N 47 120.120 120.120 118.205 1.915 18880
8577 1 19 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.174 -0.094 18880
8578 1 19 . 1 1 47 47 GLU C C 47 179.170 179.170 178.567 0.603 18880
8579 1 19 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.201 0.689 18880
8580 1 19 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.356 0.464 18880
8581 1 19 . 1 1 47 47 GLU H H 47 7.880 7.880 8.043 -0.163 18880
8582 1 19 . 1 1 48 48 PHE N N 48 120.830 120.830 120.813 0.017 18880
8583 1 19 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.315 -0.125 18880
8584 1 19 . 1 1 48 48 PHE C C 48 176.920 176.920 177.632 -0.712 18880
8585 1 19 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.249 0.621 18880
8586 1 19 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.073 0.187 18880
8587 1 19 . 1 1 48 48 PHE H H 48 8.600 8.600 8.049 0.551 18880
8588 1 19 . 1 1 49 49 ARG N N 49 118.470 118.470 119.657 -1.187 18880
8589 1 19 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.089 -0.229 18880
8590 1 19 . 1 1 49 49 ARG C C 49 178.090 178.090 178.665 -0.575 18880
8591 1 19 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.409 -0.339 18880
8592 1 19 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.963 0.177 18880
8593 1 19 . 1 1 49 49 ARG H H 49 8.650 8.650 9.079 -0.429 18880
8594 1 19 . 1 1 50 50 GLY N N 50 105.080 105.080 105.284 -0.204 18880
8595 1 19 . 1 1 50 50 GLY C C 50 175.090 175.090 175.920 -0.830 18880
8596 1 19 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.949 -0.269 18880
8597 1 19 . 1 1 50 50 GLY H H 50 7.620 7.620 7.932 -0.312 18880
8598 1 19 . 1 1 51 51 ILE N N 51 121.440 121.440 121.574 -0.134 18880
8599 1 19 . 1 1 51 51 ILE HA H 51 3.830 3.830 4.054 -0.224 18880
8600 1 19 . 1 1 51 51 ILE C C 51 178.300 178.300 177.410 0.890 18880
8601 1 19 . 1 1 51 51 ILE CA C 51 63.840 63.840 64.085 -0.245 18880
8602 1 19 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.666 -0.356 18880
8603 1 19 . 1 1 51 51 ILE H H 51 7.470 7.470 7.410 0.060 18880
8604 1 19 . 1 1 52 52 ILE N N 52 118.930 118.930 120.041 -1.111 18880
8605 1 19 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.831 -0.091 18880
8606 1 19 . 1 1 52 52 ILE CA C 52 63.760 63.760 62.930 0.830 18880
8607 1 19 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.543 1.487 18880
8608 1 19 . 1 1 52 52 ILE H H 52 7.790 7.790 8.556 -0.766 18880
8609 1 19 . 1 1 53 53 ARG N N 53 120.140 120.140 119.309 0.831 18880
8610 1 19 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.054 0.036 18880
8611 1 19 . 1 1 53 53 ARG C C 53 177.380 177.380 177.453 -0.073 18880
8612 1 19 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.279 0.831 18880
8613 1 19 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.389 -0.809 18880
8614 1 19 . 1 1 53 53 ARG H H 53 7.930 7.930 8.419 -0.489 18880
8615 1 19 . 1 1 54 54 ASP N N 54 117.500 117.500 116.513 0.987 18880
8616 1 19 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.841 -0.241 18880
8617 1 19 . 1 1 54 54 ASP C C 54 176.930 176.930 176.154 0.776 18880
8618 1 19 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.070 1.470 18880
8619 1 19 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.566 -0.466 18880
8620 1 19 . 1 1 54 54 ASP H H 54 7.870 7.870 8.137 -0.267 18880
8621 1 19 . 1 1 55 55 GLY N N 55 106.370 106.370 108.053 -1.683 18880
8622 1 19 . 1 1 55 55 GLY C C 55 173.460 173.460 173.980 -0.520 18880
8623 1 19 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.442 0.558 18880
8624 1 19 . 1 1 55 55 GLY H H 55 7.880 7.880 7.755 0.125 18880
8625 1 19 . 1 1 56 56 LEU N N 56 122.630 122.630 122.722 -0.092 18880
8626 1 19 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.743 0.027 18880
8627 1 19 . 1 1 56 56 LEU CA C 56 52.490 52.490 52.221 0.269 18880
8628 1 19 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.303 0.817 18880
8629 1 19 . 1 1 56 56 LEU H H 56 8.220 8.220 7.942 0.278 18880
8630 1 19 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.474 0.106 18880
8631 1 19 . 1 1 57 57 PRO C C 57 176.150 176.150 175.522 0.628 18880
8632 1 19 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.926 -0.506 18880
8633 1 19 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.879 -0.139 18880
8634 1 19 . 1 1 58 58 MET N N 58 121.810 121.810 123.712 -1.902 18880
8635 1 19 . 1 1 58 58 MET HA H 58 4.630 4.630 4.576 0.054 18880
8636 1 19 . 1 1 58 58 MET C C 58 176.150 176.150 175.026 1.124 18880
8637 1 19 . 1 1 58 58 MET CA C 58 55.560 55.560 54.612 0.948 18880
8638 1 19 . 1 1 58 58 MET CB C 58 36.820 36.820 36.310 0.510 18880
8639 1 19 . 1 1 58 58 MET H H 58 7.690 7.690 7.760 -0.070 18880
8640 1 19 . 1 1 59 59 THR N N 59 114.180 114.180 115.025 -0.845 18880
8641 1 19 . 1 1 59 59 THR HA H 59 4.450 4.450 4.423 0.027 18880
8642 1 19 . 1 1 59 59 THR C C 59 175.170 175.170 175.717 -0.547 18880
8643 1 19 . 1 1 59 59 THR CA C 59 60.780 60.780 60.227 0.553 18880
8644 1 19 . 1 1 59 59 THR CB C 59 71.060 71.060 69.615 1.445 18880
8645 1 19 . 1 1 59 59 THR H H 59 8.940 8.940 8.250 0.690 18880
8646 1 19 . 1 1 60 60 GLU N N 60 120.620 120.620 125.210 -4.590 18880
8647 1 19 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.677 0.333 18880
8648 1 19 . 1 1 60 60 GLU C C 60 179.010 179.010 178.080 0.930 18880
8649 1 19 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.746 0.074 18880
8650 1 19 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.628 0.422 18880
8651 1 19 . 1 1 60 60 GLU H H 60 8.850 8.850 8.886 -0.036 18880
8652 1 19 . 1 1 61 61 ALA N N 61 121.080 121.080 122.154 -1.074 18880
8653 1 19 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.952 0.188 18880
8654 1 19 . 1 1 61 61 ALA C C 61 180.350 180.350 180.019 0.331 18880
8655 1 19 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.155 -0.065 18880
8656 1 19 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.773 0.437 18880
8657 1 19 . 1 1 61 61 ALA H H 61 8.370 8.370 8.394 -0.024 18880
8658 1 19 . 1 1 62 62 GLU N N 62 118.890 118.890 118.872 0.018 18880
8659 1 19 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.532 0.468 18880
8660 1 19 . 1 1 62 62 GLU C C 62 179.690 179.690 178.692 0.998 18880
8661 1 19 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.342 0.648 18880
8662 1 19 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.502 1.808 18880
8663 1 19 . 1 1 62 62 GLU H H 62 7.680 7.680 7.603 0.077 18880
8664 1 19 . 1 1 63 63 ILE N N 63 122.340 122.340 119.888 2.452 18880
8665 1 19 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.211 0.359 18880
8666 1 19 . 1 1 63 63 ILE C C 63 177.260 177.260 178.215 -0.955 18880
8667 1 19 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.643 1.247 18880
8668 1 19 . 1 1 63 63 ILE CB C 63 37.980 37.980 36.888 1.092 18880
8669 1 19 . 1 1 63 63 ILE H H 63 8.420 8.420 7.609 0.811 18880
8670 1 19 . 1 1 64 64 THR N N 64 116.970 116.970 115.527 1.443 18880
8671 1 19 . 1 1 64 64 THR HA H 64 3.940 3.940 3.878 0.062 18880
8672 1 19 . 1 1 64 64 THR C C 64 176.520 176.520 176.748 -0.228 18880
8673 1 19 . 1 1 64 64 THR CA C 64 67.060 67.060 67.296 -0.236 18880
8674 1 19 . 1 1 64 64 THR CB C 64 68.750 68.750 68.339 0.411 18880
8675 1 19 . 1 1 64 64 THR H H 64 8.310 8.310 8.416 -0.106 18880
8676 1 19 . 1 1 65 65 GLU N N 65 120.760 120.760 119.912 0.848 18880
8677 1 19 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.169 -0.139 18880
8678 1 19 . 1 1 65 65 GLU C C 65 175.830 175.830 178.809 -2.979 18880
8679 1 19 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.855 0.645 18880
8680 1 19 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.630 0.140 18880
8681 1 19 . 1 1 65 65 GLU H H 65 7.970 7.970 8.485 -0.515 18880
8682 1 19 . 1 1 66 66 PHE N N 66 120.940 120.940 117.985 2.955 18880
8683 1 19 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.378 -0.138 18880
8684 1 19 . 1 1 66 66 PHE C C 66 177.330 177.330 177.106 0.224 18880
8685 1 19 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.160 3.040 18880
8686 1 19 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.091 -0.561 18880
8687 1 19 . 1 1 66 66 PHE H H 66 8.100 8.100 7.796 0.304 18880
8688 1 19 . 1 1 67 67 PHE N N 67 118.110 118.110 119.413 -1.303 18880
8689 1 19 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.399 -0.449 18880
8690 1 19 . 1 1 67 67 PHE C C 67 178.090 178.090 177.945 0.145 18880
8691 1 19 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.062 2.138 18880
8692 1 19 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.467 -0.216 18880
8693 1 19 . 1 1 67 67 PHE H H 67 8.380 8.380 8.713 -0.333 18880
8694 1 19 . 1 1 68 68 GLU N N 68 119.650 119.650 118.026 1.624 18880
8695 1 19 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.566 -0.556 18880
8696 1 19 . 1 1 68 68 GLU C C 68 177.910 177.910 176.978 0.932 18880
8697 1 19 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.963 1.277 18880
8698 1 19 . 1 1 68 68 GLU CB C 68 29.370 29.370 30.114 -0.744 18880
8699 1 19 . 1 1 68 68 GLU H H 68 8.230 8.230 8.126 0.104 18880
8700 1 19 . 1 1 69 69 ALA N N 69 119.090 119.090 120.239 -1.149 18880
8701 1 19 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.426 -0.246 18880
8702 1 19 . 1 1 69 69 ALA C C 69 179.030 179.030 178.274 0.756 18880
8703 1 19 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.418 0.182 18880
8704 1 19 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.660 0.120 18880
8705 1 19 . 1 1 69 69 ALA H H 69 7.340 7.340 7.726 -0.386 18880
8706 1 19 . 1 1 70 70 ALA N N 70 118.670 118.670 120.103 -1.433 18880
8707 1 19 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.294 -0.274 18880
8708 1 19 . 1 1 70 70 ALA C C 70 176.820 176.820 176.643 0.177 18880
8709 1 19 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.645 0.445 18880
8710 1 19 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.310 -0.700 18880
8711 1 19 . 1 1 70 70 ALA H H 70 8.050 8.050 7.799 0.251 18880
8712 1 19 . 1 1 71 71 ASP N N 71 116.780 116.780 117.513 -0.733 18880
8713 1 19 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.126 0.094 18880
8714 1 19 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.916 1.234 18880
8715 1 19 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.259 -2.349 18880
8716 1 19 . 1 1 71 71 ASP H H 71 8.010 8.010 7.582 0.428 18880
8717 1 19 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.355 0.115 18880
8718 1 19 . 1 1 72 72 PRO C C 72 177.970 177.970 177.168 0.802 18880
8719 1 19 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.629 0.281 18880
8720 1 19 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.319 -0.440 18880
8721 1 19 . 1 1 73 73 ASN N N 73 114.930 114.930 114.340 0.590 18880
8722 1 19 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.652 0.228 18880
8723 1 19 . 1 1 73 73 ASN C C 73 174.880 174.880 174.950 -0.070 18880
8724 1 19 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.526 -0.686 18880
8725 1 19 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.420 -0.040 18880
8726 1 19 . 1 1 73 73 ASN H H 73 9.030 9.030 8.379 0.651 18880
8727 1 19 . 1 1 74 74 ASN N N 74 118.340 118.340 114.100 4.240 18880
8728 1 19 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.521 -0.161 18880
8729 1 19 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.070 0.520 18880
8730 1 19 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.538 0.622 18880
8731 1 19 . 1 1 74 74 ASN H H 74 8.320 8.320 8.767 -0.447 18880
8732 1 19 . 1 1 75 75 THR N N 75 113.450 113.450 115.729 -2.279 18880
8733 1 19 . 1 1 75 75 THR HA H 75 4.210 4.210 4.449 -0.239 18880
8734 1 19 . 1 1 75 75 THR CA C 75 63.410 63.410 60.786 2.624 18880
8735 1 19 . 1 1 75 75 THR CB C 75 70.540 70.540 67.783 2.757 18880
8736 1 19 . 1 1 75 75 THR H H 75 9.870 9.870 8.741 1.129 18880
8737 1 19 . 1 1 76 76 GLY N N 76 111.810 111.810 109.434 2.376 18880
8738 1 19 . 1 1 76 76 GLY C C 76 173.670 173.670 173.696 -0.026 18880
8739 1 19 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.903 -0.783 18880
8740 1 19 . 1 1 76 76 GLY H H 76 10.250 10.250 7.618 2.632 18880
8741 1 19 . 1 1 77 77 PHE N N 77 120.560 120.560 118.107 2.453 18880
8742 1 19 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.840 0.310 18880
8743 1 19 . 1 1 77 77 PHE CA C 77 57.180 57.180 57.283 -0.103 18880
8744 1 19 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.334 1.166 18880
8745 1 19 . 1 1 77 77 PHE H H 77 8.110 8.110 7.478 0.632 18880
8746 1 19 . 1 1 78 78 ILE N N 78 116.410 116.410 122.563 -6.153 18880
8747 1 19 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.253 0.137 18880
8748 1 19 . 1 1 78 78 ILE C C 78 174.770 174.770 174.217 0.553 18880
8749 1 19 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.798 -0.608 18880
8750 1 19 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.286 0.894 18880
8751 1 19 . 1 1 78 78 ILE H H 78 8.930 8.930 7.944 0.986 18880
8752 1 19 . 1 1 79 79 ASP N N 79 125.220 125.220 124.739 0.481 18880
8753 1 19 . 1 1 79 79 ASP HA H 79 4.500 4.500 3.717 0.783 18880
8754 1 19 . 1 1 79 79 ASP C C 79 176.490 176.490 176.693 -0.203 18880
8755 1 19 . 1 1 79 79 ASP CA C 79 53.310 53.310 51.565 1.745 18880
8756 1 19 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.760 0.610 18880
8757 1 19 . 1 1 79 79 ASP H H 79 8.610 8.610 8.567 0.043 18880
8758 1 19 . 1 1 80 80 TYR N N 80 125.760 125.760 128.049 -2.289 18880
8759 1 19 . 1 1 80 80 TYR HA H 80 3.990 3.990 3.834 0.156 18880
8760 1 19 . 1 1 80 80 TYR C C 80 177.140 177.140 176.608 0.532 18880
8761 1 19 . 1 1 80 80 TYR CA C 80 61.580 61.580 61.903 -0.323 18880
8762 1 19 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.488 0.402 18880
8763 1 19 . 1 1 80 80 TYR H H 80 8.460 8.460 7.667 0.793 18880
8764 1 19 . 1 1 81 81 LYS N N 81 118.320 118.320 117.324 0.996 18880
8765 1 19 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.951 -0.051 18880
8766 1 19 . 1 1 81 81 LYS C C 81 179.090 179.090 178.472 0.618 18880
8767 1 19 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.593 -0.013 18880
8768 1 19 . 1 1 81 81 LYS CB C 81 31.760 31.760 32.177 -0.417 18880
8769 1 19 . 1 1 81 81 LYS H H 81 8.410 8.410 8.272 0.138 18880
8770 1 19 . 1 1 82 82 ALA N N 82 122.050 122.050 121.769 0.281 18880
8771 1 19 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.119 0.011 18880
8772 1 19 . 1 1 82 82 ALA C C 82 179.740 179.740 179.590 0.150 18880
8773 1 19 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.693 -0.173 18880
8774 1 19 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.303 0.237 18880
8775 1 19 . 1 1 82 82 ALA H H 82 7.770 7.770 7.810 -0.040 18880
8776 1 19 . 1 1 83 83 PHE N N 83 117.810 117.810 116.808 1.002 18880
8777 1 19 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.350 -0.060 18880
8778 1 19 . 1 1 83 83 PHE C C 83 176.460 176.460 176.327 0.133 18880
8779 1 19 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.630 0.400 18880
8780 1 19 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.709 -0.189 18880
8781 1 19 . 1 1 83 83 PHE H H 83 7.780 7.780 7.827 -0.046 18880
8782 1 19 . 1 1 84 84 ALA N N 84 121.530 121.530 121.954 -0.424 18880
8783 1 19 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.014 -0.354 18880
8784 1 19 . 1 1 84 84 ALA C C 84 179.010 179.010 179.370 -0.360 18880
8785 1 19 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.297 0.733 18880
8786 1 19 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.447 -0.317 18880
