data_18533
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18533
_Entry.PDB_ID 2LUO
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 18533
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 MET N N 1 119.850 119.850 124.774 -4.924 18533
2 1 1 . 1 1 2 2 MET HA H 1 4.500 4.500 4.515 -0.015 18533
3 1 1 . 1 1 2 2 MET CA C 1 55.450 55.450 54.785 0.665 18533
4 1 1 . 1 1 2 2 MET CB C 1 33.170 33.170 32.751 0.419 18533
5 1 1 . 1 1 2 2 MET H H 1 8.140 8.140 8.481 -0.341 18533
6 1 1 . 1 1 3 3 SER N N 2 117.000 117.000 119.497 -2.497 18533
7 1 1 . 1 1 3 3 SER HA H 2 4.430 4.430 4.480 -0.050 18533
8 1 1 . 1 1 3 3 SER CA C 2 58.320 58.320 57.936 0.384 18533
9 1 1 . 1 1 3 3 SER CB C 2 63.990 63.990 63.496 0.494 18533
10 1 1 . 1 1 3 3 SER H H 2 8.340 8.340 8.177 0.163 18533
11 1 1 . 1 1 4 4 ASP N N 3 123.200 123.200 127.662 -4.462 18533
12 1 1 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.680 0.180 18533
13 1 1 . 1 1 4 4 ASP CA C 3 52.880 52.880 53.203 -0.323 18533
14 1 1 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.533 0.267 18533
15 1 1 . 1 1 4 4 ASP H H 3 8.260 8.260 8.304 -0.044 18533
16 1 1 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.473 -0.073 18533
17 1 1 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.452 0.368 18533
18 1 1 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.464 -0.554 18533
19 1 1 . 1 1 6 6 LEU N N 5 123.160 123.160 120.799 2.361 18533
20 1 1 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.491 -0.101 18533
21 1 1 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.599 0.681 18533
22 1 1 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.028 1.322 18533
23 1 1 . 1 1 6 6 LEU H H 5 7.670 7.670 7.993 -0.323 18533
24 1 1 . 1 1 7 7 HIS N N 6 127.160 127.160 119.167 7.993 18533
25 1 1 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.139 0.891 18533
26 1 1 . 1 1 7 7 HIS CA C 6 52.900 52.900 54.621 -1.721 18533
27 1 1 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.413 0.717 18533
28 1 1 . 1 1 7 7 HIS H H 6 10.080 10.080 8.643 1.437 18533
29 1 1 . 1 1 8 8 VAL N N 7 128.620 128.620 127.473 1.147 18533
30 1 1 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.829 -0.329 18533
31 1 1 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.635 -0.835 18533
32 1 1 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.846 2.954 18533
33 1 1 . 1 1 8 8 VAL H H 7 8.930 8.930 8.449 0.481 18533
34 1 1 . 1 1 9 9 THR N N 8 121.530 121.530 122.569 -1.039 18533
35 1 1 . 1 1 9 9 THR HA H 8 5.270 5.270 4.737 0.533 18533
36 1 1 . 1 1 9 9 THR CA C 8 58.520 58.520 58.894 -0.374 18533
37 1 1 . 1 1 9 9 THR CB C 8 70.750 70.750 69.461 1.289 18533
38 1 1 . 1 1 9 9 THR H H 8 7.970 7.970 8.916 -0.946 18533
39 1 1 . 1 1 10 10 PHE N N 9 125.360 125.360 128.136 -2.776 18533
40 1 1 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.019 0.191 18533
41 1 1 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.002 0.308 18533
42 1 1 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.476 3.354 18533
43 1 1 . 1 1 10 10 PHE H H 9 8.180 8.180 8.164 0.016 18533
44 1 1 . 1 1 11 11 VAL N N 10 121.120 121.120 122.539 -1.419 18533
45 1 1 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.394 -0.034 18533
46 1 1 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.844 -0.424 18533
47 1 1 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.654 1.896 18533
48 1 1 . 1 1 11 11 VAL H H 10 8.710 8.710 9.272 -0.562 18533
49 1 1 . 1 1 12 12 CYS N N 11 123.270 123.270 125.420 -2.150 18533
50 1 1 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.341 -1.081 18533
51 1 1 . 1 1 12 12 CYS CA C 11 57.630 57.630 55.895 1.735 18533
52 1 1 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.286 -0.936 18533
53 1 1 . 1 1 12 12 CYS H H 11 7.940 7.940 8.472 -0.532 18533
54 1 1 . 1 1 13 13 THR HA H 12 5.010 5.010 4.094 0.916 18533
55 1 1 . 1 1 13 13 THR CA C 12 64.870 64.870 63.484 1.386 18533
56 1 1 . 1 1 13 13 THR CB C 12 69.180 69.180 67.391 1.789 18533
57 1 1 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.261 -0.301 18533
58 1 1 . 1 1 15 15 ASN N N 14 119.960 119.960 116.995 2.965 18533
59 1 1 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.389 -0.459 18533
60 1 1 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.252 0.619 18533
61 1 1 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.255 3.415 18533
62 1 1 . 1 1 15 15 ASN H H 14 9.280 9.280 8.619 0.661 18533
63 1 1 . 1 1 16 16 ILE N N 15 101.060 101.060 109.775 -8.715 18533
64 1 1 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.731 -0.051 18533
65 1 1 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.606 1.183 18533
66 1 1 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.089 3.051 18533
67 1 1 . 1 1 16 16 ILE H H 15 7.100 7.100 7.971 -0.871 18533
68 1 1 . 1 1 17 17 CYS N N 16 116.020 116.020 119.833 -3.813 18533
69 1 1 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.569 0.371 18533
70 1 1 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.970 0.090 18533
71 1 1 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.195 -0.245 18533
72 1 1 . 1 1 17 17 CYS H H 16 7.700 7.700 7.995 -0.295 18533
73 1 1 . 1 1 19 19 SER N N 18 122.340 122.340 114.911 7.429 18533
74 1 1 . 1 1 19 19 SER HA H 18 3.810 3.810 4.248 -0.438 18533
75 1 1 . 1 1 19 19 SER CA C 18 62.710 62.710 63.378 -0.668 18533
76 1 1 . 1 1 19 19 SER CB C 18 64.860 64.860 61.175 3.685 18533
77 1 1 . 1 1 19 19 SER H H 18 11.420 11.420 8.476 2.944 18533
78 1 1 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.260 -0.290 18533
79 1 1 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.899 0.131 18533
80 1 1 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.900 -2.210 18533
81 1 1 . 1 1 21 21 MET N N 20 112.430 112.430 119.077 -6.647 18533
82 1 1 . 1 1 21 21 MET HA H 20 3.730 3.730 3.977 -0.247 18533
83 1 1 . 1 1 21 21 MET CA C 20 60.160 60.160 58.248 1.912 18533
84 1 1 . 1 1 21 21 MET CB C 20 33.040 33.040 31.420 1.620 18533
85 1 1 . 1 1 21 21 MET H H 20 6.310 6.310 7.483 -1.173 18533
86 1 1 . 1 1 22 22 ALA N N 21 117.800 117.800 119.970 -2.170 18533
87 1 1 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.781 -0.381 18533
88 1 1 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.445 0.545 18533
89 1 1 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.684 -1.194 18533
90 1 1 . 1 1 22 22 ALA H H 21 6.550 6.550 7.488 -0.938 18533
91 1 1 . 1 1 23 23 GLU N N 22 115.520 115.520 118.574 -3.054 18533
92 1 1 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.081 -0.401 18533
93 1 1 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.725 -0.175 18533
94 1 1 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.734 0.056 18533
95 1 1 . 1 1 23 23 GLU H H 22 7.800 7.800 7.600 0.200 18533
96 1 1 . 1 1 24 24 LYS N N 23 114.220 114.220 116.229 -2.009 18533
97 1 1 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.126 -0.126 18533
98 1 1 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.004 -0.244 18533
99 1 1 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.358 -1.558 18533
100 1 1 . 1 1 24 24 LYS H H 23 8.040 8.040 7.410 0.630 18533
101 1 1 . 1 1 25 25 MET N N 24 115.250 115.250 119.526 -4.276 18533
102 1 1 . 1 1 25 25 MET HA H 24 3.950 3.950 3.694 0.256 18533
103 1 1 . 1 1 25 25 MET CA C 24 57.980 57.980 58.529 -0.549 18533
104 1 1 . 1 1 25 25 MET CB C 24 35.500 35.500 32.064 3.436 18533
105 1 1 . 1 1 25 25 MET H H 24 7.610 7.610 7.437 0.173 18533
106 1 1 . 1 1 26 26 PHE N N 25 119.090 119.090 116.175 2.915 18533
107 1 1 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.515 -0.175 18533
108 1 1 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.022 0.008 18533
109 1 1 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.388 2.072 18533
110 1 1 . 1 1 26 26 PHE H H 25 8.560 8.560 7.883 0.677 18533
111 1 1 . 1 1 27 27 ALA N N 26 117.830 117.830 122.544 -4.714 18533
112 1 1 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.560 0.370 18533
113 1 1 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.086 0.974 18533
114 1 1 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.799 0.611 18533
115 1 1 . 1 1 27 27 ALA H H 26 8.800 8.800 7.159 1.641 18533
116 1 1 . 1 1 28 28 GLN N N 27 117.550 117.550 118.290 -0.740 18533
117 1 1 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.936 0.114 18533
118 1 1 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.872 0.738 18533
119 1 1 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.816 0.634 18533
120 1 1 . 1 1 28 28 GLN H H 27 7.690 7.690 7.759 -0.069 18533
121 1 1 . 1 1 29 29 GLN N N 28 117.530 117.530 119.731 -2.201 18533
122 1 1 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.018 0.122 18533
123 1 1 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.755 0.425 18533
124 1 1 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.917 -0.807 18533
125 1 1 . 1 1 29 29 GLN H H 28 8.210 8.210 7.502 0.708 18533
126 1 1 . 1 1 30 30 LEU N N 29 119.330 119.330 119.491 -0.161 18533
127 1 1 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.007 -0.077 18533
128 1 1 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.898 0.182 18533
129 1 1 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.436 0.464 18533
130 1 1 . 1 1 30 30 LEU H H 29 8.540 8.540 8.372 0.168 18533
131 1 1 . 1 1 31 31 ARG N N 30 120.880 120.880 118.067 2.813 18533
132 1 1 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.081 -0.111 18533
133 1 1 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.102 0.688 18533
134 1 1 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.352 0.169 18533
135 1 1 . 1 1 31 31 ARG H H 30 8.050 8.050 8.041 0.009 18533
136 1 1 . 1 1 32 32 HIS N N 31 119.770 119.770 118.425 1.345 18533
137 1 1 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.426 0.124 18533
138 1 1 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.306 -0.226 18533
139 1 1 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.253 0.457 18533
140 1 1 . 1 1 32 32 HIS H H 31 8.440 8.440 8.444 -0.004 18533
141 1 1 . 1 1 33 33 ARG N N 32 115.430 115.430 117.378 -1.948 18533
142 1 1 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.499 0.091 18533
143 1 1 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.204 -0.234 18533
144 1 1 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.866 -0.647 18533
145 1 1 . 1 1 33 33 ARG H H 32 7.500 7.500 7.937 -0.437 18533
146 1 1 . 1 1 34 34 GLY N N 33 106.730 106.730 108.837 -2.107 18533
147 1 1 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.038 1.162 18533
148 1 1 . 1 1 34 34 GLY H H 33 7.750 7.750 8.319 -0.569 18533
149 1 1 . 1 1 35 35 LEU N N 34 119.980 119.980 117.970 2.010 18533
150 1 1 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.861 -0.181 18533
151 1 1 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.615 0.535 18533
152 1 1 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.324 0.866 18533
153 1 1 . 1 1 35 35 LEU H H 34 7.980 7.980 8.481 -0.501 18533
154 1 1 . 1 1 36 36 GLY N N 35 108.660 108.660 109.079 -0.419 18533
155 1 1 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.637 -0.537 18533
156 1 1 . 1 1 36 36 GLY H H 35 8.830 8.830 8.072 0.758 18533
157 1 1 . 1 1 37 37 ASP N N 36 115.360 115.360 117.888 -2.528 18533
158 1 1 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.561 0.209 18533
159 1 1 . 1 1 37 37 ASP CA C 36 54.390 54.390 54.944 -0.555 18533
160 1 1 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.824 0.346 18533
161 1 1 . 1 1 37 37 ASP H H 36 8.300 8.300 8.305 -0.005 18533
162 1 1 . 1 1 38 38 ALA N N 37 121.460 121.460 119.656 1.804 18533
163 1 1 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.322 -0.012 18533
164 1 1 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.015 -0.065 18533
165 1 1 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.315 0.535 18533
166 1 1 . 1 1 38 38 ALA H H 37 7.380 7.380 7.670 -0.290 18533
167 1 1 . 1 1 39 39 VAL N N 38 115.660 115.660 116.741 -1.081 18533
168 1 1 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.529 0.271 18533
169 1 1 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.415 -0.375 18533
170 1 1 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.657 0.533 18533
171 1 1 . 1 1 39 39 VAL H H 38 7.100 7.100 7.646 -0.546 18533
172 1 1 . 1 1 40 40 ARG N N 39 129.230 129.230 129.802 -0.572 18533
173 1 1 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.525 0.015 18533
174 1 1 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.109 1.601 18533
175 1 1 . 1 1 40 40 ARG CB C 39 32.320 32.320 28.955 3.365 18533
176 1 1 . 1 1 40 40 ARG H H 39 9.730 9.730 8.605 1.125 18533
177 1 1 . 1 1 41 41 VAL N N 40 126.240 126.240 125.300 0.940 18533
178 1 1 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.671 1.019 18533
179 1 1 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.458 -0.897 18533
180 1 1 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.541 0.399 18533
181 1 1 . 1 1 41 41 VAL H H 40 8.610 8.610 8.071 0.539 18533
182 1 1 . 1 1 42 42 THR N N 41 117.310 117.310 119.085 -1.775 18533
183 1 1 . 1 1 42 42 THR HA H 41 4.890 4.890 4.772 0.118 18533
184 1 1 . 1 1 42 42 THR CA C 41 60.300 60.300 60.104 0.196 18533
185 1 1 . 1 1 42 42 THR CB C 41 73.890 73.890 71.400 2.490 18533
186 1 1 . 1 1 42 42 THR H H 41 8.870 8.870 8.753 0.117 18533
187 1 1 . 1 1 43 43 SER N N 42 109.960 109.960 113.109 -3.149 18533
188 1 1 . 1 1 43 43 SER HA H 42 5.720 5.720 4.974 0.746 18533
189 1 1 . 1 1 43 43 SER CA C 42 58.090 58.090 57.898 0.193 18533
190 1 1 . 1 1 43 43 SER CB C 42 65.870 65.870 66.620 -0.749 18533
191 1 1 . 1 1 43 43 SER H H 42 8.060 8.060 8.678 -0.618 18533
192 1 1 . 1 1 44 44 ALA N N 43 119.200 119.200 119.981 -0.781 18533
193 1 1 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.057 -0.797 18533
194 1 1 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.743 -0.563 18533
195 1 1 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.099 -1.269 18533
196 1 1 . 1 1 44 44 ALA H H 43 8.710 8.710 9.053 -0.343 18533
197 1 1 . 1 1 45 45 GLY N N 44 104.090 104.090 106.460 -2.370 18533
198 1 1 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.145 -1.605 18533
199 1 1 . 1 1 45 45 GLY H H 44 8.670 8.670 8.257 0.413 18533
200 1 1 . 1 1 46 46 THR N N 45 114.060 114.060 115.922 -1.862 18533
201 1 1 . 1 1 46 46 THR HA H 45 4.080 4.080 4.174 -0.094 18533
202 1 1 . 1 1 46 46 THR CA C 45 64.680 64.680 64.380 0.300 18533
203 1 1 . 1 1 46 46 THR CB C 45 67.880 67.880 68.790 -0.909 18533
204 1 1 . 1 1 46 46 THR H H 45 9.120 9.120 8.420 0.700 18533
205 1 1 . 1 1 47 47 GLY N N 46 110.380 110.380 108.248 2.132 18533
206 1 1 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.801 0.029 18533
207 1 1 . 1 1 47 47 GLY H H 46 8.930 8.930 8.443 0.487 18533
208 1 1 . 1 1 48 48 ASN N N 47 113.440 113.440 117.352 -3.912 18533
209 1 1 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.341 0.149 18533
210 1 1 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.227 -2.467 18533
211 1 1 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.932 1.918 18533
212 1 1 . 1 1 48 48 ASN H H 47 7.600 7.600 7.591 0.009 18533
213 1 1 . 1 1 49 49 TRP N N 48 117.300 117.300 121.171 -3.871 18533
214 1 1 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.387 -0.487 18533
215 1 1 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.369 0.491 18533
216 1 1 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.952 -0.432 18533
217 1 1 . 1 1 49 49 TRP H H 48 6.920 6.920 8.657 -1.737 18533
218 1 1 . 1 1 50 50 HIS N N 49 111.590 111.590 115.107 -3.517 18533
219 1 1 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.818 0.062 18533
220 1 1 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.533 -1.673 18533
221 1 1 . 1 1 50 50 HIS CB C 49 31.040 31.040 30.026 1.014 18533
222 1 1 . 1 1 50 50 HIS H H 49 8.620 8.620 8.436 0.184 18533
223 1 1 . 1 1 51 51 VAL N N 50 119.010 119.010 120.762 -1.752 18533
224 1 1 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.823 -0.623 18533
225 1 1 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.397 1.284 18533
226 1 1 . 1 1 51 51 VAL CB C 50 31.390 31.390 32.019 -0.629 18533
227 1 1 . 1 1 51 51 VAL H H 50 6.880 6.880 7.486 -0.606 18533
228 1 1 . 1 1 52 52 GLY N N 51 115.450 115.450 116.455 -1.005 18533
229 1 1 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.365 -0.426 18533
230 1 1 . 1 1 52 52 GLY H H 51 9.120 9.120 9.305 -0.185 18533
231 1 1 . 1 1 53 53 SER N N 52 116.620 116.620 116.222 0.398 18533
232 1 1 . 1 1 53 53 SER HA H 52 4.610 4.610 4.745 -0.135 18533
233 1 1 . 1 1 53 53 SER CA C 52 59.310 59.310 58.729 0.581 18533
234 1 1 . 1 1 53 53 SER CB C 52 64.630 64.630 65.174 -0.544 18533
235 1 1 . 1 1 53 53 SER H H 52 8.430 8.430 8.009 0.421 18533
236 1 1 . 1 1 54 54 CYS N N 53 118.690 118.690 117.660 1.030 18533
237 1 1 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.395 -0.295 18533
238 1 1 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.253 1.417 18533
239 1 1 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.577 -3.227 18533
240 1 1 . 1 1 54 54 CYS H H 53 8.170 8.170 8.446 -0.276 18533
241 1 1 . 1 1 55 55 ALA N N 54 118.580 118.580 123.850 -5.270 18533
242 1 1 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.179 -0.059 18533
243 1 1 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.894 -0.254 18533
244 1 1 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.194 -2.564 18533
245 1 1 . 1 1 55 55 ALA H H 54 8.420 8.420 8.565 -0.145 18533
246 1 1 . 1 1 56 56 ASP N N 55 121.500 121.500 123.815 -2.315 18533
247 1 1 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.369 -0.029 18533
248 1 1 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.717 0.333 18533
249 1 1 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.881 3.179 18533
250 1 1 . 1 1 56 56 ASP H H 55 8.470 8.470 8.488 -0.018 18533
251 1 1 . 1 1 57 57 GLU N N 56 127.840 127.840 126.578 1.262 18533
252 1 1 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.791 0.249 18533
253 1 1 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.194 0.446 18533
254 1 1 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.268 0.232 18533
255 1 1 . 1 1 57 57 GLU H H 56 9.230 9.230 8.799 0.431 18533
256 1 1 . 1 1 58 58 ARG N N 57 120.820 120.820 117.827 2.993 18533
257 1 1 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.658 0.152 18533
258 1 1 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.354 -0.204 18533
259 1 1 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.803 -1.533 18533
260 1 1 . 1 1 58 58 ARG H H 57 9.220 9.220 8.845 0.375 18533
261 1 1 . 1 1 59 59 ALA N N 58 121.590 121.590 122.385 -0.795 18533
262 1 1 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.117 0.043 18533
263 1 1 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.373 0.406 18533
264 1 1 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.127 0.363 18533
265 1 1 . 1 1 59 59 ALA H H 58 6.680 6.680 7.521 -0.841 18533
266 1 1 . 1 1 60 60 ALA N N 59 118.970 118.970 121.487 -2.517 18533
267 1 1 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.933 -0.073 18533
268 1 1 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.170 -0.150 18533
269 1 1 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.338 -0.268 18533
270 1 1 . 1 1 60 60 ALA H H 59 8.540 8.540 8.228 0.312 18533
271 1 1 . 1 1 61 61 GLY N N 60 104.160 104.160 106.880 -2.720 18533
272 1 1 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.824 0.446 18533
273 1 1 . 1 1 61 61 GLY H H 60 8.210 8.210 7.729 0.481 18533
274 1 1 . 1 1 62 62 VAL N N 61 122.820 122.820 123.212 -0.392 18533
275 1 1 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.457 0.393 18533
276 1 1 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.596 -0.346 18533
277 1 1 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.842 0.048 18533
278 1 1 . 1 1 62 62 VAL H H 61 7.310 7.310 7.599 -0.289 18533
279 1 1 . 1 1 63 63 LEU N N 62 120.310 120.310 118.343 1.967 18533
280 1 1 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.240 -0.260 18533
281 1 1 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.203 0.747 18533
282 1 1 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.568 -0.068 18533
283 1 1 . 1 1 63 63 LEU H H 62 8.090 8.090 8.409 -0.319 18533
284 1 1 . 1 1 64 64 ARG N N 63 119.440 119.440 119.382 0.058 18533
285 1 1 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.262 -0.082 18533
286 1 1 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.824 0.626 18533
287 1 1 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.590 0.790 18533
288 1 1 . 1 1 64 64 ARG H H 63 8.740 8.740 8.285 0.455 18533
289 1 1 . 1 1 65 65 ALA N N 64 122.560 122.560 121.619 0.941 18533
290 1 1 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.081 -0.051 18533
291 1 1 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.082 0.458 18533
292 1 1 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.255 -0.175 18533
293 1 1 . 1 1 65 65 ALA H H 64 7.910 7.910 7.950 -0.040 18533
294 1 1 . 1 1 66 66 HIS N N 65 112.690 112.690 114.797 -2.107 18533
295 1 1 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.687 -0.047 18533
296 1 1 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.080 -0.580 18533
297 1 1 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.026 0.294 18533
298 1 1 . 1 1 66 66 HIS H H 65 7.410 7.410 7.843 -0.433 18533
299 1 1 . 1 1 67 67 GLY N N 66 107.440 107.440 107.293 0.147 18533
300 1 1 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.251 1.109 18533
301 1 1 . 1 1 67 67 GLY H H 66 7.850 7.850 7.563 0.287 18533
302 1 1 . 1 1 68 68 TYR N N 67 119.940 119.940 120.479 -0.539 18533
303 1 1 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.745 0.055 18533
304 1 1 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.352 0.748 18533
305 1 1 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.198 0.662 18533
306 1 1 . 1 1 68 68 TYR H H 67 8.380 8.380 8.291 0.089 18533
307 1 1 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.557 0.003 18533
308 1 1 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.802 -0.202 18533
309 1 1 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.744 0.066 18533
310 1 1 . 1 1 70 70 THR N N 69 100.660 100.660 106.354 -5.694 18533
311 1 1 . 1 1 70 70 THR HA H 69 4.300 4.300 4.409 -0.109 18533
312 1 1 . 1 1 70 70 THR CA C 69 61.250 61.250 60.840 0.410 18533
313 1 1 . 1 1 70 70 THR CB C 69 70.740 70.740 70.001 0.739 18533
314 1 1 . 1 1 70 70 THR H H 69 7.860 7.860 7.977 -0.117 18533
315 1 1 . 1 1 71 71 ASP N N 70 122.880 122.880 122.658 0.222 18533
316 1 1 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.569 -0.159 18533
317 1 1 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.948 0.922 18533
318 1 1 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.618 -0.648 18533
319 1 1 . 1 1 71 71 ASP H H 70 7.940 7.940 7.837 0.103 18533
320 1 1 . 1 1 72 72 HIS N N 71 121.720 121.720 122.953 -1.233 18533
321 1 1 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.767 -0.067 18533
322 1 1 . 1 1 72 72 HIS CA C 71 57.390 57.390 55.947 1.443 18533
323 1 1 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.445 2.895 18533
324 1 1 . 1 1 72 72 HIS H H 71 8.000 8.000 8.233 -0.233 18533
325 1 1 . 1 1 73 73 ARG N N 72 125.760 125.760 124.889 0.871 18533
326 1 1 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.942 -0.652 18533
327 1 1 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.244 0.186 18533
328 1 1 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.767 0.543 18533
329 1 1 . 1 1 73 73 ARG H H 72 7.230 7.230 8.127 -0.897 18533
330 1 1 . 1 1 74 74 ALA N N 73 127.970 127.970 129.183 -1.213 18533
331 1 1 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.271 0.359 18533
332 1 1 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.623 -0.443 18533
333 1 1 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.384 -1.484 18533
334 1 1 . 1 1 74 74 ALA H H 73 9.090 9.090 8.236 0.854 18533
335 1 1 . 1 1 75 75 ALA N N 74 126.090 126.090 124.988 1.102 18533
336 1 1 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.786 0.004 18533
337 1 1 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.473 0.497 18533
338 1 1 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.699 1.921 18533
339 1 1 . 1 1 75 75 ALA H H 74 9.410 9.410 8.150 1.260 18533
340 1 1 . 1 1 76 76 GLN N N 75 123.260 123.260 119.254 4.006 18533
341 1 1 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.781 0.169 18533
342 1 1 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.587 -0.037 18533
343 1 1 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.575 -1.525 18533
344 1 1 . 1 1 76 76 GLN H H 75 8.800 8.800 8.432 0.368 18533
345 1 1 . 1 1 77 77 VAL N N 76 125.510 125.510 123.144 2.366 18533
346 1 1 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.593 -0.293 18533
347 1 1 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.400 0.180 18533
348 1 1 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.571 2.919 18533
349 1 1 . 1 1 77 77 VAL H H 76 8.550 8.550 8.100 0.450 18533
350 1 1 . 1 1 78 78 GLY N N 77 121.850 121.850 116.667 5.183 18533
351 1 1 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.029 -0.188 18533
352 1 1 . 1 1 78 78 GLY H H 77 10.930 10.930 7.835 3.095 18533
353 1 1 . 1 1 79 79 THR N N 78 115.210 115.210 116.186 -0.976 18533
354 1 1 . 1 1 79 79 THR HA H 78 3.700 3.700 3.914 -0.214 18533
355 1 1 . 1 1 79 79 THR CA C 78 66.440 66.440 67.628 -1.188 18533
356 1 1 . 1 1 79 79 THR CB C 78 68.770 68.770 68.796 -0.026 18533
357 1 1 . 1 1 79 79 THR H H 78 8.540 8.540 8.421 0.119 18533
358 1 1 . 1 1 80 80 GLU N N 79 119.360 119.360 119.446 -0.086 18533
359 1 1 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.011 -0.051 18533
360 1 1 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.987 0.043 18533
361 1 1 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.619 0.441 18533
362 1 1 . 1 1 80 80 GLU H H 79 9.110 9.110 8.908 0.202 18533
363 1 1 . 1 1 81 81 HIS N N 80 118.380 118.380 117.221 1.159 18533
364 1 1 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.246 -0.306 18533
365 1 1 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.883 1.536 18533
366 1 1 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.125 0.805 18533
367 1 1 . 1 1 81 81 HIS H H 80 7.040 7.040 7.418 -0.378 18533
368 1 1 . 1 1 82 82 LEU N N 81 114.010 114.010 120.033 -6.023 18533
369 1 1 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.056 -0.155 18533
370 1 1 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.967 -0.287 18533
371 1 1 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.511 -0.781 18533
372 1 1 . 1 1 82 82 LEU H H 81 7.850 7.850 8.316 -0.466 18533
373 1 1 . 1 1 83 83 ALA N N 82 119.050 119.050 117.840 1.210 18533
374 1 1 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.205 0.185 18533
375 1 1 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.380 -0.180 18533
376 1 1 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.901 0.279 18533
377 1 1 . 1 1 83 83 ALA H H 82 6.950 6.950 7.437 -0.487 18533
378 1 1 . 1 1 84 84 ALA N N 83 122.500 122.500 121.457 1.043 18533
379 1 1 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.178 -0.418 18533
380 1 1 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.896 1.454 18533
381 1 1 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.417 -2.097 18533
382 1 1 . 1 1 84 84 ALA H H 83 7.280 7.280 7.316 -0.036 18533
383 1 1 . 1 1 85 85 ASP N N 84 118.740 118.740 120.309 -1.569 18533
384 1 1 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.774 -0.364 18533
385 1 1 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.078 1.562 18533
386 1 1 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.315 0.585 18533
387 1 1 . 1 1 85 85 ASP H H 84 8.440 8.440 8.452 -0.012 18533
388 1 1 . 1 1 86 86 LEU N N 85 115.180 115.180 118.798 -3.618 18533
389 1 1 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.880 -0.700 18533
390 1 1 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.864 1.177 18533
391 1 1 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.733 0.437 18533
392 1 1 . 1 1 86 86 LEU H H 85 7.280 7.280 8.223 -0.943 18533
393 1 1 . 1 1 87 87 LEU N N 86 128.140 128.140 127.487 0.653 18533
394 1 1 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.941 -0.251 18533
395 1 1 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.774 1.606 18533
396 1 1 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.697 -0.527 18533
397 1 1 . 1 1 87 87 LEU H H 86 8.780 8.780 8.946 -0.166 18533
398 1 1 . 1 1 88 88 VAL N N 87 122.630 122.630 127.145 -4.515 18533
399 1 1 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.921 -0.291 18533
400 1 1 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.339 -1.429 18533
401 1 1 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.952 -0.112 18533
402 1 1 . 1 1 88 88 VAL H H 87 9.010 9.010 8.999 0.011 18533
403 1 1 . 1 1 89 89 ALA N N 88 129.820 129.820 131.650 -1.830 18533
404 1 1 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.860 -0.340 18533
405 1 1 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.532 -0.752 18533
406 1 1 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.175 -0.395 18533
407 1 1 . 1 1 89 89 ALA H H 88 8.590 8.590 9.101 -0.511 18533
408 1 1 . 1 1 90 90 LEU N N 89 129.280 129.280 119.398 9.882 18533
409 1 1 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.714 -0.404 18533
410 1 1 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.642 0.808 18533
411 1 1 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.893 -3.873 18533
412 1 1 . 1 1 90 90 LEU H H 89 8.570 8.570 8.588 -0.018 18533
413 1 1 . 1 1 91 91 ASP N N 90 126.910 126.910 116.752 10.158 18533
414 1 1 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.739 0.061 18533
415 1 1 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.086 -0.136 18533
416 1 1 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.122 0.688 18533
417 1 1 . 1 1 91 91 ASP H H 90 11.450 11.450 7.539 3.911 18533
418 1 1 . 1 1 92 92 ARG N N 91 116.950 116.950 120.928 -3.978 18533
419 1 1 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.820 0.200 18533
420 1 1 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.720 -0.890 18533
421 1 1 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.680 0.600 18533
422 1 1 . 1 1 92 92 ARG H H 91 8.650 8.650 8.345 0.305 18533
423 1 1 . 1 1 93 93 ASN N N 92 120.740 120.740 118.014 2.726 18533
424 1 1 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.556 -0.176 18533
425 1 1 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.717 0.413 18533
426 1 1 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.869 -0.249 18533
427 1 1 . 1 1 93 93 ASN H H 92 8.610 8.610 7.881 0.729 18533
428 1 1 . 1 1 94 94 HIS N N 93 121.170 121.170 120.412 0.758 18533
429 1 1 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.192 -0.002 18533
430 1 1 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.295 0.215 18533
431 1 1 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.725 1.655 18533
432 1 1 . 1 1 94 94 HIS H H 93 7.430 7.430 8.700 -1.270 18533
433 1 1 . 1 1 95 95 ALA N N 94 118.270 118.270 121.080 -2.810 18533
434 1 1 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.952 -0.212 18533
435 1 1 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.472 0.028 18533
436 1 1 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.318 -0.348 18533
437 1 1 . 1 1 95 95 ALA H H 94 7.190 7.190 8.176 -0.986 18533
438 1 1 . 1 1 96 96 ARG N N 95 117.190 117.190 119.342 -2.152 18533
439 1 1 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.042 -0.132 18533
440 1 1 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.322 0.178 18533
441 1 1 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.072 0.158 18533
442 1 1 . 1 1 96 96 ARG H H 95 7.600 7.600 7.688 -0.088 18533
443 1 1 . 1 1 97 97 LEU N N 96 120.700 120.700 119.672 1.028 18533
444 1 1 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.972 0.108 18533
445 1 1 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.749 0.151 18533
446 1 1 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.730 -0.390 18533
447 1 1 . 1 1 97 97 LEU H H 96 7.990 7.990 8.139 -0.149 18533
448 1 1 . 1 1 98 98 LEU N N 97 118.390 118.390 118.263 0.127 18533
449 1 1 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.840 0.070 18533
450 1 1 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.037 0.063 18533
451 1 1 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.226 0.664 18533
452 1 1 . 1 1 98 98 LEU H H 97 8.210 8.210 8.228 -0.018 18533
453 1 1 . 1 1 99 99 ARG N N 98 117.470 117.470 117.983 -0.513 18533
454 1 1 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.069 0.411 18533
455 1 1 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.023 -0.663 18533
456 1 1 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.715 -0.975 18533
457 1 1 . 1 1 99 99 ARG H H 98 7.740 7.740 7.891 -0.151 18533
458 1 1 . 1 1 100 100 GLN N N 99 121.400 121.400 118.515 2.885 18533
459 1 1 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.190 -0.120 18533
460 1 1 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.151 0.529 18533
461 1 1 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.190 0.130 18533
462 1 1 . 1 1 100 100 GLN H H 99 8.030 8.030 7.990 0.040 18533
463 1 1 . 1 1 101 101 LEU N N 100 118.940 118.940 117.161 1.779 18533
464 1 1 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.187 0.073 18533
465 1 1 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.241 0.219 18533
466 1 1 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.141 0.099 18533
467 1 1 . 1 1 101 101 LEU H H 100 7.780 7.780 7.755 0.025 18533
468 1 1 . 1 1 102 102 GLY N N 101 105.740 105.740 104.266 1.474 18533
469 1 1 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.508 0.521 18533
470 1 1 . 1 1 102 102 GLY H H 101 7.700 7.700 7.638 0.062 18533
471 1 1 . 1 1 103 103 VAL N N 102 122.330 122.330 119.924 2.406 18533
472 1 1 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.098 -0.468 18533
473 1 1 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.134 1.466 18533
474 1 1 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.309 -1.819 18533
475 1 1 . 1 1 103 103 VAL H H 102 7.520 7.520 7.728 -0.208 18533
476 1 1 . 1 1 104 104 GLU N N 103 128.990 128.990 114.100 14.890 18533
477 1 1 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.394 -0.224 18533
478 1 1 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.303 1.617 18533
479 1 1 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.452 -3.502 18533
480 1 1 . 1 1 104 104 GLU H H 103 9.210 9.210 7.865 1.345 18533
481 1 1 . 1 1 105 105 ALA N N 104 124.410 124.410 123.123 1.287 18533
482 1 1 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.238 -0.478 18533
483 1 1 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.756 0.884 18533
484 1 1 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.438 -0.298 18533
485 1 1 . 1 1 105 105 ALA H H 104 8.500 8.500 8.730 -0.230 18533
486 1 1 . 1 1 106 106 ALA N N 105 115.110 115.110 120.528 -5.418 18533
487 1 1 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.243 -0.113 18533
488 1 1 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.686 -0.646 18533
489 1 1 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.394 0.666 18533
490 1 1 . 1 1 106 106 ALA H H 105 8.270 8.270 8.393 -0.123 18533
491 1 1 . 1 1 107 107 ARG N N 106 115.080 115.080 114.578 0.502 18533
492 1 1 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.836 -0.376 18533
493 1 1 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.840 -0.331 18533
494 1 1 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.583 0.787 18533
495 1 1 . 1 1 107 107 ARG H H 106 7.740 7.740 7.630 0.110 18533
496 1 1 . 1 1 108 108 VAL N N 107 118.170 118.170 121.666 -3.496 18533
497 1 1 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.283 0.787 18533
498 1 1 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.236 -1.596 18533
499 1 1 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.237 1.363 18533
500 1 1 . 1 1 108 108 VAL H H 107 7.290 7.290 8.308 -1.018 18533
501 1 1 . 1 1 109 109 ARG N N 108 124.250 124.250 128.141 -3.891 18533
502 1 1 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.565 0.055 18533
503 1 1 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.278 -1.388 18533
504 1 1 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.144 0.836 18533
505 1 1 . 1 1 109 109 ARG H H 108 8.420 8.420 9.277 -0.857 18533
506 1 1 . 1 1 110 110 MET N N 109 119.570 119.570 121.246 -1.676 18533
507 1 1 . 1 1 110 110 MET HA H 109 4.960 4.960 5.018 -0.058 18533
508 1 1 . 1 1 110 110 MET CA C 109 53.820 53.820 54.316 -0.496 18533
509 1 1 . 1 1 110 110 MET CB C 109 30.680 30.680 32.773 -2.093 18533
510 1 1 . 1 1 110 110 MET H H 109 8.890 8.890 8.485 0.405 18533
511 1 1 . 1 1 111 111 LEU N N 110 128.660 128.660 125.149 3.511 18533
512 1 1 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.314 -0.354 18533
513 1 1 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.927 0.673 18533
514 1 1 . 1 1 111 111 LEU CB C 110 41.080 41.080 42.160 -1.081 18533
515 1 1 . 1 1 111 111 LEU H H 110 9.200 9.200 8.770 0.430 18533
516 1 1 . 1 1 112 112 ARG N N 111 111.910 111.910 116.645 -4.735 18533
517 1 1 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.087 -0.137 18533
518 1 1 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.614 1.306 18533
519 1 1 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.533 -1.033 18533
520 1 1 . 1 1 112 112 ARG H H 111 8.930 8.930 8.640 0.290 18533
521 1 1 . 1 1 113 113 SER N N 112 114.800 114.800 115.154 -0.354 18533
522 1 1 . 1 1 113 113 SER HA H 112 4.290 4.290 4.280 0.010 18533
523 1 1 . 1 1 113 113 SER CA C 112 60.880 60.880 60.027 0.853 18533
524 1 1 . 1 1 113 113 SER CB C 112 63.190 63.190 62.426 0.764 18533
525 1 1 . 1 1 113 113 SER H H 112 7.680 7.680 7.505 0.175 18533
526 1 1 . 1 1 114 114 PHE N N 113 119.260 119.260 118.253 1.007 18533
527 1 1 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.485 -0.135 18533
528 1 1 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.166 0.763 18533
529 1 1 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.829 -0.109 18533
530 1 1 . 1 1 114 114 PHE H H 113 7.600 7.600 7.647 -0.047 18533
531 1 1 . 1 1 115 115 ASP N N 114 121.170 121.170 121.519 -0.349 18533
532 1 1 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.927 0.093 18533
533 1 1 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.302 -1.202 18533
534 1 1 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.505 1.005 18533
535 1 1 . 1 1 115 115 ASP H H 114 7.430 7.430 7.558 -0.128 18533
536 1 1 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.374 0.116 18533
537 1 1 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.298 0.052 18533
538 1 1 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.197 0.073 18533
539 1 1 . 1 1 117 117 ARG N N 116 117.910 117.910 116.850 1.060 18533
540 1 1 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.459 -0.189 18533
541 1 1 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.021 0.429 18533
542 1 1 . 1 1 117 117 ARG CB C 116 29.960 29.960 29.985 -0.025 18533
543 1 1 . 1 1 117 117 ARG H H 116 8.580 8.580 8.344 0.236 18533
544 1 1 . 1 1 118 118 SER N N 117 116.130 116.130 114.892 1.238 18533
545 1 1 . 1 1 118 118 SER HA H 117 3.980 3.980 4.193 -0.213 18533
546 1 1 . 1 1 118 118 SER CA C 117 59.790 59.790 61.317 -1.527 18533
547 1 1 . 1 1 118 118 SER CB C 117 63.760 63.760 63.353 0.407 18533
548 1 1 . 1 1 118 118 SER H H 117 7.950 7.950 7.645 0.305 18533
549 1 1 . 1 1 119 119 GLY N N 118 110.080 110.080 109.748 0.332 18533
550 1 1 . 1 1 119 119 GLY CA C 118 45.370 45.370 45.476 -0.106 18533
551 1 1 . 1 1 119 119 GLY H H 118 8.150 8.150 8.598 -0.448 18533
552 1 1 . 1 1 120 120 THR HA H 119 4.020 4.020 4.448 -0.428 18533
553 1 1 . 1 1 120 120 THR CA C 119 63.290 63.290 61.461 1.829 18533
554 1 1 . 1 1 120 120 THR CB C 119 69.140 69.140 70.002 -0.862 18533
555 1 1 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.357 0.213 18533
556 1 1 . 1 1 121 121 HIS CA C 120 56.010 56.010 56.026 -0.017 18533
557 1 1 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.446 0.544 18533
558 1 1 . 1 1 122 122 ALA N N 121 125.880 125.880 128.305 -2.425 18533
559 1 1 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.418 -0.078 18533
560 1 1 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.389 0.121 18533
561 1 1 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.973 -0.373 18533
562 1 1 . 1 1 122 122 ALA H H 121 7.980 7.980 8.535 -0.555 18533
563 1 1 . 1 1 123 123 LEU N N 122 119.810 119.810 120.941 -1.131 18533
564 1 1 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.464 -0.184 18533
565 1 1 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.216 0.274 18533
566 1 1 . 1 1 123 123 LEU CB C 122 43.700 43.700 42.051 1.649 18533
567 1 1 . 1 1 123 123 LEU H H 122 7.810 7.810 8.069 -0.259 18533
568 1 1 . 1 1 124 124 ASP N N 123 119.050 119.050 117.015 2.035 18533
569 1 1 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.635 -0.065 18533
570 1 1 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.889 1.431 18533
571 1 1 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.240 -0.570 18533
572 1 1 . 1 1 124 124 ASP H H 123 8.270 8.270 7.422 0.848 18533
573 1 1 . 1 1 125 125 VAL N N 124 121.970 121.970 122.445 -0.475 18533
574 1 1 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.400 -0.140 18533
575 1 1 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.132 2.178 18533
576 1 1 . 1 1 125 125 VAL CB C 124 30.780 30.780 34.062 -3.282 18533
577 1 1 . 1 1 125 125 VAL H H 124 7.930 7.930 8.022 -0.092 18533
578 1 1 . 1 1 126 126 GLU N N 125 129.490 129.490 123.933 5.557 18533
579 1 1 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.134 -0.054 18533
580 1 1 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.421 0.589 18533
581 1 1 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.797 -0.997 18533
582 1 1 . 1 1 126 126 GLU H H 125 9.100 9.100 8.366 0.734 18533
583 1 1 . 1 1 127 127 ASP N N 126 122.300 122.300 118.529 3.771 18533
584 1 1 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.681 -0.571 18533
585 1 1 . 1 1 127 127 ASP CA C 126 51.720 51.720 52.346 -0.626 18533
586 1 1 . 1 1 127 127 ASP CB C 126 42.520 42.520 43.472 -0.952 18533
587 1 1 . 1 1 127 127 ASP H H 126 8.630 8.630 7.983 0.647 18533
588 1 1 . 1 1 128 128 PRO HA H 127 4.550 4.550 3.931 0.619 18533
589 1 1 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.324 0.276 18533
590 1 1 . 1 1 128 128 PRO CB C 127 30.980 30.980 30.614 0.366 18533
591 1 1 . 1 1 129 129 TYR N N 128 122.380 122.380 121.667 0.713 18533
592 1 1 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.290 -0.490 18533
593 1 1 . 1 1 129 129 TYR CA C 128 63.120 63.120 58.473 4.647 18533
594 1 1 . 1 1 129 129 TYR CB C 128 39.390 39.390 37.523 1.867 18533
595 1 1 . 1 1 129 129 TYR H H 128 8.670 8.670 6.720 1.950 18533
596 1 1 . 1 1 130 130 TYR N N 129 116.300 116.300 117.390 -1.090 18533
597 1 1 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.401 0.089 18533
598 1 1 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.048 2.432 18533
599 1 1 . 1 1 130 130 TYR CB C 129 36.660 36.660 37.716 -1.056 18533
600 1 1 . 1 1 130 130 TYR H H 129 8.680 8.680 7.239 1.441 18533
601 1 1 . 1 1 131 131 GLY N N 130 110.870 110.870 109.148 1.722 18533
602 1 1 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.132 -1.052 18533
603 1 1 . 1 1 131 131 GLY H H 130 8.060 8.060 8.226 -0.166 18533
604 1 1 . 1 1 132 132 ASP N N 131 121.590 121.590 119.191 2.399 18533
605 1 1 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.580 0.490 18533
606 1 1 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.752 0.248 18533
607 1 1 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.529 1.071 18533
608 1 1 . 1 1 132 132 ASP H H 131 9.290 9.290 7.916 1.374 18533
609 1 1 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.128 -0.018 18533
610 1 1 . 1 1 133 133 HIS CA C 132 61.570 61.570 58.955 2.615 18533
611 1 1 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.473 0.007 18533
612 1 1 . 1 1 134 134 SER N N 133 115.370 115.370 116.163 -0.793 18533
613 1 1 . 1 1 134 134 SER HA H 133 4.180 4.180 4.109 0.071 18533
614 1 1 . 1 1 134 134 SER CA C 133 62.070 62.070 62.395 -0.325 18533
615 1 1 . 1 1 134 134 SER CB C 133 62.160 62.160 62.408 -0.248 18533
616 1 1 . 1 1 134 134 SER H H 133 8.420 8.420 7.997 0.423 18533
617 1 1 . 1 1 135 135 ASP N N 134 123.360 123.360 120.780 2.580 18533
618 1 1 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.324 0.206 18533
619 1 1 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.470 0.570 18533
620 1 1 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.021 0.789 18533
621 1 1 . 1 1 135 135 ASP H H 134 7.980 7.980 8.705 -0.725 18533
622 1 1 . 1 1 136 136 PHE N N 135 118.940 118.940 117.855 1.085 18533
623 1 1 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.375 -0.575 18533
624 1 1 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.202 3.618 18533
625 1 1 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.501 0.849 18533
626 1 1 . 1 1 136 136 PHE H H 135 7.850 7.850 7.127 0.723 18533
627 1 1 . 1 1 137 137 GLU N N 136 121.410 121.410 118.859 2.551 18533
628 1 1 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.110 0.070 18533
629 1 1 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.249 0.251 18533
630 1 1 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.328 -0.338 18533
631 1 1 . 1 1 137 137 GLU H H 136 8.150 8.150 8.018 0.132 18533
632 1 1 . 1 1 138 138 GLU N N 137 121.530 121.530 120.956 0.574 18533
633 1 1 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.141 0.149 18533
634 1 1 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.347 0.053 18533
635 1 1 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.172 -0.282 18533
636 1 1 . 1 1 138 138 GLU H H 137 7.870 7.870 8.511 -0.641 18533
637 1 1 . 1 1 139 139 VAL N N 138 119.930 119.930 119.586 0.344 18533
638 1 1 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.668 -0.188 18533
639 1 1 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.413 0.667 18533
640 1 1 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.045 0.305 18533
641 1 1 . 1 1 139 139 VAL H H 138 7.770 7.770 7.581 0.189 18533
642 1 1 . 1 1 140 140 PHE N N 139 119.130 119.130 121.094 -1.964 18533
643 1 1 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.938 -0.378 18533
644 1 1 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.931 0.749 18533
645 1 1 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.660 0.510 18533
646 1 1 . 1 1 140 140 PHE H H 139 8.050 8.050 7.849 0.201 18533
647 1 1 . 1 1 141 141 ALA N N 140 121.040 121.040 121.947 -0.907 18533
648 1 1 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.308 -0.318 18533
649 1 1 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.811 0.309 18533
650 1 1 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.342 -0.042 18533
651 1 1 . 1 1 141 141 ALA H H 140 8.010 8.010 8.154 -0.144 18533
652 1 1 . 1 1 142 142 VAL N N 141 118.550 118.550 118.912 -0.362 18533
653 1 1 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.526 0.284 18533
654 1 1 . 1 1 142 142 VAL CA C 141 65.600 65.600 67.293 -1.693 18533
655 1 1 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.447 0.003 18533
656 1 1 . 1 1 142 142 VAL H H 141 8.300 8.300 7.936 0.364 18533
657 1 1 . 1 1 143 143 ILE N N 142 121.410 121.410 119.019 2.391 18533
658 1 1 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.425 -0.035 18533
659 1 1 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.334 0.716 18533
660 1 1 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.678 -0.368 18533
661 1 1 . 1 1 143 143 ILE H H 142 8.150 8.150 8.038 0.112 18533
662 1 1 . 1 1 144 144 GLU N N 143 119.630 119.630 119.265 0.365 18533
663 1 1 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.766 -0.226 18533
664 1 1 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.148 0.612 18533
665 1 1 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.927 0.803 18533
666 1 1 . 1 1 144 144 GLU H H 143 8.640 8.640 8.092 0.548 18533
667 1 1 . 1 1 145 145 SER N N 144 110.920 110.920 113.927 -3.007 18533
668 1 1 . 1 1 145 145 SER HA H 144 4.230 4.230 4.234 -0.004 18533
669 1 1 . 1 1 145 145 SER CA C 144 60.810 60.810 60.627 0.183 18533
670 1 1 . 1 1 145 145 SER CB C 144 63.610 63.610 63.453 0.157 18533
671 1 1 . 1 1 145 145 SER H H 144 7.640 7.640 7.814 -0.174 18533
672 1 1 . 1 1 146 146 ALA N N 145 123.110 123.110 124.491 -1.381 18533
673 1 1 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.349 -0.229 18533
674 1 1 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.124 -0.724 18533
675 1 1 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.376 2.504 18533
676 1 1 . 1 1 146 146 ALA H H 145 7.500 7.500 7.625 -0.125 18533
677 1 1 . 1 1 147 147 LEU N N 146 114.220 114.220 119.624 -5.404 18533
678 1 1 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.857 0.083 18533
679 1 1 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.418 -0.368 18533
680 1 1 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.420 0.040 18533
681 1 1 . 1 1 147 147 LEU H H 146 7.410 7.410 8.131 -0.721 18533
682 1 1 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.361 0.089 18533
683 1 1 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.467 3.373 18533
684 1 1 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.023 0.197 18533
685 1 1 . 1 1 149 149 GLY N N 148 102.590 102.590 106.545 -3.955 18533
686 1 1 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.525 1.735 18533
687 1 1 . 1 1 149 149 GLY H H 148 7.960 7.960 7.962 -0.002 18533
688 1 1 . 1 1 150 150 LEU N N 149 128.060 128.060 123.415 4.645 18533
689 1 1 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.195 0.435 18533
690 1 1 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.135 0.215 18533
691 1 1 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.264 -0.064 18533
692 1 1 . 1 1 150 150 LEU H H 149 7.620 7.620 8.419 -0.799 18533
693 1 1 . 1 1 151 151 HIS N N 150 120.730 120.730 118.619 2.111 18533
694 1 1 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.130 0.040 18533
695 1 1 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.626 0.755 18533
696 1 1 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.862 0.648 18533
697 1 1 . 1 1 151 151 HIS H H 150 8.430 8.430 8.415 0.015 18533
698 1 1 . 1 1 152 152 ASP N N 151 118.170 118.170 119.603 -1.433 18533
699 1 1 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.415 0.005 18533
700 1 1 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.858 -0.048 18533
701 1 1 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.612 -0.583 18533
702 1 1 . 1 1 152 152 ASP H H 151 7.820 7.820 8.285 -0.465 18533
703 1 1 . 1 1 153 153 TRP N N 152 122.780 122.780 121.773 1.007 18533
704 1 1 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.410 -0.300 18533
705 1 1 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.296 1.314 18533
706 1 1 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.206 -0.416 18533
707 1 1 . 1 1 153 153 TRP H H 152 7.900 7.900 7.840 0.060 18533
708 1 1 . 1 1 154 154 VAL N N 153 119.460 119.460 117.767 1.693 18533
709 1 1 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.876 -0.526 18533
710 1 1 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.173 0.807 18533
711 1 1 . 1 1 154 154 VAL CB C 153 31.900 31.900 30.927 0.973 18533
712 1 1 . 1 1 154 154 VAL H H 153 8.560 8.560 8.507 0.053 18533
713 1 1 . 1 1 155 155 ASP N N 154 120.500 120.500 121.511 -1.011 18533
714 1 1 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.341 -0.141 18533
715 1 1 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.561 -0.991 18533
716 1 1 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.874 -1.014 18533
717 1 1 . 1 1 155 155 ASP H H 154 8.530 8.530 8.776 -0.246 18533
718 1 1 . 1 1 156 156 GLU N N 155 120.090 120.090 119.661 0.429 18533
719 1 1 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.951 -0.021 18533
720 1 1 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.249 -0.089 18533
721 1 1 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.304 -0.014 18533
722 1 1 . 1 1 156 156 GLU H H 155 7.870 7.870 8.370 -0.500 18533
723 1 1 . 1 1 157 157 ARG N N 156 119.230 119.230 118.991 0.239 18533
724 1 1 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.006 -0.196 18533
725 1 1 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.147 -0.157 18533
726 1 1 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.303 -0.193 18533
727 1 1 . 1 1 157 157 ARG H H 156 7.660 7.660 7.964 -0.304 18533
728 1 1 . 1 1 158 158 LEU N N 157 118.790 118.790 117.519 1.271 18533
729 1 1 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.273 -0.173 18533
730 1 1 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.756 -1.076 18533
731 1 1 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.766 0.924 18533
732 1 1 . 1 1 158 158 LEU H H 157 8.470 8.470 8.356 0.114 18533
733 1 1 . 1 1 159 159 ALA N N 158 120.760 120.760 122.841 -2.081 18533
734 1 1 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.100 0.090 18533
735 1 1 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.710 -1.430 18533
736 1 1 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.797 -0.407 18533
737 1 1 . 1 1 159 159 ALA H H 158 7.490 7.490 7.709 -0.219 18533
738 1 1 . 1 1 160 160 ARG N N 159 117.810 117.810 116.393 1.417 18533
739 1 1 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.090 0.120 18533
740 1 1 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.536 -0.756 18533
741 1 1 . 1 1 160 160 ARG CB C 159 30.530 30.530 30.157 0.373 18533
742 1 1 . 1 1 160 160 ARG H H 159 7.650 7.650 7.884 -0.234 18533
743 1 1 . 1 1 161 161 ASN N N 160 118.560 118.560 119.060 -0.500 18533
744 1 1 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.528 0.212 18533
745 1 1 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.014 -1.764 18533
746 1 1 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.623 0.547 18533
747 1 1 . 1 1 161 161 ASN H H 160 8.100 8.100 7.820 0.280 18533
748 1 1 . 1 1 162 162 GLY N N 161 108.900 108.900 107.363 1.537 18533
749 1 1 . 1 1 162 162 GLY CA C 161 44.730 44.730 43.184 1.546 18533
750 1 1 . 1 1 162 162 GLY H H 161 7.980 7.980 7.894 0.086 18533
751 1 1 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.658 -0.198 18533
752 1 1 . 1 1 163 163 PRO CA C 162 63.450 63.450 61.819 1.631 18533
753 1 1 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.941 -0.741 18533
754 1 2 . 1 1 2 2 MET N N 1 119.850 119.850 121.473 -1.623 18533
755 1 2 . 1 1 2 2 MET HA H 1 4.500 4.500 4.658 -0.158 18533
756 1 2 . 1 1 2 2 MET CA C 1 55.450 55.450 55.318 0.132 18533
757 1 2 . 1 1 2 2 MET CB C 1 33.170 33.170 32.617 0.553 18533
758 1 2 . 1 1 2 2 MET H H 1 8.140 8.140 8.285 -0.145 18533
759 1 2 . 1 1 3 3 SER N N 2 117.000 117.000 112.329 4.671 18533
760 1 2 . 1 1 3 3 SER HA H 2 4.430 4.430 4.536 -0.106 18533
761 1 2 . 1 1 3 3 SER CA C 2 58.320 58.320 57.610 0.710 18533
762 1 2 . 1 1 3 3 SER CB C 2 63.990 63.990 65.565 -1.575 18533
763 1 2 . 1 1 3 3 SER H H 2 8.340 8.340 7.346 0.994 18533
764 1 2 . 1 1 4 4 ASP N N 3 123.200 123.200 117.853 5.347 18533
765 1 2 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.783 0.077 18533
766 1 2 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.928 -0.048 18533
767 1 2 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.223 0.577 18533
768 1 2 . 1 1 4 4 ASP H H 3 8.260 8.260 8.285 -0.025 18533
769 1 2 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.451 -0.051 18533
770 1 2 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.621 0.199 18533
771 1 2 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.615 -0.705 18533
772 1 2 . 1 1 6 6 LEU N N 5 123.160 123.160 119.939 3.221 18533
773 1 2 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.313 0.077 18533
774 1 2 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.091 0.189 18533
775 1 2 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.827 1.523 18533
776 1 2 . 1 1 6 6 LEU H H 5 7.670 7.670 8.017 -0.347 18533
777 1 2 . 1 1 7 7 HIS N N 6 127.160 127.160 118.031 9.129 18533
778 1 2 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.080 0.950 18533
779 1 2 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.131 -2.231 18533
780 1 2 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.691 0.439 18533
781 1 2 . 1 1 7 7 HIS H H 6 10.080 10.080 8.672 1.408 18533
782 1 2 . 1 1 8 8 VAL N N 7 128.620 128.620 127.446 1.174 18533
783 1 2 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.933 -0.433 18533
784 1 2 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.272 -0.472 18533
785 1 2 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.621 2.179 18533
786 1 2 . 1 1 8 8 VAL H H 7 8.930 8.930 9.068 -0.138 18533
787 1 2 . 1 1 9 9 THR N N 8 121.530 121.530 122.206 -0.676 18533
788 1 2 . 1 1 9 9 THR HA H 8 5.270 5.270 4.834 0.436 18533
789 1 2 . 1 1 9 9 THR CA C 8 58.520 58.520 58.909 -0.389 18533
790 1 2 . 1 1 9 9 THR CB C 8 70.750 70.750 69.802 0.948 18533
791 1 2 . 1 1 9 9 THR H H 8 7.970 7.970 8.964 -0.994 18533
792 1 2 . 1 1 10 10 PHE N N 9 125.360 125.360 128.014 -2.654 18533
793 1 2 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.056 0.154 18533
794 1 2 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.049 0.261 18533
795 1 2 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.444 3.386 18533
796 1 2 . 1 1 10 10 PHE H H 9 8.180 8.180 8.061 0.119 18533
797 1 2 . 1 1 11 11 VAL N N 10 121.120 121.120 122.291 -1.171 18533
798 1 2 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.278 0.082 18533
799 1 2 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.824 -0.404 18533
800 1 2 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.882 1.668 18533
801 1 2 . 1 1 11 11 VAL H H 10 8.710 8.710 9.190 -0.480 18533
802 1 2 . 1 1 12 12 CYS N N 11 123.270 123.270 126.368 -3.098 18533
803 1 2 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.160 -0.900 18533
804 1 2 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.556 1.074 18533
805 1 2 . 1 1 12 12 CYS CB C 11 30.350 30.350 32.019 -1.669 18533
806 1 2 . 1 1 12 12 CYS H H 11 7.940 7.940 8.736 -0.796 18533
807 1 2 . 1 1 13 13 THR HA H 12 5.010 5.010 4.183 0.827 18533
808 1 2 . 1 1 13 13 THR CA C 12 64.870 64.870 62.876 1.994 18533
809 1 2 . 1 1 13 13 THR CB C 12 69.180 69.180 67.388 1.792 18533
810 1 2 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.227 -0.267 18533
811 1 2 . 1 1 15 15 ASN N N 14 119.960 119.960 116.592 3.368 18533
812 1 2 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.286 -0.356 18533
813 1 2 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.604 0.266 18533
814 1 2 . 1 1 15 15 ASN CB C 14 40.670 40.670 36.985 3.685 18533
815 1 2 . 1 1 15 15 ASN H H 14 9.280 9.280 8.269 1.011 18533
816 1 2 . 1 1 16 16 ILE N N 15 101.060 101.060 109.144 -8.084 18533
817 1 2 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.633 0.047 18533
818 1 2 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.654 2.136 18533
819 1 2 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.891 3.249 18533
820 1 2 . 1 1 16 16 ILE H H 15 7.100 7.100 7.543 -0.443 18533
821 1 2 . 1 1 17 17 CYS N N 16 116.020 116.020 119.712 -3.692 18533
822 1 2 . 1 1 17 17 CYS HA H 16 4.940 4.940 5.107 -0.167 18533
823 1 2 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.276 0.784 18533
824 1 2 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.275 0.675 18533
825 1 2 . 1 1 17 17 CYS H H 16 7.700 7.700 7.889 -0.189 18533
826 1 2 . 1 1 19 19 SER N N 18 122.340 122.340 114.747 7.593 18533
827 1 2 . 1 1 19 19 SER HA H 18 3.810 3.810 4.270 -0.460 18533
828 1 2 . 1 1 19 19 SER CA C 18 62.710 62.710 63.242 -0.532 18533
829 1 2 . 1 1 19 19 SER CB C 18 64.860 64.860 60.990 3.870 18533
830 1 2 . 1 1 19 19 SER H H 18 11.420 11.420 8.543 2.877 18533
831 1 2 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.109 -0.139 18533
832 1 2 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.943 0.087 18533
833 1 2 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.910 -2.220 18533
834 1 2 . 1 1 21 21 MET N N 20 112.430 112.430 118.142 -5.712 18533
835 1 2 . 1 1 21 21 MET HA H 20 3.730 3.730 3.953 -0.223 18533
836 1 2 . 1 1 21 21 MET CA C 20 60.160 60.160 58.501 1.659 18533
837 1 2 . 1 1 21 21 MET CB C 20 33.040 33.040 31.486 1.554 18533
838 1 2 . 1 1 21 21 MET H H 20 6.310 6.310 7.604 -1.294 18533
839 1 2 . 1 1 22 22 ALA N N 21 117.800 117.800 119.753 -1.953 18533
840 1 2 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.813 -0.413 18533
841 1 2 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.445 0.545 18533
842 1 2 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.349 -0.859 18533
843 1 2 . 1 1 22 22 ALA H H 21 6.550 6.550 7.412 -0.862 18533
844 1 2 . 1 1 23 23 GLU N N 22 115.520 115.520 118.905 -3.385 18533
845 1 2 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.467 -0.787 18533
846 1 2 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.986 -0.436 18533
847 1 2 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.946 -0.156 18533
848 1 2 . 1 1 23 23 GLU H H 22 7.800 7.800 7.837 -0.037 18533
849 1 2 . 1 1 24 24 LYS N N 23 114.220 114.220 115.966 -1.746 18533
850 1 2 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.279 -0.279 18533
851 1 2 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.048 -0.288 18533
852 1 2 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.415 -1.615 18533
853 1 2 . 1 1 24 24 LYS H H 23 8.040 8.040 7.677 0.363 18533
854 1 2 . 1 1 25 25 MET N N 24 115.250 115.250 120.355 -5.105 18533
855 1 2 . 1 1 25 25 MET HA H 24 3.950 3.950 3.690 0.260 18533
856 1 2 . 1 1 25 25 MET CA C 24 57.980 57.980 59.162 -1.182 18533
857 1 2 . 1 1 25 25 MET CB C 24 35.500 35.500 32.631 2.869 18533
858 1 2 . 1 1 25 25 MET H H 24 7.610 7.610 7.688 -0.078 18533
859 1 2 . 1 1 26 26 PHE N N 25 119.090 119.090 116.741 2.349 18533
860 1 2 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.534 -0.194 18533
861 1 2 . 1 1 26 26 PHE CA C 25 60.030 60.030 58.447 1.583 18533
862 1 2 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.017 2.443 18533
863 1 2 . 1 1 26 26 PHE H H 25 8.560 8.560 8.223 0.337 18533
864 1 2 . 1 1 27 27 ALA N N 26 117.830 117.830 122.948 -5.118 18533
865 1 2 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.472 0.458 18533
866 1 2 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.166 0.894 18533
867 1 2 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.871 0.539 18533
868 1 2 . 1 1 27 27 ALA H H 26 8.800 8.800 7.603 1.197 18533
869 1 2 . 1 1 28 28 GLN N N 27 117.550 117.550 118.327 -0.777 18533
870 1 2 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.924 0.126 18533
871 1 2 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.856 0.754 18533
872 1 2 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.918 0.532 18533
873 1 2 . 1 1 28 28 GLN H H 27 7.690 7.690 7.819 -0.129 18533
874 1 2 . 1 1 29 29 GLN N N 28 117.530 117.530 119.978 -2.448 18533
875 1 2 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.026 0.114 18533
876 1 2 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.708 0.472 18533
877 1 2 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.842 -0.732 18533
878 1 2 . 1 1 29 29 GLN H H 28 8.210 8.210 7.550 0.660 18533
879 1 2 . 1 1 30 30 LEU N N 29 119.330 119.330 120.385 -1.055 18533
880 1 2 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.957 -0.027 18533
881 1 2 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.868 0.212 18533
882 1 2 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.341 0.559 18533
883 1 2 . 1 1 30 30 LEU H H 29 8.540 8.540 8.339 0.201 18533
884 1 2 . 1 1 31 31 ARG N N 30 120.880 120.880 118.093 2.787 18533
885 1 2 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.062 -0.092 18533
886 1 2 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.101 0.689 18533
887 1 2 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.288 0.232 18533
888 1 2 . 1 1 31 31 ARG H H 30 8.050 8.050 8.141 -0.091 18533
889 1 2 . 1 1 32 32 HIS N N 31 119.770 119.770 118.710 1.060 18533
890 1 2 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.392 0.158 18533
891 1 2 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.278 -0.198 18533
892 1 2 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.162 0.548 18533
893 1 2 . 1 1 32 32 HIS H H 31 8.440 8.440 8.419 0.021 18533
894 1 2 . 1 1 33 33 ARG N N 32 115.430 115.430 116.882 -1.452 18533
895 1 2 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.477 0.113 18533
896 1 2 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.073 -0.103 18533
897 1 2 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.629 -0.409 18533
898 1 2 . 1 1 33 33 ARG H H 32 7.500 7.500 7.779 -0.279 18533
899 1 2 . 1 1 34 34 GLY N N 33 106.730 106.730 108.782 -2.052 18533
900 1 2 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.112 1.088 18533
901 1 2 . 1 1 34 34 GLY H H 33 7.750 7.750 8.187 -0.437 18533
902 1 2 . 1 1 35 35 LEU N N 34 119.980 119.980 117.195 2.785 18533
903 1 2 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.827 -0.147 18533
904 1 2 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.721 0.429 18533
905 1 2 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.561 0.629 18533
906 1 2 . 1 1 35 35 LEU H H 34 7.980 7.980 8.414 -0.434 18533
907 1 2 . 1 1 36 36 GLY N N 35 108.660 108.660 108.834 -0.174 18533
908 1 2 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.740 -0.640 18533
909 1 2 . 1 1 36 36 GLY H H 35 8.830 8.830 7.873 0.957 18533
910 1 2 . 1 1 37 37 ASP N N 36 115.360 115.360 118.548 -3.188 18533
911 1 2 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.608 0.162 18533
912 1 2 . 1 1 37 37 ASP CA C 36 54.390 54.390 54.694 -0.304 18533
913 1 2 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.885 0.285 18533
914 1 2 . 1 1 37 37 ASP H H 36 8.300 8.300 8.068 0.232 18533
915 1 2 . 1 1 38 38 ALA N N 37 121.460 121.460 119.341 2.119 18533
916 1 2 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.215 0.095 18533
917 1 2 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.071 -0.120 18533
918 1 2 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.106 0.744 18533
919 1 2 . 1 1 38 38 ALA H H 37 7.380 7.380 7.759 -0.379 18533
920 1 2 . 1 1 39 39 VAL N N 38 115.660 115.660 116.902 -1.242 18533
921 1 2 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.499 0.301 18533
922 1 2 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.300 -0.260 18533
923 1 2 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.730 0.460 18533
924 1 2 . 1 1 39 39 VAL H H 38 7.100 7.100 7.599 -0.499 18533
925 1 2 . 1 1 40 40 ARG N N 39 129.230 129.230 127.731 1.499 18533
926 1 2 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.453 0.087 18533
927 1 2 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.298 1.412 18533
928 1 2 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.851 1.469 18533
929 1 2 . 1 1 40 40 ARG H H 39 9.730 9.730 8.546 1.184 18533
930 1 2 . 1 1 41 41 VAL N N 40 126.240 126.240 123.589 2.651 18533
931 1 2 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.803 0.887 18533
932 1 2 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.021 -0.461 18533
933 1 2 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.157 -0.218 18533
934 1 2 . 1 1 41 41 VAL H H 40 8.610 8.610 8.482 0.128 18533
935 1 2 . 1 1 42 42 THR N N 41 117.310 117.310 117.899 -0.589 18533
936 1 2 . 1 1 42 42 THR HA H 41 4.890 4.890 4.852 0.038 18533
937 1 2 . 1 1 42 42 THR CA C 41 60.300 60.300 59.371 0.929 18533
938 1 2 . 1 1 42 42 THR CB C 41 73.890 73.890 71.745 2.146 18533
939 1 2 . 1 1 42 42 THR H H 41 8.870 8.870 9.029 -0.159 18533
940 1 2 . 1 1 43 43 SER N N 42 109.960 109.960 113.530 -3.570 18533
941 1 2 . 1 1 43 43 SER HA H 42 5.720 5.720 5.036 0.684 18533
942 1 2 . 1 1 43 43 SER CA C 42 58.090 58.090 57.671 0.419 18533
943 1 2 . 1 1 43 43 SER CB C 42 65.870 65.870 66.611 -0.741 18533
944 1 2 . 1 1 43 43 SER H H 42 8.060 8.060 8.576 -0.516 18533
945 1 2 . 1 1 44 44 ALA N N 43 119.200 119.200 119.959 -0.759 18533
946 1 2 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.134 -0.874 18533
947 1 2 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.737 -0.557 18533
948 1 2 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.878 -1.048 18533
949 1 2 . 1 1 44 44 ALA H H 43 8.710 8.710 9.032 -0.322 18533
950 1 2 . 1 1 45 45 GLY N N 44 104.090 104.090 106.323 -2.233 18533
951 1 2 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.206 -1.666 18533
952 1 2 . 1 1 45 45 GLY H H 44 8.670 8.670 8.168 0.502 18533
953 1 2 . 1 1 46 46 THR N N 45 114.060 114.060 115.294 -1.234 18533
954 1 2 . 1 1 46 46 THR HA H 45 4.080 4.080 4.168 -0.088 18533
955 1 2 . 1 1 46 46 THR CA C 45 64.680 64.680 64.119 0.561 18533
956 1 2 . 1 1 46 46 THR CB C 45 67.880 67.880 68.582 -0.702 18533
957 1 2 . 1 1 46 46 THR H H 45 9.120 9.120 8.631 0.489 18533
958 1 2 . 1 1 47 47 GLY N N 46 110.380 110.380 108.568 1.812 18533
959 1 2 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.976 -0.146 18533
960 1 2 . 1 1 47 47 GLY H H 46 8.930 8.930 8.422 0.508 18533
961 1 2 . 1 1 48 48 ASN N N 47 113.440 113.440 117.177 -3.737 18533
962 1 2 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.373 0.117 18533
963 1 2 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.348 -2.588 18533
964 1 2 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.022 2.828 18533
965 1 2 . 1 1 48 48 ASN H H 47 7.600 7.600 7.591 0.009 18533
966 1 2 . 1 1 49 49 TRP N N 48 117.300 117.300 121.357 -4.057 18533
967 1 2 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.256 -0.356 18533
968 1 2 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.807 0.053 18533
969 1 2 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.986 -0.466 18533
970 1 2 . 1 1 49 49 TRP H H 48 6.920 6.920 8.565 -1.645 18533
971 1 2 . 1 1 50 50 HIS N N 49 111.590 111.590 114.207 -2.617 18533
972 1 2 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.820 0.060 18533
973 1 2 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.432 -1.572 18533
974 1 2 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.610 1.430 18533
975 1 2 . 1 1 50 50 HIS H H 49 8.620 8.620 8.298 0.322 18533
976 1 2 . 1 1 51 51 VAL N N 50 119.010 119.010 120.654 -1.644 18533
977 1 2 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.660 -0.460 18533
978 1 2 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.669 1.011 18533
979 1 2 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.414 -0.024 18533
980 1 2 . 1 1 51 51 VAL H H 50 6.880 6.880 7.384 -0.504 18533
981 1 2 . 1 1 52 52 GLY N N 51 115.450 115.450 116.538 -1.088 18533
982 1 2 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.532 -0.592 18533
983 1 2 . 1 1 52 52 GLY H H 51 9.120 9.120 9.074 0.046 18533
984 1 2 . 1 1 53 53 SER N N 52 116.620 116.620 114.844 1.776 18533
985 1 2 . 1 1 53 53 SER HA H 52 4.610 4.610 4.647 -0.037 18533
986 1 2 . 1 1 53 53 SER CA C 52 59.310 59.310 57.587 1.723 18533
987 1 2 . 1 1 53 53 SER CB C 52 64.630 64.630 64.972 -0.343 18533
988 1 2 . 1 1 53 53 SER H H 52 8.430 8.430 7.930 0.500 18533
989 1 2 . 1 1 54 54 CYS N N 53 118.690 118.690 118.723 -0.033 18533
990 1 2 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.471 -0.371 18533
991 1 2 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.360 1.310 18533
992 1 2 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.291 -2.941 18533
993 1 2 . 1 1 54 54 CYS H H 53 8.170 8.170 8.430 -0.260 18533
994 1 2 . 1 1 55 55 ALA N N 54 118.580 118.580 123.999 -5.419 18533
995 1 2 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.239 -0.119 18533
996 1 2 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.567 0.073 18533
997 1 2 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.534 -2.904 18533
998 1 2 . 1 1 55 55 ALA H H 54 8.420 8.420 8.497 -0.077 18533
999 1 2 . 1 1 56 56 ASP N N 55 121.500 121.500 120.071 1.429 18533
1000 1 2 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.372 -0.032 18533
1001 1 2 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.146 0.904 18533
1002 1 2 . 1 1 56 56 ASP CB C 55 46.060 46.060 40.843 5.217 18533
1003 1 2 . 1 1 56 56 ASP H H 55 8.470 8.470 8.245 0.225 18533
1004 1 2 . 1 1 57 57 GLU N N 56 127.840 127.840 123.928 3.912 18533
1005 1 2 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.772 0.268 18533
1006 1 2 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.611 0.029 18533
1007 1 2 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.033 0.467 18533
1008 1 2 . 1 1 57 57 GLU H H 56 9.230 9.230 8.875 0.355 18533
1009 1 2 . 1 1 58 58 ARG N N 57 120.820 120.820 119.151 1.669 18533
1010 1 2 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.805 0.005 18533
1011 1 2 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.218 -0.068 18533
1012 1 2 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.330 -1.060 18533
1013 1 2 . 1 1 58 58 ARG H H 57 9.220 9.220 7.996 1.224 18533
1014 1 2 . 1 1 59 59 ALA N N 58 121.590 121.590 122.351 -0.761 18533
1015 1 2 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.152 0.008 18533
1016 1 2 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.441 0.338 18533
1017 1 2 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.166 0.324 18533
1018 1 2 . 1 1 59 59 ALA H H 58 6.680 6.680 7.479 -0.799 18533
1019 1 2 . 1 1 60 60 ALA N N 59 118.970 118.970 121.567 -2.597 18533
1020 1 2 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.932 -0.072 18533
1021 1 2 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.225 -0.205 18533
1022 1 2 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.330 -0.260 18533
1023 1 2 . 1 1 60 60 ALA H H 59 8.540 8.540 8.618 -0.078 18533
1024 1 2 . 1 1 61 61 GLY N N 60 104.160 104.160 106.549 -2.389 18533
1025 1 2 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.153 0.117 18533
1026 1 2 . 1 1 61 61 GLY H H 60 8.210 8.210 8.285 -0.075 18533
1027 1 2 . 1 1 62 62 VAL N N 61 122.820 122.820 120.003 2.817 18533
1028 1 2 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.780 0.070 18533
1029 1 2 . 1 1 62 62 VAL CA C 61 66.250 66.250 64.971 1.279 18533
1030 1 2 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.615 0.275 18533
1031 1 2 . 1 1 62 62 VAL H H 61 7.310 7.310 7.550 -0.240 18533
1032 1 2 . 1 1 63 63 LEU N N 62 120.310 120.310 121.030 -0.720 18533
1033 1 2 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.127 -0.147 18533
1034 1 2 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.245 0.705 18533
1035 1 2 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.403 0.097 18533
1036 1 2 . 1 1 63 63 LEU H H 62 8.090 8.090 8.538 -0.448 18533
1037 1 2 . 1 1 64 64 ARG N N 63 119.440 119.440 119.190 0.250 18533
1038 1 2 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.270 -0.090 18533
1039 1 2 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.915 0.535 18533
1040 1 2 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.572 0.808 18533
1041 1 2 . 1 1 64 64 ARG H H 63 8.740 8.740 8.486 0.254 18533
1042 1 2 . 1 1 65 65 ALA N N 64 122.560 122.560 121.462 1.098 18533
1043 1 2 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.088 -0.058 18533
1044 1 2 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.099 0.442 18533
1045 1 2 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.264 -0.184 18533
1046 1 2 . 1 1 65 65 ALA H H 64 7.910 7.910 7.664 0.246 18533
1047 1 2 . 1 1 66 66 HIS N N 65 112.690 112.690 114.962 -2.272 18533
1048 1 2 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.679 -0.039 18533
1049 1 2 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.138 -0.638 18533
1050 1 2 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.989 0.331 18533
1051 1 2 . 1 1 66 66 HIS H H 65 7.410 7.410 7.828 -0.418 18533
1052 1 2 . 1 1 67 67 GLY N N 66 107.440 107.440 107.171 0.269 18533
1053 1 2 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.234 1.126 18533
1054 1 2 . 1 1 67 67 GLY H H 66 7.850 7.850 7.556 0.294 18533
1055 1 2 . 1 1 68 68 TYR N N 67 119.940 119.940 120.513 -0.573 18533
1056 1 2 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.776 0.024 18533
1057 1 2 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.366 0.734 18533
1058 1 2 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.119 0.741 18533
1059 1 2 . 1 1 68 68 TYR H H 67 8.380 8.380 8.325 0.055 18533
1060 1 2 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.519 0.041 18533
1061 1 2 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.902 -0.302 18533
1062 1 2 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.484 0.326 18533
1063 1 2 . 1 1 70 70 THR N N 69 100.660 100.660 108.492 -7.832 18533
1064 1 2 . 1 1 70 70 THR HA H 69 4.300 4.300 4.421 -0.121 18533
1065 1 2 . 1 1 70 70 THR CA C 69 61.250 61.250 61.423 -0.173 18533
1066 1 2 . 1 1 70 70 THR CB C 69 70.740 70.740 69.337 1.403 18533
1067 1 2 . 1 1 70 70 THR H H 69 7.860 7.860 8.095 -0.235 18533
1068 1 2 . 1 1 71 71 ASP N N 70 122.880 122.880 122.739 0.141 18533
1069 1 2 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.660 -0.250 18533
1070 1 2 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.840 1.030 18533
1071 1 2 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.435 -0.465 18533
1072 1 2 . 1 1 71 71 ASP H H 70 7.940 7.940 7.878 0.062 18533
1073 1 2 . 1 1 72 72 HIS N N 71 121.720 121.720 124.318 -2.598 18533
1074 1 2 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.874 -0.174 18533
1075 1 2 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.473 0.917 18533
1076 1 2 . 1 1 72 72 HIS CB C 71 35.340 35.340 33.276 2.064 18533
1077 1 2 . 1 1 72 72 HIS H H 71 8.000 8.000 8.017 -0.017 18533
1078 1 2 . 1 1 73 73 ARG N N 72 125.760 125.760 126.824 -1.064 18533
1079 1 2 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.961 -0.671 18533
1080 1 2 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.053 0.377 18533
1081 1 2 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.656 0.654 18533
1082 1 2 . 1 1 73 73 ARG H H 72 7.230 7.230 8.085 -0.855 18533
1083 1 2 . 1 1 74 74 ALA N N 73 127.970 127.970 129.257 -1.287 18533
1084 1 2 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.307 0.323 18533
1085 1 2 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.629 -0.449 18533
1086 1 2 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.305 -1.405 18533
1087 1 2 . 1 1 74 74 ALA H H 73 9.090 9.090 8.134 0.956 18533
1088 1 2 . 1 1 75 75 ALA N N 74 126.090 126.090 124.928 1.162 18533
1089 1 2 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.753 0.037 18533
1090 1 2 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.632 0.338 18533
1091 1 2 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.726 1.894 18533
1092 1 2 . 1 1 75 75 ALA H H 74 9.410 9.410 8.107 1.303 18533
1093 1 2 . 1 1 76 76 GLN N N 75 123.260 123.260 119.552 3.708 18533
1094 1 2 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.745 0.205 18533
1095 1 2 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.598 -0.048 18533
1096 1 2 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.508 -1.458 18533
1097 1 2 . 1 1 76 76 GLN H H 75 8.800 8.800 8.400 0.400 18533
1098 1 2 . 1 1 77 77 VAL N N 76 125.510 125.510 124.528 0.982 18533
1099 1 2 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.418 -0.118 18533
1100 1 2 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.215 0.365 18533
1101 1 2 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.715 1.775 18533
1102 1 2 . 1 1 77 77 VAL H H 76 8.550 8.550 8.011 0.539 18533
1103 1 2 . 1 1 78 78 GLY N N 77 121.850 121.850 116.664 5.186 18533
1104 1 2 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.208 -0.368 18533
1105 1 2 . 1 1 78 78 GLY H H 77 10.930 10.930 8.586 2.344 18533
1106 1 2 . 1 1 79 79 THR N N 78 115.210 115.210 115.812 -0.602 18533
1107 1 2 . 1 1 79 79 THR HA H 78 3.700 3.700 3.893 -0.193 18533
1108 1 2 . 1 1 79 79 THR CA C 78 66.440 66.440 67.441 -1.001 18533
1109 1 2 . 1 1 79 79 THR CB C 78 68.770 68.770 68.827 -0.057 18533
1110 1 2 . 1 1 79 79 THR H H 78 8.540 8.540 8.418 0.122 18533
1111 1 2 . 1 1 80 80 GLU N N 79 119.360 119.360 119.202 0.158 18533
1112 1 2 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.987 -0.027 18533
1113 1 2 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.692 0.338 18533
1114 1 2 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.795 0.265 18533
1115 1 2 . 1 1 80 80 GLU H H 79 9.110 9.110 8.882 0.228 18533
1116 1 2 . 1 1 81 81 HIS N N 80 118.380 118.380 117.320 1.060 18533
1117 1 2 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.263 -0.323 18533
1118 1 2 . 1 1 81 81 HIS CA C 80 60.420 60.420 59.095 1.325 18533
1119 1 2 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.283 0.647 18533
1120 1 2 . 1 1 81 81 HIS H H 80 7.040 7.040 7.525 -0.485 18533
1121 1 2 . 1 1 82 82 LEU N N 81 114.010 114.010 119.505 -5.495 18533
1122 1 2 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.094 -0.194 18533
1123 1 2 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.707 -0.027 18533
1124 1 2 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.513 -0.783 18533
1125 1 2 . 1 1 82 82 LEU H H 81 7.850 7.850 8.275 -0.425 18533
1126 1 2 . 1 1 83 83 ALA N N 82 119.050 119.050 117.581 1.469 18533
1127 1 2 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.205 0.185 18533
1128 1 2 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.191 0.009 18533
1129 1 2 . 1 1 83 83 ALA CB C 82 19.180 19.180 19.002 0.178 18533
1130 1 2 . 1 1 83 83 ALA H H 82 6.950 6.950 7.401 -0.451 18533
1131 1 2 . 1 1 84 84 ALA N N 83 122.500 122.500 121.054 1.446 18533
1132 1 2 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.044 -0.284 18533
1133 1 2 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.261 1.089 18533
1134 1 2 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.252 -1.932 18533
1135 1 2 . 1 1 84 84 ALA H H 83 7.280 7.280 7.112 0.168 18533
1136 1 2 . 1 1 85 85 ASP N N 84 118.740 118.740 120.213 -1.473 18533
1137 1 2 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.654 -0.244 18533
1138 1 2 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.381 1.259 18533
1139 1 2 . 1 1 85 85 ASP CB C 84 42.900 42.900 41.918 0.982 18533
1140 1 2 . 1 1 85 85 ASP H H 84 8.440 8.440 8.305 0.135 18533
1141 1 2 . 1 1 86 86 LEU N N 85 115.180 115.180 118.188 -3.008 18533
1142 1 2 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.803 -0.623 18533
1143 1 2 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.781 1.259 18533
1144 1 2 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.612 0.558 18533
1145 1 2 . 1 1 86 86 LEU H H 85 7.280 7.280 8.124 -0.844 18533
1146 1 2 . 1 1 87 87 LEU N N 86 128.140 128.140 127.654 0.486 18533
1147 1 2 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.938 -0.248 18533
1148 1 2 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.726 1.654 18533
1149 1 2 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.566 -0.396 18533
1150 1 2 . 1 1 87 87 LEU H H 86 8.780 8.780 8.867 -0.087 18533
1151 1 2 . 1 1 88 88 VAL N N 87 122.630 122.630 126.983 -4.353 18533
1152 1 2 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.862 -0.232 18533
1153 1 2 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.406 -1.496 18533
1154 1 2 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.788 0.052 18533
1155 1 2 . 1 1 88 88 VAL H H 87 9.010 9.010 9.036 -0.026 18533
1156 1 2 . 1 1 89 89 ALA N N 88 129.820 129.820 131.656 -1.836 18533
1157 1 2 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.880 -0.360 18533
1158 1 2 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.320 -0.540 18533
1159 1 2 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.268 -0.488 18533
1160 1 2 . 1 1 89 89 ALA H H 88 8.590 8.590 9.246 -0.656 18533
1161 1 2 . 1 1 90 90 LEU N N 89 129.280 129.280 119.883 9.397 18533
1162 1 2 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.635 -0.325 18533
1163 1 2 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.297 0.153 18533
1164 1 2 . 1 1 90 90 LEU CB C 89 38.020 38.020 42.056 -4.037 18533
1165 1 2 . 1 1 90 90 LEU H H 89 8.570 8.570 8.580 -0.010 18533
1166 1 2 . 1 1 91 91 ASP N N 90 126.910 126.910 116.235 10.675 18533
1167 1 2 . 1 1 91 91 ASP HA H 90 4.800 4.800 5.007 -0.207 18533
1168 1 2 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.762 0.188 18533
1169 1 2 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.383 0.427 18533
1170 1 2 . 1 1 91 91 ASP H H 90 11.450 11.450 7.598 3.852 18533
1171 1 2 . 1 1 92 92 ARG N N 91 116.950 116.950 121.181 -4.231 18533
1172 1 2 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.877 0.143 18533
1173 1 2 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.403 -0.573 18533
1174 1 2 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.788 0.492 18533
1175 1 2 . 1 1 92 92 ARG H H 91 8.650 8.650 8.390 0.260 18533
1176 1 2 . 1 1 93 93 ASN N N 92 120.740 120.740 118.675 2.065 18533
1177 1 2 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.556 -0.176 18533
1178 1 2 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.363 0.767 18533
1179 1 2 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.270 -0.650 18533
1180 1 2 . 1 1 93 93 ASN H H 92 8.610 8.610 8.405 0.205 18533
1181 1 2 . 1 1 94 94 HIS N N 93 121.170 121.170 120.284 0.886 18533
1182 1 2 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.185 0.005 18533
1183 1 2 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.281 0.229 18533
1184 1 2 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.673 1.707 18533
1185 1 2 . 1 1 94 94 HIS H H 93 7.430 7.430 8.722 -1.292 18533
1186 1 2 . 1 1 95 95 ALA N N 94 118.270 118.270 121.057 -2.787 18533
1187 1 2 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.947 -0.207 18533
1188 1 2 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.425 0.075 18533
1189 1 2 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.331 -0.360 18533
1190 1 2 . 1 1 95 95 ALA H H 94 7.190 7.190 8.002 -0.812 18533
1191 1 2 . 1 1 96 96 ARG N N 95 117.190 117.190 119.193 -2.003 18533
1192 1 2 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.021 -0.111 18533
1193 1 2 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.336 0.165 18533
1194 1 2 . 1 1 96 96 ARG CB C 95 30.230 30.230 29.998 0.232 18533
1195 1 2 . 1 1 96 96 ARG H H 95 7.600 7.600 7.654 -0.054 18533
1196 1 2 . 1 1 97 97 LEU N N 96 120.700 120.700 119.464 1.236 18533
1197 1 2 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.977 0.103 18533
1198 1 2 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.703 0.197 18533
1199 1 2 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.652 -0.312 18533
1200 1 2 . 1 1 97 97 LEU H H 96 7.990 7.990 7.911 0.079 18533
1201 1 2 . 1 1 98 98 LEU N N 97 118.390 118.390 118.536 -0.146 18533
1202 1 2 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.842 0.068 18533
1203 1 2 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.076 0.024 18533
1204 1 2 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.141 0.749 18533
1205 1 2 . 1 1 98 98 LEU H H 97 8.210 8.210 8.093 0.117 18533
1206 1 2 . 1 1 99 99 ARG N N 98 117.470 117.470 118.130 -0.660 18533
1207 1 2 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.107 0.373 18533
1208 1 2 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.014 -0.654 18533
1209 1 2 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.570 -0.831 18533
1210 1 2 . 1 1 99 99 ARG H H 98 7.740 7.740 7.768 -0.028 18533
1211 1 2 . 1 1 100 100 GLN N N 99 121.400 121.400 118.490 2.910 18533
1212 1 2 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.167 -0.097 18533
1213 1 2 . 1 1 100 100 GLN CA C 99 58.680 58.680 57.976 0.704 18533
1214 1 2 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.425 -0.105 18533
1215 1 2 . 1 1 100 100 GLN H H 99 8.030 8.030 8.139 -0.109 18533
1216 1 2 . 1 1 101 101 LEU N N 100 118.940 118.940 118.372 0.568 18533
1217 1 2 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.196 0.064 18533
1218 1 2 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.330 0.130 18533
1219 1 2 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.175 0.065 18533
1220 1 2 . 1 1 101 101 LEU H H 100 7.780 7.780 8.050 -0.270 18533
1221 1 2 . 1 1 102 102 GLY N N 101 105.740 105.740 104.541 1.199 18533
1222 1 2 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.346 0.684 18533
1223 1 2 . 1 1 102 102 GLY H H 101 7.700 7.700 7.509 0.191 18533
1224 1 2 . 1 1 103 103 VAL N N 102 122.330 122.330 121.587 0.743 18533
1225 1 2 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.126 -0.496 18533
1226 1 2 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.027 1.573 18533
1227 1 2 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.739 -2.249 18533
1228 1 2 . 1 1 103 103 VAL H H 102 7.520 7.520 7.871 -0.351 18533
1229 1 2 . 1 1 104 104 GLU N N 103 128.990 128.990 114.773 14.217 18533
1230 1 2 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.470 -0.300 18533
1231 1 2 . 1 1 104 104 GLU CA C 103 56.920 56.920 54.878 2.042 18533
1232 1 2 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.723 -3.773 18533
1233 1 2 . 1 1 104 104 GLU H H 103 9.210 9.210 8.030 1.180 18533
1234 1 2 . 1 1 105 105 ALA N N 104 124.410 124.410 122.328 2.082 18533
1235 1 2 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.241 -0.481 18533
1236 1 2 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.745 0.895 18533
1237 1 2 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.591 -0.451 18533
1238 1 2 . 1 1 105 105 ALA H H 104 8.500 8.500 8.657 -0.157 18533
1239 1 2 . 1 1 106 106 ALA N N 105 115.110 115.110 119.716 -4.606 18533
1240 1 2 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.229 -0.099 18533
1241 1 2 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.635 -0.595 18533
1242 1 2 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.897 0.163 18533
1243 1 2 . 1 1 106 106 ALA H H 105 8.270 8.270 8.171 0.099 18533
1244 1 2 . 1 1 107 107 ARG N N 106 115.080 115.080 115.789 -0.709 18533
1245 1 2 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.845 -0.385 18533
1246 1 2 . 1 1 107 107 ARG CA C 106 56.510 56.510 57.010 -0.500 18533
1247 1 2 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.727 0.643 18533
1248 1 2 . 1 1 107 107 ARG H H 106 7.740 7.740 7.949 -0.209 18533
1249 1 2 . 1 1 108 108 VAL N N 107 118.170 118.170 122.117 -3.947 18533
1250 1 2 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.156 0.914 18533
1251 1 2 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.360 -1.720 18533
1252 1 2 . 1 1 108 108 VAL CB C 107 33.600 33.600 31.921 1.679 18533
1253 1 2 . 1 1 108 108 VAL H H 107 7.290 7.290 8.184 -0.894 18533
1254 1 2 . 1 1 109 109 ARG N N 108 124.250 124.250 128.575 -4.325 18533
1255 1 2 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.634 -0.014 18533
1256 1 2 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.829 -0.939 18533
1257 1 2 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.327 0.653 18533
1258 1 2 . 1 1 109 109 ARG H H 108 8.420 8.420 9.197 -0.777 18533
1259 1 2 . 1 1 110 110 MET N N 109 119.570 119.570 121.582 -2.012 18533
1260 1 2 . 1 1 110 110 MET HA H 109 4.960 4.960 4.873 0.087 18533
1261 1 2 . 1 1 110 110 MET CA C 109 53.820 53.820 54.179 -0.359 18533
1262 1 2 . 1 1 110 110 MET CB C 109 30.680 30.680 32.292 -1.612 18533
1263 1 2 . 1 1 110 110 MET H H 109 8.890 8.890 8.631 0.259 18533
1264 1 2 . 1 1 111 111 LEU N N 110 128.660 128.660 126.649 2.011 18533
1265 1 2 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.269 -0.309 18533
1266 1 2 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.031 0.569 18533
1267 1 2 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.608 -0.528 18533
1268 1 2 . 1 1 111 111 LEU H H 110 9.200 9.200 9.106 0.094 18533
1269 1 2 . 1 1 112 112 ARG N N 111 111.910 111.910 116.098 -4.188 18533
1270 1 2 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.067 -0.117 18533
1271 1 2 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.584 1.336 18533
1272 1 2 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.635 -1.135 18533
1273 1 2 . 1 1 112 112 ARG H H 111 8.930 8.930 8.635 0.295 18533
1274 1 2 . 1 1 113 113 SER N N 112 114.800 114.800 114.969 -0.169 18533
1275 1 2 . 1 1 113 113 SER HA H 112 4.290 4.290 4.315 -0.025 18533
1276 1 2 . 1 1 113 113 SER CA C 112 60.880 60.880 59.677 1.203 18533
1277 1 2 . 1 1 113 113 SER CB C 112 63.190 63.190 62.714 0.476 18533
1278 1 2 . 1 1 113 113 SER H H 112 7.680 7.680 7.710 -0.030 18533
1279 1 2 . 1 1 114 114 PHE N N 113 119.260 119.260 118.653 0.607 18533
1280 1 2 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.524 -0.174 18533
1281 1 2 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.014 0.916 18533
1282 1 2 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.819 -0.099 18533
1283 1 2 . 1 1 114 114 PHE H H 113 7.600 7.600 7.625 -0.025 18533
1284 1 2 . 1 1 115 115 ASP N N 114 121.170 121.170 121.298 -0.128 18533
1285 1 2 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.995 0.025 18533
1286 1 2 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.133 -1.033 18533
1287 1 2 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.986 0.524 18533
1288 1 2 . 1 1 115 115 ASP H H 114 7.430 7.430 7.414 0.016 18533
1289 1 2 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.340 0.150 18533
1290 1 2 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.811 -0.461 18533
1291 1 2 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.039 0.230 18533
1292 1 2 . 1 1 117 117 ARG N N 116 117.910 117.910 116.569 1.341 18533
1293 1 2 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.483 -0.213 18533
1294 1 2 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.770 0.680 18533
1295 1 2 . 1 1 117 117 ARG CB C 116 29.960 29.960 29.821 0.139 18533
1296 1 2 . 1 1 117 117 ARG H H 116 8.580 8.580 7.822 0.758 18533
1297 1 2 . 1 1 118 118 SER N N 117 116.130 116.130 114.210 1.920 18533
1298 1 2 . 1 1 118 118 SER HA H 117 3.980 3.980 4.252 -0.272 18533
1299 1 2 . 1 1 118 118 SER CA C 117 59.790 59.790 60.672 -0.882 18533
1300 1 2 . 1 1 118 118 SER CB C 117 63.760 63.760 63.854 -0.094 18533
1301 1 2 . 1 1 118 118 SER H H 117 7.950 7.950 7.675 0.275 18533
1302 1 2 . 1 1 119 119 GLY N N 118 110.080 110.080 108.829 1.251 18533
1303 1 2 . 1 1 119 119 GLY CA C 118 45.370 45.370 45.583 -0.213 18533
1304 1 2 . 1 1 119 119 GLY H H 118 8.150 8.150 8.550 -0.400 18533
1305 1 2 . 1 1 120 120 THR HA H 119 4.020 4.020 4.432 -0.412 18533
1306 1 2 . 1 1 120 120 THR CA C 119 63.290 63.290 62.834 0.456 18533
1307 1 2 . 1 1 120 120 THR CB C 119 69.140 69.140 70.061 -0.922 18533
1308 1 2 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.755 -0.185 18533
1309 1 2 . 1 1 121 121 HIS CA C 120 56.010 56.010 54.559 1.452 18533
1310 1 2 . 1 1 121 121 HIS CB C 120 30.990 30.990 31.557 -0.567 18533
1311 1 2 . 1 1 122 122 ALA N N 121 125.880 125.880 123.194 2.686 18533
1312 1 2 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.357 -0.017 18533
1313 1 2 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.571 -0.061 18533
1314 1 2 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.434 -1.834 18533
1315 1 2 . 1 1 122 122 ALA H H 121 7.980 7.980 8.396 -0.416 18533
1316 1 2 . 1 1 123 123 LEU N N 122 119.810 119.810 118.198 1.612 18533
1317 1 2 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.445 -0.165 18533
1318 1 2 . 1 1 123 123 LEU CA C 122 54.490 54.490 55.528 -1.038 18533
1319 1 2 . 1 1 123 123 LEU CB C 122 43.700 43.700 43.850 -0.150 18533
1320 1 2 . 1 1 123 123 LEU H H 122 7.810 7.810 8.322 -0.512 18533
1321 1 2 . 1 1 124 124 ASP N N 123 119.050 119.050 117.201 1.849 18533
1322 1 2 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.566 0.004 18533
1323 1 2 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.653 1.667 18533
1324 1 2 . 1 1 124 124 ASP CB C 123 42.670 42.670 42.917 -0.247 18533
1325 1 2 . 1 1 124 124 ASP H H 123 8.270 8.270 7.603 0.667 18533
1326 1 2 . 1 1 125 125 VAL N N 124 121.970 121.970 123.355 -1.385 18533
1327 1 2 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.258 0.002 18533
1328 1 2 . 1 1 125 125 VAL CA C 124 62.310 62.310 61.297 1.013 18533
1329 1 2 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.364 -2.584 18533
1330 1 2 . 1 1 125 125 VAL H H 124 7.930 7.930 8.366 -0.436 18533
1331 1 2 . 1 1 126 126 GLU N N 125 129.490 129.490 125.635 3.855 18533
1332 1 2 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.117 -0.037 18533
1333 1 2 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.200 0.810 18533
1334 1 2 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.331 -0.531 18533
1335 1 2 . 1 1 126 126 GLU H H 125 9.100 9.100 8.399 0.701 18533
1336 1 2 . 1 1 127 127 ASP N N 126 122.300 122.300 117.743 4.557 18533
1337 1 2 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.840 -0.730 18533
1338 1 2 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.720 0.000 18533
1339 1 2 . 1 1 127 127 ASP CB C 126 42.520 42.520 43.116 -0.596 18533
1340 1 2 . 1 1 127 127 ASP H H 126 8.630 8.630 8.430 0.200 18533
1341 1 2 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.440 0.110 18533
1342 1 2 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.450 -0.850 18533
1343 1 2 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.224 -1.244 18533
1344 1 2 . 1 1 129 129 TYR N N 128 122.380 122.380 120.388 1.992 18533
1345 1 2 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.175 -0.375 18533
1346 1 2 . 1 1 129 129 TYR CA C 128 63.120 63.120 60.309 2.811 18533
1347 1 2 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.234 0.156 18533
1348 1 2 . 1 1 129 129 TYR H H 128 8.670 8.670 8.351 0.319 18533
1349 1 2 . 1 1 130 130 TYR N N 129 116.300 116.300 113.972 2.328 18533
1350 1 2 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.757 -0.267 18533
1351 1 2 . 1 1 130 130 TYR CA C 129 58.480 58.480 58.127 0.353 18533
1352 1 2 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.663 -3.003 18533
1353 1 2 . 1 1 130 130 TYR H H 129 8.680 8.680 8.249 0.431 18533
1354 1 2 . 1 1 131 131 GLY N N 130 110.870 110.870 109.515 1.355 18533
1355 1 2 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.799 -0.719 18533
1356 1 2 . 1 1 131 131 GLY H H 130 8.060 8.060 8.922 -0.862 18533
1357 1 2 . 1 1 132 132 ASP N N 131 121.590 121.590 120.308 1.282 18533
1358 1 2 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.463 0.607 18533
1359 1 2 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.628 0.372 18533
1360 1 2 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.175 1.425 18533
1361 1 2 . 1 1 132 132 ASP H H 131 9.290 9.290 7.472 1.818 18533
1362 1 2 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.239 -0.129 18533
1363 1 2 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.395 2.175 18533
1364 1 2 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.285 0.195 18533
1365 1 2 . 1 1 134 134 SER N N 133 115.370 115.370 114.845 0.525 18533
1366 1 2 . 1 1 134 134 SER HA H 133 4.180 4.180 4.025 0.155 18533
1367 1 2 . 1 1 134 134 SER CA C 133 62.070 62.070 62.443 -0.373 18533
1368 1 2 . 1 1 134 134 SER CB C 133 62.160 62.160 63.042 -0.882 18533
1369 1 2 . 1 1 134 134 SER H H 133 8.420 8.420 8.729 -0.309 18533
1370 1 2 . 1 1 135 135 ASP N N 134 123.360 123.360 122.241 1.119 18533
1371 1 2 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.393 0.137 18533
1372 1 2 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.306 0.734 18533
1373 1 2 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.421 0.389 18533
1374 1 2 . 1 1 135 135 ASP H H 134 7.980 7.980 8.111 -0.131 18533
1375 1 2 . 1 1 136 136 PHE N N 135 118.940 118.940 118.765 0.175 18533
1376 1 2 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.296 -0.496 18533
1377 1 2 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.398 3.421 18533
1378 1 2 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.195 1.155 18533
1379 1 2 . 1 1 136 136 PHE H H 135 7.850 7.850 7.933 -0.083 18533
1380 1 2 . 1 1 137 137 GLU N N 136 121.410 121.410 118.063 3.347 18533
1381 1 2 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.241 -0.061 18533
1382 1 2 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.981 0.519 18533
1383 1 2 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.361 -0.371 18533
1384 1 2 . 1 1 137 137 GLU H H 136 8.150 8.150 8.233 -0.083 18533
1385 1 2 . 1 1 138 138 GLU N N 137 121.530 121.530 121.719 -0.189 18533
1386 1 2 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.056 0.234 18533
1387 1 2 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.567 -0.167 18533
1388 1 2 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.170 -0.280 18533
1389 1 2 . 1 1 138 138 GLU H H 137 7.870 7.870 8.545 -0.675 18533
1390 1 2 . 1 1 139 139 VAL N N 138 119.930 119.930 119.672 0.258 18533
1391 1 2 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.710 -0.230 18533
1392 1 2 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.243 0.837 18533
1393 1 2 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.083 0.267 18533
1394 1 2 . 1 1 139 139 VAL H H 138 7.770 7.770 7.634 0.136 18533
1395 1 2 . 1 1 140 140 PHE N N 139 119.130 119.130 121.515 -2.385 18533
1396 1 2 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.035 -0.475 18533
1397 1 2 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.620 1.060 18533
1398 1 2 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.745 0.425 18533
1399 1 2 . 1 1 140 140 PHE H H 139 8.050 8.050 7.835 0.215 18533
1400 1 2 . 1 1 141 141 ALA N N 140 121.040 121.040 121.667 -0.627 18533
1401 1 2 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.240 -0.250 18533
1402 1 2 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.766 0.354 18533
1403 1 2 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.308 -0.008 18533
1404 1 2 . 1 1 141 141 ALA H H 140 8.010 8.010 8.104 -0.094 18533
1405 1 2 . 1 1 142 142 VAL N N 141 118.550 118.550 119.318 -0.768 18533
1406 1 2 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.505 0.305 18533
1407 1 2 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.596 -0.996 18533
1408 1 2 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.453 -0.003 18533
1409 1 2 . 1 1 142 142 VAL H H 141 8.300 8.300 7.879 0.421 18533
1410 1 2 . 1 1 143 143 ILE N N 142 121.410 121.410 118.975 2.435 18533
1411 1 2 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.384 0.006 18533
1412 1 2 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.304 0.746 18533
1413 1 2 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.634 -0.324 18533
1414 1 2 . 1 1 143 143 ILE H H 142 8.150 8.150 8.101 0.049 18533
1415 1 2 . 1 1 144 144 GLU N N 143 119.630 119.630 118.757 0.873 18533
1416 1 2 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.731 -0.191 18533
1417 1 2 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.021 0.739 18533
1418 1 2 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.615 1.115 18533
1419 1 2 . 1 1 144 144 GLU H H 143 8.640 8.640 8.108 0.532 18533
1420 1 2 . 1 1 145 145 SER N N 144 110.920 110.920 114.266 -3.346 18533
1421 1 2 . 1 1 145 145 SER HA H 144 4.230 4.230 4.254 -0.024 18533
1422 1 2 . 1 1 145 145 SER CA C 144 60.810 60.810 60.369 0.441 18533
1423 1 2 . 1 1 145 145 SER CB C 144 63.610 63.610 63.324 0.286 18533
1424 1 2 . 1 1 145 145 SER H H 144 7.640 7.640 7.947 -0.307 18533
1425 1 2 . 1 1 146 146 ALA N N 145 123.110 123.110 124.383 -1.273 18533
1426 1 2 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.264 -0.144 18533
1427 1 2 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.123 -0.723 18533
1428 1 2 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.353 2.527 18533
1429 1 2 . 1 1 146 146 ALA H H 145 7.500 7.500 7.666 -0.166 18533
1430 1 2 . 1 1 147 147 LEU N N 146 114.220 114.220 119.594 -5.374 18533
1431 1 2 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.831 0.109 18533
1432 1 2 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.442 -0.392 18533
1433 1 2 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.374 0.086 18533
1434 1 2 . 1 1 147 147 LEU H H 146 7.410 7.410 8.242 -0.832 18533
1435 1 2 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.402 0.048 18533
1436 1 2 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.672 3.168 18533
1437 1 2 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.022 0.198 18533
1438 1 2 . 1 1 149 149 GLY N N 148 102.590 102.590 106.875 -4.285 18533
1439 1 2 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.700 1.560 18533
1440 1 2 . 1 1 149 149 GLY H H 148 7.960 7.960 7.976 -0.016 18533
1441 1 2 . 1 1 150 150 LEU N N 149 128.060 128.060 123.450 4.610 18533
1442 1 2 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.281 0.349 18533
1443 1 2 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.263 0.087 18533
1444 1 2 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.449 -0.249 18533
1445 1 2 . 1 1 150 150 LEU H H 149 7.620 7.620 8.535 -0.915 18533
1446 1 2 . 1 1 151 151 HIS N N 150 120.730 120.730 118.399 2.331 18533
1447 1 2 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.284 -0.114 18533
1448 1 2 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.490 0.890 18533
1449 1 2 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.787 0.723 18533
1450 1 2 . 1 1 151 151 HIS H H 150 8.430 8.430 8.666 -0.236 18533
1451 1 2 . 1 1 152 152 ASP N N 151 118.170 118.170 119.891 -1.721 18533
1452 1 2 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.428 -0.008 18533
1453 1 2 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.942 -0.132 18533
1454 1 2 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.696 -0.666 18533
1455 1 2 . 1 1 152 152 ASP H H 151 7.820 7.820 8.222 -0.402 18533
1456 1 2 . 1 1 153 153 TRP N N 152 122.780 122.780 121.913 0.867 18533
1457 1 2 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.678 -0.568 18533
1458 1 2 . 1 1 153 153 TRP CA C 152 62.610 62.610 60.847 1.763 18533
1459 1 2 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.302 -0.512 18533
1460 1 2 . 1 1 153 153 TRP H H 152 7.900 7.900 7.896 0.004 18533
1461 1 2 . 1 1 154 154 VAL N N 153 119.460 119.460 117.766 1.694 18533
1462 1 2 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.956 -0.606 18533
1463 1 2 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.048 0.932 18533
1464 1 2 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.024 0.876 18533
1465 1 2 . 1 1 154 154 VAL H H 153 8.560 8.560 8.561 -0.001 18533
1466 1 2 . 1 1 155 155 ASP N N 154 120.500 120.500 121.587 -1.087 18533
1467 1 2 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.347 -0.147 18533
1468 1 2 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.481 -0.911 18533
1469 1 2 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.759 -0.899 18533
1470 1 2 . 1 1 155 155 ASP H H 154 8.530 8.530 8.919 -0.389 18533
1471 1 2 . 1 1 156 156 GLU N N 155 120.090 120.090 119.644 0.446 18533
1472 1 2 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.976 -0.046 18533
1473 1 2 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.234 -0.074 18533
1474 1 2 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.370 -0.080 18533
1475 1 2 . 1 1 156 156 GLU H H 155 7.870 7.870 8.351 -0.481 18533
1476 1 2 . 1 1 157 157 ARG N N 156 119.230 119.230 118.974 0.256 18533
1477 1 2 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.042 -0.232 18533
1478 1 2 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.133 -0.143 18533
1479 1 2 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.404 -0.294 18533
1480 1 2 . 1 1 157 157 ARG H H 156 7.660 7.660 8.009 -0.349 18533
1481 1 2 . 1 1 158 158 LEU N N 157 118.790 118.790 117.865 0.925 18533
1482 1 2 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.194 -0.094 18533
1483 1 2 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.889 -1.209 18533
1484 1 2 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.544 1.146 18533
1485 1 2 . 1 1 158 158 LEU H H 157 8.470 8.470 8.490 -0.020 18533
1486 1 2 . 1 1 159 159 ALA N N 158 120.760 120.760 123.095 -2.335 18533
1487 1 2 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.143 0.047 18533
1488 1 2 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.726 -1.446 18533
1489 1 2 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.804 -0.414 18533
1490 1 2 . 1 1 159 159 ALA H H 158 7.490 7.490 7.576 -0.086 18533
1491 1 2 . 1 1 160 160 ARG N N 159 117.810 117.810 116.316 1.494 18533
1492 1 2 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.197 0.013 18533
1493 1 2 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.599 0.181 18533
1494 1 2 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.789 0.741 18533
1495 1 2 . 1 1 160 160 ARG H H 159 7.650 7.650 7.782 -0.132 18533
1496 1 2 . 1 1 161 161 ASN N N 160 118.560 118.560 118.410 0.150 18533
1497 1 2 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.497 0.243 18533
1498 1 2 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.355 -2.105 18533
1499 1 2 . 1 1 161 161 ASN CB C 160 39.170 39.170 39.259 -0.089 18533
1500 1 2 . 1 1 161 161 ASN H H 160 8.100 8.100 7.858 0.242 18533
1501 1 2 . 1 1 162 162 GLY N N 161 108.900 108.900 105.274 3.626 18533
1502 1 2 . 1 1 162 162 GLY CA C 161 44.730 44.730 45.099 -0.369 18533
1503 1 2 . 1 1 162 162 GLY H H 161 7.980 7.980 7.383 0.597 18533
1504 1 2 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.543 -0.083 18533
1505 1 2 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.877 0.573 18533
1506 1 2 . 1 1 163 163 PRO CB C 162 32.200 32.200 30.847 1.353 18533
1507 1 3 . 1 1 2 2 MET N N 1 119.850 119.850 120.766 -0.916 18533
1508 1 3 . 1 1 2 2 MET HA H 1 4.500 4.500 4.706 -0.206 18533
1509 1 3 . 1 1 2 2 MET CA C 1 55.450 55.450 56.118 -0.668 18533
1510 1 3 . 1 1 2 2 MET CB C 1 33.170 33.170 31.916 1.254 18533
1511 1 3 . 1 1 2 2 MET H H 1 8.140 8.140 8.635 -0.495 18533
1512 1 3 . 1 1 3 3 SER N N 2 117.000 117.000 115.166 1.834 18533
1513 1 3 . 1 1 3 3 SER HA H 2 4.430 4.430 4.390 0.040 18533
1514 1 3 . 1 1 3 3 SER CA C 2 58.320 58.320 59.216 -0.896 18533
1515 1 3 . 1 1 3 3 SER CB C 2 63.990 63.990 64.453 -0.463 18533
1516 1 3 . 1 1 3 3 SER H H 2 8.340 8.340 8.210 0.130 18533
1517 1 3 . 1 1 4 4 ASP N N 3 123.200 123.200 117.500 5.700 18533
1518 1 3 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.983 -0.123 18533
1519 1 3 . 1 1 4 4 ASP CA C 3 52.880 52.880 51.886 0.994 18533
1520 1 3 . 1 1 4 4 ASP CB C 3 40.800 40.800 41.195 -0.395 18533
1521 1 3 . 1 1 4 4 ASP H H 3 8.260 8.260 7.732 0.528 18533
1522 1 3 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.576 -0.176 18533
1523 1 3 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.380 0.439 18533
1524 1 3 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.926 -1.016 18533
1525 1 3 . 1 1 6 6 LEU N N 5 123.160 123.160 120.407 2.753 18533
1526 1 3 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.504 -0.114 18533
1527 1 3 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.787 0.493 18533
1528 1 3 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.557 0.793 18533
1529 1 3 . 1 1 6 6 LEU H H 5 7.670 7.670 7.967 -0.297 18533
1530 1 3 . 1 1 7 7 HIS N N 6 127.160 127.160 119.216 7.944 18533
1531 1 3 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.888 1.142 18533
1532 1 3 . 1 1 7 7 HIS CA C 6 52.900 52.900 54.862 -1.962 18533
1533 1 3 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.191 0.940 18533
1534 1 3 . 1 1 7 7 HIS H H 6 10.080 10.080 8.586 1.494 18533
1535 1 3 . 1 1 8 8 VAL N N 7 128.620 128.620 127.411 1.209 18533
1536 1 3 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.838 -0.338 18533
1537 1 3 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.084 -0.284 18533
1538 1 3 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.267 2.533 18533
1539 1 3 . 1 1 8 8 VAL H H 7 8.930 8.930 9.121 -0.191 18533
1540 1 3 . 1 1 9 9 THR N N 8 121.530 121.530 122.868 -1.338 18533
1541 1 3 . 1 1 9 9 THR HA H 8 5.270 5.270 4.630 0.640 18533
1542 1 3 . 1 1 9 9 THR CA C 8 58.520 58.520 59.330 -0.810 18533
1543 1 3 . 1 1 9 9 THR CB C 8 70.750 70.750 70.109 0.641 18533
1544 1 3 . 1 1 9 9 THR H H 8 7.970 7.970 8.818 -0.848 18533
1545 1 3 . 1 1 10 10 PHE N N 9 125.360 125.360 128.095 -2.735 18533
1546 1 3 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.007 0.203 18533
1547 1 3 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.561 0.749 18533
1548 1 3 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.516 3.314 18533
1549 1 3 . 1 1 10 10 PHE H H 9 8.180 8.180 7.950 0.230 18533
1550 1 3 . 1 1 11 11 VAL N N 10 121.120 121.120 123.321 -2.201 18533
1551 1 3 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.000 0.360 18533
1552 1 3 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.599 -1.179 18533
1553 1 3 . 1 1 11 11 VAL CB C 10 35.550 35.550 32.501 3.049 18533
1554 1 3 . 1 1 11 11 VAL H H 10 8.710 8.710 9.268 -0.558 18533
1555 1 3 . 1 1 12 12 CYS N N 11 123.270 123.270 126.069 -2.799 18533
1556 1 3 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.583 -1.323 18533
1557 1 3 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.057 1.573 18533
1558 1 3 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.445 -1.095 18533
1559 1 3 . 1 1 12 12 CYS H H 11 7.940 7.940 8.591 -0.651 18533
1560 1 3 . 1 1 13 13 THR HA H 12 5.010 5.010 4.090 0.920 18533
1561 1 3 . 1 1 13 13 THR CA C 12 64.870 64.870 63.366 1.504 18533
1562 1 3 . 1 1 13 13 THR CB C 12 69.180 69.180 66.995 2.185 18533
1563 1 3 . 1 1 14 14 GLY CA C 13 44.960 44.960 44.938 0.022 18533
1564 1 3 . 1 1 15 15 ASN N N 14 119.960 119.960 116.551 3.409 18533
1565 1 3 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.368 -0.438 18533
1566 1 3 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.369 0.501 18533
1567 1 3 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.982 2.688 18533
1568 1 3 . 1 1 15 15 ASN H H 14 9.280 9.280 8.645 0.635 18533
1569 1 3 . 1 1 16 16 ILE N N 15 101.060 101.060 109.522 -8.462 18533
1570 1 3 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.616 0.064 18533
1571 1 3 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.819 0.971 18533
1572 1 3 . 1 1 16 16 ILE CB C 15 42.140 42.140 37.974 4.166 18533
1573 1 3 . 1 1 16 16 ILE H H 15 7.100 7.100 7.974 -0.874 18533
1574 1 3 . 1 1 17 17 CYS N N 16 116.020 116.020 116.820 -0.800 18533
1575 1 3 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.730 0.210 18533
1576 1 3 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.187 1.873 18533
1577 1 3 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.833 0.117 18533
1578 1 3 . 1 1 17 17 CYS H H 16 7.700 7.700 7.735 -0.035 18533
1579 1 3 . 1 1 19 19 SER N N 18 122.340 122.340 114.517 7.823 18533
1580 1 3 . 1 1 19 19 SER HA H 18 3.810 3.810 4.149 -0.339 18533
1581 1 3 . 1 1 19 19 SER CA C 18 62.710 62.710 63.502 -0.792 18533
1582 1 3 . 1 1 19 19 SER CB C 18 64.860 64.860 61.169 3.691 18533
1583 1 3 . 1 1 19 19 SER H H 18 11.420 11.420 8.623 2.797 18533
1584 1 3 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.083 -0.113 18533
1585 1 3 . 1 1 20 20 PRO CA C 19 65.030 65.030 65.025 0.005 18533
1586 1 3 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.834 -2.143 18533
1587 1 3 . 1 1 21 21 MET N N 20 112.430 112.430 117.972 -5.542 18533
1588 1 3 . 1 1 21 21 MET HA H 20 3.730 3.730 3.896 -0.166 18533
1589 1 3 . 1 1 21 21 MET CA C 20 60.160 60.160 59.680 0.480 18533
1590 1 3 . 1 1 21 21 MET CB C 20 33.040 33.040 32.196 0.844 18533
1591 1 3 . 1 1 21 21 MET H H 20 6.310 6.310 7.510 -1.200 18533
1592 1 3 . 1 1 22 22 ALA N N 21 117.800 117.800 119.948 -2.148 18533
1593 1 3 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.750 -0.350 18533
1594 1 3 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.600 0.390 18533
1595 1 3 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.598 -1.108 18533
1596 1 3 . 1 1 22 22 ALA H H 21 6.550 6.550 7.445 -0.895 18533
1597 1 3 . 1 1 23 23 GLU N N 22 115.520 115.520 118.612 -3.092 18533
1598 1 3 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.119 -0.439 18533
1599 1 3 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.675 -0.125 18533
1600 1 3 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.838 -0.048 18533
1601 1 3 . 1 1 23 23 GLU H H 22 7.800 7.800 7.844 -0.044 18533
1602 1 3 . 1 1 24 24 LYS N N 23 114.220 114.220 115.893 -1.673 18533
1603 1 3 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.198 -0.198 18533
1604 1 3 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.867 -0.107 18533
1605 1 3 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.404 -1.604 18533
1606 1 3 . 1 1 24 24 LYS H H 23 8.040 8.040 7.578 0.462 18533
1607 1 3 . 1 1 25 25 MET N N 24 115.250 115.250 120.210 -4.960 18533
1608 1 3 . 1 1 25 25 MET HA H 24 3.950 3.950 3.547 0.403 18533
1609 1 3 . 1 1 25 25 MET CA C 24 57.980 57.980 59.040 -1.060 18533
1610 1 3 . 1 1 25 25 MET CB C 24 35.500 35.500 32.531 2.969 18533
1611 1 3 . 1 1 25 25 MET H H 24 7.610 7.610 7.778 -0.168 18533
1612 1 3 . 1 1 26 26 PHE N N 25 119.090 119.090 116.391 2.699 18533
1613 1 3 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.560 -0.220 18533
1614 1 3 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.927 0.103 18533
1615 1 3 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.515 1.945 18533
1616 1 3 . 1 1 26 26 PHE H H 25 8.560 8.560 7.722 0.838 18533
1617 1 3 . 1 1 27 27 ALA N N 26 117.830 117.830 122.438 -4.608 18533
1618 1 3 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.768 0.162 18533
1619 1 3 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.113 0.947 18533
1620 1 3 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.885 0.525 18533
1621 1 3 . 1 1 27 27 ALA H H 26 8.800 8.800 7.228 1.572 18533
1622 1 3 . 1 1 28 28 GLN N N 27 117.550 117.550 118.479 -0.929 18533
1623 1 3 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.063 -0.013 18533
1624 1 3 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.912 0.698 18533
1625 1 3 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.873 0.577 18533
1626 1 3 . 1 1 28 28 GLN H H 27 7.690 7.690 7.835 -0.145 18533
1627 1 3 . 1 1 29 29 GLN N N 28 117.530 117.530 119.898 -2.368 18533
1628 1 3 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.054 0.086 18533
1629 1 3 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.939 0.241 18533
1630 1 3 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.962 -0.852 18533
1631 1 3 . 1 1 29 29 GLN H H 28 8.210 8.210 7.579 0.631 18533
1632 1 3 . 1 1 30 30 LEU N N 29 119.330 119.330 119.441 -0.111 18533
1633 1 3 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.048 -0.118 18533
1634 1 3 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.965 0.115 18533
1635 1 3 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.539 0.361 18533
1636 1 3 . 1 1 30 30 LEU H H 29 8.540 8.540 8.422 0.118 18533
1637 1 3 . 1 1 31 31 ARG N N 30 120.880 120.880 118.286 2.594 18533
1638 1 3 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.061 -0.091 18533
1639 1 3 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.180 0.610 18533
1640 1 3 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.329 0.191 18533
1641 1 3 . 1 1 31 31 ARG H H 30 8.050 8.050 8.391 -0.341 18533
1642 1 3 . 1 1 32 32 HIS N N 31 119.770 119.770 118.400 1.370 18533
1643 1 3 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.450 0.100 18533
1644 1 3 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.582 -0.502 18533
1645 1 3 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.200 0.510 18533
1646 1 3 . 1 1 32 32 HIS H H 31 8.440 8.440 8.502 -0.062 18533
1647 1 3 . 1 1 33 33 ARG N N 32 115.430 115.430 116.875 -1.445 18533
1648 1 3 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.490 0.100 18533
1649 1 3 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.062 -0.092 18533
1650 1 3 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.521 -0.301 18533
1651 1 3 . 1 1 33 33 ARG H H 32 7.500 7.500 7.791 -0.291 18533
1652 1 3 . 1 1 34 34 GLY N N 33 106.730 106.730 108.199 -1.469 18533
1653 1 3 . 1 1 34 34 GLY CA C 33 46.200 46.200 44.982 1.218 18533
1654 1 3 . 1 1 34 34 GLY H H 33 7.750 7.750 8.193 -0.443 18533
1655 1 3 . 1 1 35 35 LEU N N 34 119.980 119.980 118.310 1.670 18533
1656 1 3 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.778 -0.098 18533
1657 1 3 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.911 0.239 18533
1658 1 3 . 1 1 35 35 LEU CB C 34 43.190 43.190 41.977 1.213 18533
1659 1 3 . 1 1 35 35 LEU H H 34 7.980 7.980 8.673 -0.693 18533
1660 1 3 . 1 1 36 36 GLY N N 35 108.660 108.660 109.056 -0.396 18533
1661 1 3 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.707 -0.607 18533
1662 1 3 . 1 1 36 36 GLY H H 35 8.830 8.830 7.914 0.916 18533
1663 1 3 . 1 1 37 37 ASP N N 36 115.360 115.360 118.118 -2.758 18533
1664 1 3 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.690 0.080 18533
1665 1 3 . 1 1 37 37 ASP CA C 36 54.390 54.390 54.841 -0.451 18533
1666 1 3 . 1 1 37 37 ASP CB C 36 41.170 41.170 41.254 -0.084 18533
1667 1 3 . 1 1 37 37 ASP H H 36 8.300 8.300 8.165 0.135 18533
1668 1 3 . 1 1 38 38 ALA N N 37 121.460 121.460 119.673 1.787 18533
1669 1 3 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.201 0.109 18533
1670 1 3 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.329 -0.379 18533
1671 1 3 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.015 0.835 18533
1672 1 3 . 1 1 38 38 ALA H H 37 7.380 7.380 7.714 -0.334 18533
1673 1 3 . 1 1 39 39 VAL N N 38 115.660 115.660 116.509 -0.849 18533
1674 1 3 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.479 0.321 18533
1675 1 3 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.974 -0.934 18533
1676 1 3 . 1 1 39 39 VAL CB C 38 35.190 35.190 35.291 -0.101 18533
1677 1 3 . 1 1 39 39 VAL H H 38 7.100 7.100 7.994 -0.894 18533
1678 1 3 . 1 1 40 40 ARG N N 39 129.230 129.230 128.057 1.173 18533
1679 1 3 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.546 -0.006 18533
1680 1 3 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.441 1.268 18533
1681 1 3 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.912 1.408 18533
1682 1 3 . 1 1 40 40 ARG H H 39 9.730 9.730 8.430 1.300 18533
1683 1 3 . 1 1 41 41 VAL N N 40 126.240 126.240 123.340 2.900 18533
1684 1 3 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.918 0.772 18533
1685 1 3 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.109 -0.549 18533
1686 1 3 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.950 -1.010 18533
1687 1 3 . 1 1 41 41 VAL H H 40 8.610 8.610 8.498 0.112 18533
1688 1 3 . 1 1 42 42 THR N N 41 117.310 117.310 118.656 -1.346 18533
1689 1 3 . 1 1 42 42 THR HA H 41 4.890 4.890 4.878 0.012 18533
1690 1 3 . 1 1 42 42 THR CA C 41 60.300 60.300 59.538 0.763 18533
1691 1 3 . 1 1 42 42 THR CB C 41 73.890 73.890 71.610 2.280 18533
1692 1 3 . 1 1 42 42 THR H H 41 8.870 8.870 8.982 -0.112 18533
1693 1 3 . 1 1 43 43 SER N N 42 109.960 109.960 113.219 -3.259 18533
1694 1 3 . 1 1 43 43 SER HA H 42 5.720 5.720 4.854 0.866 18533
1695 1 3 . 1 1 43 43 SER CA C 42 58.090 58.090 57.928 0.162 18533
1696 1 3 . 1 1 43 43 SER CB C 42 65.870 65.870 66.275 -0.405 18533
1697 1 3 . 1 1 43 43 SER H H 42 8.060 8.060 8.606 -0.546 18533
1698 1 3 . 1 1 44 44 ALA N N 43 119.200 119.200 119.730 -0.530 18533
1699 1 3 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.193 -0.933 18533
1700 1 3 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.844 -0.664 18533
1701 1 3 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.812 -0.982 18533
1702 1 3 . 1 1 44 44 ALA H H 43 8.710 8.710 9.052 -0.342 18533
1703 1 3 . 1 1 45 45 GLY N N 44 104.090 104.090 106.380 -2.290 18533
1704 1 3 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.312 -1.772 18533
1705 1 3 . 1 1 45 45 GLY H H 44 8.670 8.670 8.263 0.407 18533
1706 1 3 . 1 1 46 46 THR N N 45 114.060 114.060 115.930 -1.870 18533
1707 1 3 . 1 1 46 46 THR HA H 45 4.080 4.080 4.080 -0.000 18533
1708 1 3 . 1 1 46 46 THR CA C 45 64.680 64.680 64.594 0.086 18533
1709 1 3 . 1 1 46 46 THR CB C 45 67.880 67.880 68.660 -0.780 18533
1710 1 3 . 1 1 46 46 THR H H 45 9.120 9.120 8.501 0.619 18533
1711 1 3 . 1 1 47 47 GLY N N 46 110.380 110.380 108.504 1.876 18533
1712 1 3 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.876 -0.046 18533
1713 1 3 . 1 1 47 47 GLY H H 46 8.930 8.930 8.390 0.540 18533
1714 1 3 . 1 1 48 48 ASN N N 47 113.440 113.440 117.488 -4.048 18533
1715 1 3 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.360 0.130 18533
1716 1 3 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.241 -2.481 18533
1717 1 3 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.750 2.100 18533
1718 1 3 . 1 1 48 48 ASN H H 47 7.600 7.600 7.665 -0.065 18533
1719 1 3 . 1 1 49 49 TRP N N 48 117.300 117.300 121.468 -4.168 18533
1720 1 3 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.415 -0.515 18533
1721 1 3 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.400 0.460 18533
1722 1 3 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.003 -0.482 18533
1723 1 3 . 1 1 49 49 TRP H H 48 6.920 6.920 8.586 -1.666 18533
1724 1 3 . 1 1 50 50 HIS N N 49 111.590 111.590 115.360 -3.770 18533
1725 1 3 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.839 0.041 18533
1726 1 3 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.521 -1.661 18533
1727 1 3 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.819 1.221 18533
1728 1 3 . 1 1 50 50 HIS H H 49 8.620 8.620 8.409 0.210 18533
1729 1 3 . 1 1 51 51 VAL N N 50 119.010 119.010 120.090 -1.080 18533
1730 1 3 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.688 -0.488 18533
1731 1 3 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.633 1.047 18533
1732 1 3 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.702 -0.312 18533
1733 1 3 . 1 1 51 51 VAL H H 50 6.880 6.880 7.386 -0.506 18533
1734 1 3 . 1 1 52 52 GLY N N 51 115.450 115.450 116.666 -1.216 18533
1735 1 3 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.536 -0.596 18533
1736 1 3 . 1 1 52 52 GLY H H 51 9.120 9.120 9.119 0.001 18533
1737 1 3 . 1 1 53 53 SER N N 52 116.620 116.620 116.389 0.231 18533
1738 1 3 . 1 1 53 53 SER HA H 52 4.610 4.610 4.790 -0.180 18533
1739 1 3 . 1 1 53 53 SER CA C 52 59.310 59.310 57.628 1.682 18533
1740 1 3 . 1 1 53 53 SER CB C 52 64.630 64.630 65.059 -0.429 18533
1741 1 3 . 1 1 53 53 SER H H 52 8.430 8.430 8.270 0.160 18533
1742 1 3 . 1 1 54 54 CYS N N 53 118.690 118.690 117.771 0.919 18533
1743 1 3 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.128 -0.028 18533
1744 1 3 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.384 1.286 18533
1745 1 3 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.385 -3.035 18533
1746 1 3 . 1 1 54 54 CYS H H 53 8.170 8.170 8.493 -0.323 18533
1747 1 3 . 1 1 55 55 ALA N N 54 118.580 118.580 124.180 -5.600 18533
1748 1 3 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.206 -0.086 18533
1749 1 3 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.923 -0.283 18533
1750 1 3 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.214 -2.584 18533
1751 1 3 . 1 1 55 55 ALA H H 54 8.420 8.420 8.552 -0.132 18533
1752 1 3 . 1 1 56 56 ASP N N 55 121.500 121.500 123.257 -1.757 18533
1753 1 3 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.371 -0.031 18533
1754 1 3 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.616 0.434 18533
1755 1 3 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.617 3.443 18533
1756 1 3 . 1 1 56 56 ASP H H 55 8.470 8.470 8.474 -0.004 18533
1757 1 3 . 1 1 57 57 GLU N N 56 127.840 127.840 126.689 1.151 18533
1758 1 3 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.844 0.196 18533
1759 1 3 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.308 0.332 18533
1760 1 3 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.381 0.119 18533
1761 1 3 . 1 1 57 57 GLU H H 56 9.230 9.230 8.917 0.313 18533
1762 1 3 . 1 1 58 58 ARG N N 57 120.820 120.820 118.456 2.364 18533
1763 1 3 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.764 0.046 18533
1764 1 3 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.110 0.040 18533
1765 1 3 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.686 -1.416 18533
1766 1 3 . 1 1 58 58 ARG H H 57 9.220 9.220 8.211 1.009 18533
1767 1 3 . 1 1 59 59 ALA N N 58 121.590 121.590 122.387 -0.797 18533
1768 1 3 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.148 0.012 18533
1769 1 3 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.424 0.356 18533
1770 1 3 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.054 0.436 18533
1771 1 3 . 1 1 59 59 ALA H H 58 6.680 6.680 7.557 -0.877 18533
1772 1 3 . 1 1 60 60 ALA N N 59 118.970 118.970 121.332 -2.362 18533
1773 1 3 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.935 -0.075 18533
1774 1 3 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.215 -0.195 18533
1775 1 3 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.325 -0.255 18533
1776 1 3 . 1 1 60 60 ALA H H 59 8.540 8.540 8.563 -0.023 18533
1777 1 3 . 1 1 61 61 GLY N N 60 104.160 104.160 106.735 -2.575 18533
1778 1 3 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.971 0.299 18533
1779 1 3 . 1 1 61 61 GLY H H 60 8.210 8.210 7.761 0.449 18533
1780 1 3 . 1 1 62 62 VAL N N 61 122.820 122.820 123.338 -0.518 18533
1781 1 3 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.602 0.248 18533
1782 1 3 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.788 -0.538 18533
1783 1 3 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.567 0.323 18533
1784 1 3 . 1 1 62 62 VAL H H 61 7.310 7.310 7.479 -0.169 18533
1785 1 3 . 1 1 63 63 LEU N N 62 120.310 120.310 119.159 1.151 18533
1786 1 3 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.239 -0.259 18533
1787 1 3 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.397 0.553 18533
1788 1 3 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.223 0.277 18533
1789 1 3 . 1 1 63 63 LEU H H 62 8.090 8.090 8.384 -0.294 18533
1790 1 3 . 1 1 64 64 ARG N N 63 119.440 119.440 119.872 -0.432 18533
1791 1 3 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.274 -0.094 18533
1792 1 3 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.923 0.527 18533
1793 1 3 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.623 0.757 18533
1794 1 3 . 1 1 64 64 ARG H H 63 8.740 8.740 8.473 0.267 18533
1795 1 3 . 1 1 65 65 ALA N N 64 122.560 122.560 121.941 0.619 18533
1796 1 3 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.080 -0.050 18533
1797 1 3 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.071 0.469 18533
1798 1 3 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.253 -0.173 18533
1799 1 3 . 1 1 65 65 ALA H H 64 7.910 7.910 7.990 -0.080 18533
1800 1 3 . 1 1 66 66 HIS N N 65 112.690 112.690 114.969 -2.279 18533
1801 1 3 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.604 0.036 18533
1802 1 3 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.125 -0.625 18533
1803 1 3 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.166 0.154 18533
1804 1 3 . 1 1 66 66 HIS H H 65 7.410 7.410 7.814 -0.404 18533
1805 1 3 . 1 1 67 67 GLY N N 66 107.440 107.440 107.488 -0.048 18533
1806 1 3 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.210 1.150 18533
1807 1 3 . 1 1 67 67 GLY H H 66 7.850 7.850 7.776 0.074 18533
1808 1 3 . 1 1 68 68 TYR N N 67 119.940 119.940 120.539 -0.599 18533
1809 1 3 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.757 0.043 18533
1810 1 3 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.364 0.736 18533
1811 1 3 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.993 0.867 18533
1812 1 3 . 1 1 68 68 TYR H H 67 8.380 8.380 8.236 0.144 18533
1813 1 3 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.518 0.042 18533
1814 1 3 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.918 -0.318 18533
1815 1 3 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.536 0.274 18533
1816 1 3 . 1 1 70 70 THR N N 69 100.660 100.660 107.682 -7.022 18533
1817 1 3 . 1 1 70 70 THR HA H 69 4.300 4.300 4.343 -0.043 18533
1818 1 3 . 1 1 70 70 THR CA C 69 61.250 61.250 61.368 -0.118 18533
1819 1 3 . 1 1 70 70 THR CB C 69 70.740 70.740 69.757 0.983 18533
1820 1 3 . 1 1 70 70 THR H H 69 7.860 7.860 8.051 -0.191 18533
1821 1 3 . 1 1 71 71 ASP N N 70 122.880 122.880 123.318 -0.438 18533
1822 1 3 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.474 -0.064 18533
1823 1 3 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.428 0.442 18533
1824 1 3 . 1 1 71 71 ASP CB C 70 40.970 40.970 40.854 0.116 18533
1825 1 3 . 1 1 71 71 ASP H H 70 7.940 7.940 8.046 -0.106 18533
1826 1 3 . 1 1 72 72 HIS N N 71 121.720 121.720 122.965 -1.245 18533
1827 1 3 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.715 -0.015 18533
1828 1 3 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.071 1.319 18533
1829 1 3 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.684 2.656 18533
1830 1 3 . 1 1 72 72 HIS H H 71 8.000 8.000 8.219 -0.219 18533
1831 1 3 . 1 1 73 73 ARG N N 72 125.760 125.760 126.752 -0.992 18533
1832 1 3 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.969 -0.679 18533
1833 1 3 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.141 0.289 18533
1834 1 3 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.157 0.153 18533
1835 1 3 . 1 1 73 73 ARG H H 72 7.230 7.230 8.045 -0.815 18533
1836 1 3 . 1 1 74 74 ALA N N 73 127.970 127.970 129.673 -1.703 18533
1837 1 3 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.650 -0.020 18533
1838 1 3 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.426 -0.246 18533
1839 1 3 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.003 -1.103 18533
1840 1 3 . 1 1 74 74 ALA H H 73 9.090 9.090 8.181 0.909 18533
1841 1 3 . 1 1 75 75 ALA N N 74 126.090 126.090 125.366 0.724 18533
1842 1 3 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.863 -0.073 18533
1843 1 3 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.277 0.693 18533
1844 1 3 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.259 1.361 18533
1845 1 3 . 1 1 75 75 ALA H H 74 9.410 9.410 9.614 -0.204 18533
1846 1 3 . 1 1 76 76 GLN N N 75 123.260 123.260 119.596 3.664 18533
1847 1 3 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.712 0.238 18533
1848 1 3 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.621 -0.071 18533
1849 1 3 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.392 -1.341 18533
1850 1 3 . 1 1 76 76 GLN H H 75 8.800 8.800 8.415 0.385 18533
1851 1 3 . 1 1 77 77 VAL N N 76 125.510 125.510 123.771 1.739 18533
1852 1 3 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.312 -0.012 18533
1853 1 3 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.273 0.307 18533
1854 1 3 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.776 1.714 18533
1855 1 3 . 1 1 77 77 VAL H H 76 8.550 8.550 7.969 0.581 18533
1856 1 3 . 1 1 78 78 GLY N N 77 121.850 121.850 116.287 5.563 18533
1857 1 3 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.043 -0.203 18533
1858 1 3 . 1 1 78 78 GLY H H 77 10.930 10.930 8.467 2.463 18533
1859 1 3 . 1 1 79 79 THR N N 78 115.210 115.210 115.750 -0.540 18533
1860 1 3 . 1 1 79 79 THR HA H 78 3.700 3.700 3.913 -0.213 18533
1861 1 3 . 1 1 79 79 THR CA C 78 66.440 66.440 67.472 -1.032 18533
1862 1 3 . 1 1 79 79 THR CB C 78 68.770 68.770 68.859 -0.089 18533
1863 1 3 . 1 1 79 79 THR H H 78 8.540 8.540 8.434 0.106 18533
1864 1 3 . 1 1 80 80 GLU N N 79 119.360 119.360 118.849 0.511 18533
1865 1 3 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.991 -0.031 18533
1866 1 3 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.670 0.360 18533
1867 1 3 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.837 0.223 18533
1868 1 3 . 1 1 80 80 GLU H H 79 9.110 9.110 8.849 0.261 18533
1869 1 3 . 1 1 81 81 HIS N N 80 118.380 118.380 116.803 1.577 18533
1870 1 3 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.255 -0.315 18533
1871 1 3 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.981 1.439 18533
1872 1 3 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.279 0.651 18533
1873 1 3 . 1 1 81 81 HIS H H 80 7.040 7.040 7.541 -0.501 18533
1874 1 3 . 1 1 82 82 LEU N N 81 114.010 114.010 119.987 -5.977 18533
1875 1 3 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.105 -0.205 18533
1876 1 3 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.841 -0.161 18533
1877 1 3 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.431 -0.701 18533
1878 1 3 . 1 1 82 82 LEU H H 81 7.850 7.850 8.229 -0.379 18533
1879 1 3 . 1 1 83 83 ALA N N 82 119.050 119.050 117.911 1.139 18533
1880 1 3 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.222 0.168 18533
1881 1 3 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.263 -0.063 18533
1882 1 3 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.925 0.255 18533
1883 1 3 . 1 1 83 83 ALA H H 82 6.950 6.950 7.475 -0.525 18533
1884 1 3 . 1 1 84 84 ALA N N 83 122.500 122.500 120.893 1.607 18533
1885 1 3 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.242 -0.482 18533
1886 1 3 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.805 1.545 18533
1887 1 3 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.494 -2.174 18533
1888 1 3 . 1 1 84 84 ALA H H 83 7.280 7.280 7.269 0.011 18533
1889 1 3 . 1 1 85 85 ASP N N 84 118.740 118.740 120.314 -1.574 18533
1890 1 3 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.809 -0.399 18533
1891 1 3 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.034 1.606 18533
1892 1 3 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.357 0.543 18533
1893 1 3 . 1 1 85 85 ASP H H 84 8.440 8.440 8.429 0.011 18533
1894 1 3 . 1 1 86 86 LEU N N 85 115.180 115.180 119.040 -3.860 18533
1895 1 3 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.847 -0.667 18533
1896 1 3 . 1 1 86 86 LEU CA C 85 55.040 55.040 54.002 1.038 18533
1897 1 3 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.638 0.532 18533
1898 1 3 . 1 1 86 86 LEU H H 85 7.280 7.280 8.183 -0.903 18533
1899 1 3 . 1 1 87 87 LEU N N 86 128.140 128.140 127.589 0.551 18533
1900 1 3 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.904 -0.214 18533
1901 1 3 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.310 2.070 18533
1902 1 3 . 1 1 87 87 LEU CB C 86 42.170 42.170 41.838 0.332 18533
1903 1 3 . 1 1 87 87 LEU H H 86 8.780 8.780 8.942 -0.162 18533
1904 1 3 . 1 1 88 88 VAL N N 87 122.630 122.630 127.012 -4.382 18533
1905 1 3 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.529 0.101 18533
1906 1 3 . 1 1 88 88 VAL CA C 87 59.910 59.910 62.670 -2.760 18533
1907 1 3 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.452 0.388 18533
1908 1 3 . 1 1 88 88 VAL H H 87 9.010 9.010 7.933 1.077 18533
1909 1 3 . 1 1 89 89 ALA N N 88 129.820 129.820 131.756 -1.936 18533
1910 1 3 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.910 -0.390 18533
1911 1 3 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.476 -0.696 18533
1912 1 3 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.308 -0.528 18533
1913 1 3 . 1 1 89 89 ALA H H 88 8.590 8.590 9.194 -0.604 18533
1914 1 3 . 1 1 90 90 LEU N N 89 129.280 129.280 119.963 9.317 18533
1915 1 3 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.588 -0.278 18533
1916 1 3 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.615 0.835 18533
1917 1 3 . 1 1 90 90 LEU CB C 89 38.020 38.020 42.053 -4.034 18533
1918 1 3 . 1 1 90 90 LEU H H 89 8.570 8.570 8.566 0.004 18533
1919 1 3 . 1 1 91 91 ASP N N 90 126.910 126.910 116.359 10.551 18533
1920 1 3 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.814 -0.014 18533
1921 1 3 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.421 -0.471 18533
1922 1 3 . 1 1 91 91 ASP CB C 90 43.810 43.810 44.077 -0.267 18533
1923 1 3 . 1 1 91 91 ASP H H 90 11.450 11.450 7.535 3.915 18533
1924 1 3 . 1 1 92 92 ARG N N 91 116.950 116.950 120.993 -4.043 18533
1925 1 3 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.965 0.055 18533
1926 1 3 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.508 -0.678 18533
1927 1 3 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.934 0.346 18533
1928 1 3 . 1 1 92 92 ARG H H 91 8.650 8.650 8.129 0.521 18533
1929 1 3 . 1 1 93 93 ASN N N 92 120.740 120.740 118.654 2.086 18533
1930 1 3 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.532 -0.152 18533
1931 1 3 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.984 0.146 18533
1932 1 3 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.392 0.228 18533
1933 1 3 . 1 1 93 93 ASN H H 92 8.610 8.610 8.186 0.424 18533
1934 1 3 . 1 1 94 94 HIS N N 93 121.170 121.170 119.545 1.625 18533
1935 1 3 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.313 -0.123 18533
1936 1 3 . 1 1 94 94 HIS CA C 93 59.510 59.510 58.944 0.566 18533
1937 1 3 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.484 1.896 18533
1938 1 3 . 1 1 94 94 HIS H H 93 7.430 7.430 7.706 -0.276 18533
1939 1 3 . 1 1 95 95 ALA N N 94 118.270 118.270 121.586 -3.316 18533
1940 1 3 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.969 -0.229 18533
1941 1 3 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.446 0.054 18533
1942 1 3 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.380 -0.410 18533
1943 1 3 . 1 1 95 95 ALA H H 94 7.190 7.190 8.334 -1.144 18533
1944 1 3 . 1 1 96 96 ARG N N 95 117.190 117.190 119.085 -1.895 18533
1945 1 3 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.034 -0.124 18533
1946 1 3 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.306 0.194 18533
1947 1 3 . 1 1 96 96 ARG CB C 95 30.230 30.230 29.902 0.328 18533
1948 1 3 . 1 1 96 96 ARG H H 95 7.600 7.600 7.746 -0.146 18533
1949 1 3 . 1 1 97 97 LEU N N 96 120.700 120.700 119.742 0.958 18533
1950 1 3 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.996 0.084 18533
1951 1 3 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.637 0.263 18533
1952 1 3 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.681 -0.341 18533
1953 1 3 . 1 1 97 97 LEU H H 96 7.990 7.990 7.805 0.185 18533
1954 1 3 . 1 1 98 98 LEU N N 97 118.390 118.390 118.467 -0.077 18533
1955 1 3 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.847 0.063 18533
1956 1 3 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.076 0.024 18533
1957 1 3 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.155 0.735 18533
1958 1 3 . 1 1 98 98 LEU H H 97 8.210 8.210 8.186 0.024 18533
1959 1 3 . 1 1 99 99 ARG N N 98 117.470 117.470 118.250 -0.780 18533
1960 1 3 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.071 0.409 18533
1961 1 3 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.012 -0.652 18533
1962 1 3 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.561 -0.821 18533
1963 1 3 . 1 1 99 99 ARG H H 98 7.740 7.740 7.801 -0.061 18533
1964 1 3 . 1 1 100 100 GLN N N 99 121.400 121.400 118.370 3.030 18533
1965 1 3 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.166 -0.096 18533
1966 1 3 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.181 0.499 18533
1967 1 3 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.417 -0.097 18533
1968 1 3 . 1 1 100 100 GLN H H 99 8.030 8.030 8.127 -0.097 18533
1969 1 3 . 1 1 101 101 LEU N N 100 118.940 118.940 117.363 1.577 18533
1970 1 3 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.227 0.033 18533
1971 1 3 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.338 0.122 18533
1972 1 3 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.390 -0.150 18533
1973 1 3 . 1 1 101 101 LEU H H 100 7.780 7.780 7.963 -0.183 18533
1974 1 3 . 1 1 102 102 GLY N N 101 105.740 105.740 103.833 1.907 18533
1975 1 3 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.434 0.597 18533
1976 1 3 . 1 1 102 102 GLY H H 101 7.700 7.700 7.563 0.137 18533
1977 1 3 . 1 1 103 103 VAL N N 102 122.330 122.330 121.310 1.020 18533
1978 1 3 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.089 -0.459 18533
1979 1 3 . 1 1 103 103 VAL CA C 102 63.600 63.600 61.864 1.736 18533
1980 1 3 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.657 -2.167 18533
1981 1 3 . 1 1 103 103 VAL H H 102 7.520 7.520 7.933 -0.413 18533
1982 1 3 . 1 1 104 104 GLU N N 103 128.990 128.990 114.585 14.405 18533
1983 1 3 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.441 -0.271 18533
1984 1 3 . 1 1 104 104 GLU CA C 103 56.920 56.920 54.802 2.118 18533
1985 1 3 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.742 -3.792 18533
1986 1 3 . 1 1 104 104 GLU H H 103 9.210 9.210 8.013 1.197 18533
1987 1 3 . 1 1 105 105 ALA N N 104 124.410 124.410 123.108 1.302 18533
1988 1 3 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.155 -0.395 18533
1989 1 3 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.148 0.492 18533
1990 1 3 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.707 -0.567 18533
1991 1 3 . 1 1 105 105 ALA H H 104 8.500 8.500 8.685 -0.185 18533
1992 1 3 . 1 1 106 106 ALA N N 105 115.110 115.110 120.394 -5.284 18533
1993 1 3 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.197 -0.067 18533
1994 1 3 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.732 -0.692 18533
1995 1 3 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.566 0.494 18533
1996 1 3 . 1 1 106 106 ALA H H 105 8.270 8.270 8.388 -0.118 18533
1997 1 3 . 1 1 107 107 ARG N N 106 115.080 115.080 114.605 0.475 18533
1998 1 3 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.945 -0.485 18533
1999 1 3 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.682 -0.173 18533
2000 1 3 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.695 0.675 18533
2001 1 3 . 1 1 107 107 ARG H H 106 7.740 7.740 7.785 -0.045 18533
2002 1 3 . 1 1 108 108 VAL N N 107 118.170 118.170 122.007 -3.837 18533
2003 1 3 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.117 0.953 18533
2004 1 3 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.289 -1.649 18533
2005 1 3 . 1 1 108 108 VAL CB C 107 33.600 33.600 31.796 1.804 18533
2006 1 3 . 1 1 108 108 VAL H H 107 7.290 7.290 8.257 -0.967 18533
2007 1 3 . 1 1 109 109 ARG N N 108 124.250 124.250 128.720 -4.470 18533
2008 1 3 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.612 0.008 18533
2009 1 3 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.769 -0.879 18533
2010 1 3 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.164 0.816 18533
2011 1 3 . 1 1 109 109 ARG H H 108 8.420 8.420 8.896 -0.476 18533
2012 1 3 . 1 1 110 110 MET N N 109 119.570 119.570 121.644 -2.074 18533
2013 1 3 . 1 1 110 110 MET HA H 109 4.960 4.960 4.927 0.033 18533
2014 1 3 . 1 1 110 110 MET CA C 109 53.820 53.820 54.193 -0.373 18533
2015 1 3 . 1 1 110 110 MET CB C 109 30.680 30.680 32.304 -1.624 18533
2016 1 3 . 1 1 110 110 MET H H 109 8.890 8.890 8.591 0.299 18533
2017 1 3 . 1 1 111 111 LEU N N 110 128.660 128.660 126.855 1.805 18533
2018 1 3 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.288 -0.328 18533
2019 1 3 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.136 0.463 18533
2020 1 3 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.894 -0.813 18533
2021 1 3 . 1 1 111 111 LEU H H 110 9.200 9.200 9.019 0.181 18533
2022 1 3 . 1 1 112 112 ARG N N 111 111.910 111.910 116.247 -4.337 18533
2023 1 3 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.070 -0.120 18533
2024 1 3 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.631 1.289 18533
2025 1 3 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.574 -1.074 18533
2026 1 3 . 1 1 112 112 ARG H H 111 8.930 8.930 8.610 0.320 18533
2027 1 3 . 1 1 113 113 SER N N 112 114.800 114.800 115.240 -0.440 18533
2028 1 3 . 1 1 113 113 SER HA H 112 4.290 4.290 4.262 0.028 18533
2029 1 3 . 1 1 113 113 SER CA C 112 60.880 60.880 59.748 1.132 18533
2030 1 3 . 1 1 113 113 SER CB C 112 63.190 63.190 62.477 0.713 18533
2031 1 3 . 1 1 113 113 SER H H 112 7.680 7.680 7.633 0.047 18533
2032 1 3 . 1 1 114 114 PHE N N 113 119.260 119.260 118.175 1.085 18533
2033 1 3 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.446 -0.096 18533
2034 1 3 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.306 0.624 18533
2035 1 3 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.635 0.085 18533
2036 1 3 . 1 1 114 114 PHE H H 113 7.600 7.600 7.535 0.065 18533
2037 1 3 . 1 1 115 115 ASP N N 114 121.170 121.170 121.574 -0.404 18533
2038 1 3 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.918 0.102 18533
2039 1 3 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.688 -1.588 18533
2040 1 3 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.511 0.999 18533
2041 1 3 . 1 1 115 115 ASP H H 114 7.430 7.430 7.602 -0.172 18533
2042 1 3 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.381 0.109 18533
2043 1 3 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.179 0.171 18533
2044 1 3 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.083 0.187 18533
2045 1 3 . 1 1 117 117 ARG N N 116 117.910 117.910 117.448 0.462 18533
2046 1 3 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.360 -0.090 18533
2047 1 3 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.600 -0.150 18533
2048 1 3 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.535 -0.575 18533
2049 1 3 . 1 1 117 117 ARG H H 116 8.580 8.580 8.002 0.578 18533
2050 1 3 . 1 1 118 118 SER N N 117 116.130 116.130 116.481 -0.351 18533
2051 1 3 . 1 1 118 118 SER HA H 117 3.980 3.980 4.413 -0.433 18533
2052 1 3 . 1 1 118 118 SER CA C 117 59.790 59.790 58.901 0.889 18533
2053 1 3 . 1 1 118 118 SER CB C 117 63.760 63.760 62.009 1.751 18533
2054 1 3 . 1 1 118 118 SER H H 117 7.950 7.950 7.517 0.433 18533
2055 1 3 . 1 1 119 119 GLY N N 118 110.080 110.080 113.500 -3.420 18533
2056 1 3 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.273 -0.903 18533
2057 1 3 . 1 1 119 119 GLY H H 118 8.150 8.150 7.945 0.205 18533
2058 1 3 . 1 1 120 120 THR HA H 119 4.020 4.020 4.384 -0.364 18533
2059 1 3 . 1 1 120 120 THR CA C 119 63.290 63.290 61.346 1.944 18533
2060 1 3 . 1 1 120 120 THR CB C 119 69.140 69.140 69.804 -0.664 18533
2061 1 3 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.465 0.105 18533
2062 1 3 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.814 0.196 18533
2063 1 3 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.392 0.598 18533
2064 1 3 . 1 1 122 122 ALA N N 121 125.880 125.880 128.825 -2.945 18533
2065 1 3 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.418 -0.078 18533
2066 1 3 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.392 0.118 18533
2067 1 3 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.887 -0.287 18533
2068 1 3 . 1 1 122 122 ALA H H 121 7.980 7.980 8.623 -0.643 18533
2069 1 3 . 1 1 123 123 LEU N N 122 119.810 119.810 121.568 -1.758 18533
2070 1 3 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.478 -0.198 18533
2071 1 3 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.034 0.456 18533
2072 1 3 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.455 2.245 18533
2073 1 3 . 1 1 123 123 LEU H H 122 7.810 7.810 8.305 -0.495 18533
2074 1 3 . 1 1 124 124 ASP N N 123 119.050 119.050 113.820 5.230 18533
2075 1 3 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.585 -0.015 18533
2076 1 3 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.373 1.947 18533
2077 1 3 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.377 -0.707 18533
2078 1 3 . 1 1 124 124 ASP H H 123 8.270 8.270 7.559 0.711 18533
2079 1 3 . 1 1 125 125 VAL N N 124 121.970 121.970 119.934 2.036 18533
2080 1 3 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.409 -0.149 18533
2081 1 3 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.342 1.968 18533
2082 1 3 . 1 1 125 125 VAL CB C 124 30.780 30.780 35.271 -4.491 18533
2083 1 3 . 1 1 125 125 VAL H H 124 7.930 7.930 8.163 -0.233 18533
2084 1 3 . 1 1 126 126 GLU N N 125 129.490 129.490 122.179 7.311 18533
2085 1 3 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.350 -0.270 18533
2086 1 3 . 1 1 126 126 GLU CA C 125 57.010 57.010 55.613 1.397 18533
2087 1 3 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.457 -0.658 18533
2088 1 3 . 1 1 126 126 GLU H H 125 9.100 9.100 8.354 0.746 18533
2089 1 3 . 1 1 127 127 ASP N N 126 122.300 122.300 117.538 4.762 18533
2090 1 3 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.571 -0.461 18533
2091 1 3 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.909 -0.189 18533
2092 1 3 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.200 0.320 18533
2093 1 3 . 1 1 127 127 ASP H H 126 8.630 8.630 8.112 0.518 18533
2094 1 3 . 1 1 128 128 PRO HA H 127 4.550 4.550 3.628 0.922 18533
2095 1 3 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.639 -0.039 18533
2096 1 3 . 1 1 128 128 PRO CB C 127 30.980 30.980 31.072 -0.092 18533
2097 1 3 . 1 1 129 129 TYR N N 128 122.380 122.380 123.270 -0.890 18533
2098 1 3 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.335 -0.535 18533
2099 1 3 . 1 1 129 129 TYR CA C 128 63.120 63.120 58.687 4.433 18533
2100 1 3 . 1 1 129 129 TYR CB C 128 39.390 39.390 37.913 1.477 18533
2101 1 3 . 1 1 129 129 TYR H H 128 8.670 8.670 7.712 0.958 18533
2102 1 3 . 1 1 130 130 TYR N N 129 116.300 116.300 116.197 0.103 18533
2103 1 3 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.383 0.107 18533
2104 1 3 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.687 1.793 18533
2105 1 3 . 1 1 130 130 TYR CB C 129 36.660 36.660 37.902 -1.242 18533
2106 1 3 . 1 1 130 130 TYR H H 129 8.680 8.680 7.099 1.581 18533
2107 1 3 . 1 1 131 131 GLY N N 130 110.870 110.870 109.467 1.403 18533
2108 1 3 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.075 -0.995 18533
2109 1 3 . 1 1 131 131 GLY H H 130 8.060 8.060 8.450 -0.390 18533
2110 1 3 . 1 1 132 132 ASP N N 131 121.590 121.590 118.474 3.116 18533
2111 1 3 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.641 0.429 18533
2112 1 3 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.722 0.278 18533
2113 1 3 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.509 1.091 18533
2114 1 3 . 1 1 132 132 ASP H H 131 9.290 9.290 7.708 1.582 18533
2115 1 3 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.205 -0.095 18533
2116 1 3 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.492 2.078 18533
2117 1 3 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.403 0.077 18533
2118 1 3 . 1 1 134 134 SER N N 133 115.370 115.370 113.911 1.459 18533
2119 1 3 . 1 1 134 134 SER HA H 133 4.180 4.180 4.090 0.090 18533
2120 1 3 . 1 1 134 134 SER CA C 133 62.070 62.070 61.644 0.426 18533
2121 1 3 . 1 1 134 134 SER CB C 133 62.160 62.160 62.851 -0.691 18533
2122 1 3 . 1 1 134 134 SER H H 133 8.420 8.420 8.879 -0.459 18533
2123 1 3 . 1 1 135 135 ASP N N 134 123.360 123.360 121.642 1.718 18533
2124 1 3 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.429 0.101 18533
2125 1 3 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.974 1.066 18533
2126 1 3 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.113 0.697 18533
2127 1 3 . 1 1 135 135 ASP H H 134 7.980 7.980 8.138 -0.158 18533
2128 1 3 . 1 1 136 136 PHE N N 135 118.940 118.940 118.983 -0.043 18533
2129 1 3 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.220 -0.420 18533
2130 1 3 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.933 2.887 18533
2131 1 3 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.199 1.151 18533
2132 1 3 . 1 1 136 136 PHE H H 135 7.850 7.850 7.581 0.269 18533
2133 1 3 . 1 1 137 137 GLU N N 136 121.410 121.410 117.866 3.544 18533
2134 1 3 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.237 -0.057 18533
2135 1 3 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.783 0.717 18533
2136 1 3 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.252 -0.262 18533
2137 1 3 . 1 1 137 137 GLU H H 136 8.150 8.150 8.169 -0.019 18533
2138 1 3 . 1 1 138 138 GLU N N 137 121.530 121.530 121.960 -0.430 18533
2139 1 3 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.088 0.202 18533
2140 1 3 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.386 0.014 18533
2141 1 3 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.079 -0.189 18533
2142 1 3 . 1 1 138 138 GLU H H 137 7.870 7.870 8.351 -0.481 18533
2143 1 3 . 1 1 139 139 VAL N N 138 119.930 119.930 119.724 0.206 18533
2144 1 3 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.553 -0.073 18533
2145 1 3 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.584 0.496 18533
2146 1 3 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.676 -0.326 18533
2147 1 3 . 1 1 139 139 VAL H H 138 7.770 7.770 7.536 0.234 18533
2148 1 3 . 1 1 140 140 PHE N N 139 119.130 119.130 120.628 -1.498 18533
2149 1 3 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.095 -0.535 18533
2150 1 3 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.268 1.412 18533
2151 1 3 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.959 0.211 18533
2152 1 3 . 1 1 140 140 PHE H H 139 8.050 8.050 7.782 0.268 18533
2153 1 3 . 1 1 141 141 ALA N N 140 121.040 121.040 122.457 -1.417 18533
2154 1 3 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.199 -0.209 18533
2155 1 3 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.835 0.285 18533
2156 1 3 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.378 -0.078 18533
2157 1 3 . 1 1 141 141 ALA H H 140 8.010 8.010 8.377 -0.367 18533
2158 1 3 . 1 1 142 142 VAL N N 141 118.550 118.550 118.466 0.084 18533
2159 1 3 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.464 0.346 18533
2160 1 3 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.754 -1.155 18533
2161 1 3 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.671 -0.221 18533
2162 1 3 . 1 1 142 142 VAL H H 141 8.300 8.300 8.118 0.182 18533
2163 1 3 . 1 1 143 143 ILE N N 142 121.410 121.410 119.260 2.150 18533
2164 1 3 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.460 -0.070 18533
2165 1 3 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.251 0.799 18533
2166 1 3 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.789 -0.479 18533
2167 1 3 . 1 1 143 143 ILE H H 142 8.150 8.150 7.761 0.389 18533
2168 1 3 . 1 1 144 144 GLU N N 143 119.630 119.630 119.565 0.065 18533
2169 1 3 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.740 -0.200 18533
2170 1 3 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.160 0.600 18533
2171 1 3 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.912 0.818 18533
2172 1 3 . 1 1 144 144 GLU H H 143 8.640 8.640 8.151 0.489 18533
2173 1 3 . 1 1 145 145 SER N N 144 110.920 110.920 113.740 -2.820 18533
2174 1 3 . 1 1 145 145 SER HA H 144 4.230 4.230 4.230 0.000 18533
2175 1 3 . 1 1 145 145 SER CA C 144 60.810 60.810 60.600 0.210 18533
2176 1 3 . 1 1 145 145 SER CB C 144 63.610 63.610 63.499 0.111 18533
2177 1 3 . 1 1 145 145 SER H H 144 7.640 7.640 8.082 -0.442 18533
2178 1 3 . 1 1 146 146 ALA N N 145 123.110 123.110 124.414 -1.304 18533
2179 1 3 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.345 -0.225 18533
2180 1 3 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.125 -0.725 18533
2181 1 3 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.382 2.498 18533
2182 1 3 . 1 1 146 146 ALA H H 145 7.500 7.500 7.607 -0.107 18533
2183 1 3 . 1 1 147 147 LEU N N 146 114.220 114.220 119.666 -5.446 18533
2184 1 3 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.849 0.091 18533
2185 1 3 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.508 -0.458 18533
2186 1 3 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.404 0.056 18533
2187 1 3 . 1 1 147 147 LEU H H 146 7.410 7.410 8.199 -0.789 18533
2188 1 3 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.374 0.076 18533
2189 1 3 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.663 3.177 18533
2190 1 3 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.010 0.210 18533
2191 1 3 . 1 1 149 149 GLY N N 148 102.590 102.590 106.813 -4.223 18533
2192 1 3 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.685 1.575 18533
2193 1 3 . 1 1 149 149 GLY H H 148 7.960 7.960 7.942 0.018 18533
2194 1 3 . 1 1 150 150 LEU N N 149 128.060 128.060 123.492 4.568 18533
2195 1 3 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.284 0.346 18533
2196 1 3 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.255 0.095 18533
2197 1 3 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.335 -0.135 18533
2198 1 3 . 1 1 150 150 LEU H H 149 7.620 7.620 8.482 -0.862 18533
2199 1 3 . 1 1 151 151 HIS N N 150 120.730 120.730 118.339 2.391 18533
2200 1 3 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.094 0.076 18533
2201 1 3 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.532 0.848 18533
2202 1 3 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.792 0.718 18533
2203 1 3 . 1 1 151 151 HIS H H 150 8.430 8.430 8.511 -0.081 18533
2204 1 3 . 1 1 152 152 ASP N N 151 118.170 118.170 119.924 -1.754 18533
2205 1 3 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.399 0.021 18533
2206 1 3 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.898 -0.088 18533
2207 1 3 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.679 -0.649 18533
2208 1 3 . 1 1 152 152 ASP H H 151 7.820 7.820 8.032 -0.212 18533
2209 1 3 . 1 1 153 153 TRP N N 152 122.780 122.780 122.112 0.668 18533
2210 1 3 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.708 -0.598 18533
2211 1 3 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.021 1.589 18533
2212 1 3 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.277 -0.487 18533
2213 1 3 . 1 1 153 153 TRP H H 152 7.900 7.900 7.898 0.002 18533
2214 1 3 . 1 1 154 154 VAL N N 153 119.460 119.460 116.649 2.811 18533
2215 1 3 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.813 -0.463 18533
2216 1 3 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.349 0.631 18533
2217 1 3 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.551 0.349 18533
2218 1 3 . 1 1 154 154 VAL H H 153 8.560 8.560 8.630 -0.070 18533
2219 1 3 . 1 1 155 155 ASP N N 154 120.500 120.500 121.397 -0.897 18533
2220 1 3 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.321 -0.121 18533
2221 1 3 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.348 -0.778 18533
2222 1 3 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.850 -0.990 18533
2223 1 3 . 1 1 155 155 ASP H H 154 8.530 8.530 8.695 -0.165 18533
2224 1 3 . 1 1 156 156 GLU N N 155 120.090 120.090 119.622 0.468 18533
2225 1 3 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.947 -0.017 18533
2226 1 3 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.245 -0.085 18533
2227 1 3 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.337 -0.047 18533
2228 1 3 . 1 1 156 156 GLU H H 155 7.870 7.870 8.343 -0.473 18533
2229 1 3 . 1 1 157 157 ARG N N 156 119.230 119.230 119.124 0.106 18533
2230 1 3 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.004 -0.194 18533
2231 1 3 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.233 -0.243 18533
2232 1 3 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.350 -0.240 18533
2233 1 3 . 1 1 157 157 ARG H H 156 7.660 7.660 8.061 -0.401 18533
2234 1 3 . 1 1 158 158 LEU N N 157 118.790 118.790 116.445 2.345 18533
2235 1 3 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.235 -0.135 18533
2236 1 3 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.328 -0.648 18533
2237 1 3 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.963 0.727 18533
2238 1 3 . 1 1 158 158 LEU H H 157 8.470 8.470 8.235 0.235 18533
2239 1 3 . 1 1 159 159 ALA N N 158 120.760 120.760 121.067 -0.307 18533
2240 1 3 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.235 -0.045 18533
2241 1 3 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.423 -1.143 18533
2242 1 3 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.310 -0.920 18533
2243 1 3 . 1 1 159 159 ALA H H 158 7.490 7.490 7.616 -0.126 18533
2244 1 3 . 1 1 160 160 ARG N N 159 117.810 117.810 115.685 2.125 18533
2245 1 3 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.167 0.043 18533
2246 1 3 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.848 -0.068 18533
2247 1 3 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.922 0.608 18533
2248 1 3 . 1 1 160 160 ARG H H 159 7.650 7.650 7.951 -0.301 18533
2249 1 3 . 1 1 161 161 ASN N N 160 118.560 118.560 120.275 -1.715 18533
2250 1 3 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.700 0.040 18533
2251 1 3 . 1 1 161 161 ASN CA C 160 53.250 53.250 52.036 1.214 18533
2252 1 3 . 1 1 161 161 ASN CB C 160 39.170 39.170 37.908 1.262 18533
2253 1 3 . 1 1 161 161 ASN H H 160 8.100 8.100 7.839 0.261 18533
2254 1 3 . 1 1 162 162 GLY N N 161 108.900 108.900 107.182 1.718 18533
2255 1 3 . 1 1 162 162 GLY CA C 161 44.730 44.730 42.649 2.081 18533
2256 1 3 . 1 1 162 162 GLY H H 161 7.980 7.980 7.139 0.841 18533
2257 1 3 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.674 -0.214 18533
2258 1 3 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.149 1.301 18533
2259 1 3 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.147 0.053 18533
2260 1 4 . 1 1 2 2 MET N N 1 119.850 119.850 121.609 -1.759 18533
2261 1 4 . 1 1 2 2 MET HA H 1 4.500 4.500 4.625 -0.125 18533
2262 1 4 . 1 1 2 2 MET CA C 1 55.450 55.450 53.539 1.911 18533
2263 1 4 . 1 1 2 2 MET CB C 1 33.170 33.170 30.433 2.737 18533
2264 1 4 . 1 1 2 2 MET H H 1 8.140 8.140 8.317 -0.177 18533
2265 1 4 . 1 1 3 3 SER N N 2 117.000 117.000 119.647 -2.647 18533
2266 1 4 . 1 1 3 3 SER HA H 2 4.430 4.430 4.384 0.046 18533
2267 1 4 . 1 1 3 3 SER CA C 2 58.320 58.320 58.666 -0.346 18533
2268 1 4 . 1 1 3 3 SER CB C 2 63.990 63.990 63.472 0.518 18533
2269 1 4 . 1 1 3 3 SER H H 2 8.340 8.340 8.068 0.272 18533
2270 1 4 . 1 1 4 4 ASP N N 3 123.200 123.200 128.254 -5.054 18533
2271 1 4 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.755 0.105 18533
2272 1 4 . 1 1 4 4 ASP CA C 3 52.880 52.880 53.077 -0.197 18533
2273 1 4 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.430 0.370 18533
2274 1 4 . 1 1 4 4 ASP H H 3 8.260 8.260 8.250 0.010 18533
2275 1 4 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.633 -0.233 18533
2276 1 4 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.528 0.292 18533
2277 1 4 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.691 -0.781 18533
2278 1 4 . 1 1 6 6 LEU N N 5 123.160 123.160 119.724 3.436 18533
2279 1 4 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.397 -0.007 18533
2280 1 4 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.118 0.162 18533
2281 1 4 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.630 0.720 18533
2282 1 4 . 1 1 6 6 LEU H H 5 7.670 7.670 7.891 -0.221 18533
2283 1 4 . 1 1 7 7 HIS N N 6 127.160 127.160 117.895 9.265 18533
2284 1 4 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.944 1.086 18533
2285 1 4 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.322 -2.422 18533
2286 1 4 . 1 1 7 7 HIS CB C 6 32.130 32.130 30.978 1.152 18533
2287 1 4 . 1 1 7 7 HIS H H 6 10.080 10.080 8.634 1.446 18533
2288 1 4 . 1 1 8 8 VAL N N 7 128.620 128.620 126.877 1.743 18533
2289 1 4 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.968 -0.468 18533
2290 1 4 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.764 0.036 18533
2291 1 4 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.438 3.362 18533
2292 1 4 . 1 1 8 8 VAL H H 7 8.930 8.930 9.115 -0.185 18533
2293 1 4 . 1 1 9 9 THR N N 8 121.530 121.530 123.637 -2.107 18533
2294 1 4 . 1 1 9 9 THR HA H 8 5.270 5.270 4.707 0.563 18533
2295 1 4 . 1 1 9 9 THR CA C 8 58.520 58.520 59.444 -0.924 18533
2296 1 4 . 1 1 9 9 THR CB C 8 70.750 70.750 69.608 1.142 18533
2297 1 4 . 1 1 9 9 THR H H 8 7.970 7.970 9.008 -1.038 18533
2298 1 4 . 1 1 10 10 PHE N N 9 125.360 125.360 128.471 -3.111 18533
2299 1 4 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.089 0.121 18533
2300 1 4 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.330 -0.020 18533
2301 1 4 . 1 1 10 10 PHE CB C 9 42.830 42.830 40.047 2.783 18533
2302 1 4 . 1 1 10 10 PHE H H 9 8.180 8.180 8.303 -0.123 18533
2303 1 4 . 1 1 11 11 VAL N N 10 121.120 121.120 119.947 1.173 18533
2304 1 4 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.366 -0.006 18533
2305 1 4 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.816 -0.396 18533
2306 1 4 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.353 2.197 18533
2307 1 4 . 1 1 11 11 VAL H H 10 8.710 8.710 9.218 -0.508 18533
2308 1 4 . 1 1 12 12 CYS N N 11 123.270 123.270 125.496 -2.226 18533
2309 1 4 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.136 -0.876 18533
2310 1 4 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.520 1.110 18533
2311 1 4 . 1 1 12 12 CYS CB C 11 30.350 30.350 32.026 -1.676 18533
2312 1 4 . 1 1 12 12 CYS H H 11 7.940 7.940 8.616 -0.676 18533
2313 1 4 . 1 1 13 13 THR HA H 12 5.010 5.010 4.133 0.877 18533
2314 1 4 . 1 1 13 13 THR CA C 12 64.870 64.870 63.543 1.327 18533
2315 1 4 . 1 1 13 13 THR CB C 12 69.180 69.180 67.328 1.852 18533
2316 1 4 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.261 -0.301 18533
2317 1 4 . 1 1 15 15 ASN N N 14 119.960 119.960 117.091 2.869 18533
2318 1 4 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.391 -0.461 18533
2319 1 4 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.165 0.705 18533
2320 1 4 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.260 3.410 18533
2321 1 4 . 1 1 15 15 ASN H H 14 9.280 9.280 8.710 0.570 18533
2322 1 4 . 1 1 16 16 ILE N N 15 101.060 101.060 108.600 -7.540 18533
2323 1 4 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.633 0.047 18533
2324 1 4 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.901 1.889 18533
2325 1 4 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.707 2.433 18533
2326 1 4 . 1 1 16 16 ILE H H 15 7.100 7.100 8.063 -0.963 18533
2327 1 4 . 1 1 17 17 CYS N N 16 116.020 116.020 119.412 -3.392 18533
2328 1 4 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.562 0.378 18533
2329 1 4 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.505 0.555 18533
2330 1 4 . 1 1 17 17 CYS CB C 16 28.950 28.950 30.201 -1.251 18533
2331 1 4 . 1 1 17 17 CYS H H 16 7.700 7.700 7.991 -0.291 18533
2332 1 4 . 1 1 19 19 SER N N 18 122.340 122.340 116.648 5.692 18533
2333 1 4 . 1 1 19 19 SER HA H 18 3.810 3.810 4.177 -0.367 18533
2334 1 4 . 1 1 19 19 SER CA C 18 62.710 62.710 63.096 -0.386 18533
2335 1 4 . 1 1 19 19 SER CB C 18 64.860 64.860 61.046 3.814 18533
2336 1 4 . 1 1 19 19 SER H H 18 11.420 11.420 8.527 2.893 18533
2337 1 4 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.045 -0.075 18533
2338 1 4 . 1 1 20 20 PRO CA C 19 65.030 65.030 65.052 -0.022 18533
2339 1 4 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.878 -2.188 18533
2340 1 4 . 1 1 21 21 MET N N 20 112.430 112.430 118.039 -5.609 18533
2341 1 4 . 1 1 21 21 MET HA H 20 3.730 3.730 3.901 -0.171 18533
2342 1 4 . 1 1 21 21 MET CA C 20 60.160 60.160 59.717 0.443 18533
2343 1 4 . 1 1 21 21 MET CB C 20 33.040 33.040 32.172 0.868 18533
2344 1 4 . 1 1 21 21 MET H H 20 6.310 6.310 7.413 -1.103 18533
2345 1 4 . 1 1 22 22 ALA N N 21 117.800 117.800 119.929 -2.129 18533
2346 1 4 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.789 -0.389 18533
2347 1 4 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.626 0.364 18533
2348 1 4 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.601 -1.111 18533
2349 1 4 . 1 1 22 22 ALA H H 21 6.550 6.550 7.560 -1.010 18533
2350 1 4 . 1 1 23 23 GLU N N 22 115.520 115.520 118.673 -3.153 18533
2351 1 4 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.062 -0.382 18533
2352 1 4 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.675 -0.125 18533
2353 1 4 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.788 0.002 18533
2354 1 4 . 1 1 23 23 GLU H H 22 7.800 7.800 7.693 0.107 18533
2355 1 4 . 1 1 24 24 LYS N N 23 114.220 114.220 116.592 -2.372 18533
2356 1 4 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.122 -0.122 18533
2357 1 4 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.200 -0.440 18533
2358 1 4 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.376 -1.575 18533
2359 1 4 . 1 1 24 24 LYS H H 23 8.040 8.040 7.695 0.345 18533
2360 1 4 . 1 1 25 25 MET N N 24 115.250 115.250 119.245 -3.995 18533
2361 1 4 . 1 1 25 25 MET HA H 24 3.950 3.950 3.629 0.321 18533
2362 1 4 . 1 1 25 25 MET CA C 24 57.980 57.980 58.938 -0.958 18533
2363 1 4 . 1 1 25 25 MET CB C 24 35.500 35.500 32.271 3.229 18533
2364 1 4 . 1 1 25 25 MET H H 24 7.610 7.610 7.805 -0.195 18533
2365 1 4 . 1 1 26 26 PHE N N 25 119.090 119.090 116.067 3.023 18533
2366 1 4 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.543 -0.203 18533
2367 1 4 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.184 -0.155 18533
2368 1 4 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.414 2.046 18533
2369 1 4 . 1 1 26 26 PHE H H 25 8.560 8.560 7.827 0.733 18533
2370 1 4 . 1 1 27 27 ALA N N 26 117.830 117.830 122.711 -4.881 18533
2371 1 4 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.743 0.187 18533
2372 1 4 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.105 0.955 18533
2373 1 4 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.912 0.498 18533
2374 1 4 . 1 1 27 27 ALA H H 26 8.800 8.800 7.229 1.571 18533
2375 1 4 . 1 1 28 28 GLN N N 27 117.550 117.550 118.578 -1.028 18533
2376 1 4 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.022 0.028 18533
2377 1 4 . 1 1 28 28 GLN CA C 27 59.610 59.610 59.014 0.596 18533
2378 1 4 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.867 0.583 18533
2379 1 4 . 1 1 28 28 GLN H H 27 7.690 7.690 7.841 -0.151 18533
2380 1 4 . 1 1 29 29 GLN N N 28 117.530 117.530 120.060 -2.530 18533
2381 1 4 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.092 0.048 18533
2382 1 4 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.942 0.238 18533
2383 1 4 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.877 -0.767 18533
2384 1 4 . 1 1 29 29 GLN H H 28 8.210 8.210 7.616 0.594 18533
2385 1 4 . 1 1 30 30 LEU N N 29 119.330 119.330 120.345 -1.015 18533
2386 1 4 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.023 -0.093 18533
2387 1 4 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.969 0.111 18533
2388 1 4 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.448 0.452 18533
2389 1 4 . 1 1 30 30 LEU H H 29 8.540 8.540 8.458 0.082 18533
2390 1 4 . 1 1 31 31 ARG N N 30 120.880 120.880 117.533 3.347 18533
2391 1 4 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.038 -0.068 18533
2392 1 4 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.089 0.701 18533
2393 1 4 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.471 0.049 18533
2394 1 4 . 1 1 31 31 ARG H H 30 8.050 8.050 7.933 0.117 18533
2395 1 4 . 1 1 32 32 HIS N N 31 119.770 119.770 118.290 1.480 18533
2396 1 4 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.458 0.092 18533
2397 1 4 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.596 -0.516 18533
2398 1 4 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.182 0.528 18533
2399 1 4 . 1 1 32 32 HIS H H 31 8.440 8.440 8.505 -0.065 18533
2400 1 4 . 1 1 33 33 ARG N N 32 115.430 115.430 116.990 -1.560 18533
2401 1 4 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.504 0.086 18533
2402 1 4 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.142 -0.172 18533
2403 1 4 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.768 -0.548 18533
2404 1 4 . 1 1 33 33 ARG H H 32 7.500 7.500 7.769 -0.269 18533
2405 1 4 . 1 1 34 34 GLY N N 33 106.730 106.730 109.104 -2.374 18533
2406 1 4 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.131 1.069 18533
2407 1 4 . 1 1 34 34 GLY H H 33 7.750 7.750 8.207 -0.457 18533
2408 1 4 . 1 1 35 35 LEU N N 34 119.980 119.980 116.733 3.247 18533
2409 1 4 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.838 -0.158 18533
2410 1 4 . 1 1 35 35 LEU CA C 34 54.150 54.150 54.019 0.131 18533
2411 1 4 . 1 1 35 35 LEU CB C 34 43.190 43.190 43.006 0.184 18533
2412 1 4 . 1 1 35 35 LEU H H 34 7.980 7.980 8.442 -0.462 18533
2413 1 4 . 1 1 36 36 GLY N N 35 108.660 108.660 108.641 0.019 18533
2414 1 4 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.585 -0.485 18533
2415 1 4 . 1 1 36 36 GLY H H 35 8.830 8.830 7.739 1.091 18533
2416 1 4 . 1 1 37 37 ASP N N 36 115.360 115.360 119.563 -4.203 18533
2417 1 4 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.529 0.241 18533
2418 1 4 . 1 1 37 37 ASP CA C 36 54.390 54.390 56.278 -1.888 18533
2419 1 4 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.789 0.381 18533
2420 1 4 . 1 1 37 37 ASP H H 36 8.300 8.300 8.143 0.157 18533
2421 1 4 . 1 1 38 38 ALA N N 37 121.460 121.460 120.777 0.683 18533
2422 1 4 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.288 0.022 18533
2423 1 4 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.315 -0.365 18533
2424 1 4 . 1 1 38 38 ALA CB C 37 20.850 20.850 19.967 0.883 18533
2425 1 4 . 1 1 38 38 ALA H H 37 7.380 7.380 7.702 -0.322 18533
2426 1 4 . 1 1 39 39 VAL N N 38 115.660 115.660 117.349 -1.689 18533
2427 1 4 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.503 0.297 18533
2428 1 4 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.296 -0.256 18533
2429 1 4 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.791 0.399 18533
2430 1 4 . 1 1 39 39 VAL H H 38 7.100 7.100 7.740 -0.640 18533
2431 1 4 . 1 1 40 40 ARG N N 39 129.230 129.230 127.888 1.342 18533
2432 1 4 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.500 0.040 18533
2433 1 4 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.456 1.254 18533
2434 1 4 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.079 1.240 18533
2435 1 4 . 1 1 40 40 ARG H H 39 9.730 9.730 8.127 1.603 18533
2436 1 4 . 1 1 41 41 VAL N N 40 126.240 126.240 123.525 2.715 18533
2437 1 4 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.796 0.894 18533
2438 1 4 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.202 -0.642 18533
2439 1 4 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.179 -0.239 18533
2440 1 4 . 1 1 41 41 VAL H H 40 8.610 8.610 8.471 0.139 18533
2441 1 4 . 1 1 42 42 THR N N 41 117.310 117.310 118.173 -0.863 18533
2442 1 4 . 1 1 42 42 THR HA H 41 4.890 4.890 4.826 0.064 18533
2443 1 4 . 1 1 42 42 THR CA C 41 60.300 60.300 59.342 0.958 18533
2444 1 4 . 1 1 42 42 THR CB C 41 73.890 73.890 71.513 2.377 18533
2445 1 4 . 1 1 42 42 THR H H 41 8.870 8.870 9.042 -0.172 18533
2446 1 4 . 1 1 43 43 SER N N 42 109.960 109.960 113.264 -3.304 18533
2447 1 4 . 1 1 43 43 SER HA H 42 5.720 5.720 5.246 0.474 18533
2448 1 4 . 1 1 43 43 SER CA C 42 58.090 58.090 57.926 0.164 18533
2449 1 4 . 1 1 43 43 SER CB C 42 65.870 65.870 66.662 -0.792 18533
2450 1 4 . 1 1 43 43 SER H H 42 8.060 8.060 8.641 -0.581 18533
2451 1 4 . 1 1 44 44 ALA N N 43 119.200 119.200 120.065 -0.865 18533
2452 1 4 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.151 -0.891 18533
2453 1 4 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.733 -0.553 18533
2454 1 4 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.194 -1.364 18533
2455 1 4 . 1 1 44 44 ALA H H 43 8.710 8.710 9.061 -0.351 18533
2456 1 4 . 1 1 45 45 GLY N N 44 104.090 104.090 106.837 -2.747 18533
2457 1 4 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.017 -1.476 18533
2458 1 4 . 1 1 45 45 GLY H H 44 8.670 8.670 8.152 0.518 18533
2459 1 4 . 1 1 46 46 THR N N 45 114.060 114.060 117.287 -3.227 18533
2460 1 4 . 1 1 46 46 THR HA H 45 4.080 4.080 4.113 -0.033 18533
2461 1 4 . 1 1 46 46 THR CA C 45 64.680 64.680 64.914 -0.234 18533
2462 1 4 . 1 1 46 46 THR CB C 45 67.880 67.880 68.587 -0.707 18533
2463 1 4 . 1 1 46 46 THR H H 45 9.120 9.120 8.499 0.621 18533
2464 1 4 . 1 1 47 47 GLY N N 46 110.380 110.380 108.448 1.932 18533
2465 1 4 . 1 1 47 47 GLY CA C 46 43.830 43.830 44.004 -0.174 18533
2466 1 4 . 1 1 47 47 GLY H H 46 8.930 8.930 8.274 0.656 18533
2467 1 4 . 1 1 48 48 ASN N N 47 113.440 113.440 117.820 -4.380 18533
2468 1 4 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.371 0.119 18533
2469 1 4 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.227 -2.467 18533
2470 1 4 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.833 2.017 18533
2471 1 4 . 1 1 48 48 ASN H H 47 7.600 7.600 7.686 -0.086 18533
2472 1 4 . 1 1 49 49 TRP N N 48 117.300 117.300 121.537 -4.237 18533
2473 1 4 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.436 -0.536 18533
2474 1 4 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.251 0.609 18533
2475 1 4 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.108 -0.588 18533
2476 1 4 . 1 1 49 49 TRP H H 48 6.920 6.920 8.597 -1.677 18533
2477 1 4 . 1 1 50 50 HIS N N 49 111.590 111.590 115.128 -3.538 18533
2478 1 4 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.788 0.092 18533
2479 1 4 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.302 -1.442 18533
2480 1 4 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.445 1.595 18533
2481 1 4 . 1 1 50 50 HIS H H 49 8.620 8.620 8.538 0.082 18533
2482 1 4 . 1 1 51 51 VAL N N 50 119.010 119.010 120.337 -1.327 18533
2483 1 4 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.698 -0.498 18533
2484 1 4 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.627 1.053 18533
2485 1 4 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.657 -0.267 18533
2486 1 4 . 1 1 51 51 VAL H H 50 6.880 6.880 7.354 -0.474 18533
2487 1 4 . 1 1 52 52 GLY N N 51 115.450 115.450 116.414 -0.964 18533
2488 1 4 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.088 -0.148 18533
2489 1 4 . 1 1 52 52 GLY H H 51 9.120 9.120 8.859 0.261 18533
2490 1 4 . 1 1 53 53 SER N N 52 116.620 116.620 115.775 0.845 18533
2491 1 4 . 1 1 53 53 SER HA H 52 4.610 4.610 4.603 0.007 18533
2492 1 4 . 1 1 53 53 SER CA C 52 59.310 59.310 58.021 1.289 18533
2493 1 4 . 1 1 53 53 SER CB C 52 64.630 64.630 65.167 -0.537 18533
2494 1 4 . 1 1 53 53 SER H H 52 8.430 8.430 7.915 0.515 18533
2495 1 4 . 1 1 54 54 CYS N N 53 118.690 118.690 117.924 0.766 18533
2496 1 4 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.584 -0.484 18533
2497 1 4 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.066 1.603 18533
2498 1 4 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.569 -3.219 18533
2499 1 4 . 1 1 54 54 CYS H H 53 8.170 8.170 8.391 -0.221 18533
2500 1 4 . 1 1 55 55 ALA N N 54 118.580 118.580 124.311 -5.731 18533
2501 1 4 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.208 -0.088 18533
2502 1 4 . 1 1 55 55 ALA CA C 54 52.640 52.640 53.062 -0.422 18533
2503 1 4 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.155 -2.525 18533
2504 1 4 . 1 1 55 55 ALA H H 54 8.420 8.420 8.571 -0.151 18533
2505 1 4 . 1 1 56 56 ASP N N 55 121.500 121.500 123.666 -2.166 18533
2506 1 4 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.440 -0.100 18533
2507 1 4 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.780 0.270 18533
2508 1 4 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.979 3.081 18533
2509 1 4 . 1 1 56 56 ASP H H 55 8.470 8.470 8.559 -0.089 18533
2510 1 4 . 1 1 57 57 GLU N N 56 127.840 127.840 126.941 0.899 18533
2511 1 4 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.808 0.232 18533
2512 1 4 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.227 0.413 18533
2513 1 4 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.290 0.210 18533
2514 1 4 . 1 1 57 57 GLU H H 56 9.230 9.230 8.851 0.379 18533
2515 1 4 . 1 1 58 58 ARG N N 57 120.820 120.820 118.004 2.816 18533
2516 1 4 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.479 0.331 18533
2517 1 4 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.337 -0.187 18533
2518 1 4 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.033 -1.763 18533
2519 1 4 . 1 1 58 58 ARG H H 57 9.220 9.220 8.923 0.297 18533
2520 1 4 . 1 1 59 59 ALA N N 58 121.590 121.590 122.308 -0.718 18533
2521 1 4 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.109 0.051 18533
2522 1 4 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.383 0.397 18533
2523 1 4 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.173 0.317 18533
2524 1 4 . 1 1 59 59 ALA H H 58 6.680 6.680 7.591 -0.911 18533
2525 1 4 . 1 1 60 60 ALA N N 59 118.970 118.970 121.728 -2.758 18533
2526 1 4 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.916 -0.056 18533
2527 1 4 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.268 -0.248 18533
2528 1 4 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.322 -0.252 18533
2529 1 4 . 1 1 60 60 ALA H H 59 8.540 8.540 8.544 -0.004 18533
2530 1 4 . 1 1 61 61 GLY N N 60 104.160 104.160 106.639 -2.479 18533
2531 1 4 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.938 0.332 18533
2532 1 4 . 1 1 61 61 GLY H H 60 8.210 8.210 8.033 0.177 18533
2533 1 4 . 1 1 62 62 VAL N N 61 122.820 122.820 123.361 -0.541 18533
2534 1 4 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.615 0.235 18533
2535 1 4 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.925 -0.675 18533
2536 1 4 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.743 0.147 18533
2537 1 4 . 1 1 62 62 VAL H H 61 7.310 7.310 7.652 -0.342 18533
2538 1 4 . 1 1 63 63 LEU N N 62 120.310 120.310 118.814 1.496 18533
2539 1 4 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.175 -0.195 18533
2540 1 4 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.286 0.664 18533
2541 1 4 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.303 0.197 18533
2542 1 4 . 1 1 63 63 LEU H H 62 8.090 8.090 8.490 -0.400 18533
2543 1 4 . 1 1 64 64 ARG N N 63 119.440 119.440 119.106 0.334 18533
2544 1 4 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.303 -0.123 18533
2545 1 4 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.908 0.542 18533
2546 1 4 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.565 0.815 18533
2547 1 4 . 1 1 64 64 ARG H H 63 8.740 8.740 8.532 0.208 18533
2548 1 4 . 1 1 65 65 ALA N N 64 122.560 122.560 121.254 1.306 18533
2549 1 4 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.131 -0.101 18533
2550 1 4 . 1 1 65 65 ALA CA C 64 54.540 54.540 53.921 0.619 18533
2551 1 4 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.343 -0.263 18533
2552 1 4 . 1 1 65 65 ALA H H 64 7.910 7.910 7.699 0.211 18533
2553 1 4 . 1 1 66 66 HIS N N 65 112.690 112.690 115.061 -2.371 18533
2554 1 4 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.652 -0.012 18533
2555 1 4 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.129 -0.629 18533
2556 1 4 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.222 0.098 18533
2557 1 4 . 1 1 66 66 HIS H H 65 7.410 7.410 7.771 -0.361 18533
2558 1 4 . 1 1 67 67 GLY N N 66 107.440 107.440 106.035 1.405 18533
2559 1 4 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.143 1.217 18533
2560 1 4 . 1 1 67 67 GLY H H 66 7.850 7.850 7.783 0.067 18533
2561 1 4 . 1 1 68 68 TYR N N 67 119.940 119.940 121.543 -1.603 18533
2562 1 4 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.843 -0.043 18533
2563 1 4 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.180 0.920 18533
2564 1 4 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.945 0.915 18533
2565 1 4 . 1 1 68 68 TYR H H 67 8.380 8.380 8.341 0.039 18533
2566 1 4 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.489 0.071 18533
2567 1 4 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.962 -0.362 18533
2568 1 4 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.458 0.352 18533
2569 1 4 . 1 1 70 70 THR N N 69 100.660 100.660 106.841 -6.181 18533
2570 1 4 . 1 1 70 70 THR HA H 69 4.300 4.300 4.430 -0.130 18533
2571 1 4 . 1 1 70 70 THR CA C 69 61.250 61.250 61.357 -0.107 18533
2572 1 4 . 1 1 70 70 THR CB C 69 70.740 70.740 69.545 1.195 18533
2573 1 4 . 1 1 70 70 THR H H 69 7.860 7.860 8.019 -0.159 18533
2574 1 4 . 1 1 71 71 ASP N N 70 122.880 122.880 122.332 0.548 18533
2575 1 4 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.738 -0.328 18533
2576 1 4 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.295 1.575 18533
2577 1 4 . 1 1 71 71 ASP CB C 70 40.970 40.970 42.145 -1.175 18533
2578 1 4 . 1 1 71 71 ASP H H 70 7.940 7.940 7.775 0.165 18533
2579 1 4 . 1 1 72 72 HIS N N 71 121.720 121.720 122.533 -0.813 18533
2580 1 4 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.773 -0.073 18533
2581 1 4 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.263 1.127 18533
2582 1 4 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.274 3.066 18533
2583 1 4 . 1 1 72 72 HIS H H 71 8.000 8.000 7.977 0.023 18533
2584 1 4 . 1 1 73 73 ARG N N 72 125.760 125.760 125.664 0.096 18533
2585 1 4 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.012 -0.722 18533
2586 1 4 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.020 0.410 18533
2587 1 4 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.050 0.260 18533
2588 1 4 . 1 1 73 73 ARG H H 72 7.230 7.230 8.187 -0.957 18533
2589 1 4 . 1 1 74 74 ALA N N 73 127.970 127.970 129.456 -1.486 18533
2590 1 4 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.140 0.490 18533
2591 1 4 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.911 -0.731 18533
2592 1 4 . 1 1 74 74 ALA CB C 73 18.900 18.900 19.937 -1.037 18533
2593 1 4 . 1 1 74 74 ALA H H 73 9.090 9.090 8.115 0.975 18533
2594 1 4 . 1 1 75 75 ALA N N 74 126.090 126.090 125.051 1.039 18533
2595 1 4 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.763 0.027 18533
2596 1 4 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.436 0.534 18533
2597 1 4 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.866 1.754 18533
2598 1 4 . 1 1 75 75 ALA H H 74 9.410 9.410 8.315 1.095 18533
2599 1 4 . 1 1 76 76 GLN N N 75 123.260 123.260 119.544 3.716 18533
2600 1 4 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.581 0.369 18533
2601 1 4 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.993 -0.443 18533
2602 1 4 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.097 -1.047 18533
2603 1 4 . 1 1 76 76 GLN H H 75 8.800 8.800 8.377 0.423 18533
2604 1 4 . 1 1 77 77 VAL N N 76 125.510 125.510 123.529 1.981 18533
2605 1 4 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.450 -0.150 18533
2606 1 4 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.763 -0.183 18533
2607 1 4 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.710 1.780 18533
2608 1 4 . 1 1 77 77 VAL H H 76 8.550 8.550 7.934 0.616 18533
2609 1 4 . 1 1 78 78 GLY N N 77 121.850 121.850 115.822 6.028 18533
2610 1 4 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.324 -0.484 18533
2611 1 4 . 1 1 78 78 GLY H H 77 10.930 10.930 8.119 2.811 18533
2612 1 4 . 1 1 79 79 THR N N 78 115.210 115.210 116.247 -1.037 18533
2613 1 4 . 1 1 79 79 THR HA H 78 3.700 3.700 3.953 -0.253 18533
2614 1 4 . 1 1 79 79 THR CA C 78 66.440 66.440 67.873 -1.433 18533
2615 1 4 . 1 1 79 79 THR CB C 78 68.770 68.770 68.657 0.113 18533
2616 1 4 . 1 1 79 79 THR H H 78 8.540 8.540 8.403 0.137 18533
2617 1 4 . 1 1 80 80 GLU N N 79 119.360 119.360 119.240 0.120 18533
2618 1 4 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.962 -0.002 18533
2619 1 4 . 1 1 80 80 GLU CA C 79 59.030 59.030 59.025 0.005 18533
2620 1 4 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.543 0.517 18533
2621 1 4 . 1 1 80 80 GLU H H 79 9.110 9.110 8.922 0.188 18533
2622 1 4 . 1 1 81 81 HIS N N 80 118.380 118.380 117.219 1.161 18533
2623 1 4 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.260 -0.320 18533
2624 1 4 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.858 1.562 18533
2625 1 4 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.144 0.786 18533
2626 1 4 . 1 1 81 81 HIS H H 80 7.040 7.040 7.479 -0.439 18533
2627 1 4 . 1 1 82 82 LEU N N 81 114.010 114.010 120.282 -6.272 18533
2628 1 4 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.089 -0.189 18533
2629 1 4 . 1 1 82 82 LEU CA C 81 56.680 56.680 57.101 -0.421 18533
2630 1 4 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.420 -0.691 18533
2631 1 4 . 1 1 82 82 LEU H H 81 7.850 7.850 8.639 -0.789 18533
2632 1 4 . 1 1 83 83 ALA N N 82 119.050 119.050 117.700 1.350 18533
2633 1 4 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.240 0.150 18533
2634 1 4 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.128 0.072 18533
2635 1 4 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.882 0.298 18533
2636 1 4 . 1 1 83 83 ALA H H 82 6.950 6.950 7.472 -0.522 18533
2637 1 4 . 1 1 84 84 ALA N N 83 122.500 122.500 121.619 0.881 18533
2638 1 4 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.076 -0.316 18533
2639 1 4 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.224 1.126 18533
2640 1 4 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.523 -2.203 18533
2641 1 4 . 1 1 84 84 ALA H H 83 7.280 7.280 7.131 0.149 18533
2642 1 4 . 1 1 85 85 ASP N N 84 118.740 118.740 119.848 -1.108 18533
2643 1 4 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.723 -0.312 18533
2644 1 4 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.193 1.447 18533
2645 1 4 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.102 0.798 18533
2646 1 4 . 1 1 85 85 ASP H H 84 8.440 8.440 8.302 0.138 18533
2647 1 4 . 1 1 86 86 LEU N N 85 115.180 115.180 118.557 -3.377 18533
2648 1 4 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.968 -0.788 18533
2649 1 4 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.759 1.281 18533
2650 1 4 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.656 0.514 18533
2651 1 4 . 1 1 86 86 LEU H H 85 7.280 7.280 8.131 -0.851 18533
2652 1 4 . 1 1 87 87 LEU N N 86 128.140 128.140 127.571 0.569 18533
2653 1 4 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.979 -0.289 18533
2654 1 4 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.804 1.576 18533
2655 1 4 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.696 -0.526 18533
2656 1 4 . 1 1 87 87 LEU H H 86 8.780 8.780 9.027 -0.247 18533
2657 1 4 . 1 1 88 88 VAL N N 87 122.630 122.630 127.207 -4.577 18533
2658 1 4 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.971 -0.341 18533
2659 1 4 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.822 -1.913 18533
2660 1 4 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.918 -1.078 18533
2661 1 4 . 1 1 88 88 VAL H H 87 9.010 9.010 9.023 -0.013 18533
2662 1 4 . 1 1 89 89 ALA N N 88 129.820 129.820 130.968 -1.148 18533
2663 1 4 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.849 -0.329 18533
2664 1 4 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.357 -0.577 18533
2665 1 4 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.079 -0.299 18533
2666 1 4 . 1 1 89 89 ALA H H 88 8.590 8.590 9.026 -0.436 18533
2667 1 4 . 1 1 90 90 LEU N N 89 129.280 129.280 119.746 9.534 18533
2668 1 4 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.566 -0.256 18533
2669 1 4 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.150 0.300 18533
2670 1 4 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.747 -3.727 18533
2671 1 4 . 1 1 90 90 LEU H H 89 8.570 8.570 8.549 0.021 18533
2672 1 4 . 1 1 91 91 ASP N N 90 126.910 126.910 116.875 10.035 18533
2673 1 4 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.760 0.040 18533
2674 1 4 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.177 -0.227 18533
2675 1 4 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.265 0.545 18533
2676 1 4 . 1 1 91 91 ASP H H 90 11.450 11.450 7.511 3.939 18533
2677 1 4 . 1 1 92 92 ARG N N 91 116.950 116.950 120.874 -3.924 18533
2678 1 4 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.910 0.110 18533
2679 1 4 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.276 -0.446 18533
2680 1 4 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.642 0.638 18533
2681 1 4 . 1 1 92 92 ARG H H 91 8.650 8.650 8.551 0.099 18533
2682 1 4 . 1 1 93 93 ASN N N 92 120.740 120.740 118.501 2.239 18533
2683 1 4 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.479 -0.099 18533
2684 1 4 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.895 0.235 18533
2685 1 4 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.767 -1.147 18533
2686 1 4 . 1 1 93 93 ASN H H 92 8.610 8.610 8.610 -0.000 18533
2687 1 4 . 1 1 94 94 HIS N N 93 121.170 121.170 120.137 1.033 18533
2688 1 4 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.177 0.013 18533
2689 1 4 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.272 0.238 18533
2690 1 4 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.707 1.673 18533
2691 1 4 . 1 1 94 94 HIS H H 93 7.430 7.430 8.578 -1.148 18533
2692 1 4 . 1 1 95 95 ALA N N 94 118.270 118.270 121.155 -2.885 18533
2693 1 4 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.960 -0.220 18533
2694 1 4 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.467 0.033 18533
2695 1 4 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.328 -0.359 18533
2696 1 4 . 1 1 95 95 ALA H H 94 7.190 7.190 8.054 -0.864 18533
2697 1 4 . 1 1 96 96 ARG N N 95 117.190 117.190 119.324 -2.134 18533
2698 1 4 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.045 -0.135 18533
2699 1 4 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.313 0.187 18533
2700 1 4 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.060 0.170 18533
2701 1 4 . 1 1 96 96 ARG H H 95 7.600 7.600 7.663 -0.063 18533
2702 1 4 . 1 1 97 97 LEU N N 96 120.700 120.700 119.709 0.991 18533
2703 1 4 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.973 0.107 18533
2704 1 4 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.757 0.143 18533
2705 1 4 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.715 -0.375 18533
2706 1 4 . 1 1 97 97 LEU H H 96 7.990 7.990 8.014 -0.024 18533
2707 1 4 . 1 1 98 98 LEU N N 97 118.390 118.390 118.349 0.041 18533
2708 1 4 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.840 0.070 18533
2709 1 4 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.034 0.066 18533
2710 1 4 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.199 0.691 18533
2711 1 4 . 1 1 98 98 LEU H H 97 8.210 8.210 8.197 0.013 18533
2712 1 4 . 1 1 99 99 ARG N N 98 117.470 117.470 117.849 -0.379 18533
2713 1 4 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.084 0.396 18533
2714 1 4 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.008 -0.648 18533
2715 1 4 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.732 -0.992 18533
2716 1 4 . 1 1 99 99 ARG H H 98 7.740 7.740 7.896 -0.156 18533
2717 1 4 . 1 1 100 100 GLN N N 99 121.400 121.400 118.731 2.669 18533
2718 1 4 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.193 -0.123 18533
2719 1 4 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.165 0.515 18533
2720 1 4 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.209 0.111 18533
2721 1 4 . 1 1 100 100 GLN H H 99 8.030 8.030 8.026 0.004 18533
2722 1 4 . 1 1 101 101 LEU N N 100 118.940 118.940 117.080 1.860 18533
2723 1 4 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.193 0.067 18533
2724 1 4 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.280 0.180 18533
2725 1 4 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.163 0.077 18533
2726 1 4 . 1 1 101 101 LEU H H 100 7.780 7.780 7.912 -0.132 18533
2727 1 4 . 1 1 102 102 GLY N N 101 105.740 105.740 104.160 1.580 18533
2728 1 4 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.596 0.434 18533
2729 1 4 . 1 1 102 102 GLY H H 101 7.700 7.700 7.471 0.229 18533
2730 1 4 . 1 1 103 103 VAL N N 102 122.330 122.330 119.891 2.439 18533
2731 1 4 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.010 -0.380 18533
2732 1 4 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.778 0.822 18533
2733 1 4 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.040 -1.550 18533
2734 1 4 . 1 1 103 103 VAL H H 102 7.520 7.520 7.849 -0.329 18533
2735 1 4 . 1 1 104 104 GLU N N 103 128.990 128.990 114.108 14.882 18533
2736 1 4 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.406 -0.236 18533
2737 1 4 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.461 1.459 18533
2738 1 4 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.400 -3.450 18533
2739 1 4 . 1 1 104 104 GLU H H 103 9.210 9.210 7.908 1.302 18533
2740 1 4 . 1 1 105 105 ALA N N 104 124.410 124.410 122.025 2.385 18533
2741 1 4 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.256 -0.496 18533
2742 1 4 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.904 0.736 18533
2743 1 4 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.773 -0.633 18533
2744 1 4 . 1 1 105 105 ALA H H 104 8.500 8.500 8.630 -0.130 18533
2745 1 4 . 1 1 106 106 ALA N N 105 115.110 115.110 119.971 -4.861 18533
2746 1 4 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.183 -0.053 18533
2747 1 4 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.742 -0.702 18533
2748 1 4 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.626 0.434 18533
2749 1 4 . 1 1 106 106 ALA H H 105 8.270 8.270 8.313 -0.043 18533
2750 1 4 . 1 1 107 107 ARG N N 106 115.080 115.080 114.798 0.282 18533
2751 1 4 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.830 -0.370 18533
2752 1 4 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.989 -0.479 18533
2753 1 4 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.570 0.800 18533
2754 1 4 . 1 1 107 107 ARG H H 106 7.740 7.740 7.625 0.115 18533
2755 1 4 . 1 1 108 108 VAL N N 107 118.170 118.170 121.629 -3.459 18533
2756 1 4 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.281 0.789 18533
2757 1 4 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.221 -1.581 18533
2758 1 4 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.269 1.331 18533
2759 1 4 . 1 1 108 108 VAL H H 107 7.290 7.290 8.234 -0.944 18533
2760 1 4 . 1 1 109 109 ARG N N 108 124.250 124.250 127.974 -3.724 18533
2761 1 4 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.589 0.031 18533
2762 1 4 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.427 -1.537 18533
2763 1 4 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.239 0.741 18533
2764 1 4 . 1 1 109 109 ARG H H 108 8.420 8.420 9.217 -0.797 18533
2765 1 4 . 1 1 110 110 MET N N 109 119.570 119.570 121.781 -2.211 18533
2766 1 4 . 1 1 110 110 MET HA H 109 4.960 4.960 4.971 -0.011 18533
2767 1 4 . 1 1 110 110 MET CA C 109 53.820 53.820 54.471 -0.651 18533
2768 1 4 . 1 1 110 110 MET CB C 109 30.680 30.680 32.234 -1.554 18533
2769 1 4 . 1 1 110 110 MET H H 109 8.890 8.890 8.512 0.378 18533
2770 1 4 . 1 1 111 111 LEU N N 110 128.660 128.660 126.884 1.776 18533
2771 1 4 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.339 -0.379 18533
2772 1 4 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.903 0.697 18533
2773 1 4 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.947 -0.867 18533
2774 1 4 . 1 1 111 111 LEU H H 110 9.200 9.200 8.940 0.260 18533
2775 1 4 . 1 1 112 112 ARG N N 111 111.910 111.910 116.572 -4.662 18533
2776 1 4 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.067 -0.117 18533
2777 1 4 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.883 1.037 18533
2778 1 4 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.638 -1.138 18533
2779 1 4 . 1 1 112 112 ARG H H 111 8.930 8.930 8.677 0.253 18533
2780 1 4 . 1 1 113 113 SER N N 112 114.800 114.800 114.558 0.242 18533
2781 1 4 . 1 1 113 113 SER HA H 112 4.290 4.290 4.312 -0.022 18533
2782 1 4 . 1 1 113 113 SER CA C 112 60.880 60.880 59.678 1.202 18533
2783 1 4 . 1 1 113 113 SER CB C 112 63.190 63.190 62.466 0.724 18533
2784 1 4 . 1 1 113 113 SER H H 112 7.680 7.680 7.643 0.037 18533
2785 1 4 . 1 1 114 114 PHE N N 113 119.260 119.260 119.232 0.028 18533
2786 1 4 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.467 -0.117 18533
2787 1 4 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.377 0.554 18533
2788 1 4 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.477 0.242 18533
2789 1 4 . 1 1 114 114 PHE H H 113 7.600 7.600 7.653 -0.053 18533
2790 1 4 . 1 1 115 115 ASP N N 114 121.170 121.170 121.938 -0.768 18533
2791 1 4 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.914 0.106 18533
2792 1 4 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.522 -1.422 18533
2793 1 4 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.461 1.049 18533
2794 1 4 . 1 1 115 115 ASP H H 114 7.430 7.430 7.560 -0.130 18533
2795 1 4 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.378 0.112 18533
2796 1 4 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.145 0.205 18533
2797 1 4 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.086 0.184 18533
2798 1 4 . 1 1 117 117 ARG N N 116 117.910 117.910 115.809 2.101 18533
2799 1 4 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.465 -0.195 18533
2800 1 4 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.566 0.884 18533
2801 1 4 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.649 -0.690 18533
2802 1 4 . 1 1 117 117 ARG H H 116 8.580 8.580 8.855 -0.275 18533
2803 1 4 . 1 1 118 118 SER N N 117 116.130 116.130 116.098 0.032 18533
2804 1 4 . 1 1 118 118 SER HA H 117 3.980 3.980 4.309 -0.329 18533
2805 1 4 . 1 1 118 118 SER CA C 117 59.790 59.790 58.022 1.768 18533
2806 1 4 . 1 1 118 118 SER CB C 117 63.760 63.760 61.894 1.866 18533
2807 1 4 . 1 1 118 118 SER H H 117 7.950 7.950 7.602 0.348 18533
2808 1 4 . 1 1 119 119 GLY N N 118 110.080 110.080 114.518 -4.438 18533
2809 1 4 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.860 -1.490 18533
2810 1 4 . 1 1 119 119 GLY H H 118 8.150 8.150 8.736 -0.586 18533
2811 1 4 . 1 1 120 120 THR HA H 119 4.020 4.020 4.513 -0.493 18533
2812 1 4 . 1 1 120 120 THR CA C 119 63.290 63.290 62.870 0.420 18533
2813 1 4 . 1 1 120 120 THR CB C 119 69.140 69.140 71.108 -1.968 18533
2814 1 4 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.872 -0.302 18533
2815 1 4 . 1 1 121 121 HIS CA C 120 56.010 56.010 54.019 1.992 18533
2816 1 4 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.240 -1.250 18533
2817 1 4 . 1 1 122 122 ALA N N 121 125.880 125.880 124.975 0.905 18533
2818 1 4 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.486 -0.146 18533
2819 1 4 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.391 0.119 18533
2820 1 4 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.637 -2.037 18533
2821 1 4 . 1 1 122 122 ALA H H 121 7.980 7.980 8.311 -0.331 18533
2822 1 4 . 1 1 123 123 LEU N N 122 119.810 119.810 121.970 -2.160 18533
2823 1 4 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.342 -0.062 18533
2824 1 4 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.701 -0.211 18533
2825 1 4 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.412 2.288 18533
2826 1 4 . 1 1 123 123 LEU H H 122 7.810 7.810 8.395 -0.585 18533
2827 1 4 . 1 1 124 124 ASP N N 123 119.050 119.050 113.886 5.164 18533
2828 1 4 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.599 -0.029 18533
2829 1 4 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.357 1.963 18533
2830 1 4 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.605 -0.935 18533
2831 1 4 . 1 1 124 124 ASP H H 123 8.270 8.270 7.209 1.061 18533
2832 1 4 . 1 1 125 125 VAL N N 124 121.970 121.970 122.688 -0.718 18533
2833 1 4 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.128 0.132 18533
2834 1 4 . 1 1 125 125 VAL CA C 124 62.310 62.310 63.493 -1.183 18533
2835 1 4 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.150 -2.370 18533
2836 1 4 . 1 1 125 125 VAL H H 124 7.930 7.930 8.080 -0.150 18533
2837 1 4 . 1 1 126 126 GLU N N 125 129.490 129.490 117.980 11.510 18533
2838 1 4 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.524 -0.444 18533
2839 1 4 . 1 1 126 126 GLU CA C 125 57.010 57.010 54.705 2.305 18533
2840 1 4 . 1 1 126 126 GLU CB C 125 29.800 29.800 32.329 -2.529 18533
2841 1 4 . 1 1 126 126 GLU H H 125 9.100 9.100 7.987 1.113 18533
2842 1 4 . 1 1 127 127 ASP N N 126 122.300 122.300 120.189 2.111 18533
2843 1 4 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.799 -0.689 18533
2844 1 4 . 1 1 127 127 ASP CA C 126 51.720 51.720 53.427 -1.707 18533
2845 1 4 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.254 0.266 18533
2846 1 4 . 1 1 127 127 ASP H H 126 8.630 8.630 8.346 0.284 18533
2847 1 4 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.401 0.149 18533
2848 1 4 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.789 -0.189 18533
2849 1 4 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.691 -1.711 18533
2850 1 4 . 1 1 129 129 TYR N N 128 122.380 122.380 120.433 1.947 18533
2851 1 4 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.266 -0.466 18533
2852 1 4 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.599 3.521 18533
2853 1 4 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.225 0.165 18533
2854 1 4 . 1 1 129 129 TYR H H 128 8.670 8.670 8.571 0.099 18533
2855 1 4 . 1 1 130 130 TYR N N 129 116.300 116.300 117.419 -1.119 18533
2856 1 4 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.612 -0.122 18533
2857 1 4 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.841 1.639 18533
2858 1 4 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.931 -2.271 18533
2859 1 4 . 1 1 130 130 TYR H H 129 8.680 8.680 7.429 1.251 18533
2860 1 4 . 1 1 131 131 GLY N N 130 110.870 110.870 109.009 1.861 18533
2861 1 4 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.215 -1.135 18533
2862 1 4 . 1 1 131 131 GLY H H 130 8.060 8.060 8.495 -0.435 18533
2863 1 4 . 1 1 132 132 ASP N N 131 121.590 121.590 119.646 1.944 18533
2864 1 4 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.877 0.194 18533
2865 1 4 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.099 -0.099 18533
2866 1 4 . 1 1 132 132 ASP CB C 131 43.600 43.600 43.482 0.118 18533
2867 1 4 . 1 1 132 132 ASP H H 131 9.290 9.290 7.834 1.456 18533
2868 1 4 . 1 1 133 133 HIS HA H 132 4.110 4.110 2.723 1.387 18533
2869 1 4 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.139 2.431 18533
2870 1 4 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.283 0.197 18533
2871 1 4 . 1 1 134 134 SER N N 133 115.370 115.370 112.481 2.889 18533
2872 1 4 . 1 1 134 134 SER HA H 133 4.180 4.180 4.054 0.126 18533
2873 1 4 . 1 1 134 134 SER CA C 133 62.070 62.070 60.592 1.478 18533
2874 1 4 . 1 1 134 134 SER CB C 133 62.160 62.160 62.891 -0.731 18533
2875 1 4 . 1 1 134 134 SER H H 133 8.420 8.420 8.278 0.142 18533
2876 1 4 . 1 1 135 135 ASP N N 134 123.360 123.360 121.608 1.752 18533
2877 1 4 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.399 0.131 18533
2878 1 4 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.872 1.168 18533
2879 1 4 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.614 0.196 18533
2880 1 4 . 1 1 135 135 ASP H H 134 7.980 7.980 7.677 0.303 18533
2881 1 4 . 1 1 136 136 PHE N N 135 118.940 118.940 116.530 2.410 18533
2882 1 4 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.415 -0.615 18533
2883 1 4 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.799 3.021 18533
2884 1 4 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.036 1.314 18533
2885 1 4 . 1 1 136 136 PHE H H 135 7.850 7.850 7.032 0.818 18533
2886 1 4 . 1 1 137 137 GLU N N 136 121.410 121.410 120.098 1.312 18533
2887 1 4 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.205 -0.025 18533
2888 1 4 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.208 0.292 18533
2889 1 4 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.232 -0.242 18533
2890 1 4 . 1 1 137 137 GLU H H 136 8.150 8.150 7.861 0.289 18533
2891 1 4 . 1 1 138 138 GLU N N 137 121.530 121.530 121.570 -0.040 18533
2892 1 4 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.079 0.211 18533
2893 1 4 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.598 -0.198 18533
2894 1 4 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.507 -0.617 18533
2895 1 4 . 1 1 138 138 GLU H H 137 7.870 7.870 8.137 -0.267 18533
2896 1 4 . 1 1 139 139 VAL N N 138 119.930 119.930 119.783 0.147 18533
2897 1 4 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.775 -0.295 18533
2898 1 4 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.765 0.315 18533
2899 1 4 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.487 -0.137 18533
2900 1 4 . 1 1 139 139 VAL H H 138 7.770 7.770 7.906 -0.136 18533
2901 1 4 . 1 1 140 140 PHE N N 139 119.130 119.130 120.703 -1.573 18533
2902 1 4 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.957 -0.397 18533
2903 1 4 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.819 0.861 18533
2904 1 4 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.743 0.427 18533
2905 1 4 . 1 1 140 140 PHE H H 139 8.050 8.050 7.835 0.215 18533
2906 1 4 . 1 1 141 141 ALA N N 140 121.040 121.040 121.865 -0.825 18533
2907 1 4 . 1 1 141 141 ALA HA H 140 3.990 3.990 3.992 -0.002 18533
2908 1 4 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.830 0.290 18533
2909 1 4 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.438 -0.138 18533
2910 1 4 . 1 1 141 141 ALA H H 140 8.010 8.010 7.828 0.182 18533
2911 1 4 . 1 1 142 142 VAL N N 141 118.550 118.550 119.070 -0.520 18533
2912 1 4 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.582 0.228 18533
2913 1 4 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.493 -0.893 18533
2914 1 4 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.131 0.319 18533
2915 1 4 . 1 1 142 142 VAL H H 141 8.300 8.300 7.784 0.516 18533
2916 1 4 . 1 1 143 143 ILE N N 142 121.410 121.410 119.741 1.669 18533
2917 1 4 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.430 -0.040 18533
2918 1 4 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.549 0.501 18533
2919 1 4 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.714 -0.404 18533
2920 1 4 . 1 1 143 143 ILE H H 142 8.150 8.150 8.102 0.048 18533
2921 1 4 . 1 1 144 144 GLU N N 143 119.630 119.630 118.957 0.673 18533
2922 1 4 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.779 -0.239 18533
2923 1 4 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.127 0.633 18533
2924 1 4 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.816 0.914 18533
2925 1 4 . 1 1 144 144 GLU H H 143 8.640 8.640 7.932 0.708 18533
2926 1 4 . 1 1 145 145 SER N N 144 110.920 110.920 113.899 -2.979 18533
2927 1 4 . 1 1 145 145 SER HA H 144 4.230 4.230 4.268 -0.038 18533
2928 1 4 . 1 1 145 145 SER CA C 144 60.810 60.810 60.211 0.599 18533
2929 1 4 . 1 1 145 145 SER CB C 144 63.610 63.610 63.470 0.140 18533
2930 1 4 . 1 1 145 145 SER H H 144 7.640 7.640 7.635 0.005 18533
2931 1 4 . 1 1 146 146 ALA N N 145 123.110 123.110 124.275 -1.165 18533
2932 1 4 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.299 -0.179 18533
2933 1 4 . 1 1 146 146 ALA CA C 145 53.400 53.400 53.992 -0.592 18533
2934 1 4 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.452 2.428 18533
2935 1 4 . 1 1 146 146 ALA H H 145 7.500 7.500 7.644 -0.144 18533
2936 1 4 . 1 1 147 147 LEU N N 146 114.220 114.220 119.851 -5.631 18533
2937 1 4 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.870 0.070 18533
2938 1 4 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.515 -0.465 18533
2939 1 4 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.405 0.055 18533
2940 1 4 . 1 1 147 147 LEU H H 146 7.410 7.410 8.231 -0.821 18533
2941 1 4 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.357 0.093 18533
2942 1 4 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.514 3.325 18533
2943 1 4 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.017 0.203 18533
2944 1 4 . 1 1 149 149 GLY N N 148 102.590 102.590 106.320 -3.730 18533
2945 1 4 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.521 1.739 18533
2946 1 4 . 1 1 149 149 GLY H H 148 7.960 7.960 7.937 0.023 18533
2947 1 4 . 1 1 150 150 LEU N N 149 128.060 128.060 123.439 4.621 18533
2948 1 4 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.168 0.462 18533
2949 1 4 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.106 0.244 18533
2950 1 4 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.307 -0.107 18533
2951 1 4 . 1 1 150 150 LEU H H 149 7.620 7.620 8.454 -0.834 18533
2952 1 4 . 1 1 151 151 HIS N N 150 120.730 120.730 118.666 2.064 18533