8787 1 19 . 1 1 84 84 ALA H H 84 8.290 8.290 8.135 0.155 18880
8788 1 19 . 1 1 85 85 ALA N N 85 117.720 117.720 121.088 -3.368 18880
8789 1 19 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.191 -0.111 18880
8790 1 19 . 1 1 85 85 ALA C C 85 179.570 179.570 178.102 1.468 18880
8791 1 19 . 1 1 85 85 ALA CA C 85 54.370 54.370 53.983 0.387 18880
8792 1 19 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.554 -0.264 18880
8793 1 19 . 1 1 85 85 ALA H H 85 7.700 7.700 8.463 -0.763 18880
8794 1 19 . 1 1 86 86 MET N N 86 116.570 116.570 116.730 -0.160 18880
8795 1 19 . 1 1 86 86 MET HA H 86 4.160 4.160 4.163 -0.003 18880
8796 1 19 . 1 1 86 86 MET C C 86 177.360 177.360 176.925 0.435 18880
8797 1 19 . 1 1 86 86 MET CA C 86 57.380 57.380 57.342 0.038 18880
8798 1 19 . 1 1 86 86 MET CB C 86 32.720 32.720 32.448 0.272 18880
8799 1 19 . 1 1 86 86 MET H H 86 7.560 7.560 7.830 -0.270 18880
8800 1 19 . 1 1 87 87 LEU N N 87 119.090 119.090 116.633 2.457 18880
8801 1 19 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.229 -0.259 18880
8802 1 19 . 1 1 87 87 LEU C C 87 177.420 177.420 177.104 0.316 18880
8803 1 19 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.639 0.651 18880
8804 1 19 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.462 -0.182 18880
8805 1 19 . 1 1 87 87 LEU H H 87 7.570 7.570 7.156 0.414 18880
8806 1 19 . 1 1 88 88 TYR N N 88 117.060 117.060 115.785 1.275 18880
8807 1 19 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.708 -0.118 18880
8808 1 19 . 1 1 88 88 TYR C C 88 175.870 175.870 175.496 0.374 18880
8809 1 19 . 1 1 88 88 TYR CA C 88 57.840 57.840 54.838 3.002 18880
8810 1 19 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.098 0.542 18880
8811 1 19 . 1 1 88 88 TYR H H 88 7.740 7.740 7.047 0.693 18880
8812 1 19 . 1 1 89 89 SER N N 89 115.980 115.980 118.652 -2.672 18880
8813 1 19 . 1 1 89 89 SER HA H 89 4.440 4.440 4.335 0.105 18880
8814 1 19 . 1 1 89 89 SER C C 89 174.460 174.460 174.896 -0.436 18880
8815 1 19 . 1 1 89 89 SER CA C 89 58.350 58.350 59.925 -1.575 18880
8816 1 19 . 1 1 89 89 SER CB C 89 63.990 63.990 61.412 2.578 18880
8817 1 19 . 1 1 89 89 SER H H 89 7.880 7.880 8.239 -0.359 18880
8818 1 19 . 1 1 90 90 VAL N N 90 120.910 120.910 118.964 1.946 18880
8819 1 19 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.443 -0.303 18880
8820 1 19 . 1 1 90 90 VAL C C 90 175.720 175.720 174.066 1.654 18880
8821 1 19 . 1 1 90 90 VAL CA C 90 62.270 62.270 61.338 0.932 18880
8822 1 19 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.566 0.274 18880
8823 1 19 . 1 1 90 90 VAL H H 90 8.020 8.020 7.986 0.034 18880
8824 1 19 . 1 1 91 91 ASP N N 91 123.620 123.620 119.652 3.968 18880
8825 1 19 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.844 -0.214 18880
8826 1 19 . 1 1 91 91 ASP C C 91 176.000 176.000 175.362 0.638 18880
8827 1 19 . 1 1 91 91 ASP CA C 91 54.510 54.510 53.562 0.948 18880
8828 1 19 . 1 1 91 91 ASP CB C 91 41.440 41.440 42.294 -0.854 18880
8829 1 19 . 1 1 91 91 ASP H H 91 8.310 8.310 8.029 0.281 18880
8830 1 19 . 1 1 92 92 GLU N N 92 122.170 122.170 121.219 0.951 18880
8831 1 19 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.480 -0.120 18880
8832 1 19 . 1 1 92 92 GLU C C 92 175.660 175.660 176.417 -0.757 18880
8833 1 19 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.024 0.466 18880
8834 1 19 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.870 1.980 18880
8835 1 19 . 1 1 92 92 GLU H H 92 8.320 8.320 8.492 -0.172 18880
8836 1 20 . 1 1 10 10 HIS C C 10 176.040 176.040 175.170 0.870 18880
8837 1 20 . 1 1 11 11 SER N N 11 116.840 116.840 116.071 0.769 18880
8838 1 20 . 1 1 11 11 SER HA H 11 4.430 4.430 4.476 -0.046 18880
8839 1 20 . 1 1 11 11 SER C C 11 174.630 174.630 174.780 -0.150 18880
8840 1 20 . 1 1 11 11 SER CA C 11 58.350 58.350 59.002 -0.652 18880
8841 1 20 . 1 1 11 11 SER CB C 11 64.120 64.120 63.474 0.646 18880
8842 1 20 . 1 1 11 11 SER H H 11 8.360 8.360 8.775 -0.415 18880
8843 1 20 . 1 1 12 12 SER N N 12 118.030 118.030 118.078 -0.048 18880
8844 1 20 . 1 1 12 12 SER HA H 12 4.440 4.440 4.495 -0.055 18880
8845 1 20 . 1 1 12 12 SER C C 12 174.880 174.880 174.318 0.562 18880
8846 1 20 . 1 1 12 12 SER CA C 12 58.680 58.680 58.489 0.191 18880
8847 1 20 . 1 1 12 12 SER CB C 12 63.890 63.890 63.894 -0.004 18880
8848 1 20 . 1 1 12 12 SER H H 12 8.490 8.490 8.214 0.276 18880
8849 1 20 . 1 1 13 13 GLY N N 13 110.450 110.450 108.520 1.930 18880
8850 1 20 . 1 1 13 13 GLY C C 13 173.790 173.790 172.789 1.001 18880
8851 1 20 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.452 1.008 18880
8852 1 20 . 1 1 13 13 GLY H H 13 8.390 8.390 8.038 0.352 18880
8853 1 20 . 1 1 14 14 LEU N N 14 121.310 121.310 118.819 2.491 18880
8854 1 20 . 1 1 14 14 LEU HA H 14 4.340 4.340 5.116 -0.776 18880
8855 1 20 . 1 1 14 14 LEU C C 14 176.930 176.930 177.006 -0.076 18880
8856 1 20 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.693 0.507 18880
8857 1 20 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.678 -0.079 18880
8858 1 20 . 1 1 14 14 LEU H H 14 8.020 8.020 8.790 -0.770 18880
8859 1 20 . 1 1 15 15 VAL N N 15 121.550 121.550 115.173 6.377 18880
8860 1 20 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.468 -0.098 18880
8861 1 20 . 1 1 15 15 VAL CA C 15 59.720 59.720 60.218 -0.498 18880
8862 1 20 . 1 1 15 15 VAL CB C 15 32.770 32.770 33.094 -0.324 18880
8863 1 20 . 1 1 15 15 VAL H H 15 8.030 8.030 7.670 0.360 18880
8864 1 20 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.205 0.165 18880
8865 1 20 . 1 1 16 16 PRO C C 16 176.720 176.720 177.184 -0.464 18880
8866 1 20 . 1 1 16 16 PRO CA C 16 62.650 62.650 64.860 -2.210 18880
8867 1 20 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.163 0.077 18880
8868 1 20 . 1 1 17 17 ARG N N 17 121.890 121.890 115.136 6.754 18880
8869 1 20 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.269 0.011 18880
8870 1 20 . 1 1 17 17 ARG C C 17 176.940 176.940 175.938 1.002 18880
8871 1 20 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.064 0.296 18880
8872 1 20 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.596 0.454 18880
8873 1 20 . 1 1 17 17 ARG H H 17 8.450 8.450 7.811 0.639 18880
8874 1 20 . 1 1 18 18 GLY N N 18 110.160 110.160 110.502 -0.342 18880
8875 1 20 . 1 1 18 18 GLY C C 18 174.110 174.110 174.166 -0.056 18880
8876 1 20 . 1 1 18 18 GLY CA C 18 45.390 45.390 46.581 -1.191 18880
8877 1 20 . 1 1 18 18 GLY H H 18 8.480 8.480 8.607 -0.127 18880
8878 1 20 . 1 1 19 19 SER N N 19 115.500 115.500 113.565 1.935 18880
8879 1 20 . 1 1 19 19 SER HA H 19 4.400 4.400 4.542 -0.142 18880
8880 1 20 . 1 1 19 19 SER C C 19 174.380 174.380 172.798 1.582 18880
8881 1 20 . 1 1 19 19 SER CA C 19 58.610 58.610 58.597 0.013 18880
8882 1 20 . 1 1 19 19 SER CB C 19 63.830 63.830 64.145 -0.315 18880
8883 1 20 . 1 1 19 19 SER H H 19 8.210 8.210 7.621 0.589 18880
8884 1 20 . 1 1 20 20 HIS N N 20 120.770 120.770 121.630 -0.860 18880
8885 1 20 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.905 -0.295 18880
8886 1 20 . 1 1 20 20 HIS C C 20 174.870 174.870 174.230 0.640 18880
8887 1 20 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.963 -0.833 18880
8888 1 20 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.894 -1.184 18880
8889 1 20 . 1 1 20 20 HIS H H 20 8.590 8.590 8.827 -0.237 18880
8890 1 20 . 1 1 21 21 MET N N 21 121.440 121.440 119.185 2.255 18880
8891 1 20 . 1 1 21 21 MET HA H 21 4.470 4.470 4.538 -0.068 18880
8892 1 20 . 1 1 21 21 MET C C 21 176.030 176.030 175.570 0.460 18880
8893 1 20 . 1 1 21 21 MET CA C 21 55.490 55.490 55.648 -0.158 18880
8894 1 20 . 1 1 21 21 MET CB C 21 33.170 33.170 33.282 -0.112 18880
8895 1 20 . 1 1 21 21 MET H H 21 8.310 8.310 8.076 0.234 18880
8896 1 20 . 1 1 22 22 SER N N 22 116.860 116.860 117.196 -0.336 18880
8897 1 20 . 1 1 22 22 SER HA H 22 4.430 4.430 4.478 -0.048 18880
8898 1 20 . 1 1 22 22 SER C C 22 174.630 174.630 175.618 -0.988 18880
8899 1 20 . 1 1 22 22 SER CA C 22 58.410 58.410 59.243 -0.834 18880
8900 1 20 . 1 1 22 22 SER CB C 22 64.030 64.030 63.431 0.599 18880
8901 1 20 . 1 1 22 22 SER H H 22 8.340 8.340 8.541 -0.201 18880
8902 1 20 . 1 1 23 23 ASP N N 23 122.660 122.660 122.211 0.449 18880
8903 1 20 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.459 0.091 18880
8904 1 20 . 1 1 23 23 ASP C C 23 176.860 176.860 177.242 -0.382 18880
8905 1 20 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.917 -0.587 18880
8906 1 20 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.433 0.567 18880
8907 1 20 . 1 1 23 23 ASP H H 23 8.540 8.540 8.517 0.023 18880
8908 1 20 . 1 1 24 24 GLU N N 24 120.400 120.400 118.361 2.039 18880
8909 1 20 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.083 0.057 18880
8910 1 20 . 1 1 24 24 GLU C C 24 177.540 177.540 177.333 0.207 18880
8911 1 20 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.518 -0.158 18880
8912 1 20 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.605 0.145 18880
8913 1 20 . 1 1 24 24 GLU H H 24 8.610 8.610 8.057 0.553 18880
8914 1 20 . 1 1 25 25 LYS N N 25 120.390 120.390 117.000 3.390 18880
8915 1 20 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.262 -0.072 18880
8916 1 20 . 1 1 25 25 LYS C C 25 177.490 177.490 178.300 -0.810 18880
8917 1 20 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.097 0.013 18880
8918 1 20 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.879 -0.389 18880
8919 1 20 . 1 1 25 25 LYS H H 25 8.210 8.210 7.475 0.735 18880
8920 1 20 . 1 1 26 26 THR N N 26 114.880 114.880 115.993 -1.113 18880
8921 1 20 . 1 1 26 26 THR HA H 26 4.040 4.040 4.047 -0.007 18880
8922 1 20 . 1 1 26 26 THR C C 26 175.430 175.430 176.933 -1.503 18880
8923 1 20 . 1 1 26 26 THR CA C 26 64.620 64.620 65.725 -1.105 18880
8924 1 20 . 1 1 26 26 THR CB C 26 69.110 69.110 68.559 0.551 18880
8925 1 20 . 1 1 26 26 THR H H 26 8.080 8.080 7.416 0.664 18880
8926 1 20 . 1 1 27 27 GLN N N 27 120.940 120.940 120.555 0.385 18880
8927 1 20 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.078 0.112 18880
8928 1 20 . 1 1 27 27 GLN C C 27 177.280 177.280 177.629 -0.349 18880
8929 1 20 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.584 -1.034 18880
8930 1 20 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.201 0.889 18880
8931 1 20 . 1 1 27 27 GLN H H 27 8.240 8.240 7.862 0.378 18880
8932 1 20 . 1 1 28 28 LEU N N 28 121.860 121.860 118.669 3.191 18880
8933 1 20 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.421 -0.251 18880
8934 1 20 . 1 1 28 28 LEU C C 28 177.750 177.750 177.902 -0.152 18880
8935 1 20 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.334 1.746 18880
8936 1 20 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.561 -0.291 18880
8937 1 20 . 1 1 28 28 LEU H H 28 7.950 7.950 7.478 0.472 18880
8938 1 20 . 1 1 29 29 ILE N N 29 119.260 119.260 119.266 -0.006 18880
8939 1 20 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.787 0.113 18880
8940 1 20 . 1 1 29 29 ILE C C 29 177.140 177.140 177.434 -0.294 18880
8941 1 20 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.154 0.146 18880
8942 1 20 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.802 1.478 18880
8943 1 20 . 1 1 29 29 ILE H H 29 7.950 7.950 7.884 0.066 18880
8944 1 20 . 1 1 30 30 GLU N N 30 120.500 120.500 120.300 0.200 18880
8945 1 20 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.404 -0.354 18880
8946 1 20 . 1 1 30 30 GLU C C 30 177.560 177.560 176.624 0.936 18880
8947 1 20 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.751 0.339 18880
8948 1 20 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.315 0.275 18880
8949 1 20 . 1 1 30 30 GLU H H 30 8.220 8.220 8.060 0.160 18880
8950 1 20 . 1 1 31 31 ALA N N 31 121.550 121.550 120.265 1.285 18880
8951 1 20 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.615 -0.465 18880
8952 1 20 . 1 1 31 31 ALA C C 31 178.550 178.550 178.936 -0.386 18880
8953 1 20 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.828 -0.028 18880
8954 1 20 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.550 -0.920 18880
8955 1 20 . 1 1 31 31 ALA H H 31 7.890 7.890 7.667 0.223 18880
8956 1 20 . 1 1 32 32 PHE N N 32 117.240 117.240 117.767 -0.527 18880
8957 1 20 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.186 0.114 18880
8958 1 20 . 1 1 32 32 PHE C C 32 176.210 176.210 176.511 -0.301 18880
8959 1 20 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.363 -1.023 18880
8960 1 20 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.838 0.912 18880
8961 1 20 . 1 1 32 32 PHE H H 32 7.930 7.930 7.824 0.106 18880
8962 1 20 . 1 1 33 33 TYR N N 33 119.050 119.050 118.525 0.525 18880
8963 1 20 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.610 -0.280 18880
8964 1 20 . 1 1 33 33 TYR C C 33 175.680 175.680 174.938 0.742 18880
8965 1 20 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.857 1.063 18880
8966 1 20 . 1 1 33 33 TYR CB C 33 38.540 38.540 36.797 1.743 18880
8967 1 20 . 1 1 33 33 TYR H H 33 7.950 7.950 8.449 -0.499 18880
8968 1 20 . 1 1 34 34 ASN N N 34 118.390 118.390 117.809 0.581 18880
8969 1 20 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.756 -0.126 18880
8970 1 20 . 1 1 34 34 ASN C C 34 174.810 174.810 174.580 0.230 18880
8971 1 20 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.036 0.114 18880
8972 1 20 . 1 1 34 34 ASN CB C 34 38.980 38.980 38.474 0.506 18880
8973 1 20 . 1 1 34 34 ASN H H 34 7.960 7.960 7.585 0.375 18880
8974 1 20 . 1 1 35 35 PHE N N 35 120.670 120.670 120.666 0.004 18880
8975 1 20 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.336 0.114 18880
8976 1 20 . 1 1 35 35 PHE C C 35 175.310 175.310 173.387 1.923 18880
8977 1 20 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.499 -0.179 18880
8978 1 20 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.465 -0.045 18880
8979 1 20 . 1 1 35 35 PHE H H 35 7.830 7.830 7.875 -0.045 18880
8980 1 20 . 1 1 36 36 ASP N N 36 122.400 122.400 124.499 -2.099 18880
8981 1 20 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.362 0.228 18880
8982 1 20 . 1 1 36 36 ASP C C 36 176.150 176.150 174.914 1.236 18880
8983 1 20 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.751 -0.681 18880
8984 1 20 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.434 -0.114 18880
8985 1 20 . 1 1 36 36 ASP H H 36 8.180 8.180 8.090 0.090 18880
8986 1 20 . 1 1 37 37 GLY N N 37 108.560 108.560 108.943 -0.383 18880
8987 1 20 . 1 1 37 37 GLY C C 37 173.660 173.660 174.443 -0.783 18880
8988 1 20 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.530 0.080 18880
8989 1 20 . 1 1 37 37 GLY H H 37 7.680 7.680 8.230 -0.550 18880
8990 1 20 . 1 1 38 38 ASP N N 38 120.010 120.010 118.412 1.598 18880
8991 1 20 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.779 -0.179 18880
8992 1 20 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.016 0.244 18880
8993 1 20 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.906 0.544 18880
8994 1 20 . 1 1 38 38 ASP H H 38 8.220 8.220 8.003 0.217 18880
8995 1 20 . 1 1 39 39 TYR N N 39 121.030 121.030 120.026 1.004 18880
8996 1 20 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.632 -0.242 18880
8997 1 20 . 1 1 39 39 TYR C C 39 175.290 175.290 175.423 -0.133 18880
8998 1 20 . 1 1 39 39 TYR CA C 39 58.200 58.200 57.591 0.609 18880
8999 1 20 . 1 1 39 39 TYR CB C 39 39.170 39.170 40.553 -1.383 18880
9000 1 20 . 1 1 39 39 TYR H H 39 8.090 8.090 7.830 0.260 18880
9001 1 20 . 1 1 40 40 ASP N N 40 122.020 122.020 122.315 -0.295 18880
9002 1 20 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.771 -0.171 18880
9003 1 20 . 1 1 40 40 ASP C C 40 175.970 175.970 176.511 -0.541 18880
9004 1 20 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.176 0.044 18880
9005 1 20 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.525 -0.005 18880
9006 1 20 . 1 1 40 40 ASP H H 40 8.200 8.200 8.591 -0.391 18880
9007 1 20 . 1 1 41 41 GLY N N 41 108.330 108.330 107.151 1.179 18880
9008 1 20 . 1 1 41 41 GLY C C 41 173.000 173.000 172.021 0.979 18880
9009 1 20 . 1 1 41 41 GLY CA C 41 45.420 45.420 45.125 0.295 18880
9010 1 20 . 1 1 41 41 GLY H H 41 7.830 7.830 7.862 -0.032 18880
9011 1 20 . 1 1 42 42 PHE N N 42 118.600 118.600 117.529 1.071 18880
9012 1 20 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.992 0.268 18880
9013 1 20 . 1 1 42 42 PHE C C 42 175.660 175.660 174.437 1.223 18880
9014 1 20 . 1 1 42 42 PHE CA C 42 57.160 57.160 56.981 0.179 18880
9015 1 20 . 1 1 42 42 PHE CB C 42 41.170 41.170 41.996 -0.826 18880
9016 1 20 . 1 1 42 42 PHE H H 42 8.150 8.150 7.486 0.664 18880
9017 1 20 . 1 1 43 43 VAL N N 43 119.180 119.180 125.979 -6.799 18880
9018 1 20 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.714 -0.044 18880
9019 1 20 . 1 1 43 43 VAL C C 43 175.110 175.110 174.587 0.523 18880
9020 1 20 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.054 0.566 18880
9021 1 20 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.774 -1.894 18880
9022 1 20 . 1 1 43 43 VAL H H 43 9.070 9.070 9.028 0.042 18880
9023 1 20 . 1 1 44 44 SER N N 44 121.380 121.380 123.566 -2.186 18880
9024 1 20 . 1 1 44 44 SER HA H 44 4.570 4.570 4.815 -0.245 18880
9025 1 20 . 1 1 44 44 SER C C 44 175.660 175.660 175.475 0.185 18880
9026 1 20 . 1 1 44 44 SER CA C 44 57.720 57.720 58.093 -0.372 18880
9027 1 20 . 1 1 44 44 SER CB C 44 63.690 63.690 64.350 -0.660 18880
9028 1 20 . 1 1 44 44 SER H H 44 9.140 9.140 8.814 0.326 18880
9029 1 20 . 1 1 45 45 VAL N N 45 122.720 122.720 124.199 -1.479 18880
9030 1 20 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.464 0.036 18880
9031 1 20 . 1 1 45 45 VAL C C 45 177.240 177.240 177.666 -0.426 18880
9032 1 20 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.466 -0.196 18880
9033 1 20 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.881 0.569 18880
9034 1 20 . 1 1 45 45 VAL H H 45 8.140 8.140 8.605 -0.465 18880
9035 1 20 . 1 1 46 46 GLU N N 46 118.990 118.990 118.108 0.882 18880
9036 1 20 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.976 0.004 18880
9037 1 20 . 1 1 46 46 GLU C C 46 179.460 179.460 178.981 0.479 18880
9038 1 20 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.373 0.187 18880
9039 1 20 . 1 1 46 46 GLU CB C 46 29.160 29.160 29.109 0.051 18880
9040 1 20 . 1 1 46 46 GLU H H 46 8.230 8.230 7.805 0.425 18880
9041 1 20 . 1 1 47 47 GLU N N 47 120.120 120.120 118.733 1.387 18880
9042 1 20 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.367 -0.287 18880
9043 1 20 . 1 1 47 47 GLU C C 47 179.170 179.170 178.394 0.776 18880
9044 1 20 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.520 1.369 18880
9045 1 20 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.806 0.014 18880
9046 1 20 . 1 1 47 47 GLU H H 47 7.880 7.880 7.652 0.228 18880
9047 1 20 . 1 1 48 48 PHE N N 48 120.830 120.830 121.465 -0.635 18880
9048 1 20 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.149 0.041 18880
9049 1 20 . 1 1 48 48 PHE C C 48 176.920 176.920 177.609 -0.689 18880
9050 1 20 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.908 -0.038 18880
9051 1 20 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.060 0.200 18880
9052 1 20 . 1 1 48 48 PHE H H 48 8.600 8.600 8.563 0.037 18880
9053 1 20 . 1 1 49 49 ARG N N 49 118.470 118.470 118.974 -0.504 18880
9054 1 20 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.145 -0.285 18880
9055 1 20 . 1 1 49 49 ARG C C 49 178.090 178.090 178.856 -0.766 18880
9056 1 20 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.538 -0.468 18880
9057 1 20 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.855 0.285 18880
9058 1 20 . 1 1 49 49 ARG H H 49 8.650 8.650 8.477 0.173 18880
9059 1 20 . 1 1 50 50 GLY N N 50 105.080 105.080 106.198 -1.118 18880
9060 1 20 . 1 1 50 50 GLY C C 50 175.090 175.090 175.792 -0.702 18880
9061 1 20 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.865 -0.186 18880
9062 1 20 . 1 1 50 50 GLY H H 50 7.620 7.620 8.543 -0.923 18880
9063 1 20 . 1 1 51 51 ILE N N 51 121.440 121.440 121.503 -0.063 18880
9064 1 20 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.948 -0.118 18880
9065 1 20 . 1 1 51 51 ILE C C 51 178.300 178.300 177.528 0.772 18880
9066 1 20 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.863 -0.023 18880
9067 1 20 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.350 -0.040 18880
9068 1 20 . 1 1 51 51 ILE H H 51 7.470 7.470 7.140 0.330 18880
9069 1 20 . 1 1 52 52 ILE N N 52 118.930 118.930 120.462 -1.532 18880
9070 1 20 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.697 0.043 18880
9071 1 20 . 1 1 52 52 ILE CA C 52 63.760 63.760 65.001 -1.241 18880
9072 1 20 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.968 0.062 18880
9073 1 20 . 1 1 52 52 ILE H H 52 7.790 7.790 8.754 -0.964 18880
9074 1 20 . 1 1 53 53 ARG N N 53 120.140 120.140 119.253 0.887 18880
9075 1 20 . 1 1 53 53 ARG HA H 53 4.090 4.090 3.976 0.114 18880
9076 1 20 . 1 1 53 53 ARG C C 53 177.380 177.380 177.593 -0.213 18880
9077 1 20 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.986 0.124 18880
9078 1 20 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.185 -0.605 18880
9079 1 20 . 1 1 53 53 ARG H H 53 7.930 7.930 8.162 -0.232 18880
9080 1 20 . 1 1 54 54 ASP N N 54 117.500 117.500 115.823 1.677 18880
9081 1 20 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.697 -0.097 18880
9082 1 20 . 1 1 54 54 ASP C C 54 176.930 176.930 176.547 0.383 18880
9083 1 20 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.195 1.345 18880
9084 1 20 . 1 1 54 54 ASP CB C 54 41.100 41.100 40.857 0.243 18880
9085 1 20 . 1 1 54 54 ASP H H 54 7.870 7.870 7.998 -0.128 18880
9086 1 20 . 1 1 55 55 GLY N N 55 106.370 106.370 107.542 -1.172 18880
9087 1 20 . 1 1 55 55 GLY C C 55 173.460 173.460 173.896 -0.436 18880
9088 1 20 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.520 0.480 18880
9089 1 20 . 1 1 55 55 GLY H H 55 7.880 7.880 7.458 0.422 18880
9090 1 20 . 1 1 56 56 LEU N N 56 122.630 122.630 121.693 0.937 18880
9091 1 20 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.924 -0.154 18880
9092 1 20 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.173 1.317 18880
9093 1 20 . 1 1 56 56 LEU CB C 56 43.120 43.120 44.700 -1.579 18880
9094 1 20 . 1 1 56 56 LEU H H 56 8.220 8.220 7.944 0.276 18880
9095 1 20 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.526 0.054 18880
9096 1 20 . 1 1 57 57 PRO C C 57 176.150 176.150 175.630 0.520 18880
9097 1 20 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.836 -0.416 18880
9098 1 20 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.041 -0.301 18880
9099 1 20 . 1 1 58 58 MET N N 58 121.810 121.810 124.523 -2.713 18880
9100 1 20 . 1 1 58 58 MET HA H 58 4.630 4.630 4.906 -0.276 18880
9101 1 20 . 1 1 58 58 MET C C 58 176.150 176.150 175.522 0.628 18880
9102 1 20 . 1 1 58 58 MET CA C 58 55.560 55.560 54.217 1.343 18880
9103 1 20 . 1 1 58 58 MET CB C 58 36.820 36.820 37.237 -0.417 18880
9104 1 20 . 1 1 58 58 MET H H 58 7.690 7.690 7.828 -0.138 18880
9105 1 20 . 1 1 59 59 THR N N 59 114.180 114.180 116.341 -2.161 18880
9106 1 20 . 1 1 59 59 THR HA H 59 4.450 4.450 4.515 -0.065 18880
9107 1 20 . 1 1 59 59 THR C C 59 175.170 175.170 175.963 -0.793 18880
9108 1 20 . 1 1 59 59 THR CA C 59 60.780 60.780 61.070 -0.290 18880
9109 1 20 . 1 1 59 59 THR CB C 59 71.060 71.060 70.031 1.029 18880
9110 1 20 . 1 1 59 59 THR H H 59 8.940 8.940 9.365 -0.425 18880
9111 1 20 . 1 1 60 60 GLU N N 60 120.620 120.620 125.134 -4.514 18880
9112 1 20 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.733 0.277 18880
9113 1 20 . 1 1 60 60 GLU C C 60 179.010 179.010 178.127 0.883 18880
9114 1 20 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.586 0.234 18880
9115 1 20 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.524 0.526 18880
9116 1 20 . 1 1 60 60 GLU H H 60 8.850 8.850 8.952 -0.102 18880
9117 1 20 . 1 1 61 61 ALA N N 61 121.080 121.080 122.766 -1.686 18880
9118 1 20 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.860 0.280 18880
9119 1 20 . 1 1 61 61 ALA C C 61 180.350 180.350 179.866 0.484 18880
9120 1 20 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.202 -0.112 18880
9121 1 20 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.940 0.270 18880
9122 1 20 . 1 1 61 61 ALA H H 61 8.370 8.370 8.389 -0.019 18880
9123 1 20 . 1 1 62 62 GLU N N 62 118.890 118.890 119.045 -0.155 18880
9124 1 20 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.606 0.394 18880
9125 1 20 . 1 1 62 62 GLU C C 62 179.690 179.690 178.970 0.720 18880
9126 1 20 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.815 0.176 18880
9127 1 20 . 1 1 62 62 GLU CB C 62 30.310 30.310 29.350 0.960 18880
9128 1 20 . 1 1 62 62 GLU H H 62 7.680 7.680 7.720 -0.040 18880
9129 1 20 . 1 1 63 63 ILE N N 63 122.340 122.340 120.273 2.067 18880
9130 1 20 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.436 0.134 18880
9131 1 20 . 1 1 63 63 ILE C C 63 177.260 177.260 178.171 -0.911 18880
9132 1 20 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.949 0.941 18880
9133 1 20 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.045 0.935 18880
9134 1 20 . 1 1 63 63 ILE H H 63 8.420 8.420 7.833 0.587 18880
9135 1 20 . 1 1 64 64 THR N N 64 116.970 116.970 115.557 1.413 18880
9136 1 20 . 1 1 64 64 THR HA H 64 3.940 3.940 3.853 0.087 18880
9137 1 20 . 1 1 64 64 THR C C 64 176.520 176.520 176.768 -0.248 18880
9138 1 20 . 1 1 64 64 THR CA C 64 67.060 67.060 67.169 -0.109 18880
9139 1 20 . 1 1 64 64 THR CB C 64 68.750 68.750 68.356 0.394 18880
9140 1 20 . 1 1 64 64 THR H H 64 8.310 8.310 8.424 -0.114 18880
9141 1 20 . 1 1 65 65 GLU N N 65 120.760 120.760 120.116 0.644 18880
9142 1 20 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.095 -0.065 18880
9143 1 20 . 1 1 65 65 GLU C C 65 175.830 175.830 178.557 -2.727 18880
9144 1 20 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.775 0.725 18880
9145 1 20 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.157 0.613 18880
9146 1 20 . 1 1 65 65 GLU H H 65 7.970 7.970 8.543 -0.573 18880
9147 1 20 . 1 1 66 66 PHE N N 66 120.940 120.940 118.311 2.629 18880
9148 1 20 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.556 -0.316 18880
9149 1 20 . 1 1 66 66 PHE C C 66 177.330 177.330 177.124 0.206 18880
9150 1 20 . 1 1 66 66 PHE CA C 66 61.200 61.200 59.648 1.552 18880
9151 1 20 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.507 -0.977 18880
9152 1 20 . 1 1 66 66 PHE H H 66 8.100 8.100 7.639 0.461 18880
9153 1 20 . 1 1 67 67 PHE N N 67 118.110 118.110 118.702 -0.592 18880
9154 1 20 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.410 -0.460 18880
9155 1 20 . 1 1 67 67 PHE C C 67 178.090 178.090 177.847 0.243 18880
9156 1 20 . 1 1 67 67 PHE CA C 67 61.200 61.200 58.858 2.342 18880
9157 1 20 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.740 -0.490 18880
9158 1 20 . 1 1 67 67 PHE H H 67 8.380 8.380 8.556 -0.176 18880
9159 1 20 . 1 1 68 68 GLU N N 68 119.650 119.650 117.995 1.655 18880
9160 1 20 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.391 -0.381 18880
9161 1 20 . 1 1 68 68 GLU C C 68 177.910 177.910 177.125 0.785 18880
9162 1 20 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.962 1.278 18880
9163 1 20 . 1 1 68 68 GLU CB C 68 29.370 29.370 30.153 -0.783 18880
9164 1 20 . 1 1 68 68 GLU H H 68 8.230 8.230 8.411 -0.181 18880
9165 1 20 . 1 1 69 69 ALA N N 69 119.090 119.090 121.006 -1.916 18880
9166 1 20 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.397 -0.217 18880
9167 1 20 . 1 1 69 69 ALA C C 69 179.030 179.030 178.272 0.758 18880
9168 1 20 . 1 1 69 69 ALA CA C 69 53.600 53.600 54.038 -0.439 18880
9169 1 20 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.639 0.141 18880
9170 1 20 . 1 1 69 69 ALA H H 69 7.340 7.340 7.735 -0.395 18880
9171 1 20 . 1 1 70 70 ALA N N 70 118.670 118.670 119.210 -0.540 18880
9172 1 20 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.372 -0.352 18880
9173 1 20 . 1 1 70 70 ALA C C 70 176.820 176.820 176.349 0.471 18880
9174 1 20 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.620 0.470 18880
9175 1 20 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.337 -0.727 18880
9176 1 20 . 1 1 70 70 ALA H H 70 8.050 8.050 7.805 0.245 18880
9177 1 20 . 1 1 71 71 ASP N N 71 116.780 116.780 118.324 -1.544 18880
9178 1 20 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.127 0.093 18880
9179 1 20 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.274 1.876 18880
9180 1 20 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.149 -1.239 18880
9181 1 20 . 1 1 71 71 ASP H H 71 8.010 8.010 7.565 0.445 18880
9182 1 20 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.398 0.072 18880
9183 1 20 . 1 1 72 72 PRO C C 72 177.970 177.970 177.285 0.685 18880
9184 1 20 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.601 0.309 18880
9185 1 20 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.522 -0.642 18880
9186 1 20 . 1 1 73 73 ASN N N 73 114.930 114.930 117.075 -2.145 18880
9187 1 20 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.523 0.357 18880
9188 1 20 . 1 1 73 73 ASN C C 73 174.880 174.880 174.867 0.013 18880
9189 1 20 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.327 -0.487 18880
9190 1 20 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.440 -0.060 18880
9191 1 20 . 1 1 73 73 ASN H H 73 9.030 9.030 8.304 0.726 18880
9192 1 20 . 1 1 74 74 ASN N N 74 118.340 118.340 114.100 4.240 18880
9193 1 20 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.638 -0.278 18880
9194 1 20 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.981 0.609 18880
9195 1 20 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.181 0.979 18880
9196 1 20 . 1 1 74 74 ASN H H 74 8.320 8.320 8.102 0.218 18880
9197 1 20 . 1 1 75 75 THR N N 75 113.450 113.450 111.267 2.183 18880
9198 1 20 . 1 1 75 75 THR HA H 75 4.210 4.210 4.478 -0.268 18880
9199 1 20 . 1 1 75 75 THR CA C 75 63.410 63.410 61.120 2.291 18880
9200 1 20 . 1 1 75 75 THR CB C 75 70.540 70.540 68.765 1.775 18880
9201 1 20 . 1 1 75 75 THR H H 75 9.870 9.870 8.518 1.352 18880
9202 1 20 . 1 1 76 76 GLY N N 76 111.810 111.810 109.001 2.809 18880
9203 1 20 . 1 1 76 76 GLY C C 76 173.670 173.670 173.116 0.554 18880
9204 1 20 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.823 -0.703 18880
9205 1 20 . 1 1 76 76 GLY H H 76 10.250 10.250 8.351 1.899 18880
9206 1 20 . 1 1 77 77 PHE N N 77 120.560 120.560 118.705 1.855 18880
9207 1 20 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.941 0.209 18880
9208 1 20 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.529 0.651 18880
9209 1 20 . 1 1 77 77 PHE CB C 77 43.500 43.500 41.600 1.900 18880
9210 1 20 . 1 1 77 77 PHE H H 77 8.110 8.110 7.633 0.477 18880
9211 1 20 . 1 1 78 78 ILE N N 78 116.410 116.410 124.051 -7.641 18880