2953 1 4 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.081 0.089 18533
2954 1 4 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.587 0.793 18533
2955 1 4 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.832 0.678 18533
2956 1 4 . 1 1 151 151 HIS H H 150 8.430 8.430 8.476 -0.046 18533
2957 1 4 . 1 1 152 152 ASP N N 151 118.170 118.170 119.748 -1.578 18533
2958 1 4 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.391 0.029 18533
2959 1 4 . 1 1 152 152 ASP CA C 151 57.810 57.810 58.020 -0.210 18533
2960 1 4 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.635 -0.605 18533
2961 1 4 . 1 1 152 152 ASP H H 151 7.820 7.820 8.269 -0.449 18533
2962 1 4 . 1 1 153 153 TRP N N 152 122.780 122.780 121.712 1.068 18533
2963 1 4 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.369 -0.259 18533
2964 1 4 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.386 1.224 18533
2965 1 4 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.273 -0.483 18533
2966 1 4 . 1 1 153 153 TRP H H 152 7.900 7.900 7.783 0.117 18533
2967 1 4 . 1 1 154 154 VAL N N 153 119.460 119.460 116.809 2.651 18533
2968 1 4 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.799 -0.449 18533
2969 1 4 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.410 0.570 18533
2970 1 4 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.548 0.352 18533
2971 1 4 . 1 1 154 154 VAL H H 153 8.560 8.560 8.509 0.051 18533
2972 1 4 . 1 1 155 155 ASP N N 154 120.500 120.500 121.308 -0.808 18533
2973 1 4 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.321 -0.121 18533
2974 1 4 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.444 -0.875 18533
2975 1 4 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.890 -1.030 18533
2976 1 4 . 1 1 155 155 ASP H H 154 8.530 8.530 8.807 -0.277 18533
2977 1 4 . 1 1 156 156 GLU N N 155 120.090 120.090 119.751 0.339 18533
2978 1 4 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.944 -0.014 18533
2979 1 4 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.275 -0.115 18533
2980 1 4 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.318 -0.028 18533
2981 1 4 . 1 1 156 156 GLU H H 155 7.870 7.870 8.361 -0.491 18533
2982 1 4 . 1 1 157 157 ARG N N 156 119.230 119.230 119.053 0.177 18533
2983 1 4 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.014 -0.204 18533
2984 1 4 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.176 -0.186 18533
2985 1 4 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.347 -0.237 18533
2986 1 4 . 1 1 157 157 ARG H H 156 7.660 7.660 7.987 -0.327 18533
2987 1 4 . 1 1 158 158 LEU N N 157 118.790 118.790 117.484 1.306 18533
2988 1 4 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.188 -0.088 18533
2989 1 4 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.671 -0.991 18533
2990 1 4 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.713 0.977 18533
2991 1 4 . 1 1 158 158 LEU H H 157 8.470 8.470 8.324 0.146 18533
2992 1 4 . 1 1 159 159 ALA N N 158 120.760 120.760 123.037 -2.277 18533
2993 1 4 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.112 0.078 18533
2994 1 4 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.578 -1.298 18533
2995 1 4 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.969 -0.579 18533
2996 1 4 . 1 1 159 159 ALA H H 158 7.490 7.490 7.548 -0.058 18533
2997 1 4 . 1 1 160 160 ARG N N 159 117.810 117.810 116.582 1.228 18533
2998 1 4 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.121 0.089 18533
2999 1 4 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.793 -0.013 18533
3000 1 4 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.389 1.141 18533
3001 1 4 . 1 1 160 160 ARG H H 159 7.650 7.650 8.124 -0.474 18533
3002 1 4 . 1 1 161 161 ASN N N 160 118.560 118.560 118.183 0.377 18533
3003 1 4 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.458 0.282 18533
3004 1 4 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.295 -2.045 18533
3005 1 4 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.945 0.225 18533
3006 1 4 . 1 1 161 161 ASN H H 160 8.100 8.100 7.900 0.200 18533
3007 1 4 . 1 1 162 162 GLY N N 161 108.900 108.900 105.628 3.272 18533
3008 1 4 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.889 -0.159 18533
3009 1 4 . 1 1 162 162 GLY H H 161 7.980 7.980 7.387 0.593 18533
3010 1 4 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.545 -0.085 18533
3011 1 4 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.397 1.053 18533
3012 1 4 . 1 1 163 163 PRO CB C 162 32.200 32.200 29.783 2.417 18533
3013 1 5 . 1 1 2 2 MET N N 1 119.850 119.850 122.553 -2.703 18533
3014 1 5 . 1 1 2 2 MET HA H 1 4.500 4.500 4.746 -0.246 18533
3015 1 5 . 1 1 2 2 MET CA C 1 55.450 55.450 55.562 -0.112 18533
3016 1 5 . 1 1 2 2 MET CB C 1 33.170 33.170 33.106 0.064 18533
3017 1 5 . 1 1 2 2 MET H H 1 8.140 8.140 8.405 -0.265 18533
3018 1 5 . 1 1 3 3 SER N N 2 117.000 117.000 117.108 -0.108 18533
3019 1 5 . 1 1 3 3 SER HA H 2 4.430 4.430 4.710 -0.280 18533
3020 1 5 . 1 1 3 3 SER CA C 2 58.320 58.320 57.602 0.717 18533
3021 1 5 . 1 1 3 3 SER CB C 2 63.990 63.990 65.262 -1.272 18533
3022 1 5 . 1 1 3 3 SER H H 2 8.340 8.340 8.405 -0.065 18533
3023 1 5 . 1 1 4 4 ASP N N 3 123.200 123.200 119.751 3.449 18533
3024 1 5 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.916 -0.056 18533
3025 1 5 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.541 0.339 18533
3026 1 5 . 1 1 4 4 ASP CB C 3 40.800 40.800 41.076 -0.276 18533
3027 1 5 . 1 1 4 4 ASP H H 3 8.260 8.260 8.165 0.095 18533
3028 1 5 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.493 -0.093 18533
3029 1 5 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.636 0.184 18533
3030 1 5 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.567 -0.657 18533
3031 1 5 . 1 1 6 6 LEU N N 5 123.160 123.160 121.158 2.002 18533
3032 1 5 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.380 0.010 18533
3033 1 5 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.142 0.138 18533
3034 1 5 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.661 0.689 18533
3035 1 5 . 1 1 6 6 LEU H H 5 7.670 7.670 8.342 -0.672 18533
3036 1 5 . 1 1 7 7 HIS N N 6 127.160 127.160 117.296 9.864 18533
3037 1 5 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.095 0.935 18533
3038 1 5 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.097 -2.197 18533
3039 1 5 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.276 0.854 18533
3040 1 5 . 1 1 7 7 HIS H H 6 10.080 10.080 8.570 1.510 18533
3041 1 5 . 1 1 8 8 VAL N N 7 128.620 128.620 128.435 0.185 18533
3042 1 5 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.992 -0.492 18533
3043 1 5 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.096 -0.296 18533
3044 1 5 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.486 2.314 18533
3045 1 5 . 1 1 8 8 VAL H H 7 8.930 8.930 9.124 -0.194 18533
3046 1 5 . 1 1 9 9 THR N N 8 121.530 121.530 122.995 -1.465 18533
3047 1 5 . 1 1 9 9 THR HA H 8 5.270 5.270 4.723 0.547 18533
3048 1 5 . 1 1 9 9 THR CA C 8 58.520 58.520 59.399 -0.879 18533
3049 1 5 . 1 1 9 9 THR CB C 8 70.750 70.750 69.591 1.159 18533
3050 1 5 . 1 1 9 9 THR H H 8 7.970 7.970 8.917 -0.947 18533
3051 1 5 . 1 1 10 10 PHE N N 9 125.360 125.360 128.199 -2.839 18533
3052 1 5 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.071 0.139 18533
3053 1 5 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.124 0.186 18533
3054 1 5 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.555 3.275 18533
3055 1 5 . 1 1 10 10 PHE H H 9 8.180 8.180 8.124 0.056 18533
3056 1 5 . 1 1 11 11 VAL N N 10 121.120 121.120 122.013 -0.893 18533
3057 1 5 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.279 0.081 18533
3058 1 5 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.803 -0.383 18533
3059 1 5 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.643 1.907 18533
3060 1 5 . 1 1 11 11 VAL H H 10 8.710 8.710 9.199 -0.489 18533
3061 1 5 . 1 1 12 12 CYS N N 11 123.270 123.270 126.012 -2.742 18533
3062 1 5 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.255 -0.995 18533
3063 1 5 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.531 1.099 18533
3064 1 5 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.952 -1.602 18533
3065 1 5 . 1 1 12 12 CYS H H 11 7.940 7.940 8.616 -0.676 18533
3066 1 5 . 1 1 13 13 THR HA H 12 5.010 5.010 3.965 1.045 18533
3067 1 5 . 1 1 13 13 THR CA C 12 64.870 64.870 63.083 1.787 18533
3068 1 5 . 1 1 13 13 THR CB C 12 69.180 69.180 67.079 2.101 18533
3069 1 5 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.017 -0.057 18533
3070 1 5 . 1 1 15 15 ASN N N 14 119.960 119.960 116.835 3.125 18533
3071 1 5 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.335 -0.405 18533
3072 1 5 . 1 1 15 15 ASN CA C 14 54.870 54.870 53.999 0.871 18533
3073 1 5 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.173 2.497 18533
3074 1 5 . 1 1 15 15 ASN H H 14 9.280 9.280 8.606 0.674 18533
3075 1 5 . 1 1 16 16 ILE N N 15 101.060 101.060 110.774 -9.714 18533
3076 1 5 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.828 -0.148 18533
3077 1 5 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.473 1.317 18533
3078 1 5 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.142 3.998 18533
3079 1 5 . 1 1 16 16 ILE H H 15 7.100 7.100 7.900 -0.800 18533
3080 1 5 . 1 1 17 17 CYS N N 16 116.020 116.020 118.946 -2.926 18533
3081 1 5 . 1 1 17 17 CYS HA H 16 4.940 4.940 5.194 -0.254 18533
3082 1 5 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.636 1.424 18533
3083 1 5 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.076 0.874 18533
3084 1 5 . 1 1 17 17 CYS H H 16 7.700 7.700 7.806 -0.106 18533
3085 1 5 . 1 1 19 19 SER N N 18 122.340 122.340 114.782 7.558 18533
3086 1 5 . 1 1 19 19 SER HA H 18 3.810 3.810 4.164 -0.354 18533
3087 1 5 . 1 1 19 19 SER CA C 18 62.710 62.710 63.527 -0.817 18533
3088 1 5 . 1 1 19 19 SER CB C 18 64.860 64.860 60.919 3.941 18533
3089 1 5 . 1 1 19 19 SER H H 18 11.420 11.420 8.479 2.941 18533
3090 1 5 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.065 -0.095 18533
3091 1 5 . 1 1 20 20 PRO CA C 19 65.030 65.030 65.017 0.013 18533
3092 1 5 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.834 -2.144 18533
3093 1 5 . 1 1 21 21 MET N N 20 112.430 112.430 117.949 -5.519 18533
3094 1 5 . 1 1 21 21 MET HA H 20 3.730 3.730 3.881 -0.151 18533
3095 1 5 . 1 1 21 21 MET CA C 20 60.160 60.160 59.703 0.457 18533
3096 1 5 . 1 1 21 21 MET CB C 20 33.040 33.040 32.104 0.936 18533
3097 1 5 . 1 1 21 21 MET H H 20 6.310 6.310 7.437 -1.127 18533
3098 1 5 . 1 1 22 22 ALA N N 21 117.800 117.800 119.568 -1.768 18533
3099 1 5 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.812 -0.412 18533
3100 1 5 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.321 0.669 18533
3101 1 5 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.690 -1.200 18533
3102 1 5 . 1 1 22 22 ALA H H 21 6.550 6.550 7.392 -0.842 18533
3103 1 5 . 1 1 23 23 GLU N N 22 115.520 115.520 118.883 -3.363 18533
3104 1 5 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.144 -0.464 18533
3105 1 5 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.758 -0.208 18533
3106 1 5 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.850 -0.060 18533
3107 1 5 . 1 1 23 23 GLU H H 22 7.800 7.800 7.800 -0.000 18533
3108 1 5 . 1 1 24 24 LYS N N 23 114.220 114.220 116.153 -1.933 18533
3109 1 5 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.203 -0.203 18533
3110 1 5 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.006 -0.246 18533
3111 1 5 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.367 -1.567 18533
3112 1 5 . 1 1 24 24 LYS H H 23 8.040 8.040 7.528 0.512 18533
3113 1 5 . 1 1 25 25 MET N N 24 115.250 115.250 119.847 -4.597 18533
3114 1 5 . 1 1 25 25 MET HA H 24 3.950 3.950 3.707 0.243 18533
3115 1 5 . 1 1 25 25 MET CA C 24 57.980 57.980 58.980 -1.000 18533
3116 1 5 . 1 1 25 25 MET CB C 24 35.500 35.500 32.280 3.220 18533
3117 1 5 . 1 1 25 25 MET H H 24 7.610 7.610 7.532 0.078 18533
3118 1 5 . 1 1 26 26 PHE N N 25 119.090 119.090 116.268 2.822 18533
3119 1 5 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.879 -0.539 18533
3120 1 5 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.286 -0.256 18533
3121 1 5 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.518 1.942 18533
3122 1 5 . 1 1 26 26 PHE H H 25 8.560 8.560 7.809 0.751 18533
3123 1 5 . 1 1 27 27 ALA N N 26 117.830 117.830 122.362 -4.532 18533
3124 1 5 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.745 0.185 18533
3125 1 5 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.154 0.906 18533
3126 1 5 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.827 0.583 18533
3127 1 5 . 1 1 27 27 ALA H H 26 8.800 8.800 7.174 1.626 18533
3128 1 5 . 1 1 28 28 GLN N N 27 117.550 117.550 118.238 -0.688 18533
3129 1 5 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.066 -0.016 18533
3130 1 5 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.915 0.695 18533
3131 1 5 . 1 1 28 28 GLN CB C 27 28.450 28.450 28.115 0.335 18533
3132 1 5 . 1 1 28 28 GLN H H 27 7.690 7.690 7.821 -0.131 18533
3133 1 5 . 1 1 29 29 GLN N N 28 117.530 117.530 119.723 -2.193 18533
3134 1 5 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.066 0.074 18533
3135 1 5 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.739 0.441 18533
3136 1 5 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.897 -0.787 18533
3137 1 5 . 1 1 29 29 GLN H H 28 8.210 8.210 7.644 0.566 18533
3138 1 5 . 1 1 30 30 LEU N N 29 119.330 119.330 120.019 -0.689 18533
3139 1 5 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.993 -0.063 18533
3140 1 5 . 1 1 30 30 LEU CA C 29 58.080 58.080 58.212 -0.132 18533
3141 1 5 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.460 0.440 18533
3142 1 5 . 1 1 30 30 LEU H H 29 8.540 8.540 8.409 0.131 18533
3143 1 5 . 1 1 31 31 ARG N N 30 120.880 120.880 118.130 2.750 18533
3144 1 5 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.073 -0.103 18533
3145 1 5 . 1 1 31 31 ARG CA C 30 59.790 59.790 58.997 0.793 18533
3146 1 5 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.212 0.308 18533
3147 1 5 . 1 1 31 31 ARG H H 30 8.050 8.050 7.880 0.170 18533
3148 1 5 . 1 1 32 32 HIS N N 31 119.770 119.770 119.071 0.699 18533
3149 1 5 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.420 0.130 18533
3150 1 5 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.894 -0.814 18533
3151 1 5 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.277 0.433 18533
3152 1 5 . 1 1 32 32 HIS H H 31 8.440 8.440 8.310 0.130 18533
3153 1 5 . 1 1 33 33 ARG N N 32 115.430 115.430 117.251 -1.821 18533
3154 1 5 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.486 0.104 18533
3155 1 5 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.204 -0.234 18533
3156 1 5 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.835 -0.615 18533
3157 1 5 . 1 1 33 33 ARG H H 32 7.500 7.500 7.926 -0.426 18533
3158 1 5 . 1 1 34 34 GLY N N 33 106.730 106.730 108.976 -2.246 18533
3159 1 5 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.063 1.137 18533
3160 1 5 . 1 1 34 34 GLY H H 33 7.750 7.750 8.346 -0.596 18533
3161 1 5 . 1 1 35 35 LEU N N 34 119.980 119.980 117.576 2.404 18533
3162 1 5 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.856 -0.176 18533
3163 1 5 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.718 0.432 18533
3164 1 5 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.514 0.676 18533
3165 1 5 . 1 1 35 35 LEU H H 34 7.980 7.980 8.498 -0.518 18533
3166 1 5 . 1 1 36 36 GLY N N 35 108.660 108.660 109.076 -0.416 18533
3167 1 5 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.671 -0.571 18533
3168 1 5 . 1 1 36 36 GLY H H 35 8.830 8.830 7.918 0.912 18533
3169 1 5 . 1 1 37 37 ASP N N 36 115.360 115.360 118.057 -2.697 18533
3170 1 5 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.571 0.199 18533
3171 1 5 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.238 -0.848 18533
3172 1 5 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.937 0.233 18533
3173 1 5 . 1 1 37 37 ASP H H 36 8.300 8.300 8.385 -0.085 18533
3174 1 5 . 1 1 38 38 ALA N N 37 121.460 121.460 120.454 1.006 18533
3175 1 5 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.352 -0.042 18533
3176 1 5 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.319 -0.369 18533
3177 1 5 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.214 0.636 18533
3178 1 5 . 1 1 38 38 ALA H H 37 7.380 7.380 7.266 0.114 18533
3179 1 5 . 1 1 39 39 VAL N N 38 115.660 115.660 117.698 -2.038 18533
3180 1 5 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.452 0.348 18533
3181 1 5 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.496 -0.456 18533
3182 1 5 . 1 1 39 39 VAL CB C 38 35.190 35.190 33.824 1.366 18533
3183 1 5 . 1 1 39 39 VAL H H 38 7.100 7.100 8.069 -0.969 18533
3184 1 5 . 1 1 40 40 ARG N N 39 129.230 129.230 126.437 2.793 18533
3185 1 5 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.552 -0.012 18533
3186 1 5 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.180 1.530 18533
3187 1 5 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.853 1.467 18533
3188 1 5 . 1 1 40 40 ARG H H 39 9.730 9.730 8.191 1.539 18533
3189 1 5 . 1 1 41 41 VAL N N 40 126.240 126.240 124.642 1.598 18533
3190 1 5 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.705 0.985 18533
3191 1 5 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.070 -0.510 18533
3192 1 5 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.927 0.013 18533
3193 1 5 . 1 1 41 41 VAL H H 40 8.610 8.610 8.589 0.021 18533
3194 1 5 . 1 1 42 42 THR N N 41 117.310 117.310 119.054 -1.744 18533
3195 1 5 . 1 1 42 42 THR HA H 41 4.890 4.890 4.778 0.112 18533
3196 1 5 . 1 1 42 42 THR CA C 41 60.300 60.300 59.316 0.984 18533
3197 1 5 . 1 1 42 42 THR CB C 41 73.890 73.890 71.879 2.011 18533
3198 1 5 . 1 1 42 42 THR H H 41 8.870 8.870 9.009 -0.139 18533
3199 1 5 . 1 1 43 43 SER N N 42 109.960 109.960 113.304 -3.344 18533
3200 1 5 . 1 1 43 43 SER HA H 42 5.720 5.720 4.889 0.831 18533
3201 1 5 . 1 1 43 43 SER CA C 42 58.090 58.090 57.767 0.323 18533
3202 1 5 . 1 1 43 43 SER CB C 42 65.870 65.870 66.360 -0.490 18533
3203 1 5 . 1 1 43 43 SER H H 42 8.060 8.060 8.550 -0.490 18533
3204 1 5 . 1 1 44 44 ALA N N 43 119.200 119.200 119.741 -0.541 18533
3205 1 5 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.413 -1.153 18533
3206 1 5 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.736 -0.556 18533
3207 1 5 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.062 -1.232 18533
3208 1 5 . 1 1 44 44 ALA H H 43 8.710 8.710 9.049 -0.339 18533
3209 1 5 . 1 1 45 45 GLY N N 44 104.090 104.090 106.580 -2.490 18533
3210 1 5 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.028 -1.488 18533
3211 1 5 . 1 1 45 45 GLY H H 44 8.670 8.670 8.220 0.450 18533
3212 1 5 . 1 1 46 46 THR N N 45 114.060 114.060 117.107 -3.047 18533
3213 1 5 . 1 1 46 46 THR HA H 45 4.080 4.080 4.100 -0.020 18533
3214 1 5 . 1 1 46 46 THR CA C 45 64.680 64.680 64.928 -0.248 18533
3215 1 5 . 1 1 46 46 THR CB C 45 67.880 67.880 68.568 -0.688 18533
3216 1 5 . 1 1 46 46 THR H H 45 9.120 9.120 8.482 0.637 18533
3217 1 5 . 1 1 47 47 GLY N N 46 110.380 110.380 108.454 1.926 18533
3218 1 5 . 1 1 47 47 GLY CA C 46 43.830 43.830 44.025 -0.195 18533
3219 1 5 . 1 1 47 47 GLY H H 46 8.930 8.930 8.292 0.638 18533
3220 1 5 . 1 1 48 48 ASN N N 47 113.440 113.440 117.334 -3.894 18533
3221 1 5 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.364 0.126 18533
3222 1 5 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.358 -2.598 18533
3223 1 5 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.777 2.073 18533
3224 1 5 . 1 1 48 48 ASN H H 47 7.600 7.600 7.696 -0.096 18533
3225 1 5 . 1 1 49 49 TRP N N 48 117.300 117.300 121.348 -4.048 18533
3226 1 5 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.424 -0.524 18533
3227 1 5 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.232 0.628 18533
3228 1 5 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.070 -0.550 18533
3229 1 5 . 1 1 49 49 TRP H H 48 6.920 6.920 8.642 -1.722 18533
3230 1 5 . 1 1 50 50 HIS N N 49 111.590 111.590 114.865 -3.275 18533
3231 1 5 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.829 0.051 18533
3232 1 5 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.222 -1.362 18533
3233 1 5 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.724 1.316 18533
3234 1 5 . 1 1 50 50 HIS H H 49 8.620 8.620 8.535 0.085 18533
3235 1 5 . 1 1 51 51 VAL N N 50 119.010 119.010 120.066 -1.056 18533
3236 1 5 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.582 -0.382 18533
3237 1 5 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.547 1.133 18533
3238 1 5 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.685 -0.295 18533
3239 1 5 . 1 1 51 51 VAL H H 50 6.880 6.880 7.371 -0.491 18533
3240 1 5 . 1 1 52 52 GLY N N 51 115.450 115.450 116.539 -1.089 18533
3241 1 5 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.621 -0.681 18533
3242 1 5 . 1 1 52 52 GLY H H 51 9.120 9.120 8.963 0.157 18533
3243 1 5 . 1 1 53 53 SER N N 52 116.620 116.620 115.713 0.907 18533
3244 1 5 . 1 1 53 53 SER HA H 52 4.610 4.610 4.725 -0.115 18533
3245 1 5 . 1 1 53 53 SER CA C 52 59.310 59.310 57.860 1.450 18533
3246 1 5 . 1 1 53 53 SER CB C 52 64.630 64.630 65.058 -0.428 18533
3247 1 5 . 1 1 53 53 SER H H 52 8.430 8.430 8.098 0.332 18533
3248 1 5 . 1 1 54 54 CYS N N 53 118.690 118.690 117.863 0.827 18533
3249 1 5 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.196 -0.096 18533
3250 1 5 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.142 1.528 18533
3251 1 5 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.320 -2.970 18533
3252 1 5 . 1 1 54 54 CYS H H 53 8.170 8.170 8.422 -0.252 18533
3253 1 5 . 1 1 55 55 ALA N N 54 118.580 118.580 124.464 -5.884 18533
3254 1 5 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.191 -0.071 18533
3255 1 5 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.821 -0.181 18533
3256 1 5 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.233 -2.603 18533
3257 1 5 . 1 1 55 55 ALA H H 54 8.420 8.420 8.598 -0.178 18533
3258 1 5 . 1 1 56 56 ASP N N 55 121.500 121.500 122.581 -1.081 18533
3259 1 5 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.460 -0.120 18533
3260 1 5 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.125 0.925 18533
3261 1 5 . 1 1 56 56 ASP CB C 55 46.060 46.060 41.912 4.148 18533
3262 1 5 . 1 1 56 56 ASP H H 55 8.470 8.470 7.968 0.502 18533
3263 1 5 . 1 1 57 57 GLU N N 56 127.840 127.840 123.917 3.923 18533
3264 1 5 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.747 0.293 18533
3265 1 5 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.785 -0.145 18533
3266 1 5 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.205 0.295 18533
3267 1 5 . 1 1 57 57 GLU H H 56 9.230 9.230 8.907 0.323 18533
3268 1 5 . 1 1 58 58 ARG N N 57 120.820 120.820 118.408 2.412 18533
3269 1 5 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.698 0.112 18533
3270 1 5 . 1 1 58 58 ARG CA C 57 58.150 58.150 57.912 0.238 18533
3271 1 5 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.387 -2.117 18533
3272 1 5 . 1 1 58 58 ARG H H 57 9.220 9.220 8.183 1.037 18533
3273 1 5 . 1 1 59 59 ALA N N 58 121.590 121.590 122.332 -0.742 18533
3274 1 5 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.116 0.044 18533
3275 1 5 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.463 0.317 18533
3276 1 5 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.389 0.101 18533
3277 1 5 . 1 1 59 59 ALA H H 58 6.680 6.680 8.083 -1.403 18533
3278 1 5 . 1 1 60 60 ALA N N 59 118.970 118.970 121.581 -2.611 18533
3279 1 5 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.948 -0.088 18533
3280 1 5 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.150 -0.130 18533
3281 1 5 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.412 -0.342 18533
3282 1 5 . 1 1 60 60 ALA H H 59 8.540 8.540 8.514 0.026 18533
3283 1 5 . 1 1 61 61 GLY N N 60 104.160 104.160 106.490 -2.330 18533
3284 1 5 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.787 0.483 18533
3285 1 5 . 1 1 61 61 GLY H H 60 8.210 8.210 8.094 0.116 18533
3286 1 5 . 1 1 62 62 VAL N N 61 122.820 122.820 123.327 -0.507 18533
3287 1 5 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.671 0.179 18533
3288 1 5 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.438 -0.188 18533
3289 1 5 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.975 -0.085 18533
3290 1 5 . 1 1 62 62 VAL H H 61 7.310 7.310 7.377 -0.067 18533
3291 1 5 . 1 1 63 63 LEU N N 62 120.310 120.310 118.709 1.601 18533
3292 1 5 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.148 -0.168 18533
3293 1 5 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.291 0.659 18533
3294 1 5 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.424 0.076 18533
3295 1 5 . 1 1 63 63 LEU H H 62 8.090 8.090 8.378 -0.288 18533
3296 1 5 . 1 1 64 64 ARG N N 63 119.440 119.440 119.133 0.307 18533
3297 1 5 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.393 -0.213 18533
3298 1 5 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.765 0.685 18533
3299 1 5 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.684 0.696 18533
3300 1 5 . 1 1 64 64 ARG H H 63 8.740 8.740 8.599 0.141 18533
3301 1 5 . 1 1 65 65 ALA N N 64 122.560 122.560 121.874 0.686 18533
3302 1 5 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.112 -0.082 18533
3303 1 5 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.054 0.486 18533
3304 1 5 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.337 -0.257 18533
3305 1 5 . 1 1 65 65 ALA H H 64 7.910 7.910 7.802 0.108 18533
3306 1 5 . 1 1 66 66 HIS N N 65 112.690 112.690 114.600 -1.910 18533
3307 1 5 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.659 -0.019 18533
3308 1 5 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.174 -0.674 18533
3309 1 5 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.475 -0.155 18533
3310 1 5 . 1 1 66 66 HIS H H 65 7.410 7.410 7.890 -0.480 18533
3311 1 5 . 1 1 67 67 GLY N N 66 107.440 107.440 107.643 -0.203 18533
3312 1 5 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.026 1.334 18533
3313 1 5 . 1 1 67 67 GLY H H 66 7.850 7.850 7.803 0.047 18533
3314 1 5 . 1 1 68 68 TYR N N 67 119.940 119.940 120.834 -0.894 18533
3315 1 5 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.755 0.045 18533
3316 1 5 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.588 0.512 18533
3317 1 5 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.857 1.003 18533
3318 1 5 . 1 1 68 68 TYR H H 67 8.380 8.380 8.308 0.072 18533
3319 1 5 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.515 0.045 18533
3320 1 5 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.919 -0.319 18533
3321 1 5 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.486 0.325 18533
3322 1 5 . 1 1 70 70 THR N N 69 100.660 100.660 107.925 -7.265 18533
3323 1 5 . 1 1 70 70 THR HA H 69 4.300 4.300 4.416 -0.116 18533
3324 1 5 . 1 1 70 70 THR CA C 69 61.250 61.250 61.247 0.003 18533
3325 1 5 . 1 1 70 70 THR CB C 69 70.740 70.740 69.484 1.256 18533
3326 1 5 . 1 1 70 70 THR H H 69 7.860 7.860 8.085 -0.225 18533
3327 1 5 . 1 1 71 71 ASP N N 70 122.880 122.880 122.959 -0.079 18533
3328 1 5 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.687 -0.277 18533
3329 1 5 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.745 1.125 18533
3330 1 5 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.386 -0.416 18533
3331 1 5 . 1 1 71 71 ASP H H 70 7.940 7.940 7.822 0.118 18533
3332 1 5 . 1 1 72 72 HIS N N 71 121.720 121.720 124.022 -2.302 18533
3333 1 5 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.794 -0.094 18533
3334 1 5 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.548 0.842 18533
3335 1 5 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.958 2.382 18533
3336 1 5 . 1 1 72 72 HIS H H 71 8.000 8.000 8.023 -0.023 18533
3337 1 5 . 1 1 73 73 ARG N N 72 125.760 125.760 125.436 0.324 18533
3338 1 5 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.962 -0.672 18533
3339 1 5 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.423 0.007 18533
3340 1 5 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.086 0.224 18533
3341 1 5 . 1 1 73 73 ARG H H 72 7.230 7.230 8.019 -0.789 18533
3342 1 5 . 1 1 74 74 ALA N N 73 127.970 127.970 129.420 -1.450 18533
3343 1 5 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.698 -0.068 18533
3344 1 5 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.345 -0.165 18533
3345 1 5 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.062 -1.162 18533
3346 1 5 . 1 1 74 74 ALA H H 73 9.090 9.090 8.335 0.755 18533
3347 1 5 . 1 1 75 75 ALA N N 74 126.090 126.090 125.345 0.745 18533
3348 1 5 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.781 0.009 18533
3349 1 5 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.493 0.477 18533
3350 1 5 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.151 1.469 18533
3351 1 5 . 1 1 75 75 ALA H H 74 9.410 9.410 9.728 -0.318 18533
3352 1 5 . 1 1 76 76 GLN N N 75 123.260 123.260 120.851 2.409 18533
3353 1 5 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.570 0.380 18533
3354 1 5 . 1 1 76 76 GLN CA C 75 53.550 53.550 54.056 -0.506 18533
3355 1 5 . 1 1 76 76 GLN CB C 75 30.050 30.050 30.751 -0.701 18533
3356 1 5 . 1 1 76 76 GLN H H 75 8.800 8.800 8.431 0.369 18533
3357 1 5 . 1 1 77 77 VAL N N 76 125.510 125.510 123.605 1.905 18533
3358 1 5 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.298 0.002 18533
3359 1 5 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.353 0.227 18533
3360 1 5 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.753 1.737 18533
3361 1 5 . 1 1 77 77 VAL H H 76 8.550 8.550 7.941 0.609 18533
3362 1 5 . 1 1 78 78 GLY N N 77 121.850 121.850 116.204 5.646 18533
3363 1 5 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.030 -0.190 18533
3364 1 5 . 1 1 78 78 GLY H H 77 10.930 10.930 8.205 2.725 18533
3365 1 5 . 1 1 79 79 THR N N 78 115.210 115.210 116.219 -1.009 18533
3366 1 5 . 1 1 79 79 THR HA H 78 3.700 3.700 3.924 -0.224 18533
3367 1 5 . 1 1 79 79 THR CA C 78 66.440 66.440 67.653 -1.213 18533
3368 1 5 . 1 1 79 79 THR CB C 78 68.770 68.770 68.827 -0.057 18533
3369 1 5 . 1 1 79 79 THR H H 78 8.540 8.540 8.419 0.121 18533
3370 1 5 . 1 1 80 80 GLU N N 79 119.360 119.360 119.357 0.003 18533
3371 1 5 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.030 -0.070 18533
3372 1 5 . 1 1 80 80 GLU CA C 79 59.030 59.030 59.015 0.015 18533
3373 1 5 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.528 0.532 18533
3374 1 5 . 1 1 80 80 GLU H H 79 9.110 9.110 8.923 0.187 18533
3375 1 5 . 1 1 81 81 HIS N N 80 118.380 118.380 117.278 1.102 18533
3376 1 5 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.233 -0.293 18533
3377 1 5 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.968 1.452 18533
3378 1 5 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.120 0.810 18533
3379 1 5 . 1 1 81 81 HIS H H 80 7.040 7.040 7.482 -0.442 18533
3380 1 5 . 1 1 82 82 LEU N N 81 114.010 114.010 119.547 -5.537 18533
3381 1 5 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.067 -0.167 18533
3382 1 5 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.901 -0.221 18533
3383 1 5 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.562 -0.832 18533
3384 1 5 . 1 1 82 82 LEU H H 81 7.850 7.850 8.256 -0.406 18533
3385 1 5 . 1 1 83 83 ALA N N 82 119.050 119.050 118.243 0.807 18533
3386 1 5 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.349 0.041 18533
3387 1 5 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.744 -0.544 18533
3388 1 5 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.727 0.453 18533
3389 1 5 . 1 1 83 83 ALA H H 82 6.950 6.950 7.358 -0.408 18533
3390 1 5 . 1 1 84 84 ALA N N 83 122.500 122.500 122.227 0.273 18533
3391 1 5 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.189 -0.429 18533
3392 1 5 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.536 1.814 18533
3393 1 5 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.403 -2.083 18533
3394 1 5 . 1 1 84 84 ALA H H 83 7.280 7.280 7.320 -0.040 18533
3395 1 5 . 1 1 85 85 ASP N N 84 118.740 118.740 120.374 -1.634 18533
3396 1 5 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.722 -0.312 18533
3397 1 5 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.254 1.386 18533
3398 1 5 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.243 0.657 18533
3399 1 5 . 1 1 85 85 ASP H H 84 8.440 8.440 8.371 0.069 18533
3400 1 5 . 1 1 86 86 LEU N N 85 115.180 115.180 118.396 -3.216 18533
3401 1 5 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.884 -0.704 18533
3402 1 5 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.890 1.150 18533
3403 1 5 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.722 0.448 18533
3404 1 5 . 1 1 86 86 LEU H H 85 7.280 7.280 8.244 -0.964 18533
3405 1 5 . 1 1 87 87 LEU N N 86 128.140 128.140 127.636 0.504 18533
3406 1 5 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.911 -0.221 18533
3407 1 5 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.779 1.601 18533
3408 1 5 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.425 -0.256 18533
3409 1 5 . 1 1 87 87 LEU H H 86 8.780 8.780 8.990 -0.210 18533
3410 1 5 . 1 1 88 88 VAL N N 87 122.630 122.630 127.100 -4.470 18533
3411 1 5 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.957 -0.327 18533
3412 1 5 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.342 -1.432 18533
3413 1 5 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.907 -0.067 18533
3414 1 5 . 1 1 88 88 VAL H H 87 9.010 9.010 9.024 -0.014 18533
3415 1 5 . 1 1 89 89 ALA N N 88 129.820 129.820 131.607 -1.787 18533
3416 1 5 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.894 -0.374 18533
3417 1 5 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.333 -0.553 18533
3418 1 5 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.232 -0.452 18533
3419 1 5 . 1 1 89 89 ALA H H 88 8.590 8.590 9.124 -0.534 18533
3420 1 5 . 1 1 90 90 LEU N N 89 129.280 129.280 119.749 9.531 18533
3421 1 5 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.635 -0.325 18533
3422 1 5 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.114 0.336 18533
3423 1 5 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.921 -3.901 18533
3424 1 5 . 1 1 90 90 LEU H H 89 8.570 8.570 8.621 -0.051 18533
3425 1 5 . 1 1 91 91 ASP N N 90 126.910 126.910 116.270 10.640 18533
3426 1 5 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.734 0.066 18533
3427 1 5 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.964 -0.014 18533
3428 1 5 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.154 0.656 18533
3429 1 5 . 1 1 91 91 ASP H H 90 11.450 11.450 7.556 3.894 18533
3430 1 5 . 1 1 92 92 ARG N N 91 116.950 116.950 121.787 -4.837 18533
3431 1 5 . 1 1 92 92 ARG HA H 91 4.020 4.020 4.043 -0.023 18533
3432 1 5 . 1 1 92 92 ARG CA C 91 58.830 58.830 58.756 0.074 18533
3433 1 5 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.785 0.495 18533
3434 1 5 . 1 1 92 92 ARG H H 91 8.650 8.650 8.731 -0.081 18533
3435 1 5 . 1 1 93 93 ASN N N 92 120.740 120.740 119.256 1.484 18533
3436 1 5 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.445 -0.065 18533
3437 1 5 . 1 1 93 93 ASN CA C 92 56.130 56.130 56.016 0.114 18533
3438 1 5 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.617 -0.997 18533
3439 1 5 . 1 1 93 93 ASN H H 92 8.610 8.610 8.608 0.002 18533
3440 1 5 . 1 1 94 94 HIS N N 93 121.170 121.170 120.182 0.988 18533
3441 1 5 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.175 0.015 18533
3442 1 5 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.302 0.208 18533
3443 1 5 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.675 1.705 18533
3444 1 5 . 1 1 94 94 HIS H H 93 7.430 7.430 8.687 -1.257 18533
3445 1 5 . 1 1 95 95 ALA N N 94 118.270 118.270 121.266 -2.996 18533
3446 1 5 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.947 -0.207 18533
3447 1 5 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.480 0.020 18533
3448 1 5 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.344 -0.374 18533
3449 1 5 . 1 1 95 95 ALA H H 94 7.190 7.190 8.135 -0.945 18533
3450 1 5 . 1 1 96 96 ARG N N 95 117.190 117.190 119.281 -2.091 18533
3451 1 5 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.044 -0.134 18533
3452 1 5 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.279 0.221 18533
3453 1 5 . 1 1 96 96 ARG CB C 95 30.230 30.230 29.989 0.241 18533
3454 1 5 . 1 1 96 96 ARG H H 95 7.600 7.600 7.756 -0.156 18533
3455 1 5 . 1 1 97 97 LEU N N 96 120.700 120.700 119.702 0.998 18533
3456 1 5 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.971 0.109 18533
3457 1 5 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.732 0.168 18533
3458 1 5 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.709 -0.369 18533
3459 1 5 . 1 1 97 97 LEU H H 96 7.990 7.990 7.877 0.113 18533
3460 1 5 . 1 1 98 98 LEU N N 97 118.390 118.390 118.104 0.286 18533
3461 1 5 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.854 0.056 18533
3462 1 5 . 1 1 98 98 LEU CA C 97 58.100 58.100 57.921 0.179 18533
3463 1 5 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.220 0.670 18533
3464 1 5 . 1 1 98 98 LEU H H 97 8.210 8.210 8.144 0.066 18533
3465 1 5 . 1 1 99 99 ARG N N 98 117.470 117.470 117.837 -0.367 18533
3466 1 5 . 1 1 99 99 ARG HA H 98 4.480 4.480 3.930 0.550 18533
3467 1 5 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.055 -0.695 18533
3468 1 5 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.753 -1.013 18533
3469 1 5 . 1 1 99 99 ARG H H 98 7.740 7.740 8.065 -0.325 18533
3470 1 5 . 1 1 100 100 GLN N N 99 121.400 121.400 118.504 2.896 18533
3471 1 5 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.198 -0.128 18533
3472 1 5 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.105 0.575 18533
3473 1 5 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.115 0.205 18533
3474 1 5 . 1 1 100 100 GLN H H 99 8.030 8.030 7.964 0.066 18533
3475 1 5 . 1 1 101 101 LEU N N 100 118.940 118.940 117.331 1.609 18533
3476 1 5 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.177 0.083 18533
3477 1 5 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.188 0.272 18533
3478 1 5 . 1 1 101 101 LEU CB C 100 42.240 42.240 41.967 0.273 18533
3479 1 5 . 1 1 101 101 LEU H H 100 7.780 7.780 7.684 0.096 18533
3480 1 5 . 1 1 102 102 GLY N N 101 105.740 105.740 104.872 0.868 18533
3481 1 5 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.902 0.128 18533
3482 1 5 . 1 1 102 102 GLY H H 101 7.700 7.700 7.685 0.015 18533
3483 1 5 . 1 1 103 103 VAL N N 102 122.330 122.330 120.075 2.255 18533
3484 1 5 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.008 -0.378 18533
3485 1 5 . 1 1 103 103 VAL CA C 102 63.600 63.600 61.959 1.641 18533
3486 1 5 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.130 -1.640 18533
3487 1 5 . 1 1 103 103 VAL H H 102 7.520 7.520 7.442 0.078 18533
3488 1 5 . 1 1 104 104 GLU N N 103 128.990 128.990 114.487 14.503 18533
3489 1 5 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.421 -0.251 18533
3490 1 5 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.209 1.711 18533
3491 1 5 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.682 -3.732 18533
3492 1 5 . 1 1 104 104 GLU H H 103 9.210 9.210 7.876 1.334 18533
3493 1 5 . 1 1 105 105 ALA N N 104 124.410 124.410 122.529 1.881 18533
3494 1 5 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.262 -0.502 18533
3495 1 5 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.844 0.796 18533
3496 1 5 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.702 -0.562 18533
3497 1 5 . 1 1 105 105 ALA H H 104 8.500 8.500 8.695 -0.195 18533
3498 1 5 . 1 1 106 106 ALA N N 105 115.110 115.110 120.246 -5.136 18533
3499 1 5 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.167 -0.037 18533
3500 1 5 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.775 -0.735 18533
3501 1 5 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.552 0.508 18533
3502 1 5 . 1 1 106 106 ALA H H 105 8.270 8.270 8.327 -0.057 18533
3503 1 5 . 1 1 107 107 ARG N N 106 115.080 115.080 114.954 0.126 18533
3504 1 5 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.669 -0.209 18533
3505 1 5 . 1 1 107 107 ARG CA C 106 56.510 56.510 57.036 -0.526 18533
3506 1 5 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.627 0.743 18533
3507 1 5 . 1 1 107 107 ARG H H 106 7.740 7.740 7.633 0.107 18533
3508 1 5 . 1 1 108 108 VAL N N 107 118.170 118.170 122.019 -3.849 18533
3509 1 5 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.184 0.886 18533
3510 1 5 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.302 -1.662 18533
3511 1 5 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.507 1.093 18533
3512 1 5 . 1 1 108 108 VAL H H 107 7.290 7.290 8.305 -1.015 18533
3513 1 5 . 1 1 109 109 ARG N N 108 124.250 124.250 128.578 -4.328 18533
3514 1 5 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.645 -0.025 18533
3515 1 5 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.601 -0.711 18533
3516 1 5 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.103 0.877 18533
3517 1 5 . 1 1 109 109 ARG H H 108 8.420 8.420 9.252 -0.832 18533
3518 1 5 . 1 1 110 110 MET N N 109 119.570 119.570 121.536 -1.966 18533
3519 1 5 . 1 1 110 110 MET HA H 109 4.960 4.960 4.909 0.051 18533
3520 1 5 . 1 1 110 110 MET CA C 109 53.820 53.820 54.166 -0.346 18533
3521 1 5 . 1 1 110 110 MET CB C 109 30.680 30.680 32.414 -1.734 18533
3522 1 5 . 1 1 110 110 MET H H 109 8.890 8.890 8.597 0.293 18533
3523 1 5 . 1 1 111 111 LEU N N 110 128.660 128.660 126.719 1.941 18533
3524 1 5 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.271 -0.311 18533
3525 1 5 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.024 0.576 18533
3526 1 5 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.852 -0.772 18533
3527 1 5 . 1 1 111 111 LEU H H 110 9.200 9.200 8.924 0.276 18533
3528 1 5 . 1 1 112 112 ARG N N 111 111.910 111.910 116.190 -4.280 18533
3529 1 5 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.067 -0.117 18533
3530 1 5 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.589 1.331 18533
3531 1 5 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.572 -1.071 18533
3532 1 5 . 1 1 112 112 ARG H H 111 8.930 8.930 8.621 0.309 18533
3533 1 5 . 1 1 113 113 SER N N 112 114.800 114.800 115.098 -0.298 18533
3534 1 5 . 1 1 113 113 SER HA H 112 4.290 4.290 4.285 0.005 18533
3535 1 5 . 1 1 113 113 SER CA C 112 60.880 60.880 59.489 1.391 18533
3536 1 5 . 1 1 113 113 SER CB C 112 63.190 63.190 62.451 0.739 18533
3537 1 5 . 1 1 113 113 SER H H 112 7.680 7.680 7.750 -0.070 18533
3538 1 5 . 1 1 114 114 PHE N N 113 119.260 119.260 118.927 0.333 18533
3539 1 5 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.438 -0.088 18533
3540 1 5 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.812 1.117 18533
3541 1 5 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.550 0.170 18533
3542 1 5 . 1 1 114 114 PHE H H 113 7.600 7.600 7.669 -0.069 18533
3543 1 5 . 1 1 115 115 ASP N N 114 121.170 121.170 121.848 -0.678 18533
3544 1 5 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.949 0.071 18533
3545 1 5 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.577 -1.477 18533
3546 1 5 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.693 0.817 18533
3547 1 5 . 1 1 115 115 ASP H H 114 7.430 7.430 7.570 -0.140 18533
3548 1 5 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.351 0.139 18533
3549 1 5 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.525 -0.174 18533
3550 1 5 . 1 1 116 116 PRO CB C 115 32.270 32.270 31.963 0.307 18533
3551 1 5 . 1 1 117 117 ARG N N 116 117.910 117.910 118.176 -0.266 18533
3552 1 5 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.375 -0.105 18533
3553 1 5 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.618 0.832 18533
3554 1 5 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.286 -0.326 18533
3555 1 5 . 1 1 117 117 ARG H H 116 8.580 8.580 7.896 0.684 18533
3556 1 5 . 1 1 118 118 SER N N 117 116.130 116.130 116.236 -0.106 18533
3557 1 5 . 1 1 118 118 SER HA H 117 3.980 3.980 4.350 -0.370 18533
3558 1 5 . 1 1 118 118 SER CA C 117 59.790 59.790 58.541 1.249 18533
3559 1 5 . 1 1 118 118 SER CB C 117 63.760 63.760 62.051 1.708 18533
3560 1 5 . 1 1 118 118 SER H H 117 7.950 7.950 7.569 0.381 18533
3561 1 5 . 1 1 119 119 GLY N N 118 110.080 110.080 114.375 -4.295 18533
3562 1 5 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.496 -1.127 18533
3563 1 5 . 1 1 119 119 GLY H H 118 8.150 8.150 8.363 -0.213 18533
3564 1 5 . 1 1 120 120 THR HA H 119 4.020 4.020 4.435 -0.415 18533
3565 1 5 . 1 1 120 120 THR CA C 119 63.290 63.290 61.067 2.223 18533
3566 1 5 . 1 1 120 120 THR CB C 119 69.140 69.140 70.676 -1.536 18533
3567 1 5 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.368 0.202 18533
3568 1 5 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.888 0.122 18533
3569 1 5 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.470 0.520 18533
3570 1 5 . 1 1 122 122 ALA N N 121 125.880 125.880 129.170 -3.290 18533
3571 1 5 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.324 0.016 18533
3572 1 5 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.548 -0.039 18533
3573 1 5 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.573 0.027 18533
3574 1 5 . 1 1 122 122 ALA H H 121 7.980 7.980 8.571 -0.591 18533
3575 1 5 . 1 1 123 123 LEU N N 122 119.810 119.810 121.767 -1.957 18533
3576 1 5 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.459 -0.179 18533
3577 1 5 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.267 0.223 18533
3578 1 5 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.170 2.530 18533
3579 1 5 . 1 1 123 123 LEU H H 122 7.810 7.810 7.966 -0.156 18533
3580 1 5 . 1 1 124 124 ASP N N 123 119.050 119.050 116.753 2.297 18533
3581 1 5 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.586 -0.016 18533
3582 1 5 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.633 1.688 18533
3583 1 5 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.193 -0.523 18533
3584 1 5 . 1 1 124 124 ASP H H 123 8.270 8.270 7.485 0.785 18533
3585 1 5 . 1 1 125 125 VAL N N 124 121.970 121.970 122.178 -0.208 18533
3586 1 5 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.377 -0.117 18533
3587 1 5 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.842 1.468 18533
3588 1 5 . 1 1 125 125 VAL CB C 124 30.780 30.780 34.144 -3.364 18533
3589 1 5 . 1 1 125 125 VAL H H 124 7.930 7.930 7.941 -0.011 18533
3590 1 5 . 1 1 126 126 GLU N N 125 129.490 129.490 124.840 4.650 18533
3591 1 5 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.088 -0.008 18533
3592 1 5 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.623 0.387 18533
3593 1 5 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.528 -0.728 18533
3594 1 5 . 1 1 126 126 GLU H H 125 9.100 9.100 8.462 0.638 18533
3595 1 5 . 1 1 127 127 ASP N N 126 122.300 122.300 119.019 3.281 18533
3596 1 5 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.848 -0.738 18533
3597 1 5 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.000 0.720 18533
3598 1 5 . 1 1 127 127 ASP CB C 126 42.520 42.520 43.527 -1.007 18533
3599 1 5 . 1 1 127 127 ASP H H 126 8.630 8.630 8.318 0.312 18533
3600 1 5 . 1 1 128 128 PRO HA H 127 4.550 4.550 3.718 0.832 18533
3601 1 5 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.152 -0.552 18533
3602 1 5 . 1 1 128 128 PRO CB C 127 30.980 30.980 31.833 -0.853 18533
3603 1 5 . 1 1 129 129 TYR N N 128 122.380 122.380 119.183 3.197 18533
3604 1 5 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.275 -0.475 18533
3605 1 5 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.710 3.410 18533
3606 1 5 . 1 1 129 129 TYR CB C 128 39.390 39.390 38.134 1.256 18533
3607 1 5 . 1 1 129 129 TYR H H 128 8.670 8.670 8.311 0.359 18533
3608 1 5 . 1 1 130 130 TYR N N 129 116.300 116.300 111.392 4.908 18533
3609 1 5 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.869 -0.379 18533
3610 1 5 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.564 0.916 18533
3611 1 5 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.303 -2.643 18533
3612 1 5 . 1 1 130 130 TYR H H 129 8.680 8.680 8.118 0.562 18533
3613 1 5 . 1 1 131 131 GLY N N 130 110.870 110.870 111.317 -0.447 18533
3614 1 5 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.100 -1.020 18533
3615 1 5 . 1 1 131 131 GLY H H 130 8.060 8.060 8.788 -0.728 18533
3616 1 5 . 1 1 132 132 ASP N N 131 121.590 121.590 120.713 0.877 18533
3617 1 5 . 1 1 132 132 ASP HA H 131 5.070 5.070 5.081 -0.011 18533
3618 1 5 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.125 -0.125 18533
3619 1 5 . 1 1 132 132 ASP CB C 131 43.600 43.600 43.505 0.095 18533
3620 1 5 . 1 1 132 132 ASP H H 131 9.290 9.290 8.523 0.767 18533
3621 1 5 . 1 1 133 133 HIS HA H 132 4.110 4.110 2.773 1.337 18533
3622 1 5 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.891 1.679 18533
3623 1 5 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.157 0.323 18533
3624 1 5 . 1 1 134 134 SER N N 133 115.370 115.370 112.712 2.658 18533
3625 1 5 . 1 1 134 134 SER HA H 133 4.180 4.180 3.908 0.272 18533
3626 1 5 . 1 1 134 134 SER CA C 133 62.070 62.070 61.236 0.834 18533
3627 1 5 . 1 1 134 134 SER CB C 133 62.160 62.160 62.646 -0.486 18533
3628 1 5 . 1 1 134 134 SER H H 133 8.420 8.420 8.624 -0.204 18533
3629 1 5 . 1 1 135 135 ASP N N 134 123.360 123.360 123.284 0.076 18533
3630 1 5 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.137 0.393 18533
3631 1 5 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.365 0.675 18533
3632 1 5 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.181 0.629 18533
3633 1 5 . 1 1 135 135 ASP H H 134 7.980 7.980 7.397 0.583 18533
3634 1 5 . 1 1 136 136 PHE N N 135 118.940 118.940 117.387 1.553 18533
3635 1 5 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.402 -0.602 18533
3636 1 5 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.261 3.558 18533
3637 1 5 . 1 1 136 136 PHE CB C 135 39.350 39.350 37.612 1.738 18533
3638 1 5 . 1 1 136 136 PHE H H 135 7.850 7.850 7.374 0.476 18533
3639 1 5 . 1 1 137 137 GLU N N 136 121.410 121.410 120.604 0.806 18533
3640 1 5 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.118 0.062 18533
3641 1 5 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.082 0.418 18533
3642 1 5 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.019 -0.029 18533
3643 1 5 . 1 1 137 137 GLU H H 136 8.150 8.150 7.694 0.456 18533
3644 1 5 . 1 1 138 138 GLU N N 137 121.530 121.530 121.416 0.114 18533
3645 1 5 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.073 0.217 18533
3646 1 5 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.714 -0.314 18533
3647 1 5 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.388 -0.498 18533
3648 1 5 . 1 1 138 138 GLU H H 137 7.870 7.870 7.806 0.064 18533
3649 1 5 . 1 1 139 139 VAL N N 138 119.930 119.930 119.539 0.391 18533
3650 1 5 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.627 -0.147 18533
3651 1 5 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.390 0.690 18533
3652 1 5 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.255 0.095 18533
3653 1 5 . 1 1 139 139 VAL H H 138 7.770 7.770 7.740 0.030 18533
3654 1 5 . 1 1 140 140 PHE N N 139 119.130 119.130 121.130 -2.000 18533
3655 1 5 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.919 -0.359 18533
3656 1 5 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.795 0.885 18533
3657 1 5 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.771 0.399 18533
3658 1 5 . 1 1 140 140 PHE H H 139 8.050 8.050 8.100 -0.050 18533
3659 1 5 . 1 1 141 141 ALA N N 140 121.040 121.040 122.638 -1.598 18533
3660 1 5 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.232 -0.242 18533
3661 1 5 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.663 0.456 18533
3662 1 5 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.335 -0.035 18533
3663 1 5 . 1 1 141 141 ALA H H 140 8.010 8.010 8.157 -0.147 18533
3664 1 5 . 1 1 142 142 VAL N N 141 118.550 118.550 118.766 -0.216 18533
3665 1 5 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.535 0.275 18533
3666 1 5 . 1 1 142 142 VAL CA C 141 65.600 65.600 65.922 -0.322 18533
3667 1 5 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.987 -0.537 18533
3668 1 5 . 1 1 142 142 VAL H H 141 8.300 8.300 8.172 0.128 18533
3669 1 5 . 1 1 143 143 ILE N N 142 121.410 121.410 119.310 2.100 18533
3670 1 5 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.434 -0.044 18533
3671 1 5 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.298 0.752 18533
3672 1 5 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.865 -0.555 18533
3673 1 5 . 1 1 143 143 ILE H H 142 8.150 8.150 8.148 0.002 18533
3674 1 5 . 1 1 144 144 GLU N N 143 119.630 119.630 118.888 0.742 18533
3675 1 5 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.729 -0.189 18533
3676 1 5 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.100 0.660 18533
3677 1 5 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.903 0.827 18533
3678 1 5 . 1 1 144 144 GLU H H 143 8.640 8.640 7.998 0.642 18533
3679 1 5 . 1 1 145 145 SER N N 144 110.920 110.920 113.993 -3.073 18533
3680 1 5 . 1 1 145 145 SER HA H 144 4.230 4.230 4.211 0.019 18533
3681 1 5 . 1 1 145 145 SER CA C 144 60.810 60.810 60.595 0.215 18533
3682 1 5 . 1 1 145 145 SER CB C 144 63.610 63.610 63.447 0.163 18533
3683 1 5 . 1 1 145 145 SER H H 144 7.640 7.640 7.784 -0.144 18533
3684 1 5 . 1 1 146 146 ALA N N 145 123.110 123.110 124.277 -1.167 18533
3685 1 5 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.291 -0.171 18533
3686 1 5 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.055 -0.655 18533
3687 1 5 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.439 2.441 18533
3688 1 5 . 1 1 146 146 ALA H H 145 7.500 7.500 7.745 -0.245 18533
3689 1 5 . 1 1 147 147 LEU N N 146 114.220 114.220 119.837 -5.617 18533
3690 1 5 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.904 0.036 18533
3691 1 5 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.580 -0.530 18533
3692 1 5 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.396 0.064 18533
3693 1 5 . 1 1 147 147 LEU H H 146 7.410 7.410 8.158 -0.748 18533
3694 1 5 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.326 0.124 18533
3695 1 5 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.463 3.377 18533
3696 1 5 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.002 0.218 18533
3697 1 5 . 1 1 149 149 GLY N N 148 102.590 102.590 106.654 -4.064 18533
3698 1 5 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.584 1.676 18533
3699 1 5 . 1 1 149 149 GLY H H 148 7.960 7.960 7.937 0.023 18533
3700 1 5 . 1 1 150 150 LEU N N 149 128.060 128.060 123.576 4.484 18533
3701 1 5 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.329 0.301 18533
3702 1 5 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.296 0.054 18533
3703 1 5 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.340 -0.140 18533
3704 1 5 . 1 1 150 150 LEU H H 149 7.620 7.620 8.537 -0.917 18533
3705 1 5 . 1 1 151 151 HIS N N 150 120.730 120.730 118.051 2.679 18533
3706 1 5 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.086 0.084 18533
3707 1 5 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.234 1.146 18533
3708 1 5 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.963 0.547 18533
3709 1 5 . 1 1 151 151 HIS H H 150 8.430 8.430 8.514 -0.084 18533
3710 1 5 . 1 1 152 152 ASP N N 151 118.170 118.170 119.737 -1.567 18533
3711 1 5 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.419 0.001 18533
3712 1 5 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.891 -0.081 18533
3713 1 5 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.648 -0.618 18533
3714 1 5 . 1 1 152 152 ASP H H 151 7.820 7.820 8.130 -0.310 18533
3715 1 5 . 1 1 153 153 TRP N N 152 122.780 122.780 121.946 0.834 18533
3716 1 5 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.328 -0.218 18533
3717 1 5 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.472 1.138 18533
3718 1 5 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.178 -0.388 18533
3719 1 5 . 1 1 153 153 TRP H H 152 7.900 7.900 7.855 0.045 18533
3720 1 5 . 1 1 154 154 VAL N N 153 119.460 119.460 116.150 3.310 18533
3721 1 5 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.803 -0.453 18533
3722 1 5 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.324 0.656 18533
3723 1 5 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.485 0.415 18533
3724 1 5 . 1 1 154 154 VAL H H 153 8.560 8.560 8.581 -0.021 18533
3725 1 5 . 1 1 155 155 ASP N N 154 120.500 120.500 121.306 -0.806 18533
3726 1 5 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.292 -0.092 18533
3727 1 5 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.365 -0.796 18533
3728 1 5 . 1 1 155 155 ASP CB C 154 39.860 39.860 41.122 -1.262 18533
3729 1 5 . 1 1 155 155 ASP H H 154 8.530 8.530 8.382 0.148 18533
3730 1 5 . 1 1 156 156 GLU N N 155 120.090 120.090 119.564 0.526 18533
3731 1 5 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.931 -0.001 18533
3732 1 5 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.302 -0.142 18533
3733 1 5 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.324 -0.034 18533
3734 1 5 . 1 1 156 156 GLU H H 155 7.870 7.870 8.429 -0.559 18533
3735 1 5 . 1 1 157 157 ARG N N 156 119.230 119.230 119.101 0.129 18533
3736 1 5 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.983 -0.173 18533
3737 1 5 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.267 -0.277 18533
3738 1 5 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.239 -0.129 18533
3739 1 5 . 1 1 157 157 ARG H H 156 7.660 7.660 7.944 -0.284 18533
3740 1 5 . 1 1 158 158 LEU N N 157 118.790 118.790 117.780 1.010 18533
3741 1 5 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.161 -0.061 18533
3742 1 5 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.926 -1.246 18533
3743 1 5 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.702 0.988 18533
3744 1 5 . 1 1 158 158 LEU H H 157 8.470 8.470 8.360 0.110 18533
3745 1 5 . 1 1 159 159 ALA N N 158 120.760 120.760 122.661 -1.901 18533
3746 1 5 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.145 0.045 18533
3747 1 5 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.714 -1.434 18533
3748 1 5 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.624 -0.234 18533
3749 1 5 . 1 1 159 159 ALA H H 158 7.490 7.490 7.857 -0.367 18533
3750 1 5 . 1 1 160 160 ARG N N 159 117.810 117.810 117.307 0.503 18533
3751 1 5 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.122 0.088 18533
3752 1 5 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.276 -0.496 18533
3753 1 5 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.532 0.998 18533
3754 1 5 . 1 1 160 160 ARG H H 159 7.650 7.650 8.269 -0.619 18533
3755 1 5 . 1 1 161 161 ASN N N 160 118.560 118.560 117.863 0.697 18533
3756 1 5 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.439 0.301 18533
3757 1 5 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.509 -2.259 18533
3758 1 5 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.752 0.418 18533
3759 1 5 . 1 1 161 161 ASN H H 160 8.100 8.100 7.963 0.137 18533
3760 1 5 . 1 1 162 162 GLY N N 161 108.900 108.900 107.426 1.474 18533
3761 1 5 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.681 0.049 18533
3762 1 5 . 1 1 162 162 GLY H H 161 7.980 7.980 7.711 0.269 18533
3763 1 5 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.978 -0.518 18533
3764 1 5 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.467 -0.017 18533
3765 1 5 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.860 -0.660 18533
3766 1 6 . 1 1 2 2 MET N N 1 119.850 119.850 118.356 1.494 18533
3767 1 6 . 1 1 2 2 MET HA H 1 4.500 4.500 4.856 -0.356 18533
3768 1 6 . 1 1 2 2 MET CA C 1 55.450 55.450 54.791 0.659 18533
3769 1 6 . 1 1 2 2 MET CB C 1 33.170 33.170 34.980 -1.810 18533
3770 1 6 . 1 1 2 2 MET H H 1 8.140 8.140 8.146 -0.006 18533
3771 1 6 . 1 1 3 3 SER N N 2 117.000 117.000 118.596 -1.596 18533
3772 1 6 . 1 1 3 3 SER HA H 2 4.430 4.430 4.719 -0.289 18533
3773 1 6 . 1 1 3 3 SER CA C 2 58.320 58.320 58.008 0.312 18533
3774 1 6 . 1 1 3 3 SER CB C 2 63.990 63.990 63.895 0.095 18533
3775 1 6 . 1 1 3 3 SER H H 2 8.340 8.340 8.351 -0.011 18533
3776 1 6 . 1 1 4 4 ASP N N 3 123.200 123.200 119.487 3.713 18533
3777 1 6 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.809 0.051 18533
3778 1 6 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.447 0.433 18533
3779 1 6 . 1 1 4 4 ASP CB C 3 40.800 40.800 41.067 -0.267 18533
3780 1 6 . 1 1 4 4 ASP H H 3 8.260 8.260 8.191 0.069 18533
3781 1 6 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.387 0.013 18533
3782 1 6 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.452 0.368 18533
3783 1 6 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.517 -0.607 18533
3784 1 6 . 1 1 6 6 LEU N N 5 123.160 123.160 119.961 3.199 18533
3785 1 6 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.264 0.126 18533
3786 1 6 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.238 0.042 18533
3787 1 6 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.715 1.635 18533
3788 1 6 . 1 1 6 6 LEU H H 5 7.670 7.670 8.025 -0.355 18533
3789 1 6 . 1 1 7 7 HIS N N 6 127.160 127.160 117.380 9.780 18533
3790 1 6 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.975 1.055 18533
3791 1 6 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.471 -2.571 18533
3792 1 6 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.152 0.978 18533
3793 1 6 . 1 1 7 7 HIS H H 6 10.080 10.080 8.688 1.392 18533
3794 1 6 . 1 1 8 8 VAL N N 7 128.620 128.620 126.576 2.044 18533
3795 1 6 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.817 -0.317 18533
3796 1 6 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.702 -0.902 18533
3797 1 6 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.886 2.914 18533
3798 1 6 . 1 1 8 8 VAL H H 7 8.930 8.930 8.991 -0.061 18533
3799 1 6 . 1 1 9 9 THR N N 8 121.530 121.530 122.554 -1.024 18533
3800 1 6 . 1 1 9 9 THR HA H 8 5.270 5.270 4.826 0.444 18533
3801 1 6 . 1 1 9 9 THR CA C 8 58.520 58.520 59.035 -0.515 18533
3802 1 6 . 1 1 9 9 THR CB C 8 70.750 70.750 69.809 0.941 18533
3803 1 6 . 1 1 9 9 THR H H 8 7.970 7.970 8.989 -1.018 18533
3804 1 6 . 1 1 10 10 PHE N N 9 125.360 125.360 127.788 -2.428 18533
3805 1 6 . 1 1 10 10 PHE HA H 9 5.210 5.210 4.984 0.226 18533
3806 1 6 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.077 0.233 18533
3807 1 6 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.700 3.130 18533
3808 1 6 . 1 1 10 10 PHE H H 9 8.180 8.180 8.109 0.071 18533
3809 1 6 . 1 1 11 11 VAL N N 10 121.120 121.120 121.787 -0.667 18533
3810 1 6 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.377 -0.017 18533
3811 1 6 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.918 -0.498 18533
3812 1 6 . 1 1 11 11 VAL CB C 10 35.550 35.550 32.947 2.603 18533
3813 1 6 . 1 1 11 11 VAL H H 10 8.710 8.710 9.252 -0.542 18533
3814 1 6 . 1 1 12 12 CYS N N 11 123.270 123.270 125.722 -2.452 18533
3815 1 6 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.586 -1.326 18533
3816 1 6 . 1 1 12 12 CYS CA C 11 57.630 57.630 55.980 1.650 18533
3817 1 6 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.355 -1.005 18533
3818 1 6 . 1 1 12 12 CYS H H 11 7.940 7.940 8.583 -0.643 18533
3819 1 6 . 1 1 13 13 THR HA H 12 5.010 5.010 4.182 0.828 18533
3820 1 6 . 1 1 13 13 THR CA C 12 64.870 64.870 63.818 1.052 18533
3821 1 6 . 1 1 13 13 THR CB C 12 69.180 69.180 67.361 1.819 18533
3822 1 6 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.251 -0.291 18533
3823 1 6 . 1 1 15 15 ASN N N 14 119.960 119.960 117.327 2.633 18533
3824 1 6 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.365 -0.435 18533
3825 1 6 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.265 0.605 18533
3826 1 6 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.435 3.235 18533
3827 1 6 . 1 1 15 15 ASN H H 14 9.280 9.280 8.646 0.634 18533
3828 1 6 . 1 1 16 16 ILE N N 15 101.060 101.060 110.607 -9.547 18533
3829 1 6 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.633 0.047 18533
3830 1 6 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.368 2.422 18533
3831 1 6 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.021 4.119 18533
3832 1 6 . 1 1 16 16 ILE H H 15 7.100 7.100 8.008 -0.908 18533
3833 1 6 . 1 1 17 17 CYS N N 16 116.020 116.020 117.125 -1.105 18533
3834 1 6 . 1 1 17 17 CYS HA H 16 4.940 4.940 5.234 -0.294 18533
3835 1 6 . 1 1 17 17 CYS CA C 16 60.060 60.060 57.979 2.081 18533
3836 1 6 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.002 -0.052 18533
3837 1 6 . 1 1 17 17 CYS H H 16 7.700 7.700 7.783 -0.083 18533
3838 1 6 . 1 1 19 19 SER N N 18 122.340 122.340 115.227 7.113 18533
3839 1 6 . 1 1 19 19 SER HA H 18 3.810 3.810 4.130 -0.320 18533
3840 1 6 . 1 1 19 19 SER CA C 18 62.710 62.710 63.275 -0.565 18533
3841 1 6 . 1 1 19 19 SER CB C 18 64.860 64.860 61.348 3.512 18533
3842 1 6 . 1 1 19 19 SER H H 18 11.420 11.420 8.551 2.869 18533
3843 1 6 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.111 -0.141 18533
3844 1 6 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.865 0.165 18533
3845 1 6 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.913 -2.223 18533
3846 1 6 . 1 1 21 21 MET N N 20 112.430 112.430 118.319 -5.889 18533
3847 1 6 . 1 1 21 21 MET HA H 20 3.730 3.730 3.887 -0.157 18533
3848 1 6 . 1 1 21 21 MET CA C 20 60.160 60.160 59.764 0.396 18533
3849 1 6 . 1 1 21 21 MET CB C 20 33.040 33.040 32.101 0.939 18533
3850 1 6 . 1 1 21 21 MET H H 20 6.310 6.310 7.435 -1.125 18533
3851 1 6 . 1 1 22 22 ALA N N 21 117.800 117.800 119.620 -1.820 18533
3852 1 6 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.817 -0.417 18533
3853 1 6 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.342 0.648 18533
3854 1 6 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.386 -0.896 18533
3855 1 6 . 1 1 22 22 ALA H H 21 6.550 6.550 7.382 -0.832 18533
3856 1 6 . 1 1 23 23 GLU N N 22 115.520 115.520 118.914 -3.394 18533
3857 1 6 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.447 -0.767 18533
3858 1 6 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.966 -0.416 18533
3859 1 6 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.904 -0.113 18533
3860 1 6 . 1 1 23 23 GLU H H 22 7.800 7.800 7.654 0.146 18533
3861 1 6 . 1 1 24 24 LYS N N 23 114.220 114.220 116.135 -1.915 18533
3862 1 6 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.261 -0.261 18533
3863 1 6 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.145 -0.385 18533
3864 1 6 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.454 -1.654 18533
3865 1 6 . 1 1 24 24 LYS H H 23 8.040 8.040 7.602 0.438 18533
3866 1 6 . 1 1 25 25 MET N N 24 115.250 115.250 120.151 -4.901 18533
3867 1 6 . 1 1 25 25 MET HA H 24 3.950 3.950 3.439 0.511 18533
3868 1 6 . 1 1 25 25 MET CA C 24 57.980 57.980 58.989 -1.008 18533
3869 1 6 . 1 1 25 25 MET CB C 24 35.500 35.500 32.582 2.918 18533
3870 1 6 . 1 1 25 25 MET H H 24 7.610 7.610 7.577 0.033 18533
3871 1 6 . 1 1 26 26 PHE N N 25 119.090 119.090 116.481 2.609 18533
3872 1 6 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.595 -0.255 18533
3873 1 6 . 1 1 26 26 PHE CA C 25 60.030 60.030 58.222 1.808 18533
3874 1 6 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.259 2.201 18533
3875 1 6 . 1 1 26 26 PHE H H 25 8.560 8.560 8.148 0.412 18533
3876 1 6 . 1 1 27 27 ALA N N 26 117.830 117.830 122.862 -5.032 18533
3877 1 6 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.502 0.428 18533
3878 1 6 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.167 0.893 18533
3879 1 6 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.970 0.440 18533
3880 1 6 . 1 1 27 27 ALA H H 26 8.800 8.800 7.619 1.181 18533
3881 1 6 . 1 1 28 28 GLN N N 27 117.550 117.550 118.252 -0.702 18533
3882 1 6 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.052 -0.002 18533
3883 1 6 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.907 0.703 18533
3884 1 6 . 1 1 28 28 GLN CB C 27 28.450 28.450 28.008 0.442 18533
3885 1 6 . 1 1 28 28 GLN H H 27 7.690 7.690 7.841 -0.151 18533
3886 1 6 . 1 1 29 29 GLN N N 28 117.530 117.530 119.669 -2.139 18533
3887 1 6 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.041 0.099 18533
3888 1 6 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.794 0.386 18533
3889 1 6 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.907 -0.797 18533
3890 1 6 . 1 1 29 29 GLN H H 28 8.210 8.210 7.553 0.657 18533
3891 1 6 . 1 1 30 30 LEU N N 29 119.330 119.330 119.362 -0.032 18533
3892 1 6 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.827 0.103 18533
3893 1 6 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.810 0.270 18533
3894 1 6 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.356 0.544 18533
3895 1 6 . 1 1 30 30 LEU H H 29 8.540 8.540 8.243 0.297 18533
3896 1 6 . 1 1 31 31 ARG N N 30 120.880 120.880 117.417 3.463 18533
3897 1 6 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.001 -0.031 18533
3898 1 6 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.054 0.736 18533
3899 1 6 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.341 0.179 18533
3900 1 6 . 1 1 31 31 ARG H H 30 8.050 8.050 7.688 0.362 18533
3901 1 6 . 1 1 32 32 HIS N N 31 119.770 119.770 118.509 1.261 18533
3902 1 6 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.413 0.137 18533
3903 1 6 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.736 -0.656 18533
3904 1 6 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.209 0.501 18533
3905 1 6 . 1 1 32 32 HIS H H 31 8.440 8.440 8.220 0.220 18533
3906 1 6 . 1 1 33 33 ARG N N 32 115.430 115.430 116.974 -1.544 18533
3907 1 6 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.450 0.140 18533
3908 1 6 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.069 -0.099 18533
3909 1 6 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.600 -0.380 18533
3910 1 6 . 1 1 33 33 ARG H H 32 7.500 7.500 7.663 -0.163 18533
3911 1 6 . 1 1 34 34 GLY N N 33 106.730 106.730 108.747 -2.017 18533
3912 1 6 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.064 1.136 18533
3913 1 6 . 1 1 34 34 GLY H H 33 7.750 7.750 8.142 -0.392 18533
3914 1 6 . 1 1 35 35 LEU N N 34 119.980 119.980 117.024 2.956 18533
3915 1 6 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.787 -0.107 18533
3916 1 6 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.762 0.388 18533
3917 1 6 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.582 0.608 18533
3918 1 6 . 1 1 35 35 LEU H H 34 7.980 7.980 8.419 -0.439 18533
3919 1 6 . 1 1 36 36 GLY N N 35 108.660 108.660 108.928 -0.268 18533
3920 1 6 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.501 -0.401 18533
3921 1 6 . 1 1 36 36 GLY H H 35 8.830 8.830 7.813 1.017 18533
3922 1 6 . 1 1 37 37 ASP N N 36 115.360 115.360 119.446 -4.086 18533
3923 1 6 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.533 0.237 18533
3924 1 6 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.826 -1.436 18533
3925 1 6 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.596 0.574 18533
3926 1 6 . 1 1 37 37 ASP H H 36 8.300 8.300 8.069 0.231 18533
3927 1 6 . 1 1 38 38 ALA N N 37 121.460 121.460 121.849 -0.389 18533
3928 1 6 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.273 0.037 18533
3929 1 6 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.304 -0.354 18533
3930 1 6 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.410 0.440 18533
3931 1 6 . 1 1 38 38 ALA H H 37 7.380 7.380 7.621 -0.241 18533
3932 1 6 . 1 1 39 39 VAL N N 38 115.660 115.660 117.000 -1.340 18533
3933 1 6 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.457 0.343 18533
3934 1 6 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.265 -0.225 18533
3935 1 6 . 1 1 39 39 VAL CB C 38 35.190 35.190 35.032 0.158 18533
3936 1 6 . 1 1 39 39 VAL H H 38 7.100 7.100 7.704 -0.604 18533
3937 1 6 . 1 1 40 40 ARG N N 39 129.230 129.230 128.012 1.218 18533
3938 1 6 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.428 0.112 18533
3939 1 6 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.389 1.321 18533
3940 1 6 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.674 1.646 18533
3941 1 6 . 1 1 40 40 ARG H H 39 9.730 9.730 8.458 1.272 18533
3942 1 6 . 1 1 41 41 VAL N N 40 126.240 126.240 122.885 3.355 18533
3943 1 6 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.845 0.845 18533
3944 1 6 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.276 -0.716 18533
3945 1 6 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.481 -0.541 18533
3946 1 6 . 1 1 41 41 VAL H H 40 8.610 8.610 8.485 0.125 18533
3947 1 6 . 1 1 42 42 THR N N 41 117.310 117.310 116.421 0.889 18533
3948 1 6 . 1 1 42 42 THR HA H 41 4.890 4.890 4.913 -0.023 18533
3949 1 6 . 1 1 42 42 THR CA C 41 60.300 60.300 59.637 0.663 18533
3950 1 6 . 1 1 42 42 THR CB C 41 73.890 73.890 71.137 2.753 18533
3951 1 6 . 1 1 42 42 THR H H 41 8.870 8.870 8.913 -0.043 18533
3952 1 6 . 1 1 43 43 SER N N 42 109.960 109.960 113.616 -3.656 18533
3953 1 6 . 1 1 43 43 SER HA H 42 5.720 5.720 5.122 0.598 18533
3954 1 6 . 1 1 43 43 SER CA C 42 58.090 58.090 58.002 0.089 18533
3955 1 6 . 1 1 43 43 SER CB C 42 65.870 65.870 66.766 -0.895 18533
3956 1 6 . 1 1 43 43 SER H H 42 8.060 8.060 8.636 -0.576 18533
3957 1 6 . 1 1 44 44 ALA N N 43 119.200 119.200 119.848 -0.648 18533
3958 1 6 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.113 -0.853 18533
3959 1 6 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.834 -0.654 18533
3960 1 6 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.140 -1.310 18533
3961 1 6 . 1 1 44 44 ALA H H 43 8.710 8.710 9.091 -0.381 18533
3962 1 6 . 1 1 45 45 GLY N N 44 104.090 104.090 106.988 -2.898 18533
3963 1 6 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.271 -1.731 18533
3964 1 6 . 1 1 45 45 GLY H H 44 8.670 8.670 8.152 0.518 18533
3965 1 6 . 1 1 46 46 THR N N 45 114.060 114.060 115.910 -1.850 18533
3966 1 6 . 1 1 46 46 THR HA H 45 4.080 4.080 4.122 -0.042 18533
3967 1 6 . 1 1 46 46 THR CA C 45 64.680 64.680 64.415 0.265 18533
3968 1 6 . 1 1 46 46 THR CB C 45 67.880 67.880 68.634 -0.754 18533
3969 1 6 . 1 1 46 46 THR H H 45 9.120 9.120 8.528 0.592 18533
3970 1 6 . 1 1 47 47 GLY N N 46 110.380 110.380 108.532 1.848 18533
3971 1 6 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.848 -0.018 18533
3972 1 6 . 1 1 47 47 GLY H H 46 8.930 8.930 8.371 0.559 18533
3973 1 6 . 1 1 48 48 ASN N N 47 113.440 113.440 117.379 -3.939 18533
3974 1 6 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.320 0.170 18533
3975 1 6 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.282 -2.522 18533
3976 1 6 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.928 1.922 18533
3977 1 6 . 1 1 48 48 ASN H H 47 7.600 7.600 7.616 -0.016 18533
3978 1 6 . 1 1 49 49 TRP N N 48 117.300 117.300 121.274 -3.974 18533
3979 1 6 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.426 -0.526 18533
3980 1 6 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.610 0.250 18533
3981 1 6 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.936 -0.416 18533
3982 1 6 . 1 1 49 49 TRP H H 48 6.920 6.920 8.532 -1.612 18533
3983 1 6 . 1 1 50 50 HIS N N 49 111.590 111.590 115.372 -3.782 18533
3984 1 6 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.783 0.097 18533
3985 1 6 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.303 -1.443 18533
3986 1 6 . 1 1 50 50 HIS CB C 49 31.040 31.040 30.089 0.951 18533
3987 1 6 . 1 1 50 50 HIS H H 49 8.620 8.620 8.391 0.229 18533
3988 1 6 . 1 1 51 51 VAL N N 50 119.010 119.010 121.133 -2.123 18533
3989 1 6 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.809 -0.609 18533
3990 1 6 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.680 1.000 18533
3991 1 6 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.514 -0.124 18533
3992 1 6 . 1 1 51 51 VAL H H 50 6.880 6.880 7.329 -0.449 18533
3993 1 6 . 1 1 52 52 GLY N N 51 115.450 115.450 116.759 -1.309 18533
3994 1 6 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.715 -0.776 18533
3995 1 6 . 1 1 52 52 GLY H H 51 9.120 9.120 9.155 -0.035 18533
3996 1 6 . 1 1 53 53 SER N N 52 116.620 116.620 115.645 0.975 18533
3997 1 6 . 1 1 53 53 SER HA H 52 4.610 4.610 4.841 -0.231 18533
3998 1 6 . 1 1 53 53 SER CA C 52 59.310 59.310 57.511 1.799 18533
3999 1 6 . 1 1 53 53 SER CB C 52 64.630 64.630 65.171 -0.541 18533
4000 1 6 . 1 1 53 53 SER H H 52 8.430 8.430 8.084 0.346 18533
4001 1 6 . 1 1 54 54 CYS N N 53 118.690 118.690 118.058 0.632 18533
4002 1 6 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.832 -0.732 18533
4003 1 6 . 1 1 54 54 CYS CA C 53 57.670 57.670 55.718 1.952 18533
4004 1 6 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.373 -3.023 18533
4005 1 6 . 1 1 54 54 CYS H H 53 8.170 8.170 8.520 -0.350 18533
4006 1 6 . 1 1 55 55 ALA N N 54 118.580 118.580 124.316 -5.736 18533
4007 1 6 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.163 -0.043 18533
4008 1 6 . 1 1 55 55 ALA CA C 54 52.640 52.640 53.117 -0.478 18533
4009 1 6 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.226 -2.596 18533
4010 1 6 . 1 1 55 55 ALA H H 54 8.420 8.420 8.349 0.071 18533
4011 1 6 . 1 1 56 56 ASP N N 55 121.500 121.500 121.986 -0.486 18533
4012 1 6 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.372 -0.032 18533
4013 1 6 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.122 0.928 18533
4014 1 6 . 1 1 56 56 ASP CB C 55 46.060 46.060 41.652 4.408 18533
4015 1 6 . 1 1 56 56 ASP H H 55 8.470 8.470 7.835 0.635 18533
4016 1 6 . 1 1 57 57 GLU N N 56 127.840 127.840 122.754 5.086 18533
4017 1 6 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.825 0.215 18533
4018 1 6 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.346 0.294 18533
4019 1 6 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.110 0.390 18533
4020 1 6 . 1 1 57 57 GLU H H 56 9.230 9.230 8.869 0.361 18533
4021 1 6 . 1 1 58 58 ARG N N 57 120.820 120.820 119.348 1.472 18533
4022 1 6 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.782 0.028 18533
4023 1 6 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.102 0.048 18533
4024 1 6 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.910 -1.640 18533
4025 1 6 . 1 1 58 58 ARG H H 57 9.220 9.220 7.602 1.618 18533
4026 1 6 . 1 1 59 59 ALA N N 58 121.590 121.590 121.625 -0.035 18533
4027 1 6 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.095 0.065 18533
4028 1 6 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.401 0.379 18533
4029 1 6 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.227 0.263 18533
4030 1 6 . 1 1 59 59 ALA H H 58 6.680 6.680 8.314 -1.634 18533
4031 1 6 . 1 1 60 60 ALA N N 59 118.970 118.970 121.721 -2.751 18533
4032 1 6 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.933 -0.073 18533
4033 1 6 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.281 -0.261 18533
4034 1 6 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.314 -0.244 18533
4035 1 6 . 1 1 60 60 ALA H H 59 8.540 8.540 8.199 0.341 18533
4036 1 6 . 1 1 61 61 GLY N N 60 104.160 104.160 106.550 -2.390 18533
4037 1 6 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.022 0.248 18533
4038 1 6 . 1 1 61 61 GLY H H 60 8.210 8.210 7.741 0.469 18533
4039 1 6 . 1 1 62 62 VAL N N 61 122.820 122.820 122.761 0.059 18533
4040 1 6 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.590 0.260 18533
4041 1 6 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.933 0.317 18533
4042 1 6 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.204 0.686 18533
4043 1 6 . 1 1 62 62 VAL H H 61 7.310 7.310 7.611 -0.301 18533
4044 1 6 . 1 1 63 63 LEU N N 62 120.310 120.310 119.567 0.743 18533
4045 1 6 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.240 -0.260 18533
4046 1 6 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.622 0.328 18533
4047 1 6 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.307 0.193 18533
4048 1 6 . 1 1 63 63 LEU H H 62 8.090 8.090 8.627 -0.537 18533
4049 1 6 . 1 1 64 64 ARG N N 63 119.440 119.440 119.598 -0.158 18533
4050 1 6 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.299 -0.119 18533
4051 1 6 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.900 0.550 18533
4052 1 6 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.583 0.797 18533
4053 1 6 . 1 1 64 64 ARG H H 63 8.740 8.740 8.411 0.329 18533
4054 1 6 . 1 1 65 65 ALA N N 64 122.560 122.560 121.556 1.004 18533
4055 1 6 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.087 -0.057 18533
4056 1 6 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.067 0.473 18533
4057 1 6 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.214 -0.134 18533
4058 1 6 . 1 1 65 65 ALA H H 64 7.910 7.910 7.660 0.250 18533
4059 1 6 . 1 1 66 66 HIS N N 65 112.690 112.690 114.350 -1.660 18533
4060 1 6 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.592 0.048 18533
4061 1 6 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.001 -0.501 18533
4062 1 6 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.053 0.267 18533
4063 1 6 . 1 1 66 66 HIS H H 65 7.410 7.410 7.543 -0.133 18533
4064 1 6 . 1 1 67 67 GLY N N 66 107.440 107.440 107.146 0.294 18533
4065 1 6 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.369 0.991 18533
4066 1 6 . 1 1 67 67 GLY H H 66 7.850 7.850 7.456 0.394 18533
4067 1 6 . 1 1 68 68 TYR N N 67 119.940 119.940 120.479 -0.539 18533
4068 1 6 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.782 0.018 18533
4069 1 6 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.249 0.851 18533
4070 1 6 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.042 0.818 18533
4071 1 6 . 1 1 68 68 TYR H H 67 8.380 8.380 8.182 0.198 18533
4072 1 6 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.513 0.047 18533
4073 1 6 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.993 -0.394 18533
4074 1 6 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.425 0.385 18533
4075 1 6 . 1 1 70 70 THR N N 69 100.660 100.660 108.502 -7.842 18533
4076 1 6 . 1 1 70 70 THR HA H 69 4.300 4.300 4.451 -0.151 18533
4077 1 6 . 1 1 70 70 THR CA C 69 61.250 61.250 61.405 -0.155 18533
4078 1 6 . 1 1 70 70 THR CB C 69 70.740 70.740 69.486 1.254 18533
4079 1 6 . 1 1 70 70 THR H H 69 7.860 7.860 8.141 -0.281 18533
4080 1 6 . 1 1 71 71 ASP N N 70 122.880 122.880 122.638 0.242 18533
4081 1 6 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.872 -0.462 18533
4082 1 6 . 1 1 71 71 ASP CA C 70 55.870 55.870 53.678 2.192 18533
4083 1 6 . 1 1 71 71 ASP CB C 70 40.970 40.970 42.564 -1.594 18533
4084 1 6 . 1 1 71 71 ASP H H 70 7.940 7.940 7.884 0.056 18533
4085 1 6 . 1 1 72 72 HIS N N 71 121.720 121.720 124.566 -2.846 18533
4086 1 6 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.811 -0.111 18533
4087 1 6 . 1 1 72 72 HIS CA C 71 57.390 57.390 55.925 1.466 18533
4088 1 6 . 1 1 72 72 HIS CB C 71 35.340 35.340 33.339 2.001 18533
4089 1 6 . 1 1 72 72 HIS H H 71 8.000 8.000 8.145 -0.145 18533
4090 1 6 . 1 1 73 73 ARG N N 72 125.760 125.760 127.057 -1.297 18533
4091 1 6 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.000 -0.710 18533
4092 1 6 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.022 0.408 18533
4093 1 6 . 1 1 73 73 ARG CB C 72 32.310 32.310 30.438 1.872 18533
4094 1 6 . 1 1 73 73 ARG H H 72 7.230 7.230 8.193 -0.963 18533
4095 1 6 . 1 1 74 74 ALA N N 73 127.970 127.970 129.347 -1.377 18533
4096 1 6 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.269 0.361 18533
4097 1 6 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.586 -0.406 18533
4098 1 6 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.460 -1.560 18533
4099 1 6 . 1 1 74 74 ALA H H 73 9.090 9.090 8.431 0.659 18533
4100 1 6 . 1 1 75 75 ALA N N 74 126.090 126.090 124.948 1.142 18533
4101 1 6 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.835 -0.045 18533
4102 1 6 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.547 0.423 18533
4103 1 6 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.818 1.802 18533
4104 1 6 . 1 1 75 75 ALA H H 74 9.410 9.410 8.305 1.105 18533
4105 1 6 . 1 1 76 76 GLN N N 75 123.260 123.260 118.903 4.357 18533
4106 1 6 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.661 0.289 18533
4107 1 6 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.955 -0.405 18533
4108 1 6 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.291 -1.241 18533
4109 1 6 . 1 1 76 76 GLN H H 75 8.800 8.800 8.349 0.451 18533
4110 1 6 . 1 1 77 77 VAL N N 76 125.510 125.510 122.997 2.513 18533
4111 1 6 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.471 -0.171 18533
4112 1 6 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.783 -0.203 18533
4113 1 6 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.942 1.548 18533
4114 1 6 . 1 1 77 77 VAL H H 76 8.550 8.550 7.904 0.646 18533
4115 1 6 . 1 1 78 78 GLY N N 77 121.850 121.850 115.635 6.215 18533
4116 1 6 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.412 -0.572 18533
4117 1 6 . 1 1 78 78 GLY H H 77 10.930 10.930 8.036 2.894 18533
4118 1 6 . 1 1 79 79 THR N N 78 115.210 115.210 115.989 -0.779 18533
4119 1 6 . 1 1 79 79 THR HA H 78 3.700 3.700 3.976 -0.276 18533
4120 1 6 . 1 1 79 79 THR CA C 78 66.440 66.440 67.733 -1.293 18533
4121 1 6 . 1 1 79 79 THR CB C 78 68.770 68.770 68.683 0.087 18533
4122 1 6 . 1 1 79 79 THR H H 78 8.540 8.540 8.380 0.160 18533
4123 1 6 . 1 1 80 80 GLU N N 79 119.360 119.360 119.362 -0.002 18533
4124 1 6 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.958 0.002 18533
4125 1 6 . 1 1 80 80 GLU CA C 79 59.030 59.030 59.009 0.021 18533
4126 1 6 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.381 0.679 18533
4127 1 6 . 1 1 80 80 GLU H H 79 9.110 9.110 8.947 0.163 18533
4128 1 6 . 1 1 81 81 HIS N N 80 118.380 118.380 117.546 0.834 18533
4129 1 6 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.338 -0.398 18533
4130 1 6 . 1 1 81 81 HIS CA C 80 60.420 60.420 59.143 1.277 18533
4131 1 6 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.191 0.739 18533
4132 1 6 . 1 1 81 81 HIS H H 80 7.040 7.040 7.489 -0.449 18533
4133 1 6 . 1 1 82 82 LEU N N 81 114.010 114.010 119.894 -5.884 18533
4134 1 6 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.111 -0.211 18533
4135 1 6 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.791 -0.111 18533
4136 1 6 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.397 -0.667 18533
4137 1 6 . 1 1 82 82 LEU H H 81 7.850 7.850 8.334 -0.484 18533
4138 1 6 . 1 1 83 83 ALA N N 82 119.050 119.050 117.649 1.401 18533
4139 1 6 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.187 0.203 18533
4140 1 6 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.262 -0.062 18533
4141 1 6 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.924 0.256 18533
4142 1 6 . 1 1 83 83 ALA H H 82 6.950 6.950 7.442 -0.492 18533
4143 1 6 . 1 1 84 84 ALA N N 83 122.500 122.500 120.791 1.709 18533
4144 1 6 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.025 -0.265 18533
4145 1 6 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.036 1.314 18533
4146 1 6 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.608 -2.288 18533
4147 1 6 . 1 1 84 84 ALA H H 83 7.280 7.280 7.219 0.061 18533
4148 1 6 . 1 1 85 85 ASP N N 84 118.740 118.740 120.919 -2.179 18533
4149 1 6 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.788 -0.378 18533
4150 1 6 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.356 1.284 18533
4151 1 6 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.305 0.595 18533
4152 1 6 . 1 1 85 85 ASP H H 84 8.440 8.440 8.562 -0.122 18533
4153 1 6 . 1 1 86 86 LEU N N 85 115.180 115.180 118.783 -3.603 18533
4154 1 6 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.883 -0.703 18533
4155 1 6 . 1 1 86 86 LEU CA C 85 55.040 55.040 54.006 1.034 18533
4156 1 6 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.798 0.372 18533
4157 1 6 . 1 1 86 86 LEU H H 85 7.280 7.280 8.165 -0.885 18533
4158 1 6 . 1 1 87 87 LEU N N 86 128.140 128.140 127.581 0.559 18533
4159 1 6 . 1 1 87 87 LEU HA H 86 4.690 4.690 5.011 -0.321 18533
4160 1 6 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.210 2.170 18533
4161 1 6 . 1 1 87 87 LEU CB C 86 42.170 42.170 41.917 0.253 18533
4162 1 6 . 1 1 87 87 LEU H H 86 8.780 8.780 8.961 -0.181 18533
4163 1 6 . 1 1 88 88 VAL N N 87 122.630 122.630 126.806 -4.176 18533
4164 1 6 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.527 0.103 18533
4165 1 6 . 1 1 88 88 VAL CA C 87 59.910 59.910 62.629 -2.719 18533
4166 1 6 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.441 0.399 18533
4167 1 6 . 1 1 88 88 VAL H H 87 9.010 9.010 8.009 1.001 18533
4168 1 6 . 1 1 89 89 ALA N N 88 129.820 129.820 131.884 -2.064 18533
4169 1 6 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.919 -0.399 18533
4170 1 6 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.431 -0.651 18533
4171 1 6 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.327 -0.547 18533
4172 1 6 . 1 1 89 89 ALA H H 88 8.590 8.590 9.222 -0.632 18533
4173 1 6 . 1 1 90 90 LEU N N 89 129.280 129.280 119.457 9.823 18533
4174 1 6 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.606 -0.296 18533
4175 1 6 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.315 1.135 18533
4176 1 6 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.569 -3.549 18533
4177 1 6 . 1 1 90 90 LEU H H 89 8.570 8.570 8.541 0.029 18533
4178 1 6 . 1 1 91 91 ASP N N 90 126.910 126.910 114.983 11.927 18533
4179 1 6 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.688 0.112 18533
4180 1 6 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.087 -0.137 18533
4181 1 6 . 1 1 91 91 ASP CB C 90 43.810 43.810 41.941 1.869 18533
4182 1 6 . 1 1 91 91 ASP H H 90 11.450 11.450 7.397 4.053 18533
4183 1 6 . 1 1 92 92 ARG N N 91 116.950 116.950 117.342 -0.392 18533
4184 1 6 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.966 0.054 18533
4185 1 6 . 1 1 92 92 ARG CA C 91 58.830 58.830 58.896 -0.066 18533
4186 1 6 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.815 0.465 18533
4187 1 6 . 1 1 92 92 ARG H H 91 8.650 8.650 8.609 0.041 18533
4188 1 6 . 1 1 93 93 ASN N N 92 120.740 120.740 119.646 1.094 18533
4189 1 6 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.598 -0.218 18533
4190 1 6 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.648 0.482 18533
4191 1 6 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.054 -0.434 18533
4192 1 6 . 1 1 93 93 ASN H H 92 8.610 8.610 8.034 0.576 18533
4193 1 6 . 1 1 94 94 HIS N N 93 121.170 121.170 120.241 0.929 18533
4194 1 6 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.235 -0.045 18533
4195 1 6 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.118 0.392 18533
4196 1 6 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.804 1.576 18533
4197 1 6 . 1 1 94 94 HIS H H 93 7.430 7.430 9.083 -1.653 18533
4198 1 6 . 1 1 95 95 ALA N N 94 118.270 118.270 121.116 -2.846 18533
4199 1 6 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.982 -0.242 18533
4200 1 6 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.432 0.068 18533
4201 1 6 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.357 -0.387 18533
4202 1 6 . 1 1 95 95 ALA H H 94 7.190 7.190 8.056 -0.866 18533
4203 1 6 . 1 1 96 96 ARG N N 95 117.190 117.190 119.186 -1.996 18533
4204 1 6 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.050 -0.140 18533
4205 1 6 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.275 0.225 18533
4206 1 6 . 1 1 96 96 ARG CB C 95 30.230 30.230 29.991 0.239 18533
4207 1 6 . 1 1 96 96 ARG H H 95 7.600 7.600 7.548 0.052 18533
4208 1 6 . 1 1 97 97 LEU N N 96 120.700 120.700 119.597 1.103 18533
4209 1 6 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.993 0.087 18533
4210 1 6 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.683 0.217 18533
4211 1 6 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.714 -0.374 18533
4212 1 6 . 1 1 97 97 LEU H H 96 7.990 7.990 7.854 0.136 18533
4213 1 6 . 1 1 98 98 LEU N N 97 118.390 118.390 118.439 -0.049 18533
4214 1 6 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.855 0.055 18533
4215 1 6 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.086 0.014 18533
4216 1 6 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.192 0.698 18533
4217 1 6 . 1 1 98 98 LEU H H 97 8.210 8.210 8.232 -0.022 18533
4218 1 6 . 1 1 99 99 ARG N N 98 117.470 117.470 118.230 -0.760 18533
4219 1 6 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.079 0.401 18533
4220 1 6 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.006 -0.646 18533
4221 1 6 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.623 -0.884 18533
4222 1 6 . 1 1 99 99 ARG H H 98 7.740 7.740 7.791 -0.051 18533
4223 1 6 . 1 1 100 100 GLN N N 99 121.400 121.400 118.691 2.709 18533
4224 1 6 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.174 -0.104 18533
4225 1 6 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.198 0.482 18533
4226 1 6 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.232 0.088 18533
4227 1 6 . 1 1 100 100 GLN H H 99 8.030 8.030 8.021 0.009 18533
4228 1 6 . 1 1 101 101 LEU N N 100 118.940 118.940 116.972 1.968 18533
4229 1 6 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.222 0.038 18533
4230 1 6 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.378 0.082 18533
4231 1 6 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.389 -0.149 18533
4232 1 6 . 1 1 101 101 LEU H H 100 7.780 7.780 7.949 -0.169 18533
4233 1 6 . 1 1 102 102 GLY N N 101 105.740 105.740 104.142 1.598 18533
4234 1 6 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.270 0.760 18533
4235 1 6 . 1 1 102 102 GLY H H 101 7.700 7.700 7.590 0.110 18533
4236 1 6 . 1 1 103 103 VAL N N 102 122.330 122.330 121.441 0.889 18533
4237 1 6 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.076 -0.446 18533
4238 1 6 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.311 1.289 18533
4239 1 6 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.302 -1.812 18533
4240 1 6 . 1 1 103 103 VAL H H 102 7.520 7.520 7.947 -0.427 18533
4241 1 6 . 1 1 104 104 GLU N N 103 128.990 128.990 114.659 14.331 18533
4242 1 6 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.459 -0.289 18533
4243 1 6 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.010 1.910 18533
4244 1 6 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.846 -3.896 18533
4245 1 6 . 1 1 104 104 GLU H H 103 9.210 9.210 8.079 1.131 18533
4246 1 6 . 1 1 105 105 ALA N N 104 124.410 124.410 123.214 1.196 18533
4247 1 6 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.223 -0.463 18533
4248 1 6 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.021 0.619 18533
4249 1 6 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.692 -0.552 18533
4250 1 6 . 1 1 105 105 ALA H H 104 8.500 8.500 8.752 -0.252 18533
4251 1 6 . 1 1 106 106 ALA N N 105 115.110 115.110 120.448 -5.338 18533
4252 1 6 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.199 -0.069 18533
4253 1 6 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.846 -0.806 18533
4254 1 6 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.582 0.478 18533
4255 1 6 . 1 1 106 106 ALA H H 105 8.270 8.270 8.406 -0.136 18533
4256 1 6 . 1 1 107 107 ARG N N 106 115.080 115.080 114.876 0.204 18533
4257 1 6 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.812 -0.352 18533
4258 1 6 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.857 -0.347 18533
4259 1 6 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.878 0.492 18533
4260 1 6 . 1 1 107 107 ARG H H 106 7.740 7.740 7.758 -0.018 18533
4261 1 6 . 1 1 108 108 VAL N N 107 118.170 118.170 121.415 -3.245 18533
4262 1 6 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.086 0.984 18533
4263 1 6 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.100 -1.460 18533
4264 1 6 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.379 1.221 18533
4265 1 6 . 1 1 108 108 VAL H H 107 7.290 7.290 8.325 -1.035 18533
4266 1 6 . 1 1 109 109 ARG N N 108 124.250 124.250 128.340 -4.090 18533
4267 1 6 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.623 -0.003 18533
4268 1 6 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.653 -0.763 18533
4269 1 6 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.125 0.855 18533
4270 1 6 . 1 1 109 109 ARG H H 108 8.420 8.420 8.756 -0.336 18533
4271 1 6 . 1 1 110 110 MET N N 109 119.570 119.570 121.459 -1.889 18533
4272 1 6 . 1 1 110 110 MET HA H 109 4.960 4.960 4.803 0.157 18533
4273 1 6 . 1 1 110 110 MET CA C 109 53.820 53.820 54.324 -0.504 18533
4274 1 6 . 1 1 110 110 MET CB C 109 30.680 30.680 32.257 -1.577 18533
4275 1 6 . 1 1 110 110 MET H H 109 8.890 8.890 8.591 0.299 18533
4276 1 6 . 1 1 111 111 LEU N N 110 128.660 128.660 126.560 2.100 18533
4277 1 6 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.271 -0.311 18533
4278 1 6 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.045 0.555 18533
4279 1 6 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.584 -0.504 18533
4280 1 6 . 1 1 111 111 LEU H H 110 9.200 9.200 9.057 0.143 18533
4281 1 6 . 1 1 112 112 ARG N N 111 111.910 111.910 116.512 -4.602 18533
4282 1 6 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.027 -0.077 18533
4283 1 6 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.725 1.195 18533
4284 1 6 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.492 -0.992 18533
4285 1 6 . 1 1 112 112 ARG H H 111 8.930 8.930 8.596 0.334 18533
4286 1 6 . 1 1 113 113 SER N N 112 114.800 114.800 114.807 -0.007 18533
4287 1 6 . 1 1 113 113 SER HA H 112 4.290 4.290 4.220 0.070 18533
4288 1 6 . 1 1 113 113 SER CA C 112 60.880 60.880 59.723 1.157 18533
4289 1 6 . 1 1 113 113 SER CB C 112 63.190 63.190 62.317 0.873 18533
4290 1 6 . 1 1 113 113 SER H H 112 7.680 7.680 7.579 0.101 18533
4291 1 6 . 1 1 114 114 PHE N N 113 119.260 119.260 118.301 0.959 18533
4292 1 6 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.435 -0.085 18533
4293 1 6 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.845 1.085 18533
4294 1 6 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.620 0.100 18533
4295 1 6 . 1 1 114 114 PHE H H 113 7.600 7.600 7.529 0.071 18533
4296 1 6 . 1 1 115 115 ASP N N 114 121.170 121.170 121.425 -0.255 18533
4297 1 6 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.952 0.068 18533
4298 1 6 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.556 -1.456 18533
4299 1 6 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.768 0.742 18533
4300 1 6 . 1 1 115 115 ASP H H 114 7.430 7.430 7.609 -0.179 18533
4301 1 6 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.329 0.161 18533
4302 1 6 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.585 -0.235 18533
4303 1 6 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.169 0.101 18533
4304 1 6 . 1 1 117 117 ARG N N 116 117.910 117.910 115.041 2.869 18533
4305 1 6 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.405 -0.135 18533
4306 1 6 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.055 0.395 18533
4307 1 6 . 1 1 117 117 ARG CB C 116 29.960 29.960 29.962 -0.002 18533
4308 1 6 . 1 1 117 117 ARG H H 116 8.580 8.580 7.769 0.811 18533
4309 1 6 . 1 1 118 118 SER N N 117 116.130 116.130 118.216 -2.086 18533
4310 1 6 . 1 1 118 118 SER HA H 117 3.980 3.980 4.301 -0.321 18533
4311 1 6 . 1 1 118 118 SER CA C 117 59.790 59.790 58.312 1.478 18533
4312 1 6 . 1 1 118 118 SER CB C 117 63.760 63.760 61.096 2.664 18533
4313 1 6 . 1 1 118 118 SER H H 117 7.950 7.950 7.601 0.349 18533
4314 1 6 . 1 1 119 119 GLY N N 118 110.080 110.080 111.789 -1.709 18533
4315 1 6 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.210 -0.840 18533
4316 1 6 . 1 1 119 119 GLY H H 118 8.150 8.150 8.339 -0.189 18533
4317 1 6 . 1 1 120 120 THR HA H 119 4.020 4.020 4.423 -0.403 18533
4318 1 6 . 1 1 120 120 THR CA C 119 63.290 63.290 62.867 0.423 18533
4319 1 6 . 1 1 120 120 THR CB C 119 69.140 69.140 69.559 -0.419 18533
4320 1 6 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.707 -0.137 18533
4321 1 6 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.271 0.739 18533
4322 1 6 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.389 -1.399 18533
4323 1 6 . 1 1 122 122 ALA N N 121 125.880 125.880 125.110 0.770 18533
4324 1 6 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.575 -0.235 18533
4325 1 6 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.815 -0.305 18533
4326 1 6 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.184 -1.584 18533
4327 1 6 . 1 1 122 122 ALA H H 121 7.980 7.980 8.471 -0.491 18533
4328 1 6 . 1 1 123 123 LEU N N 122 119.810 119.810 121.291 -1.481 18533
4329 1 6 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.447 -0.167 18533
4330 1 6 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.533 -0.043 18533
4331 1 6 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.517 2.183 18533
4332 1 6 . 1 1 123 123 LEU H H 122 7.810 7.810 8.329 -0.519 18533
4333 1 6 . 1 1 124 124 ASP N N 123 119.050 119.050 117.970 1.080 18533
4334 1 6 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.591 -0.021 18533
4335 1 6 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.397 1.923 18533
4336 1 6 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.498 -0.828 18533
4337 1 6 . 1 1 124 124 ASP H H 123 8.270 8.270 7.351 0.919 18533
4338 1 6 . 1 1 125 125 VAL N N 124 121.970 121.970 123.325 -1.355 18533
4339 1 6 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.284 -0.024 18533
4340 1 6 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.380 1.931 18533
4341 1 6 . 1 1 125 125 VAL CB C 124 30.780 30.780 34.306 -3.526 18533
4342 1 6 . 1 1 125 125 VAL H H 124 7.930 7.930 7.918 0.012 18533
4343 1 6 . 1 1 126 126 GLU N N 125 129.490 129.490 124.256 5.234 18533
4344 1 6 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.078 0.002 18533
4345 1 6 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.561 0.449 18533
4346 1 6 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.223 -0.423 18533
4347 1 6 . 1 1 126 126 GLU H H 125 9.100 9.100 8.369 0.731 18533
4348 1 6 . 1 1 127 127 ASP N N 126 122.300 122.300 118.123 4.177 18533
4349 1 6 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.878 -0.768 18533
4350 1 6 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.457 0.263 18533
4351 1 6 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.582 -0.062 18533
4352 1 6 . 1 1 127 127 ASP H H 126 8.630 8.630 8.221 0.409 18533
4353 1 6 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.407 0.143 18533
4354 1 6 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.463 -0.863 18533
4355 1 6 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.877 -1.897 18533
4356 1 6 . 1 1 129 129 TYR N N 128 122.380 122.380 121.286 1.094 18533
4357 1 6 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.280 -0.480 18533
4358 1 6 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.340 3.780 18533
4359 1 6 . 1 1 129 129 TYR CB C 128 39.390 39.390 40.435 -1.045 18533
4360 1 6 . 1 1 129 129 TYR H H 128 8.670 8.670 9.197 -0.527 18533
4361 1 6 . 1 1 130 130 TYR N N 129 116.300 116.300 112.895 3.405 18533
4362 1 6 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.799 -0.309 18533
4363 1 6 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.453 1.028 18533
4364 1 6 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.450 -2.790 18533
4365 1 6 . 1 1 130 130 TYR H H 129 8.680 8.680 7.719 0.961 18533
4366 1 6 . 1 1 131 131 GLY N N 130 110.870 110.870 110.806 0.064 18533
4367 1 6 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.835 -0.755 18533
4368 1 6 . 1 1 131 131 GLY H H 130 8.060 8.060 8.483 -0.423 18533
4369 1 6 . 1 1 132 132 ASP N N 131 121.590 121.590 118.268 3.322 18533
4370 1 6 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.523 0.547 18533
4371 1 6 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.776 0.224 18533
4372 1 6 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.191 1.409 18533
4373 1 6 . 1 1 132 132 ASP H H 131 9.290 9.290 7.335 1.955 18533
4374 1 6 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.134 -0.024 18533
4375 1 6 . 1 1 133 133 HIS CA C 132 61.570 61.570 60.279 1.291 18533
4376 1 6 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.212 0.268 18533
4377 1 6 . 1 1 134 134 SER N N 133 115.370 115.370 113.266 2.104 18533
4378 1 6 . 1 1 134 134 SER HA H 133 4.180 4.180 4.196 -0.016 18533
4379 1 6 . 1 1 134 134 SER CA C 133 62.070 62.070 62.276 -0.206 18533
4380 1 6 . 1 1 134 134 SER CB C 133 62.160 62.160 62.955 -0.795 18533
4381 1 6 . 1 1 134 134 SER H H 133 8.420 8.420 9.032 -0.612 18533
4382 1 6 . 1 1 135 135 ASP N N 134 123.360 123.360 122.143 1.217 18533
4383 1 6 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.489 0.041 18533
4384 1 6 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.910 1.130 18533
4385 1 6 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.505 0.305 18533
4386 1 6 . 1 1 135 135 ASP H H 134 7.980 7.980 7.555 0.425 18533
4387 1 6 . 1 1 136 136 PHE N N 135 118.940 118.940 118.333 0.607 18533
4388 1 6 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.255 -0.455 18533
4389 1 6 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.261 3.559 18533
4390 1 6 . 1 1 136 136 PHE CB C 135 39.350 39.350 37.955 1.395 18533
4391 1 6 . 1 1 136 136 PHE H H 135 7.850 7.850 7.866 -0.016 18533
4392 1 6 . 1 1 137 137 GLU N N 136 121.410 121.410 118.054 3.356 18533
4393 1 6 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.189 -0.009 18533
4394 1 6 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.439 0.061 18533
4395 1 6 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.248 -0.258 18533
4396 1 6 . 1 1 137 137 GLU H H 136 8.150 8.150 8.291 -0.141 18533
4397 1 6 . 1 1 138 138 GLU N N 137 121.530 121.530 121.536 -0.006 18533
4398 1 6 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.188 0.102 18533
4399 1 6 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.162 0.238 18533
4400 1 6 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.064 -0.174 18533
4401 1 6 . 1 1 138 138 GLU H H 137 7.870 7.870 7.878 -0.008 18533
4402 1 6 . 1 1 139 139 VAL N N 138 119.930 119.930 120.084 -0.154 18533
4403 1 6 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.613 -0.133 18533
4404 1 6 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.455 0.625 18533
4405 1 6 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.614 -0.264 18533
4406 1 6 . 1 1 139 139 VAL H H 138 7.770 7.770 7.675 0.095 18533
4407 1 6 . 1 1 140 140 PHE N N 139 119.130 119.130 121.097 -1.967 18533
4408 1 6 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.070 -0.510 18533
4409 1 6 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.443 1.237 18533
4410 1 6 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.895 0.274 18533
4411 1 6 . 1 1 140 140 PHE H H 139 8.050 8.050 8.220 -0.170 18533
4412 1 6 . 1 1 141 141 ALA N N 140 121.040 121.040 121.831 -0.791 18533
4413 1 6 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.228 -0.238 18533
4414 1 6 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.731 0.389 18533
4415 1 6 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.409 -0.109 18533
4416 1 6 . 1 1 141 141 ALA H H 140 8.010 8.010 8.148 -0.138 18533
4417 1 6 . 1 1 142 142 VAL N N 141 118.550 118.550 118.697 -0.147 18533
4418 1 6 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.561 0.249 18533
4419 1 6 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.493 -0.893 18533
4420 1 6 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.017 0.433 18533
4421 1 6 . 1 1 142 142 VAL H H 141 8.300 8.300 8.023 0.277 18533
4422 1 6 . 1 1 143 143 ILE N N 142 121.410 121.410 119.711 1.699 18533
4423 1 6 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.374 0.016 18533
4424 1 6 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.407 0.643 18533
4425 1 6 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.684 -0.374 18533
4426 1 6 . 1 1 143 143 ILE H H 142 8.150 8.150 8.195 -0.045 18533
4427 1 6 . 1 1 144 144 GLU N N 143 119.630 119.630 119.150 0.480 18533
4428 1 6 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.652 -0.112 18533
4429 1 6 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.078 0.682 18533
4430 1 6 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.804 0.926 18533
4431 1 6 . 1 1 144 144 GLU H H 143 8.640 8.640 8.101 0.539 18533
4432 1 6 . 1 1 145 145 SER N N 144 110.920 110.920 114.075 -3.155 18533
4433 1 6 . 1 1 145 145 SER HA H 144 4.230 4.230 4.234 -0.004 18533
4434 1 6 . 1 1 145 145 SER CA C 144 60.810 60.810 60.295 0.515 18533
4435 1 6 . 1 1 145 145 SER CB C 144 63.610 63.610 63.456 0.154 18533
4436 1 6 . 1 1 145 145 SER H H 144 7.640 7.640 7.676 -0.036 18533
4437 1 6 . 1 1 146 146 ALA N N 145 123.110 123.110 124.409 -1.299 18533
4438 1 6 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.228 -0.108 18533
4439 1 6 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.050 -0.650 18533
4440 1 6 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.344 2.536 18533
4441 1 6 . 1 1 146 146 ALA H H 145 7.500 7.500 7.618 -0.118 18533
4442 1 6 . 1 1 147 147 LEU N N 146 114.220 114.220 119.468 -5.248 18533
4443 1 6 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.679 0.261 18533
4444 1 6 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.291 -0.241 18533
4445 1 6 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.193 0.267 18533
4446 1 6 . 1 1 147 147 LEU H H 146 7.410 7.410 7.907 -0.497 18533
4447 1 6 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.340 0.110 18533
4448 1 6 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.339 3.501 18533
4449 1 6 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.126 0.094 18533
4450 1 6 . 1 1 149 149 GLY N N 148 102.590 102.590 106.385 -3.795 18533
4451 1 6 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.456 1.804 18533
4452 1 6 . 1 1 149 149 GLY H H 148 7.960 7.960 7.894 0.066 18533
4453 1 6 . 1 1 150 150 LEU N N 149 128.060 128.060 123.851 4.209 18533
4454 1 6 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.386 0.244 18533
4455 1 6 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.494 -0.144 18533
4456 1 6 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.558 -0.358 18533
4457 1 6 . 1 1 150 150 LEU H H 149 7.620 7.620 8.488 -0.868 18533
4458 1 6 . 1 1 151 151 HIS N N 150 120.730 120.730 118.245 2.485 18533
4459 1 6 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.238 -0.068 18533
4460 1 6 . 1 1 151 151 HIS CA C 150 62.380 62.380 59.983 2.397 18533
4461 1 6 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.823 0.687 18533
4462 1 6 . 1 1 151 151 HIS H H 150 8.430 8.430 8.613 -0.183 18533
4463 1 6 . 1 1 152 152 ASP N N 151 118.170 118.170 119.458 -1.288 18533
4464 1 6 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.426 -0.006 18533
4465 1 6 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.807 0.003 18533
4466 1 6 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.654 -0.624 18533
4467 1 6 . 1 1 152 152 ASP H H 151 7.820 7.820 8.257 -0.437 18533
4468 1 6 . 1 1 153 153 TRP N N 152 122.780 122.780 122.030 0.750 18533
4469 1 6 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.592 -0.482 18533
4470 1 6 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.313 1.297 18533
4471 1 6 . 1 1 153 153 TRP CB C 152 29.790 29.790 29.993 -0.203 18533
4472 1 6 . 1 1 153 153 TRP H H 152 7.900 7.900 7.856 0.044 18533
4473 1 6 . 1 1 154 154 VAL N N 153 119.460 119.460 116.529 2.931 18533
4474 1 6 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.870 -0.520 18533
4475 1 6 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.427 0.553 18533
4476 1 6 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.355 0.545 18533
4477 1 6 . 1 1 154 154 VAL H H 153 8.560 8.560 8.725 -0.165 18533
4478 1 6 . 1 1 155 155 ASP N N 154 120.500 120.500 120.672 -0.172 18533
4479 1 6 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.260 -0.060 18533
4480 1 6 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.147 -0.577 18533
4481 1 6 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.964 -1.104 18533
4482 1 6 . 1 1 155 155 ASP H H 154 8.530 8.530 8.296 0.234 18533
4483 1 6 . 1 1 156 156 GLU N N 155 120.090 120.090 119.572 0.518 18533
4484 1 6 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.942 -0.012 18533
4485 1 6 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.251 -0.091 18533
4486 1 6 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.370 -0.080 18533
4487 1 6 . 1 1 156 156 GLU H H 155 7.870 7.870 8.358 -0.488 18533
4488 1 6 . 1 1 157 157 ARG N N 156 119.230 119.230 118.991 0.239 18533
4489 1 6 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.995 -0.185 18533
4490 1 6 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.101 -0.111 18533
4491 1 6 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.261 -0.151 18533
4492 1 6 . 1 1 157 157 ARG H H 156 7.660 7.660 8.105 -0.445 18533
4493 1 6 . 1 1 158 158 LEU N N 157 118.790 118.790 117.396 1.394 18533
4494 1 6 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.103 -0.003 18533
4495 1 6 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.566 -0.886 18533
4496 1 6 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.782 0.908 18533
4497 1 6 . 1 1 158 158 LEU H H 157 8.470 8.470 8.245 0.225 18533
4498 1 6 . 1 1 159 159 ALA N N 158 120.760 120.760 121.191 -0.431 18533
4499 1 6 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.151 0.039 18533
4500 1 6 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.460 -1.180 18533
4501 1 6 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.020 -0.630 18533
4502 1 6 . 1 1 159 159 ALA H H 158 7.490 7.490 7.739 -0.249 18533
4503 1 6 . 1 1 160 160 ARG N N 159 117.810 117.810 116.220 1.590 18533
4504 1 6 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.095 0.115 18533
4505 1 6 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.555 -0.775 18533
4506 1 6 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.798 0.732 18533
4507 1 6 . 1 1 160 160 ARG H H 159 7.650 7.650 7.982 -0.332 18533
4508 1 6 . 1 1 161 161 ASN N N 160 118.560 118.560 118.192 0.368 18533
4509 1 6 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.693 0.047 18533
4510 1 6 . 1 1 161 161 ASN CA C 160 53.250 53.250 52.871 0.379 18533
4511 1 6 . 1 1 161 161 ASN CB C 160 39.170 39.170 39.386 -0.216 18533
4512 1 6 . 1 1 161 161 ASN H H 160 8.100 8.100 7.835 0.265 18533
4513 1 6 . 1 1 162 162 GLY N N 161 108.900 108.900 107.686 1.214 18533
4514 1 6 . 1 1 162 162 GLY CA C 161 44.730 44.730 42.843 1.887 18533
4515 1 6 . 1 1 162 162 GLY H H 161 7.980 7.980 7.456 0.524 18533
4516 1 6 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.516 -0.056 18533
4517 1 6 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.346 0.104 18533
4518 1 6 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.209 -0.009 18533
4519 1 7 . 1 1 2 2 MET N N 1 119.850 119.850 119.499 0.351 18533
4520 1 7 . 1 1 2 2 MET HA H 1 4.500 4.500 4.750 -0.250 18533
4521 1 7 . 1 1 2 2 MET CA C 1 55.450 55.450 55.023 0.427 18533
4522 1 7 . 1 1 2 2 MET CB C 1 33.170 33.170 36.295 -3.125 18533
4523 1 7 . 1 1 2 2 MET H H 1 8.140 8.140 8.212 -0.072 18533
4524 1 7 . 1 1 3 3 SER N N 2 117.000 117.000 117.534 -0.534 18533
4525 1 7 . 1 1 3 3 SER HA H 2 4.430 4.430 4.463 -0.033 18533
4526 1 7 . 1 1 3 3 SER CA C 2 58.320 58.320 59.099 -0.779 18533
4527 1 7 . 1 1 3 3 SER CB C 2 63.990 63.990 63.729 0.261 18533
4528 1 7 . 1 1 3 3 SER H H 2 8.340 8.340 8.488 -0.148 18533
4529 1 7 . 1 1 4 4 ASP N N 3 123.200 123.200 119.388 3.812 18533
4530 1 7 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.944 -0.084 18533
4531 1 7 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.306 0.574 18533
4532 1 7 . 1 1 4 4 ASP CB C 3 40.800 40.800 41.312 -0.512 18533
4533 1 7 . 1 1 4 4 ASP H H 3 8.260 8.260 7.845 0.415 18533
4534 1 7 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.651 -0.251 18533
4535 1 7 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.505 0.315 18533
4536 1 7 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.759 -0.849 18533
4537 1 7 . 1 1 6 6 LEU N N 5 123.160 123.160 119.812 3.348 18533
4538 1 7 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.422 -0.032 18533
4539 1 7 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.980 0.300 18533
4540 1 7 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.730 0.620 18533
4541 1 7 . 1 1 6 6 LEU H H 5 7.670 7.670 7.912 -0.242 18533
4542 1 7 . 1 1 7 7 HIS N N 6 127.160 127.160 117.973 9.187 18533
4543 1 7 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.914 1.116 18533
4544 1 7 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.226 -2.326 18533
4545 1 7 . 1 1 7 7 HIS CB C 6 32.130 32.130 30.955 1.175 18533
4546 1 7 . 1 1 7 7 HIS H H 6 10.080 10.080 8.622 1.458 18533
4547 1 7 . 1 1 8 8 VAL N N 7 128.620 128.620 127.210 1.410 18533
4548 1 7 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.870 -0.370 18533
4549 1 7 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.852 -0.052 18533
4550 1 7 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.098 3.702 18533
4551 1 7 . 1 1 8 8 VAL H H 7 8.930 8.930 9.100 -0.170 18533
4552 1 7 . 1 1 9 9 THR N N 8 121.530 121.530 123.623 -2.093 18533
4553 1 7 . 1 1 9 9 THR HA H 8 5.270 5.270 4.700 0.570 18533
4554 1 7 . 1 1 9 9 THR CA C 8 58.520 58.520 59.339 -0.819 18533
4555 1 7 . 1 1 9 9 THR CB C 8 70.750 70.750 69.443 1.307 18533
4556 1 7 . 1 1 9 9 THR H H 8 7.970 7.970 9.034 -1.064 18533
4557 1 7 . 1 1 10 10 PHE N N 9 125.360 125.360 128.481 -3.121 18533
4558 1 7 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.060 0.150 18533
4559 1 7 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.332 -0.022 18533
4560 1 7 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.959 2.872 18533
4561 1 7 . 1 1 10 10 PHE H H 9 8.180 8.180 8.121 0.059 18533
4562 1 7 . 1 1 11 11 VAL N N 10 121.120 121.120 120.380 0.740 18533
4563 1 7 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.396 -0.036 18533
4564 1 7 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.178 -0.759 18533
4565 1 7 . 1 1 11 11 VAL CB C 10 35.550 35.550 34.242 1.308 18533
4566 1 7 . 1 1 11 11 VAL H H 10 8.710 8.710 9.110 -0.400 18533
4567 1 7 . 1 1 12 12 CYS N N 11 123.270 123.270 123.156 0.114 18533
4568 1 7 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.721 -1.461 18533
4569 1 7 . 1 1 12 12 CYS CA C 11 57.630 57.630 55.233 2.397 18533
4570 1 7 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.020 -0.669 18533
4571 1 7 . 1 1 12 12 CYS H H 11 7.940 7.940 8.583 -0.643 18533
4572 1 7 . 1 1 13 13 THR HA H 12 5.010 5.010 4.101 0.909 18533
4573 1 7 . 1 1 13 13 THR CA C 12 64.870 64.870 62.517 2.353 18533
4574 1 7 . 1 1 13 13 THR CB C 12 69.180 69.180 66.901 2.279 18533
4575 1 7 . 1 1 14 14 GLY CA C 13 44.960 44.960 44.943 0.017 18533
4576 1 7 . 1 1 15 15 ASN N N 14 119.960 119.960 117.445 2.515 18533
4577 1 7 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.313 -0.383 18533
4578 1 7 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.566 0.303 18533
4579 1 7 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.129 2.541 18533
4580 1 7 . 1 1 15 15 ASN H H 14 9.280 9.280 8.142 1.138 18533
4581 1 7 . 1 1 16 16 ILE N N 15 101.060 101.060 109.666 -8.606 18533
4582 1 7 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.716 -0.036 18533
4583 1 7 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.841 1.949 18533
4584 1 7 . 1 1 16 16 ILE CB C 15 42.140 42.140 37.993 4.147 18533
4585 1 7 . 1 1 16 16 ILE H H 15 7.100 7.100 8.069 -0.969 18533
4586 1 7 . 1 1 17 17 CYS N N 16 116.020 116.020 119.637 -3.617 18533
4587 1 7 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.570 0.370 18533
4588 1 7 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.512 1.548 18533
4589 1 7 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.498 0.452 18533
4590 1 7 . 1 1 17 17 CYS H H 16 7.700 7.700 7.643 0.057 18533
4591 1 7 . 1 1 19 19 SER N N 18 122.340 122.340 115.268 7.072 18533
4592 1 7 . 1 1 19 19 SER HA H 18 3.810 3.810 4.118 -0.308 18533
4593 1 7 . 1 1 19 19 SER CA C 18 62.710 62.710 63.511 -0.801 18533
4594 1 7 . 1 1 19 19 SER CB C 18 64.860 64.860 61.160 3.700 18533
4595 1 7 . 1 1 19 19 SER H H 18 11.420 11.420 7.635 3.785 18533
4596 1 7 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.366 -0.396 18533
4597 1 7 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.897 0.133 18533
4598 1 7 . 1 1 20 20 PRO CB C 19 28.690 28.690 31.021 -2.331 18533
4599 1 7 . 1 1 21 21 MET N N 20 112.430 112.430 118.169 -5.739 18533
4600 1 7 . 1 1 21 21 MET HA H 20 3.730 3.730 3.986 -0.256 18533
4601 1 7 . 1 1 21 21 MET CA C 20 60.160 60.160 58.421 1.739 18533
4602 1 7 . 1 1 21 21 MET CB C 20 33.040 33.040 31.494 1.546 18533
4603 1 7 . 1 1 21 21 MET H H 20 6.310 6.310 7.522 -1.212 18533
4604 1 7 . 1 1 22 22 ALA N N 21 117.800 117.800 120.244 -2.444 18533
4605 1 7 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.774 -0.374 18533
4606 1 7 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.537 0.453 18533
4607 1 7 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.586 -1.096 18533
4608 1 7 . 1 1 22 22 ALA H H 21 6.550 6.550 7.453 -0.903 18533
4609 1 7 . 1 1 23 23 GLU N N 22 115.520 115.520 118.782 -3.262 18533
4610 1 7 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.426 -0.746 18533
4611 1 7 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.965 -0.415 18533
4612 1 7 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.895 -0.105 18533
4613 1 7 . 1 1 23 23 GLU H H 22 7.800 7.800 7.836 -0.036 18533
4614 1 7 . 1 1 24 24 LYS N N 23 114.220 114.220 116.595 -2.375 18533
4615 1 7 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.217 -0.217 18533
4616 1 7 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.188 -0.428 18533
4617 1 7 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.378 -1.578 18533
4618 1 7 . 1 1 24 24 LYS H H 23 8.040 8.040 7.637 0.403 18533
4619 1 7 . 1 1 25 25 MET N N 24 115.250 115.250 119.323 -4.073 18533
4620 1 7 . 1 1 25 25 MET HA H 24 3.950 3.950 3.858 0.092 18533
4621 1 7 . 1 1 25 25 MET CA C 24 57.980 57.980 59.088 -1.108 18533
4622 1 7 . 1 1 25 25 MET CB C 24 35.500 35.500 32.353 3.147 18533
4623 1 7 . 1 1 25 25 MET H H 24 7.610 7.610 7.578 0.032 18533
4624 1 7 . 1 1 26 26 PHE N N 25 119.090 119.090 116.483 2.607 18533
4625 1 7 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.577 -0.237 18533
4626 1 7 . 1 1 26 26 PHE CA C 25 60.030 60.030 58.654 1.377 18533
4627 1 7 . 1 1 26 26 PHE CB C 25 39.460 39.460 36.963 2.497 18533
4628 1 7 . 1 1 26 26 PHE H H 25 8.560 8.560 8.324 0.236 18533
4629 1 7 . 1 1 27 27 ALA N N 26 117.830 117.830 123.053 -5.223 18533
4630 1 7 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.484 0.446 18533
4631 1 7 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.091 0.969 18533
4632 1 7 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.920 0.490 18533
4633 1 7 . 1 1 27 27 ALA H H 26 8.800 8.800 7.615 1.185 18533
4634 1 7 . 1 1 28 28 GLN N N 27 117.550 117.550 118.521 -0.971 18533
4635 1 7 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.021 0.029 18533
4636 1 7 . 1 1 28 28 GLN CA C 27 59.610 59.610 59.005 0.605 18533
4637 1 7 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.910 0.540 18533
4638 1 7 . 1 1 28 28 GLN H H 27 7.690 7.690 7.898 -0.208 18533
4639 1 7 . 1 1 29 29 GLN N N 28 117.530 117.530 119.778 -2.248 18533
4640 1 7 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.047 0.093 18533
4641 1 7 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.866 0.314 18533
4642 1 7 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.953 -0.842 18533
4643 1 7 . 1 1 29 29 GLN H H 28 8.210 8.210 7.563 0.647 18533
4644 1 7 . 1 1 30 30 LEU N N 29 119.330 119.330 119.242 0.088 18533
4645 1 7 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.939 -0.009 18533
4646 1 7 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.813 0.267 18533
4647 1 7 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.357 0.543 18533
4648 1 7 . 1 1 30 30 LEU H H 29 8.540 8.540 8.331 0.209 18533
4649 1 7 . 1 1 31 31 ARG N N 30 120.880 120.880 117.482 3.398 18533
4650 1 7 . 1 1 31 31 ARG HA H 30 3.970 3.970 3.993 -0.023 18533
4651 1 7 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.174 0.616 18533
4652 1 7 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.522 -0.002 18533
4653 1 7 . 1 1 31 31 ARG H H 30 8.050 8.050 7.902 0.148 18533
4654 1 7 . 1 1 32 32 HIS N N 31 119.770 119.770 118.145 1.625 18533
4655 1 7 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.434 0.116 18533
4656 1 7 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.573 -0.493 18533
4657 1 7 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.200 0.510 18533
4658 1 7 . 1 1 32 32 HIS H H 31 8.440 8.440 8.440 -0.000 18533
4659 1 7 . 1 1 33 33 ARG N N 32 115.430 115.430 117.104 -1.674 18533
4660 1 7 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.497 0.093 18533
4661 1 7 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.104 -0.134 18533
4662 1 7 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.732 -0.512 18533
4663 1 7 . 1 1 33 33 ARG H H 32 7.500 7.500 7.758 -0.258 18533
4664 1 7 . 1 1 34 34 GLY N N 33 106.730 106.730 109.045 -2.315 18533
4665 1 7 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.144 1.056 18533
4666 1 7 . 1 1 34 34 GLY H H 33 7.750 7.750 8.176 -0.426 18533
4667 1 7 . 1 1 35 35 LEU N N 34 119.980 119.980 117.474 2.506 18533
4668 1 7 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.690 -0.010 18533
4669 1 7 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.657 0.493 18533
4670 1 7 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.456 0.734 18533
4671 1 7 . 1 1 35 35 LEU H H 34 7.980 7.980 8.349 -0.369 18533
4672 1 7 . 1 1 36 36 GLY N N 35 108.660 108.660 108.813 -0.153 18533
4673 1 7 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.531 -0.431 18533
4674 1 7 . 1 1 36 36 GLY H H 35 8.830 8.830 7.814 1.016 18533
4675 1 7 . 1 1 37 37 ASP N N 36 115.360 115.360 119.503 -4.143 18533
4676 1 7 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.597 0.173 18533
4677 1 7 . 1 1 37 37 ASP CA C 36 54.390 54.390 56.073 -1.683 18533
4678 1 7 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.970 0.200 18533
4679 1 7 . 1 1 37 37 ASP H H 36 8.300 8.300 8.181 0.119 18533
4680 1 7 . 1 1 38 38 ALA N N 37 121.460 121.460 121.755 -0.295 18533
4681 1 7 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.274 0.036 18533
4682 1 7 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.365 -0.415 18533
4683 1 7 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.224 0.626 18533
4684 1 7 . 1 1 38 38 ALA H H 37 7.380 7.380 7.639 -0.259 18533
4685 1 7 . 1 1 39 39 VAL N N 38 115.660 115.660 116.619 -0.959 18533
4686 1 7 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.487 0.313 18533
4687 1 7 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.085 -0.045 18533
4688 1 7 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.330 0.860 18533
4689 1 7 . 1 1 39 39 VAL H H 38 7.100 7.100 8.024 -0.924 18533
4690 1 7 . 1 1 40 40 ARG N N 39 129.230 129.230 127.747 1.483 18533
4691 1 7 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.504 0.036 18533
4692 1 7 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.303 1.407 18533
4693 1 7 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.329 0.991 18533
4694 1 7 . 1 1 40 40 ARG H H 39 9.730 9.730 8.031 1.699 18533
4695 1 7 . 1 1 41 41 VAL N N 40 126.240 126.240 123.209 3.031 18533
4696 1 7 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.849 0.841 18533
4697 1 7 . 1 1 41 41 VAL CA C 40 60.560 60.560 60.758 -0.198 18533
4698 1 7 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.578 0.362 18533
4699 1 7 . 1 1 41 41 VAL H H 40 8.610 8.610 8.413 0.197 18533
4700 1 7 . 1 1 42 42 THR N N 41 117.310 117.310 116.834 0.476 18533
4701 1 7 . 1 1 42 42 THR HA H 41 4.890 4.890 4.826 0.064 18533
4702 1 7 . 1 1 42 42 THR CA C 41 60.300 60.300 59.466 0.834 18533
4703 1 7 . 1 1 42 42 THR CB C 41 73.890 73.890 71.347 2.543 18533
4704 1 7 . 1 1 42 42 THR H H 41 8.870 8.870 8.972 -0.102 18533
4705 1 7 . 1 1 43 43 SER N N 42 109.960 109.960 113.347 -3.387 18533
4706 1 7 . 1 1 43 43 SER HA H 42 5.720 5.720 5.200 0.520 18533
4707 1 7 . 1 1 43 43 SER CA C 42 58.090 58.090 57.725 0.365 18533
4708 1 7 . 1 1 43 43 SER CB C 42 65.870 65.870 66.455 -0.585 18533
4709 1 7 . 1 1 43 43 SER H H 42 8.060 8.060 8.564 -0.504 18533
4710 1 7 . 1 1 44 44 ALA N N 43 119.200 119.200 119.778 -0.578 18533
4711 1 7 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.152 -0.892 18533
4712 1 7 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.831 -0.651 18533
4713 1 7 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.933 -1.103 18533
4714 1 7 . 1 1 44 44 ALA H H 43 8.710 8.710 9.063 -0.353 18533
4715 1 7 . 1 1 45 45 GLY N N 44 104.090 104.090 106.474 -2.384 18533
4716 1 7 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.249 -1.709 18533
4717 1 7 . 1 1 45 45 GLY H H 44 8.670 8.670 8.261 0.409 18533
4718 1 7 . 1 1 46 46 THR N N 45 114.060 114.060 116.780 -2.720 18533
4719 1 7 . 1 1 46 46 THR HA H 45 4.080 4.080 4.177 -0.097 18533
4720 1 7 . 1 1 46 46 THR CA C 45 64.680 64.680 64.242 0.438 18533
4721 1 7 . 1 1 46 46 THR CB C 45 67.880 67.880 68.832 -0.952 18533
4722 1 7 . 1 1 46 46 THR H H 45 9.120 9.120 8.025 1.095 18533
4723 1 7 . 1 1 47 47 GLY N N 46 110.380 110.380 108.685 1.695 18533
4724 1 7 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.930 -0.100 18533
4725 1 7 . 1 1 47 47 GLY H H 46 8.930 8.930 8.487 0.443 18533
4726 1 7 . 1 1 48 48 ASN N N 47 113.440 113.440 117.325 -3.885 18533
4727 1 7 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.338 0.152 18533
4728 1 7 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.168 -2.408 18533
4729 1 7 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.900 1.950 18533
4730 1 7 . 1 1 48 48 ASN H H 47 7.600 7.600 7.621 -0.021 18533
4731 1 7 . 1 1 49 49 TRP N N 48 117.300 117.300 121.372 -4.072 18533
4732 1 7 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.424 -0.524 18533
4733 1 7 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.421 0.439 18533
4734 1 7 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.990 -0.470 18533
4735 1 7 . 1 1 49 49 TRP H H 48 6.920 6.920 8.613 -1.693 18533
4736 1 7 . 1 1 50 50 HIS N N 49 111.590 111.590 115.092 -3.502 18533
4737 1 7 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.787 0.093 18533
4738 1 7 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.315 -1.455 18533
4739 1 7 . 1 1 50 50 HIS CB C 49 31.040 31.040 30.007 1.033 18533
4740 1 7 . 1 1 50 50 HIS H H 49 8.620 8.620 8.492 0.128 18533
4741 1 7 . 1 1 51 51 VAL N N 50 119.010 119.010 120.534 -1.524 18533
4742 1 7 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.785 -0.585 18533
4743 1 7 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.147 1.533 18533
4744 1 7 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.833 -0.443 18533
4745 1 7 . 1 1 51 51 VAL H H 50 6.880 6.880 7.553 -0.673 18533
4746 1 7 . 1 1 52 52 GLY N N 51 115.450 115.450 115.803 -0.353 18533
4747 1 7 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.065 -0.125 18533
4748 1 7 . 1 1 52 52 GLY H H 51 9.120 9.120 8.983 0.137 18533
4749 1 7 . 1 1 53 53 SER N N 52 116.620 116.620 115.683 0.937 18533
4750 1 7 . 1 1 53 53 SER HA H 52 4.610 4.610 4.675 -0.065 18533
4751 1 7 . 1 1 53 53 SER CA C 52 59.310 59.310 57.550 1.760 18533
4752 1 7 . 1 1 53 53 SER CB C 52 64.630 64.630 65.180 -0.550 18533
4753 1 7 . 1 1 53 53 SER H H 52 8.430 8.430 8.043 0.387 18533
4754 1 7 . 1 1 54 54 CYS N N 53 118.690 118.690 118.027 0.663 18533
4755 1 7 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.364 -0.264 18533
4756 1 7 . 1 1 54 54 CYS CA C 53 57.670 57.670 55.829 1.841 18533
4757 1 7 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.180 -2.830 18533
4758 1 7 . 1 1 54 54 CYS H H 53 8.170 8.170 8.499 -0.329 18533
4759 1 7 . 1 1 55 55 ALA N N 54 118.580 118.580 124.430 -5.850 18533
4760 1 7 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.114 0.006 18533
4761 1 7 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.962 -0.323 18533
4762 1 7 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.252 -2.622 18533
4763 1 7 . 1 1 55 55 ALA H H 54 8.420 8.420 8.620 -0.200 18533
4764 1 7 . 1 1 56 56 ASP N N 55 121.500 121.500 123.676 -2.176 18533
4765 1 7 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.412 -0.072 18533
4766 1 7 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.764 0.286 18533
4767 1 7 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.892 3.168 18533
4768 1 7 . 1 1 56 56 ASP H H 55 8.470 8.470 8.451 0.019 18533
4769 1 7 . 1 1 57 57 GLU N N 56 127.840 127.840 126.104 1.736 18533
4770 1 7 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.910 0.130 18533
4771 1 7 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.006 0.634 18533
4772 1 7 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.300 0.200 18533
4773 1 7 . 1 1 57 57 GLU H H 56 9.230 9.230 8.848 0.382 18533
4774 1 7 . 1 1 58 58 ARG N N 57 120.820 120.820 119.740 1.080 18533
4775 1 7 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.525 0.285 18533
4776 1 7 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.657 -0.507 18533
4777 1 7 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.211 -1.941 18533
4778 1 7 . 1 1 58 58 ARG H H 57 9.220 9.220 9.193 0.027 18533
4779 1 7 . 1 1 59 59 ALA N N 58 121.590 121.590 121.894 -0.304 18533
4780 1 7 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.167 -0.007 18533
4781 1 7 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.554 0.226 18533
4782 1 7 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.160 0.331 18533
4783 1 7 . 1 1 59 59 ALA H H 58 6.680 6.680 7.523 -0.843 18533
4784 1 7 . 1 1 60 60 ALA N N 59 118.970 118.970 121.536 -2.566 18533
4785 1 7 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.953 -0.093 18533
4786 1 7 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.260 -0.240 18533
4787 1 7 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.347 -0.277 18533
4788 1 7 . 1 1 60 60 ALA H H 59 8.540 8.540 8.308 0.232 18533
4789 1 7 . 1 1 61 61 GLY N N 60 104.160 104.160 106.641 -2.481 18533
4790 1 7 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.847 0.423 18533
4791 1 7 . 1 1 61 61 GLY H H 60 8.210 8.210 7.770 0.440 18533
4792 1 7 . 1 1 62 62 VAL N N 61 122.820 122.820 123.268 -0.448 18533
4793 1 7 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.571 0.279 18533
4794 1 7 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.579 -0.329 18533
4795 1 7 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.907 -0.017 18533
4796 1 7 . 1 1 62 62 VAL H H 61 7.310 7.310 7.620 -0.310 18533
4797 1 7 . 1 1 63 63 LEU N N 62 120.310 120.310 118.750 1.560 18533
4798 1 7 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.221 -0.241 18533
4799 1 7 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.292 0.658 18533
4800 1 7 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.535 -0.035 18533
4801 1 7 . 1 1 63 63 LEU H H 62 8.090 8.090 8.523 -0.433 18533
4802 1 7 . 1 1 64 64 ARG N N 63 119.440 119.440 119.153 0.287 18533
4803 1 7 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.282 -0.102 18533
4804 1 7 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.880 0.570 18533
4805 1 7 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.574 0.806 18533
4806 1 7 . 1 1 64 64 ARG H H 63 8.740 8.740 8.310 0.430 18533
4807 1 7 . 1 1 65 65 ALA N N 64 122.560 122.560 121.577 0.983 18533
4808 1 7 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.108 -0.078 18533
4809 1 7 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.091 0.449 18533
4810 1 7 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.333 -0.253 18533
4811 1 7 . 1 1 65 65 ALA H H 64 7.910 7.910 7.764 0.146 18533
4812 1 7 . 1 1 66 66 HIS N N 65 112.690 112.690 115.000 -2.310 18533
4813 1 7 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.688 -0.048 18533
4814 1 7 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.011 -0.511 18533
4815 1 7 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.904 0.416 18533
4816 1 7 . 1 1 66 66 HIS H H 65 7.410 7.410 7.894 -0.484 18533
4817 1 7 . 1 1 67 67 GLY N N 66 107.440 107.440 107.247 0.193 18533
4818 1 7 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.287 1.073 18533
4819 1 7 . 1 1 67 67 GLY H H 66 7.850 7.850 7.567 0.283 18533
4820 1 7 . 1 1 68 68 TYR N N 67 119.940 119.940 120.495 -0.555 18533
4821 1 7 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.762 0.038 18533
4822 1 7 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.459 0.641 18533
4823 1 7 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.068 0.792 18533
4824 1 7 . 1 1 68 68 TYR H H 67 8.380 8.380 8.302 0.078 18533
4825 1 7 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.550 0.010 18533
4826 1 7 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.989 -0.389 18533
4827 1 7 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.550 0.260 18533
4828 1 7 . 1 1 70 70 THR N N 69 100.660 100.660 107.084 -6.424 18533
4829 1 7 . 1 1 70 70 THR HA H 69 4.300 4.300 4.440 -0.140 18533
4830 1 7 . 1 1 70 70 THR CA C 69 61.250 61.250 61.035 0.215 18533
4831 1 7 . 1 1 70 70 THR CB C 69 70.740 70.740 69.874 0.866 18533
4832 1 7 . 1 1 70 70 THR H H 69 7.860 7.860 8.024 -0.164 18533
4833 1 7 . 1 1 71 71 ASP N N 70 122.880 122.880 123.076 -0.196 18533
4834 1 7 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.600 -0.190 18533
4835 1 7 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.431 0.439 18533
4836 1 7 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.662 -0.692 18533
4837 1 7 . 1 1 71 71 ASP H H 70 7.940 7.940 7.882 0.058 18533
4838 1 7 . 1 1 72 72 HIS N N 71 121.720 121.720 123.408 -1.688 18533
4839 1 7 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.803 -0.103 18533
4840 1 7 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.345 1.045 18533
4841 1 7 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.700 2.640 18533
4842 1 7 . 1 1 72 72 HIS H H 71 8.000 8.000 8.178 -0.178 18533
4843 1 7 . 1 1 73 73 ARG N N 72 125.760 125.760 126.825 -1.065 18533
4844 1 7 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.000 -0.710 18533
4845 1 7 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.062 0.368 18533
4846 1 7 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.810 0.500 18533
4847 1 7 . 1 1 73 73 ARG H H 72 7.230 7.230 8.117 -0.887 18533
4848 1 7 . 1 1 74 74 ALA N N 73 127.970 127.970 129.638 -1.668 18533
4849 1 7 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.536 0.094 18533
4850 1 7 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.542 -0.362 18533
4851 1 7 . 1 1 74 74 ALA CB C 73 18.900 18.900 19.985 -1.085 18533
4852 1 7 . 1 1 74 74 ALA H H 73 9.090 9.090 8.262 0.828 18533
4853 1 7 . 1 1 75 75 ALA N N 74 126.090 126.090 125.348 0.742 18533
4854 1 7 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.865 -0.075 18533
4855 1 7 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.349 0.621 18533
4856 1 7 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.340 1.280 18533
4857 1 7 . 1 1 75 75 ALA H H 74 9.410 9.410 9.742 -0.332 18533
4858 1 7 . 1 1 76 76 GLN N N 75 123.260 123.260 118.901 4.359 18533
4859 1 7 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.786 0.164 18533
4860 1 7 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.477 0.073 18533
4861 1 7 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.742 -1.692 18533
4862 1 7 . 1 1 76 76 GLN H H 75 8.800 8.800 8.423 0.377 18533
4863 1 7 . 1 1 77 77 VAL N N 76 125.510 125.510 123.078 2.432 18533
4864 1 7 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.440 -0.140 18533
4865 1 7 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.396 0.184 18533
4866 1 7 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.875 2.615 18533
4867 1 7 . 1 1 77 77 VAL H H 76 8.550 8.550 7.977 0.573 18533
4868 1 7 . 1 1 78 78 GLY N N 77 121.850 121.850 116.583 5.267 18533
4869 1 7 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.292 -0.452 18533
4870 1 7 . 1 1 78 78 GLY H H 77 10.930 10.930 7.978 2.952 18533
4871 1 7 . 1 1 79 79 THR N N 78 115.210 115.210 116.298 -1.088 18533
4872 1 7 . 1 1 79 79 THR HA H 78 3.700 3.700 3.980 -0.280 18533
4873 1 7 . 1 1 79 79 THR CA C 78 66.440 66.440 67.261 -0.821 18533
4874 1 7 . 1 1 79 79 THR CB C 78 68.770 68.770 68.584 0.186 18533
4875 1 7 . 1 1 79 79 THR H H 78 8.540 8.540 8.453 0.087 18533
4876 1 7 . 1 1 80 80 GLU N N 79 119.360 119.360 119.348 0.012 18533
4877 1 7 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.028 -0.068 18533
4878 1 7 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.941 0.089 18533
4879 1 7 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.531 0.529 18533
4880 1 7 . 1 1 80 80 GLU H H 79 9.110 9.110 8.918 0.192 18533
4881 1 7 . 1 1 81 81 HIS N N 80 118.380 118.380 117.146 1.234 18533
4882 1 7 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.246 -0.306 18533
4883 1 7 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.905 1.515 18533
4884 1 7 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.192 0.738 18533
4885 1 7 . 1 1 81 81 HIS H H 80 7.040 7.040 7.493 -0.453 18533
4886 1 7 . 1 1 82 82 LEU N N 81 114.010 114.010 119.921 -5.911 18533
4887 1 7 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.099 -0.199 18533
4888 1 7 . 1 1 82 82 LEU CA C 81 56.680 56.680 57.098 -0.418 18533
4889 1 7 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.279 -0.549 18533
4890 1 7 . 1 1 82 82 LEU H H 81 7.850 7.850 8.400 -0.550 18533
4891 1 7 . 1 1 83 83 ALA N N 82 119.050 119.050 117.947 1.103 18533
4892 1 7 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.249 0.141 18533
4893 1 7 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.240 -0.040 18533
4894 1 7 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.863 0.317 18533
4895 1 7 . 1 1 83 83 ALA H H 82 6.950 6.950 7.475 -0.525 18533
4896 1 7 . 1 1 84 84 ALA N N 83 122.500 122.500 121.744 0.756 18533
4897 1 7 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.216 -0.456 18533
4898 1 7 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.020 1.330 18533
4899 1 7 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.588 -2.268 18533
4900 1 7 . 1 1 84 84 ALA H H 83 7.280 7.280 7.203 0.077 18533
4901 1 7 . 1 1 85 85 ASP N N 84 118.740 118.740 119.854 -1.114 18533
4902 1 7 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.739 -0.329 18533
4903 1 7 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.234 1.406 18533
4904 1 7 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.048 0.852 18533
4905 1 7 . 1 1 85 85 ASP H H 84 8.440 8.440 8.336 0.104 18533
4906 1 7 . 1 1 86 86 LEU N N 85 115.180 115.180 118.721 -3.541 18533
4907 1 7 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.926 -0.746 18533
4908 1 7 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.840 1.200 18533
4909 1 7 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.896 0.274 18533
4910 1 7 . 1 1 86 86 LEU H H 85 7.280 7.280 8.161 -0.881 18533
4911 1 7 . 1 1 87 87 LEU N N 86 128.140 128.140 127.519 0.621 18533
4912 1 7 . 1 1 87 87 LEU HA H 86 4.690 4.690 5.012 -0.322 18533
4913 1 7 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.708 1.673 18533
4914 1 7 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.727 -0.557 18533
4915 1 7 . 1 1 87 87 LEU H H 86 8.780 8.780 9.129 -0.349 18533
4916 1 7 . 1 1 88 88 VAL N N 87 122.630 122.630 127.204 -4.574 18533
4917 1 7 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.943 -0.313 18533
4918 1 7 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.905 -1.995 18533
4919 1 7 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.731 -0.891 18533
4920 1 7 . 1 1 88 88 VAL H H 87 9.010 9.010 8.974 0.036 18533
4921 1 7 . 1 1 89 89 ALA N N 88 129.820 129.820 130.976 -1.156 18533
4922 1 7 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.978 -0.458 18533
4923 1 7 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.210 -0.430 18533
4924 1 7 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.203 -0.423 18533
4925 1 7 . 1 1 89 89 ALA H H 88 8.590 8.590 9.139 -0.549 18533
4926 1 7 . 1 1 90 90 LEU N N 89 129.280 129.280 119.543 9.737 18533
4927 1 7 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.572 -0.262 18533
4928 1 7 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.489 0.961 18533
4929 1 7 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.672 -3.652 18533
4930 1 7 . 1 1 90 90 LEU H H 89 8.570 8.570 8.549 0.021 18533
4931 1 7 . 1 1 91 91 ASP N N 90 126.910 126.910 114.814 12.096 18533
4932 1 7 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.765 0.035 18533
4933 1 7 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.156 -0.206 18533
4934 1 7 . 1 1 91 91 ASP CB C 90 43.810 43.810 42.156 1.654 18533
4935 1 7 . 1 1 91 91 ASP H H 90 11.450 11.450 7.429 4.021 18533
4936 1 7 . 1 1 92 92 ARG N N 91 116.950 116.950 117.686 -0.736 18533
4937 1 7 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.854 0.166 18533
4938 1 7 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.261 -0.431 18533
4939 1 7 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.710 0.570 18533
4940 1 7 . 1 1 92 92 ARG H H 91 8.650 8.650 8.224 0.426 18533
4941 1 7 . 1 1 93 93 ASN N N 92 120.740 120.740 119.267 1.473 18533
4942 1 7 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.556 -0.176 18533
4943 1 7 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.571 0.560 18533
4944 1 7 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.972 -0.352 18533
4945 1 7 . 1 1 93 93 ASN H H 92 8.610 8.610 8.138 0.472 18533
4946 1 7 . 1 1 94 94 HIS N N 93 121.170 121.170 120.161 1.009 18533
4947 1 7 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.239 -0.049 18533
4948 1 7 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.078 0.432 18533
4949 1 7 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.719 1.661 18533
4950 1 7 . 1 1 94 94 HIS H H 93 7.430 7.430 8.818 -1.388 18533
4951 1 7 . 1 1 95 95 ALA N N 94 118.270 118.270 121.382 -3.112 18533
4952 1 7 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.959 -0.219 18533
4953 1 7 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.471 0.029 18533
4954 1 7 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.312 -0.342 18533
4955 1 7 . 1 1 95 95 ALA H H 94 7.190 7.190 8.028 -0.838 18533
4956 1 7 . 1 1 96 96 ARG N N 95 117.190 117.190 119.209 -2.019 18533
4957 1 7 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.031 -0.121 18533
4958 1 7 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.285 0.215 18533
4959 1 7 . 1 1 96 96 ARG CB C 95 30.230 30.230 29.968 0.262 18533
4960 1 7 . 1 1 96 96 ARG H H 95 7.600 7.600 7.711 -0.111 18533
4961 1 7 . 1 1 97 97 LEU N N 96 120.700 120.700 119.769 0.931 18533
4962 1 7 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.995 0.085 18533
4963 1 7 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.719 0.181 18533
4964 1 7 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.708 -0.368 18533
4965 1 7 . 1 1 97 97 LEU H H 96 7.990 7.990 7.828 0.162 18533
4966 1 7 . 1 1 98 98 LEU N N 97 118.390 118.390 118.637 -0.247 18533
4967 1 7 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.834 0.076 18533
4968 1 7 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.172 -0.072 18533
4969 1 7 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.235 0.655 18533
4970 1 7 . 1 1 98 98 LEU H H 97 8.210 8.210 8.298 -0.088 18533
4971 1 7 . 1 1 99 99 ARG N N 98 117.470 117.470 118.141 -0.671 18533
4972 1 7 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.063 0.417 18533
4973 1 7 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.028 -0.668 18533
4974 1 7 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.666 -0.926 18533
4975 1 7 . 1 1 99 99 ARG H H 98 7.740 7.740 7.855 -0.115 18533
4976 1 7 . 1 1 100 100 GLN N N 99 121.400 121.400 119.263 2.137 18533
4977 1 7 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.168 -0.098 18533
4978 1 7 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.054 0.626 18533
4979 1 7 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.216 0.104 18533
4980 1 7 . 1 1 100 100 GLN H H 99 8.030 8.030 8.165 -0.135 18533
4981 1 7 . 1 1 101 101 LEU N N 100 118.940 118.940 117.690 1.250 18533
4982 1 7 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.134 0.126 18533
4983 1 7 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.680 -0.220 18533
4984 1 7 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.166 0.074 18533
4985 1 7 . 1 1 101 101 LEU H H 100 7.780 7.780 8.129 -0.349 18533
4986 1 7 . 1 1 102 102 GLY N N 101 105.740 105.740 103.502 2.238 18533
4987 1 7 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.395 0.635 18533
4988 1 7 . 1 1 102 102 GLY H H 101 7.700 7.700 7.519 0.181 18533
4989 1 7 . 1 1 103 103 VAL N N 102 122.330 122.330 121.321 1.009 18533
4990 1 7 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.074 -0.444 18533
4991 1 7 . 1 1 103 103 VAL CA C 102 63.600 63.600 61.807 1.793 18533
4992 1 7 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.149 -1.659 18533
4993 1 7 . 1 1 103 103 VAL H H 102 7.520 7.520 7.971 -0.451 18533
4994 1 7 . 1 1 104 104 GLU N N 103 128.990 128.990 114.023 14.967 18533
4995 1 7 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.452 -0.282 18533
4996 1 7 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.049 1.871 18533
4997 1 7 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.664 -3.714 18533
4998 1 7 . 1 1 104 104 GLU H H 103 9.210 9.210 8.070 1.140 18533
4999 1 7 . 1 1 105 105 ALA N N 104 124.410 124.410 122.736 1.674 18533
5000 1 7 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.181 -0.421 18533
5001 1 7 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.984 0.656 18533
5002 1 7 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.673 -0.533 18533
5003 1 7 . 1 1 105 105 ALA H H 104 8.500 8.500 8.662 -0.162 18533
5004 1 7 . 1 1 106 106 ALA N N 105 115.110 115.110 120.182 -5.072 18533
5005 1 7 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.207 -0.077 18533
5006 1 7 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.751 -0.711 18533
5007 1 7 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.603 0.457 18533
5008 1 7 . 1 1 106 106 ALA H H 105 8.270 8.270 8.329 -0.059 18533
5009 1 7 . 1 1 107 107 ARG N N 106 115.080 115.080 115.435 -0.355 18533
5010 1 7 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.901 -0.441 18533
5011 1 7 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.973 -0.463 18533
5012 1 7 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.845 0.525 18533
5013 1 7 . 1 1 107 107 ARG H H 106 7.740 7.740 7.764 -0.024 18533
5014 1 7 . 1 1 108 108 VAL N N 107 118.170 118.170 121.433 -3.263 18533
5015 1 7 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.115 0.955 18533
5016 1 7 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.204 -1.564 18533
5017 1 7 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.499 1.101 18533
5018 1 7 . 1 1 108 108 VAL H H 107 7.290 7.290 8.339 -1.049 18533
5019 1 7 . 1 1 109 109 ARG N N 108 124.250 124.250 128.298 -4.048 18533
5020 1 7 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.644 -0.024 18533
5021 1 7 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.700 -0.810 18533
5022 1 7 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.400 0.580 18533
5023 1 7 . 1 1 109 109 ARG H H 108 8.420 8.420 9.228 -0.808 18533
5024 1 7 . 1 1 110 110 MET N N 109 119.570 119.570 121.435 -1.865 18533
5025 1 7 . 1 1 110 110 MET HA H 109 4.960 4.960 4.833 0.127 18533
5026 1 7 . 1 1 110 110 MET CA C 109 53.820 53.820 54.280 -0.460 18533
5027 1 7 . 1 1 110 110 MET CB C 109 30.680 30.680 32.361 -1.681 18533
5028 1 7 . 1 1 110 110 MET H H 109 8.890 8.890 8.591 0.299 18533
5029 1 7 . 1 1 111 111 LEU N N 110 128.660 128.660 124.638 4.022 18533
5030 1 7 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.301 -0.341 18533
5031 1 7 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.120 0.480 18533
5032 1 7 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.891 -0.811 18533
5033 1 7 . 1 1 111 111 LEU H H 110 9.200 9.200 8.756 0.444 18533
5034 1 7 . 1 1 112 112 ARG N N 111 111.910 111.910 116.526 -4.616 18533
5035 1 7 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.053 -0.103 18533
5036 1 7 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.715 1.205 18533
5037 1 7 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.629 -1.129 18533
5038 1 7 . 1 1 112 112 ARG H H 111 8.930 8.930 8.632 0.298 18533
5039 1 7 . 1 1 113 113 SER N N 112 114.800 114.800 114.495 0.305 18533
5040 1 7 . 1 1 113 113 SER HA H 112 4.290 4.290 4.301 -0.011 18533
5041 1 7 . 1 1 113 113 SER CA C 112 60.880 60.880 59.649 1.231 18533
5042 1 7 . 1 1 113 113 SER CB C 112 63.190 63.190 62.527 0.663 18533
5043 1 7 . 1 1 113 113 SER H H 112 7.680 7.680 7.480 0.200 18533
5044 1 7 . 1 1 114 114 PHE N N 113 119.260 119.260 118.526 0.734 18533
5045 1 7 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.507 -0.157 18533
5046 1 7 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.977 0.953 18533
5047 1 7 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.714 0.006 18533
5048 1 7 . 1 1 114 114 PHE H H 113 7.600 7.600 7.624 -0.024 18533
5049 1 7 . 1 1 115 115 ASP N N 114 121.170 121.170 121.286 -0.116 18533
5050 1 7 . 1 1 115 115 ASP HA H 114 5.020 5.020 5.016 0.004 18533
5051 1 7 . 1 1 115 115 ASP CA C 114 51.100 51.100 51.917 -0.817 18533
5052 1 7 . 1 1 115 115 ASP CB C 114 42.510 42.510 42.022 0.488 18533
5053 1 7 . 1 1 115 115 ASP H H 114 7.430 7.430 7.453 -0.023 18533
5054 1 7 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.432 0.058 18533
5055 1 7 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.236 0.114 18533
5056 1 7 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.254 0.016 18533
5057 1 7 . 1 1 117 117 ARG N N 116 117.910 117.910 117.203 0.707 18533
5058 1 7 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.375 -0.105 18533
5059 1 7 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.036 0.414 18533
5060 1 7 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.529 -0.570 18533
5061 1 7 . 1 1 117 117 ARG H H 116 8.580 8.580 8.162 0.418 18533
5062 1 7 . 1 1 118 118 SER N N 117 116.130 116.130 114.581 1.549 18533
5063 1 7 . 1 1 118 118 SER HA H 117 3.980 3.980 4.237 -0.257 18533
5064 1 7 . 1 1 118 118 SER CA C 117 59.790 59.790 60.578 -0.788 18533
5065 1 7 . 1 1 118 118 SER CB C 117 63.760 63.760 64.135 -0.375 18533
5066 1 7 . 1 1 118 118 SER H H 117 7.950 7.950 7.609 0.341 18533
5067 1 7 . 1 1 119 119 GLY N N 118 110.080 110.080 109.520 0.560 18533
5068 1 7 . 1 1 119 119 GLY CA C 118 45.370 45.370 44.939 0.431 18533
5069 1 7 . 1 1 119 119 GLY H H 118 8.150 8.150 8.451 -0.301 18533
5070 1 7 . 1 1 120 120 THR HA H 119 4.020 4.020 4.392 -0.372 18533
5071 1 7 . 1 1 120 120 THR CA C 119 63.290 63.290 62.623 0.666 18533
5072 1 7 . 1 1 120 120 THR CB C 119 69.140 69.140 70.210 -1.071 18533
5073 1 7 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.723 -0.153 18533
5074 1 7 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.663 0.347 18533
5075 1 7 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.724 -1.734 18533
5076 1 7 . 1 1 122 122 ALA N N 121 125.880 125.880 125.142 0.738 18533
5077 1 7 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.615 -0.275 18533
5078 1 7 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.707 -0.197 18533
5079 1 7 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.141 -1.541 18533
5080 1 7 . 1 1 122 122 ALA H H 121 7.980 7.980 8.644 -0.664 18533
5081 1 7 . 1 1 123 123 LEU N N 122 119.810 119.810 121.894 -2.084 18533
5082 1 7 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.482 -0.202 18533
5083 1 7 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.143 0.347 18533
5084 1 7 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.360 2.340 18533
5085 1 7 . 1 1 123 123 LEU H H 122 7.810 7.810 8.493 -0.683 18533
5086 1 7 . 1 1 124 124 ASP N N 123 119.050 119.050 114.498 4.552 18533
5087 1 7 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.567 0.003 18533
5088 1 7 . 1 1 124 124 ASP CA C 123 55.320 55.320 52.976 2.344 18533
5089 1 7 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.560 -0.890 18533
5090 1 7 . 1 1 124 124 ASP H H 123 8.270 8.270 7.535 0.735 18533
5091 1 7 . 1 1 125 125 VAL N N 124 121.970 121.970 121.294 0.676 18533
5092 1 7 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.292 -0.032 18533
5093 1 7 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.453 1.857 18533
5094 1 7 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.578 -2.798 18533
5095 1 7 . 1 1 125 125 VAL H H 124 7.930 7.930 8.226 -0.295 18533
5096 1 7 . 1 1 126 126 GLU N N 125 129.490 129.490 126.033 3.457 18533
5097 1 7 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.092 -0.012 18533
5098 1 7 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.360 0.650 18533
5099 1 7 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.224 -0.424 18533
5100 1 7 . 1 1 126 126 GLU H H 125 9.100 9.100 8.484 0.616 18533
5101 1 7 . 1 1 127 127 ASP N N 126 122.300 122.300 118.060 4.240 18533
5102 1 7 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.767 -0.657 18533
5103 1 7 . 1 1 127 127 ASP CA C 126 51.720 51.720 50.616 1.104 18533
5104 1 7 . 1 1 127 127 ASP CB C 126 42.520 42.520 43.510 -0.990 18533
5105 1 7 . 1 1 127 127 ASP H H 126 8.630 8.630 8.356 0.274 18533
5106 1 7 . 1 1 128 128 PRO HA H 127 4.550 4.550 3.887 0.663 18533
5107 1 7 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.953 -0.353 18533
5108 1 7 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.030 -1.050 18533
5109 1 7 . 1 1 129 129 TYR N N 128 122.380 122.380 118.561 3.819 18533
5110 1 7 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.238 -0.438 18533
5111 1 7 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.605 3.515 18533
5112 1 7 . 1 1 129 129 TYR CB C 128 39.390 39.390 37.830 1.560 18533
5113 1 7 . 1 1 129 129 TYR H H 128 8.670 8.670 7.470 1.200 18533
5114 1 7 . 1 1 130 130 TYR N N 129 116.300 116.300 112.929 3.371 18533
5115 1 7 . 1 1 130 130 TYR HA H 129 4.490 4.490 5.128 -0.638 18533
5116 1 7 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.711 0.769 18533
5117 1 7 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.292 -2.632 18533
5118 1 7 . 1 1 130 130 TYR H H 129 8.680 8.680 7.655 1.025 18533
5119 1 7 . 1 1 131 131 GLY N N 130 110.870 110.870 109.633 1.237 18533
5120 1 7 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.734 -1.654 18533
5121 1 7 . 1 1 131 131 GLY H H 130 8.060 8.060 8.410 -0.350 18533
5122 1 7 . 1 1 132 132 ASP N N 131 121.590 121.590 119.579 2.011 18533
5123 1 7 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.608 0.462 18533
5124 1 7 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.157 -0.157 18533
5125 1 7 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.435 1.165 18533
5126 1 7 . 1 1 132 132 ASP H H 131 9.290 9.290 8.104 1.186 18533
5127 1 7 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.801 0.309 18533
5128 1 7 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.988 1.582 18533
5129 1 7 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.512 -0.032 18533
5130 1 7 . 1 1 134 134 SER N N 133 115.370 115.370 112.764 2.606 18533
5131 1 7 . 1 1 134 134 SER HA H 133 4.180 4.180 4.024 0.156 18533
5132 1 7 . 1 1 134 134 SER CA C 133 62.070 62.070 61.014 1.056 18533
5133 1 7 . 1 1 134 134 SER CB C 133 62.160 62.160 62.647 -0.487 18533
5134 1 7 . 1 1 134 134 SER H H 133 8.420 8.420 8.578 -0.158 18533
5135 1 7 . 1 1 135 135 ASP N N 134 123.360 123.360 121.953 1.407 18533
5136 1 7 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.340 0.190 18533
5137 1 7 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.839 1.201 18533
5138 1 7 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.104 0.706 18533
5139 1 7 . 1 1 135 135 ASP H H 134 7.980 7.980 7.686 0.294 18533
5140 1 7 . 1 1 136 136 PHE N N 135 118.940 118.940 119.048 -0.108 18533
5141 1 7 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.281 -0.481 18533
5142 1 7 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.669 3.151 18533
5143 1 7 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.166 1.184 18533
5144 1 7 . 1 1 136 136 PHE H H 135 7.850 7.850 7.408 0.442 18533
5145 1 7 . 1 1 137 137 GLU N N 136 121.410 121.410 118.245 3.165 18533
5146 1 7 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.061 0.119 18533
5147 1 7 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.056 0.444 18533
5148 1 7 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.152 -0.162 18533
5149 1 7 . 1 1 137 137 GLU H H 136 8.150 8.150 7.879 0.271 18533
5150 1 7 . 1 1 138 138 GLU N N 137 121.530 121.530 121.555 -0.025 18533
5151 1 7 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.084 0.206 18533
5152 1 7 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.293 0.107 18533
5153 1 7 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.119 -0.229 18533
5154 1 7 . 1 1 138 138 GLU H H 137 7.870 7.870 7.903 -0.033 18533
5155 1 7 . 1 1 139 139 VAL N N 138 119.930 119.930 119.800 0.130 18533
5156 1 7 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.568 -0.088 18533
5157 1 7 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.287 0.793 18533
5158 1 7 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.517 -0.167 18533
5159 1 7 . 1 1 139 139 VAL H H 138 7.770 7.770 7.636 0.134 18533
5160 1 7 . 1 1 140 140 PHE N N 139 119.130 119.130 121.046 -1.916 18533
5161 1 7 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.931 -0.371 18533
5162 1 7 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.642 1.038 18533
5163 1 7 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.696 0.474 18533
5164 1 7 . 1 1 140 140 PHE H H 139 8.050 8.050 7.915 0.135 18533
5165 1 7 . 1 1 141 141 ALA N N 140 121.040 121.040 121.877 -0.837 18533
5166 1 7 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.090 -0.100 18533
5167 1 7 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.865 0.255 18533
5168 1 7 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.394 -0.094 18533
5169 1 7 . 1 1 141 141 ALA H H 140 8.010 8.010 8.142 -0.132 18533
5170 1 7 . 1 1 142 142 VAL N N 141 118.550 118.550 118.729 -0.179 18533
5171 1 7 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.554 0.256 18533
5172 1 7 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.309 -0.709 18533
5173 1 7 . 1 1 142 142 VAL CB C 141 31.450 31.450 30.942 0.509 18533
5174 1 7 . 1 1 142 142 VAL H H 141 8.300 8.300 8.024 0.276 18533
5175 1 7 . 1 1 143 143 ILE N N 142 121.410 121.410 119.669 1.741 18533
5176 1 7 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.396 -0.006 18533
5177 1 7 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.493 0.558 18533
5178 1 7 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.700 -0.390 18533
5179 1 7 . 1 1 143 143 ILE H H 142 8.150 8.150 8.249 -0.099 18533
5180 1 7 . 1 1 144 144 GLU N N 143 119.630 119.630 119.221 0.409 18533
5181 1 7 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.750 -0.210 18533
5182 1 7 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.108 0.652 18533
5183 1 7 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.851 0.879 18533
5184 1 7 . 1 1 144 144 GLU H H 143 8.640 8.640 8.078 0.562 18533
5185 1 7 . 1 1 145 145 SER N N 144 110.920 110.920 113.752 -2.832 18533
5186 1 7 . 1 1 145 145 SER HA H 144 4.230 4.230 4.220 0.010 18533
5187 1 7 . 1 1 145 145 SER CA C 144 60.810 60.810 60.389 0.422 18533
5188 1 7 . 1 1 145 145 SER CB C 144 63.610 63.610 63.462 0.148 18533
5189 1 7 . 1 1 145 145 SER H H 144 7.640 7.640 7.804 -0.164 18533
5190 1 7 . 1 1 146 146 ALA N N 145 123.110 123.110 124.526 -1.416 18533
5191 1 7 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.329 -0.209 18533
5192 1 7 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.194 -0.794 18533
5193 1 7 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.347 2.533 18533
5194 1 7 . 1 1 146 146 ALA H H 145 7.500 7.500 7.653 -0.153 18533
5195 1 7 . 1 1 147 147 LEU N N 146 114.220 114.220 119.510 -5.290 18533
5196 1 7 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.852 0.088 18533
5197 1 7 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.421 -0.371 18533
5198 1 7 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.351 0.109 18533
5199 1 7 . 1 1 147 147 LEU H H 146 7.410 7.410 8.236 -0.826 18533
5200 1 7 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.365 0.085 18533
5201 1 7 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.731 3.109 18533
5202 1 7 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.022 0.198 18533
5203 1 7 . 1 1 149 149 GLY N N 148 102.590 102.590 106.424 -3.834 18533
5204 1 7 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.641 1.619 18533
5205 1 7 . 1 1 149 149 GLY H H 148 7.960 7.960 7.965 -0.005 18533
5206 1 7 . 1 1 150 150 LEU N N 149 128.060 128.060 123.578 4.482 18533
5207 1 7 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.206 0.424 18533
5208 1 7 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.286 0.064 18533
5209 1 7 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.425 -0.225 18533
5210 1 7 . 1 1 150 150 LEU H H 149 7.620 7.620 8.499 -0.879 18533
5211 1 7 . 1 1 151 151 HIS N N 150 120.730 120.730 118.877 1.853 18533
5212 1 7 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.285 -0.115 18533
5213 1 7 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.742 0.638 18533
5214 1 7 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.956 0.554 18533
5215 1 7 . 1 1 151 151 HIS H H 150 8.430 8.430 8.723 -0.293 18533
5216 1 7 . 1 1 152 152 ASP N N 151 118.170 118.170 119.856 -1.686 18533
5217 1 7 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.427 -0.007 18533
5218 1 7 . 1 1 152 152 ASP CA C 151 57.810 57.810 58.064 -0.254 18533
5219 1 7 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.676 -0.646 18533
5220 1 7 . 1 1 152 152 ASP H H 151 7.820 7.820 8.209 -0.389 18533
5221 1 7 . 1 1 153 153 TRP N N 152 122.780 122.780 121.717 1.063 18533
5222 1 7 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.403 -0.293 18533
5223 1 7 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.376 1.234 18533
5224 1 7 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.149 -0.359 18533
5225 1 7 . 1 1 153 153 TRP H H 152 7.900 7.900 7.927 -0.027 18533
5226 1 7 . 1 1 154 154 VAL N N 153 119.460 119.460 117.599 1.861 18533
5227 1 7 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.883 -0.533 18533
5228 1 7 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.237 0.743 18533
5229 1 7 . 1 1 154 154 VAL CB C 153 31.900 31.900 30.925 0.974 18533
5230 1 7 . 1 1 154 154 VAL H H 153 8.560 8.560 8.696 -0.136 18533
5231 1 7 . 1 1 155 155 ASP N N 154 120.500 120.500 121.648 -1.148 18533
5232 1 7 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.336 -0.136 18533
5233 1 7 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.651 -1.081 18533
5234 1 7 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.941 -1.081 18533
5235 1 7 . 1 1 155 155 ASP H H 154 8.530 8.530 8.805 -0.275 18533
5236 1 7 . 1 1 156 156 GLU N N 155 120.090 120.090 119.757 0.333 18533
5237 1 7 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.950 -0.020 18533
5238 1 7 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.276 -0.116 18533
5239 1 7 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.356 -0.066 18533
5240 1 7 . 1 1 156 156 GLU H H 155 7.870 7.870 8.403 -0.533 18533
5241 1 7 . 1 1 157 157 ARG N N 156 119.230 119.230 119.111 0.119 18533
5242 1 7 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.990 -0.180 18533
5243 1 7 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.245 -0.255 18533
5244 1 7 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.320 -0.210 18533
5245 1 7 . 1 1 157 157 ARG H H 156 7.660 7.660 7.981 -0.321 18533
5246 1 7 . 1 1 158 158 LEU N N 157 118.790 118.790 116.758 2.032 18533
5247 1 7 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.117 -0.017 18533
5248 1 7 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.285 -0.605 18533
5249 1 7 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.876 0.814 18533
5250 1 7 . 1 1 158 158 LEU H H 157 8.470 8.470 8.195 0.275 18533
5251 1 7 . 1 1 159 159 ALA N N 158 120.760 120.760 122.039 -1.279 18533
5252 1 7 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.144 0.046 18533
5253 1 7 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.087 -0.806 18533
5254 1 7 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.324 -0.934 18533
5255 1 7 . 1 1 159 159 ALA H H 158 7.490 7.490 7.612 -0.122 18533
5256 1 7 . 1 1 160 160 ARG N N 159 117.810 117.810 116.355 1.455 18533
5257 1 7 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.200 0.010 18533
5258 1 7 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.714 0.066 18533
5259 1 7 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.575 0.955 18533
5260 1 7 . 1 1 160 160 ARG H H 159 7.650 7.650 7.859 -0.209 18533
5261 1 7 . 1 1 161 161 ASN N N 160 118.560 118.560 119.277 -0.717 18533
5262 1 7 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.563 0.177 18533
5263 1 7 . 1 1 161 161 ASN CA C 160 53.250 53.250 53.804 -0.554 18533
5264 1 7 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.400 0.770 18533
5265 1 7 . 1 1 161 161 ASN H H 160 8.100 8.100 7.681 0.419 18533
5266 1 7 . 1 1 162 162 GLY N N 161 108.900 108.900 107.005 1.895 18533
5267 1 7 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.319 0.411 18533
5268 1 7 . 1 1 162 162 GLY H H 161 7.980 7.980 7.364 0.616 18533
5269 1 7 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.631 -0.171 18533
5270 1 7 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.061 0.389 18533
5271 1 7 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.903 0.297 18533
5272 1 8 . 1 1 2 2 MET N N 1 119.850 119.850 118.980 0.870 18533
5273 1 8 . 1 1 2 2 MET HA H 1 4.500 4.500 4.712 -0.212 18533
5274 1 8 . 1 1 2 2 MET CA C 1 55.450 55.450 55.455 -0.005 18533
5275 1 8 . 1 1 2 2 MET CB C 1 33.170 33.170 33.387 -0.217 18533
5276 1 8 . 1 1 2 2 MET H H 1 8.140 8.140 8.193 -0.053 18533
5277 1 8 . 1 1 3 3 SER N N 2 117.000 117.000 118.632 -1.632 18533
5278 1 8 . 1 1 3 3 SER HA H 2 4.430 4.430 4.565 -0.135 18533
5279 1 8 . 1 1 3 3 SER CA C 2 58.320 58.320 57.858 0.463 18533
5280 1 8 . 1 1 3 3 SER CB C 2 63.990 63.990 63.764 0.226 18533
5281 1 8 . 1 1 3 3 SER H H 2 8.340 8.340 8.376 -0.036 18533
5282 1 8 . 1 1 4 4 ASP N N 3 123.200 123.200 127.536 -4.336 18533
5283 1 8 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.802 0.058 18533
5284 1 8 . 1 1 4 4 ASP CA C 3 52.880 52.880 53.138 -0.258 18533
5285 1 8 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.687 0.113 18533
5286 1 8 . 1 1 4 4 ASP H H 3 8.260 8.260 8.525 -0.265 18533
5287 1 8 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.512 -0.112 18533
5288 1 8 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.583 0.237 18533
5289 1 8 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.770 -0.860 18533
5290 1 8 . 1 1 6 6 LEU N N 5 123.160 123.160 119.858 3.302 18533
5291 1 8 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.368 0.022 18533
5292 1 8 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.926 0.354 18533
5293 1 8 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.893 1.457 18533
5294 1 8 . 1 1 6 6 LEU H H 5 7.670 7.670 8.057 -0.387 18533
5295 1 8 . 1 1 7 7 HIS N N 6 127.160 127.160 118.565 8.595 18533
5296 1 8 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.929 1.101 18533
5297 1 8 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.235 -2.335 18533
5298 1 8 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.307 0.823 18533
5299 1 8 . 1 1 7 7 HIS H H 6 10.080 10.080 8.694 1.386 18533
5300 1 8 . 1 1 8 8 VAL N N 7 128.620 128.620 127.043 1.577 18533
5301 1 8 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.836 -0.336 18533
5302 1 8 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.794 0.006 18533
5303 1 8 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.267 3.533 18533
5304 1 8 . 1 1 8 8 VAL H H 7 8.930 8.930 9.031 -0.101 18533
5305 1 8 . 1 1 9 9 THR N N 8 121.530 121.530 123.708 -2.178 18533
5306 1 8 . 1 1 9 9 THR HA H 8 5.270 5.270 4.670 0.600 18533
5307 1 8 . 1 1 9 9 THR CA C 8 58.520 58.520 59.392 -0.872 18533
5308 1 8 . 1 1 9 9 THR CB C 8 70.750 70.750 69.600 1.150 18533
5309 1 8 . 1 1 9 9 THR H H 8 7.970 7.970 8.939 -0.969 18533
5310 1 8 . 1 1 10 10 PHE N N 9 125.360 125.360 128.778 -3.418 18533
5311 1 8 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.044 0.166 18533
5312 1 8 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.084 0.226 18533
5313 1 8 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.640 3.190 18533
5314 1 8 . 1 1 10 10 PHE H H 9 8.180 8.180 8.209 -0.029 18533
5315 1 8 . 1 1 11 11 VAL N N 10 121.120 121.120 121.890 -0.770 18533
5316 1 8 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.312 0.048 18533
5317 1 8 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.871 -0.452 18533
5318 1 8 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.237 2.313 18533
5319 1 8 . 1 1 11 11 VAL H H 10 8.710 8.710 9.249 -0.539 18533
5320 1 8 . 1 1 12 12 CYS N N 11 123.270 123.270 126.266 -2.996 18533
5321 1 8 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.291 -1.031 18533
5322 1 8 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.457 1.173 18533
5323 1 8 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.503 -1.153 18533
5324 1 8 . 1 1 12 12 CYS H H 11 7.940 7.940 8.620 -0.680 18533
5325 1 8 . 1 1 13 13 THR HA H 12 5.010 5.010 4.015 0.995 18533
5326 1 8 . 1 1 13 13 THR CA C 12 64.870 64.870 63.633 1.236 18533
5327 1 8 . 1 1 13 13 THR CB C 12 69.180 69.180 67.117 2.063 18533
5328 1 8 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.028 -0.068 18533
5329 1 8 . 1 1 15 15 ASN N N 14 119.960 119.960 116.725 3.235 18533
5330 1 8 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.330 -0.400 18533
5331 1 8 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.385 0.485 18533
5332 1 8 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.048 2.622 18533
5333 1 8 . 1 1 15 15 ASN H H 14 9.280 9.280 8.636 0.644 18533
5334 1 8 . 1 1 16 16 ILE N N 15 101.060 101.060 109.776 -8.716 18533
5335 1 8 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.566 0.114 18533
5336 1 8 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.662 1.128 18533
5337 1 8 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.114 4.026 18533
5338 1 8 . 1 1 16 16 ILE H H 15 7.100 7.100 7.985 -0.885 18533
5339 1 8 . 1 1 17 17 CYS N N 16 116.020 116.020 117.375 -1.355 18533
5340 1 8 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.708 0.232 18533
5341 1 8 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.078 1.982 18533
5342 1 8 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.010 -0.060 18533
5343 1 8 . 1 1 17 17 CYS H H 16 7.700 7.700 7.785 -0.085 18533
5344 1 8 . 1 1 19 19 SER N N 18 122.340 122.340 114.438 7.902 18533
5345 1 8 . 1 1 19 19 SER HA H 18 3.810 3.810 4.165 -0.355 18533
5346 1 8 . 1 1 19 19 SER CA C 18 62.710 62.710 63.120 -0.410 18533
5347 1 8 . 1 1 19 19 SER CB C 18 64.860 64.860 61.294 3.566 18533
5348 1 8 . 1 1 19 19 SER H H 18 11.420 11.420 8.600 2.820 18533
5349 1 8 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.185 -0.215 18533
5350 1 8 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.772 0.258 18533
5351 1 8 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.868 -2.178 18533
5352 1 8 . 1 1 21 21 MET N N 20 112.430 112.430 118.937 -6.507 18533
5353 1 8 . 1 1 21 21 MET HA H 20 3.730 3.730 3.999 -0.269 18533
5354 1 8 . 1 1 21 21 MET CA C 20 60.160 60.160 58.154 2.006 18533
5355 1 8 . 1 1 21 21 MET CB C 20 33.040 33.040 31.445 1.595 18533
5356 1 8 . 1 1 21 21 MET H H 20 6.310 6.310 7.523 -1.213 18533
5357 1 8 . 1 1 22 22 ALA N N 21 117.800 117.800 119.711 -1.911 18533
5358 1 8 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.815 -0.415 18533
5359 1 8 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.252 0.738 18533
5360 1 8 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.775 -1.285 18533
5361 1 8 . 1 1 22 22 ALA H H 21 6.550 6.550 7.429 -0.879 18533
5362 1 8 . 1 1 23 23 GLU N N 22 115.520 115.520 118.737 -3.217 18533
5363 1 8 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.023 -0.343 18533
5364 1 8 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.696 -0.146 18533
5365 1 8 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.748 0.042 18533
5366 1 8 . 1 1 23 23 GLU H H 22 7.800 7.800 7.606 0.194 18533
5367 1 8 . 1 1 24 24 LYS N N 23 114.220 114.220 116.202 -1.982 18533
5368 1 8 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.158 -0.158 18533
5369 1 8 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.988 -0.228 18533
5370 1 8 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.362 -1.562 18533
5371 1 8 . 1 1 24 24 LYS H H 23 8.040 8.040 7.424 0.616 18533
5372 1 8 . 1 1 25 25 MET N N 24 115.250 115.250 119.694 -4.444 18533
5373 1 8 . 1 1 25 25 MET HA H 24 3.950 3.950 3.760 0.190 18533
5374 1 8 . 1 1 25 25 MET CA C 24 57.980 57.980 58.897 -0.917 18533
5375 1 8 . 1 1 25 25 MET CB C 24 35.500 35.500 32.252 3.248 18533
5376 1 8 . 1 1 25 25 MET H H 24 7.610 7.610 7.412 0.198 18533
5377 1 8 . 1 1 26 26 PHE N N 25 119.090 119.090 116.036 3.054 18533
5378 1 8 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.587 -0.247 18533
5379 1 8 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.044 -0.014 18533
5380 1 8 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.373 2.087 18533
5381 1 8 . 1 1 26 26 PHE H H 25 8.560 8.560 7.768 0.792 18533
5382 1 8 . 1 1 27 27 ALA N N 26 117.830 117.830 122.609 -4.779 18533
5383 1 8 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.749 0.181 18533
5384 1 8 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.127 0.933 18533
5385 1 8 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.888 0.522 18533
5386 1 8 . 1 1 27 27 ALA H H 26 8.800 8.800 7.178 1.622 18533
5387 1 8 . 1 1 28 28 GLN N N 27 117.550 117.550 118.375 -0.825 18533
5388 1 8 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.922 0.128 18533
5389 1 8 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.841 0.769 18533
5390 1 8 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.821 0.629 18533
5391 1 8 . 1 1 28 28 GLN H H 27 7.690 7.690 7.751 -0.061 18533
5392 1 8 . 1 1 29 29 GLN N N 28 117.530 117.530 119.794 -2.264 18533
5393 1 8 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.064 0.076 18533
5394 1 8 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.761 0.419 18533
5395 1 8 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.922 -0.812 18533
5396 1 8 . 1 1 29 29 GLN H H 28 8.210 8.210 7.531 0.679 18533
5397 1 8 . 1 1 30 30 LEU N N 29 119.330 119.330 120.020 -0.690 18533
5398 1 8 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.067 -0.137 18533
5399 1 8 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.957 0.123 18533
5400 1 8 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.508 0.392 18533
5401 1 8 . 1 1 30 30 LEU H H 29 8.540 8.540 8.427 0.113 18533
5402 1 8 . 1 1 31 31 ARG N N 30 120.880 120.880 117.890 2.990 18533
5403 1 8 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.094 -0.124 18533
5404 1 8 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.099 0.691 18533
5405 1 8 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.323 0.198 18533
5406 1 8 . 1 1 31 31 ARG H H 30 8.050 8.050 7.954 0.096 18533
5407 1 8 . 1 1 32 32 HIS N N 31 119.770 119.770 118.628 1.142 18533
5408 1 8 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.420 0.130 18533
5409 1 8 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.293 -0.213 18533
5410 1 8 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.224 0.486 18533
5411 1 8 . 1 1 32 32 HIS H H 31 8.440 8.440 8.415 0.025 18533
5412 1 8 . 1 1 33 33 ARG N N 32 115.430 115.430 116.991 -1.561 18533
5413 1 8 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.477 0.113 18533
5414 1 8 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.107 -0.137 18533
5415 1 8 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.663 -0.443 18533
5416 1 8 . 1 1 33 33 ARG H H 32 7.500 7.500 7.827 -0.327 18533
5417 1 8 . 1 1 34 34 GLY N N 33 106.730 106.730 108.831 -2.101 18533
5418 1 8 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.109 1.091 18533
5419 1 8 . 1 1 34 34 GLY H H 33 7.750 7.750 8.213 -0.463 18533
5420 1 8 . 1 1 35 35 LEU N N 34 119.980 119.980 117.291 2.689 18533
5421 1 8 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.862 -0.182 18533
5422 1 8 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.733 0.417 18533
5423 1 8 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.538 0.652 18533
5424 1 8 . 1 1 35 35 LEU H H 34 7.980 7.980 8.447 -0.467 18533
5425 1 8 . 1 1 36 36 GLY N N 35 108.660 108.660 109.244 -0.584 18533
5426 1 8 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.821 -0.721 18533
5427 1 8 . 1 1 36 36 GLY H H 35 8.830 8.830 7.875 0.955 18533
5428 1 8 . 1 1 37 37 ASP N N 36 115.360 115.360 119.463 -4.103 18533
5429 1 8 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.641 0.129 18533
5430 1 8 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.086 -0.695 18533
5431 1 8 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.464 0.706 18533
5432 1 8 . 1 1 37 37 ASP H H 36 8.300 8.300 7.957 0.343 18533
5433 1 8 . 1 1 38 38 ALA N N 37 121.460 121.460 120.952 0.508 18533
5434 1 8 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.209 0.101 18533
5435 1 8 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.482 -0.532 18533
5436 1 8 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.424 0.426 18533
5437 1 8 . 1 1 38 38 ALA H H 37 7.380 7.380 7.741 -0.361 18533
5438 1 8 . 1 1 39 39 VAL N N 38 115.660 115.660 117.161 -1.501 18533
5439 1 8 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.577 0.223 18533
5440 1 8 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.263 -0.223 18533
5441 1 8 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.787 0.403 18533
5442 1 8 . 1 1 39 39 VAL H H 38 7.100 7.100 7.697 -0.597 18533
5443 1 8 . 1 1 40 40 ARG N N 39 129.230 129.230 127.781 1.449 18533
5444 1 8 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.558 -0.018 18533
5445 1 8 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.436 1.274 18533
5446 1 8 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.165 1.155 18533
5447 1 8 . 1 1 40 40 ARG H H 39 9.730 9.730 8.515 1.215 18533
5448 1 8 . 1 1 41 41 VAL N N 40 126.240 126.240 124.145 2.095 18533
5449 1 8 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.873 0.817 18533
5450 1 8 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.648 -1.089 18533
5451 1 8 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.607 -0.667 18533
5452 1 8 . 1 1 41 41 VAL H H 40 8.610 8.610 8.415 0.195 18533
5453 1 8 . 1 1 42 42 THR N N 41 117.310 117.310 119.040 -1.730 18533
5454 1 8 . 1 1 42 42 THR HA H 41 4.890 4.890 4.818 0.072 18533
5455 1 8 . 1 1 42 42 THR CA C 41 60.300 60.300 59.572 0.728 18533
5456 1 8 . 1 1 42 42 THR CB C 41 73.890 73.890 71.121 2.769 18533
5457 1 8 . 1 1 42 42 THR H H 41 8.870 8.870 9.131 -0.261 18533
5458 1 8 . 1 1 43 43 SER N N 42 109.960 109.960 113.497 -3.537 18533
5459 1 8 . 1 1 43 43 SER HA H 42 5.720 5.720 4.917 0.803 18533
5460 1 8 . 1 1 43 43 SER CA C 42 58.090 58.090 57.959 0.131 18533
5461 1 8 . 1 1 43 43 SER CB C 42 65.870 65.870 66.612 -0.742 18533
5462 1 8 . 1 1 43 43 SER H H 42 8.060 8.060 8.589 -0.529 18533
5463 1 8 . 1 1 44 44 ALA N N 43 119.200 119.200 119.660 -0.460 18533
5464 1 8 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.287 -1.027 18533
5465 1 8 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.801 -0.621 18533
5466 1 8 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.909 -1.079 18533
5467 1 8 . 1 1 44 44 ALA H H 43 8.710 8.710 9.074 -0.364 18533
5468 1 8 . 1 1 45 45 GLY N N 44 104.090 104.090 106.276 -2.186 18533
5469 1 8 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.221 -1.681 18533
5470 1 8 . 1 1 45 45 GLY H H 44 8.670 8.670 8.242 0.428 18533
5471 1 8 . 1 1 46 46 THR N N 45 114.060 114.060 116.710 -2.650 18533
5472 1 8 . 1 1 46 46 THR HA H 45 4.080 4.080 4.108 -0.028 18533
5473 1 8 . 1 1 46 46 THR CA C 45 64.680 64.680 64.471 0.209 18533
5474 1 8 . 1 1 46 46 THR CB C 45 67.880 67.880 68.683 -0.803 18533
5475 1 8 . 1 1 46 46 THR H H 45 9.120 9.120 8.401 0.719 18533
5476 1 8 . 1 1 47 47 GLY N N 46 110.380 110.380 108.096 2.284 18533
5477 1 8 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.958 -0.128 18533
5478 1 8 . 1 1 47 47 GLY H H 46 8.930 8.930 8.248 0.682 18533
5479 1 8 . 1 1 48 48 ASN N N 47 113.440 113.440 117.676 -4.236 18533
5480 1 8 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.372 0.118 18533
5481 1 8 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.333 -2.573 18533
5482 1 8 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.812 2.038 18533
5483 1 8 . 1 1 48 48 ASN H H 47 7.600 7.600 7.687 -0.087 18533
5484 1 8 . 1 1 49 49 TRP N N 48 117.300 117.300 121.271 -3.971 18533
5485 1 8 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.388 -0.488 18533
5486 1 8 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.200 0.660 18533
5487 1 8 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.043 -0.523 18533
5488 1 8 . 1 1 49 49 TRP H H 48 6.920 6.920 8.664 -1.744 18533
5489 1 8 . 1 1 50 50 HIS N N 49 111.590 111.590 115.181 -3.591 18533
5490 1 8 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.831 0.049 18533
5491 1 8 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.532 -1.672 18533
5492 1 8 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.754 1.286 18533
5493 1 8 . 1 1 50 50 HIS H H 49 8.620 8.620 8.414 0.206 18533
5494 1 8 . 1 1 51 51 VAL N N 50 119.010 119.010 120.086 -1.076 18533
5495 1 8 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.667 -0.467 18533
5496 1 8 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.499 1.181 18533
5497 1 8 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.891 -0.501 18533
5498 1 8 . 1 1 51 51 VAL H H 50 6.880 6.880 7.516 -0.636 18533
5499 1 8 . 1 1 52 52 GLY N N 51 115.450 115.450 115.528 -0.078 18533
5500 1 8 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.405 -0.465 18533
5501 1 8 . 1 1 52 52 GLY H H 51 9.120 9.120 9.258 -0.138 18533
5502 1 8 . 1 1 53 53 SER N N 52 116.620 116.620 115.377 1.243 18533
5503 1 8 . 1 1 53 53 SER HA H 52 4.610 4.610 4.765 -0.155 18533
5504 1 8 . 1 1 53 53 SER CA C 52 59.310 59.310 57.503 1.807 18533
5505 1 8 . 1 1 53 53 SER CB C 52 64.630 64.630 65.003 -0.373 18533
5506 1 8 . 1 1 53 53 SER H H 52 8.430 8.430 8.064 0.366 18533
5507 1 8 . 1 1 54 54 CYS N N 53 118.690 118.690 117.810 0.880 18533
5508 1 8 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.183 -0.083 18533
5509 1 8 . 1 1 54 54 CYS CA C 53 57.670 57.670 55.899 1.771 18533
5510 1 8 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.010 -2.660 18533
5511 1 8 . 1 1 54 54 CYS H H 53 8.170 8.170 8.491 -0.321 18533
5512 1 8 . 1 1 55 55 ALA N N 54 118.580 118.580 124.005 -5.425 18533
5513 1 8 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.095 0.025 18533
5514 1 8 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.959 -0.319 18533
5515 1 8 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.320 -2.691 18533
5516 1 8 . 1 1 55 55 ALA H H 54 8.420 8.420 8.514 -0.094 18533
5517 1 8 . 1 1 56 56 ASP N N 55 121.500 121.500 123.065 -1.565 18533
5518 1 8 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.389 -0.049 18533
5519 1 8 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.942 0.108 18533
5520 1 8 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.990 3.070 18533
5521 1 8 . 1 1 56 56 ASP H H 55 8.470 8.470 8.285 0.185 18533
5522 1 8 . 1 1 57 57 GLU N N 56 127.840 127.840 126.419 1.421 18533
5523 1 8 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.803 0.237 18533
5524 1 8 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.373 0.267 18533
5525 1 8 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.361 0.139 18533
5526 1 8 . 1 1 57 57 GLU H H 56 9.230 9.230 8.855 0.375 18533
5527 1 8 . 1 1 58 58 ARG N N 57 120.820 120.820 117.915 2.905 18533
5528 1 8 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.730 0.080 18533
5529 1 8 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.390 -0.240 18533
5530 1 8 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.687 -1.417 18533
5531 1 8 . 1 1 58 58 ARG H H 57 9.220 9.220 8.404 0.816 18533
5532 1 8 . 1 1 59 59 ALA N N 58 121.590 121.590 122.472 -0.882 18533
5533 1 8 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.170 -0.010 18533
5534 1 8 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.376 0.404 18533
5535 1 8 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.139 0.351 18533
5536 1 8 . 1 1 59 59 ALA H H 58 6.680 6.680 7.554 -0.874 18533
5537 1 8 . 1 1 60 60 ALA N N 59 118.970 118.970 122.102 -3.132 18533
5538 1 8 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.918 -0.058 18533
5539 1 8 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.370 -0.350 18533
5540 1 8 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.316 -0.246 18533
5541 1 8 . 1 1 60 60 ALA H H 59 8.540 8.540 8.402 0.138 18533
5542 1 8 . 1 1 61 61 GLY N N 60 104.160 104.160 106.709 -2.549 18533
5543 1 8 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.193 0.077 18533
5544 1 8 . 1 1 61 61 GLY H H 60 8.210 8.210 7.967 0.243 18533
5545 1 8 . 1 1 62 62 VAL N N 61 122.820 122.820 123.257 -0.437 18533
5546 1 8 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.675 0.175 18533
5547 1 8 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.217 0.033 18533
5548 1 8 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.324 0.566 18533
5549 1 8 . 1 1 62 62 VAL H H 61 7.310 7.310 7.949 -0.639 18533
5550 1 8 . 1 1 63 63 LEU N N 62 120.310 120.310 118.836 1.474 18533
5551 1 8 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.160 -0.180 18533
5552 1 8 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.408 0.542 18533
5553 1 8 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.497 0.003 18533
5554 1 8 . 1 1 63 63 LEU H H 62 8.090 8.090 8.402 -0.312 18533
5555 1 8 . 1 1 64 64 ARG N N 63 119.440 119.440 119.456 -0.016 18533
5556 1 8 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.475 -0.295 18533
5557 1 8 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.422 1.028 18533
5558 1 8 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.018 1.362 18533
5559 1 8 . 1 1 64 64 ARG H H 63 8.740 8.740 8.844 -0.104 18533
5560 1 8 . 1 1 65 65 ALA N N 64 122.560 122.560 123.179 -0.619 18533
5561 1 8 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.113 -0.083 18533
5562 1 8 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.427 0.113 18533
5563 1 8 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.062 0.018 18533
5564 1 8 . 1 1 65 65 ALA H H 64 7.910 7.910 8.141 -0.231 18533
5565 1 8 . 1 1 66 66 HIS N N 65 112.690 112.690 114.747 -2.057 18533
5566 1 8 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.690 -0.050 18533
5567 1 8 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.198 -0.698 18533
5568 1 8 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.014 0.306 18533
5569 1 8 . 1 1 66 66 HIS H H 65 7.410 7.410 7.863 -0.453 18533
5570 1 8 . 1 1 67 67 GLY N N 66 107.440 107.440 106.281 1.159 18533
5571 1 8 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.158 1.202 18533
5572 1 8 . 1 1 67 67 GLY H H 66 7.850 7.850 7.780 0.070 18533
5573 1 8 . 1 1 68 68 TYR N N 67 119.940 119.940 121.635 -1.695 18533
5574 1 8 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.823 -0.023 18533
5575 1 8 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.299 0.801 18533
5576 1 8 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.985 0.875 18533
5577 1 8 . 1 1 68 68 TYR H H 67 8.380 8.380 8.329 0.051 18533
5578 1 8 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.519 0.041 18533
5579 1 8 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.940 -0.340 18533
5580 1 8 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.471 0.339 18533
5581 1 8 . 1 1 70 70 THR N N 69 100.660 100.660 106.373 -5.713 18533
5582 1 8 . 1 1 70 70 THR HA H 69 4.300 4.300 4.463 -0.163 18533
5583 1 8 . 1 1 70 70 THR CA C 69 61.250 61.250 60.920 0.330 18533
5584 1 8 . 1 1 70 70 THR CB C 69 70.740 70.740 69.522 1.218 18533
5585 1 8 . 1 1 70 70 THR H H 69 7.860 7.860 8.014 -0.154 18533
5586 1 8 . 1 1 71 71 ASP N N 70 122.880 122.880 122.278 0.602 18533
5587 1 8 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.535 -0.125 18533
5588 1 8 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.874 0.996 18533
5589 1 8 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.858 -0.888 18533
5590 1 8 . 1 1 71 71 ASP H H 70 7.940 7.940 7.858 0.082 18533
5591 1 8 . 1 1 72 72 HIS N N 71 121.720 121.720 124.522 -2.802 18533
5592 1 8 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.777 -0.077 18533
5593 1 8 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.472 0.918 18533
5594 1 8 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.924 2.416 18533
5595 1 8 . 1 1 72 72 HIS H H 71 8.000 8.000 8.148 -0.148 18533
5596 1 8 . 1 1 73 73 ARG N N 72 125.760 125.760 125.469 0.291 18533
5597 1 8 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.941 -0.651 18533
5598 1 8 . 1 1 73 73 ARG CA C 72 54.430 54.430 53.965 0.466 18533
5599 1 8 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.725 0.585 18533
5600 1 8 . 1 1 73 73 ARG H H 72 7.230 7.230 7.883 -0.653 18533
5601 1 8 . 1 1 74 74 ALA N N 73 127.970 127.970 129.557 -1.587 18533
5602 1 8 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.716 -0.086 18533
5603 1 8 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.380 -0.200 18533
5604 1 8 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.110 -1.210 18533
5605 1 8 . 1 1 74 74 ALA H H 73 9.090 9.090 8.341 0.749 18533
5606 1 8 . 1 1 75 75 ALA N N 74 126.090 126.090 125.536 0.554 18533
5607 1 8 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.856 -0.066 18533
5608 1 8 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.322 0.648 18533
5609 1 8 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.283 1.337 18533
5610 1 8 . 1 1 75 75 ALA H H 74 9.410 9.410 9.643 -0.233 18533
5611 1 8 . 1 1 76 76 GLN N N 75 123.260 123.260 119.345 3.915 18533
5612 1 8 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.650 0.300 18533
5613 1 8 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.855 -0.305 18533
5614 1 8 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.245 -1.195 18533
5615 1 8 . 1 1 76 76 GLN H H 75 8.800 8.800 8.389 0.411 18533
5616 1 8 . 1 1 77 77 VAL N N 76 125.510 125.510 123.606 1.904 18533
5617 1 8 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.389 -0.089 18533
5618 1 8 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.717 -0.137 18533
5619 1 8 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.751 1.739 18533
5620 1 8 . 1 1 77 77 VAL H H 76 8.550 8.550 7.913 0.637 18533
5621 1 8 . 1 1 78 78 GLY N N 77 121.850 121.850 115.842 6.008 18533
5622 1 8 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.304 -0.465 18533
5623 1 8 . 1 1 78 78 GLY H H 77 10.930 10.930 8.157 2.773 18533
5624 1 8 . 1 1 79 79 THR N N 78 115.210 115.210 115.680 -0.470 18533
5625 1 8 . 1 1 79 79 THR HA H 78 3.700 3.700 3.974 -0.274 18533
5626 1 8 . 1 1 79 79 THR CA C 78 66.440 66.440 67.610 -1.170 18533
5627 1 8 . 1 1 79 79 THR CB C 78 68.770 68.770 68.879 -0.109 18533
5628 1 8 . 1 1 79 79 THR H H 78 8.540 8.540 8.425 0.115 18533
5629 1 8 . 1 1 80 80 GLU N N 79 119.360 119.360 118.635 0.725 18533
5630 1 8 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.006 -0.046 18533
5631 1 8 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.737 0.293 18533
5632 1 8 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.960 0.099 18533
5633 1 8 . 1 1 80 80 GLU H H 79 9.110 9.110 8.860 0.250 18533
5634 1 8 . 1 1 81 81 HIS N N 80 118.380 118.380 116.883 1.497 18533
5635 1 8 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.250 -0.310 18533
5636 1 8 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.974 1.446 18533
5637 1 8 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.262 0.668 18533
5638 1 8 . 1 1 81 81 HIS H H 80 7.040 7.040 7.549 -0.509 18533
5639 1 8 . 1 1 82 82 LEU N N 81 114.010 114.010 119.259 -5.249 18533
5640 1 8 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.110 -0.210 18533
5641 1 8 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.577 0.103 18533
5642 1 8 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.378 -0.648 18533
5643 1 8 . 1 1 82 82 LEU H H 81 7.850 7.850 8.248 -0.398 18533
5644 1 8 . 1 1 83 83 ALA N N 82 119.050 119.050 118.251 0.799 18533
5645 1 8 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.278 0.112 18533
5646 1 8 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.362 -0.162 18533
5647 1 8 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.915 0.265 18533
5648 1 8 . 1 1 83 83 ALA H H 82 6.950 6.950 7.367 -0.417 18533
5649 1 8 . 1 1 84 84 ALA N N 83 122.500 122.500 122.130 0.370 18533
5650 1 8 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.266 -0.506 18533
5651 1 8 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.569 1.780 18533
5652 1 8 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.416 -2.096 18533
5653 1 8 . 1 1 84 84 ALA H H 83 7.280 7.280 7.304 -0.024 18533
5654 1 8 . 1 1 85 85 ASP N N 84 118.740 118.740 120.361 -1.621 18533
5655 1 8 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.676 -0.266 18533
5656 1 8 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.635 1.005 18533
5657 1 8 . 1 1 85 85 ASP CB C 84 42.900 42.900 41.881 1.019 18533
5658 1 8 . 1 1 85 85 ASP H H 84 8.440 8.440 8.952 -0.512 18533
5659 1 8 . 1 1 86 86 LEU N N 85 115.180 115.180 118.238 -3.058 18533
5660 1 8 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.820 -0.640 18533
5661 1 8 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.862 1.178 18533
5662 1 8 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.853 0.317 18533
5663 1 8 . 1 1 86 86 LEU H H 85 7.280 7.280 8.084 -0.804 18533
5664 1 8 . 1 1 87 87 LEU N N 86 128.140 128.140 127.659 0.481 18533
5665 1 8 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.959 -0.269 18533
5666 1 8 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.695 1.685 18533
5667 1 8 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.680 -0.510 18533
5668 1 8 . 1 1 87 87 LEU H H 86 8.780 8.780 9.185 -0.405 18533
5669 1 8 . 1 1 88 88 VAL N N 87 122.630 122.630 127.420 -4.790 18533
5670 1 8 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.899 -0.269 18533
5671 1 8 . 1 1 88 88 VAL CA C 87 59.910 59.910 62.022 -2.112 18533
5672 1 8 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.594 -0.754 18533
5673 1 8 . 1 1 88 88 VAL H H 87 9.010 9.010 9.071 -0.061 18533
5674 1 8 . 1 1 89 89 ALA N N 88 129.820 129.820 131.184 -1.364 18533
5675 1 8 . 1 1 89 89 ALA HA H 88 4.520 4.520 5.007 -0.487 18533
5676 1 8 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.408 -0.628 18533
5677 1 8 . 1 1 89 89 ALA CB C 88 20.780 20.780 20.912 -0.132 18533
5678 1 8 . 1 1 89 89 ALA H H 88 8.590 8.590 9.155 -0.565 18533
5679 1 8 . 1 1 90 90 LEU N N 89 129.280 129.280 119.707 9.573 18533
5680 1 8 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.664 -0.354 18533
5681 1 8 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.051 0.399 18533
5682 1 8 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.951 -3.931 18533
5683 1 8 . 1 1 90 90 LEU H H 89 8.570 8.570 8.649 -0.079 18533
5684 1 8 . 1 1 91 91 ASP N N 90 126.910 126.910 116.383 10.527 18533
5685 1 8 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.898 -0.098 18533
5686 1 8 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.943 0.007 18533
5687 1 8 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.084 0.726 18533
5688 1 8 . 1 1 91 91 ASP H H 90 11.450 11.450 7.509 3.941 18533
5689 1 8 . 1 1 92 92 ARG N N 91 116.950 116.950 121.681 -4.731 18533
5690 1 8 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.893 0.127 18533
5691 1 8 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.592 -0.762 18533
5692 1 8 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.727 0.553 18533
5693 1 8 . 1 1 92 92 ARG H H 91 8.650 8.650 8.049 0.601 18533
5694 1 8 . 1 1 93 93 ASN N N 92 120.740 120.740 118.428 2.312 18533
5695 1 8 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.509 -0.129 18533
5696 1 8 . 1 1 93 93 ASN CA C 92 56.130 56.130 56.800 -0.670 18533
5697 1 8 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.099 -0.479 18533
5698 1 8 . 1 1 93 93 ASN H H 92 8.610 8.610 8.518 0.092 18533
5699 1 8 . 1 1 94 94 HIS N N 93 121.170 121.170 120.200 0.970 18533
5700 1 8 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.181 0.009 18533
5701 1 8 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.181 0.329 18533
5702 1 8 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.700 1.680 18533
5703 1 8 . 1 1 94 94 HIS H H 93 7.430 7.430 8.516 -1.086 18533
5704 1 8 . 1 1 95 95 ALA N N 94 118.270 118.270 121.458 -3.188 18533
5705 1 8 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.954 -0.214 18533
5706 1 8 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.465 0.035 18533
5707 1 8 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.339 -0.369 18533
5708 1 8 . 1 1 95 95 ALA H H 94 7.190 7.190 8.123 -0.933 18533
5709 1 8 . 1 1 96 96 ARG N N 95 117.190 117.190 119.120 -1.930 18533
5710 1 8 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.040 -0.130 18533
5711 1 8 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.237 0.263 18533
5712 1 8 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.009 0.221 18533
5713 1 8 . 1 1 96 96 ARG H H 95 7.600 7.600 7.691 -0.091 18533
5714 1 8 . 1 1 97 97 LEU N N 96 120.700 120.700 119.776 0.924 18533
5715 1 8 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.990 0.090 18533
5716 1 8 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.694 0.206 18533
5717 1 8 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.700 -0.360 18533
5718 1 8 . 1 1 97 97 LEU H H 96 7.990 7.990 7.880 0.110 18533
5719 1 8 . 1 1 98 98 LEU N N 97 118.390 118.390 118.606 -0.216 18533
5720 1 8 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.836 0.074 18533
5721 1 8 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.109 -0.009 18533
5722 1 8 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.223 0.667 18533
5723 1 8 . 1 1 98 98 LEU H H 97 8.210 8.210 8.206 0.004 18533
5724 1 8 . 1 1 99 99 ARG N N 98 117.470 117.470 118.044 -0.574 18533
5725 1 8 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.020 0.460 18533
5726 1 8 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.051 -0.691 18533
5727 1 8 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.606 -0.866 18533
5728 1 8 . 1 1 99 99 ARG H H 98 7.740 7.740 7.820 -0.080 18533
5729 1 8 . 1 1 100 100 GLN N N 99 121.400 121.400 118.780 2.620 18533
5730 1 8 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.176 -0.106 18533
5731 1 8 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.174 0.506 18533
5732 1 8 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.216 0.104 18533
5733 1 8 . 1 1 100 100 GLN H H 99 8.030 8.030 8.031 -0.001 18533
5734 1 8 . 1 1 101 101 LEU N N 100 118.940 118.940 117.130 1.810 18533
5735 1 8 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.198 0.062 18533
5736 1 8 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.239 0.221 18533
5737 1 8 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.175 0.065 18533
5738 1 8 . 1 1 101 101 LEU H H 100 7.780 7.780 7.977 -0.197 18533
5739 1 8 . 1 1 102 102 GLY N N 101 105.740 105.740 104.180 1.560 18533
5740 1 8 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.267 0.763 18533
5741 1 8 . 1 1 102 102 GLY H H 101 7.700 7.700 7.599 0.101 18533
5742 1 8 . 1 1 103 103 VAL N N 102 122.330 122.330 121.161 1.169 18533
5743 1 8 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.048 -0.418 18533
5744 1 8 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.542 1.058 18533
5745 1 8 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.224 -1.734 18533
5746 1 8 . 1 1 103 103 VAL H H 102 7.520 7.520 7.985 -0.465 18533
5747 1 8 . 1 1 104 104 GLU N N 103 128.990 128.990 114.621 14.369 18533
5748 1 8 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.454 -0.284 18533
5749 1 8 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.006 1.914 18533
5750 1 8 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.789 -3.839 18533
5751 1 8 . 1 1 104 104 GLU H H 103 9.210 9.210 8.076 1.134 18533
5752 1 8 . 1 1 105 105 ALA N N 104 124.410 124.410 122.789 1.621 18533
5753 1 8 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.179 -0.419 18533
5754 1 8 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.076 0.564 18533
5755 1 8 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.636 -0.496 18533
5756 1 8 . 1 1 105 105 ALA H H 104 8.500 8.500 8.694 -0.194 18533
5757 1 8 . 1 1 106 106 ALA N N 105 115.110 115.110 120.205 -5.095 18533
5758 1 8 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.194 -0.064 18533
5759 1 8 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.800 -0.760 18533
5760 1 8 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.576 0.484 18533
5761 1 8 . 1 1 106 106 ALA H H 105 8.270 8.270 8.382 -0.112 18533
5762 1 8 . 1 1 107 107 ARG N N 106 115.080 115.080 114.741 0.339 18533
5763 1 8 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.827 -0.367 18533
5764 1 8 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.871 -0.361 18533
5765 1 8 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.678 0.692 18533
5766 1 8 . 1 1 107 107 ARG H H 106 7.740 7.740 7.739 0.001 18533
5767 1 8 . 1 1 108 108 VAL N N 107 118.170 118.170 121.893 -3.723 18533
5768 1 8 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.078 0.992 18533
5769 1 8 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.471 -1.831 18533
5770 1 8 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.488 1.112 18533
5771 1 8 . 1 1 108 108 VAL H H 107 7.290 7.290 8.281 -0.991 18533
5772 1 8 . 1 1 109 109 ARG N N 108 124.250 124.250 128.471 -4.221 18533
5773 1 8 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.638 -0.018 18533
5774 1 8 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.827 -0.937 18533
5775 1 8 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.153 0.827 18533
5776 1 8 . 1 1 109 109 ARG H H 108 8.420 8.420 9.209 -0.789 18533
5777 1 8 . 1 1 110 110 MET N N 109 119.570 119.570 121.684 -2.114 18533
5778 1 8 . 1 1 110 110 MET HA H 109 4.960 4.960 4.920 0.040 18533
5779 1 8 . 1 1 110 110 MET CA C 109 53.820 53.820 54.223 -0.403 18533
5780 1 8 . 1 1 110 110 MET CB C 109 30.680 30.680 32.367 -1.687 18533
5781 1 8 . 1 1 110 110 MET H H 109 8.890 8.890 8.630 0.260 18533
5782 1 8 . 1 1 111 111 LEU N N 110 128.660 128.660 126.682 1.978 18533
5783 1 8 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.339 -0.379 18533
5784 1 8 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.142 0.459 18533
5785 1 8 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.670 -0.590 18533
5786 1 8 . 1 1 111 111 LEU H H 110 9.200 9.200 9.029 0.171 18533
5787 1 8 . 1 1 112 112 ARG N N 111 111.910 111.910 116.382 -4.472 18533
5788 1 8 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.083 -0.133 18533
5789 1 8 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.713 1.207 18533
5790 1 8 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.575 -1.075 18533
5791 1 8 . 1 1 112 112 ARG H H 111 8.930 8.930 8.641 0.289 18533
5792 1 8 . 1 1 113 113 SER N N 112 114.800 114.800 114.934 -0.134 18533
5793 1 8 . 1 1 113 113 SER HA H 112 4.290 4.290 4.320 -0.030 18533
5794 1 8 . 1 1 113 113 SER CA C 112 60.880 60.880 59.728 1.151 18533
5795 1 8 . 1 1 113 113 SER CB C 112 63.190 63.190 62.537 0.653 18533
5796 1 8 . 1 1 113 113 SER H H 112 7.680 7.680 7.702 -0.022 18533
5797 1 8 . 1 1 114 114 PHE N N 113 119.260 119.260 119.113 0.147 18533
5798 1 8 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.465 -0.115 18533
5799 1 8 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.999 0.930 18533
5800 1 8 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.419 0.301 18533
5801 1 8 . 1 1 114 114 PHE H H 113 7.600 7.600 7.615 -0.015 18533
5802 1 8 . 1 1 115 115 ASP N N 114 121.170 121.170 121.503 -0.333 18533
5803 1 8 . 1 1 115 115 ASP HA H 114 5.020 5.020 5.018 0.002 18533
5804 1 8 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.120 -1.020 18533
5805 1 8 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.784 0.726 18533
5806 1 8 . 1 1 115 115 ASP H H 114 7.430 7.430 7.590 -0.160 18533
5807 1 8 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.355 0.135 18533
5808 1 8 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.229 0.121 18533
5809 1 8 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.135 0.136 18533
5810 1 8 . 1 1 117 117 ARG N N 116 117.910 117.910 116.375 1.535 18533
5811 1 8 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.360 -0.090 18533
5812 1 8 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.375 0.075 18533
5813 1 8 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.553 -0.593 18533
5814 1 8 . 1 1 117 117 ARG H H 116 8.580 8.580 7.895 0.685 18533
5815 1 8 . 1 1 118 118 SER N N 117 116.130 116.130 116.941 -0.811 18533
5816 1 8 . 1 1 118 118 SER HA H 117 3.980 3.980 4.398 -0.418 18533
5817 1 8 . 1 1 118 118 SER CA C 117 59.790 59.790 59.254 0.536 18533
5818 1 8 . 1 1 118 118 SER CB C 117 63.760 63.760 61.222 2.538 18533
5819 1 8 . 1 1 118 118 SER H H 117 7.950 7.950 7.517 0.433 18533
5820 1 8 . 1 1 119 119 GLY N N 118 110.080 110.080 113.011 -2.931 18533
5821 1 8 . 1 1 119 119 GLY CA C 118 45.370 45.370 47.023 -1.653 18533
5822 1 8 . 1 1 119 119 GLY H H 118 8.150 8.150 8.554 -0.404 18533
5823 1 8 . 1 1 120 120 THR HA H 119 4.020 4.020 4.286 -0.266 18533
5824 1 8 . 1 1 120 120 THR CA C 119 63.290 63.290 61.870 1.420 18533
5825 1 8 . 1 1 120 120 THR CB C 119 69.140 69.140 70.535 -1.395 18533
5826 1 8 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.722 -0.152 18533
5827 1 8 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.486 0.524 18533
5828 1 8 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.629 -1.639 18533
5829 1 8 . 1 1 122 122 ALA N N 121 125.880 125.880 124.799 1.081 18533
5830 1 8 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.619 -0.279 18533
5831 1 8 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.837 -0.327 18533
5832 1 8 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.221 -1.621 18533
5833 1 8 . 1 1 122 122 ALA H H 121 7.980 7.980 8.460 -0.480 18533
5834 1 8 . 1 1 123 123 LEU N N 122 119.810 119.810 122.029 -2.219 18533
5835 1 8 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.363 -0.083 18533
5836 1 8 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.562 -0.072 18533
5837 1 8 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.017 2.683 18533
5838 1 8 . 1 1 123 123 LEU H H 122 7.810 7.810 8.414 -0.604 18533
5839 1 8 . 1 1 124 124 ASP N N 123 119.050 119.050 116.354 2.696 18533
5840 1 8 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.611 -0.041 18533
5841 1 8 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.756 1.564 18533
5842 1 8 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.239 -0.569 18533
5843 1 8 . 1 1 124 124 ASP H H 123 8.270 8.270 7.498 0.772 18533
5844 1 8 . 1 1 125 125 VAL N N 124 121.970 121.970 122.909 -0.939 18533
5845 1 8 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.353 -0.093 18533
5846 1 8 . 1 1 125 125 VAL CA C 124 62.310 62.310 61.308 1.002 18533
5847 1 8 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.694 -2.914 18533
5848 1 8 . 1 1 125 125 VAL H H 124 7.930 7.930 7.911 0.019 18533
5849 1 8 . 1 1 126 126 GLU N N 125 129.490 129.490 125.778 3.712 18533
5850 1 8 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.161 -0.081 18533
5851 1 8 . 1 1 126 126 GLU CA C 125 57.010 57.010 55.993 1.017 18533
5852 1 8 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.362 -0.562 18533
5853 1 8 . 1 1 126 126 GLU H H 125 9.100 9.100 8.442 0.658 18533
5854 1 8 . 1 1 127 127 ASP N N 126 122.300 122.300 118.388 3.912 18533
5855 1 8 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.939 -0.829 18533
5856 1 8 . 1 1 127 127 ASP CA C 126 51.720 51.720 50.961 0.759 18533
5857 1 8 . 1 1 127 127 ASP CB C 126 42.520 42.520 43.247 -0.727 18533
5858 1 8 . 1 1 127 127 ASP H H 126 8.630 8.630 8.435 0.195 18533
5859 1 8 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.404 0.146 18533
5860 1 8 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.063 -0.463 18533
5861 1 8 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.453 -1.473 18533
5862 1 8 . 1 1 129 129 TYR N N 128 122.380 122.380 120.777 1.603 18533
5863 1 8 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.312 -0.512 18533
5864 1 8 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.962 3.158 18533
5865 1 8 . 1 1 129 129 TYR CB C 128 39.390 39.390 38.519 0.871 18533
5866 1 8 . 1 1 129 129 TYR H H 128 8.670 8.670 8.224 0.446 18533
5867 1 8 . 1 1 130 130 TYR N N 129 116.300 116.300 117.490 -1.190 18533
5868 1 8 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.932 -0.442 18533
5869 1 8 . 1 1 130 130 TYR CA C 129 58.480 58.480 59.461 -0.981 18533
5870 1 8 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.442 -1.782 18533
5871 1 8 . 1 1 130 130 TYR H H 129 8.680 8.680 7.955 0.725 18533
5872 1 8 . 1 1 131 131 GLY N N 130 110.870 110.870 108.667 2.203 18533
5873 1 8 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.846 -0.766 18533
5874 1 8 . 1 1 131 131 GLY H H 130 8.060 8.060 8.381 -0.321 18533
5875 1 8 . 1 1 132 132 ASP N N 131 121.590 121.590 118.570 3.020 18533
5876 1 8 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.666 0.404 18533
5877 1 8 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.862 0.138 18533
5878 1 8 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.429 1.171 18533
5879 1 8 . 1 1 132 132 ASP H H 131 9.290 9.290 7.610 1.680 18533
5880 1 8 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.016 0.094 18533
5881 1 8 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.489 2.081 18533
5882 1 8 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.210 0.270 18533
5883 1 8 . 1 1 134 134 SER N N 133 115.370 115.370 113.948 1.422 18533
5884 1 8 . 1 1 134 134 SER HA H 133 4.180 4.180 3.959 0.221 18533
5885 1 8 . 1 1 134 134 SER CA C 133 62.070 62.070 61.483 0.587 18533
5886 1 8 . 1 1 134 134 SER CB C 133 62.160 62.160 63.066 -0.906 18533
5887 1 8 . 1 1 134 134 SER H H 133 8.420 8.420 7.939 0.481 18533
5888 1 8 . 1 1 135 135 ASP N N 134 123.360 123.360 121.828 1.532 18533
5889 1 8 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.448 0.082 18533
5890 1 8 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.714 1.326 18533
5891 1 8 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.209 0.601 18533
5892 1 8 . 1 1 135 135 ASP H H 134 7.980 7.980 7.668 0.312 18533