9212 1 20 . 1 1 78 78 ILE HA H 78 4.390 4.390 3.912 0.478 18880
9213 1 20 . 1 1 78 78 ILE C C 78 174.770 174.770 174.384 0.386 18880
9214 1 20 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.423 -0.233 18880
9215 1 20 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.367 0.812 18880
9216 1 20 . 1 1 78 78 ILE H H 78 8.930 8.930 7.632 1.298 18880
9217 1 20 . 1 1 79 79 ASP N N 79 125.220 125.220 124.162 1.058 18880
9218 1 20 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.806 -0.306 18880
9219 1 20 . 1 1 79 79 ASP C C 79 176.490 176.490 176.783 -0.293 18880
9220 1 20 . 1 1 79 79 ASP CA C 79 53.310 53.310 53.739 -0.429 18880
9221 1 20 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.239 1.131 18880
9222 1 20 . 1 1 79 79 ASP H H 79 8.610 8.610 8.653 -0.043 18880
9223 1 20 . 1 1 80 80 TYR N N 80 125.760 125.760 128.223 -2.463 18880
9224 1 20 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.042 -0.052 18880
9225 1 20 . 1 1 80 80 TYR C C 80 177.140 177.140 176.489 0.651 18880
9226 1 20 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.770 -1.190 18880
9227 1 20 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.640 0.250 18880
9228 1 20 . 1 1 80 80 TYR H H 80 8.460 8.460 8.263 0.197 18880
9229 1 20 . 1 1 81 81 LYS N N 81 118.320 118.320 118.254 0.066 18880
9230 1 20 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.972 -0.072 18880
9231 1 20 . 1 1 81 81 LYS C C 81 179.090 179.090 178.721 0.369 18880
9232 1 20 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.166 0.414 18880
9233 1 20 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.336 0.424 18880
9234 1 20 . 1 1 81 81 LYS H H 81 8.410 8.410 8.382 0.028 18880
9235 1 20 . 1 1 82 82 ALA N N 82 122.050 122.050 121.316 0.734 18880
9236 1 20 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.185 -0.055 18880
9237 1 20 . 1 1 82 82 ALA C C 82 179.740 179.740 179.238 0.502 18880
9238 1 20 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.656 -0.136 18880
9239 1 20 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.062 0.478 18880
9240 1 20 . 1 1 82 82 ALA H H 82 7.770 7.770 8.196 -0.426 18880
9241 1 20 . 1 1 83 83 PHE N N 83 117.810 117.810 116.805 1.005 18880
9242 1 20 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.440 -0.150 18880
9243 1 20 . 1 1 83 83 PHE C C 83 176.460 176.460 176.398 0.062 18880
9244 1 20 . 1 1 83 83 PHE CA C 83 60.030 60.030 58.469 1.561 18880
9245 1 20 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.731 -0.211 18880
9246 1 20 . 1 1 83 83 PHE H H 83 7.780 7.780 7.682 0.098 18880
9247 1 20 . 1 1 84 84 ALA N N 84 121.530 121.530 121.916 -0.386 18880
9248 1 20 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.103 -0.443 18880
9249 1 20 . 1 1 84 84 ALA C C 84 179.010 179.010 179.439 -0.429 18880
9250 1 20 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.195 0.835 18880
9251 1 20 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.394 -0.264 18880
9252 1 20 . 1 1 84 84 ALA H H 84 8.290 8.290 8.223 0.067 18880
9253 1 20 . 1 1 85 85 ALA N N 85 117.720 117.720 120.950 -3.230 18880
9254 1 20 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.200 -0.120 18880
9255 1 20 . 1 1 85 85 ALA C C 85 179.570 179.570 178.292 1.278 18880
9256 1 20 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.334 0.036 18880
9257 1 20 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.385 -0.095 18880
9258 1 20 . 1 1 85 85 ALA H H 85 7.700 7.700 8.648 -0.948 18880
9259 1 20 . 1 1 86 86 MET N N 86 116.570 116.570 116.207 0.363 18880
9260 1 20 . 1 1 86 86 MET HA H 86 4.160 4.160 4.268 -0.108 18880
9261 1 20 . 1 1 86 86 MET C C 86 177.360 177.360 177.493 -0.133 18880
9262 1 20 . 1 1 86 86 MET CA C 86 57.380 57.380 57.448 -0.068 18880
9263 1 20 . 1 1 86 86 MET CB C 86 32.720 32.720 32.742 -0.022 18880
9264 1 20 . 1 1 86 86 MET H H 86 7.560 7.560 7.996 -0.436 18880
9265 1 20 . 1 1 87 87 LEU N N 87 119.090 119.090 117.608 1.482 18880
9266 1 20 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.294 -0.324 18880
9267 1 20 . 1 1 87 87 LEU C C 87 177.420 177.420 177.365 0.055 18880
9268 1 20 . 1 1 87 87 LEU CA C 87 56.290 56.290 56.201 0.089 18880
9269 1 20 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.819 -0.539 18880
9270 1 20 . 1 1 87 87 LEU H H 87 7.570 7.570 7.685 -0.115 18880
9271 1 20 . 1 1 88 88 TYR N N 88 117.060 117.060 116.618 0.442 18880
9272 1 20 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.634 -0.044 18880
9273 1 20 . 1 1 88 88 TYR C C 88 175.870 175.870 175.462 0.408 18880
9274 1 20 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.764 2.076 18880
9275 1 20 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.057 0.583 18880
9276 1 20 . 1 1 88 88 TYR H H 88 7.740 7.740 7.545 0.195 18880
9277 1 20 . 1 1 89 89 SER N N 89 115.980 115.980 119.008 -3.028 18880
9278 1 20 . 1 1 89 89 SER HA H 89 4.440 4.440 4.377 0.063 18880
9279 1 20 . 1 1 89 89 SER C C 89 174.460 174.460 174.274 0.186 18880
9280 1 20 . 1 1 89 89 SER CA C 89 58.350 58.350 60.671 -2.321 18880
9281 1 20 . 1 1 89 89 SER CB C 89 63.990 63.990 62.202 1.788 18880
9282 1 20 . 1 1 89 89 SER H H 89 7.880 7.880 8.219 -0.339 18880
9283 1 20 . 1 1 90 90 VAL N N 90 120.910 120.910 121.138 -0.228 18880
9284 1 20 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.264 -0.124 18880
9285 1 20 . 1 1 90 90 VAL C C 90 175.720 175.720 173.725 1.995 18880
9286 1 20 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.596 -0.326 18880
9287 1 20 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.343 0.497 18880
9288 1 20 . 1 1 90 90 VAL H H 90 8.020 8.020 7.971 0.049 18880
9289 1 20 . 1 1 91 91 ASP N N 91 123.620 123.620 122.880 0.740 18880
9290 1 20 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.960 -0.330 18880
9291 1 20 . 1 1 91 91 ASP C C 91 176.000 176.000 175.295 0.705 18880
9292 1 20 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.606 -0.096 18880
9293 1 20 . 1 1 91 91 ASP CB C 91 41.440 41.440 40.641 0.799 18880
9294 1 20 . 1 1 91 91 ASP H H 91 8.310 8.310 8.301 0.009 18880
9295 1 20 . 1 1 92 92 GLU N N 92 122.170 122.170 120.430 1.740 18880
9296 1 20 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.693 -0.333 18880
9297 1 20 . 1 1 92 92 GLU C C 92 175.660 175.660 175.848 -0.188 18880
9298 1 20 . 1 1 92 92 GLU CA C 92 56.490 56.490 55.870 0.620 18880
9299 1 20 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.921 1.929 18880
9300 1 20 . 1 1 92 92 GLU H H 92 8.320 8.320 8.234 0.086 18880
9301 1 21 . 1 1 10 10 HIS C C 10 176.040 176.040 173.366 2.674 18880
9302 1 21 . 1 1 11 11 SER N N 11 116.840 116.840 118.042 -1.202 18880
9303 1 21 . 1 1 11 11 SER HA H 11 4.430 4.430 4.209 0.221 18880
9304 1 21 . 1 1 11 11 SER C C 11 174.630 174.630 172.879 1.751 18880
9305 1 21 . 1 1 11 11 SER CA C 11 58.350 58.350 58.898 -0.548 18880
9306 1 21 . 1 1 11 11 SER CB C 11 64.120 64.120 63.465 0.655 18880
9307 1 21 . 1 1 11 11 SER H H 11 8.360 8.360 8.143 0.217 18880
9308 1 21 . 1 1 12 12 SER N N 12 118.030 118.030 118.213 -0.183 18880
9309 1 21 . 1 1 12 12 SER HA H 12 4.440 4.440 4.727 -0.287 18880
9310 1 21 . 1 1 12 12 SER C C 12 174.880 174.880 174.757 0.123 18880
9311 1 21 . 1 1 12 12 SER CA C 12 58.680 58.680 57.903 0.777 18880
9312 1 21 . 1 1 12 12 SER CB C 12 63.890 63.890 64.620 -0.730 18880
9313 1 21 . 1 1 12 12 SER H H 12 8.490 8.490 8.007 0.483 18880
9314 1 21 . 1 1 13 13 GLY N N 13 110.450 110.450 111.762 -1.312 18880
9315 1 21 . 1 1 13 13 GLY C C 13 173.790 173.790 174.721 -0.931 18880
9316 1 21 . 1 1 13 13 GLY CA C 13 45.460 45.460 44.820 0.640 18880
9317 1 21 . 1 1 13 13 GLY H H 13 8.390 8.390 8.496 -0.106 18880
9318 1 21 . 1 1 14 14 LEU N N 14 121.310 121.310 120.866 0.444 18880
9319 1 21 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.552 -0.212 18880
9320 1 21 . 1 1 14 14 LEU C C 14 176.930 176.930 176.508 0.422 18880
9321 1 21 . 1 1 14 14 LEU CA C 14 55.200 55.200 54.493 0.707 18880
9322 1 21 . 1 1 14 14 LEU CB C 14 42.600 42.600 41.775 0.825 18880
9323 1 21 . 1 1 14 14 LEU H H 14 8.020 8.020 7.983 0.037 18880
9324 1 21 . 1 1 15 15 VAL N N 15 121.550 121.550 119.874 1.676 18880
9325 1 21 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.610 -0.240 18880
9326 1 21 . 1 1 15 15 VAL CA C 15 59.720 59.720 59.232 0.488 18880
9327 1 21 . 1 1 15 15 VAL CB C 15 32.770 32.770 33.209 -0.439 18880
9328 1 21 . 1 1 15 15 VAL H H 15 8.030 8.030 7.586 0.444 18880
9329 1 21 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.482 -0.112 18880
9330 1 21 . 1 1 16 16 PRO C C 16 176.720 176.720 175.749 0.971 18880
9331 1 21 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.470 -0.820 18880
9332 1 21 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.191 0.049 18880
9333 1 21 . 1 1 17 17 ARG N N 17 121.890 121.890 121.352 0.538 18880
9334 1 21 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.607 -0.327 18880
9335 1 21 . 1 1 17 17 ARG C C 17 176.940 176.940 176.257 0.683 18880
9336 1 21 . 1 1 17 17 ARG CA C 17 56.360 56.360 55.959 0.401 18880
9337 1 21 . 1 1 17 17 ARG CB C 17 31.050 31.050 31.490 -0.440 18880
9338 1 21 . 1 1 17 17 ARG H H 17 8.450 8.450 8.434 0.016 18880
9339 1 21 . 1 1 18 18 GLY N N 18 110.160 110.160 110.271 -0.111 18880
9340 1 21 . 1 1 18 18 GLY C C 18 174.110 174.110 174.282 -0.172 18880
9341 1 21 . 1 1 18 18 GLY CA C 18 45.390 45.390 44.681 0.709 18880
9342 1 21 . 1 1 18 18 GLY H H 18 8.480 8.480 8.562 -0.082 18880
9343 1 21 . 1 1 19 19 SER N N 19 115.500 115.500 112.823 2.677 18880
9344 1 21 . 1 1 19 19 SER HA H 19 4.400 4.400 4.171 0.229 18880
9345 1 21 . 1 1 19 19 SER C C 19 174.380 174.380 173.420 0.960 18880
9346 1 21 . 1 1 19 19 SER CA C 19 58.610 58.610 59.651 -1.041 18880
9347 1 21 . 1 1 19 19 SER CB C 19 63.830 63.830 62.484 1.346 18880
9348 1 21 . 1 1 19 19 SER H H 19 8.210 8.210 8.458 -0.248 18880
9349 1 21 . 1 1 20 20 HIS N N 20 120.770 120.770 117.168 3.602 18880
9350 1 21 . 1 1 20 20 HIS HA H 20 4.610 4.610 5.023 -0.413 18880
9351 1 21 . 1 1 20 20 HIS C C 20 174.870 174.870 175.012 -0.142 18880
9352 1 21 . 1 1 20 20 HIS CA C 20 56.130 56.130 55.711 0.419 18880
9353 1 21 . 1 1 20 20 HIS CB C 20 29.710 29.710 29.708 0.002 18880
9354 1 21 . 1 1 20 20 HIS H H 20 8.590 8.590 8.479 0.111 18880
9355 1 21 . 1 1 21 21 MET N N 21 121.440 121.440 116.002 5.438 18880
9356 1 21 . 1 1 21 21 MET HA H 21 4.470 4.470 4.759 -0.289 18880
9357 1 21 . 1 1 21 21 MET C C 21 176.030 176.030 176.564 -0.534 18880
9358 1 21 . 1 1 21 21 MET CA C 21 55.490 55.490 56.904 -1.414 18880
9359 1 21 . 1 1 21 21 MET CB C 21 33.170 33.170 33.068 0.102 18880
9360 1 21 . 1 1 21 21 MET H H 21 8.310 8.310 7.870 0.440 18880
9361 1 21 . 1 1 22 22 SER N N 22 116.860 116.860 117.733 -0.873 18880
9362 1 21 . 1 1 22 22 SER HA H 22 4.430 4.430 4.376 0.054 18880
9363 1 21 . 1 1 22 22 SER C C 22 174.630 174.630 175.366 -0.736 18880
9364 1 21 . 1 1 22 22 SER CA C 22 58.410 58.410 59.335 -0.925 18880
9365 1 21 . 1 1 22 22 SER CB C 22 64.030 64.030 63.212 0.818 18880
9366 1 21 . 1 1 22 22 SER H H 22 8.340 8.340 8.097 0.243 18880
9367 1 21 . 1 1 23 23 ASP N N 23 122.660 122.660 121.160 1.500 18880
9368 1 21 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.469 0.081 18880
9369 1 21 . 1 1 23 23 ASP C C 23 176.860 176.860 177.500 -0.640 18880
9370 1 21 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.625 -0.295 18880
9371 1 21 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.191 0.808 18880
9372 1 21 . 1 1 23 23 ASP H H 23 8.540 8.540 8.356 0.184 18880
9373 1 21 . 1 1 24 24 GLU N N 24 120.400 120.400 118.989 1.411 18880
9374 1 21 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.052 0.088 18880
9375 1 21 . 1 1 24 24 GLU C C 24 177.540 177.540 177.418 0.122 18880
9376 1 21 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.266 0.094 18880
9377 1 21 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.127 0.623 18880
9378 1 21 . 1 1 24 24 GLU H H 24 8.610 8.610 7.675 0.935 18880
9379 1 21 . 1 1 25 25 LYS N N 25 120.390 120.390 117.175 3.215 18880
9380 1 21 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.356 -0.166 18880
9381 1 21 . 1 1 25 25 LYS C C 25 177.490 177.490 178.551 -1.061 18880
9382 1 21 . 1 1 25 25 LYS CA C 25 58.110 58.110 57.597 0.513 18880
9383 1 21 . 1 1 25 25 LYS CB C 25 32.490 32.490 33.047 -0.557 18880
9384 1 21 . 1 1 25 25 LYS H H 25 8.210 8.210 7.585 0.625 18880
9385 1 21 . 1 1 26 26 THR N N 26 114.880 114.880 115.615 -0.735 18880
9386 1 21 . 1 1 26 26 THR HA H 26 4.040 4.040 4.119 -0.079 18880
9387 1 21 . 1 1 26 26 THR C C 26 175.430 175.430 176.737 -1.307 18880
9388 1 21 . 1 1 26 26 THR CA C 26 64.620 64.620 65.929 -1.309 18880
9389 1 21 . 1 1 26 26 THR CB C 26 69.110 69.110 68.622 0.488 18880
9390 1 21 . 1 1 26 26 THR H H 26 8.080 8.080 7.459 0.621 18880
9391 1 21 . 1 1 27 27 GLN N N 27 120.940 120.940 121.695 -0.755 18880
9392 1 21 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.097 0.093 18880
9393 1 21 . 1 1 27 27 GLN C C 27 177.280 177.280 177.365 -0.085 18880
9394 1 21 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.584 -1.034 18880
9395 1 21 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.427 0.663 18880
9396 1 21 . 1 1 27 27 GLN H H 27 8.240 8.240 7.829 0.411 18880
9397 1 21 . 1 1 28 28 LEU N N 28 121.860 121.860 118.544 3.316 18880
9398 1 21 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.394 -0.224 18880
9399 1 21 . 1 1 28 28 LEU C C 28 177.750 177.750 178.010 -0.260 18880
9400 1 21 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.348 1.732 18880
9401 1 21 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.552 -0.282 18880
9402 1 21 . 1 1 28 28 LEU H H 28 7.950 7.950 7.461 0.489 18880
9403 1 21 . 1 1 29 29 ILE N N 29 119.260 119.260 119.075 0.185 18880
9404 1 21 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.936 -0.036 18880
9405 1 21 . 1 1 29 29 ILE C C 29 177.140 177.140 177.636 -0.496 18880
9406 1 21 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.472 -0.172 18880
9407 1 21 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.908 1.372 18880
9408 1 21 . 1 1 29 29 ILE H H 29 7.950 7.950 7.932 0.018 18880
9409 1 21 . 1 1 30 30 GLU N N 30 120.500 120.500 119.983 0.517 18880
9410 1 21 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.269 -0.219 18880
9411 1 21 . 1 1 30 30 GLU C C 30 177.560 177.560 176.549 1.011 18880
9412 1 21 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.432 0.658 18880
9413 1 21 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.343 0.247 18880
9414 1 21 . 1 1 30 30 GLU H H 30 8.220 8.220 8.031 0.189 18880
9415 1 21 . 1 1 31 31 ALA N N 31 121.550 121.550 120.435 1.115 18880
9416 1 21 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.438 -0.288 18880
9417 1 21 . 1 1 31 31 ALA C C 31 178.550 178.550 179.106 -0.556 18880
9418 1 21 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.829 -0.029 18880
9419 1 21 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.433 -0.803 18880
9420 1 21 . 1 1 31 31 ALA H H 31 7.890 7.890 7.606 0.284 18880
9421 1 21 . 1 1 32 32 PHE N N 32 117.240 117.240 118.342 -1.102 18880
9422 1 21 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.232 0.068 18880
9423 1 21 . 1 1 32 32 PHE C C 32 176.210 176.210 176.940 -0.730 18880
9424 1 21 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.853 -1.513 18880
9425 1 21 . 1 1 32 32 PHE CB C 32 39.750 39.750 39.017 0.733 18880
9426 1 21 . 1 1 32 32 PHE H H 32 7.930 7.930 7.653 0.277 18880