5893 1 8 . 1 1 136 136 PHE N N 135 118.940 118.940 119.433 -0.493 18533
5894 1 8 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.349 -0.549 18533
5895 1 8 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.812 3.008 18533
5896 1 8 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.250 1.100 18533
5897 1 8 . 1 1 136 136 PHE H H 135 7.850 7.850 7.189 0.661 18533
5898 1 8 . 1 1 137 137 GLU N N 136 121.410 121.410 117.945 3.465 18533
5899 1 8 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.101 0.079 18533
5900 1 8 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.941 0.559 18533
5901 1 8 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.080 -0.090 18533
5902 1 8 . 1 1 137 137 GLU H H 136 8.150 8.150 7.853 0.297 18533
5903 1 8 . 1 1 138 138 GLU N N 137 121.530 121.530 121.466 0.064 18533
5904 1 8 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.056 0.234 18533
5905 1 8 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.445 -0.045 18533
5906 1 8 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.136 -0.246 18533
5907 1 8 . 1 1 138 138 GLU H H 137 7.870 7.870 7.991 -0.121 18533
5908 1 8 . 1 1 139 139 VAL N N 138 119.930 119.930 119.675 0.255 18533
5909 1 8 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.714 -0.234 18533
5910 1 8 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.305 0.775 18533
5911 1 8 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.065 0.285 18533
5912 1 8 . 1 1 139 139 VAL H H 138 7.770 7.770 7.660 0.110 18533
5913 1 8 . 1 1 140 140 PHE N N 139 119.130 119.130 121.257 -2.127 18533
5914 1 8 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.948 -0.388 18533
5915 1 8 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.921 0.759 18533
5916 1 8 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.556 0.614 18533
5917 1 8 . 1 1 140 140 PHE H H 139 8.050 8.050 8.036 0.014 18533
5918 1 8 . 1 1 141 141 ALA N N 140 121.040 121.040 122.073 -1.033 18533
5919 1 8 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.271 -0.281 18533
5920 1 8 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.678 0.442 18533
5921 1 8 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.345 -0.045 18533
5922 1 8 . 1 1 141 141 ALA H H 140 8.010 8.010 7.984 0.026 18533
5923 1 8 . 1 1 142 142 VAL N N 141 118.550 118.550 118.727 -0.177 18533
5924 1 8 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.447 0.363 18533
5925 1 8 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.684 -1.084 18533
5926 1 8 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.664 -0.214 18533
5927 1 8 . 1 1 142 142 VAL H H 141 8.300 8.300 7.728 0.572 18533
5928 1 8 . 1 1 143 143 ILE N N 142 121.410 121.410 119.380 2.030 18533
5929 1 8 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.462 -0.072 18533
5930 1 8 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.348 0.702 18533
5931 1 8 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.772 -0.462 18533
5932 1 8 . 1 1 143 143 ILE H H 142 8.150 8.150 8.222 -0.072 18533
5933 1 8 . 1 1 144 144 GLU N N 143 119.630 119.630 118.723 0.907 18533
5934 1 8 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.778 -0.238 18533
5935 1 8 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.032 0.728 18533
5936 1 8 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.642 1.088 18533
5937 1 8 . 1 1 144 144 GLU H H 143 8.640 8.640 8.211 0.429 18533
5938 1 8 . 1 1 145 145 SER N N 144 110.920 110.920 114.342 -3.422 18533
5939 1 8 . 1 1 145 145 SER HA H 144 4.230 4.230 4.300 -0.070 18533
5940 1 8 . 1 1 145 145 SER CA C 144 60.810 60.810 60.396 0.414 18533
5941 1 8 . 1 1 145 145 SER CB C 144 63.610 63.610 63.514 0.096 18533
5942 1 8 . 1 1 145 145 SER H H 144 7.640 7.640 7.798 -0.159 18533
5943 1 8 . 1 1 146 146 ALA N N 145 123.110 123.110 124.516 -1.406 18533
5944 1 8 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.360 -0.240 18533
5945 1 8 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.160 -0.760 18533
5946 1 8 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.409 2.471 18533
5947 1 8 . 1 1 146 146 ALA H H 145 7.500 7.500 7.658 -0.158 18533
5948 1 8 . 1 1 147 147 LEU N N 146 114.220 114.220 119.703 -5.483 18533
5949 1 8 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.897 0.043 18533
5950 1 8 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.480 -0.430 18533
5951 1 8 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.449 0.011 18533
5952 1 8 . 1 1 147 147 LEU H H 146 7.410 7.410 8.231 -0.821 18533
5953 1 8 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.366 0.084 18533
5954 1 8 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.425 3.415 18533
5955 1 8 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.054 0.166 18533
5956 1 8 . 1 1 149 149 GLY N N 148 102.590 102.590 106.279 -3.689 18533
5957 1 8 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.486 1.774 18533
5958 1 8 . 1 1 149 149 GLY H H 148 7.960 7.960 7.958 0.002 18533
5959 1 8 . 1 1 150 150 LEU N N 149 128.060 128.060 123.442 4.618 18533
5960 1 8 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.206 0.424 18533
5961 1 8 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.178 0.172 18533
5962 1 8 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.310 -0.110 18533
5963 1 8 . 1 1 150 150 LEU H H 149 7.620 7.620 8.500 -0.880 18533
5964 1 8 . 1 1 151 151 HIS N N 150 120.730 120.730 118.847 1.883 18533
5965 1 8 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.081 0.089 18533
5966 1 8 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.201 1.179 18533
5967 1 8 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.623 0.886 18533
5968 1 8 . 1 1 151 151 HIS H H 150 8.430 8.430 8.292 0.138 18533
5969 1 8 . 1 1 152 152 ASP N N 151 118.170 118.170 119.638 -1.468 18533
5970 1 8 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.389 0.031 18533
5971 1 8 . 1 1 152 152 ASP CA C 151 57.810 57.810 58.022 -0.212 18533
5972 1 8 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.563 -0.533 18533
5973 1 8 . 1 1 152 152 ASP H H 151 7.820 7.820 8.209 -0.389 18533
5974 1 8 . 1 1 153 153 TRP N N 152 122.780 122.780 122.275 0.505 18533
5975 1 8 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.560 -0.450 18533
5976 1 8 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.239 1.371 18533
5977 1 8 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.011 -0.221 18533
5978 1 8 . 1 1 153 153 TRP H H 152 7.900 7.900 7.894 0.006 18533
5979 1 8 . 1 1 154 154 VAL N N 153 119.460 119.460 116.829 2.631 18533
5980 1 8 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.790 -0.440 18533
5981 1 8 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.367 0.613 18533
5982 1 8 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.536 0.364 18533
5983 1 8 . 1 1 154 154 VAL H H 153 8.560 8.560 8.595 -0.035 18533
5984 1 8 . 1 1 155 155 ASP N N 154 120.500 120.500 121.636 -1.136 18533
5985 1 8 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.278 -0.078 18533
5986 1 8 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.993 -1.423 18533
5987 1 8 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.671 -0.811 18533
5988 1 8 . 1 1 155 155 ASP H H 154 8.530 8.530 8.772 -0.242 18533
5989 1 8 . 1 1 156 156 GLU N N 155 120.090 120.090 119.672 0.418 18533
5990 1 8 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.922 0.008 18533
5991 1 8 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.243 -0.083 18533
5992 1 8 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.380 -0.090 18533
5993 1 8 . 1 1 156 156 GLU H H 155 7.870 7.870 8.428 -0.558 18533
5994 1 8 . 1 1 157 157 ARG N N 156 119.230 119.230 119.134 0.096 18533
5995 1 8 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.987 -0.177 18533
5996 1 8 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.247 -0.257 18533
5997 1 8 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.303 -0.193 18533
5998 1 8 . 1 1 157 157 ARG H H 156 7.660 7.660 8.014 -0.354 18533
5999 1 8 . 1 1 158 158 LEU N N 157 118.790 118.790 116.574 2.216 18533
6000 1 8 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.144 -0.044 18533
6001 1 8 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.237 -0.557 18533
6002 1 8 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.967 0.723 18533
6003 1 8 . 1 1 158 158 LEU H H 157 8.470 8.470 8.217 0.253 18533
6004 1 8 . 1 1 159 159 ALA N N 158 120.760 120.760 120.891 -0.131 18533
6005 1 8 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.197 -0.007 18533
6006 1 8 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.185 -0.905 18533
6007 1 8 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.141 -0.751 18533
6008 1 8 . 1 1 159 159 ALA H H 158 7.490 7.490 7.694 -0.204 18533
6009 1 8 . 1 1 160 160 ARG N N 159 117.810 117.810 116.761 1.049 18533
6010 1 8 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.118 0.092 18533
6011 1 8 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.843 -1.063 18533
6012 1 8 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.791 0.739 18533
6013 1 8 . 1 1 160 160 ARG H H 159 7.650 7.650 8.033 -0.383 18533
6014 1 8 . 1 1 161 161 ASN N N 160 118.560 118.560 119.204 -0.644 18533
6015 1 8 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.693 0.047 18533
6016 1 8 . 1 1 161 161 ASN CA C 160 53.250 53.250 53.345 -0.095 18533
6017 1 8 . 1 1 161 161 ASN CB C 160 39.170 39.170 39.103 0.067 18533
6018 1 8 . 1 1 161 161 ASN H H 160 8.100 8.100 7.669 0.431 18533
6019 1 8 . 1 1 162 162 GLY N N 161 108.900 108.900 109.344 -0.444 18533
6020 1 8 . 1 1 162 162 GLY CA C 161 44.730 44.730 43.755 0.975 18533
6021 1 8 . 1 1 162 162 GLY H H 161 7.980 7.980 7.537 0.443 18533
6022 1 8 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.574 -0.114 18533
6023 1 8 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.389 0.061 18533
6024 1 8 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.052 0.148 18533
6025 1 9 . 1 1 2 2 MET N N 1 119.850 119.850 120.783 -0.933 18533
6026 1 9 . 1 1 2 2 MET HA H 1 4.500 4.500 4.500 -0.000 18533
6027 1 9 . 1 1 2 2 MET CA C 1 55.450 55.450 55.279 0.172 18533
6028 1 9 . 1 1 2 2 MET CB C 1 33.170 33.170 33.020 0.150 18533
6029 1 9 . 1 1 2 2 MET H H 1 8.140 8.140 8.285 -0.145 18533
6030 1 9 . 1 1 3 3 SER N N 2 117.000 117.000 114.006 2.994 18533
6031 1 9 . 1 1 3 3 SER HA H 2 4.430 4.430 4.735 -0.305 18533
6032 1 9 . 1 1 3 3 SER CA C 2 58.320 58.320 57.457 0.863 18533
6033 1 9 . 1 1 3 3 SER CB C 2 63.990 63.990 65.019 -1.029 18533
6034 1 9 . 1 1 3 3 SER H H 2 8.340 8.340 7.630 0.710 18533
6035 1 9 . 1 1 4 4 ASP N N 3 123.200 123.200 121.869 1.331 18533
6036 1 9 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.940 -0.080 18533
6037 1 9 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.579 0.301 18533
6038 1 9 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.685 0.115 18533
6039 1 9 . 1 1 4 4 ASP H H 3 8.260 8.260 8.358 -0.098 18533
6040 1 9 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.497 -0.097 18533
6041 1 9 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.425 0.395 18533
6042 1 9 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.677 -0.767 18533
6043 1 9 . 1 1 6 6 LEU N N 5 123.160 123.160 119.790 3.370 18533
6044 1 9 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.368 0.022 18533
6045 1 9 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.962 0.318 18533
6046 1 9 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.961 1.389 18533
6047 1 9 . 1 1 6 6 LEU H H 5 7.670 7.670 7.982 -0.312 18533
6048 1 9 . 1 1 7 7 HIS N N 6 127.160 127.160 118.342 8.818 18533
6049 1 9 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.963 1.067 18533
6050 1 9 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.322 -2.422 18533
6051 1 9 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.197 0.933 18533
6052 1 9 . 1 1 7 7 HIS H H 6 10.080 10.080 8.732 1.348 18533
6053 1 9 . 1 1 8 8 VAL N N 7 128.620 128.620 127.739 0.881 18533
6054 1 9 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.840 -0.340 18533
6055 1 9 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.174 -0.374 18533
6056 1 9 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.352 2.448 18533
6057 1 9 . 1 1 8 8 VAL H H 7 8.930 8.930 9.071 -0.141 18533
6058 1 9 . 1 1 9 9 THR N N 8 121.530 121.530 123.061 -1.531 18533
6059 1 9 . 1 1 9 9 THR HA H 8 5.270 5.270 4.613 0.657 18533
6060 1 9 . 1 1 9 9 THR CA C 8 58.520 58.520 59.269 -0.749 18533
6061 1 9 . 1 1 9 9 THR CB C 8 70.750 70.750 69.665 1.085 18533
6062 1 9 . 1 1 9 9 THR H H 8 7.970 7.970 8.946 -0.976 18533
6063 1 9 . 1 1 10 10 PHE N N 9 125.360 125.360 128.697 -3.337 18533
6064 1 9 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.239 -0.029 18533
6065 1 9 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.511 0.799 18533
6066 1 9 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.608 3.222 18533
6067 1 9 . 1 1 10 10 PHE H H 9 8.180 8.180 8.173 0.007 18533
6068 1 9 . 1 1 11 11 VAL N N 10 121.120 121.120 122.002 -0.882 18533
6069 1 9 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.363 -0.003 18533
6070 1 9 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.057 -0.637 18533
6071 1 9 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.498 2.052 18533
6072 1 9 . 1 1 11 11 VAL H H 10 8.710 8.710 9.158 -0.448 18533
6073 1 9 . 1 1 12 12 CYS N N 11 123.270 123.270 123.074 0.196 18533
6074 1 9 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.465 -1.205 18533
6075 1 9 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.286 1.344 18533
6076 1 9 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.634 -1.284 18533
6077 1 9 . 1 1 12 12 CYS H H 11 7.940 7.940 8.576 -0.636 18533
6078 1 9 . 1 1 13 13 THR HA H 12 5.010 5.010 4.179 0.831 18533
6079 1 9 . 1 1 13 13 THR CA C 12 64.870 64.870 62.908 1.962 18533
6080 1 9 . 1 1 13 13 THR CB C 12 69.180 69.180 66.887 2.293 18533
6081 1 9 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.041 -0.081 18533
6082 1 9 . 1 1 15 15 ASN N N 14 119.960 119.960 117.902 2.058 18533
6083 1 9 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.323 -0.393 18533
6084 1 9 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.498 0.372 18533
6085 1 9 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.235 2.435 18533
6086 1 9 . 1 1 15 15 ASN H H 14 9.280 9.280 8.115 1.165 18533
6087 1 9 . 1 1 16 16 ILE N N 15 101.060 101.060 111.509 -10.449 18533
6088 1 9 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.668 0.012 18533
6089 1 9 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.149 2.641 18533
6090 1 9 . 1 1 16 16 ILE CB C 15 42.140 42.140 37.764 4.376 18533
6091 1 9 . 1 1 16 16 ILE H H 15 7.100 7.100 8.035 -0.935 18533
6092 1 9 . 1 1 17 17 CYS N N 16 116.020 116.020 116.541 -0.521 18533
6093 1 9 . 1 1 17 17 CYS HA H 16 4.940 4.940 5.241 -0.301 18533
6094 1 9 . 1 1 17 17 CYS CA C 16 60.060 60.060 57.793 2.267 18533
6095 1 9 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.252 0.698 18533
6096 1 9 . 1 1 17 17 CYS H H 16 7.700 7.700 7.975 -0.275 18533
6097 1 9 . 1 1 19 19 SER N N 18 122.340 122.340 115.660 6.680 18533
6098 1 9 . 1 1 19 19 SER HA H 18 3.810 3.810 4.249 -0.439 18533
6099 1 9 . 1 1 19 19 SER CA C 18 62.710 62.710 63.728 -1.018 18533
6100 1 9 . 1 1 19 19 SER CB C 18 64.860 64.860 61.269 3.591 18533
6101 1 9 . 1 1 19 19 SER H H 18 11.420 11.420 7.746 3.674 18533
6102 1 9 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.404 -0.434 18533
6103 1 9 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.878 0.152 18533
6104 1 9 . 1 1 20 20 PRO CB C 19 28.690 28.690 31.063 -2.373 18533
6105 1 9 . 1 1 21 21 MET N N 20 112.430 112.430 118.503 -6.073 18533
6106 1 9 . 1 1 21 21 MET HA H 20 3.730 3.730 3.921 -0.191 18533
6107 1 9 . 1 1 21 21 MET CA C 20 60.160 60.160 59.770 0.390 18533
6108 1 9 . 1 1 21 21 MET CB C 20 33.040 33.040 32.207 0.833 18533
6109 1 9 . 1 1 21 21 MET H H 20 6.310 6.310 7.477 -1.167 18533
6110 1 9 . 1 1 22 22 ALA N N 21 117.800 117.800 119.908 -2.108 18533
6111 1 9 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.797 -0.397 18533
6112 1 9 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.552 0.438 18533
6113 1 9 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.651 -1.161 18533
6114 1 9 . 1 1 22 22 ALA H H 21 6.550 6.550 7.645 -1.095 18533
6115 1 9 . 1 1 23 23 GLU N N 22 115.520 115.520 118.705 -3.185 18533
6116 1 9 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.139 -0.459 18533
6117 1 9 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.759 -0.209 18533
6118 1 9 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.803 -0.013 18533
6119 1 9 . 1 1 23 23 GLU H H 22 7.800 7.800 7.794 0.006 18533
6120 1 9 . 1 1 24 24 LYS N N 23 114.220 114.220 116.608 -2.388 18533
6121 1 9 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.136 -0.136 18533
6122 1 9 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.047 -0.287 18533
6123 1 9 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.310 -1.510 18533
6124 1 9 . 1 1 24 24 LYS H H 23 8.040 8.040 7.508 0.532 18533
6125 1 9 . 1 1 25 25 MET N N 24 115.250 115.250 118.932 -3.682 18533
6126 1 9 . 1 1 25 25 MET HA H 24 3.950 3.950 3.587 0.363 18533
6127 1 9 . 1 1 25 25 MET CA C 24 57.980 57.980 58.901 -0.921 18533
6128 1 9 . 1 1 25 25 MET CB C 24 35.500 35.500 32.226 3.274 18533
6129 1 9 . 1 1 25 25 MET H H 24 7.610 7.610 7.566 0.044 18533
6130 1 9 . 1 1 26 26 PHE N N 25 119.090 119.090 116.396 2.694 18533
6131 1 9 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.614 -0.274 18533
6132 1 9 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.074 -0.044 18533
6133 1 9 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.646 1.814 18533
6134 1 9 . 1 1 26 26 PHE H H 25 8.560 8.560 7.929 0.631 18533
6135 1 9 . 1 1 27 27 ALA N N 26 117.830 117.830 122.637 -4.807 18533
6136 1 9 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.578 0.352 18533
6137 1 9 . 1 1 27 27 ALA CA C 26 56.060 56.060 54.987 1.073 18533
6138 1 9 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.860 0.550 18533
6139 1 9 . 1 1 27 27 ALA H H 26 8.800 8.800 7.201 1.599 18533
6140 1 9 . 1 1 28 28 GLN N N 27 117.550 117.550 118.397 -0.847 18533
6141 1 9 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.993 0.057 18533
6142 1 9 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.931 0.679 18533
6143 1 9 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.846 0.604 18533
6144 1 9 . 1 1 28 28 GLN H H 27 7.690 7.690 7.810 -0.120 18533
6145 1 9 . 1 1 29 29 GLN N N 28 117.530 117.530 119.704 -2.174 18533
6146 1 9 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.086 0.054 18533
6147 1 9 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.852 0.328 18533
6148 1 9 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.943 -0.833 18533
6149 1 9 . 1 1 29 29 GLN H H 28 8.210 8.210 7.554 0.656 18533
6150 1 9 . 1 1 30 30 LEU N N 29 119.330 119.330 119.529 -0.199 18533
6151 1 9 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.928 0.002 18533
6152 1 9 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.865 0.215 18533
6153 1 9 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.416 0.484 18533
6154 1 9 . 1 1 30 30 LEU H H 29 8.540 8.540 8.304 0.236 18533
6155 1 9 . 1 1 31 31 ARG N N 30 120.880 120.880 118.224 2.656 18533
6156 1 9 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.055 -0.085 18533
6157 1 9 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.166 0.624 18533
6158 1 9 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.339 0.181 18533
6159 1 9 . 1 1 31 31 ARG H H 30 8.050 8.050 7.976 0.074 18533
6160 1 9 . 1 1 32 32 HIS N N 31 119.770 119.770 118.117 1.653 18533
6161 1 9 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.449 0.101 18533
6162 1 9 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.407 -0.327 18533
6163 1 9 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.252 0.458 18533
6164 1 9 . 1 1 32 32 HIS H H 31 8.440 8.440 8.522 -0.082 18533
6165 1 9 . 1 1 33 33 ARG N N 32 115.430 115.430 117.717 -2.287 18533
6166 1 9 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.466 0.124 18533
6167 1 9 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.200 -0.230 18533
6168 1 9 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.610 -0.390 18533
6169 1 9 . 1 1 33 33 ARG H H 32 7.500 7.500 7.791 -0.291 18533
6170 1 9 . 1 1 34 34 GLY N N 33 106.730 106.730 108.675 -1.945 18533
6171 1 9 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.044 1.156 18533
6172 1 9 . 1 1 34 34 GLY H H 33 7.750 7.750 8.171 -0.421 18533
6173 1 9 . 1 1 35 35 LEU N N 34 119.980 119.980 117.475 2.505 18533
6174 1 9 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.829 -0.149 18533
6175 1 9 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.739 0.411 18533
6176 1 9 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.547 0.643 18533
6177 1 9 . 1 1 35 35 LEU H H 34 7.980 7.980 8.511 -0.531 18533
6178 1 9 . 1 1 36 36 GLY N N 35 108.660 108.660 109.276 -0.616 18533
6179 1 9 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.655 -0.555 18533
6180 1 9 . 1 1 36 36 GLY H H 35 8.830 8.830 8.006 0.824 18533
6181 1 9 . 1 1 37 37 ASP N N 36 115.360 115.360 120.405 -5.045 18533
6182 1 9 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.601 0.169 18533
6183 1 9 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.891 -1.501 18533
6184 1 9 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.936 0.234 18533
6185 1 9 . 1 1 37 37 ASP H H 36 8.300 8.300 8.141 0.159 18533
6186 1 9 . 1 1 38 38 ALA N N 37 121.460 121.460 122.205 -0.745 18533
6187 1 9 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.413 -0.103 18533
6188 1 9 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.589 -0.639 18533
6189 1 9 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.003 0.847 18533
6190 1 9 . 1 1 38 38 ALA H H 37 7.380 7.380 7.703 -0.323 18533
6191 1 9 . 1 1 39 39 VAL N N 38 115.660 115.660 116.465 -0.805 18533
6192 1 9 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.551 0.249 18533
6193 1 9 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.546 -0.506 18533
6194 1 9 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.798 0.392 18533
6195 1 9 . 1 1 39 39 VAL H H 38 7.100 7.100 8.160 -1.060 18533
6196 1 9 . 1 1 40 40 ARG N N 39 129.230 129.230 128.361 0.869 18533
6197 1 9 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.604 -0.064 18533
6198 1 9 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.174 1.536 18533
6199 1 9 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.372 0.948 18533
6200 1 9 . 1 1 40 40 ARG H H 39 9.730 9.730 8.348 1.382 18533
6201 1 9 . 1 1 41 41 VAL N N 40 126.240 126.240 121.096 5.144 18533
6202 1 9 . 1 1 41 41 VAL HA H 40 5.690 5.690 5.095 0.595 18533
6203 1 9 . 1 1 41 41 VAL CA C 40 60.560 60.560 59.679 0.881 18533
6204 1 9 . 1 1 41 41 VAL CB C 40 33.940 33.940 35.134 -1.194 18533
6205 1 9 . 1 1 41 41 VAL H H 40 8.610 8.610 8.341 0.269 18533
6206 1 9 . 1 1 42 42 THR N N 41 117.310 117.310 117.263 0.047 18533
6207 1 9 . 1 1 42 42 THR HA H 41 4.890 4.890 4.913 -0.023 18533
6208 1 9 . 1 1 42 42 THR CA C 41 60.300 60.300 60.461 -0.161 18533
6209 1 9 . 1 1 42 42 THR CB C 41 73.890 73.890 71.558 2.333 18533
6210 1 9 . 1 1 42 42 THR H H 41 8.870 8.870 8.836 0.034 18533
6211 1 9 . 1 1 43 43 SER N N 42 109.960 109.960 113.183 -3.223 18533
6212 1 9 . 1 1 43 43 SER HA H 42 5.720 5.720 5.151 0.569 18533
6213 1 9 . 1 1 43 43 SER CA C 42 58.090 58.090 57.748 0.342 18533
6214 1 9 . 1 1 43 43 SER CB C 42 65.870 65.870 66.346 -0.476 18533
6215 1 9 . 1 1 43 43 SER H H 42 8.060 8.060 8.711 -0.651 18533
6216 1 9 . 1 1 44 44 ALA N N 43 119.200 119.200 120.033 -0.833 18533
6217 1 9 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.158 -0.898 18533
6218 1 9 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.806 -0.626 18533
6219 1 9 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.058 -1.228 18533
6220 1 9 . 1 1 44 44 ALA H H 43 8.710 8.710 9.024 -0.314 18533
6221 1 9 . 1 1 45 45 GLY N N 44 104.090 104.090 106.538 -2.448 18533
6222 1 9 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.175 -1.635 18533
6223 1 9 . 1 1 45 45 GLY H H 44 8.670 8.670 8.125 0.545 18533
6224 1 9 . 1 1 46 46 THR N N 45 114.060 114.060 117.990 -3.930 18533
6225 1 9 . 1 1 46 46 THR HA H 45 4.080 4.080 4.073 0.007 18533
6226 1 9 . 1 1 46 46 THR CA C 45 64.680 64.680 64.867 -0.187 18533
6227 1 9 . 1 1 46 46 THR CB C 45 67.880 67.880 68.860 -0.980 18533
6228 1 9 . 1 1 46 46 THR H H 45 9.120 9.120 8.050 1.070 18533
6229 1 9 . 1 1 47 47 GLY N N 46 110.380 110.380 108.080 2.300 18533
6230 1 9 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.906 -0.076 18533
6231 1 9 . 1 1 47 47 GLY H H 46 8.930 8.930 8.351 0.579 18533
6232 1 9 . 1 1 48 48 ASN N N 47 113.440 113.440 117.583 -4.143 18533
6233 1 9 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.344 0.146 18533
6234 1 9 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.272 -2.512 18533
6235 1 9 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.753 2.097 18533
6236 1 9 . 1 1 48 48 ASN H H 47 7.600 7.600 7.749 -0.149 18533
6237 1 9 . 1 1 49 49 TRP N N 48 117.300 117.300 121.555 -4.255 18533
6238 1 9 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.381 -0.481 18533
6239 1 9 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.322 0.538 18533
6240 1 9 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.021 -0.501 18533
6241 1 9 . 1 1 49 49 TRP H H 48 6.920 6.920 8.543 -1.623 18533
6242 1 9 . 1 1 50 50 HIS N N 49 111.590 111.590 114.957 -3.367 18533
6243 1 9 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.788 0.092 18533
6244 1 9 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.587 -1.727 18533
6245 1 9 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.743 1.297 18533
6246 1 9 . 1 1 50 50 HIS H H 49 8.620 8.620 8.442 0.178 18533
6247 1 9 . 1 1 51 51 VAL N N 50 119.010 119.010 120.586 -1.576 18533
6248 1 9 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.654 -0.454 18533
6249 1 9 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.643 1.037 18533
6250 1 9 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.396 -0.006 18533
6251 1 9 . 1 1 51 51 VAL H H 50 6.880 6.880 7.407 -0.526 18533
6252 1 9 . 1 1 52 52 GLY N N 51 115.450 115.450 116.793 -1.343 18533
6253 1 9 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.357 -0.417 18533
6254 1 9 . 1 1 52 52 GLY H H 51 9.120 9.120 9.023 0.097 18533
6255 1 9 . 1 1 53 53 SER N N 52 116.620 116.620 114.922 1.698 18533
6256 1 9 . 1 1 53 53 SER HA H 52 4.610 4.610 4.651 -0.041 18533
6257 1 9 . 1 1 53 53 SER CA C 52 59.310 59.310 57.845 1.465 18533
6258 1 9 . 1 1 53 53 SER CB C 52 64.630 64.630 64.778 -0.148 18533
6259 1 9 . 1 1 53 53 SER H H 52 8.430 8.430 8.163 0.267 18533
6260 1 9 . 1 1 54 54 CYS N N 53 118.690 118.690 118.600 0.090 18533
6261 1 9 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.312 -0.212 18533
6262 1 9 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.040 1.630 18533
6263 1 9 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.206 -2.856 18533
6264 1 9 . 1 1 54 54 CYS H H 53 8.170 8.170 8.403 -0.233 18533
6265 1 9 . 1 1 55 55 ALA N N 54 118.580 118.580 124.005 -5.425 18533
6266 1 9 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.315 -0.195 18533
6267 1 9 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.533 0.107 18533
6268 1 9 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.634 -3.005 18533
6269 1 9 . 1 1 55 55 ALA H H 54 8.420 8.420 8.528 -0.108 18533
6270 1 9 . 1 1 56 56 ASP N N 55 121.500 121.500 121.028 0.472 18533
6271 1 9 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.423 -0.083 18533
6272 1 9 . 1 1 56 56 ASP CA C 55 55.050 55.050 53.894 1.156 18533
6273 1 9 . 1 1 56 56 ASP CB C 55 46.060 46.060 41.357 4.703 18533
6274 1 9 . 1 1 56 56 ASP H H 55 8.470 8.470 8.196 0.274 18533
6275 1 9 . 1 1 57 57 GLU N N 56 127.840 127.840 123.402 4.438 18533
6276 1 9 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.809 0.231 18533
6277 1 9 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.651 -0.011 18533
6278 1 9 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.111 0.389 18533
6279 1 9 . 1 1 57 57 GLU H H 56 9.230 9.230 8.845 0.385 18533
6280 1 9 . 1 1 58 58 ARG N N 57 120.820 120.820 118.539 2.281 18533
6281 1 9 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.819 -0.009 18533
6282 1 9 . 1 1 58 58 ARG CA C 57 58.150 58.150 57.885 0.265 18533
6283 1 9 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.649 -1.379 18533
6284 1 9 . 1 1 58 58 ARG H H 57 9.220 9.220 7.916 1.304 18533
6285 1 9 . 1 1 59 59 ALA N N 58 121.590 121.590 122.806 -1.216 18533
6286 1 9 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.151 0.009 18533
6287 1 9 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.591 0.189 18533
6288 1 9 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.420 0.070 18533
6289 1 9 . 1 1 59 59 ALA H H 58 6.680 6.680 8.376 -1.696 18533
6290 1 9 . 1 1 60 60 ALA N N 59 118.970 118.970 121.765 -2.795 18533
6291 1 9 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.961 -0.101 18533
6292 1 9 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.203 -0.183 18533
6293 1 9 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.409 -0.339 18533
6294 1 9 . 1 1 60 60 ALA H H 59 8.540 8.540 8.596 -0.056 18533
6295 1 9 . 1 1 61 61 GLY N N 60 104.160 104.160 106.728 -2.568 18533
6296 1 9 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.166 0.104 18533
6297 1 9 . 1 1 61 61 GLY H H 60 8.210 8.210 8.462 -0.252 18533
6298 1 9 . 1 1 62 62 VAL N N 61 122.820 122.820 119.957 2.863 18533
6299 1 9 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.730 0.120 18533
6300 1 9 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.369 0.881 18533
6301 1 9 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.630 0.260 18533
6302 1 9 . 1 1 62 62 VAL H H 61 7.310 7.310 7.895 -0.585 18533
6303 1 9 . 1 1 63 63 LEU N N 62 120.310 120.310 121.682 -1.372 18533
6304 1 9 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.382 -0.402 18533
6305 1 9 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.639 0.311 18533
6306 1 9 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.245 0.255 18533
6307 1 9 . 1 1 63 63 LEU H H 62 8.090 8.090 8.566 -0.476 18533
6308 1 9 . 1 1 64 64 ARG N N 63 119.440 119.440 119.822 -0.382 18533
6309 1 9 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.353 -0.173 18533
6310 1 9 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.951 0.499 18533
6311 1 9 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.649 0.731 18533
6312 1 9 . 1 1 64 64 ARG H H 63 8.740 8.740 8.420 0.320 18533
6313 1 9 . 1 1 65 65 ALA N N 64 122.560 122.560 121.736 0.824 18533
6314 1 9 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.115 -0.085 18533
6315 1 9 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.075 0.465 18533
6316 1 9 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.302 -0.222 18533
6317 1 9 . 1 1 65 65 ALA H H 64 7.910 7.910 7.799 0.111 18533
6318 1 9 . 1 1 66 66 HIS N N 65 112.690 112.690 115.015 -2.325 18533
6319 1 9 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.661 -0.021 18533
6320 1 9 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.154 -0.654 18533
6321 1 9 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.231 0.089 18533
6322 1 9 . 1 1 66 66 HIS H H 65 7.410 7.410 7.769 -0.359 18533
6323 1 9 . 1 1 67 67 GLY N N 66 107.440 107.440 105.978 1.462 18533
6324 1 9 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.169 1.191 18533
6325 1 9 . 1 1 67 67 GLY H H 66 7.850 7.850 7.763 0.087 18533
6326 1 9 . 1 1 68 68 TYR N N 67 119.940 119.940 121.610 -1.670 18533
6327 1 9 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.830 -0.030 18533
6328 1 9 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.239 0.861 18533
6329 1 9 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.886 0.974 18533
6330 1 9 . 1 1 68 68 TYR H H 67 8.380 8.380 8.344 0.036 18533
6331 1 9 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.547 0.013 18533
6332 1 9 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.835 -0.235 18533
6333 1 9 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.553 0.257 18533
6334 1 9 . 1 1 70 70 THR N N 69 100.660 100.660 106.280 -5.620 18533
6335 1 9 . 1 1 70 70 THR HA H 69 4.300 4.300 4.423 -0.123 18533
6336 1 9 . 1 1 70 70 THR CA C 69 61.250 61.250 61.376 -0.126 18533
6337 1 9 . 1 1 70 70 THR CB C 69 70.740 70.740 69.556 1.184 18533
6338 1 9 . 1 1 70 70 THR H H 69 7.860 7.860 7.973 -0.113 18533
6339 1 9 . 1 1 71 71 ASP N N 70 122.880 122.880 122.611 0.269 18533
6340 1 9 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.539 -0.129 18533
6341 1 9 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.134 0.736 18533
6342 1 9 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.344 -0.374 18533
6343 1 9 . 1 1 71 71 ASP H H 70 7.940 7.940 8.088 -0.148 18533
6344 1 9 . 1 1 72 72 HIS N N 71 121.720 121.720 123.876 -2.156 18533
6345 1 9 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.804 -0.104 18533
6346 1 9 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.331 1.059 18533
6347 1 9 . 1 1 72 72 HIS CB C 71 35.340 35.340 33.209 2.131 18533
6348 1 9 . 1 1 72 72 HIS H H 71 8.000 8.000 8.303 -0.303 18533
6349 1 9 . 1 1 73 73 ARG N N 72 125.760 125.760 126.680 -0.920 18533
6350 1 9 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.007 -0.717 18533
6351 1 9 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.241 0.189 18533
6352 1 9 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.242 0.069 18533
6353 1 9 . 1 1 73 73 ARG H H 72 7.230 7.230 8.164 -0.934 18533
6354 1 9 . 1 1 74 74 ALA N N 73 127.970 127.970 129.368 -1.398 18533
6355 1 9 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.634 -0.004 18533
6356 1 9 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.383 -0.203 18533
6357 1 9 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.046 -1.146 18533
6358 1 9 . 1 1 74 74 ALA H H 73 9.090 9.090 8.394 0.696 18533
6359 1 9 . 1 1 75 75 ALA N N 74 126.090 126.090 126.136 -0.046 18533
6360 1 9 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.817 -0.027 18533
6361 1 9 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.517 0.453 18533
6362 1 9 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.153 1.467 18533
6363 1 9 . 1 1 75 75 ALA H H 74 9.410 9.410 9.710 -0.300 18533
6364 1 9 . 1 1 76 76 GLN N N 75 123.260 123.260 119.724 3.536 18533
6365 1 9 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.643 0.307 18533
6366 1 9 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.820 -0.270 18533
6367 1 9 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.283 -1.233 18533
6368 1 9 . 1 1 76 76 GLN H H 75 8.800 8.800 8.354 0.446 18533
6369 1 9 . 1 1 77 77 VAL N N 76 125.510 125.510 123.488 2.022 18533
6370 1 9 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.490 -0.190 18533
6371 1 9 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.161 0.419 18533
6372 1 9 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.459 3.031 18533
6373 1 9 . 1 1 77 77 VAL H H 76 8.550 8.550 7.973 0.577 18533
6374 1 9 . 1 1 78 78 GLY N N 77 121.850 121.850 116.948 4.902 18533
6375 1 9 . 1 1 78 78 GLY CA C 77 43.840 43.840 43.918 -0.078 18533
6376 1 9 . 1 1 78 78 GLY H H 77 10.930 10.930 8.155 2.775 18533
6377 1 9 . 1 1 79 79 THR N N 78 115.210 115.210 116.024 -0.814 18533
6378 1 9 . 1 1 79 79 THR HA H 78 3.700 3.700 3.963 -0.263 18533
6379 1 9 . 1 1 79 79 THR CA C 78 66.440 66.440 67.190 -0.750 18533
6380 1 9 . 1 1 79 79 THR CB C 78 68.770 68.770 68.771 -0.001 18533
6381 1 9 . 1 1 79 79 THR H H 78 8.540 8.540 8.494 0.046 18533
6382 1 9 . 1 1 80 80 GLU N N 79 119.360 119.360 118.567 0.793 18533
6383 1 9 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.038 -0.078 18533
6384 1 9 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.750 0.280 18533
6385 1 9 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.858 0.202 18533
6386 1 9 . 1 1 80 80 GLU H H 79 9.110 9.110 8.865 0.245 18533
6387 1 9 . 1 1 81 81 HIS N N 80 118.380 118.380 117.096 1.284 18533
6388 1 9 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.250 -0.310 18533
6389 1 9 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.999 1.421 18533
6390 1 9 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.254 0.676 18533
6391 1 9 . 1 1 81 81 HIS H H 80 7.040 7.040 7.605 -0.565 18533
6392 1 9 . 1 1 82 82 LEU N N 81 114.010 114.010 119.830 -5.820 18533
6393 1 9 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.083 -0.183 18533
6394 1 9 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.874 -0.194 18533
6395 1 9 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.576 -0.846 18533
6396 1 9 . 1 1 82 82 LEU H H 81 7.850 7.850 8.320 -0.470 18533
6397 1 9 . 1 1 83 83 ALA N N 82 119.050 119.050 118.315 0.735 18533
6398 1 9 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.351 0.039 18533
6399 1 9 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.746 -0.546 18533
6400 1 9 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.648 0.532 18533
6401 1 9 . 1 1 83 83 ALA H H 82 6.950 6.950 7.362 -0.412 18533
6402 1 9 . 1 1 84 84 ALA N N 83 122.500 122.500 122.409 0.091 18533
6403 1 9 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.267 -0.507 18533
6404 1 9 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.438 1.912 18533
6405 1 9 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.426 -2.106 18533
6406 1 9 . 1 1 84 84 ALA H H 83 7.280 7.280 7.287 -0.007 18533
6407 1 9 . 1 1 85 85 ASP N N 84 118.740 118.740 120.207 -1.467 18533
6408 1 9 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.734 -0.324 18533
6409 1 9 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.346 1.294 18533
6410 1 9 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.042 0.858 18533
6411 1 9 . 1 1 85 85 ASP H H 84 8.440 8.440 8.457 -0.017 18533
6412 1 9 . 1 1 86 86 LEU N N 85 115.180 115.180 118.647 -3.467 18533
6413 1 9 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.899 -0.719 18533
6414 1 9 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.987 1.053 18533
6415 1 9 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.910 0.260 18533
6416 1 9 . 1 1 86 86 LEU H H 85 7.280 7.280 8.230 -0.951 18533
6417 1 9 . 1 1 87 87 LEU N N 86 128.140 128.140 127.533 0.607 18533
6418 1 9 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.907 -0.217 18533
6419 1 9 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.849 1.531 18533
6420 1 9 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.611 -0.441 18533
6421 1 9 . 1 1 87 87 LEU H H 86 8.780 8.780 9.072 -0.292 18533
6422 1 9 . 1 1 88 88 VAL N N 87 122.630 122.630 127.127 -4.497 18533
6423 1 9 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.980 -0.350 18533
6424 1 9 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.765 -1.855 18533
6425 1 9 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.978 -1.138 18533
6426 1 9 . 1 1 88 88 VAL H H 87 9.010 9.010 9.056 -0.046 18533
6427 1 9 . 1 1 89 89 ALA N N 88 129.820 129.820 131.004 -1.184 18533
6428 1 9 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.886 -0.366 18533
6429 1 9 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.184 -0.404 18533
6430 1 9 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.209 -0.429 18533
6431 1 9 . 1 1 89 89 ALA H H 88 8.590 8.590 9.045 -0.455 18533
6432 1 9 . 1 1 90 90 LEU N N 89 129.280 129.280 120.082 9.198 18533
6433 1 9 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.630 -0.320 18533
6434 1 9 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.470 -0.020 18533
6435 1 9 . 1 1 90 90 LEU CB C 89 38.020 38.020 42.120 -4.100 18533
6436 1 9 . 1 1 90 90 LEU H H 89 8.570 8.570 8.611 -0.041 18533
6437 1 9 . 1 1 91 91 ASP N N 90 126.910 126.910 116.234 10.676 18533
6438 1 9 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.744 0.056 18533
6439 1 9 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.805 0.145 18533
6440 1 9 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.169 0.641 18533
6441 1 9 . 1 1 91 91 ASP H H 90 11.450 11.450 7.510 3.940 18533
6442 1 9 . 1 1 92 92 ARG N N 91 116.950 116.950 120.961 -4.011 18533
6443 1 9 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.827 0.193 18533
6444 1 9 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.389 -0.559 18533
6445 1 9 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.640 0.640 18533
6446 1 9 . 1 1 92 92 ARG H H 91 8.650 8.650 8.536 0.114 18533
6447 1 9 . 1 1 93 93 ASN N N 92 120.740 120.740 117.855 2.885 18533
6448 1 9 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.555 -0.175 18533
6449 1 9 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.537 0.593 18533
6450 1 9 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.009 -0.389 18533
6451 1 9 . 1 1 93 93 ASN H H 92 8.610 8.610 7.828 0.782 18533
6452 1 9 . 1 1 94 94 HIS N N 93 121.170 121.170 120.289 0.881 18533
6453 1 9 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.191 -0.001 18533
6454 1 9 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.181 0.329 18533
6455 1 9 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.695 1.685 18533
6456 1 9 . 1 1 94 94 HIS H H 93 7.430 7.430 8.549 -1.119 18533
6457 1 9 . 1 1 95 95 ALA N N 94 118.270 118.270 120.953 -2.683 18533
6458 1 9 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.952 -0.212 18533
6459 1 9 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.429 0.070 18533
6460 1 9 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.320 -0.350 18533
6461 1 9 . 1 1 95 95 ALA H H 94 7.190 7.190 8.089 -0.899 18533
6462 1 9 . 1 1 96 96 ARG N N 95 117.190 117.190 119.305 -2.115 18533
6463 1 9 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.024 -0.114 18533
6464 1 9 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.346 0.153 18533
6465 1 9 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.029 0.201 18533
6466 1 9 . 1 1 96 96 ARG H H 95 7.600 7.600 7.597 0.003 18533
6467 1 9 . 1 1 97 97 LEU N N 96 120.700 120.700 119.503 1.197 18533
6468 1 9 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.957 0.123 18533
6469 1 9 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.724 0.176 18533
6470 1 9 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.695 -0.355 18533
6471 1 9 . 1 1 97 97 LEU H H 96 7.990 7.990 7.989 0.001 18533
6472 1 9 . 1 1 98 98 LEU N N 97 118.390 118.390 118.123 0.267 18533
6473 1 9 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.838 0.072 18533
6474 1 9 . 1 1 98 98 LEU CA C 97 58.100 58.100 57.940 0.160 18533
6475 1 9 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.209 0.681 18533
6476 1 9 . 1 1 98 98 LEU H H 97 8.210 8.210 8.085 0.125 18533
6477 1 9 . 1 1 99 99 ARG N N 98 117.470 117.470 117.847 -0.377 18533
6478 1 9 . 1 1 99 99 ARG HA H 98 4.480 4.480 3.925 0.555 18533
6479 1 9 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.051 -0.691 18533
6480 1 9 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.718 -0.978 18533
6481 1 9 . 1 1 99 99 ARG H H 98 7.740 7.740 7.791 -0.051 18533
6482 1 9 . 1 1 100 100 GLN N N 99 121.400 121.400 117.826 3.574 18533
6483 1 9 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.203 -0.133 18533
6484 1 9 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.007 0.673 18533
6485 1 9 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.401 -0.082 18533
6486 1 9 . 1 1 100 100 GLN H H 99 8.030 8.030 7.963 0.067 18533
6487 1 9 . 1 1 101 101 LEU N N 100 118.940 118.940 117.794 1.146 18533
6488 1 9 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.207 0.053 18533
6489 1 9 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.244 0.216 18533
6490 1 9 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.079 0.161 18533
6491 1 9 . 1 1 101 101 LEU H H 100 7.780 7.780 7.741 0.039 18533
6492 1 9 . 1 1 102 102 GLY N N 101 105.740 105.740 104.896 0.844 18533
6493 1 9 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.339 0.691 18533
6494 1 9 . 1 1 102 102 GLY H H 101 7.700 7.700 7.617 0.083 18533
6495 1 9 . 1 1 103 103 VAL N N 102 122.330 122.330 120.195 2.135 18533
6496 1 9 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.068 -0.438 18533
6497 1 9 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.440 1.160 18533
6498 1 9 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.049 -1.559 18533
6499 1 9 . 1 1 103 103 VAL H H 102 7.520 7.520 7.554 -0.034 18533
6500 1 9 . 1 1 104 104 GLU N N 103 128.990 128.990 114.350 14.640 18533
6501 1 9 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.429 -0.259 18533
6502 1 9 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.309 1.611 18533
6503 1 9 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.681 -3.731 18533
6504 1 9 . 1 1 104 104 GLU H H 103 9.210 9.210 7.931 1.279 18533
6505 1 9 . 1 1 105 105 ALA N N 104 124.410 124.410 122.569 1.841 18533
6506 1 9 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.225 -0.465 18533
6507 1 9 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.015 0.625 18533
6508 1 9 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.683 -0.543 18533
6509 1 9 . 1 1 105 105 ALA H H 104 8.500 8.500 8.697 -0.197 18533
6510 1 9 . 1 1 106 106 ALA N N 105 115.110 115.110 120.358 -5.248 18533
6511 1 9 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.189 -0.059 18533
6512 1 9 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.772 -0.732 18533
6513 1 9 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.552 0.508 18533
6514 1 9 . 1 1 106 106 ALA H H 105 8.270 8.270 8.414 -0.144 18533
6515 1 9 . 1 1 107 107 ARG N N 106 115.080 115.080 114.941 0.139 18533
6516 1 9 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.743 -0.283 18533
6517 1 9 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.947 -0.438 18533
6518 1 9 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.849 0.521 18533
6519 1 9 . 1 1 107 107 ARG H H 106 7.740 7.740 7.613 0.127 18533
6520 1 9 . 1 1 108 108 VAL N N 107 118.170 118.170 121.277 -3.107 18533
6521 1 9 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.219 0.851 18533
6522 1 9 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.063 -1.423 18533
6523 1 9 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.596 1.004 18533
6524 1 9 . 1 1 108 108 VAL H H 107 7.290 7.290 8.306 -1.016 18533
6525 1 9 . 1 1 109 109 ARG N N 108 124.250 124.250 127.530 -3.280 18533
6526 1 9 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.616 0.004 18533
6527 1 9 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.014 -1.125 18533
6528 1 9 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.016 0.964 18533
6529 1 9 . 1 1 109 109 ARG H H 108 8.420 8.420 9.154 -0.734 18533
6530 1 9 . 1 1 110 110 MET N N 109 119.570 119.570 121.708 -2.138 18533
6531 1 9 . 1 1 110 110 MET HA H 109 4.960 4.960 4.917 0.043 18533
6532 1 9 . 1 1 110 110 MET CA C 109 53.820 53.820 54.473 -0.653 18533
6533 1 9 . 1 1 110 110 MET CB C 109 30.680 30.680 32.309 -1.629 18533
6534 1 9 . 1 1 110 110 MET H H 109 8.890 8.890 8.567 0.323 18533
6535 1 9 . 1 1 111 111 LEU N N 110 128.660 128.660 126.638 2.022 18533
6536 1 9 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.271 -0.311 18533
6537 1 9 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.943 0.657 18533
6538 1 9 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.843 -0.763 18533
6539 1 9 . 1 1 111 111 LEU H H 110 9.200 9.200 9.064 0.136 18533
6540 1 9 . 1 1 112 112 ARG N N 111 111.910 111.910 116.249 -4.339 18533
6541 1 9 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.071 -0.121 18533
6542 1 9 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.655 1.265 18533
6543 1 9 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.610 -1.110 18533
6544 1 9 . 1 1 112 112 ARG H H 111 8.930 8.930 8.639 0.291 18533
6545 1 9 . 1 1 113 113 SER N N 112 114.800 114.800 115.362 -0.562 18533
6546 1 9 . 1 1 113 113 SER HA H 112 4.290 4.290 4.263 0.027 18533
6547 1 9 . 1 1 113 113 SER CA C 112 60.880 60.880 60.059 0.821 18533
6548 1 9 . 1 1 113 113 SER CB C 112 63.190 63.190 62.551 0.639 18533
6549 1 9 . 1 1 113 113 SER H H 112 7.680 7.680 7.744 -0.064 18533
6550 1 9 . 1 1 114 114 PHE N N 113 119.260 119.260 118.007 1.253 18533
6551 1 9 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.487 -0.137 18533
6552 1 9 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.203 0.727 18533
6553 1 9 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.727 -0.007 18533
6554 1 9 . 1 1 114 114 PHE H H 113 7.600 7.600 7.569 0.031 18533
6555 1 9 . 1 1 115 115 ASP N N 114 121.170 121.170 121.232 -0.062 18533
6556 1 9 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.930 0.090 18533
6557 1 9 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.121 -1.021 18533
6558 1 9 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.596 0.914 18533
6559 1 9 . 1 1 115 115 ASP H H 114 7.430 7.430 7.537 -0.107 18533
6560 1 9 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.450 0.040 18533
6561 1 9 . 1 1 116 116 PRO CA C 115 64.350 64.350 63.965 0.385 18533
6562 1 9 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.281 -0.011 18533
6563 1 9 . 1 1 117 117 ARG N N 116 117.910 117.910 117.067 0.843 18533
6564 1 9 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.426 -0.156 18533
6565 1 9 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.538 0.911 18533
6566 1 9 . 1 1 117 117 ARG CB C 116 29.960 29.960 29.490 0.470 18533
6567 1 9 . 1 1 117 117 ARG H H 116 8.580 8.580 8.522 0.058 18533
6568 1 9 . 1 1 118 118 SER N N 117 116.130 116.130 114.346 1.784 18533
6569 1 9 . 1 1 118 118 SER HA H 117 3.980 3.980 4.195 -0.215 18533
6570 1 9 . 1 1 118 118 SER CA C 117 59.790 59.790 60.711 -0.921 18533
6571 1 9 . 1 1 118 118 SER CB C 117 63.760 63.760 63.326 0.434 18533
6572 1 9 . 1 1 118 118 SER H H 117 7.950 7.950 7.590 0.360 18533
6573 1 9 . 1 1 119 119 GLY N N 118 110.080 110.080 109.025 1.055 18533
6574 1 9 . 1 1 119 119 GLY CA C 118 45.370 45.370 44.861 0.509 18533
6575 1 9 . 1 1 119 119 GLY H H 118 8.150 8.150 8.671 -0.522 18533
6576 1 9 . 1 1 120 120 THR HA H 119 4.020 4.020 4.624 -0.604 18533
6577 1 9 . 1 1 120 120 THR CA C 119 63.290 63.290 60.435 2.855 18533
6578 1 9 . 1 1 120 120 THR CB C 119 69.140 69.140 70.511 -1.371 18533
6579 1 9 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.381 0.189 18533
6580 1 9 . 1 1 121 121 HIS CA C 120 56.010 56.010 54.921 1.089 18533
6581 1 9 . 1 1 121 121 HIS CB C 120 30.990 30.990 29.929 1.061 18533
6582 1 9 . 1 1 122 122 ALA N N 121 125.880 125.880 126.320 -0.440 18533
6583 1 9 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.449 -0.109 18533
6584 1 9 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.270 0.240 18533
6585 1 9 . 1 1 122 122 ALA CB C 121 18.600 18.600 19.854 -1.254 18533
6586 1 9 . 1 1 122 122 ALA H H 121 7.980 7.980 8.542 -0.562 18533
6587 1 9 . 1 1 123 123 LEU N N 122 119.810 119.810 121.905 -2.095 18533
6588 1 9 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.394 -0.114 18533
6589 1 9 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.119 0.371 18533
6590 1 9 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.757 1.944 18533
6591 1 9 . 1 1 123 123 LEU H H 122 7.810 7.810 8.368 -0.558 18533
6592 1 9 . 1 1 124 124 ASP N N 123 119.050 119.050 115.329 3.721 18533
6593 1 9 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.584 -0.014 18533
6594 1 9 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.905 1.415 18533
6595 1 9 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.132 -0.462 18533
6596 1 9 . 1 1 124 124 ASP H H 123 8.270 8.270 7.238 1.032 18533
6597 1 9 . 1 1 125 125 VAL N N 124 121.970 121.970 122.456 -0.486 18533
6598 1 9 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.030 0.230 18533
6599 1 9 . 1 1 125 125 VAL CA C 124 62.310 62.310 63.739 -1.429 18533
6600 1 9 . 1 1 125 125 VAL CB C 124 30.780 30.780 32.953 -2.173 18533
6601 1 9 . 1 1 125 125 VAL H H 124 7.930 7.930 7.910 0.020 18533
6602 1 9 . 1 1 126 126 GLU N N 125 129.490 129.490 116.550 12.940 18533
6603 1 9 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.420 -0.340 18533
6604 1 9 . 1 1 126 126 GLU CA C 125 57.010 57.010 55.434 1.576 18533
6605 1 9 . 1 1 126 126 GLU CB C 125 29.800 29.800 32.380 -2.580 18533
6606 1 9 . 1 1 126 126 GLU H H 125 9.100 9.100 8.141 0.959 18533
6607 1 9 . 1 1 127 127 ASP N N 126 122.300 122.300 120.593 1.707 18533
6608 1 9 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.814 -0.704 18533
6609 1 9 . 1 1 127 127 ASP CA C 126 51.720 51.720 52.555 -0.835 18533
6610 1 9 . 1 1 127 127 ASP CB C 126 42.520 42.520 41.756 0.764 18533
6611 1 9 . 1 1 127 127 ASP H H 126 8.630 8.630 8.364 0.266 18533
6612 1 9 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.331 0.219 18533
6613 1 9 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.051 -0.451 18533
6614 1 9 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.490 -1.510 18533
6615 1 9 . 1 1 129 129 TYR N N 128 122.380 122.380 118.789 3.591 18533
6616 1 9 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.356 -0.556 18533
6617 1 9 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.155 3.965 18533
6618 1 9 . 1 1 129 129 TYR CB C 128 39.390 39.390 40.611 -1.221 18533
6619 1 9 . 1 1 129 129 TYR H H 128 8.670 8.670 8.740 -0.070 18533
6620 1 9 . 1 1 130 130 TYR N N 129 116.300 116.300 112.921 3.379 18533
6621 1 9 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.743 -0.253 18533
6622 1 9 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.094 1.386 18533
6623 1 9 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.545 -2.885 18533
6624 1 9 . 1 1 130 130 TYR H H 129 8.680 8.680 7.583 1.097 18533
6625 1 9 . 1 1 131 131 GLY N N 130 110.870 110.870 110.425 0.445 18533
6626 1 9 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.048 -0.968 18533
6627 1 9 . 1 1 131 131 GLY H H 130 8.060 8.060 7.987 0.073 18533
6628 1 9 . 1 1 132 132 ASP N N 131 121.590 121.590 119.674 1.916 18533
6629 1 9 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.493 0.577 18533
6630 1 9 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.922 0.078 18533
6631 1 9 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.288 1.312 18533
6632 1 9 . 1 1 132 132 ASP H H 131 9.290 9.290 7.988 1.302 18533
6633 1 9 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.048 0.062 18533
6634 1 9 . 1 1 133 133 HIS CA C 132 61.570 61.570 60.101 1.469 18533
6635 1 9 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.232 0.248 18533
6636 1 9 . 1 1 134 134 SER N N 133 115.370 115.370 113.611 1.759 18533
6637 1 9 . 1 1 134 134 SER HA H 133 4.180 4.180 3.874 0.306 18533
6638 1 9 . 1 1 134 134 SER CA C 133 62.070 62.070 61.692 0.378 18533
6639 1 9 . 1 1 134 134 SER CB C 133 62.160 62.160 62.325 -0.165 18533
6640 1 9 . 1 1 134 134 SER H H 133 8.420 8.420 8.421 -0.001 18533
6641 1 9 . 1 1 135 135 ASP N N 134 123.360 123.360 123.311 0.049 18533
6642 1 9 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.386 0.144 18533
6643 1 9 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.997 1.043 18533
6644 1 9 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.502 0.308 18533
6645 1 9 . 1 1 135 135 ASP H H 134 7.980 7.980 8.077 -0.097 18533
6646 1 9 . 1 1 136 136 PHE N N 135 118.940 118.940 118.564 0.376 18533
6647 1 9 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.244 -0.444 18533
6648 1 9 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.260 3.560 18533
6649 1 9 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.011 1.339 18533
6650 1 9 . 1 1 136 136 PHE H H 135 7.850 7.850 7.845 0.005 18533
6651 1 9 . 1 1 137 137 GLU N N 136 121.410 121.410 117.653 3.757 18533
6652 1 9 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.180 0.000 18533
6653 1 9 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.801 0.699 18533
6654 1 9 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.109 -0.119 18533
6655 1 9 . 1 1 137 137 GLU H H 136 8.150 8.150 7.996 0.154 18533
6656 1 9 . 1 1 138 138 GLU N N 137 121.530 121.530 121.870 -0.340 18533
6657 1 9 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.049 0.241 18533
6658 1 9 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.334 0.066 18533
6659 1 9 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.006 -0.116 18533
6660 1 9 . 1 1 138 138 GLU H H 137 7.870 7.870 7.918 -0.048 18533
6661 1 9 . 1 1 139 139 VAL N N 138 119.930 119.930 119.685 0.245 18533
6662 1 9 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.630 -0.150 18533
6663 1 9 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.488 0.592 18533
6664 1 9 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.651 -0.301 18533
6665 1 9 . 1 1 139 139 VAL H H 138 7.770 7.770 7.551 0.219 18533
6666 1 9 . 1 1 140 140 PHE N N 139 119.130 119.130 120.620 -1.490 18533
6667 1 9 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.020 -0.460 18533
6668 1 9 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.633 1.047 18533
6669 1 9 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.881 0.289 18533
6670 1 9 . 1 1 140 140 PHE H H 139 8.050 8.050 7.952 0.098 18533
6671 1 9 . 1 1 141 141 ALA N N 140 121.040 121.040 122.333 -1.293 18533
6672 1 9 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.435 -0.445 18533
6673 1 9 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.743 0.377 18533
6674 1 9 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.348 -0.048 18533
6675 1 9 . 1 1 141 141 ALA H H 140 8.010 8.010 8.204 -0.194 18533
6676 1 9 . 1 1 142 142 VAL N N 141 118.550 118.550 119.288 -0.738 18533
6677 1 9 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.441 0.369 18533
6678 1 9 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.816 -1.216 18533
6679 1 9 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.645 -0.195 18533
6680 1 9 . 1 1 142 142 VAL H H 141 8.300 8.300 7.837 0.463 18533
6681 1 9 . 1 1 143 143 ILE N N 142 121.410 121.410 119.273 2.137 18533
6682 1 9 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.406 -0.016 18533
6683 1 9 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.409 0.641 18533
6684 1 9 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.703 -0.393 18533
6685 1 9 . 1 1 143 143 ILE H H 142 8.150 8.150 7.977 0.173 18533
6686 1 9 . 1 1 144 144 GLU N N 143 119.630 119.630 119.712 -0.082 18533
6687 1 9 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.744 -0.204 18533
6688 1 9 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.256 0.504 18533
6689 1 9 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.820 0.910 18533
6690 1 9 . 1 1 144 144 GLU H H 143 8.640 8.640 8.137 0.503 18533
6691 1 9 . 1 1 145 145 SER N N 144 110.920 110.920 114.441 -3.521 18533
6692 1 9 . 1 1 145 145 SER HA H 144 4.230 4.230 4.203 0.027 18533
6693 1 9 . 1 1 145 145 SER CA C 144 60.810 60.810 61.450 -0.640 18533
6694 1 9 . 1 1 145 145 SER CB C 144 63.610 63.610 63.396 0.214 18533
6695 1 9 . 1 1 145 145 SER H H 144 7.640 7.640 7.752 -0.112 18533
6696 1 9 . 1 1 146 146 ALA N N 145 123.110 123.110 124.302 -1.192 18533
6697 1 9 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.332 -0.212 18533
6698 1 9 . 1 1 146 146 ALA CA C 145 53.400 53.400 53.962 -0.562 18533
6699 1 9 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.237 2.643 18533
6700 1 9 . 1 1 146 146 ALA H H 145 7.500 7.500 7.673 -0.173 18533
6701 1 9 . 1 1 147 147 LEU N N 146 114.220 114.220 119.522 -5.302 18533
6702 1 9 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.832 0.108 18533
6703 1 9 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.330 -0.280 18533
6704 1 9 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.304 0.156 18533
6705 1 9 . 1 1 147 147 LEU H H 146 7.410 7.410 7.958 -0.548 18533
6706 1 9 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.278 0.172 18533
6707 1 9 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.480 3.360 18533
6708 1 9 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.011 0.209 18533
6709 1 9 . 1 1 149 149 GLY N N 148 102.590 102.590 106.559 -3.969 18533
6710 1 9 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.557 1.703 18533
6711 1 9 . 1 1 149 149 GLY H H 148 7.960 7.960 7.937 0.023 18533
6712 1 9 . 1 1 150 150 LEU N N 149 128.060 128.060 123.514 4.546 18533
6713 1 9 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.276 0.354 18533
6714 1 9 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.312 0.038 18533
6715 1 9 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.344 -0.144 18533
6716 1 9 . 1 1 150 150 LEU H H 149 7.620 7.620 8.377 -0.757 18533
6717 1 9 . 1 1 151 151 HIS N N 150 120.730 120.730 118.225 2.505 18533
6718 1 9 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.135 0.035 18533
6719 1 9 . 1 1 151 151 HIS CA C 150 62.380 62.380 60.595 1.785 18533
6720 1 9 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.798 0.712 18533
6721 1 9 . 1 1 151 151 HIS H H 150 8.430 8.430 8.398 0.032 18533
6722 1 9 . 1 1 152 152 ASP N N 151 118.170 118.170 119.463 -1.293 18533
6723 1 9 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.464 -0.044 18533
6724 1 9 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.439 0.371 18533
6725 1 9 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.453 -0.423 18533
6726 1 9 . 1 1 152 152 ASP H H 151 7.820 7.820 8.309 -0.488 18533
6727 1 9 . 1 1 153 153 TRP N N 152 122.780 122.780 122.395 0.385 18533
6728 1 9 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.703 -0.593 18533
6729 1 9 . 1 1 153 153 TRP CA C 152 62.610 62.610 60.869 1.741 18533
6730 1 9 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.202 -0.412 18533
6731 1 9 . 1 1 153 153 TRP H H 152 7.900 7.900 7.862 0.038 18533
6732 1 9 . 1 1 154 154 VAL N N 153 119.460 119.460 117.287 2.173 18533
6733 1 9 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.857 -0.507 18533
6734 1 9 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.229 0.751 18533
6735 1 9 . 1 1 154 154 VAL CB C 153 31.900 31.900 30.828 1.072 18533
6736 1 9 . 1 1 154 154 VAL H H 153 8.560 8.560 8.648 -0.088 18533
6737 1 9 . 1 1 155 155 ASP N N 154 120.500 120.500 121.504 -1.004 18533
6738 1 9 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.307 -0.107 18533
6739 1 9 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.170 -0.600 18533
6740 1 9 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.624 -0.764 18533
6741 1 9 . 1 1 155 155 ASP H H 154 8.530 8.530 8.476 0.054 18533
6742 1 9 . 1 1 156 156 GLU N N 155 120.090 120.090 119.585 0.505 18533
6743 1 9 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.927 0.003 18533
6744 1 9 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.241 -0.081 18533
6745 1 9 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.349 -0.059 18533
6746 1 9 . 1 1 156 156 GLU H H 155 7.870 7.870 8.364 -0.494 18533
6747 1 9 . 1 1 157 157 ARG N N 156 119.230 119.230 118.956 0.274 18533
6748 1 9 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.005 -0.195 18533
6749 1 9 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.044 -0.054 18533
6750 1 9 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.342 -0.232 18533
6751 1 9 . 1 1 157 157 ARG H H 156 7.660 7.660 7.984 -0.324 18533
6752 1 9 . 1 1 158 158 LEU N N 157 118.790 118.790 117.167 1.623 18533
6753 1 9 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.144 -0.044 18533
6754 1 9 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.639 -0.959 18533
6755 1 9 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.724 0.966 18533
6756 1 9 . 1 1 158 158 LEU H H 157 8.470 8.470 8.319 0.151 18533
6757 1 9 . 1 1 159 159 ALA N N 158 120.760 120.760 121.355 -0.595 18533
6758 1 9 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.231 -0.041 18533
6759 1 9 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.106 -0.826 18533
6760 1 9 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.181 -0.791 18533
6761 1 9 . 1 1 159 159 ALA H H 158 7.490 7.490 7.513 -0.023 18533
6762 1 9 . 1 1 160 160 ARG N N 159 117.810 117.810 117.382 0.428 18533
6763 1 9 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.188 0.022 18533
6764 1 9 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.669 -0.889 18533
6765 1 9 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.783 0.747 18533
6766 1 9 . 1 1 160 160 ARG H H 159 7.650 7.650 8.004 -0.354 18533
6767 1 9 . 1 1 161 161 ASN N N 160 118.560 118.560 116.209 2.351 18533
6768 1 9 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.866 -0.126 18533
6769 1 9 . 1 1 161 161 ASN CA C 160 53.250 53.250 52.921 0.329 18533
6770 1 9 . 1 1 161 161 ASN CB C 160 39.170 39.170 40.287 -1.117 18533
6771 1 9 . 1 1 161 161 ASN H H 160 8.100 8.100 7.868 0.232 18533
6772 1 9 . 1 1 162 162 GLY N N 161 108.900 108.900 106.477 2.423 18533
6773 1 9 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.871 -0.141 18533
6774 1 9 . 1 1 162 162 GLY H H 161 7.980 7.980 7.383 0.597 18533
6775 1 9 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.667 -0.207 18533
6776 1 9 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.733 0.718 18533
6777 1 9 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.686 0.515 18533
6778 1 10 . 1 1 2 2 MET N N 1 119.850 119.850 116.881 2.969 18533
6779 1 10 . 1 1 2 2 MET HA H 1 4.500 4.500 4.667 -0.167 18533
6780 1 10 . 1 1 2 2 MET CA C 1 55.450 55.450 56.151 -0.701 18533
6781 1 10 . 1 1 2 2 MET CB C 1 33.170 33.170 32.935 0.235 18533
6782 1 10 . 1 1 2 2 MET H H 1 8.140 8.140 8.184 -0.044 18533
6783 1 10 . 1 1 3 3 SER N N 2 117.000 117.000 115.926 1.074 18533
6784 1 10 . 1 1 3 3 SER HA H 2 4.430 4.430 4.486 -0.056 18533
6785 1 10 . 1 1 3 3 SER CA C 2 58.320 58.320 58.314 0.006 18533
6786 1 10 . 1 1 3 3 SER CB C 2 63.990 63.990 64.555 -0.565 18533
6787 1 10 . 1 1 3 3 SER H H 2 8.340 8.340 8.033 0.307 18533
6788 1 10 . 1 1 4 4 ASP N N 3 123.200 123.200 120.997 2.203 18533
6789 1 10 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.671 0.189 18533
6790 1 10 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.892 -0.012 18533
6791 1 10 . 1 1 4 4 ASP CB C 3 40.800 40.800 39.907 0.893 18533
6792 1 10 . 1 1 4 4 ASP H H 3 8.260 8.260 8.421 -0.161 18533
6793 1 10 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.420 -0.020 18533
6794 1 10 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.660 0.160 18533
6795 1 10 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.621 -0.711 18533
6796 1 10 . 1 1 6 6 LEU N N 5 123.160 123.160 119.761 3.399 18533
6797 1 10 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.339 0.051 18533
6798 1 10 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.992 0.288 18533
6799 1 10 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.781 1.569 18533
6800 1 10 . 1 1 6 6 LEU H H 5 7.670 7.670 8.204 -0.534 18533
6801 1 10 . 1 1 7 7 HIS N N 6 127.160 127.160 118.098 9.062 18533
6802 1 10 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.081 0.949 18533
6803 1 10 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.251 -2.351 18533
6804 1 10 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.611 0.519 18533
6805 1 10 . 1 1 7 7 HIS H H 6 10.080 10.080 8.707 1.373 18533
6806 1 10 . 1 1 8 8 VAL N N 7 128.620 128.620 127.491 1.129 18533
6807 1 10 . 1 1 8 8 VAL HA H 7 4.500 4.500 5.044 -0.544 18533
6808 1 10 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.650 0.150 18533
6809 1 10 . 1 1 8 8 VAL CB C 7 34.800 34.800 33.115 1.685 18533
6810 1 10 . 1 1 8 8 VAL H H 7 8.930 8.930 9.076 -0.146 18533
6811 1 10 . 1 1 9 9 THR N N 8 121.530 121.530 122.661 -1.131 18533
6812 1 10 . 1 1 9 9 THR HA H 8 5.270 5.270 4.741 0.529 18533
6813 1 10 . 1 1 9 9 THR CA C 8 58.520 58.520 59.371 -0.851 18533
6814 1 10 . 1 1 9 9 THR CB C 8 70.750 70.750 69.974 0.776 18533
6815 1 10 . 1 1 9 9 THR H H 8 7.970 7.970 8.876 -0.906 18533
6816 1 10 . 1 1 10 10 PHE N N 9 125.360 125.360 128.687 -3.327 18533
6817 1 10 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.082 0.128 18533
6818 1 10 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.995 0.315 18533
6819 1 10 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.588 3.242 18533
6820 1 10 . 1 1 10 10 PHE H H 9 8.180 8.180 8.070 0.110 18533
6821 1 10 . 1 1 11 11 VAL N N 10 121.120 121.120 122.624 -1.504 18533
6822 1 10 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.297 0.063 18533
6823 1 10 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.084 -0.664 18533
6824 1 10 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.737 1.813 18533
6825 1 10 . 1 1 11 11 VAL H H 10 8.710 8.710 9.122 -0.412 18533
6826 1 10 . 1 1 12 12 CYS N N 11 123.270 123.270 123.635 -0.365 18533
6827 1 10 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.370 -1.110 18533
6828 1 10 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.299 1.331 18533
6829 1 10 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.232 -0.882 18533
6830 1 10 . 1 1 12 12 CYS H H 11 7.940 7.940 8.579 -0.639 18533
6831 1 10 . 1 1 13 13 THR HA H 12 5.010 5.010 3.825 1.185 18533
6832 1 10 . 1 1 13 13 THR CA C 12 64.870 64.870 62.622 2.248 18533
6833 1 10 . 1 1 13 13 THR CB C 12 69.180 69.180 67.126 2.054 18533
6834 1 10 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.482 -0.522 18533
6835 1 10 . 1 1 15 15 ASN N N 14 119.960 119.960 116.455 3.505 18533
6836 1 10 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.268 -0.338 18533
6837 1 10 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.809 0.061 18533
6838 1 10 . 1 1 15 15 ASN CB C 14 40.670 40.670 36.225 4.445 18533
6839 1 10 . 1 1 15 15 ASN H H 14 9.280 9.280 8.128 1.152 18533
6840 1 10 . 1 1 16 16 ILE N N 15 101.060 101.060 109.323 -8.263 18533
6841 1 10 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.695 -0.015 18533
6842 1 10 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.565 2.225 18533
6843 1 10 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.340 2.800 18533
6844 1 10 . 1 1 16 16 ILE H H 15 7.100 7.100 7.717 -0.617 18533
6845 1 10 . 1 1 17 17 CYS N N 16 116.020 116.020 121.095 -5.075 18533
6846 1 10 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.439 0.501 18533
6847 1 10 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.552 0.508 18533
6848 1 10 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.391 0.559 18533
6849 1 10 . 1 1 17 17 CYS H H 16 7.700 7.700 8.171 -0.471 18533
6850 1 10 . 1 1 19 19 SER N N 18 122.340 122.340 114.827 7.513 18533
6851 1 10 . 1 1 19 19 SER HA H 18 3.810 3.810 4.178 -0.367 18533
6852 1 10 . 1 1 19 19 SER CA C 18 62.710 62.710 63.457 -0.747 18533
6853 1 10 . 1 1 19 19 SER CB C 18 64.860 64.860 61.332 3.528 18533
6854 1 10 . 1 1 19 19 SER H H 18 11.420 11.420 7.592 3.828 18533
6855 1 10 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.085 -0.115 18533
6856 1 10 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.963 0.066 18533
6857 1 10 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.874 -2.184 18533
6858 1 10 . 1 1 21 21 MET N N 20 112.430 112.430 118.211 -5.781 18533
6859 1 10 . 1 1 21 21 MET HA H 20 3.730 3.730 3.880 -0.150 18533
6860 1 10 . 1 1 21 21 MET CA C 20 60.160 60.160 59.773 0.387 18533
6861 1 10 . 1 1 21 21 MET CB C 20 33.040 33.040 32.143 0.897 18533
6862 1 10 . 1 1 21 21 MET H H 20 6.310 6.310 7.666 -1.356 18533
6863 1 10 . 1 1 22 22 ALA N N 21 117.800 117.800 119.627 -1.827 18533
6864 1 10 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.815 -0.415 18533
6865 1 10 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.280 0.710 18533
6866 1 10 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.482 -0.992 18533
6867 1 10 . 1 1 22 22 ALA H H 21 6.550 6.550 7.380 -0.830 18533
6868 1 10 . 1 1 23 23 GLU N N 22 115.520 115.520 118.718 -3.198 18533
6869 1 10 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.086 -0.406 18533
6870 1 10 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.684 -0.134 18533
6871 1 10 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.805 -0.015 18533
6872 1 10 . 1 1 23 23 GLU H H 22 7.800 7.800 7.652 0.148 18533
6873 1 10 . 1 1 24 24 LYS N N 23 114.220 114.220 116.145 -1.925 18533
6874 1 10 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.174 -0.174 18533
6875 1 10 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.978 -0.218 18533
6876 1 10 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.438 -1.639 18533
6877 1 10 . 1 1 24 24 LYS H H 23 8.040 8.040 7.533 0.507 18533
6878 1 10 . 1 1 25 25 MET N N 24 115.250 115.250 120.056 -4.806 18533
6879 1 10 . 1 1 25 25 MET HA H 24 3.950 3.950 3.407 0.543 18533
6880 1 10 . 1 1 25 25 MET CA C 24 57.980 57.980 58.958 -0.978 18533
6881 1 10 . 1 1 25 25 MET CB C 24 35.500 35.500 32.470 3.030 18533
6882 1 10 . 1 1 25 25 MET H H 24 7.610 7.610 7.595 0.015 18533
6883 1 10 . 1 1 26 26 PHE N N 25 119.090 119.090 116.102 2.988 18533
6884 1 10 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.456 -0.116 18533
6885 1 10 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.800 0.230 18533
6886 1 10 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.665 1.795 18533
6887 1 10 . 1 1 26 26 PHE H H 25 8.560 8.560 7.676 0.884 18533
6888 1 10 . 1 1 27 27 ALA N N 26 117.830 117.830 122.537 -4.707 18533
6889 1 10 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.782 0.148 18533
6890 1 10 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.173 0.887 18533
6891 1 10 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.872 0.538 18533
6892 1 10 . 1 1 27 27 ALA H H 26 8.800 8.800 7.241 1.559 18533
6893 1 10 . 1 1 28 28 GLN N N 27 117.550 117.550 118.316 -0.766 18533
6894 1 10 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.054 -0.004 18533
6895 1 10 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.889 0.721 18533
6896 1 10 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.974 0.477 18533
6897 1 10 . 1 1 28 28 GLN H H 27 7.690 7.690 7.802 -0.112 18533
6898 1 10 . 1 1 29 29 GLN N N 28 117.530 117.530 119.818 -2.288 18533
6899 1 10 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.062 0.078 18533
6900 1 10 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.761 0.419 18533
6901 1 10 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.770 -0.660 18533
6902 1 10 . 1 1 29 29 GLN H H 28 8.210 8.210 7.577 0.633 18533
6903 1 10 . 1 1 30 30 LEU N N 29 119.330 119.330 120.543 -1.213 18533
6904 1 10 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.019 -0.089 18533
6905 1 10 . 1 1 30 30 LEU CA C 29 58.080 58.080 58.193 -0.113 18533
6906 1 10 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.438 0.462 18533
6907 1 10 . 1 1 30 30 LEU H H 29 8.540 8.540 8.441 0.099 18533
6908 1 10 . 1 1 31 31 ARG N N 30 120.880 120.880 117.252 3.628 18533
6909 1 10 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.037 -0.067 18533
6910 1 10 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.147 0.643 18533
6911 1 10 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.511 0.009 18533
6912 1 10 . 1 1 31 31 ARG H H 30 8.050 8.050 7.976 0.074 18533
6913 1 10 . 1 1 32 32 HIS N N 31 119.770 119.770 118.498 1.272 18533
6914 1 10 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.434 0.116 18533
6915 1 10 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.699 -0.619 18533
6916 1 10 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.240 0.470 18533
6917 1 10 . 1 1 32 32 HIS H H 31 8.440 8.440 8.402 0.038 18533
6918 1 10 . 1 1 33 33 ARG N N 32 115.430 115.430 116.977 -1.547 18533
6919 1 10 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.466 0.124 18533
6920 1 10 . 1 1 33 33 ARG CA C 32 55.970 55.970 55.990 -0.020 18533
6921 1 10 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.506 -0.286 18533
6922 1 10 . 1 1 33 33 ARG H H 32 7.500 7.500 7.743 -0.243 18533
6923 1 10 . 1 1 34 34 GLY N N 33 106.730 106.730 109.034 -2.304 18533
6924 1 10 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.204 0.996 18533
6925 1 10 . 1 1 34 34 GLY H H 33 7.750 7.750 8.135 -0.385 18533
6926 1 10 . 1 1 35 35 LEU N N 34 119.980 119.980 117.081 2.899 18533
6927 1 10 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.843 -0.163 18533
6928 1 10 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.757 0.394 18533
6929 1 10 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.543 0.647 18533
6930 1 10 . 1 1 35 35 LEU H H 34 7.980 7.980 8.481 -0.501 18533
6931 1 10 . 1 1 36 36 GLY N N 35 108.660 108.660 109.271 -0.611 18533
6932 1 10 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.734 -0.634 18533
6933 1 10 . 1 1 36 36 GLY H H 35 8.830 8.830 8.046 0.784 18533
6934 1 10 . 1 1 37 37 ASP N N 36 115.360 115.360 118.886 -3.526 18533
6935 1 10 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.636 0.134 18533
6936 1 10 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.612 -1.222 18533
6937 1 10 . 1 1 37 37 ASP CB C 36 41.170 41.170 41.042 0.127 18533
6938 1 10 . 1 1 37 37 ASP H H 36 8.300 8.300 8.279 0.021 18533
6939 1 10 . 1 1 38 38 ALA N N 37 121.460 121.460 119.921 1.539 18533
6940 1 10 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.305 0.005 18533
6941 1 10 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.145 -0.195 18533
6942 1 10 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.479 0.371 18533
6943 1 10 . 1 1 38 38 ALA H H 37 7.380 7.380 7.691 -0.311 18533
6944 1 10 . 1 1 39 39 VAL N N 38 115.660 115.660 116.635 -0.975 18533
6945 1 10 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.585 0.215 18533
6946 1 10 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.148 -0.108 18533
6947 1 10 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.429 0.761 18533
6948 1 10 . 1 1 39 39 VAL H H 38 7.100 7.100 8.102 -1.002 18533
6949 1 10 . 1 1 40 40 ARG N N 39 129.230 129.230 127.701 1.529 18533
6950 1 10 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.594 -0.054 18533
6951 1 10 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.270 1.440 18533
6952 1 10 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.157 1.163 18533
6953 1 10 . 1 1 40 40 ARG H H 39 9.730 9.730 8.453 1.277 18533
6954 1 10 . 1 1 41 41 VAL N N 40 126.240 126.240 124.527 1.713 18533
6955 1 10 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.883 0.807 18533
6956 1 10 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.389 -0.829 18533
6957 1 10 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.954 -1.014 18533
6958 1 10 . 1 1 41 41 VAL H H 40 8.610 8.610 8.388 0.222 18533
6959 1 10 . 1 1 42 42 THR N N 41 117.310 117.310 119.169 -1.859 18533
6960 1 10 . 1 1 42 42 THR HA H 41 4.890 4.890 5.014 -0.124 18533
6961 1 10 . 1 1 42 42 THR CA C 41 60.300 60.300 59.823 0.477 18533
6962 1 10 . 1 1 42 42 THR CB C 41 73.890 73.890 71.789 2.101 18533
6963 1 10 . 1 1 42 42 THR H H 41 8.870 8.870 9.216 -0.346 18533
6964 1 10 . 1 1 43 43 SER N N 42 109.960 109.960 113.496 -3.536 18533
6965 1 10 . 1 1 43 43 SER HA H 42 5.720 5.720 5.012 0.708 18533
6966 1 10 . 1 1 43 43 SER CA C 42 58.090 58.090 57.735 0.355 18533
6967 1 10 . 1 1 43 43 SER CB C 42 65.870 65.870 66.476 -0.606 18533
6968 1 10 . 1 1 43 43 SER H H 42 8.060 8.060 8.438 -0.378 18533
6969 1 10 . 1 1 44 44 ALA N N 43 119.200 119.200 119.950 -0.750 18533
6970 1 10 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.132 -0.872 18533
6971 1 10 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.783 -0.604 18533
6972 1 10 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.849 -1.019 18533
6973 1 10 . 1 1 44 44 ALA H H 43 8.710 8.710 9.070 -0.360 18533
6974 1 10 . 1 1 45 45 GLY N N 44 104.090 104.090 106.093 -2.003 18533
6975 1 10 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.283 -1.743 18533
6976 1 10 . 1 1 45 45 GLY H H 44 8.670 8.670 8.100 0.570 18533
6977 1 10 . 1 1 46 46 THR N N 45 114.060 114.060 116.357 -2.297 18533
6978 1 10 . 1 1 46 46 THR HA H 45 4.080 4.080 4.134 -0.054 18533
6979 1 10 . 1 1 46 46 THR CA C 45 64.680 64.680 64.373 0.307 18533
6980 1 10 . 1 1 46 46 THR CB C 45 67.880 67.880 68.675 -0.795 18533
6981 1 10 . 1 1 46 46 THR H H 45 9.120 9.120 8.458 0.662 18533
6982 1 10 . 1 1 47 47 GLY N N 46 110.380 110.380 108.276 2.104 18533
6983 1 10 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.976 -0.146 18533
6984 1 10 . 1 1 47 47 GLY H H 46 8.930 8.930 8.324 0.606 18533
6985 1 10 . 1 1 48 48 ASN N N 47 113.440 113.440 117.720 -4.280 18533
6986 1 10 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.375 0.115 18533
6987 1 10 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.292 -2.532 18533
6988 1 10 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.782 2.068 18533
6989 1 10 . 1 1 48 48 ASN H H 47 7.600 7.600 7.744 -0.144 18533
6990 1 10 . 1 1 49 49 TRP N N 48 117.300 117.300 121.213 -3.913 18533
6991 1 10 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.379 -0.479 18533
6992 1 10 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.269 0.591 18533
6993 1 10 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.052 -0.532 18533
6994 1 10 . 1 1 49 49 TRP H H 48 6.920 6.920 8.680 -1.760 18533
6995 1 10 . 1 1 50 50 HIS N N 49 111.590 111.590 114.787 -3.197 18533
6996 1 10 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.834 0.046 18533
6997 1 10 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.474 -1.613 18533
6998 1 10 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.599 1.441 18533
6999 1 10 . 1 1 50 50 HIS H H 49 8.620 8.620 8.476 0.144 18533
7000 1 10 . 1 1 51 51 VAL N N 50 119.010 119.010 119.779 -0.769 18533
7001 1 10 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.718 -0.518 18533
7002 1 10 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.868 0.812 18533
7003 1 10 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.808 -0.419 18533
7004 1 10 . 1 1 51 51 VAL H H 50 6.880 6.880 7.568 -0.688 18533
7005 1 10 . 1 1 52 52 GLY N N 51 115.450 115.450 115.776 -0.326 18533
7006 1 10 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.373 -0.434 18533
7007 1 10 . 1 1 52 52 GLY H H 51 9.120 9.120 9.242 -0.122 18533
7008 1 10 . 1 1 53 53 SER N N 52 116.620 116.620 115.646 0.974 18533
7009 1 10 . 1 1 53 53 SER HA H 52 4.610 4.610 4.708 -0.098 18533
7010 1 10 . 1 1 53 53 SER CA C 52 59.310 59.310 57.558 1.752 18533
7011 1 10 . 1 1 53 53 SER CB C 52 64.630 64.630 64.970 -0.340 18533
7012 1 10 . 1 1 53 53 SER H H 52 8.430 8.430 8.038 0.392 18533
7013 1 10 . 1 1 54 54 CYS N N 53 118.690 118.690 118.392 0.298 18533
7014 1 10 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.597 -0.497 18533
7015 1 10 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.313 1.357 18533
7016 1 10 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.537 -3.187 18533
7017 1 10 . 1 1 54 54 CYS H H 53 8.170 8.170 8.411 -0.241 18533
7018 1 10 . 1 1 55 55 ALA N N 54 118.580 118.580 123.865 -5.285 18533
7019 1 10 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.261 -0.141 18533
7020 1 10 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.742 -0.102 18533
7021 1 10 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.372 -2.742 18533
7022 1 10 . 1 1 55 55 ALA H H 54 8.420 8.420 8.488 -0.068 18533
7023 1 10 . 1 1 56 56 ASP N N 55 121.500 121.500 122.905 -1.405 18533
7024 1 10 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.443 -0.103 18533
7025 1 10 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.636 0.413 18533
7026 1 10 . 1 1 56 56 ASP CB C 55 46.060 46.060 43.059 3.001 18533
7027 1 10 . 1 1 56 56 ASP H H 55 8.470 8.470 8.559 -0.089 18533
7028 1 10 . 1 1 57 57 GLU N N 56 127.840 127.840 126.658 1.182 18533
7029 1 10 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.829 0.211 18533
7030 1 10 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.258 0.382 18533
7031 1 10 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.335 0.165 18533
7032 1 10 . 1 1 57 57 GLU H H 56 9.230 9.230 8.800 0.430 18533
7033 1 10 . 1 1 58 58 ARG N N 57 120.820 120.820 118.247 2.573 18533
7034 1 10 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.642 0.168 18533
7035 1 10 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.639 -0.489 18533
7036 1 10 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.573 -2.303 18533
7037 1 10 . 1 1 58 58 ARG H H 57 9.220 9.220 9.261 -0.041 18533
7038 1 10 . 1 1 59 59 ALA N N 58 121.590 121.590 122.424 -0.834 18533
7039 1 10 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.167 -0.007 18533
7040 1 10 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.498 0.282 18533
7041 1 10 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.198 0.292 18533
7042 1 10 . 1 1 59 59 ALA H H 58 6.680 6.680 7.522 -0.842 18533
7043 1 10 . 1 1 60 60 ALA N N 59 118.970 118.970 121.546 -2.576 18533
7044 1 10 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.939 -0.079 18533
7045 1 10 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.098 -0.078 18533
7046 1 10 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.336 -0.266 18533
7047 1 10 . 1 1 60 60 ALA H H 59 8.540 8.540 8.182 0.358 18533
7048 1 10 . 1 1 61 61 GLY N N 60 104.160 104.160 106.652 -2.492 18533
7049 1 10 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.063 0.207 18533
7050 1 10 . 1 1 61 61 GLY H H 60 8.210 8.210 8.211 -0.001 18533
7051 1 10 . 1 1 62 62 VAL N N 61 122.820 122.820 119.948 2.872 18533
7052 1 10 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.727 0.123 18533
7053 1 10 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.007 1.243 18533
7054 1 10 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.465 0.424 18533
7055 1 10 . 1 1 62 62 VAL H H 61 7.310 7.310 7.545 -0.235 18533
7056 1 10 . 1 1 63 63 LEU N N 62 120.310 120.310 120.989 -0.679 18533
7057 1 10 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.208 -0.228 18533
7058 1 10 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.263 0.687 18533
7059 1 10 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.370 0.130 18533
7060 1 10 . 1 1 63 63 LEU H H 62 8.090 8.090 8.441 -0.351 18533
7061 1 10 . 1 1 64 64 ARG N N 63 119.440 119.440 119.249 0.191 18533
7062 1 10 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.254 -0.074 18533
7063 1 10 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.920 0.530 18533
7064 1 10 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.563 0.817 18533
7065 1 10 . 1 1 64 64 ARG H H 63 8.740 8.740 8.489 0.251 18533
7066 1 10 . 1 1 65 65 ALA N N 64 122.560 122.560 121.793 0.767 18533
7067 1 10 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.072 -0.042 18533
7068 1 10 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.114 0.426 18533
7069 1 10 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.266 -0.186 18533
7070 1 10 . 1 1 65 65 ALA H H 64 7.910 7.910 7.593 0.317 18533
7071 1 10 . 1 1 66 66 HIS N N 65 112.690 112.690 114.447 -1.757 18533
7072 1 10 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.634 0.006 18533
7073 1 10 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.239 -0.738 18533
7074 1 10 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.750 0.570 18533
7075 1 10 . 1 1 66 66 HIS H H 65 7.410 7.410 7.834 -0.424 18533
7076 1 10 . 1 1 67 67 GLY N N 66 107.440 107.440 106.210 1.230 18533
7077 1 10 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.220 1.140 18533
7078 1 10 . 1 1 67 67 GLY H H 66 7.850 7.850 7.498 0.352 18533
7079 1 10 . 1 1 68 68 TYR N N 67 119.940 119.940 121.341 -1.401 18533
7080 1 10 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.853 -0.053 18533
7081 1 10 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.185 0.914 18533
7082 1 10 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.007 0.853 18533
7083 1 10 . 1 1 68 68 TYR H H 67 8.380 8.380 8.372 0.008 18533
7084 1 10 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.505 0.055 18533
7085 1 10 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.932 -0.332 18533
7086 1 10 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.417 0.393 18533
7087 1 10 . 1 1 70 70 THR N N 69 100.660 100.660 107.856 -7.196 18533
7088 1 10 . 1 1 70 70 THR HA H 69 4.300 4.300 4.449 -0.149 18533
7089 1 10 . 1 1 70 70 THR CA C 69 61.250 61.250 60.755 0.495 18533
7090 1 10 . 1 1 70 70 THR CB C 69 70.740 70.740 69.592 1.148 18533
7091 1 10 . 1 1 70 70 THR H H 69 7.860 7.860 8.086 -0.226 18533
7092 1 10 . 1 1 71 71 ASP N N 70 122.880 122.880 122.376 0.504 18533
7093 1 10 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.821 -0.411 18533
7094 1 10 . 1 1 71 71 ASP CA C 70 55.870 55.870 53.738 2.132 18533
7095 1 10 . 1 1 71 71 ASP CB C 70 40.970 40.970 42.377 -1.407 18533
7096 1 10 . 1 1 71 71 ASP H H 70 7.940 7.940 7.857 0.083 18533
7097 1 10 . 1 1 72 72 HIS N N 71 121.720 121.720 124.229 -2.509 18533
7098 1 10 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.715 -0.015 18533
7099 1 10 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.310 1.080 18533
7100 1 10 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.719 2.621 18533
7101 1 10 . 1 1 72 72 HIS H H 71 8.000 8.000 8.131 -0.131 18533
7102 1 10 . 1 1 73 73 ARG N N 72 125.760 125.760 126.057 -0.297 18533
7103 1 10 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.002 -0.712 18533
7104 1 10 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.055 0.375 18533
7105 1 10 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.620 0.690 18533
7106 1 10 . 1 1 73 73 ARG H H 72 7.230 7.230 8.098 -0.868 18533
7107 1 10 . 1 1 74 74 ALA N N 73 127.970 127.970 128.834 -0.864 18533
7108 1 10 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.285 0.345 18533
7109 1 10 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.787 -0.607 18533
7110 1 10 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.168 -1.268 18533
7111 1 10 . 1 1 74 74 ALA H H 73 9.090 9.090 8.209 0.881 18533
7112 1 10 . 1 1 75 75 ALA N N 74 126.090 126.090 124.857 1.233 18533
7113 1 10 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.776 0.014 18533
7114 1 10 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.650 0.320 18533
7115 1 10 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.007 1.613 18533
7116 1 10 . 1 1 75 75 ALA H H 74 9.410 9.410 8.305 1.105 18533
7117 1 10 . 1 1 76 76 GLN N N 75 123.260 123.260 119.355 3.905 18533
7118 1 10 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.615 0.335 18533
7119 1 10 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.562 -0.012 18533
7120 1 10 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.419 -1.369 18533
7121 1 10 . 1 1 76 76 GLN H H 75 8.800 8.800 8.417 0.383 18533
7122 1 10 . 1 1 77 77 VAL N N 76 125.510 125.510 123.588 1.922 18533
7123 1 10 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.470 -0.170 18533
7124 1 10 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.226 0.354 18533
7125 1 10 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.438 3.052 18533
7126 1 10 . 1 1 77 77 VAL H H 76 8.550 8.550 7.964 0.586 18533
7127 1 10 . 1 1 78 78 GLY N N 77 121.850 121.850 116.919 4.931 18533
7128 1 10 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.032 -0.192 18533
7129 1 10 . 1 1 78 78 GLY H H 77 10.930 10.930 8.203 2.727 18533
7130 1 10 . 1 1 79 79 THR N N 78 115.210 115.210 116.121 -0.911 18533
7131 1 10 . 1 1 79 79 THR HA H 78 3.700 3.700 3.976 -0.276 18533
7132 1 10 . 1 1 79 79 THR CA C 78 66.440 66.440 67.182 -0.742 18533
7133 1 10 . 1 1 79 79 THR CB C 78 68.770 68.770 68.707 0.063 18533
7134 1 10 . 1 1 79 79 THR H H 78 8.540 8.540 8.488 0.052 18533
7135 1 10 . 1 1 80 80 GLU N N 79 119.360 119.360 118.607 0.753 18533
7136 1 10 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.000 -0.040 18533
7137 1 10 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.714 0.316 18533
7138 1 10 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.802 0.258 18533
7139 1 10 . 1 1 80 80 GLU H H 79 9.110 9.110 8.876 0.234 18533
7140 1 10 . 1 1 81 81 HIS N N 80 118.380 118.380 116.993 1.387 18533
7141 1 10 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.249 -0.309 18533
7142 1 10 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.972 1.448 18533
7143 1 10 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.264 0.666 18533
7144 1 10 . 1 1 81 81 HIS H H 80 7.040 7.040 7.542 -0.502 18533
7145 1 10 . 1 1 82 82 LEU N N 81 114.010 114.010 120.267 -6.257 18533
7146 1 10 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.073 -0.173 18533
7147 1 10 . 1 1 82 82 LEU CA C 81 56.680 56.680 57.149 -0.469 18533
7148 1 10 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.492 -0.762 18533
7149 1 10 . 1 1 82 82 LEU H H 81 7.850 7.850 8.523 -0.673 18533
7150 1 10 . 1 1 83 83 ALA N N 82 119.050 119.050 118.895 0.155 18533
7151 1 10 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.337 0.053 18533
7152 1 10 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.581 -0.381 18533
7153 1 10 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.472 0.708 18533
7154 1 10 . 1 1 83 83 ALA H H 82 6.950 6.950 7.403 -0.453 18533
7155 1 10 . 1 1 84 84 ALA N N 83 122.500 122.500 122.122 0.378 18533
7156 1 10 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.098 -0.338 18533
7157 1 10 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.728 1.622 18533
7158 1 10 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.464 -2.144 18533
7159 1 10 . 1 1 84 84 ALA H H 83 7.280 7.280 7.215 0.065 18533
7160 1 10 . 1 1 85 85 ASP N N 84 118.740 118.740 120.359 -1.619 18533
7161 1 10 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.700 -0.290 18533
7162 1 10 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.233 1.407 18533
7163 1 10 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.062 0.838 18533
7164 1 10 . 1 1 85 85 ASP H H 84 8.440 8.440 8.376 0.064 18533
7165 1 10 . 1 1 86 86 LEU N N 85 115.180 115.180 118.391 -3.211 18533
7166 1 10 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.871 -0.691 18533
7167 1 10 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.875 1.165 18533
7168 1 10 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.661 0.509 18533
7169 1 10 . 1 1 86 86 LEU H H 85 7.280 7.280 8.172 -0.892 18533
7170 1 10 . 1 1 87 87 LEU N N 86 128.140 128.140 127.597 0.543 18533
7171 1 10 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.909 -0.219 18533
7172 1 10 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.834 1.546 18533
7173 1 10 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.638 -0.468 18533
7174 1 10 . 1 1 87 87 LEU H H 86 8.780 8.780 9.014 -0.234 18533
7175 1 10 . 1 1 88 88 VAL N N 87 122.630 122.630 127.179 -4.549 18533
7176 1 10 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.967 -0.337 18533
7177 1 10 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.861 -1.951 18533
7178 1 10 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.846 -1.006 18533
7179 1 10 . 1 1 88 88 VAL H H 87 9.010 9.010 8.964 0.046 18533
7180 1 10 . 1 1 89 89 ALA N N 88 129.820 129.820 131.085 -1.265 18533
7181 1 10 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.929 -0.409 18533
7182 1 10 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.226 -0.446 18533
7183 1 10 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.123 -0.343 18533
7184 1 10 . 1 1 89 89 ALA H H 88 8.590 8.590 9.033 -0.443 18533
7185 1 10 . 1 1 90 90 LEU N N 89 129.280 129.280 120.109 9.171 18533
7186 1 10 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.570 -0.260 18533
7187 1 10 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.719 0.731 18533
7188 1 10 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.680 -3.660 18533
7189 1 10 . 1 1 90 90 LEU H H 89 8.570 8.570 8.699 -0.129 18533
7190 1 10 . 1 1 91 91 ASP N N 90 126.910 126.910 116.425 10.485 18533
7191 1 10 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.708 0.092 18533
7192 1 10 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.381 -0.431 18533
7193 1 10 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.429 0.381 18533
7194 1 10 . 1 1 91 91 ASP H H 90 11.450 11.450 7.516 3.934 18533
7195 1 10 . 1 1 92 92 ARG N N 91 116.950 116.950 121.672 -4.722 18533
7196 1 10 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.948 0.072 18533
7197 1 10 . 1 1 92 92 ARG CA C 91 58.830 58.830 58.905 -0.075 18533
7198 1 10 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.763 0.517 18533
7199 1 10 . 1 1 92 92 ARG H H 91 8.650 8.650 8.695 -0.045 18533
7200 1 10 . 1 1 93 93 ASN N N 92 120.740 120.740 118.581 2.159 18533
7201 1 10 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.556 -0.176 18533
7202 1 10 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.496 0.634 18533
7203 1 10 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.189 -0.569 18533
7204 1 10 . 1 1 93 93 ASN H H 92 8.610 8.610 8.211 0.399 18533
7205 1 10 . 1 1 94 94 HIS N N 93 121.170 121.170 120.325 0.845 18533
7206 1 10 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.211 -0.021 18533
7207 1 10 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.260 0.250 18533
7208 1 10 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.665 1.715 18533
7209 1 10 . 1 1 94 94 HIS H H 93 7.430 7.430 8.406 -0.976 18533
7210 1 10 . 1 1 95 95 ALA N N 94 118.270 118.270 121.159 -2.889 18533
7211 1 10 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.945 -0.205 18533
7212 1 10 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.482 0.018 18533
7213 1 10 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.304 -0.334 18533
7214 1 10 . 1 1 95 95 ALA H H 94 7.190 7.190 8.166 -0.976 18533
7215 1 10 . 1 1 96 96 ARG N N 95 117.190 117.190 119.299 -2.109 18533
7216 1 10 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.036 -0.126 18533
7217 1 10 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.362 0.138 18533
7218 1 10 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.033 0.197 18533
7219 1 10 . 1 1 96 96 ARG H H 95 7.600 7.600 7.778 -0.178 18533
7220 1 10 . 1 1 97 97 LEU N N 96 120.700 120.700 119.624 1.076 18533
7221 1 10 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.972 0.108 18533
7222 1 10 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.728 0.172 18533
7223 1 10 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.722 -0.382 18533
7224 1 10 . 1 1 97 97 LEU H H 96 7.990 7.990 7.948 0.042 18533
7225 1 10 . 1 1 98 98 LEU N N 97 118.390 118.390 118.060 0.330 18533
7226 1 10 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.854 0.056 18533
7227 1 10 . 1 1 98 98 LEU CA C 97 58.100 58.100 57.935 0.165 18533
7228 1 10 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.173 0.717 18533
7229 1 10 . 1 1 98 98 LEU H H 97 8.210 8.210 8.262 -0.052 18533
7230 1 10 . 1 1 99 99 ARG N N 98 117.470 117.470 118.050 -0.580 18533
7231 1 10 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.005 0.475 18533
7232 1 10 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.029 -0.669 18533
7233 1 10 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.751 -1.011 18533
7234 1 10 . 1 1 99 99 ARG H H 98 7.740 7.740 7.989 -0.249 18533
7235 1 10 . 1 1 100 100 GLN N N 99 121.400 121.400 118.755 2.645 18533
7236 1 10 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.184 -0.114 18533
7237 1 10 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.187 0.493 18533
7238 1 10 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.134 0.186 18533
7239 1 10 . 1 1 100 100 GLN H H 99 8.030 8.030 8.059 -0.029 18533
7240 1 10 . 1 1 101 101 LEU N N 100 118.940 118.940 116.978 1.962 18533
7241 1 10 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.166 0.094 18533
7242 1 10 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.327 0.133 18533
7243 1 10 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.099 0.141 18533
7244 1 10 . 1 1 101 101 LEU H H 100 7.780 7.780 7.749 0.031 18533
7245 1 10 . 1 1 102 102 GLY N N 101 105.740 105.740 104.446 1.294 18533
7246 1 10 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.727 0.302 18533
7247 1 10 . 1 1 102 102 GLY H H 101 7.700 7.700 7.598 0.102 18533
7248 1 10 . 1 1 103 103 VAL N N 102 122.330 122.330 119.509 2.821 18533
7249 1 10 . 1 1 103 103 VAL HA H 102 3.630 3.630 3.970 -0.340 18533
7250 1 10 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.414 1.186 18533
7251 1 10 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.041 -1.551 18533
7252 1 10 . 1 1 103 103 VAL H H 102 7.520 7.520 7.655 -0.135 18533
7253 1 10 . 1 1 104 104 GLU N N 103 128.990 128.990 113.973 15.017 18533
7254 1 10 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.399 -0.229 18533
7255 1 10 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.416 1.504 18533
7256 1 10 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.511 -3.561 18533
7257 1 10 . 1 1 104 104 GLU H H 103 9.210 9.210 7.902 1.308 18533
7258 1 10 . 1 1 105 105 ALA N N 104 124.410 124.410 122.394 2.016 18533
7259 1 10 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.359 -0.599 18533
7260 1 10 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.869 0.771 18533
7261 1 10 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.744 -0.604 18533
7262 1 10 . 1 1 105 105 ALA H H 104 8.500 8.500 8.657 -0.157 18533
7263 1 10 . 1 1 106 106 ALA N N 105 115.110 115.110 120.136 -5.026 18533
7264 1 10 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.149 -0.019 18533
7265 1 10 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.704 -0.664 18533
7266 1 10 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.552 0.508 18533
7267 1 10 . 1 1 106 106 ALA H H 105 8.270 8.270 8.312 -0.042 18533
7268 1 10 . 1 1 107 107 ARG N N 106 115.080 115.080 114.600 0.480 18533
7269 1 10 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.752 -0.292 18533
7270 1 10 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.889 -0.379 18533
7271 1 10 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.509 0.862 18533
7272 1 10 . 1 1 107 107 ARG H H 106 7.740 7.740 7.600 0.140 18533
7273 1 10 . 1 1 108 108 VAL N N 107 118.170 118.170 121.884 -3.714 18533
7274 1 10 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.350 0.720 18533
7275 1 10 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.169 -1.529 18533
7276 1 10 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.085 1.515 18533
7277 1 10 . 1 1 108 108 VAL H H 107 7.290 7.290 8.365 -1.075 18533
7278 1 10 . 1 1 109 109 ARG N N 108 124.250 124.250 128.225 -3.975 18533
7279 1 10 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.601 0.019 18533
7280 1 10 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.273 -1.383 18533
7281 1 10 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.140 0.840 18533
7282 1 10 . 1 1 109 109 ARG H H 108 8.420 8.420 9.209 -0.789 18533
7283 1 10 . 1 1 110 110 MET N N 109 119.570 119.570 122.118 -2.548 18533
7284 1 10 . 1 1 110 110 MET HA H 109 4.960 4.960 4.961 -0.001 18533
7285 1 10 . 1 1 110 110 MET CA C 109 53.820 53.820 54.483 -0.663 18533
7286 1 10 . 1 1 110 110 MET CB C 109 30.680 30.680 32.078 -1.398 18533
7287 1 10 . 1 1 110 110 MET H H 109 8.890 8.890 8.531 0.359 18533
7288 1 10 . 1 1 111 111 LEU N N 110 128.660 128.660 127.303 1.357 18533
7289 1 10 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.273 -0.313 18533
7290 1 10 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.966 0.634 18533
7291 1 10 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.918 -0.838 18533
7292 1 10 . 1 1 111 111 LEU H H 110 9.200 9.200 9.009 0.191 18533
7293 1 10 . 1 1 112 112 ARG N N 111 111.910 111.910 116.380 -4.470 18533
7294 1 10 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.074 -0.124 18533
7295 1 10 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.822 1.098 18533
7296 1 10 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.692 -1.192 18533
7297 1 10 . 1 1 112 112 ARG H H 111 8.930 8.930 8.680 0.250 18533
7298 1 10 . 1 1 113 113 SER N N 112 114.800 114.800 115.156 -0.356 18533
7299 1 10 . 1 1 113 113 SER HA H 112 4.290 4.290 4.302 -0.012 18533
7300 1 10 . 1 1 113 113 SER CA C 112 60.880 60.880 59.715 1.165 18533
7301 1 10 . 1 1 113 113 SER CB C 112 63.190 63.190 62.629 0.561 18533
7302 1 10 . 1 1 113 113 SER H H 112 7.680 7.680 7.736 -0.056 18533
7303 1 10 . 1 1 114 114 PHE N N 113 119.260 119.260 118.578 0.682 18533
7304 1 10 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.440 -0.090 18533
7305 1 10 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.238 0.692 18533
7306 1 10 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.778 -0.058 18533
7307 1 10 . 1 1 114 114 PHE H H 113 7.600 7.600 7.652 -0.052 18533
7308 1 10 . 1 1 115 115 ASP N N 114 121.170 121.170 121.447 -0.277 18533
7309 1 10 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.958 0.062 18533
7310 1 10 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.331 -1.231 18533
7311 1 10 . 1 1 115 115 ASP CB C 114 42.510 42.510 42.013 0.497 18533
7312 1 10 . 1 1 115 115 ASP H H 114 7.430 7.430 7.492 -0.062 18533
7313 1 10 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.414 0.076 18533
7314 1 10 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.285 0.065 18533
7315 1 10 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.246 0.024 18533
7316 1 10 . 1 1 117 117 ARG N N 116 117.910 117.910 117.883 0.027 18533
7317 1 10 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.400 -0.130 18533
7318 1 10 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.668 0.782 18533
7319 1 10 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.462 -0.502 18533
7320 1 10 . 1 1 117 117 ARG H H 116 8.580 8.580 8.014 0.566 18533
7321 1 10 . 1 1 118 118 SER N N 117 116.130 116.130 116.240 -0.110 18533
7322 1 10 . 1 1 118 118 SER HA H 117 3.980 3.980 4.344 -0.364 18533
7323 1 10 . 1 1 118 118 SER CA C 117 59.790 59.790 58.989 0.801 18533
7324 1 10 . 1 1 118 118 SER CB C 117 63.760 63.760 62.679 1.081 18533
7325 1 10 . 1 1 118 118 SER H H 117 7.950 7.950 7.406 0.544 18533
7326 1 10 . 1 1 119 119 GLY N N 118 110.080 110.080 113.746 -3.666 18533
7327 1 10 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.494 -1.124 18533
7328 1 10 . 1 1 119 119 GLY H H 118 8.150 8.150 8.402 -0.252 18533
7329 1 10 . 1 1 120 120 THR HA H 119 4.020 4.020 4.500 -0.480 18533
7330 1 10 . 1 1 120 120 THR CA C 119 63.290 63.290 60.130 3.160 18533
7331 1 10 . 1 1 120 120 THR CB C 119 69.140 69.140 70.882 -1.742 18533
7332 1 10 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.313 0.257 18533
7333 1 10 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.724 0.286 18533
7334 1 10 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.241 0.749 18533
7335 1 10 . 1 1 122 122 ALA N N 121 125.880 125.880 127.911 -2.031 18533
7336 1 10 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.384 -0.044 18533
7337 1 10 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.207 0.303 18533
7338 1 10 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.806 -0.206 18533
7339 1 10 . 1 1 122 122 ALA H H 121 7.980 7.980 8.762 -0.782 18533
7340 1 10 . 1 1 123 123 LEU N N 122 119.810 119.810 121.606 -1.796 18533
7341 1 10 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.466 -0.186 18533
7342 1 10 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.132 0.358 18533
7343 1 10 . 1 1 123 123 LEU CB C 122 43.700 43.700 40.938 2.762 18533
7344 1 10 . 1 1 123 123 LEU H H 122 7.810 7.810 8.102 -0.292 18533
7345 1 10 . 1 1 124 124 ASP N N 123 119.050 119.050 115.576 3.474 18533
7346 1 10 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.644 -0.074 18533
7347 1 10 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.560 1.760 18533
7348 1 10 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.276 -0.606 18533
7349 1 10 . 1 1 124 124 ASP H H 123 8.270 8.270 7.621 0.649 18533
7350 1 10 . 1 1 125 125 VAL N N 124 121.970 121.970 119.808 2.162 18533
7351 1 10 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.287 -0.027 18533
7352 1 10 . 1 1 125 125 VAL CA C 124 62.310 62.310 61.233 1.077 18533
7353 1 10 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.647 -2.866 18533
7354 1 10 . 1 1 125 125 VAL H H 124 7.930 7.930 7.925 0.005 18533
7355 1 10 . 1 1 126 126 GLU N N 125 129.490 129.490 125.034 4.456 18533
7356 1 10 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.093 -0.013 18533
7357 1 10 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.338 0.672 18533
7358 1 10 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.395 -0.595 18533
7359 1 10 . 1 1 126 126 GLU H H 125 9.100 9.100 8.578 0.522 18533
7360 1 10 . 1 1 127 127 ASP N N 126 122.300 122.300 119.323 2.977 18533
7361 1 10 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.833 -0.723 18533
7362 1 10 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.688 0.033 18533
7363 1 10 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.321 0.199 18533
7364 1 10 . 1 1 127 127 ASP H H 126 8.630 8.630 8.237 0.393 18533
7365 1 10 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.395 0.155 18533
7366 1 10 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.459 -0.859 18533
7367 1 10 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.791 -1.811 18533
7368 1 10 . 1 1 129 129 TYR N N 128 122.380 122.380 118.706 3.674 18533
7369 1 10 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.455 -0.654 18533
7370 1 10 . 1 1 129 129 TYR CA C 128 63.120 63.120 58.962 4.158 18533
7371 1 10 . 1 1 129 129 TYR CB C 128 39.390 39.390 41.373 -1.983 18533
7372 1 10 . 1 1 129 129 TYR H H 128 8.670 8.670 8.631 0.039 18533
7373 1 10 . 1 1 130 130 TYR N N 129 116.300 116.300 113.851 2.449 18533
7374 1 10 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.809 -0.319 18533
7375 1 10 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.229 1.251 18533
7376 1 10 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.712 -3.052 18533
7377 1 10 . 1 1 130 130 TYR H H 129 8.680 8.680 8.107 0.573 18533
7378 1 10 . 1 1 131 131 GLY N N 130 110.870 110.870 110.023 0.847 18533
7379 1 10 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.954 -0.874 18533
7380 1 10 . 1 1 131 131 GLY H H 130 8.060 8.060 8.275 -0.215 18533
7381 1 10 . 1 1 132 132 ASP N N 131 121.590 121.590 119.454 2.136 18533
7382 1 10 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.889 0.181 18533
7383 1 10 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.445 -0.445 18533
7384 1 10 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.849 0.750 18533
7385 1 10 . 1 1 132 132 ASP H H 131 9.290 9.290 8.248 1.042 18533
7386 1 10 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.111 0.999 18533
7387 1 10 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.704 1.866 18533
7388 1 10 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.072 0.408 18533
7389 1 10 . 1 1 134 134 SER N N 133 115.370 115.370 113.298 2.072 18533
7390 1 10 . 1 1 134 134 SER HA H 133 4.180 4.180 4.004 0.176 18533
7391 1 10 . 1 1 134 134 SER CA C 133 62.070 62.070 61.156 0.914 18533
7392 1 10 . 1 1 134 134 SER CB C 133 62.160 62.160 62.691 -0.531 18533
7393 1 10 . 1 1 134 134 SER H H 133 8.420 8.420 8.425 -0.005 18533
7394 1 10 . 1 1 135 135 ASP N N 134 123.360 123.360 122.164 1.196 18533
7395 1 10 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.440 0.090 18533
7396 1 10 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.274 0.766 18533
7397 1 10 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.852 -0.042 18533
7398 1 10 . 1 1 135 135 ASP H H 134 7.980 7.980 8.164 -0.184 18533
7399 1 10 . 1 1 136 136 PHE N N 135 118.940 118.940 117.041 1.899 18533
7400 1 10 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.424 -0.624 18533
7401 1 10 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.350 3.470 18533
7402 1 10 . 1 1 136 136 PHE CB C 135 39.350 39.350 37.553 1.797 18533
7403 1 10 . 1 1 136 136 PHE H H 135 7.850 7.850 7.433 0.417 18533
7404 1 10 . 1 1 137 137 GLU N N 136 121.410 121.410 120.667 0.743 18533
7405 1 10 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.211 -0.031 18533
7406 1 10 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.170 0.329 18533
7407 1 10 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.254 -0.264 18533
7408 1 10 . 1 1 137 137 GLU H H 136 8.150 8.150 7.829 0.321 18533
7409 1 10 . 1 1 138 138 GLU N N 137 121.530 121.530 121.134 0.396 18533
7410 1 10 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.123 0.167 18533
7411 1 10 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.621 -0.221 18533
7412 1 10 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.462 -0.572 18533
7413 1 10 . 1 1 138 138 GLU H H 137 7.870 7.870 8.064 -0.194 18533
7414 1 10 . 1 1 139 139 VAL N N 138 119.930 119.930 119.561 0.369 18533
7415 1 10 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.599 -0.119 18533
7416 1 10 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.380 0.700 18533
7417 1 10 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.600 -0.250 18533
7418 1 10 . 1 1 139 139 VAL H H 138 7.770 7.770 7.554 0.216 18533
7419 1 10 . 1 1 140 140 PHE N N 139 119.130 119.130 120.898 -1.768 18533
7420 1 10 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.100 -0.540 18533
7421 1 10 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.592 1.088 18533
7422 1 10 . 1 1 140 140 PHE CB C 139 39.170 39.170 39.014 0.156 18533
7423 1 10 . 1 1 140 140 PHE H H 139 8.050 8.050 7.736 0.314 18533
7424 1 10 . 1 1 141 141 ALA N N 140 121.040 121.040 121.771 -0.731 18533
7425 1 10 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.189 -0.199 18533
7426 1 10 . 1 1 141 141 ALA CA C 140 55.120 55.120 55.307 -0.187 18533
7427 1 10 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.077 0.223 18533
7428 1 10 . 1 1 141 141 ALA H H 140 8.010 8.010 7.878 0.132 18533
7429 1 10 . 1 1 142 142 VAL N N 141 118.550 118.550 119.045 -0.495 18533
7430 1 10 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.566 0.244 18533
7431 1 10 . 1 1 142 142 VAL CA C 141 65.600 65.600 67.086 -1.486 18533
7432 1 10 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.497 -0.047 18533
7433 1 10 . 1 1 142 142 VAL H H 141 8.300 8.300 7.732 0.568 18533
7434 1 10 . 1 1 143 143 ILE N N 142 121.410 121.410 119.146 2.264 18533
7435 1 10 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.432 -0.042 18533
7436 1 10 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.345 0.705 18533
7437 1 10 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.681 -0.371 18533
7438 1 10 . 1 1 143 143 ILE H H 142 8.150 8.150 7.841 0.309 18533
7439 1 10 . 1 1 144 144 GLU N N 143 119.630 119.630 119.138 0.492 18533
7440 1 10 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.785 -0.245 18533
7441 1 10 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.180 0.580 18533
7442 1 10 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.984 0.746 18533
7443 1 10 . 1 1 144 144 GLU H H 143 8.640 8.640 8.099 0.541 18533
7444 1 10 . 1 1 145 145 SER N N 144 110.920 110.920 114.025 -3.105 18533
7445 1 10 . 1 1 145 145 SER HA H 144 4.230 4.230 4.241 -0.011 18533
7446 1 10 . 1 1 145 145 SER CA C 144 60.810 60.810 60.693 0.117 18533
7447 1 10 . 1 1 145 145 SER CB C 144 63.610 63.610 63.456 0.154 18533
7448 1 10 . 1 1 145 145 SER H H 144 7.640 7.640 7.685 -0.045 18533
7449 1 10 . 1 1 146 146 ALA N N 145 123.110 123.110 124.289 -1.179 18533
7450 1 10 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.345 -0.225 18533
7451 1 10 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.076 -0.676 18533
7452 1 10 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.379 2.501 18533
7453 1 10 . 1 1 146 146 ALA H H 145 7.500 7.500 7.639 -0.139 18533
7454 1 10 . 1 1 147 147 LEU N N 146 114.220 114.220 119.813 -5.593 18533
7455 1 10 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.855 0.085 18533
7456 1 10 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.539 -0.490 18533
7457 1 10 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.404 0.056 18533
7458 1 10 . 1 1 147 147 LEU H H 146 7.410 7.410 8.124 -0.714 18533
7459 1 10 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.948 -0.498 18533
7460 1 10 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.582 3.258 18533
7461 1 10 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.361 -0.141 18533
7462 1 10 . 1 1 149 149 GLY N N 148 102.590 102.590 106.284 -3.694 18533
7463 1 10 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.254 2.006 18533
7464 1 10 . 1 1 149 149 GLY H H 148 7.960 7.960 7.774 0.186 18533
7465 1 10 . 1 1 150 150 LEU N N 149 128.060 128.060 124.170 3.890 18533
7466 1 10 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.254 0.376 18533
7467 1 10 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.271 0.079 18533
7468 1 10 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.419 -0.219 18533
7469 1 10 . 1 1 150 150 LEU H H 149 7.620 7.620 8.246 -0.626 18533
7470 1 10 . 1 1 151 151 HIS N N 150 120.730 120.730 117.837 2.893 18533
7471 1 10 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.022 0.148 18533
7472 1 10 . 1 1 151 151 HIS CA C 150 62.380 62.380 59.669 2.711 18533
7473 1 10 . 1 1 151 151 HIS CB C 150 30.510 30.510 28.832 1.678 18533
7474 1 10 . 1 1 151 151 HIS H H 150 8.430 8.430 8.500 -0.070 18533
7475 1 10 . 1 1 152 152 ASP N N 151 118.170 118.170 120.501 -2.331 18533
7476 1 10 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.051 0.369 18533
7477 1 10 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.823 -0.013 18533
7478 1 10 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.322 -0.292 18533
7479 1 10 . 1 1 152 152 ASP H H 151 7.820 7.820 7.601 0.219 18533
7480 1 10 . 1 1 153 153 TRP N N 152 122.780 122.780 122.026 0.754 18533
7481 1 10 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.647 -0.537 18533
7482 1 10 . 1 1 153 153 TRP CA C 152 62.610 62.610 60.543 2.067 18533
7483 1 10 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.141 -0.351 18533
7484 1 10 . 1 1 153 153 TRP H H 152 7.900 7.900 7.583 0.317 18533
7485 1 10 . 1 1 154 154 VAL N N 153 119.460 119.460 117.811 1.649 18533
7486 1 10 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.931 -0.581 18533
7487 1 10 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.100 0.880 18533
7488 1 10 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.015 0.885 18533
7489 1 10 . 1 1 154 154 VAL H H 153 8.560 8.560 8.644 -0.084 18533
7490 1 10 . 1 1 155 155 ASP N N 154 120.500 120.500 121.798 -1.298 18533
7491 1 10 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.348 -0.148 18533
7492 1 10 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.128 -0.558 18533
7493 1 10 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.465 -0.605 18533
7494 1 10 . 1 1 155 155 ASP H H 154 8.530 8.530 8.831 -0.301 18533
7495 1 10 . 1 1 156 156 GLU N N 155 120.090 120.090 119.701 0.389 18533
7496 1 10 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.896 0.034 18533
7497 1 10 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.318 -0.158 18533
7498 1 10 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.281 0.009 18533
7499 1 10 . 1 1 156 156 GLU H H 155 7.870 7.870 8.501 -0.631 18533
7500 1 10 . 1 1 157 157 ARG N N 156 119.230 119.230 119.055 0.175 18533
7501 1 10 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.015 -0.205 18533
7502 1 10 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.245 -0.255 18533
7503 1 10 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.359 -0.249 18533
7504 1 10 . 1 1 157 157 ARG H H 156 7.660 7.660 7.895 -0.235 18533
7505 1 10 . 1 1 158 158 LEU N N 157 118.790 118.790 116.476 2.314 18533
7506 1 10 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.174 -0.074 18533
7507 1 10 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.077 -0.397 18533
7508 1 10 . 1 1 158 158 LEU CB C 157 41.690 41.690 41.004 0.686 18533
7509 1 10 . 1 1 158 158 LEU H H 157 8.470 8.470 8.293 0.177 18533
7510 1 10 . 1 1 159 159 ALA N N 158 120.760 120.760 122.073 -1.313 18533
7511 1 10 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.155 0.035 18533
7512 1 10 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.216 -0.936 18533
7513 1 10 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.471 -1.081 18533
7514 1 10 . 1 1 159 159 ALA H H 158 7.490 7.490 7.843 -0.353 18533
7515 1 10 . 1 1 160 160 ARG N N 159 117.810 117.810 115.537 2.273 18533
7516 1 10 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.195 0.015 18533
7517 1 10 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.532 0.248 18533
7518 1 10 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.827 0.703 18533
7519 1 10 . 1 1 160 160 ARG H H 159 7.650 7.650 7.974 -0.324 18533
7520 1 10 . 1 1 161 161 ASN N N 160 118.560 118.560 120.367 -1.807 18533
7521 1 10 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.600 0.140 18533
7522 1 10 . 1 1 161 161 ASN CA C 160 53.250 53.250 52.107 1.143 18533
7523 1 10 . 1 1 161 161 ASN CB C 160 39.170 39.170 36.629 2.541 18533
7524 1 10 . 1 1 161 161 ASN H H 160 8.100 8.100 8.223 -0.123 18533
7525 1 10 . 1 1 162 162 GLY N N 161 108.900 108.900 108.770 0.130 18533
7526 1 10 . 1 1 162 162 GLY CA C 161 44.730 44.730 42.947 1.783 18533
7527 1 10 . 1 1 162 162 GLY H H 161 7.980 7.980 7.638 0.342 18533
7528 1 10 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.568 -0.108 18533
7529 1 10 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.525 -0.075 18533
7530 1 10 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.005 1.195 18533
7531 1 11 . 1 1 2 2 MET N N 1 119.850 119.850 117.918 1.932 18533
7532 1 11 . 1 1 2 2 MET HA H 1 4.500 4.500 4.162 0.338 18533
7533 1 11 . 1 1 2 2 MET CA C 1 55.450 55.450 56.012 -0.562 18533
7534 1 11 . 1 1 2 2 MET CB C 1 33.170 33.170 31.532 1.638 18533
7535 1 11 . 1 1 2 2 MET H H 1 8.140 8.140 8.394 -0.254 18533
7536 1 11 . 1 1 3 3 SER N N 2 117.000 117.000 112.755 4.245 18533
7537 1 11 . 1 1 3 3 SER HA H 2 4.430 4.430 4.803 -0.373 18533
7538 1 11 . 1 1 3 3 SER CA C 2 58.320 58.320 57.057 1.263 18533
7539 1 11 . 1 1 3 3 SER CB C 2 63.990 63.990 64.945 -0.955 18533
7540 1 11 . 1 1 3 3 SER H H 2 8.340 8.340 7.605 0.735 18533
7541 1 11 . 1 1 4 4 ASP N N 3 123.200 123.200 123.084 0.116 18533
7542 1 11 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.790 0.070 18533
7543 1 11 . 1 1 4 4 ASP CA C 3 52.880 52.880 53.211 -0.331 18533
7544 1 11 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.703 0.097 18533
7545 1 11 . 1 1 4 4 ASP H H 3 8.260 8.260 8.353 -0.093 18533
7546 1 11 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.338 0.062 18533
7547 1 11 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.426 0.394 18533
7548 1 11 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.740 -0.830 18533
7549 1 11 . 1 1 6 6 LEU N N 5 123.160 123.160 119.554 3.606 18533
7550 1 11 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.359 0.031 18533
7551 1 11 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.976 0.304 18533
7552 1 11 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.803 1.547 18533
7553 1 11 . 1 1 6 6 LEU H H 5 7.670 7.670 7.994 -0.324 18533
7554 1 11 . 1 1 7 7 HIS N N 6 127.160 127.160 118.926 8.234 18533
7555 1 11 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.152 0.878 18533
7556 1 11 . 1 1 7 7 HIS CA C 6 52.900 52.900 54.978 -2.078 18533
7557 1 11 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.388 0.742 18533
7558 1 11 . 1 1 7 7 HIS H H 6 10.080 10.080 8.729 1.351 18533
7559 1 11 . 1 1 8 8 VAL N N 7 128.620 128.620 126.753 1.867 18533
7560 1 11 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.601 -0.101 18533
7561 1 11 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.311 -0.511 18533
7562 1 11 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.062 3.738 18533
7563 1 11 . 1 1 8 8 VAL H H 7 8.930 8.930 8.568 0.362 18533
7564 1 11 . 1 1 9 9 THR N N 8 121.530 121.530 122.764 -1.234 18533
7565 1 11 . 1 1 9 9 THR HA H 8 5.270 5.270 4.607 0.663 18533
7566 1 11 . 1 1 9 9 THR CA C 8 58.520 58.520 58.993 -0.473 18533
7567 1 11 . 1 1 9 9 THR CB C 8 70.750 70.750 69.270 1.480 18533
7568 1 11 . 1 1 9 9 THR H H 8 7.970 7.970 9.060 -1.090 18533
7569 1 11 . 1 1 10 10 PHE N N 9 125.360 125.360 128.228 -2.868 18533
7570 1 11 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.002 0.208 18533
7571 1 11 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.988 0.322 18533
7572 1 11 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.373 3.457 18533
7573 1 11 . 1 1 10 10 PHE H H 9 8.180 8.180 8.354 -0.174 18533
7574 1 11 . 1 1 11 11 VAL N N 10 121.120 121.120 123.364 -2.244 18533
7575 1 11 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.397 -0.037 18533
7576 1 11 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.360 -0.940 18533
7577 1 11 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.118 2.432 18533
7578 1 11 . 1 1 11 11 VAL H H 10 8.710 8.710 9.289 -0.579 18533
7579 1 11 . 1 1 12 12 CYS N N 11 123.270 123.270 126.012 -2.742 18533
7580 1 11 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.440 -1.180 18533
7581 1 11 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.061 1.569 18533
7582 1 11 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.380 -1.030 18533
7583 1 11 . 1 1 12 12 CYS H H 11 7.940 7.940 8.539 -0.599 18533
7584 1 11 . 1 1 13 13 THR HA H 12 5.010 5.010 4.171 0.839 18533
7585 1 11 . 1 1 13 13 THR CA C 12 64.870 64.870 63.504 1.366 18533
7586 1 11 . 1 1 13 13 THR CB C 12 69.180 69.180 66.747 2.433 18533
7587 1 11 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.156 -0.196 18533
7588 1 11 . 1 1 15 15 ASN N N 14 119.960 119.960 116.559 3.401 18533
7589 1 11 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.392 -0.462 18533
7590 1 11 . 1 1 15 15 ASN CA C 14 54.870 54.870 53.997 0.873 18533
7591 1 11 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.378 3.292 18533
7592 1 11 . 1 1 15 15 ASN H H 14 9.280 9.280 8.593 0.687 18533
7593 1 11 . 1 1 16 16 ILE N N 15 101.060 101.060 110.983 -9.923 18533
7594 1 11 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.803 -0.123 18533
7595 1 11 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.973 0.817 18533
7596 1 11 . 1 1 16 16 ILE CB C 15 42.140 42.140 37.980 4.160 18533
7597 1 11 . 1 1 16 16 ILE H H 15 7.100 7.100 7.937 -0.837 18533
7598 1 11 . 1 1 17 17 CYS N N 16 116.020 116.020 117.941 -1.921 18533
7599 1 11 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.659 0.281 18533
7600 1 11 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.865 1.195 18533
7601 1 11 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.545 -0.595 18533
7602 1 11 . 1 1 17 17 CYS H H 16 7.700 7.700 7.888 -0.188 18533
7603 1 11 . 1 1 19 19 SER N N 18 122.340 122.340 115.599 6.741 18533
7604 1 11 . 1 1 19 19 SER HA H 18 3.810 3.810 4.246 -0.436 18533
7605 1 11 . 1 1 19 19 SER CA C 18 62.710 62.710 63.270 -0.560 18533
7606 1 11 . 1 1 19 19 SER CB C 18 64.860 64.860 61.370 3.490 18533
7607 1 11 . 1 1 19 19 SER H H 18 11.420 11.420 8.615 2.805 18533
7608 1 11 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.198 -0.228 18533
7609 1 11 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.881 0.149 18533
7610 1 11 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.820 -2.131 18533
7611 1 11 . 1 1 21 21 MET N N 20 112.430 112.430 118.565 -6.135 18533
7612 1 11 . 1 1 21 21 MET HA H 20 3.730 3.730 3.935 -0.205 18533
7613 1 11 . 1 1 21 21 MET CA C 20 60.160 60.160 59.533 0.627 18533
7614 1 11 . 1 1 21 21 MET CB C 20 33.040 33.040 32.093 0.948 18533
7615 1 11 . 1 1 21 21 MET H H 20 6.310 6.310 7.412 -1.102 18533
7616 1 11 . 1 1 22 22 ALA N N 21 117.800 117.800 119.703 -1.903 18533
7617 1 11 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.797 -0.397 18533
7618 1 11 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.489 0.501 18533
7619 1 11 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.636 -1.146 18533
7620 1 11 . 1 1 22 22 ALA H H 21 6.550 6.550 7.435 -0.885 18533
7621 1 11 . 1 1 23 23 GLU N N 22 115.520 115.520 118.591 -3.071 18533
7622 1 11 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.114 -0.434 18533
7623 1 11 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.746 -0.196 18533
7624 1 11 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.783 0.007 18533
7625 1 11 . 1 1 23 23 GLU H H 22 7.800 7.800 7.669 0.131 18533
7626 1 11 . 1 1 24 24 LYS N N 23 114.220 114.220 116.548 -2.328 18533
7627 1 11 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.152 -0.152 18533
7628 1 11 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.045 -0.285 18533
7629 1 11 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.301 -1.502 18533
7630 1 11 . 1 1 24 24 LYS H H 23 8.040 8.040 7.465 0.575 18533
7631 1 11 . 1 1 25 25 MET N N 24 115.250 115.250 119.318 -4.068 18533
7632 1 11 . 1 1 25 25 MET HA H 24 3.950 3.950 3.514 0.436 18533
7633 1 11 . 1 1 25 25 MET CA C 24 57.980 57.980 58.862 -0.882 18533
7634 1 11 . 1 1 25 25 MET CB C 24 35.500 35.500 32.224 3.276 18533
7635 1 11 . 1 1 25 25 MET H H 24 7.610 7.610 7.477 0.133 18533
7636 1 11 . 1 1 26 26 PHE N N 25 119.090 119.090 116.212 2.878 18533
7637 1 11 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.682 -0.342 18533
7638 1 11 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.087 -0.057 18533
7639 1 11 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.615 1.845 18533
7640 1 11 . 1 1 26 26 PHE H H 25 8.560 8.560 7.886 0.674 18533
7641 1 11 . 1 1 27 27 ALA N N 26 117.830 117.830 122.658 -4.828 18533
7642 1 11 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.589 0.341 18533
7643 1 11 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.066 0.994 18533
7644 1 11 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.843 0.567 18533
7645 1 11 . 1 1 27 27 ALA H H 26 8.800 8.800 7.205 1.595 18533
7646 1 11 . 1 1 28 28 GLN N N 27 117.550 117.550 118.443 -0.893 18533
7647 1 11 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.948 0.102 18533
7648 1 11 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.861 0.749 18533
7649 1 11 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.868 0.582 18533
7650 1 11 . 1 1 28 28 GLN H H 27 7.690 7.690 7.802 -0.112 18533
7651 1 11 . 1 1 29 29 GLN N N 28 117.530 117.530 119.843 -2.313 18533
7652 1 11 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.074 0.066 18533
7653 1 11 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.796 0.384 18533
7654 1 11 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.927 -0.817 18533
7655 1 11 . 1 1 29 29 GLN H H 28 8.210 8.210 7.541 0.669 18533
7656 1 11 . 1 1 30 30 LEU N N 29 119.330 119.330 120.116 -0.786 18533
7657 1 11 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.981 -0.051 18533
7658 1 11 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.845 0.235 18533
7659 1 11 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.368 0.532 18533
7660 1 11 . 1 1 30 30 LEU H H 29 8.540 8.540 8.367 0.173 18533
7661 1 11 . 1 1 31 31 ARG N N 30 120.880 120.880 118.071 2.809 18533
7662 1 11 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.061 -0.091 18533
7663 1 11 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.170 0.620 18533
7664 1 11 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.355 0.165 18533
7665 1 11 . 1 1 31 31 ARG H H 30 8.050 8.050 8.146 -0.096 18533
7666 1 11 . 1 1 32 32 HIS N N 31 119.770 119.770 118.245 1.525 18533
7667 1 11 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.426 0.124 18533
7668 1 11 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.250 -0.170 18533
7669 1 11 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.201 0.509 18533
7670 1 11 . 1 1 32 32 HIS H H 31 8.440 8.440 8.313 0.127 18533
7671 1 11 . 1 1 33 33 ARG N N 32 115.430 115.430 117.002 -1.572 18533
7672 1 11 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.480 0.110 18533
7673 1 11 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.064 -0.094 18533
7674 1 11 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.588 -0.368 18533
7675 1 11 . 1 1 33 33 ARG H H 32 7.500 7.500 7.768 -0.268 18533
7676 1 11 . 1 1 34 34 GLY N N 33 106.730 106.730 108.634 -1.904 18533
7677 1 11 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.127 1.073 18533
7678 1 11 . 1 1 34 34 GLY H H 33 7.750 7.750 8.216 -0.466 18533
7679 1 11 . 1 1 35 35 LEU N N 34 119.980 119.980 117.432 2.548 18533
7680 1 11 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.843 -0.163 18533
7681 1 11 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.664 0.486 18533
7682 1 11 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.332 0.858 18533
7683 1 11 . 1 1 35 35 LEU H H 34 7.980 7.980 8.499 -0.519 18533
7684 1 11 . 1 1 36 36 GLY N N 35 108.660 108.660 109.147 -0.487 18533
7685 1 11 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.702 -0.602 18533
7686 1 11 . 1 1 36 36 GLY H H 35 8.830 8.830 7.926 0.904 18533
7687 1 11 . 1 1 37 37 ASP N N 36 115.360 115.360 118.792 -3.432 18533
7688 1 11 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.651 0.119 18533
7689 1 11 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.150 -0.760 18533
7690 1 11 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.968 0.202 18533
7691 1 11 . 1 1 37 37 ASP H H 36 8.300 8.300 8.249 0.051 18533
7692 1 11 . 1 1 38 38 ALA N N 37 121.460 121.460 119.796 1.664 18533
7693 1 11 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.268 0.042 18533
7694 1 11 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.178 -0.228 18533
7695 1 11 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.402 0.448 18533
7696 1 11 . 1 1 38 38 ALA H H 37 7.380 7.380 7.731 -0.350 18533
7697 1 11 . 1 1 39 39 VAL N N 38 115.660 115.660 115.969 -0.309 18533
7698 1 11 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.522 0.278 18533
7699 1 11 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.025 0.015 18533
7700 1 11 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.259 0.931 18533
7701 1 11 . 1 1 39 39 VAL H H 38 7.100 7.100 7.740 -0.640 18533
7702 1 11 . 1 1 40 40 ARG N N 39 129.230 129.230 129.627 -0.397 18533
7703 1 11 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.554 -0.014 18533
7704 1 11 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.050 1.660 18533
7705 1 11 . 1 1 40 40 ARG CB C 39 32.320 32.320 29.019 3.301 18533
7706 1 11 . 1 1 40 40 ARG H H 39 9.730 9.730 8.516 1.214 18533
7707 1 11 . 1 1 41 41 VAL N N 40 126.240 126.240 124.893 1.347 18533
7708 1 11 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.737 0.953 18533
7709 1 11 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.002 -0.442 18533
7710 1 11 . 1 1 41 41 VAL CB C 40 33.940 33.940 32.755 1.185 18533
7711 1 11 . 1 1 41 41 VAL H H 40 8.610 8.610 8.092 0.518 18533
7712 1 11 . 1 1 42 42 THR N N 41 117.310 117.310 117.503 -0.193 18533
7713 1 11 . 1 1 42 42 THR HA H 41 4.890 4.890 4.749 0.141 18533
7714 1 11 . 1 1 42 42 THR CA C 41 60.300 60.300 60.118 0.182 18533
7715 1 11 . 1 1 42 42 THR CB C 41 73.890 73.890 71.689 2.201 18533
7716 1 11 . 1 1 42 42 THR H H 41 8.870 8.870 8.699 0.171 18533
7717 1 11 . 1 1 43 43 SER N N 42 109.960 109.960 113.368 -3.408 18533
7718 1 11 . 1 1 43 43 SER HA H 42 5.720 5.720 5.153 0.567 18533
7719 1 11 . 1 1 43 43 SER CA C 42 58.090 58.090 57.574 0.516 18533
7720 1 11 . 1 1 43 43 SER CB C 42 65.870 65.870 66.743 -0.873 18533
7721 1 11 . 1 1 43 43 SER H H 42 8.060 8.060 8.591 -0.531 18533
7722 1 11 . 1 1 44 44 ALA N N 43 119.200 119.200 120.207 -1.007 18533
7723 1 11 . 1 1 44 44 ALA HA H 43 4.260 4.260 4.978 -0.718 18533
7724 1 11 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.701 -0.521 18533
7725 1 11 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.160 -1.330 18533
7726 1 11 . 1 1 44 44 ALA H H 43 8.710 8.710 9.074 -0.364 18533
7727 1 11 . 1 1 45 45 GLY N N 44 104.090 104.090 106.929 -2.839 18533
7728 1 11 . 1 1 45 45 GLY CA C 44 42.540 42.540 43.953 -1.413 18533
7729 1 11 . 1 1 45 45 GLY H H 44 8.670 8.670 8.224 0.446 18533
7730 1 11 . 1 1 46 46 THR N N 45 114.060 114.060 116.663 -2.603 18533
7731 1 11 . 1 1 46 46 THR HA H 45 4.080 4.080 4.111 -0.031 18533
7732 1 11 . 1 1 46 46 THR CA C 45 64.680 64.680 64.753 -0.073 18533
7733 1 11 . 1 1 46 46 THR CB C 45 67.880 67.880 68.530 -0.650 18533
7734 1 11 . 1 1 46 46 THR H H 45 9.120 9.120 8.451 0.669 18533
7735 1 11 . 1 1 47 47 GLY N N 46 110.380 110.380 108.492 1.888 18533
7736 1 11 . 1 1 47 47 GLY CA C 46 43.830 43.830 44.029 -0.199 18533
7737 1 11 . 1 1 47 47 GLY H H 46 8.930 8.930 8.255 0.675 18533
7738 1 11 . 1 1 48 48 ASN N N 47 113.440 113.440 117.321 -3.881 18533
7739 1 11 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.326 0.164 18533
7740 1 11 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.225 -2.465 18533
7741 1 11 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.955 1.895 18533
7742 1 11 . 1 1 48 48 ASN H H 47 7.600 7.600 7.657 -0.057 18533
7743 1 11 . 1 1 49 49 TRP N N 48 117.300 117.300 121.360 -4.060 18533
7744 1 11 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.360 -0.460 18533
7745 1 11 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.341 0.519 18533
7746 1 11 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.066 -0.545 18533
7747 1 11 . 1 1 49 49 TRP H H 48 6.920 6.920 8.632 -1.712 18533
7748 1 11 . 1 1 50 50 HIS N N 49 111.590 111.590 114.927 -3.337 18533
7749 1 11 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.851 0.029 18533
7750 1 11 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.517 -1.657 18533
7751 1 11 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.845 1.195 18533
7752 1 11 . 1 1 50 50 HIS H H 49 8.620 8.620 8.328 0.292 18533
7753 1 11 . 1 1 51 51 VAL N N 50 119.010 119.010 120.614 -1.604 18533
7754 1 11 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.720 -0.520 18533
7755 1 11 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.664 1.016 18533
7756 1 11 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.796 -0.406 18533
7757 1 11 . 1 1 51 51 VAL H H 50 6.880 6.880 7.423 -0.543 18533
7758 1 11 . 1 1 52 52 GLY N N 51 115.450 115.450 116.388 -0.938 18533
7759 1 11 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.182 -0.242 18533
7760 1 11 . 1 1 52 52 GLY H H 51 9.120 9.120 8.933 0.187 18533
7761 1 11 . 1 1 53 53 SER N N 52 116.620 116.620 115.614 1.006 18533
7762 1 11 . 1 1 53 53 SER HA H 52 4.610 4.610 4.631 -0.021 18533
7763 1 11 . 1 1 53 53 SER CA C 52 59.310 59.310 58.026 1.284 18533
7764 1 11 . 1 1 53 53 SER CB C 52 64.630 64.630 65.172 -0.542 18533
7765 1 11 . 1 1 53 53 SER H H 52 8.430 8.430 7.952 0.478 18533
7766 1 11 . 1 1 54 54 CYS N N 53 118.690 118.690 117.490 1.200 18533
7767 1 11 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.100 0.000 18533
7768 1 11 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.136 1.534 18533
7769 1 11 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.133 -2.783 18533
7770 1 11 . 1 1 54 54 CYS H H 53 8.170 8.170 8.408 -0.238 18533
7771 1 11 . 1 1 55 55 ALA N N 54 118.580 118.580 124.487 -5.907 18533
7772 1 11 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.145 -0.025 18533
7773 1 11 . 1 1 55 55 ALA CA C 54 52.640 52.640 53.022 -0.382 18533
7774 1 11 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.195 -2.565 18533
7775 1 11 . 1 1 55 55 ALA H H 54 8.420 8.420 8.539 -0.119 18533
7776 1 11 . 1 1 56 56 ASP N N 55 121.500 121.500 123.623 -2.123 18533
7777 1 11 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.397 -0.057 18533
7778 1 11 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.744 0.306 18533
7779 1 11 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.869 3.191 18533
7780 1 11 . 1 1 56 56 ASP H H 55 8.470 8.470 8.508 -0.038 18533
7781 1 11 . 1 1 57 57 GLU N N 56 127.840 127.840 126.397 1.443 18533
7782 1 11 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.899 0.141 18533
7783 1 11 . 1 1 57 57 GLU CA C 56 59.640 59.640 58.986 0.654 18533
7784 1 11 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.314 0.186 18533
7785 1 11 . 1 1 57 57 GLU H H 56 9.230 9.230 8.830 0.400 18533
7786 1 11 . 1 1 58 58 ARG N N 57 120.820 120.820 119.633 1.187 18533
7787 1 11 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.721 0.089 18533
7788 1 11 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.683 -0.533 18533
7789 1 11 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.167 -1.897 18533
7790 1 11 . 1 1 58 58 ARG H H 57 9.220 9.220 9.198 0.022 18533
7791 1 11 . 1 1 59 59 ALA N N 58 121.590 121.590 121.448 0.142 18533
7792 1 11 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.139 0.021 18533
7793 1 11 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.415 0.365 18533
7794 1 11 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.089 0.401 18533
7795 1 11 . 1 1 59 59 ALA H H 58 6.680 6.680 7.544 -0.864 18533
7796 1 11 . 1 1 60 60 ALA N N 59 118.970 118.970 121.519 -2.549 18533
7797 1 11 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.952 -0.092 18533
7798 1 11 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.268 -0.248 18533
7799 1 11 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.317 -0.247 18533
7800 1 11 . 1 1 60 60 ALA H H 59 8.540 8.540 8.319 0.221 18533
7801 1 11 . 1 1 61 61 GLY N N 60 104.160 104.160 106.692 -2.532 18533
7802 1 11 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.979 0.291 18533
7803 1 11 . 1 1 61 61 GLY H H 60 8.210 8.210 7.738 0.472 18533
7804 1 11 . 1 1 62 62 VAL N N 61 122.820 122.820 123.279 -0.459 18533
7805 1 11 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.690 0.160 18533
7806 1 11 . 1 1 62 62 VAL CA C 61 66.250 66.250 67.005 -0.755 18533
7807 1 11 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.775 0.115 18533
7808 1 11 . 1 1 62 62 VAL H H 61 7.310 7.310 7.617 -0.307 18533
7809 1 11 . 1 1 63 63 LEU N N 62 120.310 120.310 118.712 1.598 18533
7810 1 11 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.218 -0.238 18533
7811 1 11 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.249 0.701 18533
7812 1 11 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.368 0.132 18533
7813 1 11 . 1 1 63 63 LEU H H 62 8.090 8.090 8.467 -0.377 18533
7814 1 11 . 1 1 64 64 ARG N N 63 119.440 119.440 119.319 0.121 18533
7815 1 11 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.295 -0.115 18533
7816 1 11 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.861 0.589 18533
7817 1 11 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.597 0.783 18533
7818 1 11 . 1 1 64 64 ARG H H 63 8.740 8.740 8.484 0.256 18533
7819 1 11 . 1 1 65 65 ALA N N 64 122.560 122.560 121.737 0.823 18533
7820 1 11 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.112 -0.082 18533
7821 1 11 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.147 0.393 18533
7822 1 11 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.317 -0.237 18533
7823 1 11 . 1 1 65 65 ALA H H 64 7.910 7.910 7.902 0.008 18533
7824 1 11 . 1 1 66 66 HIS N N 65 112.690 112.690 115.008 -2.318 18533
7825 1 11 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.685 -0.045 18533
7826 1 11 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.048 -0.548 18533
7827 1 11 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.094 0.226 18533
7828 1 11 . 1 1 66 66 HIS H H 65 7.410 7.410 7.962 -0.552 18533
7829 1 11 . 1 1 67 67 GLY N N 66 107.440 107.440 106.378 1.062 18533
7830 1 11 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.121 1.239 18533
7831 1 11 . 1 1 67 67 GLY H H 66 7.850 7.850 7.539 0.311 18533
7832 1 11 . 1 1 68 68 TYR N N 67 119.940 119.940 121.387 -1.447 18533
7833 1 11 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.804 -0.004 18533
7834 1 11 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.177 0.923 18533
7835 1 11 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.846 1.014 18533
7836 1 11 . 1 1 68 68 TYR H H 67 8.380 8.380 8.318 0.062 18533
7837 1 11 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.537 0.023 18533
7838 1 11 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.775 -0.175 18533
7839 1 11 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.776 0.034 18533
7840 1 11 . 1 1 70 70 THR N N 69 100.660 100.660 105.501 -4.841 18533
7841 1 11 . 1 1 70 70 THR HA H 69 4.300 4.300 4.390 -0.090 18533
7842 1 11 . 1 1 70 70 THR CA C 69 61.250 61.250 61.720 -0.470 18533
7843 1 11 . 1 1 70 70 THR CB C 69 70.740 70.740 69.605 1.135 18533
7844 1 11 . 1 1 70 70 THR H H 69 7.860 7.860 8.014 -0.154 18533
7845 1 11 . 1 1 71 71 ASP N N 70 122.880 122.880 123.427 -0.547 18533
7846 1 11 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.592 -0.182 18533
7847 1 11 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.176 0.694 18533
7848 1 11 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.419 -0.449 18533
7849 1 11 . 1 1 71 71 ASP H H 70 7.940 7.940 8.037 -0.097 18533
7850 1 11 . 1 1 72 72 HIS N N 71 121.720 121.720 123.975 -2.255 18533
7851 1 11 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.729 -0.029 18533
7852 1 11 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.105 1.285 18533
7853 1 11 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.357 2.983 18533
7854 1 11 . 1 1 72 72 HIS H H 71 8.000 8.000 8.062 -0.062 18533
7855 1 11 . 1 1 73 73 ARG N N 72 125.760 125.760 125.785 -0.025 18533
7856 1 11 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.040 -0.750 18533
7857 1 11 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.060 0.370 18533
7858 1 11 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.067 0.243 18533
7859 1 11 . 1 1 73 73 ARG H H 72 7.230 7.230 8.108 -0.878 18533
7860 1 11 . 1 1 74 74 ALA N N 73 127.970 127.970 128.980 -1.010 18533
7861 1 11 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.157 0.473 18533
7862 1 11 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.797 -0.617 18533
7863 1 11 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.093 -1.194 18533
7864 1 11 . 1 1 74 74 ALA H H 73 9.090 9.090 8.051 1.039 18533
7865 1 11 . 1 1 75 75 ALA N N 74 126.090 126.090 124.745 1.345 18533
7866 1 11 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.784 0.006 18533
7867 1 11 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.513 0.457 18533
7868 1 11 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.907 1.712 18533
7869 1 11 . 1 1 75 75 ALA H H 74 9.410 9.410 8.328 1.082 18533
7870 1 11 . 1 1 76 76 GLN N N 75 123.260 123.260 119.280 3.980 18533
7871 1 11 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.696 0.254 18533
7872 1 11 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.724 -0.173 18533
7873 1 11 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.450 -1.400 18533
7874 1 11 . 1 1 76 76 GLN H H 75 8.800 8.800 8.376 0.424 18533
7875 1 11 . 1 1 77 77 VAL N N 76 125.510 125.510 123.257 2.253 18533
7876 1 11 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.489 -0.189 18533
7877 1 11 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.450 0.130 18533
7878 1 11 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.895 1.595 18533
7879 1 11 . 1 1 77 77 VAL H H 76 8.550 8.550 7.996 0.554 18533
7880 1 11 . 1 1 78 78 GLY N N 77 121.850 121.850 115.921 5.929 18533
7881 1 11 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.106 -0.266 18533
7882 1 11 . 1 1 78 78 GLY H H 77 10.930 10.930 7.953 2.977 18533
7883 1 11 . 1 1 79 79 THR N N 78 115.210 115.210 116.358 -1.148 18533
7884 1 11 . 1 1 79 79 THR HA H 78 3.700 3.700 4.000 -0.300 18533
7885 1 11 . 1 1 79 79 THR CA C 78 66.440 66.440 67.252 -0.812 18533
7886 1 11 . 1 1 79 79 THR CB C 78 68.770 68.770 68.620 0.150 18533
7887 1 11 . 1 1 79 79 THR H H 78 8.540 8.540 8.449 0.091 18533
7888 1 11 . 1 1 80 80 GLU N N 79 119.360 119.360 119.481 -0.121 18533
7889 1 11 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.021 -0.061 18533
7890 1 11 . 1 1 80 80 GLU CA C 79 59.030 59.030 59.099 -0.069 18533
7891 1 11 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.430 0.630 18533
7892 1 11 . 1 1 80 80 GLU H H 79 9.110 9.110 8.952 0.158 18533
7893 1 11 . 1 1 81 81 HIS N N 80 118.380 118.380 117.219 1.161 18533
7894 1 11 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.251 -0.311 18533
7895 1 11 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.898 1.522 18533
7896 1 11 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.080 0.850 18533
7897 1 11 . 1 1 81 81 HIS H H 80 7.040 7.040 7.449 -0.409 18533
7898 1 11 . 1 1 82 82 LEU N N 81 114.010 114.010 119.144 -5.134 18533
7899 1 11 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.069 -0.169 18533
7900 1 11 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.829 -0.149 18533
7901 1 11 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.573 -0.843 18533
7902 1 11 . 1 1 82 82 LEU H H 81 7.850 7.850 8.297 -0.447 18533
7903 1 11 . 1 1 83 83 ALA N N 82 119.050 119.050 118.331 0.719 18533
7904 1 11 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.347 0.043 18533
7905 1 11 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.879 -0.679 18533
7906 1 11 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.755 0.425 18533
7907 1 11 . 1 1 83 83 ALA H H 82 6.950 6.950 7.363 -0.413 18533
7908 1 11 . 1 1 84 84 ALA N N 83 122.500 122.500 121.828 0.672 18533
7909 1 11 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.283 -0.523 18533
7910 1 11 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.008 1.342 18533
7911 1 11 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.399 -2.079 18533
7912 1 11 . 1 1 84 84 ALA H H 83 7.280 7.280 7.351 -0.071 18533
7913 1 11 . 1 1 85 85 ASP N N 84 118.740 118.740 119.927 -1.187 18533
7914 1 11 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.664 -0.254 18533
7915 1 11 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.398 1.242 18533
7916 1 11 . 1 1 85 85 ASP CB C 84 42.900 42.900 41.772 1.128 18533
7917 1 11 . 1 1 85 85 ASP H H 84 8.440 8.440 8.780 -0.340 18533
7918 1 11 . 1 1 86 86 LEU N N 85 115.180 115.180 118.134 -2.954 18533
7919 1 11 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.987 -0.807 18533
7920 1 11 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.772 1.268 18533
7921 1 11 . 1 1 86 86 LEU CB C 85 45.170 45.170 45.066 0.104 18533
7922 1 11 . 1 1 86 86 LEU H H 85 7.280 7.280 8.030 -0.750 18533
7923 1 11 . 1 1 87 87 LEU N N 86 128.140 128.140 126.974 1.166 18533
7924 1 11 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.994 -0.304 18533
7925 1 11 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.654 1.726 18533
7926 1 11 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.545 -0.375 18533
7927 1 11 . 1 1 87 87 LEU H H 86 8.780 8.780 9.155 -0.375 18533
7928 1 11 . 1 1 88 88 VAL N N 87 122.630 122.630 126.884 -4.254 18533
7929 1 11 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.933 -0.303 18533
7930 1 11 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.874 -1.964 18533
7931 1 11 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.769 -0.929 18533
7932 1 11 . 1 1 88 88 VAL H H 87 9.010 9.010 9.102 -0.092 18533
7933 1 11 . 1 1 89 89 ALA N N 88 129.820 129.820 131.046 -1.226 18533
7934 1 11 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.945 -0.425 18533
7935 1 11 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.236 -0.456 18533
7936 1 11 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.184 -0.404 18533
7937 1 11 . 1 1 89 89 ALA H H 88 8.590 8.590 8.947 -0.357 18533
7938 1 11 . 1 1 90 90 LEU N N 89 129.280 129.280 120.075 9.205 18533
7939 1 11 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.571 -0.261 18533
7940 1 11 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.908 0.542 18533
7941 1 11 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.995 -3.975 18533
7942 1 11 . 1 1 90 90 LEU H H 89 8.570 8.570 8.553 0.017 18533
7943 1 11 . 1 1 91 91 ASP N N 90 126.910 126.910 116.482 10.428 18533
7944 1 11 . 1 1 91 91 ASP HA H 90 4.800 4.800 5.089 -0.289 18533
7945 1 11 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.214 -0.264 18533
7946 1 11 . 1 1 91 91 ASP CB C 90 43.810 43.810 44.135 -0.325 18533
7947 1 11 . 1 1 91 91 ASP H H 90 11.450 11.450 7.513 3.937 18533
7948 1 11 . 1 1 92 92 ARG N N 91 116.950 116.950 121.166 -4.216 18533
7949 1 11 . 1 1 92 92 ARG HA H 91 4.020 4.020 4.073 -0.053 18533
7950 1 11 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.261 -0.431 18533
7951 1 11 . 1 1 92 92 ARG CB C 91 30.280 30.280 30.059 0.221 18533
7952 1 11 . 1 1 92 92 ARG H H 91 8.650 8.650 9.416 -0.766 18533
7953 1 11 . 1 1 93 93 ASN N N 92 120.740 120.740 118.702 2.038 18533
7954 1 11 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.555 -0.175 18533
7955 1 11 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.920 0.210 18533
7956 1 11 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.514 0.106 18533
7957 1 11 . 1 1 93 93 ASN H H 92 8.610 8.610 8.101 0.509 18533
7958 1 11 . 1 1 94 94 HIS N N 93 121.170 121.170 119.762 1.408 18533
7959 1 11 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.297 -0.107 18533
7960 1 11 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.131 0.379 18533
7961 1 11 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.576 1.804 18533
7962 1 11 . 1 1 94 94 HIS H H 93 7.430 7.430 7.738 -0.308 18533
7963 1 11 . 1 1 95 95 ALA N N 94 118.270 118.270 121.189 -2.919 18533
7964 1 11 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.967 -0.227 18533
7965 1 11 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.480 0.020 18533
7966 1 11 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.319 -0.349 18533
7967 1 11 . 1 1 95 95 ALA H H 94 7.190 7.190 8.109 -0.919 18533
7968 1 11 . 1 1 96 96 ARG N N 95 117.190 117.190 119.346 -2.156 18533
7969 1 11 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.040 -0.130 18533
7970 1 11 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.318 0.182 18533
7971 1 11 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.035 0.195 18533
7972 1 11 . 1 1 96 96 ARG H H 95 7.600 7.600 7.632 -0.032 18533
7973 1 11 . 1 1 97 97 LEU N N 96 120.700 120.700 119.607 1.093 18533
7974 1 11 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.972 0.108 18533
7975 1 11 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.721 0.180 18533
7976 1 11 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.718 -0.378 18533
7977 1 11 . 1 1 97 97 LEU H H 96 7.990 7.990 7.966 0.024 18533
7978 1 11 . 1 1 98 98 LEU N N 97 118.390 118.390 118.455 -0.065 18533
7979 1 11 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.836 0.074 18533
7980 1 11 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.192 -0.092 18533
7981 1 11 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.358 0.532 18533
7982 1 11 . 1 1 98 98 LEU H H 97 8.210 8.210 8.243 -0.033 18533
7983 1 11 . 1 1 99 99 ARG N N 98 117.470 117.470 117.781 -0.311 18533
7984 1 11 . 1 1 99 99 ARG HA H 98 4.480 4.480 3.925 0.555 18533
7985 1 11 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.069 -0.709 18533
7986 1 11 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.709 -0.969 18533
7987 1 11 . 1 1 99 99 ARG H H 98 7.740 7.740 7.838 -0.098 18533
7988 1 11 . 1 1 100 100 GLN N N 99 121.400 121.400 118.347 3.053 18533
7989 1 11 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.197 -0.127 18533
7990 1 11 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.150 0.530 18533
7991 1 11 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.243 0.077 18533
7992 1 11 . 1 1 100 100 GLN H H 99 8.030 8.030 7.937 0.093 18533
7993 1 11 . 1 1 101 101 LEU N N 100 118.940 118.940 117.514 1.426 18533
7994 1 11 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.166 0.094 18533
7995 1 11 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.276 0.184 18533
7996 1 11 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.015 0.225 18533
7997 1 11 . 1 1 101 101 LEU H H 100 7.780 7.780 7.864 -0.084 18533
7998 1 11 . 1 1 102 102 GLY N N 101 105.740 105.740 104.432 1.308 18533
7999 1 11 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.967 0.063 18533
8000 1 11 . 1 1 102 102 GLY H H 101 7.700 7.700 7.672 0.028 18533
8001 1 11 . 1 1 103 103 VAL N N 102 122.330 122.330 120.121 2.209 18533
8002 1 11 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.026 -0.396 18533
8003 1 11 . 1 1 103 103 VAL CA C 102 63.600 63.600 61.848 1.752 18533
8004 1 11 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.119 -1.629 18533
8005 1 11 . 1 1 103 103 VAL H H 102 7.520 7.520 7.463 0.057 18533
8006 1 11 . 1 1 104 104 GLU N N 103 128.990 128.990 114.650 14.340 18533
8007 1 11 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.439 -0.269 18533
8008 1 11 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.233 1.687 18533
8009 1 11 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.566 -3.616 18533
8010 1 11 . 1 1 104 104 GLU H H 103 9.210 9.210 7.910 1.300 18533
8011 1 11 . 1 1 105 105 ALA N N 104 124.410 124.410 122.002 2.408 18533
8012 1 11 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.253 -0.493 18533
8013 1 11 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.831 0.809 18533
8014 1 11 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.668 -0.528 18533
8015 1 11 . 1 1 105 105 ALA H H 104 8.500 8.500 8.732 -0.232 18533
8016 1 11 . 1 1 106 106 ALA N N 105 115.110 115.110 120.466 -5.356 18533
8017 1 11 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.167 -0.037 18533
8018 1 11 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.864 -0.824 18533
8019 1 11 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.553 0.507 18533
8020 1 11 . 1 1 106 106 ALA H H 105 8.270 8.270 8.205 0.065 18533
8021 1 11 . 1 1 107 107 ARG N N 106 115.080 115.080 114.521 0.559 18533
8022 1 11 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.851 -0.391 18533
8023 1 11 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.879 -0.369 18533
8024 1 11 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.707 0.663 18533
8025 1 11 . 1 1 107 107 ARG H H 106 7.740 7.740 7.606 0.134 18533
8026 1 11 . 1 1 108 108 VAL N N 107 118.170 118.170 122.267 -4.097 18533
8027 1 11 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.184 0.886 18533
8028 1 11 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.191 -1.551 18533
8029 1 11 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.500 1.100 18533
8030 1 11 . 1 1 108 108 VAL H H 107 7.290 7.290 8.046 -0.756 18533
8031 1 11 . 1 1 109 109 ARG N N 108 124.250 124.250 128.714 -4.464 18533
8032 1 11 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.625 -0.005 18533
8033 1 11 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.466 -0.576 18533
8034 1 11 . 1 1 109 109 ARG CB C 108 34.980 34.980 33.679 1.300 18533
8035 1 11 . 1 1 109 109 ARG H H 108 8.420 8.420 9.153 -0.733 18533
8036 1 11 . 1 1 110 110 MET N N 109 119.570 119.570 121.842 -2.272 18533
8037 1 11 . 1 1 110 110 MET HA H 109 4.960 4.960 4.741 0.219 18533
8038 1 11 . 1 1 110 110 MET CA C 109 53.820 53.820 54.072 -0.251 18533
8039 1 11 . 1 1 110 110 MET CB C 109 30.680 30.680 32.170 -1.490 18533
8040 1 11 . 1 1 110 110 MET H H 109 8.890 8.890 8.613 0.277 18533
8041 1 11 . 1 1 111 111 LEU N N 110 128.660 128.660 126.938 1.722 18533
8042 1 11 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.275 -0.315 18533
8043 1 11 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.993 0.607 18533
8044 1 11 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.869 -0.789 18533
8045 1 11 . 1 1 111 111 LEU H H 110 9.200 9.200 9.005 0.195 18533
8046 1 11 . 1 1 112 112 ARG N N 111 111.910 111.910 115.962 -4.052 18533
8047 1 11 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.096 -0.146 18533
8048 1 11 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.472 1.448 18533
8049 1 11 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.662 -1.161 18533
8050 1 11 . 1 1 112 112 ARG H H 111 8.930 8.930 8.620 0.310 18533
8051 1 11 . 1 1 113 113 SER N N 112 114.800 114.800 115.572 -0.772 18533
8052 1 11 . 1 1 113 113 SER HA H 112 4.290 4.290 4.281 0.009 18533
8053 1 11 . 1 1 113 113 SER CA C 112 60.880 60.880 59.638 1.242 18533
8054 1 11 . 1 1 113 113 SER CB C 112 63.190 63.190 62.590 0.600 18533
8055 1 11 . 1 1 113 113 SER H H 112 7.680 7.680 7.670 0.010 18533
8056 1 11 . 1 1 114 114 PHE N N 113 119.260 119.260 118.881 0.379 18533
8057 1 11 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.384 -0.034 18533
8058 1 11 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.157 0.773 18533
8059 1 11 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.421 0.299 18533
8060 1 11 . 1 1 114 114 PHE H H 113 7.600 7.600 7.531 0.069 18533
8061 1 11 . 1 1 115 115 ASP N N 114 121.170 121.170 121.578 -0.408 18533
8062 1 11 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.895 0.125 18533
8063 1 11 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.593 -1.493 18533
8064 1 11 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.791 0.719 18533
8065 1 11 . 1 1 115 115 ASP H H 114 7.430 7.430 7.451 -0.021 18533
8066 1 11 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.371 0.119 18533
8067 1 11 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.528 -0.178 18533
8068 1 11 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.217 0.053 18533
8069 1 11 . 1 1 117 117 ARG N N 116 117.910 117.910 117.649 0.261 18533
8070 1 11 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.403 -0.133 18533
8071 1 11 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.596 0.854 18533
8072 1 11 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.299 -0.339 18533
8073 1 11 . 1 1 117 117 ARG H H 116 8.580 8.580 8.244 0.336 18533
8074 1 11 . 1 1 118 118 SER N N 117 116.130 116.130 116.221 -0.091 18533
8075 1 11 . 1 1 118 118 SER HA H 117 3.980 3.980 4.334 -0.354 18533
8076 1 11 . 1 1 118 118 SER CA C 117 59.790 59.790 59.050 0.740 18533
8077 1 11 . 1 1 118 118 SER CB C 117 63.760 63.760 62.564 1.196 18533
8078 1 11 . 1 1 118 118 SER H H 117 7.950 7.950 7.458 0.492 18533
8079 1 11 . 1 1 119 119 GLY N N 118 110.080 110.080 113.498 -3.418 18533
8080 1 11 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.109 -0.739 18533
8081 1 11 . 1 1 119 119 GLY H H 118 8.150 8.150 8.395 -0.245 18533
8082 1 11 . 1 1 120 120 THR HA H 119 4.020 4.020 4.508 -0.488 18533
8083 1 11 . 1 1 120 120 THR CA C 119 63.290 63.290 60.592 2.698 18533
8084 1 11 . 1 1 120 120 THR CB C 119 69.140 69.140 71.035 -1.895 18533
8085 1 11 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.434 0.136 18533
8086 1 11 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.850 0.160 18533
8087 1 11 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.450 0.540 18533
8088 1 11 . 1 1 122 122 ALA N N 121 125.880 125.880 127.779 -1.899 18533
8089 1 11 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.419 -0.079 18533
8090 1 11 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.321 0.189 18533
8091 1 11 . 1 1 122 122 ALA CB C 121 18.600 18.600 19.226 -0.626 18533
8092 1 11 . 1 1 122 122 ALA H H 121 7.980 7.980 8.647 -0.667 18533
8093 1 11 . 1 1 123 123 LEU N N 122 119.810 119.810 121.691 -1.881 18533
8094 1 11 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.497 -0.217 18533
8095 1 11 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.263 0.227 18533
8096 1 11 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.677 2.023 18533
8097 1 11 . 1 1 123 123 LEU H H 122 7.810 7.810 8.396 -0.586 18533
8098 1 11 . 1 1 124 124 ASP N N 123 119.050 119.050 115.952 3.098 18533
8099 1 11 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.657 -0.087 18533
8100 1 11 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.665 1.655 18533
8101 1 11 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.935 -1.265 18533
8102 1 11 . 1 1 124 124 ASP H H 123 8.270 8.270 7.551 0.719 18533
8103 1 11 . 1 1 125 125 VAL N N 124 121.970 121.970 121.653 0.317 18533
8104 1 11 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.386 -0.126 18533
8105 1 11 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.302 2.008 18533
8106 1 11 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.873 -3.093 18533
8107 1 11 . 1 1 125 125 VAL H H 124 7.930 7.930 8.015 -0.086 18533
8108 1 11 . 1 1 126 126 GLU N N 125 129.490 129.490 125.115 4.375 18533
8109 1 11 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.147 -0.067 18533
8110 1 11 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.212 0.798 18533
8111 1 11 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.330 -0.530 18533
8112 1 11 . 1 1 126 126 GLU H H 125 9.100 9.100 8.504 0.596 18533
8113 1 11 . 1 1 127 127 ASP N N 126 122.300 122.300 118.397 3.903 18533
8114 1 11 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.830 -0.720 18533
8115 1 11 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.514 0.206 18533
8116 1 11 . 1 1 127 127 ASP CB C 126 42.520 42.520 41.701 0.819 18533
8117 1 11 . 1 1 127 127 ASP H H 126 8.630 8.630 8.405 0.225 18533
8118 1 11 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.585 -0.035 18533
8119 1 11 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.574 0.026 18533
8120 1 11 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.491 -1.511 18533
8121 1 11 . 1 1 129 129 TYR N N 128 122.380 122.380 119.659 2.721 18533
8122 1 11 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.235 -0.435 18533
8123 1 11 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.881 3.239 18533
8124 1 11 . 1 1 129 129 TYR CB C 128 39.390 39.390 38.792 0.598 18533
8125 1 11 . 1 1 129 129 TYR H H 128 8.670 8.670 8.466 0.204 18533
8126 1 11 . 1 1 130 130 TYR N N 129 116.300 116.300 114.136 2.164 18533
8127 1 11 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.581 -0.091 18533
8128 1 11 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.739 1.741 18533
8129 1 11 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.381 -1.721 18533
8130 1 11 . 1 1 130 130 TYR H H 129 8.680 8.680 7.622 1.058 18533
8131 1 11 . 1 1 131 131 GLY N N 130 110.870 110.870 111.005 -0.135 18533
8132 1 11 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.838 -0.758 18533
8133 1 11 . 1 1 131 131 GLY H H 130 8.060 8.060 8.355 -0.295 18533
8134 1 11 . 1 1 132 132 ASP N N 131 121.590 121.590 118.971 2.619 18533
8135 1 11 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.597 0.473 18533
8136 1 11 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.020 -0.020 18533
8137 1 11 . 1 1 132 132 ASP CB C 131 43.600 43.600 41.940 1.660 18533
8138 1 11 . 1 1 132 132 ASP H H 131 9.290 9.290 7.989 1.301 18533
8139 1 11 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.964 0.146 18533
8140 1 11 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.468 2.102 18533
8141 1 11 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.218 0.262 18533
8142 1 11 . 1 1 134 134 SER N N 133 115.370 115.370 113.320 2.050 18533
8143 1 11 . 1 1 134 134 SER HA H 133 4.180 4.180 3.983 0.197 18533
8144 1 11 . 1 1 134 134 SER CA C 133 62.070 62.070 61.876 0.194 18533
8145 1 11 . 1 1 134 134 SER CB C 133 62.160 62.160 62.875 -0.715 18533
8146 1 11 . 1 1 134 134 SER H H 133 8.420 8.420 8.305 0.115 18533
8147 1 11 . 1 1 135 135 ASP N N 134 123.360 123.360 122.363 0.997 18533
8148 1 11 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.384 0.146 18533
8149 1 11 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.888 1.152 18533
8150 1 11 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.381 0.429 18533
8151 1 11 . 1 1 135 135 ASP H H 134 7.980 7.980 7.603 0.377 18533
8152 1 11 . 1 1 136 136 PHE N N 135 118.940 118.940 118.570 0.370 18533
8153 1 11 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.316 -0.516 18533
8154 1 11 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.437 3.383 18533
8155 1 11 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.034 1.316 18533
8156 1 11 . 1 1 136 136 PHE H H 135 7.850 7.850 7.164 0.686 18533
8157 1 11 . 1 1 137 137 GLU N N 136 121.410 121.410 118.772 2.638 18533
8158 1 11 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.055 0.125 18533
8159 1 11 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.081 0.419 18533
8160 1 11 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.047 -0.058 18533
8161 1 11 . 1 1 137 137 GLU H H 136 8.150 8.150 7.913 0.237 18533
8162 1 11 . 1 1 138 138 GLU N N 137 121.530 121.530 121.477 0.053 18533
8163 1 11 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.073 0.217 18533
8164 1 11 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.712 -0.312 18533
8165 1 11 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.568 -0.678 18533
8166 1 11 . 1 1 138 138 GLU H H 137 7.870 7.870 8.180 -0.310 18533
8167 1 11 . 1 1 139 139 VAL N N 138 119.930 119.930 119.561 0.369 18533
8168 1 11 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.675 -0.195 18533
8169 1 11 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.657 0.423 18533
8170 1 11 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.516 -0.166 18533
8171 1 11 . 1 1 139 139 VAL H H 138 7.770 7.770 7.939 -0.169 18533
8172 1 11 . 1 1 140 140 PHE N N 139 119.130 119.130 121.248 -2.118 18533
8173 1 11 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.943 -0.383 18533
8174 1 11 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.661 1.019 18533
8175 1 11 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.642 0.528 18533
8176 1 11 . 1 1 140 140 PHE H H 139 8.050 8.050 8.079 -0.029 18533
8177 1 11 . 1 1 141 141 ALA N N 140 121.040 121.040 122.106 -1.066 18533
8178 1 11 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.361 -0.371 18533
8179 1 11 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.845 0.275 18533
8180 1 11 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.256 0.044 18533
8181 1 11 . 1 1 141 141 ALA H H 140 8.010 8.010 8.386 -0.376 18533
8182 1 11 . 1 1 142 142 VAL N N 141 118.550 118.550 119.402 -0.852 18533
8183 1 11 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.539 0.271 18533
8184 1 11 . 1 1 142 142 VAL CA C 141 65.600 65.600 67.322 -1.722 18533
8185 1 11 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.508 -0.058 18533
8186 1 11 . 1 1 142 142 VAL H H 141 8.300 8.300 7.983 0.317 18533
8187 1 11 . 1 1 143 143 ILE N N 142 121.410 121.410 119.079 2.331 18533
8188 1 11 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.431 -0.041 18533
8189 1 11 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.339 0.711 18533
8190 1 11 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.709 -0.399 18533
8191 1 11 . 1 1 143 143 ILE H H 142 8.150 8.150 8.214 -0.064 18533
8192 1 11 . 1 1 144 144 GLU N N 143 119.630 119.630 119.322 0.308 18533
8193 1 11 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.747 -0.207 18533
8194 1 11 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.180 0.580 18533
8195 1 11 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.979 0.751 18533
8196 1 11 . 1 1 144 144 GLU H H 143 8.640 8.640 8.304 0.336 18533
8197 1 11 . 1 1 145 145 SER N N 144 110.920 110.920 114.438 -3.518 18533
8198 1 11 . 1 1 145 145 SER HA H 144 4.230 4.230 4.209 0.021 18533
8199 1 11 . 1 1 145 145 SER CA C 144 60.810 60.810 61.562 -0.752 18533
8200 1 11 . 1 1 145 145 SER CB C 144 63.610 63.610 63.395 0.215 18533
8201 1 11 . 1 1 145 145 SER H H 144 7.640 7.640 7.883 -0.243 18533
8202 1 11 . 1 1 146 146 ALA N N 145 123.110 123.110 124.222 -1.112 18533
8203 1 11 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.285 -0.165 18533
8204 1 11 . 1 1 146 146 ALA CA C 145 53.400 53.400 53.910 -0.509 18533
8205 1 11 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.249 2.631 18533
8206 1 11 . 1 1 146 146 ALA H H 145 7.500 7.500 7.626 -0.126 18533
8207 1 11 . 1 1 147 147 LEU N N 146 114.220 114.220 119.747 -5.527 18533
8208 1 11 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.874 0.066 18533
8209 1 11 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.481 -0.431 18533
8210 1 11 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.395 0.065 18533
8211 1 11 . 1 1 147 147 LEU H H 146 7.410 7.410 8.162 -0.752 18533
8212 1 11 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.315 0.135 18533
8213 1 11 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.424 3.416 18533
8214 1 11 . 1 1 148 148 PRO CB C 147 31.220 31.220 30.995 0.225 18533
8215 1 11 . 1 1 149 149 GLY N N 148 102.590 102.590 106.501 -3.911 18533
8216 1 11 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.525 1.735 18533
8217 1 11 . 1 1 149 149 GLY H H 148 7.960 7.960 7.916 0.044 18533
8218 1 11 . 1 1 150 150 LEU N N 149 128.060 128.060 123.439 4.621 18533
8219 1 11 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.217 0.413 18533
8220 1 11 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.184 0.167 18533
8221 1 11 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.325 -0.125 18533
8222 1 11 . 1 1 150 150 LEU H H 149 7.620 7.620 8.381 -0.761 18533
8223 1 11 . 1 1 151 151 HIS N N 150 120.730 120.730 118.129 2.601 18533
8224 1 11 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.131 0.039 18533
8225 1 11 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.277 1.103 18533
8226 1 11 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.764 0.746 18533
8227 1 11 . 1 1 151 151 HIS H H 150 8.430 8.430 8.516 -0.086 18533
8228 1 11 . 1 1 152 152 ASP N N 151 118.170 118.170 119.572 -1.402 18533
8229 1 11 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.451 -0.031 18533
8230 1 11 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.965 -0.155 18533
8231 1 11 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.544 -0.514 18533
8232 1 11 . 1 1 152 152 ASP H H 151 7.820 7.820 8.384 -0.564 18533
8233 1 11 . 1 1 153 153 TRP N N 152 122.780 122.780 122.049 0.731 18533
8234 1 11 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.642 -0.532 18533
8235 1 11 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.108 1.502 18533
8236 1 11 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.218 -0.428 18533
8237 1 11 . 1 1 153 153 TRP H H 152 7.900 7.900 7.749 0.151 18533
8238 1 11 . 1 1 154 154 VAL N N 153 119.460 119.460 116.771 2.689 18533
8239 1 11 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.793 -0.443 18533
8240 1 11 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.353 0.627 18533
8241 1 11 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.582 0.318 18533
8242 1 11 . 1 1 154 154 VAL H H 153 8.560 8.560 8.574 -0.014 18533
8243 1 11 . 1 1 155 155 ASP N N 154 120.500 120.500 121.423 -0.923 18533
8244 1 11 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.292 -0.092 18533
8245 1 11 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.192 -0.622 18533
8246 1 11 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.701 -0.841 18533
8247 1 11 . 1 1 155 155 ASP H H 154 8.530 8.530 8.642 -0.112 18533
8248 1 11 . 1 1 156 156 GLU N N 155 120.090 120.090 119.695 0.395 18533
8249 1 11 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.917 0.013 18533
8250 1 11 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.291 -0.131 18533
8251 1 11 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.297 -0.007 18533
8252 1 11 . 1 1 156 156 GLU H H 155 7.870 7.870 8.399 -0.529 18533
8253 1 11 . 1 1 157 157 ARG N N 156 119.230 119.230 119.214 0.016 18533
8254 1 11 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.982 -0.172 18533
8255 1 11 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.331 -0.341 18533
8256 1 11 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.331 -0.221 18533
8257 1 11 . 1 1 157 157 ARG H H 156 7.660 7.660 7.959 -0.299 18533
8258 1 11 . 1 1 158 158 LEU N N 157 118.790 118.790 117.175 1.615 18533
8259 1 11 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.176 -0.076 18533
8260 1 11 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.490 -0.810 18533
8261 1 11 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.850 0.840 18533
8262 1 11 . 1 1 158 158 LEU H H 157 8.470 8.470 8.320 0.150 18533
8263 1 11 . 1 1 159 159 ALA N N 158 120.760 120.760 121.744 -0.984 18533
8264 1 11 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.247 -0.057 18533
8265 1 11 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.357 -1.077 18533
8266 1 11 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.192 -0.802 18533
8267 1 11 . 1 1 159 159 ALA H H 158 7.490 7.490 7.780 -0.290 18533
8268 1 11 . 1 1 160 160 ARG N N 159 117.810 117.810 117.693 0.117 18533
8269 1 11 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.161 0.049 18533
8270 1 11 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.425 0.355 18533
8271 1 11 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.202 1.328 18533
8272 1 11 . 1 1 160 160 ARG H H 159 7.650 7.650 8.219 -0.569 18533
8273 1 11 . 1 1 161 161 ASN N N 160 118.560 118.560 118.391 0.169 18533
8274 1 11 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.397 0.343 18533
8275 1 11 . 1 1 161 161 ASN CA C 160 53.250 53.250 54.991 -1.741 18533
8276 1 11 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.718 0.452 18533
8277 1 11 . 1 1 161 161 ASN H H 160 8.100 8.100 7.868 0.232 18533
8278 1 11 . 1 1 162 162 GLY N N 161 108.900 108.900 106.126 2.774 18533
8279 1 11 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.444 0.285 18533
8280 1 11 . 1 1 162 162 GLY H H 161 7.980 7.980 7.480 0.500 18533
8281 1 11 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.990 -0.530 18533
8282 1 11 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.324 1.127 18533
8283 1 11 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.036 0.164 18533
8284 1 12 . 1 1 2 2 MET N N 1 119.850 119.850 120.964 -1.114 18533
8285 1 12 . 1 1 2 2 MET HA H 1 4.500 4.500 4.599 -0.099 18533
8286 1 12 . 1 1 2 2 MET CA C 1 55.450 55.450 55.781 -0.331 18533
8287 1 12 . 1 1 2 2 MET CB C 1 33.170 33.170 31.248 1.922 18533
8288 1 12 . 1 1 2 2 MET H H 1 8.140 8.140 8.615 -0.475 18533
8289 1 12 . 1 1 3 3 SER N N 2 117.000 117.000 116.208 0.792 18533
8290 1 12 . 1 1 3 3 SER HA H 2 4.430 4.430 4.662 -0.232 18533
8291 1 12 . 1 1 3 3 SER CA C 2 58.320 58.320 57.295 1.025 18533
8292 1 12 . 1 1 3 3 SER CB C 2 63.990 63.990 65.715 -1.725 18533
8293 1 12 . 1 1 3 3 SER H H 2 8.340 8.340 8.009 0.331 18533
8294 1 12 . 1 1 4 4 ASP N N 3 123.200 123.200 122.720 0.480 18533
8295 1 12 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.746 0.114 18533
8296 1 12 . 1 1 4 4 ASP CA C 3 52.880 52.880 53.037 -0.157 18533
8297 1 12 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.010 0.791 18533
8298 1 12 . 1 1 4 4 ASP H H 3 8.260 8.260 8.383 -0.123 18533
8299 1 12 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.513 -0.113 18533
8300 1 12 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.538 0.282 18533
8301 1 12 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.608 -0.698 18533
8302 1 12 . 1 1 6 6 LEU N N 5 123.160 123.160 120.929 2.231 18533
8303 1 12 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.360 0.030 18533
8304 1 12 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.936 0.344 18533
8305 1 12 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.912 1.438 18533
8306 1 12 . 1 1 6 6 LEU H H 5 7.670 7.670 8.286 -0.616 18533
8307 1 12 . 1 1 7 7 HIS N N 6 127.160 127.160 118.023 9.137 18533
8308 1 12 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.092 0.938 18533
8309 1 12 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.128 -2.228 18533
8310 1 12 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.603 0.527 18533
8311 1 12 . 1 1 7 7 HIS H H 6 10.080 10.080 8.667 1.413 18533
8312 1 12 . 1 1 8 8 VAL N N 7 128.620 128.620 127.942 0.678 18533
8313 1 12 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.968 -0.468 18533
8314 1 12 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.181 -0.381 18533
8315 1 12 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.612 2.188 18533
8316 1 12 . 1 1 8 8 VAL H H 7 8.930 8.930 9.117 -0.187 18533
8317 1 12 . 1 1 9 9 THR N N 8 121.530 121.530 122.325 -0.795 18533
8318 1 12 . 1 1 9 9 THR HA H 8 5.270 5.270 4.803 0.467 18533
8319 1 12 . 1 1 9 9 THR CA C 8 58.520 58.520 58.958 -0.438 18533
8320 1 12 . 1 1 9 9 THR CB C 8 70.750 70.750 69.700 1.050 18533
8321 1 12 . 1 1 9 9 THR H H 8 7.970 7.970 8.947 -0.977 18533
8322 1 12 . 1 1 10 10 PHE N N 9 125.360 125.360 128.574 -3.214 18533
8323 1 12 . 1 1 10 10 PHE HA H 9 5.210 5.210 4.980 0.230 18533
8324 1 12 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.264 0.047 18533
8325 1 12 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.253 3.577 18533
8326 1 12 . 1 1 10 10 PHE H H 9 8.180 8.180 8.330 -0.150 18533
8327 1 12 . 1 1 11 11 VAL N N 10 121.120 121.120 122.560 -1.440 18533
8328 1 12 . 1 1 11 11 VAL HA H 10 5.360 5.360 4.962 0.398 18533
8329 1 12 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.868 -0.448 18533
8330 1 12 . 1 1 11 11 VAL CB C 10 35.550 35.550 31.927 3.623 18533
8331 1 12 . 1 1 11 11 VAL H H 10 8.710 8.710 9.205 -0.495 18533
8332 1 12 . 1 1 12 12 CYS N N 11 123.270 123.270 126.375 -3.105 18533
8333 1 12 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.473 -1.213 18533
8334 1 12 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.273 1.357 18533
8335 1 12 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.430 -1.079 18533
8336 1 12 . 1 1 12 12 CYS H H 11 7.940 7.940 8.714 -0.774 18533
8337 1 12 . 1 1 13 13 THR HA H 12 5.010 5.010 3.984 1.026 18533
8338 1 12 . 1 1 13 13 THR CA C 12 64.870 64.870 64.745 0.126 18533
8339 1 12 . 1 1 13 13 THR CB C 12 69.180 69.180 68.271 0.909 18533
8340 1 12 . 1 1 14 14 GLY CA C 13 44.960 44.960 43.561 1.399 18533
8341 1 12 . 1 1 15 15 ASN N N 14 119.960 119.960 121.411 -1.451 18533
8342 1 12 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.406 -0.476 18533
8343 1 12 . 1 1 15 15 ASN CA C 14 54.870 54.870 53.777 1.093 18533
8344 1 12 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.014 2.656 18533
8345 1 12 . 1 1 15 15 ASN H H 14 9.280 9.280 8.292 0.988 18533
8346 1 12 . 1 1 16 16 ILE N N 15 101.060 101.060 109.978 -8.918 18533
8347 1 12 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.813 -0.133 18533
8348 1 12 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.493 1.297 18533
8349 1 12 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.386 2.754 18533
8350 1 12 . 1 1 16 16 ILE H H 15 7.100 7.100 7.585 -0.485 18533
8351 1 12 . 1 1 17 17 CYS N N 16 116.020 116.020 121.689 -5.669 18533
8352 1 12 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.633 0.307 18533
8353 1 12 . 1 1 17 17 CYS CA C 16 60.060 60.060 60.303 -0.243 18533
8354 1 12 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.637 0.313 18533
8355 1 12 . 1 1 17 17 CYS H H 16 7.700 7.700 8.363 -0.663 18533
8356 1 12 . 1 1 19 19 SER N N 18 122.340 122.340 115.317 7.023 18533
8357 1 12 . 1 1 19 19 SER HA H 18 3.810 3.810 4.160 -0.350 18533
8358 1 12 . 1 1 19 19 SER CA C 18 62.710 62.710 63.430 -0.720 18533
8359 1 12 . 1 1 19 19 SER CB C 18 64.860 64.860 61.456 3.404 18533
8360 1 12 . 1 1 19 19 SER H H 18 11.420 11.420 8.404 3.016 18533
8361 1 12 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.144 -0.174 18533
8362 1 12 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.930 0.100 18533
8363 1 12 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.895 -2.205 18533
8364 1 12 . 1 1 21 21 MET N N 20 112.430 112.430 118.804 -6.374 18533
8365 1 12 . 1 1 21 21 MET HA H 20 3.730 3.730 4.000 -0.270 18533
8366 1 12 . 1 1 21 21 MET CA C 20 60.160 60.160 58.140 2.020 18533
8367 1 12 . 1 1 21 21 MET CB C 20 33.040 33.040 31.454 1.586 18533
8368 1 12 . 1 1 21 21 MET H H 20 6.310 6.310 7.471 -1.161 18533
8369 1 12 . 1 1 22 22 ALA N N 21 117.800 117.800 119.655 -1.855 18533
8370 1 12 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.824 -0.424 18533
8371 1 12 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.307 0.683 18533
8372 1 12 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.734 -1.244 18533
8373 1 12 . 1 1 22 22 ALA H H 21 6.550 6.550 7.399 -0.849 18533
8374 1 12 . 1 1 23 23 GLU N N 22 115.520 115.520 118.754 -3.234 18533
8375 1 12 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.067 -0.387 18533
8376 1 12 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.718 -0.168 18533
8377 1 12 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.731 0.059 18533
8378 1 12 . 1 1 23 23 GLU H H 22 7.800 7.800 7.481 0.319 18533
8379 1 12 . 1 1 24 24 LYS N N 23 114.220 114.220 116.423 -2.203 18533
8380 1 12 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.131 -0.131 18533
8381 1 12 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.078 -0.318 18533
8382 1 12 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.336 -1.536 18533
8383 1 12 . 1 1 24 24 LYS H H 23 8.040 8.040 7.412 0.628 18533
8384 1 12 . 1 1 25 25 MET N N 24 115.250 115.250 119.373 -4.123 18533
8385 1 12 . 1 1 25 25 MET HA H 24 3.950 3.950 3.520 0.430 18533
8386 1 12 . 1 1 25 25 MET CA C 24 57.980 57.980 58.850 -0.870 18533
8387 1 12 . 1 1 25 25 MET CB C 24 35.500 35.500 32.231 3.269 18533
8388 1 12 . 1 1 25 25 MET H H 24 7.610 7.610 7.378 0.232 18533
8389 1 12 . 1 1 26 26 PHE N N 25 119.090 119.090 115.866 3.224 18533
8390 1 12 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.587 -0.247 18533
8391 1 12 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.958 0.072 18533
8392 1 12 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.500 1.960 18533
8393 1 12 . 1 1 26 26 PHE H H 25 8.560 8.560 7.759 0.801 18533
8394 1 12 . 1 1 27 27 ALA N N 26 117.830 117.830 122.330 -4.500 18533
8395 1 12 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.746 0.184 18533
8396 1 12 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.074 0.986 18533
8397 1 12 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.495 0.915 18533
8398 1 12 . 1 1 27 27 ALA H H 26 8.800 8.800 7.302 1.498 18533
8399 1 12 . 1 1 28 28 GLN N N 27 117.550 117.550 118.343 -0.793 18533
8400 1 12 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.943 0.107 18533
8401 1 12 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.822 0.788 18533
8402 1 12 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.847 0.603 18533
8403 1 12 . 1 1 28 28 GLN H H 27 7.690 7.690 7.751 -0.061 18533
8404 1 12 . 1 1 29 29 GLN N N 28 117.530 117.530 119.840 -2.310 18533
8405 1 12 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.052 0.088 18533
8406 1 12 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.821 0.359 18533
8407 1 12 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.965 -0.855 18533
8408 1 12 . 1 1 29 29 GLN H H 28 8.210 8.210 7.506 0.704 18533
8409 1 12 . 1 1 30 30 LEU N N 29 119.330 119.330 119.391 -0.061 18533
8410 1 12 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.029 -0.099 18533
8411 1 12 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.922 0.158 18533
8412 1 12 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.494 0.406 18533
8413 1 12 . 1 1 30 30 LEU H H 29 8.540 8.540 8.412 0.128 18533
8414 1 12 . 1 1 31 31 ARG N N 30 120.880 120.880 117.378 3.502 18533
8415 1 12 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.092 -0.122 18533
8416 1 12 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.098 0.692 18533
8417 1 12 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.483 0.037 18533
8418 1 12 . 1 1 31 31 ARG H H 30 8.050 8.050 7.817 0.233 18533
8419 1 12 . 1 1 32 32 HIS N N 31 119.770 119.770 118.498 1.272 18533
8420 1 12 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.431 0.119 18533
8421 1 12 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.260 -0.180 18533
8422 1 12 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.236 0.474 18533
8423 1 12 . 1 1 32 32 HIS H H 31 8.440 8.440 8.307 0.133 18533
8424 1 12 . 1 1 33 33 ARG N N 32 115.430 115.430 116.974 -1.544 18533
8425 1 12 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.481 0.109 18533
8426 1 12 . 1 1 33 33 ARG CA C 32 55.970 55.970 55.987 -0.017 18533
8427 1 12 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.480 -0.260 18533
8428 1 12 . 1 1 33 33 ARG H H 32 7.500 7.500 7.782 -0.282 18533
8429 1 12 . 1 1 34 34 GLY N N 33 106.730 106.730 108.691 -1.961 18533
8430 1 12 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.202 0.998 18533
8431 1 12 . 1 1 34 34 GLY H H 33 7.750 7.750 8.126 -0.376 18533
8432 1 12 . 1 1 35 35 LEU N N 34 119.980 119.980 117.070 2.910 18533
8433 1 12 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.846 -0.166 18533
8434 1 12 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.810 0.340 18533
8435 1 12 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.649 0.541 18533
8436 1 12 . 1 1 35 35 LEU H H 34 7.980 7.980 8.426 -0.446 18533
8437 1 12 . 1 1 36 36 GLY N N 35 108.660 108.660 108.918 -0.258 18533
8438 1 12 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.691 -0.591 18533
8439 1 12 . 1 1 36 36 GLY H H 35 8.830 8.830 7.901 0.929 18533
8440 1 12 . 1 1 37 37 ASP N N 36 115.360 115.360 119.604 -4.244 18533
8441 1 12 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.565 0.205 18533
8442 1 12 . 1 1 37 37 ASP CA C 36 54.390 54.390 56.021 -1.631 18533
8443 1 12 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.725 0.445 18533
8444 1 12 . 1 1 37 37 ASP H H 36 8.300 8.300 8.026 0.274 18533
8445 1 12 . 1 1 38 38 ALA N N 37 121.460 121.460 121.190 0.270 18533
8446 1 12 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.257 0.053 18533
8447 1 12 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.208 -0.258 18533
8448 1 12 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.225 0.625 18533
8449 1 12 . 1 1 38 38 ALA H H 37 7.380 7.380 7.753 -0.373 18533
8450 1 12 . 1 1 39 39 VAL N N 38 115.660 115.660 116.924 -1.264 18533
8451 1 12 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.566 0.234 18533
8452 1 12 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.270 -0.230 18533
8453 1 12 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.923 0.267 18533
8454 1 12 . 1 1 39 39 VAL H H 38 7.100 7.100 7.709 -0.609 18533
8455 1 12 . 1 1 40 40 ARG N N 39 129.230 129.230 128.008 1.222 18533
8456 1 12 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.479 0.061 18533
8457 1 12 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.711 0.999 18533
8458 1 12 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.852 1.468 18533
8459 1 12 . 1 1 40 40 ARG H H 39 9.730 9.730 8.560 1.170 18533
8460 1 12 . 1 1 41 41 VAL N N 40 126.240 126.240 124.620 1.620 18533
8461 1 12 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.761 0.929 18533
8462 1 12 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.249 -0.689 18533
8463 1 12 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.745 0.195 18533
8464 1 12 . 1 1 41 41 VAL H H 40 8.610 8.610 8.630 -0.020 18533
8465 1 12 . 1 1 42 42 THR N N 41 117.310 117.310 117.598 -0.288 18533
8466 1 12 . 1 1 42 42 THR HA H 41 4.890 4.890 4.864 0.026 18533
8467 1 12 . 1 1 42 42 THR CA C 41 60.300 60.300 59.403 0.897 18533
8468 1 12 . 1 1 42 42 THR CB C 41 73.890 73.890 71.374 2.516 18533
8469 1 12 . 1 1 42 42 THR H H 41 8.870 8.870 8.951 -0.081 18533
8470 1 12 . 1 1 43 43 SER N N 42 109.960 109.960 113.488 -3.528 18533
8471 1 12 . 1 1 43 43 SER HA H 42 5.720 5.720 4.991 0.729 18533
8472 1 12 . 1 1 43 43 SER CA C 42 58.090 58.090 57.855 0.235 18533
8473 1 12 . 1 1 43 43 SER CB C 42 65.870 65.870 66.682 -0.812 18533
8474 1 12 . 1 1 43 43 SER H H 42 8.060 8.060 8.623 -0.563 18533
8475 1 12 . 1 1 44 44 ALA N N 43 119.200 119.200 119.588 -0.388 18533
8476 1 12 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.140 -0.880 18533
8477 1 12 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.757 -0.577 18533
8478 1 12 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.829 -0.999 18533
8479 1 12 . 1 1 44 44 ALA H H 43 8.710 8.710 9.030 -0.320 18533
8480 1 12 . 1 1 45 45 GLY N N 44 104.090 104.090 106.034 -1.944 18533
8481 1 12 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.191 -1.651 18533
8482 1 12 . 1 1 45 45 GLY H H 44 8.670 8.670 8.159 0.511 18533
8483 1 12 . 1 1 46 46 THR N N 45 114.060 114.060 116.772 -2.712 18533
8484 1 12 . 1 1 46 46 THR HA H 45 4.080 4.080 4.146 -0.066 18533
8485 1 12 . 1 1 46 46 THR CA C 45 64.680 64.680 64.203 0.477 18533
8486 1 12 . 1 1 46 46 THR CB C 45 67.880 67.880 68.636 -0.756 18533
8487 1 12 . 1 1 46 46 THR H H 45 9.120 9.120 8.439 0.681 18533
8488 1 12 . 1 1 47 47 GLY N N 46 110.380 110.380 107.977 2.403 18533
8489 1 12 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.922 -0.092 18533
8490 1 12 . 1 1 47 47 GLY H H 46 8.930 8.930 8.185 0.745 18533
8491 1 12 . 1 1 48 48 ASN N N 47 113.440 113.440 116.988 -3.548 18533
8492 1 12 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.281 0.209 18533
8493 1 12 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.395 -2.635 18533
8494 1 12 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.518 2.332 18533
8495 1 12 . 1 1 48 48 ASN H H 47 7.600 7.600 7.647 -0.047 18533
8496 1 12 . 1 1 49 49 TRP N N 48 117.300 117.300 121.516 -4.216 18533
8497 1 12 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.242 -0.342 18533
8498 1 12 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.890 -0.030 18533
8499 1 12 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.008 -0.488 18533
8500 1 12 . 1 1 49 49 TRP H H 48 6.920 6.920 8.177 -1.257 18533
8501 1 12 . 1 1 50 50 HIS N N 49 111.590 111.590 114.287 -2.697 18533
8502 1 12 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.870 0.010 18533
8503 1 12 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.383 -1.523 18533
8504 1 12 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.447 1.593 18533
8505 1 12 . 1 1 50 50 HIS H H 49 8.620 8.620 8.564 0.056 18533
8506 1 12 . 1 1 51 51 VAL N N 50 119.010 119.010 120.032 -1.022 18533
8507 1 12 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.717 -0.517 18533
8508 1 12 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.625 1.055 18533
8509 1 12 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.749 -0.359 18533
8510 1 12 . 1 1 51 51 VAL H H 50 6.880 6.880 7.458 -0.578 18533
8511 1 12 . 1 1 52 52 GLY N N 51 115.450 115.450 116.144 -0.694 18533
8512 1 12 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.146 -0.206 18533
8513 1 12 . 1 1 52 52 GLY H H 51 9.120 9.120 8.909 0.211 18533
8514 1 12 . 1 1 53 53 SER N N 52 116.620 116.620 115.492 1.128 18533
8515 1 12 . 1 1 53 53 SER HA H 52 4.610 4.610 4.606 0.004 18533
8516 1 12 . 1 1 53 53 SER CA C 52 59.310 59.310 57.961 1.349 18533
8517 1 12 . 1 1 53 53 SER CB C 52 64.630 64.630 65.292 -0.662 18533
8518 1 12 . 1 1 53 53 SER H H 52 8.430 8.430 8.119 0.311 18533
8519 1 12 . 1 1 54 54 CYS N N 53 118.690 118.690 117.875 0.815 18533
8520 1 12 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.138 -0.038 18533
8521 1 12 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.127 1.543 18533
8522 1 12 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.253 -2.903 18533
8523 1 12 . 1 1 54 54 CYS H H 53 8.170 8.170 8.325 -0.155 18533
8524 1 12 . 1 1 55 55 ALA N N 54 118.580 118.580 124.703 -6.123 18533
8525 1 12 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.153 -0.033 18533
8526 1 12 . 1 1 55 55 ALA CA C 54 52.640 52.640 53.057 -0.417 18533
8527 1 12 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.148 -2.518 18533
8528 1 12 . 1 1 55 55 ALA H H 54 8.420 8.420 8.589 -0.169 18533
8529 1 12 . 1 1 56 56 ASP N N 55 121.500 121.500 124.273 -2.773 18533
8530 1 12 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.380 -0.040 18533
8531 1 12 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.966 0.084 18533
8532 1 12 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.882 3.178 18533
8533 1 12 . 1 1 56 56 ASP H H 55 8.470 8.470 8.580 -0.110 18533
8534 1 12 . 1 1 57 57 GLU N N 56 127.840 127.840 126.543 1.297 18533
8535 1 12 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.797 0.243 18533
8536 1 12 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.197 0.443 18533
8537 1 12 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.251 0.249 18533
8538 1 12 . 1 1 57 57 GLU H H 56 9.230 9.230 8.844 0.386 18533
8539 1 12 . 1 1 58 58 ARG N N 57 120.820 120.820 117.930 2.890 18533
8540 1 12 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.577 0.233 18533
8541 1 12 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.346 -0.196 18533
8542 1 12 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.972 -1.702 18533
8543 1 12 . 1 1 58 58 ARG H H 57 9.220 9.220 8.883 0.337 18533
8544 1 12 . 1 1 59 59 ALA N N 58 121.590 121.590 122.356 -0.766 18533
8545 1 12 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.184 -0.024 18533
8546 1 12 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.390 0.390 18533
8547 1 12 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.181 0.309 18533
8548 1 12 . 1 1 59 59 ALA H H 58 6.680 6.680 7.608 -0.928 18533
8549 1 12 . 1 1 60 60 ALA N N 59 118.970 118.970 121.155 -2.185 18533
8550 1 12 . 1 1 60 60 ALA HA H 59 3.860 3.860 4.023 -0.163 18533
8551 1 12 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.329 -0.309 18533
8552 1 12 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.299 -0.229 18533
8553 1 12 . 1 1 60 60 ALA H H 59 8.540 8.540 8.456 0.084 18533
8554 1 12 . 1 1 61 61 GLY N N 60 104.160 104.160 106.554 -2.394 18533
8555 1 12 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.958 0.312 18533
8556 1 12 . 1 1 61 61 GLY H H 60 8.210 8.210 7.881 0.329 18533
8557 1 12 . 1 1 62 62 VAL N N 61 122.820 122.820 123.451 -0.631 18533
8558 1 12 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.715 0.135 18533
8559 1 12 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.895 -0.645 18533
8560 1 12 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.777 0.113 18533
8561 1 12 . 1 1 62 62 VAL H H 61 7.310 7.310 7.585 -0.275 18533
8562 1 12 . 1 1 63 63 LEU N N 62 120.310 120.310 118.779 1.531 18533
8563 1 12 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.204 -0.224 18533
8564 1 12 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.229 0.721 18533
8565 1 12 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.411 0.089 18533
8566 1 12 . 1 1 63 63 LEU H H 62 8.090 8.090 8.361 -0.271 18533
8567 1 12 . 1 1 64 64 ARG N N 63 119.440 119.440 119.250 0.190 18533
8568 1 12 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.258 -0.078 18533
8569 1 12 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.912 0.538 18533
8570 1 12 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.561 0.819 18533
8571 1 12 . 1 1 64 64 ARG H H 63 8.740 8.740 8.479 0.261 18533
8572 1 12 . 1 1 65 65 ALA N N 64 122.560 122.560 121.470 1.090 18533
8573 1 12 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.104 -0.074 18533
8574 1 12 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.090 0.451 18533
8575 1 12 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.323 -0.243 18533
8576 1 12 . 1 1 65 65 ALA H H 64 7.910 7.910 7.777 0.133 18533
8577 1 12 . 1 1 66 66 HIS N N 65 112.690 112.690 114.904 -2.214 18533
8578 1 12 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.673 -0.033 18533
8579 1 12 . 1 1 66 66 HIS CA C 65 55.500 55.500 55.947 -0.447 18533
8580 1 12 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.932 0.388 18533
8581 1 12 . 1 1 66 66 HIS H H 65 7.410 7.410 7.870 -0.460 18533
8582 1 12 . 1 1 67 67 GLY N N 66 107.440 107.440 106.376 1.064 18533
8583 1 12 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.205 1.155 18533
8584 1 12 . 1 1 67 67 GLY H H 66 7.850 7.850 7.573 0.277 18533
8585 1 12 . 1 1 68 68 TYR N N 67 119.940 119.940 121.548 -1.608 18533
8586 1 12 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.831 -0.031 18533
8587 1 12 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.131 0.969 18533
8588 1 12 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.951 0.909 18533
8589 1 12 . 1 1 68 68 TYR H H 67 8.380 8.380 8.325 0.055 18533
8590 1 12 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.549 0.011 18533
8591 1 12 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.793 -0.193 18533
8592 1 12 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.565 0.245 18533
8593 1 12 . 1 1 70 70 THR N N 69 100.660 100.660 106.374 -5.714 18533
8594 1 12 . 1 1 70 70 THR HA H 69 4.300 4.300 4.460 -0.160 18533
8595 1 12 . 1 1 70 70 THR CA C 69 61.250 61.250 61.055 0.195 18533
8596 1 12 . 1 1 70 70 THR CB C 69 70.740 70.740 69.635 1.105 18533
8597 1 12 . 1 1 70 70 THR H H 69 7.860 7.860 7.986 -0.126 18533
8598 1 12 . 1 1 71 71 ASP N N 70 122.880 122.880 122.326 0.554 18533
8599 1 12 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.487 -0.077 18533
8600 1 12 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.388 0.482 18533
8601 1 12 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.488 -0.518 18533
8602 1 12 . 1 1 71 71 ASP H H 70 7.940 7.940 7.896 0.044 18533
8603 1 12 . 1 1 72 72 HIS N N 71 121.720 121.720 124.714 -2.994 18533
8604 1 12 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.761 -0.061 18533
8605 1 12 . 1 1 72 72 HIS CA C 71 57.390 57.390 55.960 1.430 18533
8606 1 12 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.424 2.916 18533
8607 1 12 . 1 1 72 72 HIS H H 71 8.000 8.000 8.155 -0.155 18533
8608 1 12 . 1 1 73 73 ARG N N 72 125.760 125.760 125.613 0.147 18533
8609 1 12 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.954 -0.664 18533
8610 1 12 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.134 0.296 18533
8611 1 12 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.056 0.254 18533
8612 1 12 . 1 1 73 73 ARG H H 72 7.230 7.230 8.027 -0.797 18533
8613 1 12 . 1 1 74 74 ALA N N 73 127.970 127.970 129.030 -1.060 18533
8614 1 12 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.231 0.399 18533
8615 1 12 . 1 1 74 74 ALA CA C 73 52.180 52.180 53.003 -0.823 18533
8616 1 12 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.009 -1.109 18533
8617 1 12 . 1 1 74 74 ALA H H 73 9.090 9.090 8.174 0.916 18533
8618 1 12 . 1 1 75 75 ALA N N 74 126.090 126.090 125.076 1.014 18533
8619 1 12 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.777 0.013 18533
8620 1 12 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.462 0.507 18533
8621 1 12 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.978 1.642 18533
8622 1 12 . 1 1 75 75 ALA H H 74 9.410 9.410 8.379 1.031 18533
8623 1 12 . 1 1 76 76 GLN N N 75 123.260 123.260 119.850 3.410 18533
8624 1 12 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.669 0.281 18533
8625 1 12 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.734 -0.184 18533
8626 1 12 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.281 -1.231 18533
8627 1 12 . 1 1 76 76 GLN H H 75 8.800 8.800 8.389 0.411 18533
8628 1 12 . 1 1 77 77 VAL N N 76 125.510 125.510 124.762 0.748 18533
8629 1 12 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.411 -0.111 18533
8630 1 12 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.210 0.370 18533
8631 1 12 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.620 1.870 18533
8632 1 12 . 1 1 77 77 VAL H H 76 8.550 8.550 7.984 0.566 18533
8633 1 12 . 1 1 78 78 GLY N N 77 121.850 121.850 116.626 5.224 18533
8634 1 12 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.250 -0.410 18533
8635 1 12 . 1 1 78 78 GLY H H 77 10.930 10.930 8.616 2.314 18533
8636 1 12 . 1 1 79 79 THR N N 78 115.210 115.210 116.309 -1.099 18533
8637 1 12 . 1 1 79 79 THR HA H 78 3.700 3.700 3.995 -0.295 18533
8638 1 12 . 1 1 79 79 THR CA C 78 66.440 66.440 66.434 0.006 18533
8639 1 12 . 1 1 79 79 THR CB C 78 68.770 68.770 68.857 -0.087 18533
8640 1 12 . 1 1 79 79 THR H H 78 8.540 8.540 8.424 0.116 18533
8641 1 12 . 1 1 80 80 GLU N N 79 119.360 119.360 118.618 0.742 18533
8642 1 12 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.014 -0.054 18533
8643 1 12 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.764 0.266 18533
8644 1 12 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.767 0.293 18533
8645 1 12 . 1 1 80 80 GLU H H 79 9.110 9.110 8.872 0.238 18533
8646 1 12 . 1 1 81 81 HIS N N 80 118.380 118.380 116.881 1.499 18533
8647 1 12 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.247 -0.307 18533
8648 1 12 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.908 1.512 18533
8649 1 12 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.297 0.634 18533
8650 1 12 . 1 1 81 81 HIS H H 80 7.040 7.040 7.510 -0.470 18533
8651 1 12 . 1 1 82 82 LEU N N 81 114.010 114.010 120.086 -6.076 18533
8652 1 12 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.070 -0.170 18533
8653 1 12 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.882 -0.202 18533
8654 1 12 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.516 -0.786 18533
8655 1 12 . 1 1 82 82 LEU H H 81 7.850 7.850 8.392 -0.542 18533
8656 1 12 . 1 1 83 83 ALA N N 82 119.050 119.050 118.714 0.336 18533
8657 1 12 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.323 0.067 18533
8658 1 12 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.663 -0.462 18533
8659 1 12 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.518 0.662 18533
8660 1 12 . 1 1 83 83 ALA H H 82 6.950 6.950 7.366 -0.416 18533
8661 1 12 . 1 1 84 84 ALA N N 83 122.500 122.500 122.214 0.286 18533
8662 1 12 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.095 -0.335 18533
8663 1 12 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.565 1.785 18533
8664 1 12 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.290 -1.970 18533
8665 1 12 . 1 1 84 84 ALA H H 83 7.280 7.280 7.265 0.015 18533
8666 1 12 . 1 1 85 85 ASP N N 84 118.740 118.740 120.816 -2.076 18533
8667 1 12 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.744 -0.334 18533
8668 1 12 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.292 1.348 18533
8669 1 12 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.233 0.667 18533
8670 1 12 . 1 1 85 85 ASP H H 84 8.440 8.440 8.398 0.042 18533
8671 1 12 . 1 1 86 86 LEU N N 85 115.180 115.180 118.541 -3.361 18533
8672 1 12 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.872 -0.692 18533
8673 1 12 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.867 1.173 18533
8674 1 12 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.714 0.456 18533
8675 1 12 . 1 1 86 86 LEU H H 85 7.280 7.280 8.249 -0.969 18533
8676 1 12 . 1 1 87 87 LEU N N 86 128.140 128.140 127.514 0.626 18533
8677 1 12 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.899 -0.209 18533
8678 1 12 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.769 1.611 18533
8679 1 12 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.618 -0.448 18533
8680 1 12 . 1 1 87 87 LEU H H 86 8.780 8.780 9.103 -0.323 18533
8681 1 12 . 1 1 88 88 VAL N N 87 122.630 122.630 127.121 -4.491 18533
8682 1 12 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.932 -0.302 18533
8683 1 12 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.305 -1.395 18533
8684 1 12 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.895 -0.055 18533
8685 1 12 . 1 1 88 88 VAL H H 87 9.010 9.010 9.051 -0.041 18533
8686 1 12 . 1 1 89 89 ALA N N 88 129.820 129.820 131.745 -1.925 18533
8687 1 12 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.904 -0.384 18533
8688 1 12 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.491 -0.711 18533
8689 1 12 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.146 -0.366 18533
8690 1 12 . 1 1 89 89 ALA H H 88 8.590 8.590 9.224 -0.634 18533
8691 1 12 . 1 1 90 90 LEU N N 89 129.280 129.280 119.579 9.701 18533
8692 1 12 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.673 -0.363 18533
8693 1 12 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.941 0.509 18533
8694 1 12 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.922 -3.902 18533
8695 1 12 . 1 1 90 90 LEU H H 89 8.570 8.570 8.602 -0.032 18533
8696 1 12 . 1 1 91 91 ASP N N 90 126.910 126.910 117.172 9.738 18533
8697 1 12 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.656 0.144 18533
8698 1 12 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.114 -0.164 18533
8699 1 12 . 1 1 91 91 ASP CB C 90 43.810 43.810 42.945 0.865 18533
8700 1 12 . 1 1 91 91 ASP H H 90 11.450 11.450 7.451 3.999 18533
8701 1 12 . 1 1 92 92 ARG N N 91 116.950 116.950 120.324 -3.374 18533
8702 1 12 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.901 0.119 18533
8703 1 12 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.200 -0.370 18533
8704 1 12 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.787 0.493 18533
8705 1 12 . 1 1 92 92 ARG H H 91 8.650 8.650 8.713 -0.063 18533
8706 1 12 . 1 1 93 93 ASN N N 92 120.740 120.740 118.541 2.199 18533
8707 1 12 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.541 -0.161 18533
8708 1 12 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.621 0.509 18533
8709 1 12 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.078 -0.458 18533
8710 1 12 . 1 1 93 93 ASN H H 92 8.610 8.610 7.912 0.698 18533
8711 1 12 . 1 1 94 94 HIS N N 93 121.170 121.170 120.259 0.911 18533
8712 1 12 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.196 -0.006 18533
8713 1 12 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.148 0.362 18533
8714 1 12 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.676 1.704 18533
8715 1 12 . 1 1 94 94 HIS H H 93 7.430 7.430 8.653 -1.223 18533
8716 1 12 . 1 1 95 95 ALA N N 94 118.270 118.270 120.924 -2.654 18533
8717 1 12 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.958 -0.218 18533
8718 1 12 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.448 0.052 18533
8719 1 12 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.331 -0.361 18533
8720 1 12 . 1 1 95 95 ALA H H 94 7.190 7.190 7.982 -0.792 18533
8721 1 12 . 1 1 96 96 ARG N N 95 117.190 117.190 119.252 -2.062 18533
8722 1 12 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.035 -0.124 18533
8723 1 12 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.290 0.210 18533
8724 1 12 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.018 0.212 18533
8725 1 12 . 1 1 96 96 ARG H H 95 7.600 7.600 7.526 0.074 18533
8726 1 12 . 1 1 97 97 LEU N N 96 120.700 120.700 119.704 0.996 18533
8727 1 12 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.958 0.122 18533
8728 1 12 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.764 0.136 18533
8729 1 12 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.676 -0.336 18533
8730 1 12 . 1 1 97 97 LEU H H 96 7.990 7.990 8.039 -0.049 18533
8731 1 12 . 1 1 98 98 LEU N N 97 118.390 118.390 118.263 0.127 18533
8732 1 12 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.829 0.081 18533
8733 1 12 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.054 0.046 18533
8734 1 12 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.164 0.725 18533
8735 1 12 . 1 1 98 98 LEU H H 97 8.210 8.210 8.346 -0.136 18533
8736 1 12 . 1 1 99 99 ARG N N 98 117.470 117.470 118.426 -0.956 18533
8737 1 12 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.095 0.385 18533
8738 1 12 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.092 -0.732 18533
8739 1 12 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.613 -0.873 18533
8740 1 12 . 1 1 99 99 ARG H H 98 7.740 7.740 7.742 -0.002 18533
8741 1 12 . 1 1 100 100 GLN N N 99 121.400 121.400 118.531 2.869 18533
8742 1 12 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.227 -0.157 18533
8743 1 12 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.209 0.471 18533
8744 1 12 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.503 -0.183 18533
8745 1 12 . 1 1 100 100 GLN H H 99 8.030 8.030 8.041 -0.011 18533
8746 1 12 . 1 1 101 101 LEU N N 100 118.940 118.940 118.304 0.636 18533
8747 1 12 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.375 -0.115 18533
8748 1 12 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.579 -0.119 18533
8749 1 12 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.534 -0.294 18533
8750 1 12 . 1 1 101 101 LEU H H 100 7.780 7.780 8.270 -0.490 18533
8751 1 12 . 1 1 102 102 GLY N N 101 105.740 105.740 104.305 1.435 18533
8752 1 12 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.684 0.346 18533
8753 1 12 . 1 1 102 102 GLY H H 101 7.700 7.700 7.723 -0.023 18533
8754 1 12 . 1 1 103 103 VAL N N 102 122.330 122.330 121.834 0.496 18533
8755 1 12 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.114 -0.484 18533
8756 1 12 . 1 1 103 103 VAL CA C 102 63.600 63.600 61.944 1.657 18533
8757 1 12 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.272 -1.782 18533
8758 1 12 . 1 1 103 103 VAL H H 102 7.520 7.520 8.026 -0.506 18533
8759 1 12 . 1 1 104 104 GLU N N 103 128.990 128.990 113.996 14.994 18533
8760 1 12 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.447 -0.277 18533
8761 1 12 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.098 1.822 18533
8762 1 12 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.683 -3.733 18533
8763 1 12 . 1 1 104 104 GLU H H 103 9.210 9.210 8.045 1.165 18533
8764 1 12 . 1 1 105 105 ALA N N 104 124.410 124.410 122.920 1.490 18533
8765 1 12 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.204 -0.444 18533
8766 1 12 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.051 0.589 18533
8767 1 12 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.718 -0.578 18533
8768 1 12 . 1 1 105 105 ALA H H 104 8.500 8.500 8.671 -0.171 18533
8769 1 12 . 1 1 106 106 ALA N N 105 115.110 115.110 120.103 -4.993 18533
8770 1 12 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.193 -0.063 18533
8771 1 12 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.731 -0.691 18533
8772 1 12 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.574 0.486 18533
8773 1 12 . 1 1 106 106 ALA H H 105 8.270 8.270 8.334 -0.064 18533
8774 1 12 . 1 1 107 107 ARG N N 106 115.080 115.080 114.801 0.279 18533
8775 1 12 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.754 -0.294 18533
8776 1 12 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.823 -0.313 18533
8777 1 12 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.941 0.429 18533
8778 1 12 . 1 1 107 107 ARG H H 106 7.740 7.740 7.763 -0.023 18533
8779 1 12 . 1 1 108 108 VAL N N 107 118.170 118.170 121.369 -3.199 18533
8780 1 12 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.147 0.923 18533
8781 1 12 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.177 -1.537 18533
8782 1 12 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.544 1.056 18533
8783 1 12 . 1 1 108 108 VAL H H 107 7.290 7.290 8.407 -1.117 18533
8784 1 12 . 1 1 109 109 ARG N N 108 124.250 124.250 127.561 -3.311 18533
8785 1 12 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.656 -0.036 18533
8786 1 12 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.166 -1.276 18533
8787 1 12 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.384 0.596 18533
8788 1 12 . 1 1 109 109 ARG H H 108 8.420 8.420 9.187 -0.767 18533
8789 1 12 . 1 1 110 110 MET N N 109 119.570 119.570 121.949 -2.379 18533
8790 1 12 . 1 1 110 110 MET HA H 109 4.960 4.960 4.982 -0.022 18533
8791 1 12 . 1 1 110 110 MET CA C 109 53.820 53.820 54.602 -0.782 18533
8792 1 12 . 1 1 110 110 MET CB C 109 30.680 30.680 32.258 -1.577 18533
8793 1 12 . 1 1 110 110 MET H H 109 8.890 8.890 8.566 0.324 18533
8794 1 12 . 1 1 111 111 LEU N N 110 128.660 128.660 127.400 1.260 18533
8795 1 12 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.239 -0.279 18533
8796 1 12 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.115 0.485 18533
8797 1 12 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.957 -0.877 18533
8798 1 12 . 1 1 111 111 LEU H H 110 9.200 9.200 9.136 0.064 18533
8799 1 12 . 1 1 112 112 ARG N N 111 111.910 111.910 116.010 -4.100 18533
8800 1 12 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.126 -0.176 18533
8801 1 12 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.324 1.597 18533
8802 1 12 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.508 -1.008 18533
8803 1 12 . 1 1 112 112 ARG H H 111 8.930 8.930 8.614 0.316 18533