9427 1 21 . 1 1 33 33 TYR N N 33 119.050 119.050 116.249 2.801 18880
9428 1 21 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.706 -0.376 18880
9429 1 21 . 1 1 33 33 TYR C C 33 175.680 175.680 175.474 0.206 18880
9430 1 21 . 1 1 33 33 TYR CA C 33 58.920 58.920 58.208 0.712 18880
9431 1 21 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.346 1.194 18880
9432 1 21 . 1 1 33 33 TYR H H 33 7.950 7.950 8.448 -0.498 18880
9433 1 21 . 1 1 34 34 ASN N N 34 118.390 118.390 118.742 -0.352 18880
9434 1 21 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.831 -0.201 18880
9435 1 21 . 1 1 34 34 ASN C C 34 174.810 174.810 173.936 0.874 18880
9436 1 21 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.779 -0.629 18880
9437 1 21 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.875 -0.895 18880
9438 1 21 . 1 1 34 34 ASN H H 34 7.960 7.960 7.910 0.050 18880
9439 1 21 . 1 1 35 35 PHE N N 35 120.670 120.670 121.138 -0.468 18880
9440 1 21 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.537 -0.087 18880
9441 1 21 . 1 1 35 35 PHE C C 35 175.310 175.310 173.006 2.304 18880
9442 1 21 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.163 0.158 18880
9443 1 21 . 1 1 35 35 PHE CB C 35 39.420 39.420 40.439 -1.019 18880
9444 1 21 . 1 1 35 35 PHE H H 35 7.830 7.830 8.089 -0.259 18880
9445 1 21 . 1 1 36 36 ASP N N 36 122.400 122.400 120.655 1.745 18880
9446 1 21 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.881 -0.291 18880
9447 1 21 . 1 1 36 36 ASP C C 36 176.150 176.150 175.588 0.562 18880
9448 1 21 . 1 1 36 36 ASP CA C 36 54.070 54.070 54.234 -0.164 18880
9449 1 21 . 1 1 36 36 ASP CB C 36 41.320 41.320 41.103 0.216 18880
9450 1 21 . 1 1 36 36 ASP H H 36 8.180 8.180 8.044 0.136 18880
9451 1 21 . 1 1 37 37 GLY N N 37 108.560 108.560 109.237 -0.677 18880
9452 1 21 . 1 1 37 37 GLY C C 37 173.660 173.660 174.854 -1.194 18880
9453 1 21 . 1 1 37 37 GLY CA C 37 45.610 45.610 46.017 -0.407 18880
9454 1 21 . 1 1 37 37 GLY H H 37 7.680 7.680 8.586 -0.906 18880
9455 1 21 . 1 1 38 38 ASP N N 38 120.010 120.010 118.036 1.974 18880
9456 1 21 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.670 -0.070 18880
9457 1 21 . 1 1 38 38 ASP CA C 38 54.260 54.260 53.548 0.711 18880
9458 1 21 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.878 0.572 18880
9459 1 21 . 1 1 38 38 ASP H H 38 8.220 8.220 8.160 0.060 18880
9460 1 21 . 1 1 39 39 TYR N N 39 121.030 121.030 119.990 1.040 18880
9461 1 21 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.194 0.196 18880
9462 1 21 . 1 1 39 39 TYR C C 39 175.290 175.290 175.053 0.237 18880
9463 1 21 . 1 1 39 39 TYR CA C 39 58.200 58.200 57.987 0.213 18880
9464 1 21 . 1 1 39 39 TYR CB C 39 39.170 39.170 38.278 0.892 18880
9465 1 21 . 1 1 39 39 TYR H H 39 8.090 8.090 8.613 -0.523 18880
9466 1 21 . 1 1 40 40 ASP N N 40 122.020 122.020 121.567 0.453 18880
9467 1 21 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.785 -0.185 18880
9468 1 21 . 1 1 40 40 ASP C C 40 175.970 175.970 174.323 1.647 18880
9469 1 21 . 1 1 40 40 ASP CA C 40 54.220 54.220 53.333 0.887 18880
9470 1 21 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.225 0.295 18880
9471 1 21 . 1 1 40 40 ASP H H 40 8.200 8.200 8.246 -0.046 18880
9472 1 21 . 1 1 41 41 GLY N N 41 108.330 108.330 108.005 0.325 18880
9473 1 21 . 1 1 41 41 GLY C C 41 173.000 173.000 172.828 0.172 18880
9474 1 21 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.892 0.528 18880
9475 1 21 . 1 1 41 41 GLY H H 41 7.830 7.830 8.482 -0.652 18880
9476 1 21 . 1 1 42 42 PHE N N 42 118.600 118.600 119.597 -0.997 18880
9477 1 21 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.949 0.311 18880
9478 1 21 . 1 1 42 42 PHE C C 42 175.660 175.660 173.727 1.933 18880
9479 1 21 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.508 -0.348 18880
9480 1 21 . 1 1 42 42 PHE CB C 42 41.170 41.170 41.522 -0.352 18880
9481 1 21 . 1 1 42 42 PHE H H 42 8.150 8.150 7.684 0.466 18880
9482 1 21 . 1 1 43 43 VAL N N 43 119.180 119.180 127.966 -8.786 18880
9483 1 21 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.530 0.140 18880
9484 1 21 . 1 1 43 43 VAL C C 43 175.110 175.110 174.163 0.947 18880
9485 1 21 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.216 0.404 18880
9486 1 21 . 1 1 43 43 VAL CB C 43 32.880 32.880 34.452 -1.572 18880
9487 1 21 . 1 1 43 43 VAL H H 43 9.070 9.070 8.173 0.897 18880
9488 1 21 . 1 1 44 44 SER N N 44 121.380 121.380 123.432 -2.052 18880
9489 1 21 . 1 1 44 44 SER HA H 44 4.570 4.570 4.069 0.501 18880
9490 1 21 . 1 1 44 44 SER C C 44 175.660 175.660 175.330 0.330 18880
9491 1 21 . 1 1 44 44 SER CA C 44 57.720 57.720 57.490 0.230 18880
9492 1 21 . 1 1 44 44 SER CB C 44 63.690 63.690 62.949 0.741 18880
9493 1 21 . 1 1 44 44 SER H H 44 9.140 9.140 8.465 0.675 18880
9494 1 21 . 1 1 45 45 VAL N N 45 122.720 122.720 123.768 -1.048 18880
9495 1 21 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.252 0.248 18880
9496 1 21 . 1 1 45 45 VAL C C 45 177.240 177.240 177.484 -0.244 18880
9497 1 21 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.903 -0.633 18880
9498 1 21 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.931 0.519 18880
9499 1 21 . 1 1 45 45 VAL H H 45 8.140 8.140 8.275 -0.135 18880
9500 1 21 . 1 1 46 46 GLU N N 46 118.990 118.990 116.825 2.165 18880
9501 1 21 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.875 0.105 18880
9502 1 21 . 1 1 46 46 GLU C C 46 179.460 179.460 179.165 0.295 18880
9503 1 21 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.440 0.120 18880
9504 1 21 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.930 0.230 18880
9505 1 21 . 1 1 46 46 GLU H H 46 8.230 8.230 7.749 0.481 18880
9506 1 21 . 1 1 47 47 GLU N N 47 120.120 120.120 118.702 1.418 18880
9507 1 21 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.208 -0.128 18880
9508 1 21 . 1 1 47 47 GLU C C 47 179.170 179.170 178.787 0.383 18880
9509 1 21 . 1 1 47 47 GLU CA C 47 58.890 58.890 57.578 1.312 18880
9510 1 21 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.688 0.132 18880
9511 1 21 . 1 1 47 47 GLU H H 47 7.880 7.880 7.505 0.375 18880
9512 1 21 . 1 1 48 48 PHE N N 48 120.830 120.830 121.241 -0.411 18880
9513 1 21 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.364 -0.174 18880
9514 1 21 . 1 1 48 48 PHE C C 48 176.920 176.920 177.809 -0.889 18880
9515 1 21 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.431 0.439 18880
9516 1 21 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.105 0.155 18880
9517 1 21 . 1 1 48 48 PHE H H 48 8.600 8.600 8.217 0.383 18880
9518 1 21 . 1 1 49 49 ARG N N 49 118.470 118.470 119.107 -0.637 18880
9519 1 21 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.124 -0.264 18880
9520 1 21 . 1 1 49 49 ARG C C 49 178.090 178.090 178.627 -0.537 18880
9521 1 21 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.245 -0.175 18880
9522 1 21 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.840 0.300 18880
9523 1 21 . 1 1 49 49 ARG H H 49 8.650 8.650 8.932 -0.282 18880
9524 1 21 . 1 1 50 50 GLY N N 50 105.080 105.080 105.231 -0.151 18880
9525 1 21 . 1 1 50 50 GLY C C 50 175.090 175.090 175.894 -0.804 18880
9526 1 21 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.776 -0.097 18880
9527 1 21 . 1 1 50 50 GLY H H 50 7.620 7.620 8.245 -0.625 18880
9528 1 21 . 1 1 51 51 ILE N N 51 121.440 121.440 121.248 0.192 18880
9529 1 21 . 1 1 51 51 ILE HA H 51 3.830 3.830 4.082 -0.252 18880
9530 1 21 . 1 1 51 51 ILE C C 51 178.300 178.300 176.914 1.386 18880
9531 1 21 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.740 0.100 18880
9532 1 21 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.565 -0.255 18880
9533 1 21 . 1 1 51 51 ILE H H 51 7.470 7.470 7.535 -0.065 18880
9534 1 21 . 1 1 52 52 ILE N N 52 118.930 118.930 119.751 -0.821 18880
9535 1 21 . 1 1 52 52 ILE HA H 52 3.740 3.740 4.023 -0.283 18880
9536 1 21 . 1 1 52 52 ILE CA C 52 63.760 63.760 61.994 1.766 18880
9537 1 21 . 1 1 52 52 ILE CB C 52 38.030 38.030 37.249 0.781 18880
9538 1 21 . 1 1 52 52 ILE H H 52 7.790 7.790 8.012 -0.222 18880
9539 1 21 . 1 1 53 53 ARG N N 53 120.140 120.140 119.913 0.227 18880
9540 1 21 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.029 0.061 18880
9541 1 21 . 1 1 53 53 ARG C C 53 177.380 177.380 177.211 0.169 18880
9542 1 21 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.176 0.934 18880
9543 1 21 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.690 -1.110 18880
9544 1 21 . 1 1 53 53 ARG H H 53 7.930 7.930 8.492 -0.562 18880
9545 1 21 . 1 1 54 54 ASP N N 54 117.500 117.500 117.005 0.495 18880
9546 1 21 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.823 -0.223 18880
9547 1 21 . 1 1 54 54 ASP C C 54 176.930 176.930 176.086 0.844 18880
9548 1 21 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.279 1.261 18880
9549 1 21 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.457 -0.357 18880
9550 1 21 . 1 1 54 54 ASP H H 54 7.870 7.870 7.964 -0.094 18880
9551 1 21 . 1 1 55 55 GLY N N 55 106.370 106.370 108.323 -1.953 18880
9552 1 21 . 1 1 55 55 GLY C C 55 173.460 173.460 173.968 -0.508 18880
9553 1 21 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.256 0.744 18880
9554 1 21 . 1 1 55 55 GLY H H 55 7.880 7.880 8.037 -0.157 18880
9555 1 21 . 1 1 56 56 LEU N N 56 122.630 122.630 123.018 -0.388 18880
9556 1 21 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.867 -0.097 18880
9557 1 21 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.735 0.755 18880
9558 1 21 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.745 0.375 18880
9559 1 21 . 1 1 56 56 LEU H H 56 8.220 8.220 7.950 0.270 18880
9560 1 21 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.483 0.097 18880
9561 1 21 . 1 1 57 57 PRO C C 57 176.150 176.150 175.574 0.576 18880
9562 1 21 . 1 1 57 57 PRO CA C 57 62.420 62.420 63.033 -0.613 18880
9563 1 21 . 1 1 57 57 PRO CB C 57 30.740 30.740 31.916 -1.176 18880
9564 1 21 . 1 1 58 58 MET N N 58 121.810 121.810 124.834 -3.024 18880
9565 1 21 . 1 1 58 58 MET HA H 58 4.630 4.630 4.756 -0.126 18880
9566 1 21 . 1 1 58 58 MET C C 58 176.150 176.150 175.075 1.075 18880
9567 1 21 . 1 1 58 58 MET CA C 58 55.560 55.560 54.337 1.223 18880
9568 1 21 . 1 1 58 58 MET CB C 58 36.820 36.820 37.347 -0.527 18880
9569 1 21 . 1 1 58 58 MET H H 58 7.690 7.690 8.342 -0.652 18880
9570 1 21 . 1 1 59 59 THR N N 59 114.180 114.180 116.535 -2.355 18880
9571 1 21 . 1 1 59 59 THR HA H 59 4.450 4.450 4.485 -0.035 18880
9572 1 21 . 1 1 59 59 THR C C 59 175.170 175.170 175.909 -0.739 18880
9573 1 21 . 1 1 59 59 THR CA C 59 60.780 60.780 61.459 -0.679 18880
9574 1 21 . 1 1 59 59 THR CB C 59 71.060 71.060 69.950 1.110 18880
9575 1 21 . 1 1 59 59 THR H H 59 8.940 8.940 9.126 -0.186 18880
9576 1 21 . 1 1 60 60 GLU N N 60 120.620 120.620 125.429 -4.809 18880
9577 1 21 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.773 0.237 18880
9578 1 21 . 1 1 60 60 GLU C C 60 179.010 179.010 178.082 0.928 18880
9579 1 21 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.715 0.105 18880
9580 1 21 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.550 0.500 18880
9581 1 21 . 1 1 60 60 GLU H H 60 8.850 8.850 8.966 -0.116 18880
9582 1 21 . 1 1 61 61 ALA N N 61 121.080 121.080 122.534 -1.454 18880
9583 1 21 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.977 0.163 18880
9584 1 21 . 1 1 61 61 ALA C C 61 180.350 180.350 180.006 0.344 18880
9585 1 21 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.158 -0.068 18880
9586 1 21 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.749 0.461 18880
9587 1 21 . 1 1 61 61 ALA H H 61 8.370 8.370 8.431 -0.061 18880
9588 1 21 . 1 1 62 62 GLU N N 62 118.890 118.890 119.055 -0.165 18880
9589 1 21 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.504 0.496 18880
9590 1 21 . 1 1 62 62 GLU C C 62 179.690 179.690 178.692 0.998 18880
9591 1 21 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.630 0.360 18880
9592 1 21 . 1 1 62 62 GLU CB C 62 30.310 30.310 29.018 1.292 18880
9593 1 21 . 1 1 62 62 GLU H H 62 7.680 7.680 7.575 0.105 18880
9594 1 21 . 1 1 63 63 ILE N N 63 122.340 122.340 119.879 2.461 18880
9595 1 21 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.258 0.312 18880
9596 1 21 . 1 1 63 63 ILE C C 63 177.260 177.260 178.234 -0.974 18880
9597 1 21 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.730 1.160 18880
9598 1 21 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.117 0.863 18880
9599 1 21 . 1 1 63 63 ILE H H 63 8.420 8.420 7.617 0.803 18880
9600 1 21 . 1 1 64 64 THR N N 64 116.970 116.970 115.760 1.210 18880
9601 1 21 . 1 1 64 64 THR HA H 64 3.940 3.940 3.990 -0.050 18880
9602 1 21 . 1 1 64 64 THR C C 64 176.520 176.520 176.813 -0.293 18880
9603 1 21 . 1 1 64 64 THR CA C 64 67.060 67.060 67.385 -0.325 18880
9604 1 21 . 1 1 64 64 THR CB C 64 68.750 68.750 68.403 0.347 18880
9605 1 21 . 1 1 64 64 THR H H 64 8.310 8.310 8.493 -0.183 18880
9606 1 21 . 1 1 65 65 GLU N N 65 120.760 120.760 120.382 0.378 18880
9607 1 21 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.355 -0.325 18880
9608 1 21 . 1 1 65 65 GLU C C 65 175.830 175.830 178.706 -2.876 18880
9609 1 21 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.777 0.723 18880
9610 1 21 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.471 0.299 18880
9611 1 21 . 1 1 65 65 GLU H H 65 7.970 7.970 8.511 -0.541 18880
9612 1 21 . 1 1 66 66 PHE N N 66 120.940 120.940 117.928 3.012 18880
9613 1 21 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.351 -0.111 18880
9614 1 21 . 1 1 66 66 PHE C C 66 177.330 177.330 176.532 0.798 18880
9615 1 21 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.398 2.802 18880
9616 1 21 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.067 -0.537 18880
9617 1 21 . 1 1 66 66 PHE H H 66 8.100 8.100 7.794 0.306 18880
9618 1 21 . 1 1 67 67 PHE N N 67 118.110 118.110 118.267 -0.157 18880
9619 1 21 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.481 -0.531 18880
9620 1 21 . 1 1 67 67 PHE C C 67 178.090 178.090 177.505 0.585 18880
9621 1 21 . 1 1 67 67 PHE CA C 67 61.200 61.200 58.913 2.287 18880
9622 1 21 . 1 1 67 67 PHE CB C 67 38.250 38.250 39.151 -0.901 18880
9623 1 21 . 1 1 67 67 PHE H H 67 8.380 8.380 8.420 -0.040 18880
9624 1 21 . 1 1 68 68 GLU N N 68 119.650 119.650 118.544 1.106 18880
9625 1 21 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.366 -0.356 18880
9626 1 21 . 1 1 68 68 GLU C C 68 177.910 177.910 177.227 0.683 18880
9627 1 21 . 1 1 68 68 GLU CA C 68 59.240 59.240 58.113 1.127 18880
9628 1 21 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.233 0.137 18880
9629 1 21 . 1 1 68 68 GLU H H 68 8.230 8.230 8.325 -0.095 18880
9630 1 21 . 1 1 69 69 ALA N N 69 119.090 119.090 121.573 -2.483 18880
9631 1 21 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.260 -0.080 18880
9632 1 21 . 1 1 69 69 ALA C C 69 179.030 179.030 178.413 0.617 18880
9633 1 21 . 1 1 69 69 ALA CA C 69 53.600 53.600 54.065 -0.465 18880
9634 1 21 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.326 0.454 18880
9635 1 21 . 1 1 69 69 ALA H H 69 7.340 7.340 7.788 -0.448 18880
9636 1 21 . 1 1 70 70 ALA N N 70 118.670 118.670 119.035 -0.365 18880
9637 1 21 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.337 -0.317 18880
9638 1 21 . 1 1 70 70 ALA C C 70 176.820 176.820 176.794 0.026 18880
9639 1 21 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.444 0.646 18880