8804 1 12 . 1 1 113 113 SER N N 112 114.800 114.800 115.586 -0.786 18533
8805 1 12 . 1 1 113 113 SER HA H 112 4.290 4.290 4.299 -0.009 18533
8806 1 12 . 1 1 113 113 SER CA C 112 60.880 60.880 59.945 0.935 18533
8807 1 12 . 1 1 113 113 SER CB C 112 63.190 63.190 62.560 0.629 18533
8808 1 12 . 1 1 113 113 SER H H 112 7.680 7.680 7.776 -0.096 18533
8809 1 12 . 1 1 114 114 PHE N N 113 119.260 119.260 118.247 1.013 18533
8810 1 12 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.541 -0.191 18533
8811 1 12 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.620 1.310 18533
8812 1 12 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.776 -0.056 18533
8813 1 12 . 1 1 114 114 PHE H H 113 7.600 7.600 7.706 -0.106 18533
8814 1 12 . 1 1 115 115 ASP N N 114 121.170 121.170 121.267 -0.097 18533
8815 1 12 . 1 1 115 115 ASP HA H 114 5.020 5.020 5.152 -0.132 18533
8816 1 12 . 1 1 115 115 ASP CA C 114 51.100 51.100 51.425 -0.325 18533
8817 1 12 . 1 1 115 115 ASP CB C 114 42.510 42.510 42.255 0.255 18533
8818 1 12 . 1 1 115 115 ASP H H 114 7.430 7.430 7.624 -0.194 18533
8819 1 12 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.430 0.060 18533
8820 1 12 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.239 0.111 18533
8821 1 12 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.235 0.035 18533
8822 1 12 . 1 1 117 117 ARG N N 116 117.910 117.910 116.850 1.060 18533
8823 1 12 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.347 -0.077 18533
8824 1 12 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.537 -0.087 18533
8825 1 12 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.778 -0.818 18533
8826 1 12 . 1 1 117 117 ARG H H 116 8.580 8.580 8.372 0.208 18533
8827 1 12 . 1 1 118 118 SER N N 117 116.130 116.130 115.803 0.327 18533
8828 1 12 . 1 1 118 118 SER HA H 117 3.980 3.980 4.383 -0.403 18533
8829 1 12 . 1 1 118 118 SER CA C 117 59.790 59.790 58.730 1.060 18533
8830 1 12 . 1 1 118 118 SER CB C 117 63.760 63.760 62.008 1.752 18533
8831 1 12 . 1 1 118 118 SER H H 117 7.950 7.950 7.579 0.371 18533
8832 1 12 . 1 1 119 119 GLY N N 118 110.080 110.080 111.765 -1.685 18533
8833 1 12 . 1 1 119 119 GLY CA C 118 45.370 45.370 47.069 -1.698 18533
8834 1 12 . 1 1 119 119 GLY H H 118 8.150 8.150 8.538 -0.388 18533
8835 1 12 . 1 1 120 120 THR HA H 119 4.020 4.020 4.402 -0.382 18533
8836 1 12 . 1 1 120 120 THR CA C 119 63.290 63.290 62.306 0.984 18533
8837 1 12 . 1 1 120 120 THR CB C 119 69.140 69.140 71.620 -2.480 18533
8838 1 12 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.843 -0.273 18533
8839 1 12 . 1 1 121 121 HIS CA C 120 56.010 56.010 54.153 1.857 18533
8840 1 12 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.259 -1.269 18533
8841 1 12 . 1 1 122 122 ALA N N 121 125.880 125.880 125.583 0.297 18533
8842 1 12 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.491 -0.151 18533
8843 1 12 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.417 0.093 18533
8844 1 12 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.343 -1.743 18533
8845 1 12 . 1 1 122 122 ALA H H 121 7.980 7.980 8.379 -0.399 18533
8846 1 12 . 1 1 123 123 LEU N N 122 119.810 119.810 121.969 -2.159 18533
8847 1 12 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.425 -0.145 18533
8848 1 12 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.284 0.206 18533
8849 1 12 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.161 2.539 18533
8850 1 12 . 1 1 123 123 LEU H H 122 7.810 7.810 8.260 -0.450 18533
8851 1 12 . 1 1 124 124 ASP N N 123 119.050 119.050 117.234 1.816 18533
8852 1 12 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.560 0.010 18533
8853 1 12 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.714 1.606 18533
8854 1 12 . 1 1 124 124 ASP CB C 123 42.670 42.670 42.676 -0.006 18533
8855 1 12 . 1 1 124 124 ASP H H 123 8.270 8.270 7.503 0.767 18533
8856 1 12 . 1 1 125 125 VAL N N 124 121.970 121.970 124.201 -2.231 18533
8857 1 12 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.326 -0.066 18533
8858 1 12 . 1 1 125 125 VAL CA C 124 62.310 62.310 61.208 1.102 18533
8859 1 12 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.746 -2.966 18533
8860 1 12 . 1 1 125 125 VAL H H 124 7.930 7.930 8.096 -0.166 18533
8861 1 12 . 1 1 126 126 GLU N N 125 129.490 129.490 126.622 2.868 18533
8862 1 12 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.156 -0.076 18533
8863 1 12 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.329 0.681 18533
8864 1 12 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.359 -0.559 18533
8865 1 12 . 1 1 126 126 GLU H H 125 9.100 9.100 8.529 0.571 18533
8866 1 12 . 1 1 127 127 ASP N N 126 122.300 122.300 117.993 4.307 18533
8867 1 12 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.735 -0.625 18533
8868 1 12 . 1 1 127 127 ASP CA C 126 51.720 51.720 52.411 -0.691 18533
8869 1 12 . 1 1 127 127 ASP CB C 126 42.520 42.520 40.970 1.550 18533
8870 1 12 . 1 1 127 127 ASP H H 126 8.630 8.630 8.183 0.447 18533
8871 1 12 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.411 0.139 18533
8872 1 12 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.819 -0.219 18533
8873 1 12 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.104 -1.124 18533
8874 1 12 . 1 1 129 129 TYR N N 128 122.380 122.380 122.260 0.120 18533
8875 1 12 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.308 -0.508 18533
8876 1 12 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.871 3.249 18533
8877 1 12 . 1 1 129 129 TYR CB C 128 39.390 39.390 38.742 0.648 18533
8878 1 12 . 1 1 129 129 TYR H H 128 8.670 8.670 8.101 0.569 18533
8879 1 12 . 1 1 130 130 TYR N N 129 116.300 116.300 116.374 -0.074 18533
8880 1 12 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.954 -0.464 18533
8881 1 12 . 1 1 130 130 TYR CA C 129 58.480 58.480 58.591 -0.111 18533
8882 1 12 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.530 -1.870 18533
8883 1 12 . 1 1 130 130 TYR H H 129 8.680 8.680 7.542 1.138 18533
8884 1 12 . 1 1 131 131 GLY N N 130 110.870 110.870 109.103 1.767 18533
8885 1 12 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.935 -0.855 18533
8886 1 12 . 1 1 131 131 GLY H H 130 8.060 8.060 8.453 -0.393 18533
8887 1 12 . 1 1 132 132 ASP N N 131 121.590 121.590 119.032 2.558 18533
8888 1 12 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.704 0.366 18533
8889 1 12 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.916 0.083 18533
8890 1 12 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.694 0.906 18533
8891 1 12 . 1 1 132 132 ASP H H 131 9.290 9.290 7.993 1.297 18533
8892 1 12 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.855 0.255 18533
8893 1 12 . 1 1 133 133 HIS CA C 132 61.570 61.570 58.940 2.630 18533
8894 1 12 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.156 0.324 18533
8895 1 12 . 1 1 134 134 SER N N 133 115.370 115.370 113.587 1.783 18533
8896 1 12 . 1 1 134 134 SER HA H 133 4.180 4.180 4.030 0.150 18533
8897 1 12 . 1 1 134 134 SER CA C 133 62.070 62.070 61.707 0.363 18533
8898 1 12 . 1 1 134 134 SER CB C 133 62.160 62.160 63.068 -0.908 18533
8899 1 12 . 1 1 134 134 SER H H 133 8.420 8.420 7.879 0.541 18533
8900 1 12 . 1 1 135 135 ASP N N 134 123.360 123.360 121.467 1.893 18533
8901 1 12 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.491 0.039 18533
8902 1 12 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.803 1.237 18533
8903 1 12 . 1 1 135 135 ASP CB C 134 40.810 40.810 39.996 0.814 18533
8904 1 12 . 1 1 135 135 ASP H H 134 7.980 7.980 7.766 0.214 18533
8905 1 12 . 1 1 136 136 PHE N N 135 118.940 118.940 119.425 -0.485 18533
8906 1 12 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.379 -0.579 18533
8907 1 12 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.882 2.938 18533
8908 1 12 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.273 1.077 18533
8909 1 12 . 1 1 136 136 PHE H H 135 7.850 7.850 7.283 0.567 18533
8910 1 12 . 1 1 137 137 GLU N N 136 121.410 121.410 118.168 3.242 18533
8911 1 12 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.195 -0.015 18533
8912 1 12 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.932 0.568 18533
8913 1 12 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.209 -0.220 18533
8914 1 12 . 1 1 137 137 GLU H H 136 8.150 8.150 7.922 0.228 18533
8915 1 12 . 1 1 138 138 GLU N N 137 121.530 121.530 121.926 -0.396 18533
8916 1 12 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.092 0.198 18533
8917 1 12 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.280 0.120 18533
8918 1 12 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.048 -0.158 18533
8919 1 12 . 1 1 138 138 GLU H H 137 7.870 7.870 8.384 -0.514 18533
8920 1 12 . 1 1 139 139 VAL N N 138 119.930 119.930 119.812 0.118 18533
8921 1 12 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.627 -0.147 18533
8922 1 12 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.282 0.798 18533
8923 1 12 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.567 -0.217 18533
8924 1 12 . 1 1 139 139 VAL H H 138 7.770 7.770 7.576 0.194 18533
8925 1 12 . 1 1 140 140 PHE N N 139 119.130 119.130 121.192 -2.062 18533
8926 1 12 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.969 -0.409 18533
8927 1 12 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.658 1.022 18533
8928 1 12 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.687 0.483 18533
8929 1 12 . 1 1 140 140 PHE H H 139 8.050 8.050 7.956 0.094 18533
8930 1 12 . 1 1 141 141 ALA N N 140 121.040 121.040 122.217 -1.177 18533
8931 1 12 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.162 -0.172 18533
8932 1 12 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.842 0.278 18533
8933 1 12 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.322 -0.022 18533
8934 1 12 . 1 1 141 141 ALA H H 140 8.010 8.010 8.381 -0.371 18533
8935 1 12 . 1 1 142 142 VAL N N 141 118.550 118.550 118.725 -0.175 18533
8936 1 12 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.453 0.357 18533
8937 1 12 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.762 -1.162 18533
8938 1 12 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.602 -0.152 18533
8939 1 12 . 1 1 142 142 VAL H H 141 8.300 8.300 8.029 0.271 18533
8940 1 12 . 1 1 143 143 ILE N N 142 121.410 121.410 119.372 2.038 18533
8941 1 12 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.462 -0.072 18533
8942 1 12 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.289 0.761 18533
8943 1 12 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.780 -0.470 18533
8944 1 12 . 1 1 143 143 ILE H H 142 8.150 8.150 8.173 -0.023 18533
8945 1 12 . 1 1 144 144 GLU N N 143 119.630 119.630 120.085 -0.455 18533
8946 1 12 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.779 -0.239 18533
8947 1 12 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.300 0.460 18533
8948 1 12 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.808 0.922 18533
8949 1 12 . 1 1 144 144 GLU H H 143 8.640 8.640 8.212 0.428 18533
8950 1 12 . 1 1 145 145 SER N N 144 110.920 110.920 115.100 -4.180 18533
8951 1 12 . 1 1 145 145 SER HA H 144 4.230 4.230 4.267 -0.037 18533
8952 1 12 . 1 1 145 145 SER CA C 144 60.810 60.810 61.293 -0.483 18533
8953 1 12 . 1 1 145 145 SER CB C 144 63.610 63.610 63.313 0.297 18533
8954 1 12 . 1 1 145 145 SER H H 144 7.640 7.640 7.917 -0.277 18533
8955 1 12 . 1 1 146 146 ALA N N 145 123.110 123.110 124.383 -1.273 18533
8956 1 12 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.367 -0.247 18533
8957 1 12 . 1 1 146 146 ALA CA C 145 53.400 53.400 53.968 -0.568 18533
8958 1 12 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.228 2.652 18533
8959 1 12 . 1 1 146 146 ALA H H 145 7.500 7.500 7.651 -0.151 18533
8960 1 12 . 1 1 147 147 LEU N N 146 114.220 114.220 119.679 -5.459 18533
8961 1 12 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.881 0.059 18533
8962 1 12 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.445 -0.395 18533
8963 1 12 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.413 0.047 18533
8964 1 12 . 1 1 147 147 LEU H H 146 7.410 7.410 8.167 -0.757 18533
8965 1 12 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.342 0.108 18533
8966 1 12 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.462 3.378 18533
8967 1 12 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.033 0.187 18533
8968 1 12 . 1 1 149 149 GLY N N 148 102.590 102.590 106.220 -3.630 18533
8969 1 12 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.606 1.653 18533
8970 1 12 . 1 1 149 149 GLY H H 148 7.960 7.960 7.868 0.092 18533
8971 1 12 . 1 1 150 150 LEU N N 149 128.060 128.060 123.420 4.640 18533
8972 1 12 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.502 0.128 18533
8973 1 12 . 1 1 150 150 LEU CA C 149 57.350 57.350 56.543 0.807 18533
8974 1 12 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.113 0.087 18533
8975 1 12 . 1 1 150 150 LEU H H 149 7.620 7.620 8.223 -0.603 18533
8976 1 12 . 1 1 151 151 HIS N N 150 120.730 120.730 118.816 1.914 18533
8977 1 12 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.084 0.086 18533
8978 1 12 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.748 0.632 18533
8979 1 12 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.834 0.676 18533
8980 1 12 . 1 1 151 151 HIS H H 150 8.430 8.430 8.437 -0.007 18533
8981 1 12 . 1 1 152 152 ASP N N 151 118.170 118.170 119.691 -1.521 18533
8982 1 12 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.399 0.021 18533
8983 1 12 . 1 1 152 152 ASP CA C 151 57.810 57.810 58.059 -0.249 18533
8984 1 12 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.615 -0.585 18533
8985 1 12 . 1 1 152 152 ASP H H 151 7.820 7.820 8.286 -0.466 18533
8986 1 12 . 1 1 153 153 TRP N N 152 122.780 122.780 122.032 0.748 18533
8987 1 12 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.677 -0.567 18533
8988 1 12 . 1 1 153 153 TRP CA C 152 62.610 62.610 60.831 1.779 18533
8989 1 12 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.234 -0.444 18533
8990 1 12 . 1 1 153 153 TRP H H 152 7.900 7.900 7.939 -0.039 18533
8991 1 12 . 1 1 154 154 VAL N N 153 119.460 119.460 117.260 2.200 18533
8992 1 12 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.881 -0.531 18533
8993 1 12 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.226 0.754 18533
8994 1 12 . 1 1 154 154 VAL CB C 153 31.900 31.900 30.862 1.038 18533
8995 1 12 . 1 1 154 154 VAL H H 153 8.560 8.560 8.616 -0.056 18533
8996 1 12 . 1 1 155 155 ASP N N 154 120.500 120.500 121.491 -0.991 18533
8997 1 12 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.340 -0.140 18533
8998 1 12 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.521 -0.951 18533
8999 1 12 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.885 -1.025 18533
9000 1 12 . 1 1 155 155 ASP H H 154 8.530 8.530 8.743 -0.213 18533
9001 1 12 . 1 1 156 156 GLU N N 155 120.090 120.090 119.661 0.429 18533
9002 1 12 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.940 -0.010 18533
9003 1 12 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.264 -0.104 18533
9004 1 12 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.320 -0.030 18533
9005 1 12 . 1 1 156 156 GLU H H 155 7.870 7.870 8.372 -0.502 18533
9006 1 12 . 1 1 157 157 ARG N N 156 119.230 119.230 119.144 0.086 18533
9007 1 12 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.001 -0.191 18533
9008 1 12 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.138 -0.148 18533
9009 1 12 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.231 -0.121 18533
9010 1 12 . 1 1 157 157 ARG H H 156 7.660 7.660 7.886 -0.226 18533
9011 1 12 . 1 1 158 158 LEU N N 157 118.790 118.790 117.362 1.428 18533
9012 1 12 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.210 -0.110 18533
9013 1 12 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.776 -1.096 18533
9014 1 12 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.789 0.901 18533
9015 1 12 . 1 1 158 158 LEU H H 157 8.470 8.470 8.352 0.118 18533
9016 1 12 . 1 1 159 159 ALA N N 158 120.760 120.760 122.321 -1.561 18533
9017 1 12 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.153 0.037 18533
9018 1 12 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.605 -1.325 18533
9019 1 12 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.823 -0.433 18533
9020 1 12 . 1 1 159 159 ALA H H 158 7.490 7.490 7.646 -0.156 18533
9021 1 12 . 1 1 160 160 ARG N N 159 117.810 117.810 116.602 1.208 18533
9022 1 12 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.096 0.114 18533
9023 1 12 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.660 -0.880 18533
9024 1 12 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.848 0.682 18533
9025 1 12 . 1 1 160 160 ARG H H 159 7.650 7.650 7.957 -0.307 18533
9026 1 12 . 1 1 161 161 ASN N N 160 118.560 118.560 117.743 0.817 18533
9027 1 12 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.541 0.199 18533
9028 1 12 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.495 -2.244 18533
9029 1 12 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.472 0.698 18533
9030 1 12 . 1 1 161 161 ASN H H 160 8.100 8.100 8.110 -0.010 18533
9031 1 12 . 1 1 162 162 GLY N N 161 108.900 108.900 107.046 1.854 18533
9032 1 12 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.023 0.707 18533
9033 1 12 . 1 1 162 162 GLY H H 161 7.980 7.980 7.474 0.506 18533
9034 1 12 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.472 -0.012 18533
9035 1 12 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.071 0.380 18533
9036 1 12 . 1 1 163 163 PRO CB C 162 32.200 32.200 30.260 1.940 18533
9037 1 13 . 1 1 2 2 MET N N 1 119.850 119.850 117.667 2.183 18533
9038 1 13 . 1 1 2 2 MET HA H 1 4.500 4.500 4.193 0.307 18533
9039 1 13 . 1 1 2 2 MET CA C 1 55.450 55.450 55.831 -0.381 18533
9040 1 13 . 1 1 2 2 MET CB C 1 33.170 33.170 31.673 1.497 18533
9041 1 13 . 1 1 2 2 MET H H 1 8.140 8.140 8.198 -0.058 18533
9042 1 13 . 1 1 3 3 SER N N 2 117.000 117.000 114.437 2.563 18533
9043 1 13 . 1 1 3 3 SER HA H 2 4.430 4.430 4.687 -0.257 18533
9044 1 13 . 1 1 3 3 SER CA C 2 58.320 58.320 57.830 0.490 18533
9045 1 13 . 1 1 3 3 SER CB C 2 63.990 63.990 65.124 -1.134 18533
9046 1 13 . 1 1 3 3 SER H H 2 8.340 8.340 7.800 0.540 18533
9047 1 13 . 1 1 4 4 ASP N N 3 123.200 123.200 125.314 -2.114 18533
9048 1 13 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.718 0.142 18533
9049 1 13 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.651 0.229 18533
9050 1 13 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.520 0.280 18533
9051 1 13 . 1 1 4 4 ASP H H 3 8.260 8.260 8.301 -0.041 18533
9052 1 13 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.507 -0.107 18533
9053 1 13 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.300 0.520 18533
9054 1 13 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.745 -0.835 18533
9055 1 13 . 1 1 6 6 LEU N N 5 123.160 123.160 120.122 3.038 18533
9056 1 13 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.396 -0.006 18533
9057 1 13 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.773 0.507 18533
9058 1 13 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.021 1.329 18533
9059 1 13 . 1 1 6 6 LEU H H 5 7.670 7.670 8.206 -0.536 18533
9060 1 13 . 1 1 7 7 HIS N N 6 127.160 127.160 118.399 8.761 18533
9061 1 13 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.974 1.056 18533
9062 1 13 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.223 -2.323 18533
9063 1 13 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.244 0.886 18533
9064 1 13 . 1 1 7 7 HIS H H 6 10.080 10.080 8.696 1.384 18533
9065 1 13 . 1 1 8 8 VAL N N 7 128.620 128.620 126.668 1.952 18533
9066 1 13 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.658 -0.158 18533
9067 1 13 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.882 -0.082 18533
9068 1 13 . 1 1 8 8 VAL CB C 7 34.800 34.800 30.970 3.830 18533
9069 1 13 . 1 1 8 8 VAL H H 7 8.930 8.930 8.986 -0.056 18533
9070 1 13 . 1 1 9 9 THR N N 8 121.530 121.530 123.517 -1.987 18533
9071 1 13 . 1 1 9 9 THR HA H 8 5.270 5.270 4.659 0.611 18533
9072 1 13 . 1 1 9 9 THR CA C 8 58.520 58.520 59.312 -0.792 18533
9073 1 13 . 1 1 9 9 THR CB C 8 70.750 70.750 69.359 1.391 18533
9074 1 13 . 1 1 9 9 THR H H 8 7.970 7.970 8.969 -0.999 18533
9075 1 13 . 1 1 10 10 PHE N N 9 125.360 125.360 128.923 -3.563 18533
9076 1 13 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.006 0.203 18533
9077 1 13 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.230 0.080 18533
9078 1 13 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.728 3.102 18533
9079 1 13 . 1 1 10 10 PHE H H 9 8.180 8.180 8.190 -0.010 18533
9080 1 13 . 1 1 11 11 VAL N N 10 121.120 121.120 121.225 -0.105 18533
9081 1 13 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.455 -0.095 18533
9082 1 13 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.737 -0.317 18533
9083 1 13 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.764 1.786 18533
9084 1 13 . 1 1 11 11 VAL H H 10 8.710 8.710 9.179 -0.469 18533
9085 1 13 . 1 1 12 12 CYS N N 11 123.270 123.270 125.992 -2.722 18533
9086 1 13 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.398 -1.138 18533
9087 1 13 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.676 0.954 18533
9088 1 13 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.299 -0.949 18533
9089 1 13 . 1 1 12 12 CYS H H 11 7.940 7.940 8.476 -0.536 18533
9090 1 13 . 1 1 13 13 THR HA H 12 5.010 5.010 3.855 1.155 18533
9091 1 13 . 1 1 13 13 THR CA C 12 64.870 64.870 62.595 2.275 18533
9092 1 13 . 1 1 13 13 THR CB C 12 69.180 69.180 67.717 1.463 18533
9093 1 13 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.196 -0.236 18533
9094 1 13 . 1 1 15 15 ASN N N 14 119.960 119.960 116.826 3.134 18533
9095 1 13 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.256 -0.326 18533
9096 1 13 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.493 0.377 18533
9097 1 13 . 1 1 15 15 ASN CB C 14 40.670 40.670 36.795 3.875 18533
9098 1 13 . 1 1 15 15 ASN H H 14 9.280 9.280 8.128 1.152 18533
9099 1 13 . 1 1 16 16 ILE N N 15 101.060 101.060 110.569 -9.509 18533
9100 1 13 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.806 -0.126 18533
9101 1 13 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.718 1.072 18533
9102 1 13 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.631 3.509 18533
9103 1 13 . 1 1 16 16 ILE H H 15 7.100 7.100 7.855 -0.755 18533
9104 1 13 . 1 1 17 17 CYS N N 16 116.020 116.020 118.234 -2.214 18533
9105 1 13 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.617 0.323 18533
9106 1 13 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.940 1.120 18533
9107 1 13 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.345 -0.395 18533
9108 1 13 . 1 1 17 17 CYS H H 16 7.700 7.700 7.906 -0.206 18533
9109 1 13 . 1 1 19 19 SER N N 18 122.340 122.340 115.253 7.087 18533
9110 1 13 . 1 1 19 19 SER HA H 18 3.810 3.810 4.175 -0.365 18533
9111 1 13 . 1 1 19 19 SER CA C 18 62.710 62.710 63.168 -0.458 18533
9112 1 13 . 1 1 19 19 SER CB C 18 64.860 64.860 61.312 3.548 18533
9113 1 13 . 1 1 19 19 SER H H 18 11.420 11.420 8.591 2.829 18533
9114 1 13 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.116 -0.146 18533
9115 1 13 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.822 0.208 18533
9116 1 13 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.897 -2.207 18533
9117 1 13 . 1 1 21 21 MET N N 20 112.430 112.430 118.339 -5.909 18533
9118 1 13 . 1 1 21 21 MET HA H 20 3.730 3.730 3.972 -0.242 18533
9119 1 13 . 1 1 21 21 MET CA C 20 60.160 60.160 58.373 1.787 18533
9120 1 13 . 1 1 21 21 MET CB C 20 33.040 33.040 31.425 1.615 18533
9121 1 13 . 1 1 21 21 MET H H 20 6.310 6.310 7.442 -1.132 18533
9122 1 13 . 1 1 22 22 ALA N N 21 117.800 117.800 119.441 -1.641 18533
9123 1 13 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.843 -0.443 18533
9124 1 13 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.268 0.722 18533
9125 1 13 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.616 -1.126 18533
9126 1 13 . 1 1 22 22 ALA H H 21 6.550 6.550 7.385 -0.835 18533
9127 1 13 . 1 1 23 23 GLU N N 22 115.520 115.520 118.658 -3.138 18533
9128 1 13 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.006 -0.326 18533
9129 1 13 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.644 -0.094 18533
9130 1 13 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.763 0.027 18533
9131 1 13 . 1 1 23 23 GLU H H 22 7.800 7.800 7.574 0.226 18533
9132 1 13 . 1 1 24 24 LYS N N 23 114.220 114.220 116.085 -1.865 18533
9133 1 13 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.120 -0.120 18533
9134 1 13 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.901 -0.141 18533
9135 1 13 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.439 -1.639 18533
9136 1 13 . 1 1 24 24 LYS H H 23 8.040 8.040 7.483 0.557 18533
9137 1 13 . 1 1 25 25 MET N N 24 115.250 115.250 119.782 -4.532 18533
9138 1 13 . 1 1 25 25 MET HA H 24 3.950 3.950 3.341 0.609 18533
9139 1 13 . 1 1 25 25 MET CA C 24 57.980 57.980 58.936 -0.956 18533
9140 1 13 . 1 1 25 25 MET CB C 24 35.500 35.500 32.420 3.079 18533
9141 1 13 . 1 1 25 25 MET H H 24 7.610 7.610 7.428 0.182 18533
9142 1 13 . 1 1 26 26 PHE N N 25 119.090 119.090 116.394 2.696 18533
9143 1 13 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.657 -0.317 18533
9144 1 13 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.819 0.210 18533
9145 1 13 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.612 1.848 18533
9146 1 13 . 1 1 26 26 PHE H H 25 8.560 8.560 7.713 0.847 18533
9147 1 13 . 1 1 27 27 ALA N N 26 117.830 117.830 122.247 -4.417 18533
9148 1 13 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.771 0.159 18533
9149 1 13 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.091 0.969 18533
9150 1 13 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.502 0.909 18533
9151 1 13 . 1 1 27 27 ALA H H 26 8.800 8.800 7.285 1.515 18533
9152 1 13 . 1 1 28 28 GLN N N 27 117.550 117.550 118.348 -0.798 18533
9153 1 13 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.935 0.115 18533
9154 1 13 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.850 0.760 18533
9155 1 13 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.785 0.665 18533
9156 1 13 . 1 1 28 28 GLN H H 27 7.690 7.690 7.773 -0.083 18533
9157 1 13 . 1 1 29 29 GLN N N 28 117.530 117.530 119.779 -2.249 18533
9158 1 13 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.067 0.073 18533
9159 1 13 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.826 0.354 18533
9160 1 13 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.966 -0.856 18533
9161 1 13 . 1 1 29 29 GLN H H 28 8.210 8.210 7.539 0.671 18533
9162 1 13 . 1 1 30 30 LEU N N 29 119.330 119.330 119.437 -0.107 18533
9163 1 13 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.998 -0.068 18533
9164 1 13 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.900 0.180 18533
9165 1 13 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.464 0.436 18533
9166 1 13 . 1 1 30 30 LEU H H 29 8.540 8.540 8.461 0.079 18533
9167 1 13 . 1 1 31 31 ARG N N 30 120.880 120.880 118.142 2.738 18533
9168 1 13 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.086 -0.116 18533
9169 1 13 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.125 0.665 18533
9170 1 13 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.369 0.151 18533
9171 1 13 . 1 1 31 31 ARG H H 30 8.050 8.050 8.104 -0.054 18533
9172 1 13 . 1 1 32 32 HIS N N 31 119.770 119.770 118.338 1.432 18533
9173 1 13 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.436 0.114 18533
9174 1 13 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.212 -0.131 18533
9175 1 13 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.263 0.447 18533
9176 1 13 . 1 1 32 32 HIS H H 31 8.440 8.440 8.500 -0.060 18533
9177 1 13 . 1 1 33 33 ARG N N 32 115.430 115.430 117.324 -1.894 18533
9178 1 13 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.505 0.085 18533
9179 1 13 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.161 -0.191 18533
9180 1 13 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.895 -0.675 18533
9181 1 13 . 1 1 33 33 ARG H H 32 7.500 7.500 7.881 -0.381 18533
9182 1 13 . 1 1 34 34 GLY N N 33 106.730 106.730 109.121 -2.391 18533
9183 1 13 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.093 1.107 18533
9184 1 13 . 1 1 34 34 GLY H H 33 7.750 7.750 8.380 -0.630 18533
9185 1 13 . 1 1 35 35 LEU N N 34 119.980 119.980 117.524 2.456 18533
9186 1 13 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.859 -0.179 18533
9187 1 13 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.719 0.431 18533
9188 1 13 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.460 0.730 18533
9189 1 13 . 1 1 35 35 LEU H H 34 7.980 7.980 8.572 -0.592 18533
9190 1 13 . 1 1 36 36 GLY N N 35 108.660 108.660 109.177 -0.517 18533
9191 1 13 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.700 -0.601 18533
9192 1 13 . 1 1 36 36 GLY H H 35 8.830 8.830 7.893 0.937 18533
9193 1 13 . 1 1 37 37 ASP N N 36 115.360 115.360 118.593 -3.233 18533
9194 1 13 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.536 0.234 18533
9195 1 13 . 1 1 37 37 ASP CA C 36 54.390 54.390 54.966 -0.576 18533
9196 1 13 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.519 0.651 18533
9197 1 13 . 1 1 37 37 ASP H H 36 8.300 8.300 8.373 -0.073 18533
9198 1 13 . 1 1 38 38 ALA N N 37 121.460 121.460 118.849 2.611 18533
9199 1 13 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.241 0.069 18533
9200 1 13 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.157 -0.207 18533
9201 1 13 . 1 1 38 38 ALA CB C 37 20.850 20.850 19.720 1.130 18533
9202 1 13 . 1 1 38 38 ALA H H 37 7.380 7.380 7.174 0.206 18533
9203 1 13 . 1 1 39 39 VAL N N 38 115.660 115.660 116.703 -1.043 18533
9204 1 13 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.413 0.387 18533
9205 1 13 . 1 1 39 39 VAL CA C 38 60.040 60.040 61.301 -1.261 18533
9206 1 13 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.371 0.819 18533
9207 1 13 . 1 1 39 39 VAL H H 38 7.100 7.100 8.107 -1.007 18533
9208 1 13 . 1 1 40 40 ARG N N 39 129.230 129.230 126.699 2.531 18533
9209 1 13 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.494 0.046 18533
9210 1 13 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.521 1.189 18533
9211 1 13 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.779 1.541 18533
9212 1 13 . 1 1 40 40 ARG H H 39 9.730 9.730 8.580 1.150 18533
9213 1 13 . 1 1 41 41 VAL N N 40 126.240 126.240 124.637 1.603 18533
9214 1 13 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.672 1.018 18533
9215 1 13 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.241 -0.681 18533
9216 1 13 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.939 0.001 18533
9217 1 13 . 1 1 41 41 VAL H H 40 8.610 8.610 8.586 0.024 18533
9218 1 13 . 1 1 42 42 THR N N 41 117.310 117.310 118.134 -0.824 18533
9219 1 13 . 1 1 42 42 THR HA H 41 4.890 4.890 4.871 0.019 18533
9220 1 13 . 1 1 42 42 THR CA C 41 60.300 60.300 59.166 1.134 18533
9221 1 13 . 1 1 42 42 THR CB C 41 73.890 73.890 71.910 1.980 18533
9222 1 13 . 1 1 42 42 THR H H 41 8.870 8.870 8.918 -0.048 18533
9223 1 13 . 1 1 43 43 SER N N 42 109.960 109.960 113.452 -3.492 18533
9224 1 13 . 1 1 43 43 SER HA H 42 5.720 5.720 5.136 0.584 18533
9225 1 13 . 1 1 43 43 SER CA C 42 58.090 58.090 57.776 0.314 18533
9226 1 13 . 1 1 43 43 SER CB C 42 65.870 65.870 66.542 -0.672 18533
9227 1 13 . 1 1 43 43 SER H H 42 8.060 8.060 8.597 -0.537 18533
9228 1 13 . 1 1 44 44 ALA N N 43 119.200 119.200 119.676 -0.476 18533
9229 1 13 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.014 -0.754 18533
9230 1 13 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.796 -0.616 18533
9231 1 13 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.898 -1.068 18533
9232 1 13 . 1 1 44 44 ALA H H 43 8.710 8.710 9.093 -0.383 18533
9233 1 13 . 1 1 45 45 GLY N N 44 104.090 104.090 106.372 -2.282 18533
9234 1 13 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.236 -1.696 18533
9235 1 13 . 1 1 45 45 GLY H H 44 8.670 8.670 8.200 0.470 18533
9236 1 13 . 1 1 46 46 THR N N 45 114.060 114.060 115.773 -1.713 18533
9237 1 13 . 1 1 46 46 THR HA H 45 4.080 4.080 4.160 -0.080 18533
9238 1 13 . 1 1 46 46 THR CA C 45 64.680 64.680 64.150 0.530 18533
9239 1 13 . 1 1 46 46 THR CB C 45 67.880 67.880 68.484 -0.605 18533
9240 1 13 . 1 1 46 46 THR H H 45 9.120 9.120 8.565 0.555 18533
9241 1 13 . 1 1 47 47 GLY N N 46 110.380 110.380 108.721 1.659 18533
9242 1 13 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.965 -0.135 18533
9243 1 13 . 1 1 47 47 GLY H H 46 8.930 8.930 8.367 0.563 18533
9244 1 13 . 1 1 48 48 ASN N N 47 113.440 113.440 117.080 -3.640 18533
9245 1 13 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.292 0.198 18533
9246 1 13 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.489 -2.728 18533
9247 1 13 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.227 2.623 18533
9248 1 13 . 1 1 48 48 ASN H H 47 7.600 7.600 7.622 -0.022 18533
9249 1 13 . 1 1 49 49 TRP N N 48 117.300 117.300 121.314 -4.014 18533
9250 1 13 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.337 -0.437 18533
9251 1 13 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.619 0.241 18533
9252 1 13 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.025 -0.505 18533
9253 1 13 . 1 1 49 49 TRP H H 48 6.920 6.920 8.540 -1.620 18533
9254 1 13 . 1 1 50 50 HIS N N 49 111.590 111.590 115.093 -3.503 18533
9255 1 13 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.776 0.104 18533
9256 1 13 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.522 -1.662 18533
9257 1 13 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.847 1.193 18533
9258 1 13 . 1 1 50 50 HIS H H 49 8.620 8.620 8.294 0.326 18533
9259 1 13 . 1 1 51 51 VAL N N 50 119.010 119.010 120.235 -1.225 18533
9260 1 13 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.691 -0.491 18533
9261 1 13 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.347 1.333 18533
9262 1 13 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.915 -0.525 18533
9263 1 13 . 1 1 51 51 VAL H H 50 6.880 6.880 7.541 -0.661 18533
9264 1 13 . 1 1 52 52 GLY N N 51 115.450 115.450 116.201 -0.751 18533
9265 1 13 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.344 -0.404 18533
9266 1 13 . 1 1 52 52 GLY H H 51 9.120 9.120 9.123 -0.003 18533
9267 1 13 . 1 1 53 53 SER N N 52 116.620 116.620 115.306 1.314 18533
9268 1 13 . 1 1 53 53 SER HA H 52 4.610 4.610 4.727 -0.117 18533
9269 1 13 . 1 1 53 53 SER CA C 52 59.310 59.310 57.649 1.661 18533
9270 1 13 . 1 1 53 53 SER CB C 52 64.630 64.630 64.832 -0.202 18533
9271 1 13 . 1 1 53 53 SER H H 52 8.430 8.430 8.027 0.403 18533
9272 1 13 . 1 1 54 54 CYS N N 53 118.690 118.690 118.199 0.491 18533
9273 1 13 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.305 -0.205 18533
9274 1 13 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.248 1.422 18533
9275 1 13 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.098 -2.748 18533
9276 1 13 . 1 1 54 54 CYS H H 53 8.170 8.170 8.539 -0.369 18533
9277 1 13 . 1 1 55 55 ALA N N 54 118.580 118.580 123.975 -5.395 18533
9278 1 13 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.100 0.020 18533
9279 1 13 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.800 -0.160 18533
9280 1 13 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.336 -2.706 18533
9281 1 13 . 1 1 55 55 ALA H H 54 8.420 8.420 8.553 -0.133 18533
9282 1 13 . 1 1 56 56 ASP N N 55 121.500 121.500 123.624 -2.124 18533
9283 1 13 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.388 -0.048 18533
9284 1 13 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.760 0.290 18533
9285 1 13 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.930 3.130 18533
9286 1 13 . 1 1 56 56 ASP H H 55 8.470 8.470 8.393 0.077 18533
9287 1 13 . 1 1 57 57 GLU N N 56 127.840 127.840 126.811 1.029 18533
9288 1 13 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.833 0.207 18533
9289 1 13 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.274 0.366 18533
9290 1 13 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.364 0.136 18533
9291 1 13 . 1 1 57 57 GLU H H 56 9.230 9.230 8.835 0.395 18533
9292 1 13 . 1 1 58 58 ARG N N 57 120.820 120.820 117.995 2.825 18533
9293 1 13 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.832 -0.022 18533
9294 1 13 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.495 -0.345 18533
9295 1 13 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.794 -1.524 18533
9296 1 13 . 1 1 58 58 ARG H H 57 9.220 9.220 8.987 0.233 18533
9297 1 13 . 1 1 59 59 ALA N N 58 121.590 121.590 122.552 -0.962 18533
9298 1 13 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.162 -0.002 18533
9299 1 13 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.443 0.337 18533
9300 1 13 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.168 0.322 18533
9301 1 13 . 1 1 59 59 ALA H H 58 6.680 6.680 7.317 -0.637 18533
9302 1 13 . 1 1 60 60 ALA N N 59 118.970 118.970 121.284 -2.314 18533
9303 1 13 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.963 -0.103 18533
9304 1 13 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.119 -0.099 18533
9305 1 13 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.387 -0.317 18533
9306 1 13 . 1 1 60 60 ALA H H 59 8.540 8.540 8.582 -0.042 18533
9307 1 13 . 1 1 61 61 GLY N N 60 104.160 104.160 106.997 -2.837 18533
9308 1 13 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.346 -0.076 18533
9309 1 13 . 1 1 61 61 GLY H H 60 8.210 8.210 8.228 -0.018 18533
9310 1 13 . 1 1 62 62 VAL N N 61 122.820 122.820 119.836 2.984 18533
9311 1 13 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.833 0.017 18533
9312 1 13 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.119 1.131 18533
9313 1 13 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.095 0.795 18533
9314 1 13 . 1 1 62 62 VAL H H 61 7.310 7.310 7.583 -0.273 18533
9315 1 13 . 1 1 63 63 LEU N N 62 120.310 120.310 122.120 -1.810 18533
9316 1 13 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.301 -0.321 18533
9317 1 13 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.298 0.652 18533
9318 1 13 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.019 0.481 18533
9319 1 13 . 1 1 63 63 LEU H H 62 8.090 8.090 8.448 -0.358 18533
9320 1 13 . 1 1 64 64 ARG N N 63 119.440 119.440 119.956 -0.516 18533
9321 1 13 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.296 -0.116 18533
9322 1 13 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.976 0.474 18533
9323 1 13 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.648 0.733 18533
9324 1 13 . 1 1 64 64 ARG H H 63 8.740 8.740 8.555 0.185 18533
9325 1 13 . 1 1 65 65 ALA N N 64 122.560 122.560 121.342 1.218 18533
9326 1 13 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.081 -0.051 18533
9327 1 13 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.071 0.469 18533
9328 1 13 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.317 -0.237 18533
9329 1 13 . 1 1 65 65 ALA H H 64 7.910 7.910 7.900 0.010 18533
9330 1 13 . 1 1 66 66 HIS N N 65 112.690 112.690 114.876 -2.186 18533
9331 1 13 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.649 -0.009 18533
9332 1 13 . 1 1 66 66 HIS CA C 65 55.500 55.500 55.964 -0.464 18533
9333 1 13 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.754 0.566 18533
9334 1 13 . 1 1 66 66 HIS H H 65 7.410 7.410 7.769 -0.359 18533
9335 1 13 . 1 1 67 67 GLY N N 66 107.440 107.440 106.233 1.207 18533
9336 1 13 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.173 1.187 18533
9337 1 13 . 1 1 67 67 GLY H H 66 7.850 7.850 7.578 0.272 18533
9338 1 13 . 1 1 68 68 TYR N N 67 119.940 119.940 121.539 -1.599 18533
9339 1 13 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.851 -0.051 18533
9340 1 13 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.094 1.006 18533
9341 1 13 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.985 0.875 18533
9342 1 13 . 1 1 68 68 TYR H H 67 8.380 8.380 8.318 0.062 18533
9343 1 13 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.553 0.007 18533
9344 1 13 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.923 -0.323 18533
9345 1 13 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.869 -0.059 18533
9346 1 13 . 1 1 70 70 THR N N 69 100.660 100.660 106.869 -6.209 18533
9347 1 13 . 1 1 70 70 THR HA H 69 4.300 4.300 4.429 -0.129 18533
9348 1 13 . 1 1 70 70 THR CA C 69 61.250 61.250 61.191 0.059 18533
9349 1 13 . 1 1 70 70 THR CB C 69 70.740 70.740 69.451 1.289 18533
9350 1 13 . 1 1 70 70 THR H H 69 7.860 7.860 8.029 -0.169 18533
9351 1 13 . 1 1 71 71 ASP N N 70 122.880 122.880 123.439 -0.559 18533
9352 1 13 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.608 -0.198 18533
9353 1 13 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.896 -0.026 18533
9354 1 13 . 1 1 71 71 ASP CB C 70 40.970 40.970 40.910 0.060 18533
9355 1 13 . 1 1 71 71 ASP H H 70 7.940 7.940 7.863 0.077 18533
9356 1 13 . 1 1 72 72 HIS N N 71 121.720 121.720 123.181 -1.461 18533
9357 1 13 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.818 -0.118 18533
9358 1 13 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.432 0.958 18533
9359 1 13 . 1 1 72 72 HIS CB C 71 35.340 35.340 33.332 2.008 18533
9360 1 13 . 1 1 72 72 HIS H H 71 8.000 8.000 8.037 -0.037 18533
9361 1 13 . 1 1 73 73 ARG N N 72 125.760 125.760 126.158 -0.398 18533
9362 1 13 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.981 -0.691 18533
9363 1 13 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.338 0.092 18533
9364 1 13 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.897 0.413 18533
9365 1 13 . 1 1 73 73 ARG H H 72 7.230 7.230 8.072 -0.842 18533
9366 1 13 . 1 1 74 74 ALA N N 73 127.970 127.970 128.718 -0.748 18533
9367 1 13 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.239 0.391 18533
9368 1 13 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.767 -0.587 18533
9369 1 13 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.142 -1.242 18533
9370 1 13 . 1 1 74 74 ALA H H 73 9.090 9.090 8.247 0.843 18533
9371 1 13 . 1 1 75 75 ALA N N 74 126.090 126.090 124.690 1.400 18533
9372 1 13 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.781 0.009 18533
9373 1 13 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.739 0.231 18533
9374 1 13 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.006 1.615 18533
9375 1 13 . 1 1 75 75 ALA H H 74 9.410 9.410 8.358 1.052 18533
9376 1 13 . 1 1 76 76 GLN N N 75 123.260 123.260 118.561 4.699 18533
9377 1 13 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.767 0.183 18533
9378 1 13 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.709 -0.159 18533
9379 1 13 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.613 -1.563 18533
9380 1 13 . 1 1 76 76 GLN H H 75 8.800 8.800 8.363 0.437 18533
9381 1 13 . 1 1 77 77 VAL N N 76 125.510 125.510 123.226 2.284 18533
9382 1 13 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.575 -0.275 18533
9383 1 13 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.991 -0.411 18533
9384 1 13 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.629 1.861 18533
9385 1 13 . 1 1 77 77 VAL H H 76 8.550 8.550 8.017 0.533 18533
9386 1 13 . 1 1 78 78 GLY N N 77 121.850 121.850 116.119 5.731 18533
9387 1 13 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.077 -0.237 18533
9388 1 13 . 1 1 78 78 GLY H H 77 10.930 10.930 7.929 3.001 18533
9389 1 13 . 1 1 79 79 THR N N 78 115.210 115.210 116.179 -0.969 18533
9390 1 13 . 1 1 79 79 THR HA H 78 3.700 3.700 3.990 -0.290 18533
9391 1 13 . 1 1 79 79 THR CA C 78 66.440 66.440 67.205 -0.765 18533
9392 1 13 . 1 1 79 79 THR CB C 78 68.770 68.770 68.610 0.160 18533
9393 1 13 . 1 1 79 79 THR H H 78 8.540 8.540 8.467 0.073 18533
9394 1 13 . 1 1 80 80 GLU N N 79 119.360 119.360 119.163 0.197 18533
9395 1 13 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.027 -0.067 18533
9396 1 13 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.952 0.078 18533
9397 1 13 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.523 0.537 18533
9398 1 13 . 1 1 80 80 GLU H H 79 9.110 9.110 8.911 0.199 18533
9399 1 13 . 1 1 81 81 HIS N N 80 118.380 118.380 117.209 1.171 18533
9400 1 13 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.230 -0.290 18533
9401 1 13 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.883 1.537 18533
9402 1 13 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.160 0.770 18533
9403 1 13 . 1 1 81 81 HIS H H 80 7.040 7.040 7.488 -0.448 18533
9404 1 13 . 1 1 82 82 LEU N N 81 114.010 114.010 119.287 -5.277 18533
9405 1 13 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.056 -0.155 18533
9406 1 13 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.836 -0.156 18533
9407 1 13 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.515 -0.785 18533
9408 1 13 . 1 1 82 82 LEU H H 81 7.850 7.850 8.174 -0.324 18533
9409 1 13 . 1 1 83 83 ALA N N 82 119.050 119.050 118.945 0.105 18533
9410 1 13 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.323 0.067 18533
9411 1 13 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.645 -0.445 18533
9412 1 13 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.798 0.382 18533
9413 1 13 . 1 1 83 83 ALA H H 82 6.950 6.950 7.391 -0.441 18533
9414 1 13 . 1 1 84 84 ALA N N 83 122.500 122.500 120.950 1.550 18533
9415 1 13 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.112 -0.352 18533
9416 1 13 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.443 0.907 18533
9417 1 13 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.175 -1.855 18533
9418 1 13 . 1 1 84 84 ALA H H 83 7.280 7.280 7.208 0.072 18533
9419 1 13 . 1 1 85 85 ASP N N 84 118.740 118.740 119.760 -1.020 18533
9420 1 13 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.644 -0.234 18533
9421 1 13 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.431 1.209 18533
9422 1 13 . 1 1 85 85 ASP CB C 84 42.900 42.900 41.775 1.125 18533
9423 1 13 . 1 1 85 85 ASP H H 84 8.440 8.440 8.758 -0.318 18533
9424 1 13 . 1 1 86 86 LEU N N 85 115.180 115.180 117.961 -2.781 18533
9425 1 13 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.904 -0.724 18533
9426 1 13 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.755 1.285 18533
9427 1 13 . 1 1 86 86 LEU CB C 85 45.170 45.170 45.089 0.081 18533
9428 1 13 . 1 1 86 86 LEU H H 85 7.280 7.280 7.997 -0.717 18533
9429 1 13 . 1 1 87 87 LEU N N 86 128.140 128.140 126.993 1.147 18533
9430 1 13 . 1 1 87 87 LEU HA H 86 4.690 4.690 5.018 -0.328 18533
9431 1 13 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.552 1.828 18533
9432 1 13 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.644 -0.474 18533
9433 1 13 . 1 1 87 87 LEU H H 86 8.780 8.780 8.955 -0.175 18533
9434 1 13 . 1 1 88 88 VAL N N 87 122.630 122.630 126.662 -4.032 18533
9435 1 13 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.891 -0.261 18533
9436 1 13 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.442 -1.532 18533
9437 1 13 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.703 0.137 18533
9438 1 13 . 1 1 88 88 VAL H H 87 9.010 9.010 8.915 0.095 18533
9439 1 13 . 1 1 89 89 ALA N N 88 129.820 129.820 131.576 -1.756 18533
9440 1 13 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.952 -0.432 18533
9441 1 13 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.317 -0.537 18533
9442 1 13 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.264 -0.484 18533
9443 1 13 . 1 1 89 89 ALA H H 88 8.590 8.590 9.204 -0.614 18533
9444 1 13 . 1 1 90 90 LEU N N 89 129.280 129.280 119.779 9.501 18533
9445 1 13 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.651 -0.341 18533
9446 1 13 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.953 0.497 18533
9447 1 13 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.988 -3.968 18533
9448 1 13 . 1 1 90 90 LEU H H 89 8.570 8.570 8.602 -0.032 18533
9449 1 13 . 1 1 91 91 ASP N N 90 126.910 126.910 117.373 9.537 18533
9450 1 13 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.758 0.042 18533
9451 1 13 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.648 0.302 18533
9452 1 13 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.512 0.298 18533
9453 1 13 . 1 1 91 91 ASP H H 90 11.450 11.450 7.528 3.922 18533
9454 1 13 . 1 1 92 92 ARG N N 91 116.950 116.950 123.692 -6.742 18533
9455 1 13 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.867 0.153 18533
9456 1 13 . 1 1 92 92 ARG CA C 91 58.830 58.830 58.922 -0.092 18533
9457 1 13 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.715 0.565 18533
9458 1 13 . 1 1 92 92 ARG H H 91 8.650 8.650 8.324 0.326 18533
9459 1 13 . 1 1 93 93 ASN N N 92 120.740 120.740 118.518 2.222 18533
9460 1 13 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.492 -0.112 18533
9461 1 13 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.737 0.393 18533
9462 1 13 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.595 0.025 18533
9463 1 13 . 1 1 93 93 ASN H H 92 8.610 8.610 8.987 -0.377 18533
9464 1 13 . 1 1 94 94 HIS N N 93 121.170 121.170 119.968 1.202 18533
9465 1 13 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.297 -0.107 18533
9466 1 13 . 1 1 94 94 HIS CA C 93 59.510 59.510 58.762 0.748 18533
9467 1 13 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.396 1.984 18533
9468 1 13 . 1 1 94 94 HIS H H 93 7.430 7.430 7.676 -0.246 18533
9469 1 13 . 1 1 95 95 ALA N N 94 118.270 118.270 121.670 -3.400 18533
9470 1 13 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.944 -0.204 18533
9471 1 13 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.492 0.008 18533
9472 1 13 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.314 -0.344 18533
9473 1 13 . 1 1 95 95 ALA H H 94 7.190 7.190 8.254 -1.064 18533
9474 1 13 . 1 1 96 96 ARG N N 95 117.190 117.190 119.249 -2.059 18533
9475 1 13 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.037 -0.127 18533
9476 1 13 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.255 0.245 18533
9477 1 13 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.035 0.195 18533
9478 1 13 . 1 1 96 96 ARG H H 95 7.600 7.600 7.782 -0.182 18533
9479 1 13 . 1 1 97 97 LEU N N 96 120.700 120.700 119.742 0.958 18533
9480 1 13 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.981 0.099 18533
9481 1 13 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.746 0.154 18533
9482 1 13 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.719 -0.379 18533
9483 1 13 . 1 1 97 97 LEU H H 96 7.990 7.990 7.972 0.018 18533
9484 1 13 . 1 1 98 98 LEU N N 97 118.390 118.390 118.502 -0.112 18533
9485 1 13 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.841 0.069 18533
9486 1 13 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.196 -0.096 18533
9487 1 13 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.369 0.521 18533
9488 1 13 . 1 1 98 98 LEU H H 97 8.210 8.210 8.169 0.041 18533
9489 1 13 . 1 1 99 99 ARG N N 98 117.470 117.470 117.751 -0.281 18533
9490 1 13 . 1 1 99 99 ARG HA H 98 4.480 4.480 3.983 0.497 18533
9491 1 13 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.050 -0.689 18533
9492 1 13 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.700 -0.960 18533
9493 1 13 . 1 1 99 99 ARG H H 98 7.740 7.740 7.901 -0.161 18533
9494 1 13 . 1 1 100 100 GLN N N 99 121.400 121.400 118.844 2.556 18533
9495 1 13 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.179 -0.109 18533
9496 1 13 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.180 0.500 18533
9497 1 13 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.073 0.247 18533
9498 1 13 . 1 1 100 100 GLN H H 99 8.030 8.030 8.079 -0.049 18533
9499 1 13 . 1 1 101 101 LEU N N 100 118.940 118.940 117.075 1.865 18533
9500 1 13 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.163 0.097 18533
9501 1 13 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.351 0.109 18533
9502 1 13 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.125 0.115 18533
9503 1 13 . 1 1 101 101 LEU H H 100 7.780 7.780 7.805 -0.025 18533
9504 1 13 . 1 1 102 102 GLY N N 101 105.740 105.740 104.395 1.345 18533
9505 1 13 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.978 0.052 18533
9506 1 13 . 1 1 102 102 GLY H H 101 7.700 7.700 7.766 -0.066 18533
9507 1 13 . 1 1 103 103 VAL N N 102 122.330 122.330 120.359 1.971 18533
9508 1 13 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.053 -0.423 18533
9509 1 13 . 1 1 103 103 VAL CA C 102 63.600 63.600 61.720 1.880 18533
9510 1 13 . 1 1 103 103 VAL CB C 102 31.490 31.490 32.842 -1.352 18533
9511 1 13 . 1 1 103 103 VAL H H 102 7.520 7.520 7.553 -0.033 18533
9512 1 13 . 1 1 104 104 GLU N N 103 128.990 128.990 114.299 14.691 18533
9513 1 13 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.443 -0.273 18533
9514 1 13 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.368 1.552 18533
9515 1 13 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.637 -3.687 18533
9516 1 13 . 1 1 104 104 GLU H H 103 9.210 9.210 7.963 1.247 18533
9517 1 13 . 1 1 105 105 ALA N N 104 124.410 124.410 122.693 1.717 18533
9518 1 13 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.236 -0.476 18533
9519 1 13 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.717 0.923 18533
9520 1 13 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.433 -0.293 18533
9521 1 13 . 1 1 105 105 ALA H H 104 8.500 8.500 8.704 -0.204 18533
9522 1 13 . 1 1 106 106 ALA N N 105 115.110 115.110 120.212 -5.102 18533
9523 1 13 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.242 -0.112 18533
9524 1 13 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.733 -0.693 18533
9525 1 13 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.385 0.675 18533
9526 1 13 . 1 1 106 106 ALA H H 105 8.270 8.270 8.364 -0.094 18533
9527 1 13 . 1 1 107 107 ARG N N 106 115.080 115.080 114.513 0.567 18533
9528 1 13 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.849 -0.389 18533
9529 1 13 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.831 -0.321 18533
9530 1 13 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.721 0.649 18533
9531 1 13 . 1 1 107 107 ARG H H 106 7.740 7.740 7.640 0.100 18533
9532 1 13 . 1 1 108 108 VAL N N 107 118.170 118.170 122.037 -3.867 18533
9533 1 13 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.295 0.775 18533
9534 1 13 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.127 -1.487 18533
9535 1 13 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.078 1.522 18533
9536 1 13 . 1 1 108 108 VAL H H 107 7.290 7.290 8.163 -0.873 18533
9537 1 13 . 1 1 109 109 ARG N N 108 124.250 124.250 128.014 -3.764 18533
9538 1 13 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.589 0.031 18533
9539 1 13 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.017 -1.127 18533
9540 1 13 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.429 0.551 18533
9541 1 13 . 1 1 109 109 ARG H H 108 8.420 8.420 9.153 -0.733 18533
9542 1 13 . 1 1 110 110 MET N N 109 119.570 119.570 121.946 -2.376 18533
9543 1 13 . 1 1 110 110 MET HA H 109 4.960 4.960 4.936 0.024 18533
9544 1 13 . 1 1 110 110 MET CA C 109 53.820 53.820 54.388 -0.568 18533
9545 1 13 . 1 1 110 110 MET CB C 109 30.680 30.680 32.289 -1.609 18533
9546 1 13 . 1 1 110 110 MET H H 109 8.890 8.890 8.522 0.368 18533
9547 1 13 . 1 1 111 111 LEU N N 110 128.660 128.660 126.531 2.129 18533
9548 1 13 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.296 -0.336 18533
9549 1 13 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.117 0.483 18533
9550 1 13 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.657 -0.577 18533
9551 1 13 . 1 1 111 111 LEU H H 110 9.200 9.200 9.012 0.188 18533
9552 1 13 . 1 1 112 112 ARG N N 111 111.910 111.910 116.220 -4.310 18533
9553 1 13 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.081 -0.131 18533
9554 1 13 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.603 1.317 18533
9555 1 13 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.590 -1.090 18533
9556 1 13 . 1 1 112 112 ARG H H 111 8.930 8.930 8.656 0.274 18533
9557 1 13 . 1 1 113 113 SER N N 112 114.800 114.800 115.677 -0.877 18533
9558 1 13 . 1 1 113 113 SER HA H 112 4.290 4.290 4.268 0.022 18533
9559 1 13 . 1 1 113 113 SER CA C 112 60.880 60.880 60.035 0.845 18533
9560 1 13 . 1 1 113 113 SER CB C 112 63.190 63.190 62.541 0.648 18533
9561 1 13 . 1 1 113 113 SER H H 112 7.680 7.680 7.757 -0.077 18533
9562 1 13 . 1 1 114 114 PHE N N 113 119.260 119.260 118.331 0.929 18533
9563 1 13 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.515 -0.165 18533
9564 1 13 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.889 1.041 18533
9565 1 13 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.660 0.060 18533
9566 1 13 . 1 1 114 114 PHE H H 113 7.600 7.600 7.594 0.006 18533
9567 1 13 . 1 1 115 115 ASP N N 114 121.170 121.170 121.200 -0.030 18533
9568 1 13 . 1 1 115 115 ASP HA H 114 5.020 5.020 5.078 -0.058 18533
9569 1 13 . 1 1 115 115 ASP CA C 114 51.100 51.100 51.475 -0.375 18533
9570 1 13 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.897 0.613 18533
9571 1 13 . 1 1 115 115 ASP H H 114 7.430 7.430 7.613 -0.183 18533
9572 1 13 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.430 0.060 18533
9573 1 13 . 1 1 116 116 PRO CA C 115 64.350 64.350 63.931 0.419 18533
9574 1 13 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.131 0.139 18533
9575 1 13 . 1 1 117 117 ARG N N 116 117.910 117.910 116.122 1.788 18533
9576 1 13 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.466 -0.196 18533
9577 1 13 . 1 1 117 117 ARG CA C 116 56.450 56.450 54.813 1.637 18533
9578 1 13 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.370 -0.411 18533
9579 1 13 . 1 1 117 117 ARG H H 116 8.580 8.580 8.227 0.353 18533
9580 1 13 . 1 1 118 118 SER N N 117 116.130 116.130 116.970 -0.840 18533
9581 1 13 . 1 1 118 118 SER HA H 117 3.980 3.980 4.317 -0.337 18533
9582 1 13 . 1 1 118 118 SER CA C 117 59.790 59.790 58.558 1.232 18533
9583 1 13 . 1 1 118 118 SER CB C 117 63.760 63.760 61.516 2.244 18533
9584 1 13 . 1 1 118 118 SER H H 117 7.950 7.950 7.518 0.432 18533
9585 1 13 . 1 1 119 119 GLY N N 118 110.080 110.080 113.773 -3.693 18533
9586 1 13 . 1 1 119 119 GLY CA C 118 45.370 45.370 47.057 -1.687 18533
9587 1 13 . 1 1 119 119 GLY H H 118 8.150 8.150 8.767 -0.617 18533
9588 1 13 . 1 1 120 120 THR HA H 119 4.020 4.020 4.477 -0.457 18533
9589 1 13 . 1 1 120 120 THR CA C 119 63.290 63.290 62.847 0.443 18533
9590 1 13 . 1 1 120 120 THR CB C 119 69.140 69.140 71.131 -1.991 18533
9591 1 13 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.824 -0.254 18533
9592 1 13 . 1 1 121 121 HIS CA C 120 56.010 56.010 53.774 2.236 18533
9593 1 13 . 1 1 121 121 HIS CB C 120 30.990 30.990 31.994 -1.004 18533
9594 1 13 . 1 1 122 122 ALA N N 121 125.880 125.880 123.937 1.943 18533
9595 1 13 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.550 -0.210 18533
9596 1 13 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.226 0.284 18533
9597 1 13 . 1 1 122 122 ALA CB C 121 18.600 18.600 21.308 -2.708 18533
9598 1 13 . 1 1 122 122 ALA H H 121 7.980 7.980 8.233 -0.253 18533
9599 1 13 . 1 1 123 123 LEU N N 122 119.810 119.810 118.417 1.393 18533
9600 1 13 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.482 -0.202 18533
9601 1 13 . 1 1 123 123 LEU CA C 122 54.490 54.490 55.562 -1.071 18533
9602 1 13 . 1 1 123 123 LEU CB C 122 43.700 43.700 43.494 0.206 18533
9603 1 13 . 1 1 123 123 LEU H H 122 7.810 7.810 8.392 -0.582 18533
9604 1 13 . 1 1 124 124 ASP N N 123 119.050 119.050 117.403 1.647 18533
9605 1 13 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.619 -0.049 18533
9606 1 13 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.904 1.416 18533
9607 1 13 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.311 -0.641 18533
9608 1 13 . 1 1 124 124 ASP H H 123 8.270 8.270 7.539 0.731 18533
9609 1 13 . 1 1 125 125 VAL N N 124 121.970 121.970 123.464 -1.494 18533
9610 1 13 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.271 -0.011 18533
9611 1 13 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.998 1.312 18533
9612 1 13 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.612 -2.832 18533
9613 1 13 . 1 1 125 125 VAL H H 124 7.930 7.930 7.966 -0.036 18533
9614 1 13 . 1 1 126 126 GLU N N 125 129.490 129.490 125.087 4.403 18533
9615 1 13 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.091 -0.011 18533
9616 1 13 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.207 0.803 18533
9617 1 13 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.314 -0.514 18533
9618 1 13 . 1 1 126 126 GLU H H 125 9.100 9.100 8.450 0.650 18533
9619 1 13 . 1 1 127 127 ASP N N 126 122.300 122.300 118.153 4.147 18533
9620 1 13 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.797 -0.687 18533
9621 1 13 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.337 0.383 18533
9622 1 13 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.313 0.207 18533
9623 1 13 . 1 1 127 127 ASP H H 126 8.630 8.630 8.265 0.365 18533
9624 1 13 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.214 0.336 18533
9625 1 13 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.570 -0.970 18533
9626 1 13 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.154 -1.174 18533
9627 1 13 . 1 1 129 129 TYR N N 128 122.380 122.380 122.479 -0.099 18533
9628 1 13 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.327 -0.527 18533
9629 1 13 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.684 3.436 18533
9630 1 13 . 1 1 129 129 TYR CB C 128 39.390 39.390 40.362 -0.972 18533
9631 1 13 . 1 1 129 129 TYR H H 128 8.670 8.670 8.917 -0.247 18533
9632 1 13 . 1 1 130 130 TYR N N 129 116.300 116.300 112.783 3.517 18533
9633 1 13 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.723 -0.233 18533
9634 1 13 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.279 1.201 18533
9635 1 13 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.542 -2.882 18533
9636 1 13 . 1 1 130 130 TYR H H 129 8.680 8.680 7.915 0.765 18533
9637 1 13 . 1 1 131 131 GLY N N 130 110.870 110.870 110.267 0.603 18533
9638 1 13 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.124 -1.044 18533
9639 1 13 . 1 1 131 131 GLY H H 130 8.060 8.060 8.707 -0.647 18533
9640 1 13 . 1 1 132 132 ASP N N 131 121.590 121.590 119.394 2.196 18533
9641 1 13 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.639 0.431 18533
9642 1 13 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.211 -0.211 18533
9643 1 13 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.454 1.146 18533
9644 1 13 . 1 1 132 132 ASP H H 131 9.290 9.290 7.476 1.814 18533
9645 1 13 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.263 -0.153 18533
9646 1 13 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.815 1.755 18533
9647 1 13 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.427 0.053 18533
9648 1 13 . 1 1 134 134 SER N N 133 115.370 115.370 115.333 0.037 18533
9649 1 13 . 1 1 134 134 SER HA H 133 4.180 4.180 4.022 0.158 18533
9650 1 13 . 1 1 134 134 SER CA C 133 62.070 62.070 62.135 -0.065 18533
9651 1 13 . 1 1 134 134 SER CB C 133 62.160 62.160 62.291 -0.131 18533
9652 1 13 . 1 1 134 134 SER H H 133 8.420 8.420 8.247 0.173 18533
9653 1 13 . 1 1 135 135 ASP N N 134 123.360 123.360 120.988 2.372 18533
9654 1 13 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.305 0.225 18533
9655 1 13 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.958 1.082 18533
9656 1 13 . 1 1 135 135 ASP CB C 134 40.810 40.810 39.539 1.271 18533
9657 1 13 . 1 1 135 135 ASP H H 134 7.980 7.980 8.332 -0.352 18533
9658 1 13 . 1 1 136 136 PHE N N 135 118.940 118.940 118.338 0.602 18533
9659 1 13 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.349 -0.549 18533
9660 1 13 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.600 3.220 18533
9661 1 13 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.376 0.974 18533
9662 1 13 . 1 1 136 136 PHE H H 135 7.850 7.850 7.433 0.417 18533
9663 1 13 . 1 1 137 137 GLU N N 136 121.410 121.410 118.383 3.027 18533
9664 1 13 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.166 0.014 18533
9665 1 13 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.817 0.683 18533
9666 1 13 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.312 -0.322 18533
9667 1 13 . 1 1 137 137 GLU H H 136 8.150 8.150 7.926 0.224 18533
9668 1 13 . 1 1 138 138 GLU N N 137 121.530 121.530 121.503 0.027 18533
9669 1 13 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.116 0.174 18533
9670 1 13 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.197 0.203 18533
9671 1 13 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.107 -0.217 18533
9672 1 13 . 1 1 138 138 GLU H H 137 7.870 7.870 8.457 -0.587 18533
9673 1 13 . 1 1 139 139 VAL N N 138 119.930 119.930 119.847 0.083 18533
9674 1 13 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.606 -0.126 18533
9675 1 13 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.319 0.761 18533
9676 1 13 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.601 -0.251 18533
9677 1 13 . 1 1 139 139 VAL H H 138 7.770 7.770 7.576 0.194 18533
9678 1 13 . 1 1 140 140 PHE N N 139 119.130 119.130 120.952 -1.822 18533
9679 1 13 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.071 -0.511 18533
9680 1 13 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.470 1.210 18533
9681 1 13 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.911 0.259 18533
9682 1 13 . 1 1 140 140 PHE H H 139 8.050 8.050 7.925 0.125 18533
9683 1 13 . 1 1 141 141 ALA N N 140 121.040 121.040 121.814 -0.774 18533
9684 1 13 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.171 -0.181 18533
9685 1 13 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.889 0.231 18533
9686 1 13 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.405 -0.106 18533
9687 1 13 . 1 1 141 141 ALA H H 140 8.010 8.010 8.005 0.005 18533
9688 1 13 . 1 1 142 142 VAL N N 141 118.550 118.550 118.638 -0.088 18533
9689 1 13 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.591 0.219 18533
9690 1 13 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.416 -0.816 18533
9691 1 13 . 1 1 142 142 VAL CB C 141 31.450 31.450 30.953 0.497 18533
9692 1 13 . 1 1 142 142 VAL H H 141 8.300 8.300 8.050 0.249 18533
9693 1 13 . 1 1 143 143 ILE N N 142 121.410 121.410 119.637 1.773 18533
9694 1 13 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.501 -0.111 18533
9695 1 13 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.449 0.601 18533
9696 1 13 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.786 -0.476 18533
9697 1 13 . 1 1 143 143 ILE H H 142 8.150 8.150 8.253 -0.103 18533
9698 1 13 . 1 1 144 144 GLU N N 143 119.630 119.630 118.808 0.822 18533
9699 1 13 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.747 -0.207 18533
9700 1 13 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.139 0.621 18533
9701 1 13 . 1 1 144 144 GLU CB C 143 29.730 29.730 29.036 0.694 18533
9702 1 13 . 1 1 144 144 GLU H H 143 8.640 8.640 8.239 0.401 18533
9703 1 13 . 1 1 145 145 SER N N 144 110.920 110.920 113.815 -2.895 18533
9704 1 13 . 1 1 145 145 SER HA H 144 4.230 4.230 4.239 -0.009 18533
9705 1 13 . 1 1 145 145 SER CA C 144 60.810 60.810 60.468 0.342 18533
9706 1 13 . 1 1 145 145 SER CB C 144 63.610 63.610 63.493 0.117 18533
9707 1 13 . 1 1 145 145 SER H H 144 7.640 7.640 7.920 -0.280 18533
9708 1 13 . 1 1 146 146 ALA N N 145 123.110 123.110 124.456 -1.346 18533
9709 1 13 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.356 -0.236 18533
9710 1 13 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.132 -0.732 18533
9711 1 13 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.417 2.463 18533
9712 1 13 . 1 1 146 146 ALA H H 145 7.500 7.500 7.714 -0.214 18533
9713 1 13 . 1 1 147 147 LEU N N 146 114.220 114.220 119.615 -5.395 18533
9714 1 13 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.938 0.002 18533
9715 1 13 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.442 -0.392 18533
9716 1 13 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.428 0.032 18533
9717 1 13 . 1 1 147 147 LEU H H 146 7.410 7.410 8.218 -0.808 18533
9718 1 13 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.287 0.163 18533
9719 1 13 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.619 3.221 18533
9720 1 13 . 1 1 148 148 PRO CB C 147 31.220 31.220 30.978 0.242 18533
9721 1 13 . 1 1 149 149 GLY N N 148 102.590 102.590 106.372 -3.782 18533
9722 1 13 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.628 1.632 18533
9723 1 13 . 1 1 149 149 GLY H H 148 7.960 7.960 7.926 0.034 18533
9724 1 13 . 1 1 150 150 LEU N N 149 128.060 128.060 123.558 4.502 18533
9725 1 13 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.332 0.298 18533
9726 1 13 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.252 0.098 18533
9727 1 13 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.352 -0.152 18533
9728 1 13 . 1 1 150 150 LEU H H 149 7.620 7.620 8.353 -0.733 18533
9729 1 13 . 1 1 151 151 HIS N N 150 120.730 120.730 118.120 2.610 18533
9730 1 13 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.069 0.101 18533
9731 1 13 . 1 1 151 151 HIS CA C 150 62.380 62.380 60.835 1.545 18533
9732 1 13 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.611 0.899 18533
9733 1 13 . 1 1 151 151 HIS H H 150 8.430 8.430 8.555 -0.125 18533
9734 1 13 . 1 1 152 152 ASP N N 151 118.170 118.170 119.756 -1.586 18533
9735 1 13 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.432 -0.012 18533
9736 1 13 . 1 1 152 152 ASP CA C 151 57.810 57.810 58.140 -0.330 18533
9737 1 13 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.655 -0.625 18533
9738 1 13 . 1 1 152 152 ASP H H 151 7.820 7.820 8.149 -0.329 18533
9739 1 13 . 1 1 153 153 TRP N N 152 122.780 122.780 122.254 0.526 18533
9740 1 13 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.603 -0.493 18533
9741 1 13 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.124 1.486 18533
9742 1 13 . 1 1 153 153 TRP CB C 152 29.790 29.790 29.827 -0.037 18533
9743 1 13 . 1 1 153 153 TRP H H 152 7.900 7.900 7.970 -0.070 18533
9744 1 13 . 1 1 154 154 VAL N N 153 119.460 119.460 116.884 2.576 18533
9745 1 13 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.821 -0.471 18533
9746 1 13 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.241 0.739 18533
9747 1 13 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.306 0.594 18533
9748 1 13 . 1 1 154 154 VAL H H 153 8.560 8.560 8.552 0.008 18533
9749 1 13 . 1 1 155 155 ASP N N 154 120.500 120.500 121.177 -0.677 18533
9750 1 13 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.287 -0.087 18533
9751 1 13 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.155 -0.585 18533
9752 1 13 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.689 -0.829 18533
9753 1 13 . 1 1 155 155 ASP H H 154 8.530 8.530 8.447 0.083 18533
9754 1 13 . 1 1 156 156 GLU N N 155 120.090 120.090 119.387 0.703 18533
9755 1 13 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.927 0.003 18533
9756 1 13 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.205 -0.045 18533
9757 1 13 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.290 0.000 18533
9758 1 13 . 1 1 156 156 GLU H H 155 7.870 7.870 8.451 -0.581 18533
9759 1 13 . 1 1 157 157 ARG N N 156 119.230 119.230 118.962 0.268 18533
9760 1 13 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.997 -0.187 18533
9761 1 13 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.184 -0.194 18533
9762 1 13 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.394 -0.284 18533
9763 1 13 . 1 1 157 157 ARG H H 156 7.660 7.660 7.973 -0.313 18533
9764 1 13 . 1 1 158 158 LEU N N 157 118.790 118.790 117.280 1.510 18533
9765 1 13 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.267 -0.167 18533
9766 1 13 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.724 -1.044 18533
9767 1 13 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.697 0.993 18533
9768 1 13 . 1 1 158 158 LEU H H 157 8.470 8.470 8.411 0.059 18533
9769 1 13 . 1 1 159 159 ALA N N 158 120.760 120.760 122.114 -1.354 18533
9770 1 13 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.100 0.090 18533
9771 1 13 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.776 -1.496 18533
9772 1 13 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.403 -0.013 18533
9773 1 13 . 1 1 159 159 ALA H H 158 7.490 7.490 7.748 -0.258 18533
9774 1 13 . 1 1 160 160 ARG N N 159 117.810 117.810 117.114 0.696 18533
9775 1 13 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.047 0.163 18533
9776 1 13 . 1 1 160 160 ARG CA C 159 56.780 56.780 58.345 -1.565 18533
9777 1 13 . 1 1 160 160 ARG CB C 159 30.530 30.530 30.004 0.526 18533
9778 1 13 . 1 1 160 160 ARG H H 159 7.650 7.650 7.780 -0.130 18533
9779 1 13 . 1 1 161 161 ASN N N 160 118.560 118.560 118.152 0.408 18533
9780 1 13 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.604 0.136 18533
9781 1 13 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.128 -1.878 18533
9782 1 13 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.675 0.495 18533
9783 1 13 . 1 1 161 161 ASN H H 160 8.100 8.100 7.585 0.515 18533
9784 1 13 . 1 1 162 162 GLY N N 161 108.900 108.900 107.973 0.927 18533
9785 1 13 . 1 1 162 162 GLY CA C 161 44.730 44.730 43.429 1.301 18533
9786 1 13 . 1 1 162 162 GLY H H 161 7.980 7.980 7.595 0.385 18533
9787 1 13 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.637 -0.177 18533
9788 1 13 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.880 0.570 18533
9789 1 13 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.830 0.370 18533
9790 1 14 . 1 1 2 2 MET N N 1 119.850 119.850 120.558 -0.708 18533
9791 1 14 . 1 1 2 2 MET HA H 1 4.500 4.500 4.670 -0.170 18533
9792 1 14 . 1 1 2 2 MET CA C 1 55.450 55.450 55.605 -0.155 18533
9793 1 14 . 1 1 2 2 MET CB C 1 33.170 33.170 31.256 1.913 18533
9794 1 14 . 1 1 2 2 MET H H 1 8.140 8.140 8.363 -0.223 18533
9795 1 14 . 1 1 3 3 SER N N 2 117.000 117.000 114.742 2.258 18533
9796 1 14 . 1 1 3 3 SER HA H 2 4.430 4.430 4.759 -0.329 18533
9797 1 14 . 1 1 3 3 SER CA C 2 58.320 58.320 58.090 0.230 18533
9798 1 14 . 1 1 3 3 SER CB C 2 63.990 63.990 65.510 -1.520 18533
9799 1 14 . 1 1 3 3 SER H H 2 8.340 8.340 7.690 0.650 18533
9800 1 14 . 1 1 4 4 ASP N N 3 123.200 123.200 119.134 4.066 18533
9801 1 14 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.883 -0.023 18533
9802 1 14 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.893 -0.013 18533
9803 1 14 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.868 -0.069 18533
9804 1 14 . 1 1 4 4 ASP H H 3 8.260 8.260 8.237 0.023 18533
9805 1 14 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.507 -0.107 18533
9806 1 14 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.621 0.199 18533
9807 1 14 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.701 -0.791 18533
9808 1 14 . 1 1 6 6 LEU N N 5 123.160 123.160 120.362 2.798 18533
9809 1 14 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.393 -0.003 18533
9810 1 14 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.228 0.052 18533
9811 1 14 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.690 0.660 18533
9812 1 14 . 1 1 6 6 LEU H H 5 7.670 7.670 7.989 -0.319 18533
9813 1 14 . 1 1 7 7 HIS N N 6 127.160 127.160 117.989 9.171 18533
9814 1 14 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.046 0.984 18533
9815 1 14 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.125 -2.225 18533
9816 1 14 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.473 0.657 18533
9817 1 14 . 1 1 7 7 HIS H H 6 10.080 10.080 8.630 1.450 18533
9818 1 14 . 1 1 8 8 VAL N N 7 128.620 128.620 127.465 1.155 18533
9819 1 14 . 1 1 8 8 VAL HA H 7 4.500 4.500 5.054 -0.554 18533
9820 1 14 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.316 0.484 18533
9821 1 14 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.236 2.563 18533
9822 1 14 . 1 1 8 8 VAL H H 7 8.930 8.930 9.174 -0.244 18533
9823 1 14 . 1 1 9 9 THR N N 8 121.530 121.530 123.259 -1.729 18533
9824 1 14 . 1 1 9 9 THR HA H 8 5.270 5.270 4.719 0.551 18533
9825 1 14 . 1 1 9 9 THR CA C 8 58.520 58.520 59.427 -0.907 18533
9826 1 14 . 1 1 9 9 THR CB C 8 70.750 70.750 69.715 1.036 18533
9827 1 14 . 1 1 9 9 THR H H 8 7.970 7.970 8.943 -0.973 18533
9828 1 14 . 1 1 10 10 PHE N N 9 125.360 125.360 128.600 -3.240 18533
9829 1 14 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.071 0.139 18533
9830 1 14 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.977 0.333 18533
9831 1 14 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.335 3.495 18533
9832 1 14 . 1 1 10 10 PHE H H 9 8.180 8.180 8.184 -0.004 18533
9833 1 14 . 1 1 11 11 VAL N N 10 121.120 121.120 123.491 -2.371 18533
9834 1 14 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.280 0.080 18533
9835 1 14 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.107 -0.687 18533
9836 1 14 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.335 2.215 18533
9837 1 14 . 1 1 11 11 VAL H H 10 8.710 8.710 9.238 -0.528 18533
9838 1 14 . 1 1 12 12 CYS N N 11 123.270 123.270 126.268 -2.998 18533
9839 1 14 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.448 -1.188 18533
9840 1 14 . 1 1 12 12 CYS CA C 11 57.630 57.630 55.583 2.047 18533
9841 1 14 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.087 -0.737 18533
9842 1 14 . 1 1 12 12 CYS H H 11 7.940 7.940 8.911 -0.971 18533
9843 1 14 . 1 1 13 13 THR HA H 12 5.010 5.010 4.124 0.886 18533
9844 1 14 . 1 1 13 13 THR CA C 12 64.870 64.870 63.388 1.482 18533
9845 1 14 . 1 1 13 13 THR CB C 12 69.180 69.180 67.836 1.344 18533
9846 1 14 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.063 -0.103 18533
9847 1 14 . 1 1 15 15 ASN N N 14 119.960 119.960 116.859 3.101 18533
9848 1 14 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.387 -0.457 18533
9849 1 14 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.060 0.810 18533
9850 1 14 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.123 2.547 18533
9851 1 14 . 1 1 15 15 ASN H H 14 9.280 9.280 8.724 0.556 18533
9852 1 14 . 1 1 16 16 ILE N N 15 101.060 101.060 108.655 -7.595 18533
9853 1 14 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.785 -0.105 18533
9854 1 14 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.411 1.379 18533
9855 1 14 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.734 3.406 18533
9856 1 14 . 1 1 16 16 ILE H H 15 7.100 7.100 7.907 -0.807 18533
9857 1 14 . 1 1 17 17 CYS N N 16 116.020 116.020 120.775 -4.755 18533
9858 1 14 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.663 0.277 18533
9859 1 14 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.361 0.700 18533
9860 1 14 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.160 -0.210 18533
9861 1 14 . 1 1 17 17 CYS H H 16 7.700 7.700 7.993 -0.293 18533
9862 1 14 . 1 1 19 19 SER N N 18 122.340 122.340 116.576 5.764 18533
9863 1 14 . 1 1 19 19 SER HA H 18 3.810 3.810 4.249 -0.439 18533
9864 1 14 . 1 1 19 19 SER CA C 18 62.710 62.710 63.072 -0.362 18533
9865 1 14 . 1 1 19 19 SER CB C 18 64.860 64.860 61.018 3.842 18533
9866 1 14 . 1 1 19 19 SER H H 18 11.420 11.420 8.513 2.907 18533
9867 1 14 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.000 -0.030 18533
9868 1 14 . 1 1 20 20 PRO CA C 19 65.030 65.030 65.017 0.013 18533
9869 1 14 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.887 -2.197 18533
9870 1 14 . 1 1 21 21 MET N N 20 112.430 112.430 117.860 -5.430 18533
9871 1 14 . 1 1 21 21 MET HA H 20 3.730 3.730 3.881 -0.151 18533
9872 1 14 . 1 1 21 21 MET CA C 20 60.160 60.160 59.726 0.434 18533
9873 1 14 . 1 1 21 21 MET CB C 20 33.040 33.040 32.126 0.914 18533
9874 1 14 . 1 1 21 21 MET H H 20 6.310 6.310 7.470 -1.160 18533
9875 1 14 . 1 1 22 22 ALA N N 21 117.800 117.800 119.755 -1.955 18533
9876 1 14 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.764 -0.364 18533
9877 1 14 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.361 0.629 18533
9878 1 14 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.634 -1.144 18533
9879 1 14 . 1 1 22 22 ALA H H 21 6.550 6.550 7.403 -0.853 18533
9880 1 14 . 1 1 23 23 GLU N N 22 115.520 115.520 118.622 -3.102 18533
9881 1 14 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.009 -0.329 18533
9882 1 14 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.599 -0.049 18533
9883 1 14 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.738 0.052 18533
9884 1 14 . 1 1 23 23 GLU H H 22 7.800 7.800 7.635 0.165 18533
9885 1 14 . 1 1 24 24 LYS N N 23 114.220 114.220 116.636 -2.416 18533
9886 1 14 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.082 -0.082 18533
9887 1 14 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.075 -0.315 18533
9888 1 14 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.319 -1.519 18533
9889 1 14 . 1 1 24 24 LYS H H 23 8.040 8.040 7.629 0.411 18533
9890 1 14 . 1 1 25 25 MET N N 24 115.250 115.250 118.990 -3.740 18533
9891 1 14 . 1 1 25 25 MET HA H 24 3.950 3.950 3.442 0.508 18533
9892 1 14 . 1 1 25 25 MET CA C 24 57.980 57.980 58.865 -0.885 18533
9893 1 14 . 1 1 25 25 MET CB C 24 35.500 35.500 32.179 3.321 18533
9894 1 14 . 1 1 25 25 MET H H 24 7.610 7.610 7.570 0.040 18533
9895 1 14 . 1 1 26 26 PHE N N 25 119.090 119.090 116.060 3.030 18533
9896 1 14 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.510 -0.170 18533
9897 1 14 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.074 -0.044 18533
9898 1 14 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.379 2.081 18533
9899 1 14 . 1 1 26 26 PHE H H 25 8.560 8.560 7.735 0.825 18533
9900 1 14 . 1 1 27 27 ALA N N 26 117.830 117.830 122.715 -4.885 18533
9901 1 14 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.725 0.205 18533
9902 1 14 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.122 0.938 18533
9903 1 14 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.859 0.551 18533
9904 1 14 . 1 1 27 27 ALA H H 26 8.800 8.800 7.154 1.646 18533
9905 1 14 . 1 1 28 28 GLN N N 27 117.550 117.550 118.264 -0.714 18533
9906 1 14 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.970 0.080 18533
9907 1 14 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.910 0.700 18533
9908 1 14 . 1 1 28 28 GLN CB C 27 28.450 28.450 28.048 0.402 18533
9909 1 14 . 1 1 28 28 GLN H H 27 7.690 7.690 7.781 -0.091 18533
9910 1 14 . 1 1 29 29 GLN N N 28 117.530 117.530 119.826 -2.296 18533
9911 1 14 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.033 0.107 18533
9912 1 14 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.827 0.353 18533
9913 1 14 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.917 -0.807 18533
9914 1 14 . 1 1 29 29 GLN H H 28 8.210 8.210 7.543 0.667 18533
9915 1 14 . 1 1 30 30 LEU N N 29 119.330 119.330 119.301 0.029 18533
9916 1 14 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.040 -0.110 18533
9917 1 14 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.926 0.154 18533
9918 1 14 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.502 0.398 18533
9919 1 14 . 1 1 30 30 LEU H H 29 8.540 8.540 8.327 0.213 18533
9920 1 14 . 1 1 31 31 ARG N N 30 120.880 120.880 117.865 3.015 18533
9921 1 14 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.084 -0.114 18533
9922 1 14 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.036 0.754 18533
9923 1 14 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.438 0.082 18533
9924 1 14 . 1 1 31 31 ARG H H 30 8.050 8.050 7.840 0.210 18533
9925 1 14 . 1 1 32 32 HIS N N 31 119.770 119.770 118.330 1.440 18533
9926 1 14 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.428 0.122 18533
9927 1 14 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.396 -0.316 18533
9928 1 14 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.234 0.476 18533
9929 1 14 . 1 1 32 32 HIS H H 31 8.440 8.440 8.588 -0.148 18533
9930 1 14 . 1 1 33 33 ARG N N 32 115.430 115.430 117.280 -1.850 18533
9931 1 14 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.509 0.081 18533
9932 1 14 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.147 -0.177 18533
9933 1 14 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.862 -0.642 18533
9934 1 14 . 1 1 33 33 ARG H H 32 7.500 7.500 7.841 -0.341 18533
9935 1 14 . 1 1 34 34 GLY N N 33 106.730 106.730 109.169 -2.439 18533
9936 1 14 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.157 1.043 18533
9937 1 14 . 1 1 34 34 GLY H H 33 7.750 7.750 8.303 -0.553 18533
9938 1 14 . 1 1 35 35 LEU N N 34 119.980 119.980 117.178 2.802 18533
9939 1 14 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.856 -0.176 18533
9940 1 14 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.919 0.231 18533
9941 1 14 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.796 0.394 18533
9942 1 14 . 1 1 35 35 LEU H H 34 7.980 7.980 8.519 -0.539 18533
9943 1 14 . 1 1 36 36 GLY N N 35 108.660 108.660 108.654 0.006 18533
9944 1 14 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.734 -0.634 18533
9945 1 14 . 1 1 36 36 GLY H H 35 8.830 8.830 7.764 1.066 18533
9946 1 14 . 1 1 37 37 ASP N N 36 115.360 115.360 120.342 -4.982 18533
9947 1 14 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.565 0.205 18533
9948 1 14 . 1 1 37 37 ASP CA C 36 54.390 54.390 56.560 -2.171 18533
9949 1 14 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.646 0.524 18533
9950 1 14 . 1 1 37 37 ASP H H 36 8.300 8.300 8.231 0.069 18533
9951 1 14 . 1 1 38 38 ALA N N 37 121.460 121.460 120.691 0.769 18533
9952 1 14 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.437 -0.127 18533
9953 1 14 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.195 -0.245 18533
9954 1 14 . 1 1 38 38 ALA CB C 37 20.850 20.850 19.953 0.897 18533
9955 1 14 . 1 1 38 38 ALA H H 37 7.380 7.380 7.645 -0.265 18533
9956 1 14 . 1 1 39 39 VAL N N 38 115.660 115.660 117.008 -1.348 18533
9957 1 14 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.499 0.301 18533
9958 1 14 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.528 -0.488 18533
9959 1 14 . 1 1 39 39 VAL CB C 38 35.190 35.190 35.324 -0.134 18533
9960 1 14 . 1 1 39 39 VAL H H 38 7.100 7.100 7.572 -0.472 18533
9961 1 14 . 1 1 40 40 ARG N N 39 129.230 129.230 127.727 1.503 18533
9962 1 14 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.607 -0.067 18533
9963 1 14 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.229 1.481 18533
9964 1 14 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.279 1.041 18533
9965 1 14 . 1 1 40 40 ARG H H 39 9.730 9.730 8.369 1.361 18533
9966 1 14 . 1 1 41 41 VAL N N 40 126.240 126.240 124.204 2.036 18533
9967 1 14 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.827 0.863 18533
9968 1 14 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.203 -0.642 18533
9969 1 14 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.560 0.380 18533
9970 1 14 . 1 1 41 41 VAL H H 40 8.610 8.610 8.592 0.018 18533
9971 1 14 . 1 1 42 42 THR N N 41 117.310 117.310 117.347 -0.037 18533
9972 1 14 . 1 1 42 42 THR HA H 41 4.890 4.890 4.841 0.049 18533
9973 1 14 . 1 1 42 42 THR CA C 41 60.300 60.300 59.637 0.663 18533
9974 1 14 . 1 1 42 42 THR CB C 41 73.890 73.890 71.023 2.867 18533
9975 1 14 . 1 1 42 42 THR H H 41 8.870 8.870 8.963 -0.094 18533
9976 1 14 . 1 1 43 43 SER N N 42 109.960 109.960 113.452 -3.492 18533
9977 1 14 . 1 1 43 43 SER HA H 42 5.720 5.720 4.898 0.822 18533
9978 1 14 . 1 1 43 43 SER CA C 42 58.090 58.090 57.990 0.100 18533
9979 1 14 . 1 1 43 43 SER CB C 42 65.870 65.870 66.529 -0.659 18533
9980 1 14 . 1 1 43 43 SER H H 42 8.060 8.060 8.604 -0.544 18533
9981 1 14 . 1 1 44 44 ALA N N 43 119.200 119.200 119.543 -0.343 18533
9982 1 14 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.356 -1.096 18533
9983 1 14 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.651 -0.471 18533
9984 1 14 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.973 -1.143 18533
9985 1 14 . 1 1 44 44 ALA H H 43 8.710 8.710 9.039 -0.329 18533
9986 1 14 . 1 1 45 45 GLY N N 44 104.090 104.090 106.215 -2.125 18533
9987 1 14 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.183 -1.643 18533
9988 1 14 . 1 1 45 45 GLY H H 44 8.670 8.670 8.313 0.357 18533
9989 1 14 . 1 1 46 46 THR N N 45 114.060 114.060 117.083 -3.023 18533
9990 1 14 . 1 1 46 46 THR HA H 45 4.080 4.080 4.121 -0.041 18533
9991 1 14 . 1 1 46 46 THR CA C 45 64.680 64.680 64.526 0.154 18533
9992 1 14 . 1 1 46 46 THR CB C 45 67.880 67.880 68.711 -0.831 18533
9993 1 14 . 1 1 46 46 THR H H 45 9.120 9.120 8.394 0.726 18533
9994 1 14 . 1 1 47 47 GLY N N 46 110.380 110.380 107.984 2.396 18533
9995 1 14 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.847 -0.017 18533
9996 1 14 . 1 1 47 47 GLY H H 46 8.930 8.930 8.355 0.575 18533
9997 1 14 . 1 1 48 48 ASN N N 47 113.440 113.440 117.308 -3.868 18533
9998 1 14 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.343 0.147 18533
9999 1 14 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.279 -2.518 18533
10000 1 14 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.714 2.136 18533
10001 1 14 . 1 1 48 48 ASN H H 47 7.600 7.600 7.617 -0.017 18533
10002 1 14 . 1 1 49 49 TRP N N 48 117.300 117.300 121.357 -4.057 18533
10003 1 14 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.405 -0.505 18533
10004 1 14 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.502 0.358 18533
10005 1 14 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.995 -0.475 18533
10006 1 14 . 1 1 49 49 TRP H H 48 6.920 6.920 8.578 -1.658 18533
10007 1 14 . 1 1 50 50 HIS N N 49 111.590 111.590 114.943 -3.353 18533
10008 1 14 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.824 0.056 18533
10009 1 14 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.345 -1.485 18533
10010 1 14 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.730 1.310 18533
10011 1 14 . 1 1 50 50 HIS H H 49 8.620 8.620 8.463 0.157 18533
10012 1 14 . 1 1 51 51 VAL N N 50 119.010 119.010 120.025 -1.015 18533
10013 1 14 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.568 -0.368 18533
10014 1 14 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.444 1.236 18533
10015 1 14 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.652 -0.262 18533
10016 1 14 . 1 1 51 51 VAL H H 50 6.880 6.880 7.361 -0.481 18533
10017 1 14 . 1 1 52 52 GLY N N 51 115.450 115.450 116.517 -1.067 18533
10018 1 14 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.642 -0.702 18533
10019 1 14 . 1 1 52 52 GLY H H 51 9.120 9.120 8.965 0.155 18533
10020 1 14 . 1 1 53 53 SER N N 52 116.620 116.620 115.829 0.791 18533
10021 1 14 . 1 1 53 53 SER HA H 52 4.610 4.610 4.727 -0.117 18533
10022 1 14 . 1 1 53 53 SER CA C 52 59.310 59.310 57.825 1.484 18533
10023 1 14 . 1 1 53 53 SER CB C 52 64.630 64.630 65.046 -0.416 18533
10024 1 14 . 1 1 53 53 SER H H 52 8.430 8.430 7.953 0.477 18533
10025 1 14 . 1 1 54 54 CYS N N 53 118.690 118.690 117.866 0.824 18533
10026 1 14 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.435 -0.335 18533
10027 1 14 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.005 1.665 18533
10028 1 14 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.475 -3.125 18533
10029 1 14 . 1 1 54 54 CYS H H 53 8.170 8.170 8.406 -0.236 18533
10030 1 14 . 1 1 55 55 ALA N N 54 118.580 118.580 124.299 -5.719 18533
10031 1 14 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.150 -0.030 18533
10032 1 14 . 1 1 55 55 ALA CA C 54 52.640 52.640 53.050 -0.410 18533
10033 1 14 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.182 -2.552 18533
10034 1 14 . 1 1 55 55 ALA H H 54 8.420 8.420 8.623 -0.203 18533
10035 1 14 . 1 1 56 56 ASP N N 55 121.500 121.500 123.933 -2.433 18533
10036 1 14 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.432 -0.092 18533
10037 1 14 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.667 0.383 18533
10038 1 14 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.961 3.099 18533
10039 1 14 . 1 1 56 56 ASP H H 55 8.470 8.470 8.420 0.050 18533
10040 1 14 . 1 1 57 57 GLU N N 56 127.840 127.840 126.622 1.218 18533
10041 1 14 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.869 0.171 18533
10042 1 14 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.193 0.447 18533
10043 1 14 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.287 0.213 18533
10044 1 14 . 1 1 57 57 GLU H H 56 9.230 9.230 8.847 0.383 18533
10045 1 14 . 1 1 58 58 ARG N N 57 120.820 120.820 118.120 2.700 18533
10046 1 14 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.797 0.013 18533
10047 1 14 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.414 -0.264 18533
10048 1 14 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.695 -1.425 18533
10049 1 14 . 1 1 58 58 ARG H H 57 9.220 9.220 8.631 0.589 18533
10050 1 14 . 1 1 59 59 ALA N N 58 121.590 121.590 122.258 -0.668 18533
10051 1 14 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.114 0.046 18533
10052 1 14 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.348 0.432 18533
10053 1 14 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.221 0.269 18533
10054 1 14 . 1 1 59 59 ALA H H 58 6.680 6.680 7.538 -0.858 18533
10055 1 14 . 1 1 60 60 ALA N N 59 118.970 118.970 121.525 -2.555 18533
10056 1 14 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.957 -0.097 18533
10057 1 14 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.166 -0.146 18533
10058 1 14 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.383 -0.313 18533
10059 1 14 . 1 1 60 60 ALA H H 59 8.540 8.540 8.519 0.021 18533
10060 1 14 . 1 1 61 61 GLY N N 60 104.160 104.160 106.867 -2.707 18533
10061 1 14 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.136 0.134 18533
10062 1 14 . 1 1 61 61 GLY H H 60 8.210 8.210 8.226 -0.016 18533
10063 1 14 . 1 1 62 62 VAL N N 61 122.820 122.820 118.974 3.846 18533
10064 1 14 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.719 0.132 18533
10065 1 14 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.515 0.735 18533
10066 1 14 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.877 0.013 18533
10067 1 14 . 1 1 62 62 VAL H H 61 7.310 7.310 7.434 -0.124 18533
10068 1 14 . 1 1 63 63 LEU N N 62 120.310 120.310 121.525 -1.215 18533
10069 1 14 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.321 -0.341 18533
10070 1 14 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.727 0.223 18533
10071 1 14 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.386 0.114 18533
10072 1 14 . 1 1 63 63 LEU H H 62 8.090 8.090 8.359 -0.269 18533
10073 1 14 . 1 1 64 64 ARG N N 63 119.440 119.440 119.684 -0.244 18533
10074 1 14 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.321 -0.141 18533
10075 1 14 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.972 0.478 18533
10076 1 14 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.589 0.791 18533
10077 1 14 . 1 1 64 64 ARG H H 63 8.740 8.740 8.560 0.180 18533
10078 1 14 . 1 1 65 65 ALA N N 64 122.560 122.560 121.426 1.134 18533
10079 1 14 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.114 -0.084 18533
10080 1 14 . 1 1 65 65 ALA CA C 64 54.540 54.540 53.986 0.554 18533
10081 1 14 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.344 -0.264 18533
10082 1 14 . 1 1 65 65 ALA H H 64 7.910 7.910 7.711 0.199 18533
10083 1 14 . 1 1 66 66 HIS N N 65 112.690 112.690 115.279 -2.589 18533
10084 1 14 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.662 -0.022 18533
10085 1 14 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.097 -0.597 18533
10086 1 14 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.821 0.499 18533
10087 1 14 . 1 1 66 66 HIS H H 65 7.410 7.410 7.824 -0.414 18533
10088 1 14 . 1 1 67 67 GLY N N 66 107.440 107.440 106.299 1.141 18533
10089 1 14 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.217 1.143 18533
10090 1 14 . 1 1 67 67 GLY H H 66 7.850 7.850 7.508 0.342 18533
10091 1 14 . 1 1 68 68 TYR N N 67 119.940 119.940 121.498 -1.558 18533
10092 1 14 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.839 -0.039 18533
10093 1 14 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.076 1.024 18533
10094 1 14 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.947 0.913 18533
10095 1 14 . 1 1 68 68 TYR H H 67 8.380 8.380 8.280 0.100 18533
10096 1 14 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.489 0.071 18533
10097 1 14 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.937 -0.337 18533
10098 1 14 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.455 0.355 18533
10099 1 14 . 1 1 70 70 THR N N 69 100.660 100.660 107.056 -6.396 18533
10100 1 14 . 1 1 70 70 THR HA H 69 4.300 4.300 4.385 -0.085 18533
10101 1 14 . 1 1 70 70 THR CA C 69 61.250 61.250 61.614 -0.364 18533
10102 1 14 . 1 1 70 70 THR CB C 69 70.740 70.740 70.037 0.703 18533
10103 1 14 . 1 1 70 70 THR H H 69 7.860 7.860 8.027 -0.167 18533
10104 1 14 . 1 1 71 71 ASP N N 70 122.880 122.880 121.512 1.368 18533
10105 1 14 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.899 -0.489 18533
10106 1 14 . 1 1 71 71 ASP CA C 70 55.870 55.870 53.952 1.918 18533
10107 1 14 . 1 1 71 71 ASP CB C 70 40.970 40.970 42.337 -1.367 18533
10108 1 14 . 1 1 71 71 ASP H H 70 7.940 7.940 7.751 0.189 18533
10109 1 14 . 1 1 72 72 HIS N N 71 121.720 121.720 120.833 0.887 18533
10110 1 14 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.769 -0.069 18533
10111 1 14 . 1 1 72 72 HIS CA C 71 57.390 57.390 55.942 1.448 18533
10112 1 14 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.131 3.209 18533
10113 1 14 . 1 1 72 72 HIS H H 71 8.000 8.000 8.072 -0.072 18533
10114 1 14 . 1 1 73 73 ARG N N 72 125.760 125.760 122.493 3.267 18533
10115 1 14 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.918 -0.628 18533
10116 1 14 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.218 0.212 18533
10117 1 14 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.883 0.427 18533
10118 1 14 . 1 1 73 73 ARG H H 72 7.230 7.230 8.198 -0.968 18533
10119 1 14 . 1 1 74 74 ALA N N 73 127.970 127.970 129.173 -1.203 18533
10120 1 14 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.593 0.037 18533
10121 1 14 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.250 -0.070 18533
10122 1 14 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.002 -1.102 18533
10123 1 14 . 1 1 74 74 ALA H H 73 9.090 9.090 8.355 0.735 18533
10124 1 14 . 1 1 75 75 ALA N N 74 126.090 126.090 125.191 0.899 18533
10125 1 14 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.781 0.009 18533
10126 1 14 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.472 0.498 18533
10127 1 14 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.163 1.457 18533
10128 1 14 . 1 1 75 75 ALA H H 74 9.410 9.410 9.635 -0.225 18533
10129 1 14 . 1 1 76 76 GLN N N 75 123.260 123.260 121.034 2.226 18533
10130 1 14 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.607 0.343 18533
10131 1 14 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.966 -0.416 18533
10132 1 14 . 1 1 76 76 GLN CB C 75 30.050 30.050 30.751 -0.701 18533
10133 1 14 . 1 1 76 76 GLN H H 75 8.800 8.800 8.477 0.323 18533
10134 1 14 . 1 1 77 77 VAL N N 76 125.510 125.510 123.736 1.774 18533
10135 1 14 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.405 -0.105 18533
10136 1 14 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.397 0.183 18533
10137 1 14 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.888 2.602 18533
10138 1 14 . 1 1 77 77 VAL H H 76 8.550 8.550 7.937 0.613 18533
10139 1 14 . 1 1 78 78 GLY N N 77 121.850 121.850 116.556 5.294 18533
10140 1 14 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.355 -0.514 18533
10141 1 14 . 1 1 78 78 GLY H H 77 10.930 10.930 8.344 2.586 18533
10142 1 14 . 1 1 79 79 THR N N 78 115.210 115.210 115.643 -0.433 18533
10143 1 14 . 1 1 79 79 THR HA H 78 3.700 3.700 3.991 -0.291 18533
10144 1 14 . 1 1 79 79 THR CA C 78 66.440 66.440 67.559 -1.119 18533
10145 1 14 . 1 1 79 79 THR CB C 78 68.770 68.770 68.872 -0.102 18533
10146 1 14 . 1 1 79 79 THR H H 78 8.540 8.540 8.425 0.115 18533
10147 1 14 . 1 1 80 80 GLU N N 79 119.360 119.360 118.918 0.442 18533
10148 1 14 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.033 -0.073 18533
10149 1 14 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.867 0.163 18533
10150 1 14 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.889 0.171 18533
10151 1 14 . 1 1 80 80 GLU H H 79 9.110 9.110 8.930 0.180 18533
10152 1 14 . 1 1 81 81 HIS N N 80 118.380 118.380 117.332 1.048 18533
10153 1 14 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.281 -0.341 18533
10154 1 14 . 1 1 81 81 HIS CA C 80 60.420 60.420 59.151 1.269 18533
10155 1 14 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.280 0.650 18533
10156 1 14 . 1 1 81 81 HIS H H 80 7.040 7.040 7.521 -0.481 18533
10157 1 14 . 1 1 82 82 LEU N N 81 114.010 114.010 119.285 -5.275 18533
10158 1 14 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.108 -0.208 18533
10159 1 14 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.618 0.062 18533
10160 1 14 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.447 -0.717 18533
10161 1 14 . 1 1 82 82 LEU H H 81 7.850 7.850 8.241 -0.391 18533
10162 1 14 . 1 1 83 83 ALA N N 82 119.050 119.050 118.229 0.821 18533
10163 1 14 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.257 0.133 18533
10164 1 14 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.447 -0.247 18533
10165 1 14 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.863 0.317 18533
10166 1 14 . 1 1 83 83 ALA H H 82 6.950 6.950 7.335 -0.385 18533
10167 1 14 . 1 1 84 84 ALA N N 83 122.500 122.500 122.108 0.392 18533
10168 1 14 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.219 -0.459 18533
10169 1 14 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.058 1.292 18533
10170 1 14 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.149 -1.829 18533
10171 1 14 . 1 1 84 84 ALA H H 83 7.280 7.280 7.254 0.026 18533
10172 1 14 . 1 1 85 85 ASP N N 84 118.740 118.740 120.616 -1.876 18533
10173 1 14 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.669 -0.259 18533
10174 1 14 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.284 1.356 18533
10175 1 14 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.074 0.826 18533
10176 1 14 . 1 1 85 85 ASP H H 84 8.440 8.440 8.393 0.047 18533
10177 1 14 . 1 1 86 86 LEU N N 85 115.180 115.180 118.292 -3.112 18533
10178 1 14 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.832 -0.652 18533
10179 1 14 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.767 1.273 18533
10180 1 14 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.689 0.481 18533
10181 1 14 . 1 1 86 86 LEU H H 85 7.280 7.280 8.237 -0.957 18533
10182 1 14 . 1 1 87 87 LEU N N 86 128.140 128.140 127.684 0.456 18533
10183 1 14 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.880 -0.190 18533
10184 1 14 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.723 1.657 18533
10185 1 14 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.521 -0.351 18533
10186 1 14 . 1 1 87 87 LEU H H 86 8.780 8.780 9.059 -0.279 18533
10187 1 14 . 1 1 88 88 VAL N N 87 122.630 122.630 127.116 -4.486 18533
10188 1 14 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.888 -0.258 18533
10189 1 14 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.449 -1.539 18533
10190 1 14 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.817 0.023 18533
10191 1 14 . 1 1 88 88 VAL H H 87 9.010 9.010 8.976 0.034 18533
10192 1 14 . 1 1 89 89 ALA N N 88 129.820 129.820 131.572 -1.752 18533
10193 1 14 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.811 -0.291 18533
10194 1 14 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.526 -0.746 18533
10195 1 14 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.053 -0.273 18533
10196 1 14 . 1 1 89 89 ALA H H 88 8.590 8.590 9.154 -0.564 18533
10197 1 14 . 1 1 90 90 LEU N N 89 129.280 129.280 120.036 9.244 18533
10198 1 14 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.614 -0.304 18533
10199 1 14 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.252 0.198 18533
10200 1 14 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.895 -3.875 18533
10201 1 14 . 1 1 90 90 LEU H H 89 8.570 8.570 8.619 -0.049 18533
10202 1 14 . 1 1 91 91 ASP N N 90 126.910 126.910 116.698 10.212 18533
10203 1 14 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.798 0.002 18533
10204 1 14 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.513 -0.563 18533
10205 1 14 . 1 1 91 91 ASP CB C 90 43.810 43.810 44.629 -0.819 18533
10206 1 14 . 1 1 91 91 ASP H H 90 11.450 11.450 7.573 3.877 18533
10207 1 14 . 1 1 92 92 ARG N N 91 116.950 116.950 120.573 -3.623 18533
10208 1 14 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.941 0.079 18533
10209 1 14 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.609 -0.779 18533
10210 1 14 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.820 0.460 18533
10211 1 14 . 1 1 92 92 ARG H H 91 8.650 8.650 8.162 0.488 18533
10212 1 14 . 1 1 93 93 ASN N N 92 120.740 120.740 118.524 2.216 18533
10213 1 14 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.488 -0.108 18533
10214 1 14 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.972 0.158 18533
10215 1 14 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.301 0.319 18533
10216 1 14 . 1 1 93 93 ASN H H 92 8.610 8.610 8.178 0.432 18533
10217 1 14 . 1 1 94 94 HIS N N 93 121.170 121.170 119.588 1.582 18533
10218 1 14 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.302 -0.112 18533
10219 1 14 . 1 1 94 94 HIS CA C 93 59.510 59.510 58.960 0.550 18533
10220 1 14 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.436 1.944 18533
10221 1 14 . 1 1 94 94 HIS H H 93 7.430 7.430 7.609 -0.179 18533
10222 1 14 . 1 1 95 95 ALA N N 94 118.270 118.270 121.439 -3.169 18533
10223 1 14 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.962 -0.222 18533
10224 1 14 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.405 0.095 18533
10225 1 14 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.373 -0.403 18533
10226 1 14 . 1 1 95 95 ALA H H 94 7.190 7.190 8.329 -1.139 18533
10227 1 14 . 1 1 96 96 ARG N N 95 117.190 117.190 119.221 -2.031 18533
10228 1 14 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.029 -0.119 18533
10229 1 14 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.323 0.177 18533
10230 1 14 . 1 1 96 96 ARG CB C 95 30.230 30.230 29.976 0.254 18533
10231 1 14 . 1 1 96 96 ARG H H 95 7.600 7.600 7.749 -0.149 18533
10232 1 14 . 1 1 97 97 LEU N N 96 120.700 120.700 119.409 1.291 18533
10233 1 14 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.984 0.096 18533
10234 1 14 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.652 0.248 18533
10235 1 14 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.644 -0.304 18533
10236 1 14 . 1 1 97 97 LEU H H 96 7.990 7.990 7.814 0.176 18533
10237 1 14 . 1 1 98 98 LEU N N 97 118.390 118.390 118.589 -0.199 18533
10238 1 14 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.860 0.050 18533
10239 1 14 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.093 0.007 18533
10240 1 14 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.220 0.670 18533
10241 1 14 . 1 1 98 98 LEU H H 97 8.210 8.210 7.991 0.219 18533
10242 1 14 . 1 1 99 99 ARG N N 98 117.470 117.470 118.283 -0.813 18533
10243 1 14 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.064 0.416 18533
10244 1 14 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.012 -0.652 18533
10245 1 14 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.554 -0.814 18533
10246 1 14 . 1 1 99 99 ARG H H 98 7.740 7.740 7.756 -0.016 18533
10247 1 14 . 1 1 100 100 GLN N N 99 121.400 121.400 118.229 3.171 18533
10248 1 14 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.166 -0.096 18533
10249 1 14 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.160 0.520 18533
10250 1 14 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.405 -0.085 18533
10251 1 14 . 1 1 100 100 GLN H H 99 8.030 8.030 8.121 -0.091 18533