9640 1 21 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.259 -0.648 18880
9641 1 21 . 1 1 70 70 ALA H H 70 8.050 8.050 7.893 0.157 18880
9642 1 21 . 1 1 71 71 ASP N N 71 116.780 116.780 118.466 -1.686 18880
9643 1 21 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.221 -0.001 18880
9644 1 21 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.779 1.371 18880
9645 1 21 . 1 1 71 71 ASP CB C 71 40.910 40.910 43.164 -2.254 18880
9646 1 21 . 1 1 71 71 ASP H H 71 8.010 8.010 7.486 0.524 18880
9647 1 21 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.407 0.063 18880
9648 1 21 . 1 1 72 72 PRO C C 72 177.970 177.970 177.402 0.568 18880
9649 1 21 . 1 1 72 72 PRO CA C 72 64.910 64.910 65.084 -0.174 18880
9650 1 21 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.460 -0.580 18880
9651 1 21 . 1 1 73 73 ASN N N 73 114.930 114.930 117.585 -2.655 18880
9652 1 21 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.513 0.367 18880
9653 1 21 . 1 1 73 73 ASN C C 73 174.880 174.880 175.144 -0.264 18880
9654 1 21 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.761 -0.921 18880
9655 1 21 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.340 0.040 18880
9656 1 21 . 1 1 73 73 ASN H H 73 9.030 9.030 8.649 0.381 18880
9657 1 21 . 1 1 74 74 ASN N N 74 118.340 118.340 112.543 5.797 18880
9658 1 21 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.558 -0.198 18880
9659 1 21 . 1 1 74 74 ASN CA C 74 54.590 54.590 53.871 0.719 18880
9660 1 21 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.320 0.840 18880
9661 1 21 . 1 1 74 74 ASN H H 74 8.320 8.320 8.395 -0.075 18880
9662 1 21 . 1 1 75 75 THR N N 75 113.450 113.450 110.726 2.724 18880
9663 1 21 . 1 1 75 75 THR HA H 75 4.210 4.210 4.506 -0.296 18880
9664 1 21 . 1 1 75 75 THR CA C 75 63.410 63.410 60.709 2.701 18880
9665 1 21 . 1 1 75 75 THR CB C 75 70.540 70.540 68.740 1.800 18880
9666 1 21 . 1 1 75 75 THR H H 75 9.870 9.870 8.925 0.945 18880
9667 1 21 . 1 1 76 76 GLY N N 76 111.810 111.810 108.567 3.243 18880
9668 1 21 . 1 1 76 76 GLY C C 76 173.670 173.670 173.803 -0.133 18880
9669 1 21 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.656 -0.536 18880
9670 1 21 . 1 1 76 76 GLY H H 76 10.250 10.250 8.567 1.683 18880
9671 1 21 . 1 1 77 77 PHE N N 77 120.560 120.560 118.175 2.385 18880
9672 1 21 . 1 1 77 77 PHE HA H 77 5.150 5.150 5.048 0.102 18880
9673 1 21 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.985 0.195 18880
9674 1 21 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.241 1.259 18880
9675 1 21 . 1 1 77 77 PHE H H 77 8.110 8.110 7.602 0.508 18880
9676 1 21 . 1 1 78 78 ILE N N 78 116.410 116.410 122.121 -5.711 18880
9677 1 21 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.224 0.166 18880
9678 1 21 . 1 1 78 78 ILE C C 78 174.770 174.770 174.070 0.700 18880
9679 1 21 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.679 -0.489 18880
9680 1 21 . 1 1 78 78 ILE CB C 78 41.180 41.180 40.252 0.928 18880
9681 1 21 . 1 1 78 78 ILE H H 78 8.930 8.930 7.792 1.138 18880
9682 1 21 . 1 1 79 79 ASP N N 79 125.220 125.220 125.019 0.201 18880
9683 1 21 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.562 -0.062 18880
9684 1 21 . 1 1 79 79 ASP C C 79 176.490 176.490 176.751 -0.261 18880
9685 1 21 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.734 0.576 18880
9686 1 21 . 1 1 79 79 ASP CB C 79 41.370 41.370 41.453 -0.083 18880
9687 1 21 . 1 1 79 79 ASP H H 79 8.610 8.610 8.665 -0.055 18880
9688 1 21 . 1 1 80 80 TYR N N 80 125.760 125.760 127.825 -2.065 18880
9689 1 21 . 1 1 80 80 TYR HA H 80 3.990 3.990 3.934 0.056 18880
9690 1 21 . 1 1 80 80 TYR C C 80 177.140 177.140 176.855 0.285 18880
9691 1 21 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.486 -0.906 18880
9692 1 21 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.600 0.290 18880
9693 1 21 . 1 1 80 80 TYR H H 80 8.460 8.460 8.225 0.235 18880
9694 1 21 . 1 1 81 81 LYS N N 81 118.320 118.320 118.533 -0.213 18880
9695 1 21 . 1 1 81 81 LYS HA H 81 3.900 3.900 4.079 -0.179 18880
9696 1 21 . 1 1 81 81 LYS C C 81 179.090 179.090 178.598 0.492 18880
9697 1 21 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.898 -0.318 18880
9698 1 21 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.807 -0.047 18880
9699 1 21 . 1 1 81 81 LYS H H 81 8.410 8.410 8.342 0.068 18880
9700 1 21 . 1 1 82 82 ALA N N 82 122.050 122.050 121.738 0.312 18880
9701 1 21 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.118 0.012 18880
9702 1 21 . 1 1 82 82 ALA C C 82 179.740 179.740 179.562 0.178 18880
9703 1 21 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.744 -0.224 18880
9704 1 21 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.230 0.310 18880
9705 1 21 . 1 1 82 82 ALA H H 82 7.770 7.770 7.905 -0.135 18880
9706 1 21 . 1 1 83 83 PHE N N 83 117.810 117.810 116.511 1.299 18880
9707 1 21 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.223 0.067 18880
9708 1 21 . 1 1 83 83 PHE C C 83 176.460 176.460 176.900 -0.440 18880
9709 1 21 . 1 1 83 83 PHE CA C 83 60.030 60.030 60.158 -0.128 18880
9710 1 21 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.801 -0.281 18880
9711 1 21 . 1 1 83 83 PHE H H 83 7.780 7.780 7.751 0.029 18880
9712 1 21 . 1 1 84 84 ALA N N 84 121.530 121.530 121.426 0.104 18880
9713 1 21 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.091 -0.431 18880
9714 1 21 . 1 1 84 84 ALA C C 84 179.010 179.010 179.285 -0.275 18880
9715 1 21 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.344 0.686 18880
9716 1 21 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.791 -0.661 18880
9717 1 21 . 1 1 84 84 ALA H H 84 8.290 8.290 8.168 0.122 18880
9718 1 21 . 1 1 85 85 ALA N N 85 117.720 117.720 121.413 -3.693 18880
9719 1 21 . 1 1 85 85 ALA HA H 85 4.080 4.080 2.332 1.748 18880
9720 1 21 . 1 1 85 85 ALA C C 85 179.570 179.570 178.281 1.289 18880
9721 1 21 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.189 0.181 18880
9722 1 21 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.103 0.187 18880
9723 1 21 . 1 1 85 85 ALA H H 85 7.700 7.700 8.503 -0.803 18880
9724 1 21 . 1 1 86 86 MET N N 86 116.570 116.570 114.368 2.202 18880
9725 1 21 . 1 1 86 86 MET HA H 86 4.160 4.160 4.028 0.132 18880
9726 1 21 . 1 1 86 86 MET C C 86 177.360 177.360 176.719 0.641 18880
9727 1 21 . 1 1 86 86 MET CA C 86 57.380 57.380 56.589 0.791 18880
9728 1 21 . 1 1 86 86 MET CB C 86 32.720 32.720 32.259 0.461 18880
9729 1 21 . 1 1 86 86 MET H H 86 7.560 7.560 7.259 0.301 18880
9730 1 21 . 1 1 87 87 LEU N N 87 119.090 119.090 116.186 2.904 18880
9731 1 21 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.236 -0.266 18880
9732 1 21 . 1 1 87 87 LEU C C 87 177.420 177.420 177.428 -0.008 18880
9733 1 21 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.311 0.979 18880
9734 1 21 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.534 -0.254 18880
9735 1 21 . 1 1 87 87 LEU H H 87 7.570 7.570 7.676 -0.106 18880
9736 1 21 . 1 1 88 88 TYR N N 88 117.060 117.060 115.081 1.979 18880
9737 1 21 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.740 -0.150 18880
9738 1 21 . 1 1 88 88 TYR C C 88 175.870 175.870 174.427 1.443 18880
9739 1 21 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.506 2.334 18880
9740 1 21 . 1 1 88 88 TYR CB C 88 38.640 38.640 37.797 0.843 18880
9741 1 21 . 1 1 88 88 TYR H H 88 7.740 7.740 7.079 0.661 18880
9742 1 21 . 1 1 89 89 SER N N 89 115.980 115.980 118.447 -2.467 18880
9743 1 21 . 1 1 89 89 SER HA H 89 4.440 4.440 4.166 0.274 18880
9744 1 21 . 1 1 89 89 SER C C 89 174.460 174.460 174.320 0.140 18880
9745 1 21 . 1 1 89 89 SER CA C 89 58.350 58.350 59.380 -1.030 18880
9746 1 21 . 1 1 89 89 SER CB C 89 63.990 63.990 62.215 1.775 18880
9747 1 21 . 1 1 89 89 SER H H 89 7.880 7.880 8.048 -0.168 18880
9748 1 21 . 1 1 90 90 VAL N N 90 120.910 120.910 124.007 -3.097 18880
9749 1 21 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.137 0.003 18880
9750 1 21 . 1 1 90 90 VAL C C 90 175.720 175.720 174.841 0.879 18880
9751 1 21 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.737 -0.467 18880
9752 1 21 . 1 1 90 90 VAL CB C 90 32.840 32.840 32.598 0.242 18880
9753 1 21 . 1 1 90 90 VAL H H 90 8.020 8.020 8.305 -0.285 18880
9754 1 21 . 1 1 91 91 ASP N N 91 123.620 123.620 122.132 1.488 18880
9755 1 21 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.767 -0.137 18880
9756 1 21 . 1 1 91 91 ASP C C 91 176.000 176.000 176.012 -0.012 18880
9757 1 21 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.690 -0.180 18880
9758 1 21 . 1 1 91 91 ASP CB C 91 41.440 41.440 42.099 -0.659 18880
9759 1 21 . 1 1 91 91 ASP H H 91 8.310 8.310 8.242 0.068 18880
9760 1 21 . 1 1 92 92 GLU N N 92 122.170 122.170 120.932 1.238 18880
9761 1 21 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.501 -0.141 18880
9762 1 21 . 1 1 92 92 GLU C C 92 175.660 175.660 176.463 -0.803 18880
9763 1 21 . 1 1 92 92 GLU CA C 92 56.490 56.490 55.626 0.864 18880
9764 1 21 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.743 2.107 18880
9765 1 21 . 1 1 92 92 GLU H H 92 8.320 8.320 8.415 -0.095 18880
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 79 2.049 -0.104 2.059 18880
2 1 1 "Average Difference" HA 89 0.194 0.011 0.194 18880
3 1 1 "Average Difference" C 75 0.896 -0.049 0.901 18880
4 1 1 "Average Difference" CA 82 0.970 -0.087 0.972 18880
5 1 1 "Average Difference" CB 75 0.976 -0.214 0.959 18880
6 1 1 "Average Difference" HN 79 0.521 -0.199 0.485 18880
7 1 2 "Average Difference" N 79 2.222 -0.325 2.212 18880
8 1 2 "Average Difference" HA 89 0.285 0.036 0.284 18880
9 1 2 "Average Difference" C 75 0.761 -0.162 0.748 18880
10 1 2 "Average Difference" CA 82 0.953 -0.182 0.941 18880
11 1 2 "Average Difference" CB 75 0.845 -0.251 0.812 18880
12 1 2 "Average Difference" HN 79 0.497 -0.110 0.487 18880
13 1 3 "Average Difference" N 79 2.246 -0.243 2.247 18880
14 1 3 "Average Difference" HA 89 0.263 -0.004 0.265 18880
15 1 3 "Average Difference" C 75 0.838 -0.087 0.839 18880
16 1 3 "Average Difference" CA 82 0.896 -0.162 0.887 18880
17 1 3 "Average Difference" CB 75 1.013 -0.293 0.976 18880
18 1 3 "Average Difference" HN 79 0.480 -0.141 0.461 18880
19 1 4 "Average Difference" N 79 2.554 -0.612 2.496 18880
20 1 4 "Average Difference" HA 89 0.196 0.040 0.193 18880
21 1 4 "Average Difference" C 75 0.882 -0.217 0.860 18880
22 1 4 "Average Difference" CA 82 0.900 -0.186 0.886 18880
23 1 4 "Average Difference" CB 75 0.885 -0.178 0.873 18880
24 1 4 "Average Difference" HN 79 0.504 -0.159 0.482 18880
25 1 5 "Average Difference" N 79 2.355 -0.141 2.366 18880
26 1 5 "Average Difference" HA 89 0.312 -0.037 0.312 18880
27 1 5 "Average Difference" C 75 0.829 -0.125 0.825 18880
28 1 5 "Average Difference" CA 82 0.913 -0.209 0.894 18880
29 1 5 "Average Difference" CB 75 0.978 -0.331 0.926 18880
30 1 5 "Average Difference" HN 79 0.504 -0.155 0.483 18880
31 1 6 "Average Difference" N 79 2.280 -0.289 2.276 18880
32 1 6 "Average Difference" HA 89 0.235 0.019 0.236 18880
33 1 6 "Average Difference" C 75 0.858 -0.176 0.846 18880
34 1 6 "Average Difference" CA 82 1.042 -0.181 1.032 18880
35 1 6 "Average Difference" CB 75 0.944 -0.298 0.902 18880
36 1 6 "Average Difference" HN 79 0.507 -0.162 0.483 18880
37 1 7 "Average Difference" N 79 2.537 -0.272 2.538 18880
38 1 7 "Average Difference" HA 89 0.249 0.015 0.250 18880
39 1 7 "Average Difference" C 75 0.851 -0.093 0.851 18880
40 1 7 "Average Difference" CA 82 0.923 -0.205 0.906 18880
41 1 7 "Average Difference" CB 75 0.904 -0.310 0.855 18880
42 1 7 "Average Difference" HN 79 0.495 -0.154 0.473 18880
43 1 8 "Average Difference" N 79 2.182 0.030 2.196 18880
44 1 8 "Average Difference" HA 89 0.246 0.019 0.247 18880
45 1 8 "Average Difference" C 75 0.846 -0.204 0.826 18880
46 1 8 "Average Difference" CA 82 0.979 -0.298 0.939 18880
47 1 8 "Average Difference" CB 75 0.988 -0.253 0.961 18880
48 1 8 "Average Difference" HN 79 0.539 -0.128 0.527 18880
49 1 9 "Average Difference" N 79 2.573 -0.357 2.564 18880
50 1 9 "Average Difference" HA 89 0.254 0.017 0.255 18880
51 1 9 "Average Difference" C 75 0.814 -0.192 0.796 18880
52 1 9 "Average Difference" CA 82 0.980 -0.272 0.948 18880
53 1 9 "Average Difference" CB 75 0.945 -0.257 0.916 18880
54 1 9 "Average Difference" HN 79 0.542 -0.158 0.521 18880
55 1 10 "Average Difference" N 79 2.434 -0.391 2.418 18880
56 1 10 "Average Difference" HA 89 0.230 -0.005 0.231 18880
57 1 10 "Average Difference" C 75 0.841 -0.032 0.846 18880
58 1 10 "Average Difference" CA 82 0.915 -0.175 0.903 18880
59 1 10 "Average Difference" CB 75 1.065 -0.324 1.021 18880
60 1 10 "Average Difference" HN 79 0.532 -0.142 0.516 18880
61 1 11 "Average Difference" N 79 2.473 -0.175 2.483 18880
62 1 11 "Average Difference" HA 89 0.273 -0.011 0.274 18880
63 1 11 "Average Difference" C 75 0.775 -0.128 0.769 18880
64 1 11 "Average Difference" CA 82 0.926 -0.219 0.906 18880
65 1 11 "Average Difference" CB 75 0.960 -0.216 0.942 18880
66 1 11 "Average Difference" HN 79 0.510 -0.162 0.487 18880
67 1 12 "Average Difference" N 79 2.135 -0.258 2.132 18880
68 1 12 "Average Difference" HA 89 0.230 0.009 0.231 18880
69 1 12 "Average Difference" C 75 0.784 -0.169 0.771 18880
70 1 12 "Average Difference" CA 82 1.022 -0.170 1.014 18880
71 1 12 "Average Difference" CB 75 1.046 -0.210 1.032 18880
72 1 12 "Average Difference" HN 79 0.500 -0.172 0.472 18880
73 1 13 "Average Difference" N 79 2.498 -0.519 2.459 18880
74 1 13 "Average Difference" HA 89 0.254 -0.001 0.256 18880
75 1 13 "Average Difference" C 75 0.727 -0.071 0.728 18880
76 1 13 "Average Difference" CA 82 0.965 -0.166 0.956 18880
77 1 13 "Average Difference" CB 75 1.030 -0.363 0.970 18880
78 1 13 "Average Difference" HN 79 0.463 -0.111 0.452 18880
79 1 14 "Average Difference" N 79 2.451 -0.228 2.456 18880
80 1 14 "Average Difference" HA 89 0.258 0.026 0.259 18880
81 1 14 "Average Difference" C 75 0.878 -0.192 0.862 18880
82 1 14 "Average Difference" CA 82 0.894 -0.217 0.873 18880
83 1 14 "Average Difference" CB 75 0.990 -0.225 0.971 18880
84 1 14 "Average Difference" HN 79 0.513 -0.065 0.512 18880
85 1 15 "Average Difference" N 79 2.252 -0.184 2.259 18880
86 1 15 "Average Difference" HA 89 0.224 0.042 0.222 18880
87 1 15 "Average Difference" C 75 0.803 -0.176 0.788 18880
88 1 15 "Average Difference" CA 82 0.980 -0.186 0.968 18880
89 1 15 "Average Difference" CB 75 1.027 -0.281 0.995 18880
90 1 15 "Average Difference" HN 79 0.537 -0.139 0.522 18880
91 1 16 "Average Difference" N 79 2.745 -0.626 2.689 18880
92 1 16 "Average Difference" HA 89 0.182 0.035 0.180 18880
93 1 16 "Average Difference" C 75 0.904 -0.178 0.892 18880
94 1 16 "Average Difference" CA 82 1.019 -0.219 1.001 18880
95 1 16 "Average Difference" CB 75 0.841 -0.213 0.819 18880
96 1 16 "Average Difference" HN 79 0.464 -0.151 0.442 18880
97 1 17 "Average Difference" N 79 2.267 -0.191 2.274 18880
98 1 17 "Average Difference" HA 89 0.225 0.004 0.226 18880
99 1 17 "Average Difference" C 75 0.815 -0.126 0.811 18880
100 1 17 "Average Difference" CA 82 0.878 -0.141 0.872 18880
101 1 17 "Average Difference" CB 75 0.888 -0.361 0.817 18880
102 1 17 "Average Difference" HN 79 0.539 -0.170 0.515 18880
103 1 18 "Average Difference" N 79 2.626 -0.038 2.642 18880
104 1 18 "Average Difference" HA 89 0.273 0.019 0.274 18880
105 1 18 "Average Difference" C 75 0.776 -0.162 0.764 18880
106 1 18 "Average Difference" CA 82 1.020 -0.176 1.011 18880
107 1 18 "Average Difference" CB 75 0.923 -0.205 0.906 18880
108 1 18 "Average Difference" HN 79 0.567 -0.159 0.548 18880
109 1 19 "Average Difference" N 79 1.983 -0.088 1.994 18880
110 1 19 "Average Difference" HA 89 0.231 0.009 0.232 18880
111 1 19 "Average Difference" C 75 0.867 -0.189 0.852 18880
112 1 19 "Average Difference" CA 82 1.011 -0.225 0.992 18880
113 1 19 "Average Difference" CB 75 0.930 -0.256 0.900 18880
114 1 19 "Average Difference" HN 79 0.518 -0.141 0.501 18880
115 1 20 "Average Difference" N 79 2.260 -0.201 2.265 18880
116 1 20 "Average Difference" HA 89 0.265 0.046 0.263 18880
117 1 20 "Average Difference" C 75 0.783 -0.186 0.766 18880
118 1 20 "Average Difference" CA 82 0.897 -0.142 0.891 18880
119 1 20 "Average Difference" CB 75 0.807 -0.153 0.797 18880
120 1 20 "Average Difference" HN 79 0.490 -0.097 0.484 18880
121 1 21 "Average Difference" N 79 2.305 -0.140 2.315 18880
122 1 21 "Average Difference" HA 89 0.286 0.035 0.285 18880
123 1 21 "Average Difference" C 75 0.914 -0.205 0.896 18880
124 1 21 "Average Difference" CA 82 0.924 -0.258 0.893 18880
125 1 21 "Average Difference" CB 75 0.812 -0.190 0.794 18880
126 1 21 "Average Difference" HN 79 0.462 -0.106 0.452 18880
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 18880
_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 10 10 HIS C C 10 176.040 176.040 174.861 1.179 18880
2 1 . 1 1 11 11 SER N N 11 116.840 116.840 115.813 1.027 18880
3 1 . 1 1 11 11 SER HA H 11 4.430 4.430 4.464 -0.034 18880
4 1 . 1 1 11 11 SER C C 11 174.630 174.630 174.124 0.506 18880
5 1 . 1 1 11 11 SER CA C 11 58.350 58.350 58.565 -0.215 18880
6 1 . 1 1 11 11 SER CB C 11 64.120 64.120 63.791 0.329 18880
7 1 . 1 1 11 11 SER H H 11 8.360 8.360 8.293 0.067 18880
8 1 . 1 1 12 12 SER N N 12 118.030 118.030 117.696 0.334 18880
9 1 . 1 1 12 12 SER HA H 12 4.440 4.440 4.502 -0.062 18880
10 1 . 1 1 12 12 SER C C 12 174.880 174.880 174.429 0.451 18880
11 1 . 1 1 12 12 SER CA C 12 58.680 58.680 58.469 0.211 18880
12 1 . 1 1 12 12 SER CB C 12 63.890 63.890 63.792 0.098 18880
13 1 . 1 1 12 12 SER H H 12 8.490 8.490 8.236 0.254 18880
14 1 . 1 1 13 13 GLY N N 13 110.450 110.450 110.858 -0.408 18880
15 1 . 1 1 13 13 GLY C C 13 173.790 173.790 174.008 -0.218 18880
16 1 . 1 1 13 13 GLY CA C 13 45.460 45.460 45.079 0.381 18880
17 1 . 1 1 13 13 GLY H H 13 8.390 8.390 8.326 0.064 18880
18 1 . 1 1 14 14 LEU N N 14 121.310 121.310 121.852 -0.542 18880
19 1 . 1 1 14 14 LEU HA H 14 4.340 4.340 4.474 -0.134 18880
20 1 . 1 1 14 14 LEU C C 14 176.930 176.930 176.430 0.500 18880
21 1 . 1 1 14 14 LEU CA C 14 55.200 55.200 55.292 -0.092 18880
22 1 . 1 1 14 14 LEU CB C 14 42.600 42.600 42.227 0.372 18880
23 1 . 1 1 14 14 LEU H H 14 8.020 8.020 8.126 -0.106 18880
24 1 . 1 1 15 15 VAL N N 15 121.550 121.550 118.237 3.313 18880
25 1 . 1 1 15 15 VAL HA H 15 4.370 4.370 4.314 0.056 18880
26 1 . 1 1 15 15 VAL CA C 15 59.720 59.720 60.543 -0.823 18880
27 1 . 1 1 15 15 VAL CB C 15 32.770 32.770 31.774 0.996 18880
28 1 . 1 1 15 15 VAL H H 15 8.030 8.030 7.842 0.188 18880
29 1 . 1 1 16 16 PRO HA H 16 4.370 4.370 4.374 -0.004 18880
30 1 . 1 1 16 16 PRO C C 16 176.720 176.720 176.657 0.063 18880
31 1 . 1 1 16 16 PRO CA C 16 62.650 62.650 63.826 -1.176 18880
32 1 . 1 1 16 16 PRO CB C 16 32.240 32.240 32.111 0.129 18880
33 1 . 1 1 17 17 ARG N N 17 121.890 121.890 118.903 2.987 18880
34 1 . 1 1 17 17 ARG HA H 17 4.280 4.280 4.274 0.006 18880
35 1 . 1 1 17 17 ARG C C 17 176.940 176.940 176.416 0.524 18880
36 1 . 1 1 17 17 ARG CA C 17 56.360 56.360 56.299 0.061 18880
37 1 . 1 1 17 17 ARG CB C 17 31.050 31.050 30.530 0.520 18880
38 1 . 1 1 17 17 ARG H H 17 8.450 8.450 8.211 0.239 18880
39 1 . 1 1 18 18 GLY N N 18 110.160 110.160 109.919 0.241 18880
40 1 . 1 1 18 18 GLY C C 18 174.110 174.110 174.056 0.054 18880
41 1 . 1 1 18 18 GLY CA C 18 45.390 45.390 45.007 0.383 18880
42 1 . 1 1 18 18 GLY H H 18 8.480 8.480 8.349 0.131 18880
43 1 . 1 1 19 19 SER N N 19 115.500 115.500 115.778 -0.278 18880
44 1 . 1 1 19 19 SER HA H 19 4.400 4.400 4.479 -0.079 18880
45 1 . 1 1 19 19 SER C C 19 174.380 174.380 174.052 0.328 18880
46 1 . 1 1 19 19 SER CA C 19 58.610 58.610 58.210 0.400 18880
47 1 . 1 1 19 19 SER CB C 19 63.830 63.830 63.719 0.111 18880
48 1 . 1 1 19 19 SER H H 19 8.210 8.210 8.137 0.073 18880
49 1 . 1 1 20 20 HIS N N 20 120.770 120.770 120.829 -0.059 18880
50 1 . 1 1 20 20 HIS HA H 20 4.610 4.610 4.614 -0.004 18880
51 1 . 1 1 20 20 HIS C C 20 174.870 174.870 174.871 -0.001 18880
52 1 . 1 1 20 20 HIS CA C 20 56.130 56.130 56.454 -0.324 18880
53 1 . 1 1 20 20 HIS CB C 20 29.710 29.710 30.183 -0.474 18880
54 1 . 1 1 20 20 HIS H H 20 8.590 8.590 8.418 0.172 18880
55 1 . 1 1 21 21 MET N N 21 121.440 121.440 119.856 1.584 18880
56 1 . 1 1 21 21 MET HA H 21 4.470 4.470 4.591 -0.121 18880
57 1 . 1 1 21 21 MET C C 21 176.030 176.030 176.218 -0.188 18880
58 1 . 1 1 21 21 MET CA C 21 55.490 55.490 55.634 -0.144 18880
59 1 . 1 1 21 21 MET CB C 21 33.170 33.170 33.107 0.063 18880
60 1 . 1 1 21 21 MET H H 21 8.310 8.310 8.167 0.143 18880
61 1 . 1 1 22 22 SER N N 22 116.860 116.860 116.359 0.501 18880
62 1 . 1 1 22 22 SER HA H 22 4.430 4.430 4.561 -0.131 18880
63 1 . 1 1 22 22 SER C C 22 174.630 174.630 174.958 -0.328 18880
64 1 . 1 1 22 22 SER CA C 22 58.410 58.410 58.825 -0.415 18880
65 1 . 1 1 22 22 SER CB C 22 64.030 64.030 63.448 0.582 18880
66 1 . 1 1 22 22 SER H H 22 8.340 8.340 8.479 -0.139 18880
67 1 . 1 1 23 23 ASP N N 23 122.660 122.660 121.947 0.713 18880
68 1 . 1 1 23 23 ASP HA H 23 4.550 4.550 4.614 -0.064 18880
69 1 . 1 1 23 23 ASP C C 23 176.860 176.860 177.482 -0.622 18880
70 1 . 1 1 23 23 ASP CA C 23 55.330 55.330 55.751 -0.421 18880
71 1 . 1 1 23 23 ASP CB C 23 41.000 41.000 40.659 0.341 18880
72 1 . 1 1 23 23 ASP H H 23 8.540 8.540 8.431 0.109 18880
73 1 . 1 1 24 24 GLU N N 24 120.400 120.400 118.818 1.582 18880
74 1 . 1 1 24 24 GLU HA H 24 4.140 4.140 4.114 0.026 18880
75 1 . 1 1 24 24 GLU C C 24 177.540 177.540 177.404 0.136 18880
76 1 . 1 1 24 24 GLU CA C 24 58.360 58.360 58.491 -0.131 18880
77 1 . 1 1 24 24 GLU CB C 24 29.750 29.750 29.366 0.384 18880
78 1 . 1 1 24 24 GLU H H 24 8.610 8.610 8.193 0.417 18880
79 1 . 1 1 25 25 LYS N N 25 120.390 120.390 117.927 2.463 18880
80 1 . 1 1 25 25 LYS HA H 25 4.190 4.190 4.276 -0.086 18880
81 1 . 1 1 25 25 LYS C C 25 177.490 177.490 178.290 -0.800 18880
82 1 . 1 1 25 25 LYS CA C 25 58.110 58.110 58.098 0.012 18880
83 1 . 1 1 25 25 LYS CB C 25 32.490 32.490 32.850 -0.360 18880
84 1 . 1 1 25 25 LYS H H 25 8.210 8.210 7.730 0.480 18880
85 1 . 1 1 26 26 THR N N 26 114.880 114.880 115.873 -0.993 18880
86 1 . 1 1 26 26 THR HA H 26 4.040 4.040 4.096 -0.056 18880
87 1 . 1 1 26 26 THR C C 26 175.430 175.430 176.877 -1.447 18880
88 1 . 1 1 26 26 THR CA C 26 64.620 64.620 65.793 -1.173 18880
89 1 . 1 1 26 26 THR CB C 26 69.110 69.110 68.530 0.581 18880
90 1 . 1 1 26 26 THR H H 26 8.080 8.080 7.535 0.545 18880
91 1 . 1 1 27 27 GLN N N 27 120.940 120.940 121.372 -0.432 18880
92 1 . 1 1 27 27 GLN HA H 27 4.190 4.190 4.102 0.088 18880
93 1 . 1 1 27 27 GLN C C 27 177.280 177.280 177.433 -0.153 18880
94 1 . 1 1 27 27 GLN CA C 27 57.550 57.550 58.561 -1.011 18880
95 1 . 1 1 27 27 GLN CB C 27 29.090 29.090 28.450 0.640 18880
96 1 . 1 1 27 27 GLN H H 27 8.240 8.240 7.905 0.335 18880
97 1 . 1 1 28 28 LEU N N 28 121.860 121.860 118.838 3.022 18880
98 1 . 1 1 28 28 LEU HA H 28 4.170 4.170 4.373 -0.203 18880
99 1 . 1 1 28 28 LEU C C 28 177.750 177.750 177.799 -0.049 18880
100 1 . 1 1 28 28 LEU CA C 28 57.080 57.080 55.539 1.541 18880
101 1 . 1 1 28 28 LEU CB C 28 42.270 42.270 42.459 -0.189 18880
102 1 . 1 1 28 28 LEU H H 28 7.950 7.950 7.609 0.341 18880
103 1 . 1 1 29 29 ILE N N 29 119.260 119.260 119.108 0.152 18880
104 1 . 1 1 29 29 ILE HA H 29 3.900 3.900 3.987 -0.087 18880
105 1 . 1 1 29 29 ILE C C 29 177.140 177.140 177.587 -0.447 18880
106 1 . 1 1 29 29 ILE CA C 29 63.300 63.300 63.427 -0.127 18880
107 1 . 1 1 29 29 ILE CB C 29 38.280 38.280 36.911 1.369 18880
108 1 . 1 1 29 29 ILE H H 29 7.950 7.950 7.887 0.063 18880
109 1 . 1 1 30 30 GLU N N 30 120.500 120.500 119.247 1.253 18880
110 1 . 1 1 30 30 GLU HA H 30 4.050 4.050 4.352 -0.302 18880
111 1 . 1 1 30 30 GLU C C 30 177.560 177.560 176.595 0.965 18880
112 1 . 1 1 30 30 GLU CA C 30 58.090 58.090 57.796 0.294 18880
113 1 . 1 1 30 30 GLU CB C 30 29.590 29.590 29.066 0.524 18880
114 1 . 1 1 30 30 GLU H H 30 8.220 8.220 8.055 0.165 18880
115 1 . 1 1 31 31 ALA N N 31 121.550 121.550 120.618 0.932 18880
116 1 . 1 1 31 31 ALA HA H 31 4.150 4.150 4.436 -0.286 18880
117 1 . 1 1 31 31 ALA C C 31 178.550 178.550 178.857 -0.307 18880
118 1 . 1 1 31 31 ALA CA C 31 53.800 53.800 53.847 -0.047 18880
119 1 . 1 1 31 31 ALA CB C 31 18.630 18.630 19.331 -0.701 18880
120 1 . 1 1 31 31 ALA H H 31 7.890 7.890 7.678 0.212 18880
121 1 . 1 1 32 32 PHE N N 32 117.240 117.240 118.012 -0.772 18880
122 1 . 1 1 32 32 PHE HA H 32 4.300 4.300 4.225 0.075 18880
123 1 . 1 1 32 32 PHE C C 32 176.210 176.210 176.699 -0.489 18880
124 1 . 1 1 32 32 PHE CA C 32 59.340 59.340 60.998 -1.658 18880
125 1 . 1 1 32 32 PHE CB C 32 39.750 39.750 38.930 0.820 18880
126 1 . 1 1 32 32 PHE H H 32 7.930 7.930 7.666 0.264 18880
127 1 . 1 1 33 33 TYR N N 33 119.050 119.050 116.038 3.012 18880
128 1 . 1 1 33 33 TYR HA H 33 4.330 4.330 4.666 -0.336 18880
129 1 . 1 1 33 33 TYR C C 33 175.680 175.680 175.472 0.208 18880
130 1 . 1 1 33 33 TYR CA C 33 58.920 58.920 57.866 1.054 18880
131 1 . 1 1 33 33 TYR CB C 33 38.540 38.540 37.164 1.376 18880
132 1 . 1 1 33 33 TYR H H 33 7.950 7.950 8.184 -0.234 18880
133 1 . 1 1 34 34 ASN N N 34 118.390 118.390 118.405 -0.015 18880
134 1 . 1 1 34 34 ASN HA H 34 4.630 4.630 4.837 -0.207 18880
135 1 . 1 1 34 34 ASN C C 34 174.810 174.810 173.968 0.842 18880
136 1 . 1 1 34 34 ASN CA C 34 53.150 53.150 53.632 -0.482 18880
137 1 . 1 1 34 34 ASN CB C 34 38.980 38.980 39.591 -0.611 18880
138 1 . 1 1 34 34 ASN H H 34 7.960 7.960 7.944 0.016 18880
139 1 . 1 1 35 35 PHE N N 35 120.670 120.670 119.836 0.834 18880
140 1 . 1 1 35 35 PHE HA H 35 4.450 4.450 4.552 -0.102 18880
141 1 . 1 1 35 35 PHE C C 35 175.310 175.310 173.322 1.988 18880
142 1 . 1 1 35 35 PHE CA C 35 58.320 58.320 58.135 0.185 18880
143 1 . 1 1 35 35 PHE CB C 35 39.420 39.420 39.924 -0.504 18880
144 1 . 1 1 35 35 PHE H H 35 7.830 7.830 7.927 -0.097 18880
145 1 . 1 1 36 36 ASP N N 36 122.400 122.400 121.605 0.795 18880
146 1 . 1 1 36 36 ASP HA H 36 4.590 4.590 4.577 0.013 18880
147 1 . 1 1 36 36 ASP C C 36 176.150 176.150 176.186 -0.036 18880
148 1 . 1 1 36 36 ASP CA C 36 54.070 54.070 53.975 0.095 18880
149 1 . 1 1 36 36 ASP CB C 36 41.320 41.320 40.826 0.494 18880
150 1 . 1 1 36 36 ASP H H 36 8.180 8.180 8.204 -0.024 18880
151 1 . 1 1 37 37 GLY N N 37 108.560 108.560 108.066 0.494 18880
152 1 . 1 1 37 37 GLY C C 37 173.660 173.660 174.250 -0.590 18880
153 1 . 1 1 37 37 GLY CA C 37 45.610 45.610 45.536 0.074 18880
154 1 . 1 1 37 37 GLY H H 37 7.680 7.680 8.095 -0.415 18880
155 1 . 1 1 38 38 ASP N N 38 120.010 120.010 118.262 1.748 18880
156 1 . 1 1 38 38 ASP HA H 38 4.600 4.600 4.499 0.101 18880
157 1 . 1 1 38 38 ASP CA C 38 54.260 54.260 54.236 0.024 18880
158 1 . 1 1 38 38 ASP CB C 38 41.450 41.450 40.387 1.063 18880
159 1 . 1 1 38 38 ASP H H 38 8.220 8.220 8.109 0.111 18880
160 1 . 1 1 39 39 TYR N N 39 121.030 121.030 119.412 1.618 18880
161 1 . 1 1 39 39 TYR HA H 39 4.390 4.390 4.299 0.091 18880
162 1 . 1 1 39 39 TYR C C 39 175.290 175.290 175.079 0.211 18880
163 1 . 1 1 39 39 TYR CA C 39 58.200 58.200 58.500 -0.300 18880
164 1 . 1 1 39 39 TYR CB C 39 39.170 39.170 38.744 0.426 18880
165 1 . 1 1 39 39 TYR H H 39 8.090 8.090 7.960 0.130 18880
166 1 . 1 1 40 40 ASP N N 40 122.020 122.020 120.709 1.311 18880
167 1 . 1 1 40 40 ASP HA H 40 4.600 4.600 4.550 0.050 18880
168 1 . 1 1 40 40 ASP C C 40 175.970 175.970 176.037 -0.067 18880
169 1 . 1 1 40 40 ASP CA C 40 54.220 54.220 54.047 0.173 18880
170 1 . 1 1 40 40 ASP CB C 40 41.520 41.520 41.797 -0.277 18880
171 1 . 1 1 40 40 ASP H H 40 8.200 8.200 8.160 0.040 18880
172 1 . 1 1 41 41 GLY N N 41 108.330 108.330 107.057 1.273 18880
173 1 . 1 1 41 41 GLY C C 41 173.000 173.000 172.997 0.003 18880
174 1 . 1 1 41 41 GLY CA C 41 45.420 45.420 44.762 0.658 18880
175 1 . 1 1 41 41 GLY H H 41 7.830 7.830 8.206 -0.376 18880
176 1 . 1 1 42 42 PHE N N 42 118.600 118.600 119.922 -1.322 18880
177 1 . 1 1 42 42 PHE HA H 42 5.260 5.260 4.740 0.520 18880
178 1 . 1 1 42 42 PHE C C 42 175.660 175.660 174.356 1.304 18880
179 1 . 1 1 42 42 PHE CA C 42 57.160 57.160 57.998 -0.838 18880
180 1 . 1 1 42 42 PHE CB C 42 41.170 41.170 41.278 -0.108 18880
181 1 . 1 1 42 42 PHE H H 42 8.150 8.150 7.568 0.582 18880
182 1 . 1 1 43 43 VAL N N 43 119.180 119.180 125.608 -6.428 18880
183 1 . 1 1 43 43 VAL HA H 43 4.670 4.670 4.473 0.197 18880
184 1 . 1 1 43 43 VAL C C 43 175.110 175.110 174.165 0.945 18880
185 1 . 1 1 43 43 VAL CA C 43 60.620 60.620 60.151 0.469 18880
186 1 . 1 1 43 43 VAL CB C 43 32.880 32.880 35.018 -2.138 18880
187 1 . 1 1 43 43 VAL H H 43 9.070 9.070 8.433 0.637 18880
188 1 . 1 1 44 44 SER N N 44 121.380 121.380 122.670 -1.290 18880
189 1 . 1 1 44 44 SER HA H 44 4.570 4.570 4.380 0.190 18880
190 1 . 1 1 44 44 SER C C 44 175.660 175.660 175.351 0.309 18880
191 1 . 1 1 44 44 SER CA C 44 57.720 57.720 57.533 0.187 18880
192 1 . 1 1 44 44 SER CB C 44 63.690 63.690 63.781 -0.091 18880
193 1 . 1 1 44 44 SER H H 44 9.140 9.140 8.477 0.663 18880
194 1 . 1 1 45 45 VAL N N 45 122.720 122.720 123.424 -0.704 18880
195 1 . 1 1 45 45 VAL HA H 45 3.500 3.500 3.278 0.222 18880
196 1 . 1 1 45 45 VAL C C 45 177.240 177.240 177.400 -0.160 18880
197 1 . 1 1 45 45 VAL CA C 45 66.270 66.270 66.655 -0.385 18880
198 1 . 1 1 45 45 VAL CB C 45 31.450 31.450 30.915 0.535 18880
199 1 . 1 1 45 45 VAL H H 45 8.140 8.140 8.414 -0.274 18880
200 1 . 1 1 46 46 GLU N N 46 118.990 118.990 118.365 0.625 18880
201 1 . 1 1 46 46 GLU HA H 46 3.980 3.980 3.828 0.152 18880
202 1 . 1 1 46 46 GLU C C 46 179.460 179.460 179.027 0.433 18880
203 1 . 1 1 46 46 GLU CA C 46 59.560 59.560 59.484 0.077 18880
204 1 . 1 1 46 46 GLU CB C 46 29.160 29.160 28.947 0.213 18880
205 1 . 1 1 46 46 GLU H H 46 8.230 8.230 7.539 0.691 18880
206 1 . 1 1 47 47 GLU N N 47 120.120 120.120 118.530 1.590 18880
207 1 . 1 1 47 47 GLU HA H 47 4.080 4.080 4.178 -0.098 18880
208 1 . 1 1 47 47 GLU C C 47 179.170 179.170 178.689 0.481 18880
209 1 . 1 1 47 47 GLU CA C 47 58.890 58.890 58.098 0.792 18880
210 1 . 1 1 47 47 GLU CB C 47 29.820 29.820 29.563 0.257 18880
211 1 . 1 1 47 47 GLU H H 47 7.880 7.880 7.713 0.167 18880
212 1 . 1 1 48 48 PHE N N 48 120.830 120.830 120.832 -0.002 18880
213 1 . 1 1 48 48 PHE HA H 48 4.190 4.190 4.191 -0.001 18880
214 1 . 1 1 48 48 PHE C C 48 176.920 176.920 177.558 -0.638 18880
215 1 . 1 1 48 48 PHE CA C 48 60.870 60.870 60.521 0.349 18880
216 1 . 1 1 48 48 PHE CB C 48 39.260 39.260 39.000 0.260 18880
217 1 . 1 1 48 48 PHE H H 48 8.600 8.600 8.211 0.389 18880
218 1 . 1 1 49 49 ARG N N 49 118.470 118.470 119.269 -0.799 18880
219 1 . 1 1 49 49 ARG HA H 49 3.860 3.860 4.108 -0.248 18880
220 1 . 1 1 49 49 ARG C C 49 178.090 178.090 178.719 -0.629 18880
221 1 . 1 1 49 49 ARG CA C 49 60.070 60.070 60.276 -0.206 18880
222 1 . 1 1 49 49 ARG CB C 49 30.140 30.140 29.770 0.370 18880
223 1 . 1 1 49 49 ARG H H 49 8.650 8.650 8.621 0.029 18880
224 1 . 1 1 50 50 GLY N N 50 105.080 105.080 105.741 -0.661 18880
225 1 . 1 1 50 50 GLY C C 50 175.090 175.090 175.905 -0.815 18880
226 1 . 1 1 50 50 GLY CA C 50 46.680 46.680 46.866 -0.186 18880
227 1 . 1 1 50 50 GLY H H 50 7.620 7.620 8.154 -0.534 18880
228 1 . 1 1 51 51 ILE N N 51 121.440 121.440 121.245 0.195 18880
229 1 . 1 1 51 51 ILE HA H 51 3.830 3.830 3.937 -0.107 18880
230 1 . 1 1 51 51 ILE C C 51 178.300 178.300 177.241 1.059 18880
231 1 . 1 1 51 51 ILE CA C 51 63.840 63.840 63.918 -0.078 18880
232 1 . 1 1 51 51 ILE CB C 51 38.310 38.310 38.410 -0.100 18880
233 1 . 1 1 51 51 ILE H H 51 7.470 7.470 7.298 0.172 18880
234 1 . 1 1 52 52 ILE N N 52 118.930 118.930 119.572 -0.642 18880
235 1 . 1 1 52 52 ILE HA H 52 3.740 3.740 3.854 -0.114 18880
236 1 . 1 1 52 52 ILE CA C 52 63.760 63.760 63.099 0.661 18880
237 1 . 1 1 52 52 ILE CB C 52 38.030 38.030 36.917 1.113 18880
238 1 . 1 1 52 52 ILE H H 52 7.790 7.790 8.302 -0.512 18880
239 1 . 1 1 53 53 ARG N N 53 120.140 120.140 119.657 0.483 18880
240 1 . 1 1 53 53 ARG HA H 53 4.090 4.090 4.010 0.080 18880
241 1 . 1 1 53 53 ARG C C 53 177.380 177.380 177.207 0.173 18880
242 1 . 1 1 53 53 ARG CA C 53 60.110 60.110 59.366 0.744 18880
243 1 . 1 1 53 53 ARG CB C 53 29.580 29.580 30.412 -0.832 18880
244 1 . 1 1 53 53 ARG H H 53 7.930 7.930 8.330 -0.400 18880
245 1 . 1 1 54 54 ASP N N 54 117.500 117.500 116.159 1.341 18880
246 1 . 1 1 54 54 ASP HA H 54 4.600 4.600 4.794 -0.194 18880
247 1 . 1 1 54 54 ASP C C 54 176.930 176.930 176.154 0.776 18880
248 1 . 1 1 54 54 ASP CA C 54 55.540 55.540 54.043 1.497 18880
249 1 . 1 1 54 54 ASP CB C 54 41.100 41.100 41.280 -0.180 18880
250 1 . 1 1 54 54 ASP H H 54 7.870 7.870 7.966 -0.096 18880
251 1 . 1 1 55 55 GLY N N 55 106.370 106.370 108.103 -1.733 18880
252 1 . 1 1 55 55 GLY C C 55 173.460 173.460 173.853 -0.393 18880
253 1 . 1 1 55 55 GLY CA C 55 46.000 46.000 45.423 0.577 18880
254 1 . 1 1 55 55 GLY H H 55 7.880 7.880 7.710 0.170 18880
255 1 . 1 1 56 56 LEU N N 56 122.630 122.630 122.206 0.424 18880
256 1 . 1 1 56 56 LEU HA H 56 4.770 4.770 4.821 -0.051 18880
257 1 . 1 1 56 56 LEU CA C 56 52.490 52.490 51.633 0.857 18880
258 1 . 1 1 56 56 LEU CB C 56 43.120 43.120 42.835 0.285 18880
259 1 . 1 1 56 56 LEU H H 56 8.220 8.220 7.854 0.366 18880
260 1 . 1 1 57 57 PRO HA H 57 4.580 4.580 4.483 0.097 18880
261 1 . 1 1 57 57 PRO C C 57 176.150 176.150 175.634 0.516 18880
262 1 . 1 1 57 57 PRO CA C 57 62.420 62.420 62.908 -0.488 18880
263 1 . 1 1 57 57 PRO CB C 57 30.740 30.740 30.990 -0.250 18880
264 1 . 1 1 58 58 MET N N 58 121.810 121.810 123.350 -1.540 18880
265 1 . 1 1 58 58 MET HA H 58 4.630 4.630 4.608 0.022 18880
266 1 . 1 1 58 58 MET C C 58 176.150 176.150 175.095 1.055 18880
267 1 . 1 1 58 58 MET CA C 58 55.560 55.560 54.692 0.868 18880
268 1 . 1 1 58 58 MET CB C 58 36.820 36.820 36.050 0.770 18880
269 1 . 1 1 58 58 MET H H 58 7.690 7.690 7.992 -0.302 18880
270 1 . 1 1 59 59 THR N N 59 114.180 114.180 115.434 -1.254 18880
271 1 . 1 1 59 59 THR HA H 59 4.450 4.450 4.475 -0.025 18880
272 1 . 1 1 59 59 THR C C 59 175.170 175.170 175.817 -0.647 18880
273 1 . 1 1 59 59 THR CA C 59 60.780 60.780 60.865 -0.085 18880
274 1 . 1 1 59 59 THR CB C 59 71.060 71.060 69.820 1.240 18880
275 1 . 1 1 59 59 THR H H 59 8.940 8.940 8.466 0.474 18880
276 1 . 1 1 60 60 GLU N N 60 120.620 120.620 125.822 -5.202 18880
277 1 . 1 1 60 60 GLU HA H 60 4.010 4.010 3.736 0.274 18880
278 1 . 1 1 60 60 GLU C C 60 179.010 179.010 178.060 0.950 18880
279 1 . 1 1 60 60 GLU CA C 60 59.820 59.820 59.711 0.109 18880
280 1 . 1 1 60 60 GLU CB C 60 29.050 29.050 28.637 0.413 18880
281 1 . 1 1 60 60 GLU H H 60 8.850 8.850 8.950 -0.100 18880
282 1 . 1 1 61 61 ALA N N 61 121.080 121.080 122.391 -1.311 18880
283 1 . 1 1 61 61 ALA HA H 61 4.140 4.140 3.951 0.189 18880
284 1 . 1 1 61 61 ALA C C 61 180.350 180.350 179.752 0.598 18880
285 1 . 1 1 61 61 ALA CA C 61 55.090 55.090 55.044 0.046 18880
286 1 . 1 1 61 61 ALA CB C 61 18.210 18.210 17.898 0.312 18880
287 1 . 1 1 61 61 ALA H H 61 8.370 8.370 8.403 -0.033 18880
288 1 . 1 1 62 62 GLU N N 62 118.890 118.890 118.538 0.352 18880
289 1 . 1 1 62 62 GLU HA H 62 4.000 4.000 3.598 0.402 18880
290 1 . 1 1 62 62 GLU C C 62 179.690 179.690 178.580 1.110 18880
291 1 . 1 1 62 62 GLU CA C 62 58.990 58.990 58.239 0.751 18880
292 1 . 1 1 62 62 GLU CB C 62 30.310 30.310 28.919 1.391 18880
293 1 . 1 1 62 62 GLU H H 62 7.680 7.680 7.749 -0.069 18880
294 1 . 1 1 63 63 ILE N N 63 122.340 122.340 119.772 2.568 18880
295 1 . 1 1 63 63 ILE HA H 63 3.570 3.570 3.330 0.240 18880
296 1 . 1 1 63 63 ILE C C 63 177.260 177.260 178.212 -0.952 18880
297 1 . 1 1 63 63 ILE CA C 63 65.890 65.890 64.602 1.288 18880
298 1 . 1 1 63 63 ILE CB C 63 37.980 37.980 37.083 0.897 18880
299 1 . 1 1 63 63 ILE H H 63 8.420 8.420 7.697 0.723 18880
300 1 . 1 1 64 64 THR N N 64 116.970 116.970 116.156 0.814 18880
301 1 . 1 1 64 64 THR HA H 64 3.940 3.940 4.011 -0.071 18880
302 1 . 1 1 64 64 THR C C 64 176.520 176.520 176.754 -0.234 18880
303 1 . 1 1 64 64 THR CA C 64 67.060 67.060 67.461 -0.401 18880
304 1 . 1 1 64 64 THR CB C 64 68.750 68.750 68.345 0.405 18880
305 1 . 1 1 64 64 THR H H 64 8.310 8.310 8.506 -0.196 18880
306 1 . 1 1 65 65 GLU N N 65 120.760 120.760 120.075 0.685 18880
307 1 . 1 1 65 65 GLU HA H 65 4.030 4.030 4.181 -0.151 18880
308 1 . 1 1 65 65 GLU C C 65 175.830 175.830 178.648 -2.818 18880
309 1 . 1 1 65 65 GLU CA C 65 59.500 59.500 58.914 0.586 18880
310 1 . 1 1 65 65 GLU CB C 65 29.770 29.770 29.439 0.331 18880
311 1 . 1 1 65 65 GLU H H 65 7.970 7.970 8.409 -0.439 18880
312 1 . 1 1 66 66 PHE N N 66 120.940 120.940 117.999 2.941 18880
313 1 . 1 1 66 66 PHE HA H 66 4.240 4.240 4.421 -0.181 18880
314 1 . 1 1 66 66 PHE C C 66 177.330 177.330 177.056 0.274 18880
315 1 . 1 1 66 66 PHE CA C 66 61.200 61.200 58.546 2.654 18880
316 1 . 1 1 66 66 PHE CB C 66 38.530 38.530 39.072 -0.542 18880
317 1 . 1 1 66 66 PHE H H 66 8.100 8.100 7.757 0.343 18880
318 1 . 1 1 67 67 PHE N N 67 118.110 118.110 119.269 -1.159 18880
319 1 . 1 1 67 67 PHE HA H 67 3.950 3.950 4.384 -0.434 18880
320 1 . 1 1 67 67 PHE C C 67 178.090 178.090 177.747 0.343 18880
321 1 . 1 1 67 67 PHE CA C 67 61.200 61.200 59.519 1.681 18880
322 1 . 1 1 67 67 PHE CB C 67 38.250 38.250 38.746 -0.496 18880
323 1 . 1 1 67 67 PHE H H 67 8.380 8.380 8.593 -0.213 18880
324 1 . 1 1 68 68 GLU N N 68 119.650 119.650 117.882 1.768 18880
325 1 . 1 1 68 68 GLU HA H 68 4.010 4.010 4.393 -0.383 18880
326 1 . 1 1 68 68 GLU C C 68 177.910 177.910 177.130 0.780 18880
327 1 . 1 1 68 68 GLU CA C 68 59.240 59.240 57.988 1.252 18880
328 1 . 1 1 68 68 GLU CB C 68 29.370 29.370 29.725 -0.355 18880
329 1 . 1 1 68 68 GLU H H 68 8.230 8.230 8.176 0.054 18880
330 1 . 1 1 69 69 ALA N N 69 119.090 119.090 120.668 -1.578 18880
331 1 . 1 1 69 69 ALA HA H 69 4.180 4.180 4.344 -0.164 18880
332 1 . 1 1 69 69 ALA C C 69 179.030 179.030 178.317 0.713 18880
333 1 . 1 1 69 69 ALA CA C 69 53.600 53.600 53.692 -0.092 18880
334 1 . 1 1 69 69 ALA CB C 69 18.780 18.780 18.592 0.188 18880
335 1 . 1 1 69 69 ALA H H 69 7.340 7.340 7.758 -0.418 18880
336 1 . 1 1 70 70 ALA N N 70 118.670 118.670 119.912 -1.242 18880
337 1 . 1 1 70 70 ALA HA H 70 4.020 4.020 4.350 -0.330 18880
338 1 . 1 1 70 70 ALA C C 70 176.820 176.820 176.853 -0.033 18880
339 1 . 1 1 70 70 ALA CA C 70 53.090 53.090 52.604 0.486 18880
340 1 . 1 1 70 70 ALA CB C 70 19.610 19.610 20.316 -0.706 18880
341 1 . 1 1 70 70 ALA H H 70 8.050 8.050 7.768 0.282 18880
342 1 . 1 1 71 71 ASP N N 71 116.780 116.780 118.090 -1.310 18880
343 1 . 1 1 71 71 ASP HA H 71 5.220 5.220 5.135 0.085 18880
344 1 . 1 1 71 71 ASP CA C 71 52.150 52.150 50.613 1.537 18880
345 1 . 1 1 71 71 ASP CB C 71 40.910 40.910 42.755 -1.845 18880
346 1 . 1 1 71 71 ASP H H 71 8.010 8.010 7.586 0.424 18880
347 1 . 1 1 72 72 PRO HA H 72 4.470 4.470 4.403 0.067 18880
348 1 . 1 1 72 72 PRO C C 72 177.970 177.970 177.251 0.719 18880
349 1 . 1 1 72 72 PRO CA C 72 64.910 64.910 64.563 0.347 18880
350 1 . 1 1 72 72 PRO CB C 72 31.880 31.880 32.446 -0.566 18880
351 1 . 1 1 73 73 ASN N N 73 114.930 114.930 116.153 -1.223 18880
352 1 . 1 1 73 73 ASN HA H 73 4.880 4.880 4.606 0.274 18880
353 1 . 1 1 73 73 ASN C C 73 174.880 174.880 174.894 -0.014 18880
354 1 . 1 1 73 73 ASN CA C 73 52.840 52.840 53.621 -0.781 18880
355 1 . 1 1 73 73 ASN CB C 73 38.380 38.380 38.616 -0.236 18880
356 1 . 1 1 73 73 ASN H H 73 9.030 9.030 8.369 0.661 18880
357 1 . 1 1 74 74 ASN N N 74 118.340 118.340 113.024 5.316 18880
358 1 . 1 1 74 74 ASN HA H 74 4.360 4.360 4.582 -0.222 18880
359 1 . 1 1 74 74 ASN CA C 74 54.590 54.590 54.013 0.577 18880
360 1 . 1 1 74 74 ASN CB C 74 37.160 37.160 36.499 0.661 18880
361 1 . 1 1 74 74 ASN H H 74 8.320 8.320 8.406 -0.086 18880
362 1 . 1 1 75 75 THR N N 75 113.450 113.450 113.377 0.073 18880
363 1 . 1 1 75 75 THR HA H 75 4.210 4.210 4.394 -0.184 18880
364 1 . 1 1 75 75 THR CA C 75 63.410 63.410 61.602 1.808 18880
365 1 . 1 1 75 75 THR CB C 75 70.540 70.540 68.586 1.954 18880
366 1 . 1 1 75 75 THR H H 75 9.870 9.870 8.433 1.437 18880
367 1 . 1 1 76 76 GLY N N 76 111.810 111.810 109.041 2.769 18880
368 1 . 1 1 76 76 GLY C C 76 173.670 173.670 173.441 0.229 18880
369 1 . 1 1 76 76 GLY CA C 76 45.120 45.120 45.566 -0.446 18880
370 1 . 1 1 76 76 GLY H H 76 10.250 10.250 8.050 2.200 18880
371 1 . 1 1 77 77 PHE N N 77 120.560 120.560 118.348 2.212 18880
372 1 . 1 1 77 77 PHE HA H 77 5.150 5.150 4.956 0.194 18880
373 1 . 1 1 77 77 PHE CA C 77 57.180 57.180 56.780 0.400 18880
374 1 . 1 1 77 77 PHE CB C 77 43.500 43.500 42.259 1.242 18880
375 1 . 1 1 77 77 PHE H H 77 8.110 8.110 7.604 0.506 18880
376 1 . 1 1 78 78 ILE N N 78 116.410 116.410 121.863 -5.453 18880
377 1 . 1 1 78 78 ILE HA H 78 4.390 4.390 4.251 0.139 18880
378 1 . 1 1 78 78 ILE C C 78 174.770 174.770 174.408 0.362 18880
379 1 . 1 1 78 78 ILE CA C 78 59.190 59.190 59.798 -0.608 18880
380 1 . 1 1 78 78 ILE CB C 78 41.180 41.180 41.073 0.107 18880
381 1 . 1 1 78 78 ILE H H 78 8.930 8.930 7.910 1.020 18880
382 1 . 1 1 79 79 ASP N N 79 125.220 125.220 125.626 -0.406 18880
383 1 . 1 1 79 79 ASP HA H 79 4.500 4.500 4.821 -0.321 18880
384 1 . 1 1 79 79 ASP C C 79 176.490 176.490 176.860 -0.370 18880
385 1 . 1 1 79 79 ASP CA C 79 53.310 53.310 52.994 0.316 18880
386 1 . 1 1 79 79 ASP CB C 79 41.370 41.370 40.609 0.761 18880
387 1 . 1 1 79 79 ASP H H 79 8.610 8.610 8.686 -0.076 18880
388 1 . 1 1 80 80 TYR N N 80 125.760 125.760 128.188 -2.428 18880
389 1 . 1 1 80 80 TYR HA H 80 3.990 3.990 4.021 -0.031 18880
390 1 . 1 1 80 80 TYR C C 80 177.140 177.140 176.679 0.461 18880
391 1 . 1 1 80 80 TYR CA C 80 61.580 61.580 62.408 -0.828 18880
392 1 . 1 1 80 80 TYR CB C 80 38.890 38.890 38.607 0.283 18880
393 1 . 1 1 80 80 TYR H H 80 8.460 8.460 8.411 0.049 18880
394 1 . 1 1 81 81 LYS N N 81 118.320 118.320 118.270 0.050 18880
395 1 . 1 1 81 81 LYS HA H 81 3.900 3.900 3.935 -0.035 18880
396 1 . 1 1 81 81 LYS C C 81 179.090 179.090 178.607 0.483 18880
397 1 . 1 1 81 81 LYS CA C 81 59.580 59.580 59.599 -0.019 18880
398 1 . 1 1 81 81 LYS CB C 81 31.760 31.760 31.750 0.010 18880
399 1 . 1 1 81 81 LYS H H 81 8.410 8.410 8.339 0.071 18880
400 1 . 1 1 82 82 ALA N N 82 122.050 122.050 121.697 0.353 18880
401 1 . 1 1 82 82 ALA HA H 82 4.130 4.130 4.168 -0.038 18880
402 1 . 1 1 82 82 ALA C C 82 179.740 179.740 179.412 0.328 18880
403 1 . 1 1 82 82 ALA CA C 82 54.520 54.520 54.713 -0.193 18880
404 1 . 1 1 82 82 ALA CB C 82 18.540 18.540 18.314 0.226 18880
405 1 . 1 1 82 82 ALA H H 82 7.770 7.770 8.007 -0.237 18880
406 1 . 1 1 83 83 PHE N N 83 117.810 117.810 116.870 0.940 18880
407 1 . 1 1 83 83 PHE HA H 83 4.290 4.290 4.367 -0.077 18880
408 1 . 1 1 83 83 PHE C C 83 176.460 176.460 176.926 -0.466 18880
409 1 . 1 1 83 83 PHE CA C 83 60.030 60.030 59.767 0.263 18880
410 1 . 1 1 83 83 PHE CB C 83 39.520 39.520 39.953 -0.433 18880
411 1 . 1 1 83 83 PHE H H 83 7.780 7.780 7.782 -0.002 18880
412 1 . 1 1 84 84 ALA N N 84 121.530 121.530 122.058 -0.528 18880
413 1 . 1 1 84 84 ALA HA H 84 3.660 3.660 4.066 -0.406 18880
414 1 . 1 1 84 84 ALA C C 84 179.010 179.010 178.981 0.029 18880
415 1 . 1 1 84 84 ALA CA C 84 55.030 55.030 54.052 0.978 18880
416 1 . 1 1 84 84 ALA CB C 84 18.130 18.130 18.213 -0.083 18880
417 1 . 1 1 84 84 ALA H H 84 8.290 8.290 8.302 -0.012 18880
418 1 . 1 1 85 85 ALA N N 85 117.720 117.720 120.619 -2.899 18880
419 1 . 1 1 85 85 ALA HA H 85 4.080 4.080 4.145 -0.065 18880
420 1 . 1 1 85 85 ALA C C 85 179.570 179.570 178.418 1.152 18880
421 1 . 1 1 85 85 ALA CA C 85 54.370 54.370 54.345 0.025 18880
422 1 . 1 1 85 85 ALA CB C 85 18.290 18.290 18.445 -0.155 18880
423 1 . 1 1 85 85 ALA H H 85 7.700 7.700 8.483 -0.783 18880
424 1 . 1 1 86 86 MET N N 86 116.570 116.570 115.922 0.648 18880
425 1 . 1 1 86 86 MET HA H 86 4.160 4.160 4.168 -0.008 18880
426 1 . 1 1 86 86 MET C C 86 177.360 177.360 177.541 -0.181 18880
427 1 . 1 1 86 86 MET CA C 86 57.380 57.380 57.539 -0.159 18880
428 1 . 1 1 86 86 MET CB C 86 32.720 32.720 32.469 0.251 18880
429 1 . 1 1 86 86 MET H H 86 7.560 7.560 7.489 0.071 18880
430 1 . 1 1 87 87 LEU N N 87 119.090 119.090 116.894 2.196 18880
431 1 . 1 1 87 87 LEU HA H 87 3.970 3.970 4.136 -0.166 18880
432 1 . 1 1 87 87 LEU C C 87 177.420 177.420 176.947 0.473 18880
433 1 . 1 1 87 87 LEU CA C 87 56.290 56.290 55.515 0.775 18880
434 1 . 1 1 87 87 LEU CB C 87 42.280 42.280 42.010 0.270 18880
435 1 . 1 1 87 87 LEU H H 87 7.570 7.570 7.324 0.246 18880
436 1 . 1 1 88 88 TYR N N 88 117.060 117.060 115.209 1.851 18880
437 1 . 1 1 88 88 TYR HA H 88 4.590 4.590 4.716 -0.126 18880
438 1 . 1 1 88 88 TYR C C 88 175.870 175.870 175.202 0.668 18880
439 1 . 1 1 88 88 TYR CA C 88 57.840 57.840 55.259 2.581 18880
440 1 . 1 1 88 88 TYR CB C 88 38.640 38.640 38.011 0.629 18880
441 1 . 1 1 88 88 TYR H H 88 7.740 7.740 7.246 0.494 18880
442 1 . 1 1 89 89 SER N N 89 115.980 115.980 117.925 -1.945 18880
443 1 . 1 1 89 89 SER HA H 89 4.440 4.440 4.456 -0.016 18880
444 1 . 1 1 89 89 SER C C 89 174.460 174.460 174.573 -0.113 18880
445 1 . 1 1 89 89 SER CA C 89 58.350 58.350 59.230 -0.880 18880
446 1 . 1 1 89 89 SER CB C 89 63.990 63.990 62.333 1.657 18880
447 1 . 1 1 89 89 SER H H 89 7.880 7.880 8.037 -0.157 18880
448 1 . 1 1 90 90 VAL N N 90 120.910 120.910 120.212 0.698 18880
449 1 . 1 1 90 90 VAL HA H 90 4.140 4.140 4.188 -0.048 18880
450 1 . 1 1 90 90 VAL C C 90 175.720 175.720 174.663 1.057 18880
451 1 . 1 1 90 90 VAL CA C 90 62.270 62.270 62.192 0.078 18880
452 1 . 1 1 90 90 VAL CB C 90 32.840 32.840 31.727 1.113 18880
453 1 . 1 1 90 90 VAL H H 90 8.020 8.020 7.980 0.040 18880
454 1 . 1 1 91 91 ASP N N 91 123.620 123.620 120.472 3.148 18880
455 1 . 1 1 91 91 ASP HA H 91 4.630 4.630 4.658 -0.028 18880
456 1 . 1 1 91 91 ASP C C 91 176.000 176.000 175.736 0.264 18880
457 1 . 1 1 91 91 ASP CA C 91 54.510 54.510 54.443 0.067 18880
458 1 . 1 1 91 91 ASP CB C 91 41.440 41.440 41.610 -0.170 18880
459 1 . 1 1 91 91 ASP H H 91 8.310 8.310 8.145 0.165 18880
460 1 . 1 1 92 92 GLU N N 92 122.170 122.170 120.707 1.463 18880
461 1 . 1 1 92 92 GLU HA H 92 4.360 4.360 4.408 -0.048 18880
462 1 . 1 1 92 92 GLU C C 92 175.660 175.660 176.314 -0.654 18880
463 1 . 1 1 92 92 GLU CA C 92 56.490 56.490 56.586 -0.096 18880
464 1 . 1 1 92 92 GLU CB C 92 32.850 32.850 30.589 2.261 18880
465 1 . 1 1 92 92 GLU H H 92 8.320 8.320 8.463 -0.143 18880
stop_
save_