10252 1 14 . 1 1 101 101 LEU N N 100 118.940 118.940 117.516 1.424 18533
10253 1 14 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.232 0.028 18533
10254 1 14 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.255 0.204 18533
10255 1 14 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.283 -0.043 18533
10256 1 14 . 1 1 101 101 LEU H H 100 7.780 7.780 7.913 -0.133 18533
10257 1 14 . 1 1 102 102 GLY N N 101 105.740 105.740 104.128 1.612 18533
10258 1 14 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.475 0.555 18533
10259 1 14 . 1 1 102 102 GLY H H 101 7.700 7.700 7.629 0.071 18533
10260 1 14 . 1 1 103 103 VAL N N 102 122.330 122.330 121.677 0.653 18533
10261 1 14 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.120 -0.490 18533
10262 1 14 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.062 1.538 18533
10263 1 14 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.672 -2.182 18533
10264 1 14 . 1 1 103 103 VAL H H 102 7.520 7.520 7.869 -0.349 18533
10265 1 14 . 1 1 104 104 GLU N N 103 128.990 128.990 114.408 14.582 18533
10266 1 14 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.447 -0.277 18533
10267 1 14 . 1 1 104 104 GLU CA C 103 56.920 56.920 54.913 2.007 18533
10268 1 14 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.619 -3.669 18533
10269 1 14 . 1 1 104 104 GLU H H 103 9.210 9.210 8.025 1.185 18533
10270 1 14 . 1 1 105 105 ALA N N 104 124.410 124.410 122.552 1.858 18533
10271 1 14 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.204 -0.444 18533
10272 1 14 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.039 0.601 18533
10273 1 14 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.672 -0.532 18533
10274 1 14 . 1 1 105 105 ALA H H 104 8.500 8.500 8.683 -0.183 18533
10275 1 14 . 1 1 106 106 ALA N N 105 115.110 115.110 119.970 -4.860 18533
10276 1 14 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.206 -0.076 18533
10277 1 14 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.859 -0.819 18533
10278 1 14 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.635 0.425 18533
10279 1 14 . 1 1 106 106 ALA H H 105 8.270 8.270 8.406 -0.136 18533
10280 1 14 . 1 1 107 107 ARG N N 106 115.080 115.080 114.837 0.243 18533
10281 1 14 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.905 -0.445 18533
10282 1 14 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.695 -0.185 18533
10283 1 14 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.908 0.462 18533
10284 1 14 . 1 1 107 107 ARG H H 106 7.740 7.740 7.876 -0.136 18533
10285 1 14 . 1 1 108 108 VAL N N 107 118.170 118.170 122.237 -4.067 18533
10286 1 14 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.128 0.942 18533
10287 1 14 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.456 -1.816 18533
10288 1 14 . 1 1 108 108 VAL CB C 107 33.600 33.600 31.973 1.627 18533
10289 1 14 . 1 1 108 108 VAL H H 107 7.290 7.290 8.275 -0.985 18533
10290 1 14 . 1 1 109 109 ARG N N 108 124.250 124.250 128.534 -4.284 18533
10291 1 14 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.606 0.014 18533
10292 1 14 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.108 -1.218 18533
10293 1 14 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.336 0.644 18533
10294 1 14 . 1 1 109 109 ARG H H 108 8.420 8.420 9.170 -0.750 18533
10295 1 14 . 1 1 110 110 MET N N 109 119.570 119.570 121.777 -2.207 18533
10296 1 14 . 1 1 110 110 MET HA H 109 4.960 4.960 4.875 0.085 18533
10297 1 14 . 1 1 110 110 MET CA C 109 53.820 53.820 54.268 -0.448 18533
10298 1 14 . 1 1 110 110 MET CB C 109 30.680 30.680 32.354 -1.674 18533
10299 1 14 . 1 1 110 110 MET H H 109 8.890 8.890 8.632 0.258 18533
10300 1 14 . 1 1 111 111 LEU N N 110 128.660 128.660 126.505 2.155 18533
10301 1 14 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.319 -0.359 18533
10302 1 14 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.117 0.482 18533
10303 1 14 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.670 -0.590 18533
10304 1 14 . 1 1 111 111 LEU H H 110 9.200 9.200 9.092 0.108 18533
10305 1 14 . 1 1 112 112 ARG N N 111 111.910 111.910 116.405 -4.495 18533
10306 1 14 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.080 -0.130 18533
10307 1 14 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.703 1.217 18533
10308 1 14 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.579 -1.079 18533
10309 1 14 . 1 1 112 112 ARG H H 111 8.930 8.930 8.633 0.297 18533
10310 1 14 . 1 1 113 113 SER N N 112 114.800 114.800 115.038 -0.238 18533
10311 1 14 . 1 1 113 113 SER HA H 112 4.290 4.290 4.303 -0.013 18533
10312 1 14 . 1 1 113 113 SER CA C 112 60.880 60.880 59.766 1.114 18533
10313 1 14 . 1 1 113 113 SER CB C 112 63.190 63.190 62.408 0.782 18533
10314 1 14 . 1 1 113 113 SER H H 112 7.680 7.680 7.621 0.059 18533
10315 1 14 . 1 1 114 114 PHE N N 113 119.260 119.260 118.643 0.617 18533
10316 1 14 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.502 -0.152 18533
10317 1 14 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.042 0.888 18533
10318 1 14 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.726 -0.006 18533
10319 1 14 . 1 1 114 114 PHE H H 113 7.600 7.600 7.618 -0.018 18533
10320 1 14 . 1 1 115 115 ASP N N 114 121.170 121.170 121.178 -0.008 18533
10321 1 14 . 1 1 115 115 ASP HA H 114 5.020 5.020 5.035 -0.015 18533
10322 1 14 . 1 1 115 115 ASP CA C 114 51.100 51.100 51.639 -0.539 18533
10323 1 14 . 1 1 115 115 ASP CB C 114 42.510 42.510 42.197 0.313 18533
10324 1 14 . 1 1 115 115 ASP H H 114 7.430 7.430 7.505 -0.075 18533
10325 1 14 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.460 0.030 18533
10326 1 14 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.064 0.286 18533
10327 1 14 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.253 0.017 18533
10328 1 14 . 1 1 117 117 ARG N N 116 117.910 117.910 117.142 0.768 18533
10329 1 14 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.456 -0.186 18533
10330 1 14 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.647 0.803 18533
10331 1 14 . 1 1 117 117 ARG CB C 116 29.960 29.960 29.781 0.179 18533
10332 1 14 . 1 1 117 117 ARG H H 116 8.580 8.580 8.288 0.292 18533
10333 1 14 . 1 1 118 118 SER N N 117 116.130 116.130 114.479 1.651 18533
10334 1 14 . 1 1 118 118 SER HA H 117 3.980 3.980 4.300 -0.320 18533
10335 1 14 . 1 1 118 118 SER CA C 117 59.790 59.790 60.933 -1.143 18533
10336 1 14 . 1 1 118 118 SER CB C 117 63.760 63.760 64.121 -0.361 18533
10337 1 14 . 1 1 118 118 SER H H 117 7.950 7.950 7.637 0.313 18533
10338 1 14 . 1 1 119 119 GLY N N 118 110.080 110.080 106.675 3.405 18533
10339 1 14 . 1 1 119 119 GLY CA C 118 45.370 45.370 45.312 0.058 18533
10340 1 14 . 1 1 119 119 GLY H H 118 8.150 8.150 7.891 0.259 18533
10341 1 14 . 1 1 120 120 THR HA H 119 4.020 4.020 4.497 -0.477 18533
10342 1 14 . 1 1 120 120 THR CA C 119 63.290 63.290 62.545 0.745 18533
10343 1 14 . 1 1 120 120 THR CB C 119 69.140 69.140 69.556 -0.416 18533
10344 1 14 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.757 -0.187 18533
10345 1 14 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.173 0.837 18533
10346 1 14 . 1 1 121 121 HIS CB C 120 30.990 30.990 31.341 -0.351 18533
10347 1 14 . 1 1 122 122 ALA N N 121 125.880 125.880 124.898 0.982 18533
10348 1 14 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.525 -0.185 18533
10349 1 14 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.404 0.106 18533
10350 1 14 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.506 -1.906 18533
10351 1 14 . 1 1 122 122 ALA H H 121 7.980 7.980 8.382 -0.402 18533
10352 1 14 . 1 1 123 123 LEU N N 122 119.810 119.810 121.661 -1.851 18533
10353 1 14 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.384 -0.104 18533
10354 1 14 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.223 0.267 18533
10355 1 14 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.156 2.544 18533
10356 1 14 . 1 1 123 123 LEU H H 122 7.810 7.810 8.381 -0.571 18533
10357 1 14 . 1 1 124 124 ASP N N 123 119.050 119.050 114.138 4.912 18533
10358 1 14 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.586 -0.016 18533
10359 1 14 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.245 2.075 18533
10360 1 14 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.042 -0.372 18533
10361 1 14 . 1 1 124 124 ASP H H 123 8.270 8.270 7.438 0.832 18533
10362 1 14 . 1 1 125 125 VAL N N 124 121.970 121.970 120.553 1.417 18533
10363 1 14 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.299 -0.039 18533
10364 1 14 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.893 1.417 18533
10365 1 14 . 1 1 125 125 VAL CB C 124 30.780 30.780 34.059 -3.279 18533
10366 1 14 . 1 1 125 125 VAL H H 124 7.930 7.930 7.998 -0.068 18533
10367 1 14 . 1 1 126 126 GLU N N 125 129.490 129.490 124.377 5.113 18533
10368 1 14 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.210 -0.130 18533
10369 1 14 . 1 1 126 126 GLU CA C 125 57.010 57.010 55.755 1.255 18533
10370 1 14 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.497 -0.697 18533
10371 1 14 . 1 1 126 126 GLU H H 125 9.100 9.100 8.353 0.747 18533
10372 1 14 . 1 1 127 127 ASP N N 126 122.300 122.300 118.476 3.824 18533
10373 1 14 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.867 -0.757 18533
10374 1 14 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.508 0.212 18533
10375 1 14 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.519 0.001 18533
10376 1 14 . 1 1 127 127 ASP H H 126 8.630 8.630 8.205 0.425 18533
10377 1 14 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.245 0.305 18533
10378 1 14 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.729 -1.129 18533
10379 1 14 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.185 -1.205 18533
10380 1 14 . 1 1 129 129 TYR N N 128 122.380 122.380 123.304 -0.924 18533
10381 1 14 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.244 -0.444 18533
10382 1 14 . 1 1 129 129 TYR CA C 128 63.120 63.120 60.076 3.044 18533
10383 1 14 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.727 -0.337 18533
10384 1 14 . 1 1 129 129 TYR H H 128 8.670 8.670 9.589 -0.919 18533
10385 1 14 . 1 1 130 130 TYR N N 129 116.300 116.300 114.350 1.950 18533
10386 1 14 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.718 -0.228 18533
10387 1 14 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.808 0.672 18533
10388 1 14 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.236 -2.576 18533
10389 1 14 . 1 1 130 130 TYR H H 129 8.680 8.680 8.128 0.552 18533
10390 1 14 . 1 1 131 131 GLY N N 130 110.870 110.870 110.614 0.256 18533
10391 1 14 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.836 -0.756 18533
10392 1 14 . 1 1 131 131 GLY H H 130 8.060 8.060 8.461 -0.401 18533
10393 1 14 . 1 1 132 132 ASP N N 131 121.590 121.590 119.126 2.464 18533
10394 1 14 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.660 0.410 18533
10395 1 14 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.230 0.770 18533
10396 1 14 . 1 1 132 132 ASP CB C 131 43.600 43.600 43.026 0.574 18533
10397 1 14 . 1 1 132 132 ASP H H 131 9.290 9.290 7.879 1.411 18533
10398 1 14 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.077 0.033 18533
10399 1 14 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.742 1.828 18533
10400 1 14 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.215 0.265 18533
10401 1 14 . 1 1 134 134 SER N N 133 115.370 115.370 115.377 -0.007 18533
10402 1 14 . 1 1 134 134 SER HA H 133 4.180 4.180 3.953 0.227 18533
10403 1 14 . 1 1 134 134 SER CA C 133 62.070 62.070 62.426 -0.356 18533
10404 1 14 . 1 1 134 134 SER CB C 133 62.160 62.160 62.612 -0.452 18533
10405 1 14 . 1 1 134 134 SER H H 133 8.420 8.420 7.898 0.522 18533
10406 1 14 . 1 1 135 135 ASP N N 134 123.360 123.360 121.541 1.819 18533
10407 1 14 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.356 0.174 18533
10408 1 14 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.723 0.317 18533
10409 1 14 . 1 1 135 135 ASP CB C 134 40.810 40.810 39.871 0.939 18533
10410 1 14 . 1 1 135 135 ASP H H 134 7.980 7.980 8.356 -0.376 18533
10411 1 14 . 1 1 136 136 PHE N N 135 118.940 118.940 118.212 0.728 18533
10412 1 14 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.298 -0.498 18533
10413 1 14 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.052 3.768 18533
10414 1 14 . 1 1 136 136 PHE CB C 135 39.350 39.350 37.989 1.361 18533
10415 1 14 . 1 1 136 136 PHE H H 135 7.850 7.850 7.173 0.677 18533
10416 1 14 . 1 1 137 137 GLU N N 136 121.410 121.410 118.293 3.117 18533
10417 1 14 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.128 0.052 18533
10418 1 14 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.091 0.409 18533
10419 1 14 . 1 1 137 137 GLU CB C 136 28.990 28.990 28.956 0.034 18533
10420 1 14 . 1 1 137 137 GLU H H 136 8.150 8.150 7.870 0.280 18533
10421 1 14 . 1 1 138 138 GLU N N 137 121.530 121.530 121.471 0.059 18533
10422 1 14 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.042 0.248 18533
10423 1 14 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.484 -0.084 18533
10424 1 14 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.040 -0.150 18533
10425 1 14 . 1 1 138 138 GLU H H 137 7.870 7.870 8.328 -0.458 18533
10426 1 14 . 1 1 139 139 VAL N N 138 119.930 119.930 119.662 0.268 18533
10427 1 14 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.710 -0.230 18533
10428 1 14 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.321 0.759 18533
10429 1 14 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.029 0.321 18533
10430 1 14 . 1 1 139 139 VAL H H 138 7.770 7.770 7.637 0.133 18533
10431 1 14 . 1 1 140 140 PHE N N 139 119.130 119.130 121.127 -1.997 18533
10432 1 14 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.936 -0.376 18533
10433 1 14 . 1 1 140 140 PHE CA C 139 62.680 62.680 62.074 0.606 18533
10434 1 14 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.717 0.453 18533
10435 1 14 . 1 1 140 140 PHE H H 139 8.050 8.050 8.217 -0.167 18533
10436 1 14 . 1 1 141 141 ALA N N 140 121.040 121.040 122.544 -1.504 18533
10437 1 14 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.417 -0.427 18533
10438 1 14 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.735 0.385 18533
10439 1 14 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.357 -0.057 18533
10440 1 14 . 1 1 141 141 ALA H H 140 8.010 8.010 8.345 -0.335 18533
10441 1 14 . 1 1 142 142 VAL N N 141 118.550 118.550 119.105 -0.555 18533
10442 1 14 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.674 0.136 18533
10443 1 14 . 1 1 142 142 VAL CA C 141 65.600 65.600 65.841 -0.241 18533
10444 1 14 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.630 -0.180 18533
10445 1 14 . 1 1 142 142 VAL H H 141 8.300 8.300 8.291 0.009 18533
10446 1 14 . 1 1 143 143 ILE N N 142 121.410 121.410 119.702 1.708 18533
10447 1 14 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.492 -0.102 18533
10448 1 14 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.384 0.666 18533
10449 1 14 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.856 -0.546 18533
10450 1 14 . 1 1 143 143 ILE H H 142 8.150 8.150 8.091 0.059 18533
10451 1 14 . 1 1 144 144 GLU N N 143 119.630 119.630 120.218 -0.588 18533
10452 1 14 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.804 -0.264 18533
10453 1 14 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.311 0.449 18533
10454 1 14 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.910 0.820 18533
10455 1 14 . 1 1 144 144 GLU H H 143 8.640 8.640 8.224 0.416 18533
10456 1 14 . 1 1 145 145 SER N N 144 110.920 110.920 114.252 -3.332 18533
10457 1 14 . 1 1 145 145 SER HA H 144 4.230 4.230 4.254 -0.024 18533
10458 1 14 . 1 1 145 145 SER CA C 144 60.810 60.810 61.405 -0.595 18533
10459 1 14 . 1 1 145 145 SER CB C 144 63.610 63.610 63.461 0.149 18533
10460 1 14 . 1 1 145 145 SER H H 144 7.640 7.640 7.964 -0.324 18533
10461 1 14 . 1 1 146 146 ALA N N 145 123.110 123.110 124.494 -1.384 18533
10462 1 14 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.353 -0.233 18533
10463 1 14 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.048 -0.648 18533
10464 1 14 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.291 2.589 18533
10465 1 14 . 1 1 146 146 ALA H H 145 7.500 7.500 7.714 -0.214 18533
10466 1 14 . 1 1 147 147 LEU N N 146 114.220 114.220 119.649 -5.429 18533
10467 1 14 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.881 0.059 18533
10468 1 14 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.479 -0.429 18533
10469 1 14 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.376 0.084 18533
10470 1 14 . 1 1 147 147 LEU H H 146 7.410 7.410 8.211 -0.801 18533
10471 1 14 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.328 0.122 18533
10472 1 14 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.704 3.136 18533
10473 1 14 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.000 0.220 18533
10474 1 14 . 1 1 149 149 GLY N N 148 102.590 102.590 106.377 -3.787 18533
10475 1 14 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.602 1.658 18533
10476 1 14 . 1 1 149 149 GLY H H 148 7.960 7.960 7.922 0.038 18533
10477 1 14 . 1 1 150 150 LEU N N 149 128.060 128.060 123.407 4.653 18533
10478 1 14 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.193 0.437 18533
10479 1 14 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.111 0.239 18533
10480 1 14 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.279 -0.079 18533
10481 1 14 . 1 1 150 150 LEU H H 149 7.620 7.620 8.365 -0.745 18533
10482 1 14 . 1 1 151 151 HIS N N 150 120.730 120.730 118.435 2.295 18533
10483 1 14 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.050 0.120 18533
10484 1 14 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.571 0.809 18533
10485 1 14 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.840 0.670 18533
10486 1 14 . 1 1 151 151 HIS H H 150 8.430 8.430 8.464 -0.034 18533
10487 1 14 . 1 1 152 152 ASP N N 151 118.170 118.170 119.655 -1.485 18533
10488 1 14 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.399 0.021 18533
10489 1 14 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.913 -0.103 18533
10490 1 14 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.642 -0.612 18533
10491 1 14 . 1 1 152 152 ASP H H 151 7.820 7.820 8.216 -0.396 18533
10492 1 14 . 1 1 153 153 TRP N N 152 122.780 122.780 121.808 0.972 18533
10493 1 14 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.349 -0.239 18533
10494 1 14 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.412 1.198 18533
10495 1 14 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.186 -0.397 18533
10496 1 14 . 1 1 153 153 TRP H H 152 7.900 7.900 7.754 0.146 18533
10497 1 14 . 1 1 154 154 VAL N N 153 119.460 119.460 116.772 2.688 18533
10498 1 14 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.821 -0.471 18533
10499 1 14 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.359 0.621 18533
10500 1 14 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.566 0.334 18533
10501 1 14 . 1 1 154 154 VAL H H 153 8.560 8.560 8.493 0.067 18533
10502 1 14 . 1 1 155 155 ASP N N 154 120.500 120.500 121.256 -0.756 18533
10503 1 14 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.323 -0.123 18533
10504 1 14 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.303 -0.733 18533
10505 1 14 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.829 -0.969 18533
10506 1 14 . 1 1 155 155 ASP H H 154 8.530 8.530 8.793 -0.263 18533
10507 1 14 . 1 1 156 156 GLU N N 155 120.090 120.090 119.828 0.262 18533
10508 1 14 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.936 -0.006 18533
10509 1 14 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.266 -0.106 18533
10510 1 14 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.335 -0.045 18533
10511 1 14 . 1 1 156 156 GLU H H 155 7.870 7.870 8.366 -0.496 18533
10512 1 14 . 1 1 157 157 ARG N N 156 119.230 119.230 119.184 0.046 18533
10513 1 14 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.981 -0.171 18533
10514 1 14 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.406 -0.416 18533
10515 1 14 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.327 -0.217 18533
10516 1 14 . 1 1 157 157 ARG H H 156 7.660 7.660 8.033 -0.373 18533
10517 1 14 . 1 1 158 158 LEU N N 157 118.790 118.790 116.544 2.246 18533
10518 1 14 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.211 -0.111 18533
10519 1 14 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.523 -0.843 18533
10520 1 14 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.967 0.723 18533
10521 1 14 . 1 1 158 158 LEU H H 157 8.470 8.470 8.231 0.239 18533
10522 1 14 . 1 1 159 159 ALA N N 158 120.760 120.760 121.242 -0.482 18533
10523 1 14 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.148 0.042 18533
10524 1 14 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.589 -1.309 18533
10525 1 14 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.041 -0.651 18533
10526 1 14 . 1 1 159 159 ALA H H 158 7.490 7.490 7.592 -0.102 18533
10527 1 14 . 1 1 160 160 ARG N N 159 117.810 117.810 116.032 1.778 18533
10528 1 14 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.133 0.077 18533
10529 1 14 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.368 -0.588 18533
10530 1 14 . 1 1 160 160 ARG CB C 159 30.530 30.530 30.112 0.418 18533
10531 1 14 . 1 1 160 160 ARG H H 159 7.650 7.650 8.059 -0.409 18533
10532 1 14 . 1 1 161 161 ASN N N 160 118.560 118.560 119.724 -1.164 18533
10533 1 14 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.737 0.003 18533
10534 1 14 . 1 1 161 161 ASN CA C 160 53.250 53.250 52.029 1.220 18533
10535 1 14 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.021 1.149 18533
10536 1 14 . 1 1 161 161 ASN H H 160 8.100 8.100 8.225 -0.125 18533
10537 1 14 . 1 1 162 162 GLY N N 161 108.900 108.900 108.878 0.022 18533
10538 1 14 . 1 1 162 162 GLY CA C 161 44.730 44.730 43.532 1.198 18533
10539 1 14 . 1 1 162 162 GLY H H 161 7.980 7.980 7.507 0.473 18533
10540 1 14 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.640 -0.180 18533
10541 1 14 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.303 0.147 18533
10542 1 14 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.685 0.515 18533
10543 1 15 . 1 1 2 2 MET N N 1 119.850 119.850 121.490 -1.640 18533
10544 1 15 . 1 1 2 2 MET HA H 1 4.500 4.500 4.690 -0.190 18533
10545 1 15 . 1 1 2 2 MET CA C 1 55.450 55.450 55.342 0.108 18533
10546 1 15 . 1 1 2 2 MET CB C 1 33.170 33.170 35.662 -2.492 18533
10547 1 15 . 1 1 2 2 MET H H 1 8.140 8.140 8.135 0.005 18533
10548 1 15 . 1 1 3 3 SER N N 2 117.000 117.000 119.201 -2.201 18533
10549 1 15 . 1 1 3 3 SER HA H 2 4.430 4.430 4.568 -0.138 18533
10550 1 15 . 1 1 3 3 SER CA C 2 58.320 58.320 57.814 0.506 18533
10551 1 15 . 1 1 3 3 SER CB C 2 63.990 63.990 63.603 0.387 18533
10552 1 15 . 1 1 3 3 SER H H 2 8.340 8.340 8.442 -0.102 18533
10553 1 15 . 1 1 4 4 ASP N N 3 123.200 123.200 126.311 -3.111 18533
10554 1 15 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.714 0.146 18533
10555 1 15 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.573 0.307 18533
10556 1 15 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.245 0.555 18533
10557 1 15 . 1 1 4 4 ASP H H 3 8.260 8.260 8.447 -0.187 18533
10558 1 15 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.360 0.040 18533
10559 1 15 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.640 0.180 18533
10560 1 15 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.570 -0.660 18533
10561 1 15 . 1 1 6 6 LEU N N 5 123.160 123.160 119.896 3.264 18533
10562 1 15 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.309 0.081 18533
10563 1 15 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.078 0.202 18533
10564 1 15 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.782 1.567 18533
10565 1 15 . 1 1 6 6 LEU H H 5 7.670 7.670 8.130 -0.460 18533
10566 1 15 . 1 1 7 7 HIS N N 6 127.160 127.160 118.140 9.020 18533
10567 1 15 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.141 0.889 18533
10568 1 15 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.259 -2.359 18533
10569 1 15 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.841 0.289 18533
10570 1 15 . 1 1 7 7 HIS H H 6 10.080 10.080 8.652 1.428 18533
10571 1 15 . 1 1 8 8 VAL N N 7 128.620 128.620 127.047 1.573 18533
10572 1 15 . 1 1 8 8 VAL HA H 7 4.500 4.500 5.013 -0.513 18533
10573 1 15 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.401 0.399 18533
10574 1 15 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.981 2.819 18533
10575 1 15 . 1 1 8 8 VAL H H 7 8.930 8.930 9.197 -0.267 18533
10576 1 15 . 1 1 9 9 THR N N 8 121.530 121.530 123.411 -1.881 18533
10577 1 15 . 1 1 9 9 THR HA H 8 5.270 5.270 4.758 0.512 18533
10578 1 15 . 1 1 9 9 THR CA C 8 58.520 58.520 59.481 -0.961 18533
10579 1 15 . 1 1 9 9 THR CB C 8 70.750 70.750 70.022 0.728 18533
10580 1 15 . 1 1 9 9 THR H H 8 7.970 7.970 8.971 -1.001 18533
10581 1 15 . 1 1 10 10 PHE N N 9 125.360 125.360 127.868 -2.508 18533
10582 1 15 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.069 0.141 18533
10583 1 15 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.929 0.381 18533
10584 1 15 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.713 3.117 18533
10585 1 15 . 1 1 10 10 PHE H H 9 8.180 8.180 8.130 0.050 18533
10586 1 15 . 1 1 11 11 VAL N N 10 121.120 121.120 122.337 -1.217 18533
10587 1 15 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.343 0.017 18533
10588 1 15 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.874 -0.454 18533
10589 1 15 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.791 1.759 18533
10590 1 15 . 1 1 11 11 VAL H H 10 8.710 8.710 9.228 -0.518 18533
10591 1 15 . 1 1 12 12 CYS N N 11 123.270 123.270 126.138 -2.868 18533
10592 1 15 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.332 -1.072 18533
10593 1 15 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.396 1.234 18533
10594 1 15 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.799 -1.449 18533
10595 1 15 . 1 1 12 12 CYS H H 11 7.940 7.940 8.833 -0.893 18533
10596 1 15 . 1 1 13 13 THR HA H 12 5.010 5.010 3.944 1.066 18533
10597 1 15 . 1 1 13 13 THR CA C 12 64.870 64.870 63.225 1.645 18533
10598 1 15 . 1 1 13 13 THR CB C 12 69.180 69.180 67.942 1.238 18533
10599 1 15 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.267 -0.307 18533
10600 1 15 . 1 1 15 15 ASN N N 14 119.960 119.960 117.323 2.637 18533
10601 1 15 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.391 -0.461 18533
10602 1 15 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.054 0.816 18533
10603 1 15 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.071 3.599 18533
10604 1 15 . 1 1 15 15 ASN H H 14 9.280 9.280 8.542 0.738 18533
10605 1 15 . 1 1 16 16 ILE N N 15 101.060 101.060 109.441 -8.381 18533
10606 1 15 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.622 0.058 18533
10607 1 15 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.393 1.397 18533
10608 1 15 . 1 1 16 16 ILE CB C 15 42.140 42.140 40.129 2.011 18533
10609 1 15 . 1 1 16 16 ILE H H 15 7.100 7.100 8.177 -1.077 18533
10610 1 15 . 1 1 17 17 CYS N N 16 116.020 116.020 120.399 -4.379 18533
10611 1 15 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.471 0.469 18533
10612 1 15 . 1 1 17 17 CYS CA C 16 60.060 60.060 60.331 -0.271 18533
10613 1 15 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.642 -0.692 18533
10614 1 15 . 1 1 17 17 CYS H H 16 7.700 7.700 8.047 -0.347 18533
10615 1 15 . 1 1 19 19 SER N N 18 122.340 122.340 116.740 5.600 18533
10616 1 15 . 1 1 19 19 SER HA H 18 3.810 3.810 4.196 -0.386 18533
10617 1 15 . 1 1 19 19 SER CA C 18 62.710 62.710 63.105 -0.395 18533
10618 1 15 . 1 1 19 19 SER CB C 18 64.860 64.860 61.090 3.770 18533
10619 1 15 . 1 1 19 19 SER H H 18 11.420 11.420 8.567 2.853 18533
10620 1 15 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.262 -0.292 18533
10621 1 15 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.965 0.065 18533
10622 1 15 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.856 -2.166 18533
10623 1 15 . 1 1 21 21 MET N N 20 112.430 112.430 118.218 -5.788 18533
10624 1 15 . 1 1 21 21 MET HA H 20 3.730 3.730 3.892 -0.162 18533
10625 1 15 . 1 1 21 21 MET CA C 20 60.160 60.160 59.711 0.449 18533
10626 1 15 . 1 1 21 21 MET CB C 20 33.040 33.040 32.156 0.885 18533
10627 1 15 . 1 1 21 21 MET H H 20 6.310 6.310 7.483 -1.173 18533
10628 1 15 . 1 1 22 22 ALA N N 21 117.800 117.800 119.754 -1.954 18533
10629 1 15 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.853 -0.453 18533
10630 1 15 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.363 0.627 18533
10631 1 15 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.523 -1.033 18533
10632 1 15 . 1 1 22 22 ALA H H 21 6.550 6.550 7.436 -0.886 18533
10633 1 15 . 1 1 23 23 GLU N N 22 115.520 115.520 118.622 -3.102 18533
10634 1 15 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.040 -0.360 18533
10635 1 15 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.643 -0.093 18533
10636 1 15 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.753 0.037 18533
10637 1 15 . 1 1 23 23 GLU H H 22 7.800 7.800 7.580 0.220 18533
10638 1 15 . 1 1 24 24 LYS N N 23 114.220 114.220 116.098 -1.878 18533
10639 1 15 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.171 -0.171 18533
10640 1 15 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.902 -0.142 18533
10641 1 15 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.483 -1.683 18533
10642 1 15 . 1 1 24 24 LYS H H 23 8.040 8.040 7.492 0.548 18533
10643 1 15 . 1 1 25 25 MET N N 24 115.250 115.250 119.985 -4.735 18533
10644 1 15 . 1 1 25 25 MET HA H 24 3.950 3.950 3.492 0.458 18533
10645 1 15 . 1 1 25 25 MET CA C 24 57.980 57.980 59.016 -1.036 18533
10646 1 15 . 1 1 25 25 MET CB C 24 35.500 35.500 32.542 2.958 18533
10647 1 15 . 1 1 25 25 MET H H 24 7.610 7.610 7.685 -0.075 18533
10648 1 15 . 1 1 26 26 PHE N N 25 119.090 119.090 116.546 2.544 18533
10649 1 15 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.572 -0.232 18533
10650 1 15 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.935 0.095 18533
10651 1 15 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.525 1.935 18533
10652 1 15 . 1 1 26 26 PHE H H 25 8.560 8.560 7.706 0.854 18533
10653 1 15 . 1 1 27 27 ALA N N 26 117.830 117.830 122.366 -4.536 18533
10654 1 15 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.775 0.155 18533
10655 1 15 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.111 0.949 18533
10656 1 15 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.887 0.523 18533
10657 1 15 . 1 1 27 27 ALA H H 26 8.800 8.800 7.201 1.599 18533
10658 1 15 . 1 1 28 28 GLN N N 27 117.550 117.550 118.378 -0.828 18533
10659 1 15 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.008 0.042 18533
10660 1 15 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.917 0.693 18533
10661 1 15 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.908 0.542 18533
10662 1 15 . 1 1 28 28 GLN H H 27 7.690 7.690 7.771 -0.081 18533
10663 1 15 . 1 1 29 29 GLN N N 28 117.530 117.530 119.828 -2.298 18533
10664 1 15 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.110 0.030 18533
10665 1 15 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.824 0.356 18533
10666 1 15 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.946 -0.836 18533
10667 1 15 . 1 1 29 29 GLN H H 28 8.210 8.210 7.571 0.639 18533
10668 1 15 . 1 1 30 30 LEU N N 29 119.330 119.330 120.488 -1.158 18533
10669 1 15 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.024 -0.094 18533
10670 1 15 . 1 1 30 30 LEU CA C 29 58.080 58.080 58.244 -0.164 18533
10671 1 15 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.433 0.467 18533
10672 1 15 . 1 1 30 30 LEU H H 29 8.540 8.540 8.348 0.192 18533
10673 1 15 . 1 1 31 31 ARG N N 30 120.880 120.880 117.376 3.504 18533
10674 1 15 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.055 -0.085 18533
10675 1 15 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.168 0.622 18533
10676 1 15 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.463 0.057 18533
10677 1 15 . 1 1 31 31 ARG H H 30 8.050 8.050 7.850 0.200 18533
10678 1 15 . 1 1 32 32 HIS N N 31 119.770 119.770 118.518 1.252 18533
10679 1 15 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.440 0.110 18533
10680 1 15 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.633 -0.553 18533
10681 1 15 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.264 0.446 18533
10682 1 15 . 1 1 32 32 HIS H H 31 8.440 8.440 8.260 0.180 18533
10683 1 15 . 1 1 33 33 ARG N N 32 115.430 115.430 116.980 -1.550 18533
10684 1 15 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.481 0.109 18533
10685 1 15 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.138 -0.168 18533
10686 1 15 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.686 -0.466 18533
10687 1 15 . 1 1 33 33 ARG H H 32 7.500 7.500 7.814 -0.314 18533
10688 1 15 . 1 1 34 34 GLY N N 33 106.730 106.730 108.603 -1.873 18533
10689 1 15 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.083 1.117 18533
10690 1 15 . 1 1 34 34 GLY H H 33 7.750 7.750 8.267 -0.517 18533
10691 1 15 . 1 1 35 35 LEU N N 34 119.980 119.980 117.416 2.564 18533
10692 1 15 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.862 -0.182 18533
10693 1 15 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.709 0.441 18533
10694 1 15 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.433 0.757 18533
10695 1 15 . 1 1 35 35 LEU H H 34 7.980 7.980 8.500 -0.520 18533
10696 1 15 . 1 1 36 36 GLY N N 35 108.660 108.660 108.896 -0.236 18533
10697 1 15 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.527 -0.427 18533
10698 1 15 . 1 1 36 36 GLY H H 35 8.830 8.830 7.907 0.923 18533
10699 1 15 . 1 1 37 37 ASP N N 36 115.360 115.360 118.145 -2.785 18533
10700 1 15 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.629 0.141 18533
10701 1 15 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.400 -1.010 18533
10702 1 15 . 1 1 37 37 ASP CB C 36 41.170 41.170 41.177 -0.007 18533
10703 1 15 . 1 1 37 37 ASP H H 36 8.300 8.300 8.228 0.072 18533
10704 1 15 . 1 1 38 38 ALA N N 37 121.460 121.460 119.918 1.542 18533
10705 1 15 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.298 0.012 18533
10706 1 15 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.070 -0.120 18533
10707 1 15 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.419 0.431 18533
10708 1 15 . 1 1 38 38 ALA H H 37 7.380 7.380 7.676 -0.296 18533
10709 1 15 . 1 1 39 39 VAL N N 38 115.660 115.660 116.387 -0.727 18533
10710 1 15 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.544 0.256 18533
10711 1 15 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.075 -0.035 18533
10712 1 15 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.466 0.724 18533
10713 1 15 . 1 1 39 39 VAL H H 38 7.100 7.100 7.852 -0.752 18533
10714 1 15 . 1 1 40 40 ARG N N 39 129.230 129.230 127.672 1.558 18533
10715 1 15 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.475 0.065 18533
10716 1 15 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.683 1.027 18533
10717 1 15 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.772 1.548 18533
10718 1 15 . 1 1 40 40 ARG H H 39 9.730 9.730 8.594 1.136 18533
10719 1 15 . 1 1 41 41 VAL N N 40 126.240 126.240 125.788 0.452 18533
10720 1 15 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.927 0.763 18533
10721 1 15 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.102 -0.542 18533
10722 1 15 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.711 -0.771 18533
10723 1 15 . 1 1 41 41 VAL H H 40 8.610 8.610 8.442 0.168 18533
10724 1 15 . 1 1 42 42 THR N N 41 117.310 117.310 118.946 -1.636 18533
10725 1 15 . 1 1 42 42 THR HA H 41 4.890 4.890 4.919 -0.029 18533
10726 1 15 . 1 1 42 42 THR CA C 41 60.300 60.300 59.819 0.481 18533
10727 1 15 . 1 1 42 42 THR CB C 41 73.890 73.890 71.873 2.018 18533
10728 1 15 . 1 1 42 42 THR H H 41 8.870 8.870 9.183 -0.313 18533
10729 1 15 . 1 1 43 43 SER N N 42 109.960 109.960 113.289 -3.329 18533
10730 1 15 . 1 1 43 43 SER HA H 42 5.720 5.720 5.088 0.632 18533
10731 1 15 . 1 1 43 43 SER CA C 42 58.090 58.090 57.993 0.097 18533
10732 1 15 . 1 1 43 43 SER CB C 42 65.870 65.870 66.586 -0.716 18533
10733 1 15 . 1 1 43 43 SER H H 42 8.060 8.060 8.681 -0.621 18533
10734 1 15 . 1 1 44 44 ALA N N 43 119.200 119.200 119.983 -0.783 18533
10735 1 15 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.320 -1.060 18533
10736 1 15 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.658 -0.478 18533
10737 1 15 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.191 -1.361 18533
10738 1 15 . 1 1 44 44 ALA H H 43 8.710 8.710 9.113 -0.403 18533
10739 1 15 . 1 1 45 45 GLY N N 44 104.090 104.090 106.824 -2.734 18533
10740 1 15 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.020 -1.480 18533
10741 1 15 . 1 1 45 45 GLY H H 44 8.670 8.670 8.223 0.447 18533
10742 1 15 . 1 1 46 46 THR N N 45 114.060 114.060 117.257 -3.197 18533
10743 1 15 . 1 1 46 46 THR HA H 45 4.080 4.080 4.128 -0.048 18533
10744 1 15 . 1 1 46 46 THR CA C 45 64.680 64.680 64.814 -0.134 18533
10745 1 15 . 1 1 46 46 THR CB C 45 67.880 67.880 68.598 -0.718 18533
10746 1 15 . 1 1 46 46 THR H H 45 9.120 9.120 8.468 0.652 18533
10747 1 15 . 1 1 47 47 GLY N N 46 110.380 110.380 108.433 1.947 18533
10748 1 15 . 1 1 47 47 GLY CA C 46 43.830 43.830 44.023 -0.193 18533
10749 1 15 . 1 1 47 47 GLY H H 46 8.930 8.930 8.263 0.667 18533
10750 1 15 . 1 1 48 48 ASN N N 47 113.440 113.440 117.841 -4.401 18533
10751 1 15 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.396 0.094 18533
10752 1 15 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.263 -2.503 18533
10753 1 15 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.872 1.978 18533
10754 1 15 . 1 1 48 48 ASN H H 47 7.600 7.600 7.644 -0.044 18533
10755 1 15 . 1 1 49 49 TRP N N 48 117.300 117.300 121.189 -3.889 18533
10756 1 15 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.458 -0.558 18533
10757 1 15 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.259 0.601 18533
10758 1 15 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.986 -0.466 18533
10759 1 15 . 1 1 49 49 TRP H H 48 6.920 6.920 8.649 -1.729 18533
10760 1 15 . 1 1 50 50 HIS N N 49 111.590 111.590 115.162 -3.572 18533
10761 1 15 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.763 0.117 18533
10762 1 15 . 1 1 50 50 HIS CA C 49 53.860 53.860 54.916 -1.056 18533
10763 1 15 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.824 1.216 18533
10764 1 15 . 1 1 50 50 HIS H H 49 8.620 8.620 8.494 0.126 18533
10765 1 15 . 1 1 51 51 VAL N N 50 119.010 119.010 120.931 -1.921 18533
10766 1 15 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.753 -0.553 18533
10767 1 15 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.923 0.757 18533
10768 1 15 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.052 0.338 18533
10769 1 15 . 1 1 51 51 VAL H H 50 6.880 6.880 7.358 -0.478 18533
10770 1 15 . 1 1 52 52 GLY N N 51 115.450 115.450 116.695 -1.245 18533
10771 1 15 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.215 -0.275 18533
10772 1 15 . 1 1 52 52 GLY H H 51 9.120 9.120 8.865 0.255 18533
10773 1 15 . 1 1 53 53 SER N N 52 116.620 116.620 115.651 0.969 18533
10774 1 15 . 1 1 53 53 SER HA H 52 4.610 4.610 4.586 0.024 18533
10775 1 15 . 1 1 53 53 SER CA C 52 59.310 59.310 57.932 1.378 18533
10776 1 15 . 1 1 53 53 SER CB C 52 64.630 64.630 65.087 -0.457 18533
10777 1 15 . 1 1 53 53 SER H H 52 8.430 8.430 7.962 0.468 18533
10778 1 15 . 1 1 54 54 CYS N N 53 118.690 118.690 118.256 0.434 18533
10779 1 15 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.610 -0.510 18533
10780 1 15 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.004 1.666 18533
10781 1 15 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.282 -2.932 18533
10782 1 15 . 1 1 54 54 CYS H H 53 8.170 8.170 8.449 -0.279 18533
10783 1 15 . 1 1 55 55 ALA N N 54 118.580 118.580 123.296 -4.716 18533
10784 1 15 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.216 -0.096 18533
10785 1 15 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.639 0.001 18533
10786 1 15 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.283 -2.653 18533
10787 1 15 . 1 1 55 55 ALA H H 54 8.420 8.420 8.521 -0.101 18533
10788 1 15 . 1 1 56 56 ASP N N 55 121.500 121.500 123.076 -1.576 18533
10789 1 15 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.415 -0.075 18533
10790 1 15 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.890 0.160 18533
10791 1 15 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.342 3.718 18533
10792 1 15 . 1 1 56 56 ASP H H 55 8.470 8.470 8.569 -0.099 18533
10793 1 15 . 1 1 57 57 GLU N N 56 127.840 127.840 126.928 0.912 18533
10794 1 15 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.845 0.195 18533
10795 1 15 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.368 0.272 18533
10796 1 15 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.398 0.102 18533
10797 1 15 . 1 1 57 57 GLU H H 56 9.230 9.230 8.896 0.334 18533
10798 1 15 . 1 1 58 58 ARG N N 57 120.820 120.820 118.330 2.490 18533
10799 1 15 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.824 -0.014 18533
10800 1 15 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.025 0.125 18533
10801 1 15 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.415 -1.145 18533
10802 1 15 . 1 1 58 58 ARG H H 57 9.220 9.220 8.102 1.118 18533
10803 1 15 . 1 1 59 59 ALA N N 58 121.590 121.590 122.535 -0.945 18533
10804 1 15 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.139 0.021 18533
10805 1 15 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.515 0.265 18533
10806 1 15 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.137 0.353 18533
10807 1 15 . 1 1 59 59 ALA H H 58 6.680 6.680 7.607 -0.927 18533
10808 1 15 . 1 1 60 60 ALA N N 59 118.970 118.970 121.463 -2.493 18533
10809 1 15 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.960 -0.100 18533
10810 1 15 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.194 -0.174 18533
10811 1 15 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.378 -0.308 18533
10812 1 15 . 1 1 60 60 ALA H H 59 8.540 8.540 8.658 -0.118 18533
10813 1 15 . 1 1 61 61 GLY N N 60 104.160 104.160 106.923 -2.763 18533
10814 1 15 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.056 0.214 18533
10815 1 15 . 1 1 61 61 GLY H H 60 8.210 8.210 7.978 0.232 18533
10816 1 15 . 1 1 62 62 VAL N N 61 122.820 122.820 123.246 -0.426 18533
10817 1 15 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.617 0.233 18533
10818 1 15 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.965 -0.715 18533
10819 1 15 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.759 0.132 18533
10820 1 15 . 1 1 62 62 VAL H H 61 7.310 7.310 7.573 -0.263 18533
10821 1 15 . 1 1 63 63 LEU N N 62 120.310 120.310 118.327 1.983 18533
10822 1 15 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.171 -0.191 18533
10823 1 15 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.161 0.789 18533
10824 1 15 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.388 0.112 18533
10825 1 15 . 1 1 63 63 LEU H H 62 8.090 8.090 8.465 -0.375 18533
10826 1 15 . 1 1 64 64 ARG N N 63 119.440 119.440 119.431 0.009 18533
10827 1 15 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.354 -0.174 18533
10828 1 15 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.831 0.619 18533
10829 1 15 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.689 0.692 18533
10830 1 15 . 1 1 64 64 ARG H H 63 8.740 8.740 8.409 0.331 18533
10831 1 15 . 1 1 65 65 ALA N N 64 122.560 122.560 121.564 0.996 18533
10832 1 15 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.083 -0.053 18533
10833 1 15 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.021 0.519 18533
10834 1 15 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.314 -0.234 18533
10835 1 15 . 1 1 65 65 ALA H H 64 7.910 7.910 7.905 0.005 18533
10836 1 15 . 1 1 66 66 HIS N N 65 112.690 112.690 114.761 -2.071 18533
10837 1 15 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.639 0.001 18533
10838 1 15 . 1 1 66 66 HIS CA C 65 55.500 55.500 55.956 -0.456 18533
10839 1 15 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.901 0.419 18533
10840 1 15 . 1 1 66 66 HIS H H 65 7.410 7.410 7.836 -0.426 18533
10841 1 15 . 1 1 67 67 GLY N N 66 107.440 107.440 106.336 1.104 18533
10842 1 15 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.172 1.188 18533
10843 1 15 . 1 1 67 67 GLY H H 66 7.850 7.850 7.586 0.264 18533
10844 1 15 . 1 1 68 68 TYR N N 67 119.940 119.940 121.478 -1.538 18533
10845 1 15 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.807 -0.007 18533
10846 1 15 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.117 0.983 18533
10847 1 15 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.635 1.225 18533
10848 1 15 . 1 1 68 68 TYR H H 67 8.380 8.380 8.244 0.136 18533
10849 1 15 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.485 0.075 18533
10850 1 15 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.922 -0.322 18533
10851 1 15 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.345 0.465 18533
10852 1 15 . 1 1 70 70 THR N N 69 100.660 100.660 107.525 -6.865 18533
10853 1 15 . 1 1 70 70 THR HA H 69 4.300 4.300 4.490 -0.190 18533
10854 1 15 . 1 1 70 70 THR CA C 69 61.250 61.250 61.047 0.203 18533
10855 1 15 . 1 1 70 70 THR CB C 69 70.740 70.740 69.501 1.239 18533
10856 1 15 . 1 1 70 70 THR H H 69 7.860 7.860 8.047 -0.187 18533
10857 1 15 . 1 1 71 71 ASP N N 70 122.880 122.880 121.509 1.371 18533
10858 1 15 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.751 -0.341 18533
10859 1 15 . 1 1 71 71 ASP CA C 70 55.870 55.870 53.936 1.934 18533
10860 1 15 . 1 1 71 71 ASP CB C 70 40.970 40.970 42.436 -1.466 18533
10861 1 15 . 1 1 71 71 ASP H H 70 7.940 7.940 7.895 0.045 18533
10862 1 15 . 1 1 72 72 HIS N N 71 121.720 121.720 124.301 -2.581 18533
10863 1 15 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.761 -0.061 18533
10864 1 15 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.065 1.325 18533
10865 1 15 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.581 2.759 18533
10866 1 15 . 1 1 72 72 HIS H H 71 8.000 8.000 8.174 -0.174 18533
10867 1 15 . 1 1 73 73 ARG N N 72 125.760 125.760 126.793 -1.033 18533
10868 1 15 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.058 -0.768 18533
10869 1 15 . 1 1 73 73 ARG CA C 72 54.430 54.430 53.984 0.446 18533
10870 1 15 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.107 0.203 18533
10871 1 15 . 1 1 73 73 ARG H H 72 7.230 7.230 8.129 -0.899 18533
10872 1 15 . 1 1 74 74 ALA N N 73 127.970 127.970 129.167 -1.197 18533
10873 1 15 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.191 0.439 18533
10874 1 15 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.850 -0.670 18533
10875 1 15 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.030 -1.130 18533
10876 1 15 . 1 1 74 74 ALA H H 73 9.090 9.090 8.143 0.947 18533
10877 1 15 . 1 1 75 75 ALA N N 74 126.090 126.090 125.614 0.476 18533
10878 1 15 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.726 0.064 18533
10879 1 15 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.568 0.403 18533
10880 1 15 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.948 1.672 18533
10881 1 15 . 1 1 75 75 ALA H H 74 9.410 9.410 8.339 1.071 18533
10882 1 15 . 1 1 76 76 GLN N N 75 123.260 123.260 121.507 1.753 18533
10883 1 15 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.612 0.338 18533
10884 1 15 . 1 1 76 76 GLN CA C 75 53.550 53.550 54.265 -0.715 18533
10885 1 15 . 1 1 76 76 GLN CB C 75 30.050 30.050 30.336 -0.286 18533
10886 1 15 . 1 1 76 76 GLN H H 75 8.800 8.800 8.460 0.340 18533
10887 1 15 . 1 1 77 77 VAL N N 76 125.510 125.510 123.497 2.013 18533
10888 1 15 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.383 -0.083 18533
10889 1 15 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.325 0.255 18533
10890 1 15 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.745 2.745 18533
10891 1 15 . 1 1 77 77 VAL H H 76 8.550 8.550 7.980 0.570 18533
10892 1 15 . 1 1 78 78 GLY N N 77 121.850 121.850 116.784 5.066 18533
10893 1 15 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.090 -0.250 18533
10894 1 15 . 1 1 78 78 GLY H H 77 10.930 10.930 8.357 2.573 18533
10895 1 15 . 1 1 79 79 THR N N 78 115.210 115.210 115.751 -0.541 18533
10896 1 15 . 1 1 79 79 THR HA H 78 3.700 3.700 3.895 -0.195 18533
10897 1 15 . 1 1 79 79 THR CA C 78 66.440 66.440 67.407 -0.967 18533
10898 1 15 . 1 1 79 79 THR CB C 78 68.770 68.770 68.841 -0.071 18533
10899 1 15 . 1 1 79 79 THR H H 78 8.540 8.540 8.424 0.116 18533
10900 1 15 . 1 1 80 80 GLU N N 79 119.360 119.360 118.878 0.482 18533
10901 1 15 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.934 0.026 18533
10902 1 15 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.602 0.428 18533
10903 1 15 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.878 0.182 18533
10904 1 15 . 1 1 80 80 GLU H H 79 9.110 9.110 8.814 0.296 18533
10905 1 15 . 1 1 81 81 HIS N N 80 118.380 118.380 116.885 1.495 18533
10906 1 15 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.262 -0.322 18533
10907 1 15 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.940 1.480 18533
10908 1 15 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.325 0.605 18533
10909 1 15 . 1 1 81 81 HIS H H 80 7.040 7.040 7.542 -0.502 18533
10910 1 15 . 1 1 82 82 LEU N N 81 114.010 114.010 119.739 -5.729 18533
10911 1 15 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.084 -0.184 18533
10912 1 15 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.905 -0.225 18533
10913 1 15 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.277 -0.547 18533
10914 1 15 . 1 1 82 82 LEU H H 81 7.850 7.850 8.279 -0.429 18533
10915 1 15 . 1 1 83 83 ALA N N 82 119.050 119.050 118.184 0.866 18533
10916 1 15 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.226 0.164 18533
10917 1 15 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.269 -0.069 18533
10918 1 15 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.870 0.310 18533
10919 1 15 . 1 1 83 83 ALA H H 82 6.950 6.950 7.314 -0.364 18533
10920 1 15 . 1 1 84 84 ALA N N 83 122.500 122.500 122.047 0.453 18533
10921 1 15 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.004 -0.244 18533
10922 1 15 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.814 1.536 18533
10923 1 15 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.646 -2.326 18533
10924 1 15 . 1 1 84 84 ALA H H 83 7.280 7.280 7.186 0.094 18533
10925 1 15 . 1 1 85 85 ASP N N 84 118.740 118.740 120.543 -1.803 18533
10926 1 15 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.692 -0.282 18533
10927 1 15 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.367 1.273 18533
10928 1 15 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.011 0.889 18533
10929 1 15 . 1 1 85 85 ASP H H 84 8.440 8.440 8.375 0.065 18533
10930 1 15 . 1 1 86 86 LEU N N 85 115.180 115.180 118.446 -3.266 18533
10931 1 15 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.855 -0.675 18533
10932 1 15 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.880 1.160 18533
10933 1 15 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.812 0.358 18533
10934 1 15 . 1 1 86 86 LEU H H 85 7.280 7.280 8.167 -0.887 18533
10935 1 15 . 1 1 87 87 LEU N N 86 128.140 128.140 127.622 0.518 18533
10936 1 15 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.927 -0.237 18533
10937 1 15 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.291 2.088 18533
10938 1 15 . 1 1 87 87 LEU CB C 86 42.170 42.170 41.929 0.241 18533
10939 1 15 . 1 1 87 87 LEU H H 86 8.780 8.780 8.989 -0.209 18533
10940 1 15 . 1 1 88 88 VAL N N 87 122.630 122.630 126.819 -4.189 18533
10941 1 15 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.549 0.081 18533
10942 1 15 . 1 1 88 88 VAL CA C 87 59.910 59.910 62.604 -2.694 18533
10943 1 15 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.429 0.411 18533
10944 1 15 . 1 1 88 88 VAL H H 87 9.010 9.010 7.968 1.042 18533
10945 1 15 . 1 1 89 89 ALA N N 88 129.820 129.820 131.765 -1.945 18533
10946 1 15 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.861 -0.341 18533
10947 1 15 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.526 -0.746 18533
10948 1 15 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.195 -0.415 18533
10949 1 15 . 1 1 89 89 ALA H H 88 8.590 8.590 9.149 -0.559 18533
10950 1 15 . 1 1 90 90 LEU N N 89 129.280 129.280 119.750 9.530 18533
10951 1 15 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.674 -0.364 18533
10952 1 15 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.089 0.361 18533
10953 1 15 . 1 1 90 90 LEU CB C 89 38.020 38.020 42.041 -4.021 18533
10954 1 15 . 1 1 90 90 LEU H H 89 8.570 8.570 8.679 -0.109 18533
10955 1 15 . 1 1 91 91 ASP N N 90 126.910 126.910 117.255 9.655 18533
10956 1 15 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.679 0.121 18533
10957 1 15 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.052 -0.102 18533
10958 1 15 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.053 0.757 18533
10959 1 15 . 1 1 91 91 ASP H H 90 11.450 11.450 7.442 4.008 18533
10960 1 15 . 1 1 92 92 ARG N N 91 116.950 116.950 120.631 -3.681 18533
10961 1 15 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.872 0.148 18533
10962 1 15 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.341 -0.511 18533
10963 1 15 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.704 0.576 18533
10964 1 15 . 1 1 92 92 ARG H H 91 8.650 8.650 8.610 0.040 18533
10965 1 15 . 1 1 93 93 ASN N N 92 120.740 120.740 118.106 2.634 18533
10966 1 15 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.567 -0.187 18533
10967 1 15 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.688 0.443 18533
10968 1 15 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.584 0.036 18533
10969 1 15 . 1 1 93 93 ASN H H 92 8.610 8.610 8.659 -0.049 18533
10970 1 15 . 1 1 94 94 HIS N N 93 121.170 121.170 120.244 0.926 18533
10971 1 15 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.186 0.004 18533
10972 1 15 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.197 0.313 18533
10973 1 15 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.690 1.690 18533
10974 1 15 . 1 1 94 94 HIS H H 93 7.430 7.430 8.740 -1.310 18533
10975 1 15 . 1 1 95 95 ALA N N 94 118.270 118.270 121.222 -2.952 18533
10976 1 15 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.957 -0.217 18533
10977 1 15 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.409 0.091 18533
10978 1 15 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.362 -0.392 18533
10979 1 15 . 1 1 95 95 ALA H H 94 7.190 7.190 8.023 -0.833 18533
10980 1 15 . 1 1 96 96 ARG N N 95 117.190 117.190 119.212 -2.022 18533
10981 1 15 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.037 -0.127 18533
10982 1 15 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.300 0.200 18533
10983 1 15 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.001 0.229 18533
10984 1 15 . 1 1 96 96 ARG H H 95 7.600 7.600 7.630 -0.030 18533
10985 1 15 . 1 1 97 97 LEU N N 96 120.700 120.700 119.713 0.987 18533
10986 1 15 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.969 0.111 18533
10987 1 15 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.732 0.168 18533
10988 1 15 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.669 -0.329 18533
10989 1 15 . 1 1 97 97 LEU H H 96 7.990 7.990 8.064 -0.074 18533
10990 1 15 . 1 1 98 98 LEU N N 97 118.390 118.390 118.404 -0.014 18533
10991 1 15 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.847 0.063 18533
10992 1 15 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.069 0.031 18533
10993 1 15 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.182 0.708 18533
10994 1 15 . 1 1 98 98 LEU H H 97 8.210 8.210 8.236 -0.026 18533
10995 1 15 . 1 1 99 99 ARG N N 98 117.470 117.470 118.414 -0.944 18533
10996 1 15 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.050 0.430 18533
10997 1 15 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.064 -0.704 18533
10998 1 15 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.625 -0.885 18533
10999 1 15 . 1 1 99 99 ARG H H 98 7.740 7.740 7.845 -0.105 18533
11000 1 15 . 1 1 100 100 GLN N N 99 121.400 121.400 118.382 3.018 18533
11001 1 15 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.172 -0.102 18533
11002 1 15 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.207 0.473 18533
11003 1 15 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.388 -0.068 18533
11004 1 15 . 1 1 100 100 GLN H H 99 8.030 8.030 8.146 -0.116 18533
11005 1 15 . 1 1 101 101 LEU N N 100 118.940 118.940 117.182 1.758 18533
11006 1 15 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.225 0.035 18533
11007 1 15 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.279 0.181 18533
11008 1 15 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.331 -0.091 18533
11009 1 15 . 1 1 101 101 LEU H H 100 7.780 7.780 7.950 -0.170 18533
11010 1 15 . 1 1 102 102 GLY N N 101 105.740 105.740 104.632 1.108 18533
11011 1 15 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.335 0.695 18533
11012 1 15 . 1 1 102 102 GLY H H 101 7.700 7.700 7.547 0.153 18533
11013 1 15 . 1 1 103 103 VAL N N 102 122.330 122.330 121.686 0.644 18533
11014 1 15 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.095 -0.465 18533
11015 1 15 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.008 1.592 18533
11016 1 15 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.741 -2.251 18533
11017 1 15 . 1 1 103 103 VAL H H 102 7.520 7.520 7.978 -0.458 18533
11018 1 15 . 1 1 104 104 GLU N N 103 128.990 128.990 114.516 14.474 18533
11019 1 15 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.437 -0.267 18533
11020 1 15 . 1 1 104 104 GLU CA C 103 56.920 56.920 54.826 2.094 18533
11021 1 15 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.702 -3.752 18533
11022 1 15 . 1 1 104 104 GLU H H 103 9.210 9.210 8.017 1.193 18533
11023 1 15 . 1 1 105 105 ALA N N 104 124.410 124.410 122.924 1.486 18533
11024 1 15 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.157 -0.397 18533
11025 1 15 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.062 0.578 18533
11026 1 15 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.676 -0.536 18533
11027 1 15 . 1 1 105 105 ALA H H 104 8.500 8.500 8.700 -0.200 18533
11028 1 15 . 1 1 106 106 ALA N N 105 115.110 115.110 120.485 -5.375 18533
11029 1 15 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.161 -0.031 18533
11030 1 15 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.771 -0.731 18533
11031 1 15 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.524 0.536 18533
11032 1 15 . 1 1 106 106 ALA H H 105 8.270 8.270 8.383 -0.113 18533
11033 1 15 . 1 1 107 107 ARG N N 106 115.080 115.080 114.770 0.310 18533
11034 1 15 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.790 -0.330 18533
11035 1 15 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.801 -0.291 18533
11036 1 15 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.775 0.595 18533
11037 1 15 . 1 1 107 107 ARG H H 106 7.740 7.740 7.701 0.039 18533
11038 1 15 . 1 1 108 108 VAL N N 107 118.170 118.170 121.223 -3.053 18533
11039 1 15 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.047 1.023 18533
11040 1 15 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.144 -1.504 18533
11041 1 15 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.405 1.195 18533
11042 1 15 . 1 1 108 108 VAL H H 107 7.290 7.290 8.294 -1.004 18533
11043 1 15 . 1 1 109 109 ARG N N 108 124.250 124.250 127.501 -3.251 18533
11044 1 15 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.598 0.022 18533
11045 1 15 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.191 -1.301 18533
11046 1 15 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.240 0.740 18533
11047 1 15 . 1 1 109 109 ARG H H 108 8.420 8.420 8.814 -0.394 18533
11048 1 15 . 1 1 110 110 MET N N 109 119.570 119.570 121.450 -1.880 18533
11049 1 15 . 1 1 110 110 MET HA H 109 4.960 4.960 5.020 -0.060 18533
11050 1 15 . 1 1 110 110 MET CA C 109 53.820 53.820 54.322 -0.502 18533
11051 1 15 . 1 1 110 110 MET CB C 109 30.680 30.680 32.433 -1.753 18533
11052 1 15 . 1 1 110 110 MET H H 109 8.890 8.890 8.525 0.365 18533
11053 1 15 . 1 1 111 111 LEU N N 110 128.660 128.660 126.765 1.895 18533
11054 1 15 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.338 -0.378 18533
11055 1 15 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.836 0.764 18533
11056 1 15 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.978 -0.898 18533
11057 1 15 . 1 1 111 111 LEU H H 110 9.200 9.200 9.014 0.186 18533
11058 1 15 . 1 1 112 112 ARG N N 111 111.910 111.910 116.556 -4.646 18533
11059 1 15 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.066 -0.116 18533
11060 1 15 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.852 1.068 18533
11061 1 15 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.605 -1.105 18533
11062 1 15 . 1 1 112 112 ARG H H 111 8.930 8.930 8.668 0.262 18533
11063 1 15 . 1 1 113 113 SER N N 112 114.800 114.800 114.910 -0.110 18533
11064 1 15 . 1 1 113 113 SER HA H 112 4.290 4.290 4.284 0.006 18533
11065 1 15 . 1 1 113 113 SER CA C 112 60.880 60.880 59.834 1.046 18533
11066 1 15 . 1 1 113 113 SER CB C 112 63.190 63.190 62.490 0.700 18533
11067 1 15 . 1 1 113 113 SER H H 112 7.680 7.680 7.656 0.024 18533
11068 1 15 . 1 1 114 114 PHE N N 113 119.260 119.260 118.498 0.762 18533
11069 1 15 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.512 -0.162 18533
11070 1 15 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.103 0.827 18533
11071 1 15 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.948 -0.228 18533
11072 1 15 . 1 1 114 114 PHE H H 113 7.600 7.600 7.588 0.012 18533
11073 1 15 . 1 1 115 115 ASP N N 114 121.170 121.170 121.695 -0.525 18533
11074 1 15 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.950 0.070 18533
11075 1 15 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.496 -1.396 18533
11076 1 15 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.734 0.776 18533
11077 1 15 . 1 1 115 115 ASP H H 114 7.430 7.430 7.564 -0.134 18533
11078 1 15 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.360 0.130 18533
11079 1 15 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.228 0.122 18533
11080 1 15 . 1 1 116 116 PRO CB C 115 32.270 32.270 31.993 0.277 18533
11081 1 15 . 1 1 117 117 ARG N N 116 117.910 117.910 117.090 0.820 18533
11082 1 15 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.421 -0.151 18533
11083 1 15 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.836 0.614 18533
11084 1 15 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.451 -0.491 18533
11085 1 15 . 1 1 117 117 ARG H H 116 8.580 8.580 7.839 0.741 18533
11086 1 15 . 1 1 118 118 SER N N 117 116.130 116.130 117.037 -0.907 18533
11087 1 15 . 1 1 118 118 SER HA H 117 3.980 3.980 4.352 -0.372 18533
11088 1 15 . 1 1 118 118 SER CA C 117 59.790 59.790 58.676 1.113 18533
11089 1 15 . 1 1 118 118 SER CB C 117 63.760 63.760 62.181 1.579 18533
11090 1 15 . 1 1 118 118 SER H H 117 7.950 7.950 7.685 0.265 18533
11091 1 15 . 1 1 119 119 GLY N N 118 110.080 110.080 113.958 -3.878 18533
11092 1 15 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.213 -0.843 18533
11093 1 15 . 1 1 119 119 GLY H H 118 8.150 8.150 8.079 0.071 18533
11094 1 15 . 1 1 120 120 THR HA H 119 4.020 4.020 4.389 -0.369 18533
11095 1 15 . 1 1 120 120 THR CA C 119 63.290 63.290 60.752 2.538 18533
11096 1 15 . 1 1 120 120 THR CB C 119 69.140 69.140 70.681 -1.541 18533
11097 1 15 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.408 0.162 18533
11098 1 15 . 1 1 121 121 HIS CA C 120 56.010 56.010 56.187 -0.177 18533
11099 1 15 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.414 0.576 18533
11100 1 15 . 1 1 122 122 ALA N N 121 125.880 125.880 128.715 -2.835 18533
11101 1 15 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.365 -0.025 18533
11102 1 15 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.410 0.100 18533
11103 1 15 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.769 -0.169 18533
11104 1 15 . 1 1 122 122 ALA H H 121 7.980 7.980 8.547 -0.567 18533
11105 1 15 . 1 1 123 123 LEU N N 122 119.810 119.810 121.173 -1.363 18533
11106 1 15 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.403 -0.123 18533
11107 1 15 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.131 0.359 18533
11108 1 15 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.604 2.096 18533
11109 1 15 . 1 1 123 123 LEU H H 122 7.810 7.810 7.788 0.022 18533
11110 1 15 . 1 1 124 124 ASP N N 123 119.050 119.050 116.244 2.806 18533
11111 1 15 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.591 -0.021 18533
11112 1 15 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.732 1.588 18533
11113 1 15 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.350 -0.680 18533
11114 1 15 . 1 1 124 124 ASP H H 123 8.270 8.270 7.351 0.919 18533
11115 1 15 . 1 1 125 125 VAL N N 124 121.970 121.970 121.869 0.101 18533
11116 1 15 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.350 -0.090 18533
11117 1 15 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.248 2.062 18533
11118 1 15 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.751 -2.971 18533
11119 1 15 . 1 1 125 125 VAL H H 124 7.930 7.930 7.916 0.014 18533
11120 1 15 . 1 1 126 126 GLU N N 125 129.490 129.490 124.059 5.431 18533
11121 1 15 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.086 -0.006 18533
11122 1 15 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.246 0.764 18533
11123 1 15 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.532 -0.732 18533
11124 1 15 . 1 1 126 126 GLU H H 125 9.100 9.100 8.343 0.757 18533
11125 1 15 . 1 1 127 127 ASP N N 126 122.300 122.300 117.702 4.598 18533
11126 1 15 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.792 -0.682 18533
11127 1 15 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.603 0.117 18533
11128 1 15 . 1 1 127 127 ASP CB C 126 42.520 42.520 43.172 -0.652 18533
11129 1 15 . 1 1 127 127 ASP H H 126 8.630 8.630 8.389 0.241 18533
11130 1 15 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.379 0.171 18533
11131 1 15 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.991 -0.391 18533
11132 1 15 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.379 -1.399 18533
11133 1 15 . 1 1 129 129 TYR N N 128 122.380 122.380 120.089 2.291 18533
11134 1 15 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.445 -0.645 18533
11135 1 15 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.020 4.101 18533
11136 1 15 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.533 -0.143 18533
11137 1 15 . 1 1 129 129 TYR H H 128 8.670 8.670 8.634 0.036 18533
11138 1 15 . 1 1 130 130 TYR N N 129 116.300 116.300 116.454 -0.154 18533
11139 1 15 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.718 -0.228 18533
11140 1 15 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.317 1.163 18533
11141 1 15 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.625 -1.965 18533
11142 1 15 . 1 1 130 130 TYR H H 129 8.680 8.680 7.625 1.055 18533
11143 1 15 . 1 1 131 131 GLY N N 130 110.870 110.870 109.724 1.146 18533
11144 1 15 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.439 -1.359 18533
11145 1 15 . 1 1 131 131 GLY H H 130 8.060 8.060 8.606 -0.546 18533
11146 1 15 . 1 1 132 132 ASP N N 131 121.590 121.590 119.351 2.239 18533
11147 1 15 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.543 0.527 18533
11148 1 15 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.148 -0.148 18533
11149 1 15 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.343 1.258 18533
11150 1 15 . 1 1 132 132 ASP H H 131 9.290 9.290 7.637 1.653 18533
11151 1 15 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.957 0.153 18533
11152 1 15 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.550 2.021 18533
11153 1 15 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.201 0.279 18533
11154 1 15 . 1 1 134 134 SER N N 133 115.370 115.370 113.928 1.442 18533
11155 1 15 . 1 1 134 134 SER HA H 133 4.180 4.180 3.917 0.263 18533
11156 1 15 . 1 1 134 134 SER CA C 133 62.070 62.070 62.400 -0.330 18533
11157 1 15 . 1 1 134 134 SER CB C 133 62.160 62.160 62.897 -0.737 18533
11158 1 15 . 1 1 134 134 SER H H 133 8.420 8.420 8.726 -0.306 18533
11159 1 15 . 1 1 135 135 ASP N N 134 123.360 123.360 122.093 1.267 18533
11160 1 15 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.427 0.103 18533
11161 1 15 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.863 1.177 18533
11162 1 15 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.263 0.547 18533
11163 1 15 . 1 1 135 135 ASP H H 134 7.980 7.980 7.438 0.542 18533
11164 1 15 . 1 1 136 136 PHE N N 135 118.940 118.940 118.627 0.313 18533
11165 1 15 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.276 -0.476 18533
11166 1 15 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.456 3.364 18533
11167 1 15 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.103 1.247 18533
11168 1 15 . 1 1 136 136 PHE H H 135 7.850 7.850 7.205 0.645 18533
11169 1 15 . 1 1 137 137 GLU N N 136 121.410 121.410 118.575 2.835 18533
11170 1 15 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.143 0.037 18533
11171 1 15 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.059 0.440 18533
11172 1 15 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.234 -0.244 18533
11173 1 15 . 1 1 137 137 GLU H H 136 8.150 8.150 7.938 0.212 18533
11174 1 15 . 1 1 138 138 GLU N N 137 121.530 121.530 121.614 -0.084 18533
11175 1 15 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.104 0.186 18533
11176 1 15 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.755 -0.355 18533
11177 1 15 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.483 -0.594 18533
11178 1 15 . 1 1 138 138 GLU H H 137 7.870 7.870 8.238 -0.368 18533
11179 1 15 . 1 1 139 139 VAL N N 138 119.930 119.930 119.719 0.211 18533
11180 1 15 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.608 -0.128 18533
11181 1 15 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.388 0.692 18533
11182 1 15 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.640 -0.289 18533
11183 1 15 . 1 1 139 139 VAL H H 138 7.770 7.770 7.725 0.045 18533
11184 1 15 . 1 1 140 140 PHE N N 139 119.130 119.130 120.772 -1.642 18533
11185 1 15 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.124 -0.564 18533
11186 1 15 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.298 1.382 18533
11187 1 15 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.984 0.186 18533
11188 1 15 . 1 1 140 140 PHE H H 139 8.050 8.050 7.850 0.200 18533
11189 1 15 . 1 1 141 141 ALA N N 140 121.040 121.040 122.268 -1.228 18533
11190 1 15 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.341 -0.351 18533
11191 1 15 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.750 0.370 18533
11192 1 15 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.331 -0.031 18533
11193 1 15 . 1 1 141 141 ALA H H 140 8.010 8.010 8.138 -0.128 18533
11194 1 15 . 1 1 142 142 VAL N N 141 118.550 118.550 119.210 -0.660 18533
11195 1 15 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.560 0.250 18533
11196 1 15 . 1 1 142 142 VAL CA C 141 65.600 65.600 67.219 -1.619 18533
11197 1 15 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.481 -0.031 18533
11198 1 15 . 1 1 142 142 VAL H H 141 8.300 8.300 8.052 0.248 18533
11199 1 15 . 1 1 143 143 ILE N N 142 121.410 121.410 119.118 2.292 18533
11200 1 15 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.470 -0.080 18533
11201 1 15 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.414 0.636 18533
11202 1 15 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.732 -0.422 18533
11203 1 15 . 1 1 143 143 ILE H H 142 8.150 8.150 8.106 0.044 18533
11204 1 15 . 1 1 144 144 GLU N N 143 119.630 119.630 119.296 0.334 18533
11205 1 15 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.777 -0.237 18533
11206 1 15 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.142 0.618 18533
11207 1 15 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.880 0.850 18533
11208 1 15 . 1 1 144 144 GLU H H 143 8.640 8.640 8.113 0.527 18533
11209 1 15 . 1 1 145 145 SER N N 144 110.920 110.920 113.943 -3.023 18533
11210 1 15 . 1 1 145 145 SER HA H 144 4.230 4.230 4.236 -0.006 18533
11211 1 15 . 1 1 145 145 SER CA C 144 60.810 60.810 60.525 0.285 18533
11212 1 15 . 1 1 145 145 SER CB C 144 63.610 63.610 63.518 0.092 18533
11213 1 15 . 1 1 145 145 SER H H 144 7.640 7.640 7.826 -0.186 18533
11214 1 15 . 1 1 146 146 ALA N N 145 123.110 123.110 124.472 -1.362 18533
11215 1 15 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.295 -0.175 18533
11216 1 15 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.075 -0.675 18533
11217 1 15 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.413 2.466 18533
11218 1 15 . 1 1 146 146 ALA H H 145 7.500 7.500 7.675 -0.175 18533
11219 1 15 . 1 1 147 147 LEU N N 146 114.220 114.220 119.820 -5.600 18533
11220 1 15 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.913 0.027 18533
11221 1 15 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.501 -0.451 18533
11222 1 15 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.467 -0.007 18533
11223 1 15 . 1 1 147 147 LEU H H 146 7.410 7.410 8.286 -0.876 18533
11224 1 15 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.330 0.120 18533
11225 1 15 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.403 3.437 18533
11226 1 15 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.132 0.088 18533
11227 1 15 . 1 1 149 149 GLY N N 148 102.590 102.590 106.318 -3.728 18533
11228 1 15 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.187 2.073 18533
11229 1 15 . 1 1 149 149 GLY H H 148 7.960 7.960 8.001 -0.041 18533
11230 1 15 . 1 1 150 150 LEU N N 149 128.060 128.060 123.671 4.389 18533
11231 1 15 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.136 0.494 18533
11232 1 15 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.331 0.019 18533
11233 1 15 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.358 -0.158 18533
11234 1 15 . 1 1 150 150 LEU H H 149 7.620 7.620 8.492 -0.872 18533
11235 1 15 . 1 1 151 151 HIS N N 150 120.730 120.730 118.450 2.280 18533
11236 1 15 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.021 0.149 18533
11237 1 15 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.190 1.190 18533
11238 1 15 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.520 0.990 18533
11239 1 15 . 1 1 151 151 HIS H H 150 8.430 8.430 8.333 0.097 18533
11240 1 15 . 1 1 152 152 ASP N N 151 118.170 118.170 119.693 -1.523 18533
11241 1 15 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.382 0.038 18533
11242 1 15 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.919 -0.109 18533
11243 1 15 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.533 -0.503 18533
11244 1 15 . 1 1 152 152 ASP H H 151 7.820 7.820 8.418 -0.598 18533
11245 1 15 . 1 1 153 153 TRP N N 152 122.780 122.780 121.691 1.089 18533
11246 1 15 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.377 -0.267 18533
11247 1 15 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.290 1.320 18533
11248 1 15 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.148 -0.358 18533
11249 1 15 . 1 1 153 153 TRP H H 152 7.900 7.900 7.951 -0.051 18533
11250 1 15 . 1 1 154 154 VAL N N 153 119.460 119.460 117.518 1.942 18533
11251 1 15 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.884 -0.534 18533
11252 1 15 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.129 0.851 18533
11253 1 15 . 1 1 154 154 VAL CB C 153 31.900 31.900 30.882 1.018 18533
11254 1 15 . 1 1 154 154 VAL H H 153 8.560 8.560 8.590 -0.030 18533
11255 1 15 . 1 1 155 155 ASP N N 154 120.500 120.500 121.499 -0.999 18533
11256 1 15 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.338 -0.138 18533
11257 1 15 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.414 -0.844 18533
11258 1 15 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.781 -0.920 18533
11259 1 15 . 1 1 155 155 ASP H H 154 8.530 8.530 8.826 -0.296 18533
11260 1 15 . 1 1 156 156 GLU N N 155 120.090 120.090 119.674 0.416 18533
11261 1 15 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.930 -0.000 18533
11262 1 15 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.243 -0.083 18533
11263 1 15 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.319 -0.029 18533
11264 1 15 . 1 1 156 156 GLU H H 155 7.870 7.870 8.316 -0.446 18533
11265 1 15 . 1 1 157 157 ARG N N 156 119.230 119.230 119.445 -0.215 18533
11266 1 15 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.978 -0.168 18533
11267 1 15 . 1 1 157 157 ARG CA C 156 56.990 56.990 56.904 0.086 18533
11268 1 15 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.189 -0.079 18533
11269 1 15 . 1 1 157 157 ARG H H 156 7.660 7.660 7.958 -0.298 18533
11270 1 15 . 1 1 158 158 LEU N N 157 118.790 118.790 118.218 0.572 18533
11271 1 15 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.099 0.001 18533
11272 1 15 . 1 1 158 158 LEU CA C 157 56.680 56.680 58.191 -1.511 18533
11273 1 15 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.642 1.048 18533
11274 1 15 . 1 1 158 158 LEU H H 157 8.470 8.470 8.476 -0.006 18533
11275 1 15 . 1 1 159 159 ALA N N 158 120.760 120.760 122.057 -1.297 18533
11276 1 15 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.137 0.053 18533
11277 1 15 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.555 -1.275 18533
11278 1 15 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.673 -0.283 18533
11279 1 15 . 1 1 159 159 ALA H H 158 7.490 7.490 7.689 -0.199 18533
11280 1 15 . 1 1 160 160 ARG N N 159 117.810 117.810 117.137 0.673 18533
11281 1 15 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.131 0.079 18533
11282 1 15 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.852 -1.072 18533
11283 1 15 . 1 1 160 160 ARG CB C 159 30.530 30.530 30.164 0.366 18533
11284 1 15 . 1 1 160 160 ARG H H 159 7.650 7.650 7.937 -0.287 18533
11285 1 15 . 1 1 161 161 ASN N N 160 118.560 118.560 118.179 0.381 18533
11286 1 15 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.488 0.252 18533
11287 1 15 . 1 1 161 161 ASN CA C 160 53.250 53.250 55.126 -1.876 18533
11288 1 15 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.934 0.236 18533
11289 1 15 . 1 1 161 161 ASN H H 160 8.100 8.100 8.179 -0.079 18533
11290 1 15 . 1 1 162 162 GLY N N 161 108.900 108.900 107.171 1.729 18533
11291 1 15 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.600 0.130 18533
11292 1 15 . 1 1 162 162 GLY H H 161 7.980 7.980 7.707 0.273 18533
11293 1 15 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.508 -0.048 18533
11294 1 15 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.599 0.851 18533
11295 1 15 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.801 0.399 18533
11296 1 16 . 1 1 2 2 MET N N 1 119.850 119.850 121.222 -1.372 18533
11297 1 16 . 1 1 2 2 MET HA H 1 4.500 4.500 4.748 -0.248 18533
11298 1 16 . 1 1 2 2 MET CA C 1 55.450 55.450 55.210 0.240 18533
11299 1 16 . 1 1 2 2 MET CB C 1 33.170 33.170 33.490 -0.320 18533
11300 1 16 . 1 1 2 2 MET H H 1 8.140 8.140 8.163 -0.023 18533
11301 1 16 . 1 1 3 3 SER N N 2 117.000 117.000 114.500 2.500 18533
11302 1 16 . 1 1 3 3 SER HA H 2 4.430 4.430 4.718 -0.288 18533
11303 1 16 . 1 1 3 3 SER CA C 2 58.320 58.320 57.005 1.315 18533
11304 1 16 . 1 1 3 3 SER CB C 2 63.990 63.990 65.240 -1.250 18533
11305 1 16 . 1 1 3 3 SER H H 2 8.340 8.340 8.230 0.110 18533
11306 1 16 . 1 1 4 4 ASP N N 3 123.200 123.200 121.741 1.459 18533
11307 1 16 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.820 0.040 18533
11308 1 16 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.968 -0.088 18533
11309 1 16 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.695 0.105 18533
11310 1 16 . 1 1 4 4 ASP H H 3 8.260 8.260 8.360 -0.100 18533
11311 1 16 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.493 -0.093 18533
11312 1 16 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.723 0.097 18533
11313 1 16 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.633 -0.723 18533
11314 1 16 . 1 1 6 6 LEU N N 5 123.160 123.160 119.685 3.475 18533
11315 1 16 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.378 0.012 18533
11316 1 16 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.262 0.018 18533
11317 1 16 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.543 0.807 18533
11318 1 16 . 1 1 6 6 LEU H H 5 7.670 7.670 7.845 -0.175 18533
11319 1 16 . 1 1 7 7 HIS N N 6 127.160 127.160 117.725 9.435 18533
11320 1 16 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.958 1.072 18533
11321 1 16 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.294 -2.394 18533
11322 1 16 . 1 1 7 7 HIS CB C 6 32.130 32.130 30.949 1.181 18533
11323 1 16 . 1 1 7 7 HIS H H 6 10.080 10.080 8.637 1.443 18533
11324 1 16 . 1 1 8 8 VAL N N 7 128.620 128.620 126.879 1.741 18533
11325 1 16 . 1 1 8 8 VAL HA H 7 4.500 4.500 5.009 -0.509 18533
11326 1 16 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.152 -0.352 18533
11327 1 16 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.730 3.071 18533
11328 1 16 . 1 1 8 8 VAL H H 7 8.930 8.930 9.200 -0.270 18533
11329 1 16 . 1 1 9 9 THR N N 8 121.530 121.530 122.817 -1.287 18533
11330 1 16 . 1 1 9 9 THR HA H 8 5.270 5.270 4.780 0.490 18533
11331 1 16 . 1 1 9 9 THR CA C 8 58.520 58.520 58.955 -0.435 18533
11332 1 16 . 1 1 9 9 THR CB C 8 70.750 70.750 69.740 1.010 18533
11333 1 16 . 1 1 9 9 THR H H 8 7.970 7.970 9.006 -1.036 18533
11334 1 16 . 1 1 10 10 PHE N N 9 125.360 125.360 128.060 -2.700 18533
11335 1 16 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.059 0.151 18533
11336 1 16 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.118 0.192 18533
11337 1 16 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.465 3.365 18533
11338 1 16 . 1 1 10 10 PHE H H 9 8.180 8.180 8.110 0.070 18533
11339 1 16 . 1 1 11 11 VAL N N 10 121.120 121.120 122.639 -1.519 18533
11340 1 16 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.240 0.120 18533
11341 1 16 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.342 -0.922 18533
11342 1 16 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.692 1.858 18533
11343 1 16 . 1 1 11 11 VAL H H 10 8.710 8.710 9.184 -0.474 18533
11344 1 16 . 1 1 12 12 CYS N N 11 123.270 123.270 125.520 -2.250 18533
11345 1 16 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.330 -1.070 18533
11346 1 16 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.561 1.069 18533
11347 1 16 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.801 -1.451 18533
11348 1 16 . 1 1 12 12 CYS H H 11 7.940 7.940 8.941 -1.001 18533
11349 1 16 . 1 1 13 13 THR HA H 12 5.010 5.010 4.156 0.854 18533
11350 1 16 . 1 1 13 13 THR CA C 12 64.870 64.870 63.015 1.855 18533
11351 1 16 . 1 1 13 13 THR CB C 12 69.180 69.180 67.767 1.413 18533
11352 1 16 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.079 -0.119 18533
11353 1 16 . 1 1 15 15 ASN N N 14 119.960 119.960 116.907 3.053 18533
11354 1 16 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.353 -0.423 18533
11355 1 16 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.112 0.758 18533
11356 1 16 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.129 2.541 18533
11357 1 16 . 1 1 15 15 ASN H H 14 9.280 9.280 8.646 0.634 18533
11358 1 16 . 1 1 16 16 ILE N N 15 101.060 101.060 110.415 -9.355 18533
11359 1 16 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.603 0.077 18533
11360 1 16 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.585 2.205 18533
11361 1 16 . 1 1 16 16 ILE CB C 15 42.140 42.140 37.902 4.238 18533
11362 1 16 . 1 1 16 16 ILE H H 15 7.100 7.100 7.858 -0.758 18533
11363 1 16 . 1 1 17 17 CYS N N 16 116.020 116.020 117.252 -1.232 18533
11364 1 16 . 1 1 17 17 CYS HA H 16 4.940 4.940 5.165 -0.225 18533
11365 1 16 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.271 1.789 18533
11366 1 16 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.469 0.481 18533
11367 1 16 . 1 1 17 17 CYS H H 16 7.700 7.700 7.685 0.015 18533
11368 1 16 . 1 1 19 19 SER N N 18 122.340 122.340 114.952 7.388 18533
11369 1 16 . 1 1 19 19 SER HA H 18 3.810 3.810 4.146 -0.336 18533
11370 1 16 . 1 1 19 19 SER CA C 18 62.710 62.710 63.226 -0.516 18533
11371 1 16 . 1 1 19 19 SER CB C 18 64.860 64.860 61.175 3.685 18533
11372 1 16 . 1 1 19 19 SER H H 18 11.420 11.420 8.560 2.860 18533
11373 1 16 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.099 -0.129 18533
11374 1 16 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.933 0.097 18533
11375 1 16 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.834 -2.144 18533
11376 1 16 . 1 1 21 21 MET N N 20 112.430 112.430 118.171 -5.741 18533
11377 1 16 . 1 1 21 21 MET HA H 20 3.730 3.730 3.882 -0.152 18533
11378 1 16 . 1 1 21 21 MET CA C 20 60.160 60.160 59.707 0.453 18533
11379 1 16 . 1 1 21 21 MET CB C 20 33.040 33.040 32.124 0.916 18533
11380 1 16 . 1 1 21 21 MET H H 20 6.310 6.310 7.432 -1.122 18533
11381 1 16 . 1 1 22 22 ALA N N 21 117.800 117.800 119.682 -1.882 18533
11382 1 16 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.802 -0.402 18533
11383 1 16 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.310 0.680 18533
11384 1 16 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.682 -1.192 18533
11385 1 16 . 1 1 22 22 ALA H H 21 6.550 6.550 7.462 -0.912 18533
11386 1 16 . 1 1 23 23 GLU N N 22 115.520 115.520 118.760 -3.240 18533
11387 1 16 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.098 -0.418 18533
11388 1 16 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.753 -0.203 18533
11389 1 16 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.812 -0.022 18533
11390 1 16 . 1 1 23 23 GLU H H 22 7.800 7.800 7.723 0.077 18533
11391 1 16 . 1 1 24 24 LYS N N 23 114.220 114.220 116.496 -2.276 18533
11392 1 16 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.119 -0.119 18533
11393 1 16 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.151 -0.391 18533
11394 1 16 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.342 -1.542 18533
11395 1 16 . 1 1 24 24 LYS H H 23 8.040 8.040 7.396 0.644 18533
11396 1 16 . 1 1 25 25 MET N N 24 115.250 115.250 119.128 -3.878 18533
11397 1 16 . 1 1 25 25 MET HA H 24 3.950 3.950 3.709 0.241 18533
11398 1 16 . 1 1 25 25 MET CA C 24 57.980 57.980 58.869 -0.889 18533
11399 1 16 . 1 1 25 25 MET CB C 24 35.500 35.500 32.184 3.316 18533
11400 1 16 . 1 1 25 25 MET H H 24 7.610 7.610 7.430 0.180 18533
11401 1 16 . 1 1 26 26 PHE N N 25 119.090 119.090 115.860 3.230 18533
11402 1 16 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.424 -0.084 18533
11403 1 16 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.025 0.005 18533
11404 1 16 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.456 2.005 18533
11405 1 16 . 1 1 26 26 PHE H H 25 8.560 8.560 7.760 0.800 18533
11406 1 16 . 1 1 27 27 ALA N N 26 117.830 117.830 122.792 -4.962 18533
11407 1 16 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.767 0.163 18533
11408 1 16 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.214 0.846 18533
11409 1 16 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.878 0.532 18533
11410 1 16 . 1 1 27 27 ALA H H 26 8.800 8.800 7.250 1.550 18533
11411 1 16 . 1 1 28 28 GLN N N 27 117.550 117.550 118.258 -0.708 18533
11412 1 16 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.043 0.007 18533
11413 1 16 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.874 0.736 18533
11414 1 16 . 1 1 28 28 GLN CB C 27 28.450 28.450 28.018 0.432 18533
11415 1 16 . 1 1 28 28 GLN H H 27 7.690 7.690 7.822 -0.132 18533
11416 1 16 . 1 1 29 29 GLN N N 28 117.530 117.530 119.804 -2.274 18533
11417 1 16 . 1 1 29 29 GLN HA H 28 4.140 4.140 3.988 0.152 18533
11418 1 16 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.748 0.432 18533
11419 1 16 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.841 -0.731 18533
11420 1 16 . 1 1 29 29 GLN H H 28 8.210 8.210 7.541 0.669 18533
11421 1 16 . 1 1 30 30 LEU N N 29 119.330 119.330 119.665 -0.335 18533
11422 1 16 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.993 -0.063 18533
11423 1 16 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.982 0.098 18533
11424 1 16 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.518 0.382 18533
11425 1 16 . 1 1 30 30 LEU H H 29 8.540 8.540 8.595 -0.055 18533
11426 1 16 . 1 1 31 31 ARG N N 30 120.880 120.880 117.991 2.889 18533
11427 1 16 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.061 -0.091 18533
11428 1 16 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.090 0.700 18533
11429 1 16 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.311 0.209 18533
11430 1 16 . 1 1 31 31 ARG H H 30 8.050 8.050 8.094 -0.044 18533
11431 1 16 . 1 1 32 32 HIS N N 31 119.770 119.770 118.791 0.979 18533
11432 1 16 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.416 0.134 18533
11433 1 16 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.693 -0.612 18533
11434 1 16 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.227 0.483 18533
11435 1 16 . 1 1 32 32 HIS H H 31 8.440 8.440 8.310 0.130 18533
11436 1 16 . 1 1 33 33 ARG N N 32 115.430 115.430 117.026 -1.596 18533
11437 1 16 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.436 0.154 18533
11438 1 16 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.007 -0.037 18533
11439 1 16 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.435 -0.215 18533
11440 1 16 . 1 1 33 33 ARG H H 32 7.500 7.500 7.705 -0.205 18533
11441 1 16 . 1 1 34 34 GLY N N 33 106.730 106.730 108.588 -1.858 18533
11442 1 16 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.248 0.952 18533
11443 1 16 . 1 1 34 34 GLY H H 33 7.750 7.750 8.260 -0.510 18533
11444 1 16 . 1 1 35 35 LEU N N 34 119.980 119.980 117.425 2.555 18533
11445 1 16 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.843 -0.163 18533
11446 1 16 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.797 0.353 18533
11447 1 16 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.396 0.794 18533
11448 1 16 . 1 1 35 35 LEU H H 34 7.980 7.980 8.624 -0.644 18533
11449 1 16 . 1 1 36 36 GLY N N 35 108.660 108.660 108.982 -0.322 18533
11450 1 16 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.637 -0.537 18533
11451 1 16 . 1 1 36 36 GLY H H 35 8.830 8.830 7.729 1.101 18533
11452 1 16 . 1 1 37 37 ASP N N 36 115.360 115.360 119.272 -3.912 18533
11453 1 16 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.624 0.146 18533
11454 1 16 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.132 -0.742 18533
11455 1 16 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.773 0.397 18533
11456 1 16 . 1 1 37 37 ASP H H 36 8.300 8.300 8.324 -0.024 18533
11457 1 16 . 1 1 38 38 ALA N N 37 121.460 121.460 118.787 2.673 18533
11458 1 16 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.273 0.037 18533
11459 1 16 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.153 -0.203 18533
11460 1 16 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.154 0.696 18533
11461 1 16 . 1 1 38 38 ALA H H 37 7.380 7.380 7.659 -0.279 18533
11462 1 16 . 1 1 39 39 VAL N N 38 115.660 115.660 117.328 -1.668 18533
11463 1 16 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.526 0.274 18533
11464 1 16 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.242 -0.202 18533
11465 1 16 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.979 0.211 18533
11466 1 16 . 1 1 39 39 VAL H H 38 7.100 7.100 7.823 -0.723 18533
11467 1 16 . 1 1 40 40 ARG N N 39 129.230 129.230 127.651 1.579 18533
11468 1 16 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.539 0.001 18533
11469 1 16 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.459 1.252 18533
11470 1 16 . 1 1 40 40 ARG CB C 39 32.320 32.320 31.203 1.117 18533
11471 1 16 . 1 1 40 40 ARG H H 39 9.730 9.730 8.123 1.607 18533
11472 1 16 . 1 1 41 41 VAL N N 40 126.240 126.240 123.166 3.074 18533
11473 1 16 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.948 0.742 18533
11474 1 16 . 1 1 41 41 VAL CA C 40 60.560 60.560 60.959 -0.399 18533
11475 1 16 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.600 -0.660 18533
11476 1 16 . 1 1 41 41 VAL H H 40 8.610 8.610 8.480 0.130 18533
11477 1 16 . 1 1 42 42 THR N N 41 117.310 117.310 118.182 -0.872 18533
11478 1 16 . 1 1 42 42 THR HA H 41 4.890 4.890 4.845 0.045 18533
11479 1 16 . 1 1 42 42 THR CA C 41 60.300 60.300 59.780 0.520 18533
11480 1 16 . 1 1 42 42 THR CB C 41 73.890 73.890 71.676 2.214 18533
11481 1 16 . 1 1 42 42 THR H H 41 8.870 8.870 9.038 -0.168 18533
11482 1 16 . 1 1 43 43 SER N N 42 109.960 109.960 113.304 -3.344 18533
11483 1 16 . 1 1 43 43 SER HA H 42 5.720 5.720 4.806 0.914 18533
11484 1 16 . 1 1 43 43 SER CA C 42 58.090 58.090 57.914 0.176 18533
11485 1 16 . 1 1 43 43 SER CB C 42 65.870 65.870 66.333 -0.463 18533
11486 1 16 . 1 1 43 43 SER H H 42 8.060 8.060 8.640 -0.580 18533
11487 1 16 . 1 1 44 44 ALA N N 43 119.200 119.200 119.503 -0.303 18533
11488 1 16 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.128 -0.868 18533
11489 1 16 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.738 -0.558 18533
11490 1 16 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.841 -1.011 18533
11491 1 16 . 1 1 44 44 ALA H H 43 8.710 8.710 9.051 -0.341 18533
11492 1 16 . 1 1 45 45 GLY N N 44 104.090 104.090 105.892 -1.802 18533
11493 1 16 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.154 -1.614 18533
11494 1 16 . 1 1 45 45 GLY H H 44 8.670 8.670 8.264 0.406 18533
11495 1 16 . 1 1 46 46 THR N N 45 114.060 114.060 116.995 -2.935 18533
11496 1 16 . 1 1 46 46 THR HA H 45 4.080 4.080 4.181 -0.101 18533
11497 1 16 . 1 1 46 46 THR CA C 45 64.680 64.680 64.595 0.085 18533
11498 1 16 . 1 1 46 46 THR CB C 45 67.880 67.880 68.974 -1.094 18533
11499 1 16 . 1 1 46 46 THR H H 45 9.120 9.120 8.047 1.073 18533
11500 1 16 . 1 1 47 47 GLY N N 46 110.380 110.380 108.281 2.099 18533
11501 1 16 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.853 -0.023 18533
11502 1 16 . 1 1 47 47 GLY H H 46 8.930 8.930 8.415 0.515 18533
11503 1 16 . 1 1 48 48 ASN N N 47 113.440 113.440 117.249 -3.809 18533
11504 1 16 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.348 0.142 18533
11505 1 16 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.229 -2.469 18533
11506 1 16 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.950 1.900 18533
11507 1 16 . 1 1 48 48 ASN H H 47 7.600 7.600 7.550 0.050 18533
11508 1 16 . 1 1 49 49 TRP N N 48 117.300 117.300 121.191 -3.891 18533
11509 1 16 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.414 -0.514 18533
11510 1 16 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.531 0.329 18533
11511 1 16 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.009 -0.489 18533
11512 1 16 . 1 1 49 49 TRP H H 48 6.920 6.920 8.636 -1.716 18533
11513 1 16 . 1 1 50 50 HIS N N 49 111.590 111.590 115.088 -3.498 18533
11514 1 16 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.855 0.025 18533
11515 1 16 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.453 -1.593 18533
11516 1 16 . 1 1 50 50 HIS CB C 49 31.040 31.040 30.249 0.791 18533
11517 1 16 . 1 1 50 50 HIS H H 49 8.620 8.620 8.203 0.417 18533
11518 1 16 . 1 1 51 51 VAL N N 50 119.010 119.010 120.178 -1.168 18533
11519 1 16 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.672 -0.472 18533
11520 1 16 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.571 1.109 18533
11521 1 16 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.824 -0.434 18533
11522 1 16 . 1 1 51 51 VAL H H 50 6.880 6.880 7.575 -0.695 18533
11523 1 16 . 1 1 52 52 GLY N N 51 115.450 115.450 115.822 -0.372 18533
11524 1 16 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.442 -0.502 18533
11525 1 16 . 1 1 52 52 GLY H H 51 9.120 9.120 9.316 -0.196 18533
11526 1 16 . 1 1 53 53 SER N N 52 116.620 116.620 115.951 0.669 18533
11527 1 16 . 1 1 53 53 SER HA H 52 4.610 4.610 4.761 -0.151 18533
11528 1 16 . 1 1 53 53 SER CA C 52 59.310 59.310 57.695 1.615 18533
11529 1 16 . 1 1 53 53 SER CB C 52 64.630 64.630 65.066 -0.436 18533
11530 1 16 . 1 1 53 53 SER H H 52 8.430 8.430 8.120 0.310 18533
11531 1 16 . 1 1 54 54 CYS N N 53 118.690 118.690 117.983 0.707 18533
11532 1 16 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.300 -0.200 18533
11533 1 16 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.253 1.417 18533
11534 1 16 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.383 -3.033 18533
11535 1 16 . 1 1 54 54 CYS H H 53 8.170 8.170 8.468 -0.298 18533
11536 1 16 . 1 1 55 55 ALA N N 54 118.580 118.580 124.015 -5.435 18533
11537 1 16 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.221 -0.101 18533
11538 1 16 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.477 0.162 18533
11539 1 16 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.441 -2.811 18533
11540 1 16 . 1 1 55 55 ALA H H 54 8.420 8.420 8.519 -0.099 18533
11541 1 16 . 1 1 56 56 ASP N N 55 121.500 121.500 119.962 1.538 18533
11542 1 16 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.335 0.005 18533
11543 1 16 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.151 0.899 18533
11544 1 16 . 1 1 56 56 ASP CB C 55 46.060 46.060 40.799 5.261 18533
11545 1 16 . 1 1 56 56 ASP H H 55 8.470 8.470 8.207 0.263 18533
11546 1 16 . 1 1 57 57 GLU N N 56 127.840 127.840 123.826 4.014 18533
11547 1 16 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.777 0.263 18533
11548 1 16 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.571 0.069 18533
11549 1 16 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.002 0.498 18533
11550 1 16 . 1 1 57 57 GLU H H 56 9.230 9.230 8.833 0.397 18533
11551 1 16 . 1 1 58 58 ARG N N 57 120.820 120.820 118.912 1.908 18533
11552 1 16 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.889 -0.079 18533
11553 1 16 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.086 0.064 18533
11554 1 16 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.317 -1.047 18533
11555 1 16 . 1 1 58 58 ARG H H 57 9.220 9.220 7.930 1.290 18533
11556 1 16 . 1 1 59 59 ALA N N 58 121.590 121.590 122.487 -0.897 18533
11557 1 16 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.078 0.082 18533
11558 1 16 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.429 0.351 18533
11559 1 16 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.142 0.348 18533
11560 1 16 . 1 1 59 59 ALA H H 58 6.680 6.680 7.537 -0.857 18533
11561 1 16 . 1 1 60 60 ALA N N 59 118.970 118.970 121.494 -2.524 18533
11562 1 16 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.936 -0.076 18533
11563 1 16 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.200 -0.180 18533
11564 1 16 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.356 -0.286 18533
11565 1 16 . 1 1 60 60 ALA H H 59 8.540 8.540 8.583 -0.043 18533
11566 1 16 . 1 1 61 61 GLY N N 60 104.160 104.160 106.896 -2.736 18533
11567 1 16 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.200 0.070 18533
11568 1 16 . 1 1 61 61 GLY H H 60 8.210 8.210 8.349 -0.139 18533
11569 1 16 . 1 1 62 62 VAL N N 61 122.820 122.820 120.097 2.723 18533
11570 1 16 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.691 0.159 18533
11571 1 16 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.158 1.092 18533
11572 1 16 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.417 0.473 18533
11573 1 16 . 1 1 62 62 VAL H H 61 7.310 7.310 7.771 -0.461 18533
11574 1 16 . 1 1 63 63 LEU N N 62 120.310 120.310 121.052 -0.742 18533
11575 1 16 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.257 -0.277 18533
11576 1 16 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.325 0.625 18533
11577 1 16 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.419 0.081 18533
11578 1 16 . 1 1 63 63 LEU H H 62 8.090 8.090 8.396 -0.306 18533
11579 1 16 . 1 1 64 64 ARG N N 63 119.440 119.440 119.413 0.027 18533
11580 1 16 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.302 -0.122 18533
11581 1 16 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.909 0.541 18533
11582 1 16 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.614 0.766 18533
11583 1 16 . 1 1 64 64 ARG H H 63 8.740 8.740 8.678 0.062 18533
11584 1 16 . 1 1 65 65 ALA N N 64 122.560 122.560 121.673 0.887 18533
11585 1 16 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.101 -0.071 18533
11586 1 16 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.131 0.409 18533
11587 1 16 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.288 -0.208 18533
11588 1 16 . 1 1 65 65 ALA H H 64 7.910 7.910 7.854 0.056 18533
11589 1 16 . 1 1 66 66 HIS N N 65 112.690 112.690 114.941 -2.251 18533
11590 1 16 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.685 -0.045 18533
11591 1 16 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.082 -0.582 18533
11592 1 16 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.936 0.384 18533
11593 1 16 . 1 1 66 66 HIS H H 65 7.410 7.410 7.832 -0.422 18533
11594 1 16 . 1 1 67 67 GLY N N 66 107.440 107.440 107.333 0.107 18533
11595 1 16 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.296 1.064 18533
11596 1 16 . 1 1 67 67 GLY H H 66 7.850 7.850 7.597 0.253 18533
11597 1 16 . 1 1 68 68 TYR N N 67 119.940 119.940 120.640 -0.700 18533
11598 1 16 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.737 0.063 18533
11599 1 16 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.584 0.516 18533
11600 1 16 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.094 0.766 18533
11601 1 16 . 1 1 68 68 TYR H H 67 8.380 8.380 8.372 0.008 18533
11602 1 16 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.591 -0.031 18533
11603 1 16 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.694 -0.094 18533
11604 1 16 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.756 0.054 18533
11605 1 16 . 1 1 70 70 THR N N 69 100.660 100.660 106.320 -5.660 18533
11606 1 16 . 1 1 70 70 THR HA H 69 4.300 4.300 4.412 -0.112 18533
11607 1 16 . 1 1 70 70 THR CA C 69 61.250 61.250 60.749 0.501 18533
11608 1 16 . 1 1 70 70 THR CB C 69 70.740 70.740 69.975 0.765 18533
11609 1 16 . 1 1 70 70 THR H H 69 7.860 7.860 7.984 -0.124 18533
11610 1 16 . 1 1 71 71 ASP N N 70 122.880 122.880 122.809 0.071 18533
11611 1 16 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.439 -0.029 18533
11612 1 16 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.555 0.315 18533
11613 1 16 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.132 -0.162 18533
11614 1 16 . 1 1 71 71 ASP H H 70 7.940 7.940 7.918 0.022 18533
11615 1 16 . 1 1 72 72 HIS N N 71 121.720 121.720 123.977 -2.257 18533
11616 1 16 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.762 -0.062 18533
11617 1 16 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.165 1.225 18533
11618 1 16 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.417 2.923 18533
11619 1 16 . 1 1 72 72 HIS H H 71 8.000 8.000 8.184 -0.184 18533
11620 1 16 . 1 1 73 73 ARG N N 72 125.760 125.760 126.111 -0.351 18533
11621 1 16 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.103 -0.813 18533
11622 1 16 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.309 0.121 18533
11623 1 16 . 1 1 73 73 ARG CB C 72 32.310 32.310 32.210 0.100 18533
11624 1 16 . 1 1 73 73 ARG H H 72 7.230 7.230 8.107 -0.877 18533
11625 1 16 . 1 1 74 74 ALA N N 73 127.970 127.970 129.066 -1.096 18533
11626 1 16 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.754 -0.124 18533
11627 1 16 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.188 -0.008 18533
11628 1 16 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.214 -1.314 18533
11629 1 16 . 1 1 74 74 ALA H H 73 9.090 9.090 8.225 0.865 18533
11630 1 16 . 1 1 75 75 ALA N N 74 126.090 126.090 125.498 0.592 18533
11631 1 16 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.821 -0.031 18533
11632 1 16 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.635 0.335 18533
11633 1 16 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.078 1.542 18533
11634 1 16 . 1 1 75 75 ALA H H 74 9.410 9.410 9.550 -0.140 18533
11635 1 16 . 1 1 76 76 GLN N N 75 123.260 123.260 119.760 3.500 18533
11636 1 16 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.826 0.124 18533
11637 1 16 . 1 1 76 76 GLN CA C 75 53.550 53.550 54.178 -0.628 18533
11638 1 16 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.438 -1.388 18533
11639 1 16 . 1 1 76 76 GLN H H 75 8.800 8.800 8.308 0.492 18533
11640 1 16 . 1 1 77 77 VAL N N 76 125.510 125.510 123.665 1.845 18533
11641 1 16 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.602 -0.302 18533
11642 1 16 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.976 -0.396 18533
11643 1 16 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.427 2.063 18533
11644 1 16 . 1 1 77 77 VAL H H 76 8.550 8.550 8.132 0.418 18533
11645 1 16 . 1 1 78 78 GLY N N 77 121.850 121.850 115.934 5.916 18533
11646 1 16 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.202 -0.362 18533
11647 1 16 . 1 1 78 78 GLY H H 77 10.930 10.930 7.991 2.939 18533
11648 1 16 . 1 1 79 79 THR N N 78 115.210 115.210 115.641 -0.431 18533
11649 1 16 . 1 1 79 79 THR HA H 78 3.700 3.700 3.951 -0.251 18533
11650 1 16 . 1 1 79 79 THR CA C 78 66.440 66.440 67.653 -1.213 18533
11651 1 16 . 1 1 79 79 THR CB C 78 68.770 68.770 68.829 -0.059 18533
11652 1 16 . 1 1 79 79 THR H H 78 8.540 8.540 8.425 0.115 18533
11653 1 16 . 1 1 80 80 GLU N N 79 119.360 119.360 118.758 0.602 18533
11654 1 16 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.936 0.024 18533
11655 1 16 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.705 0.325 18533
11656 1 16 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.923 0.137 18533
11657 1 16 . 1 1 80 80 GLU H H 79 9.110 9.110 8.818 0.292 18533
11658 1 16 . 1 1 81 81 HIS N N 80 118.380 118.380 116.919 1.461 18533
11659 1 16 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.242 -0.302 18533
11660 1 16 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.909 1.511 18533
11661 1 16 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.274 0.655 18533
11662 1 16 . 1 1 81 81 HIS H H 80 7.040 7.040 7.487 -0.447 18533
11663 1 16 . 1 1 82 82 LEU N N 81 114.010 114.010 120.013 -6.003 18533
11664 1 16 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.085 -0.185 18533
11665 1 16 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.813 -0.133 18533
11666 1 16 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.473 -0.743 18533
11667 1 16 . 1 1 82 82 LEU H H 81 7.850 7.850 8.170 -0.320 18533
11668 1 16 . 1 1 83 83 ALA N N 82 119.050 119.050 118.927 0.123 18533
11669 1 16 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.309 0.081 18533
11670 1 16 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.739 -0.539 18533
11671 1 16 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.518 0.662 18533
11672 1 16 . 1 1 83 83 ALA H H 82 6.950 6.950 7.325 -0.375 18533
11673 1 16 . 1 1 84 84 ALA N N 83 122.500 122.500 121.939 0.561 18533
11674 1 16 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.135 -0.375 18533
11675 1 16 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.721 1.629 18533
11676 1 16 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.530 -2.210 18533
11677 1 16 . 1 1 84 84 ALA H H 83 7.280 7.280 7.277 0.003 18533
11678 1 16 . 1 1 85 85 ASP N N 84 118.740 118.740 120.284 -1.544 18533
11679 1 16 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.693 -0.283 18533
11680 1 16 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.177 1.463 18533
11681 1 16 . 1 1 85 85 ASP CB C 84 42.900 42.900 41.994 0.906 18533
11682 1 16 . 1 1 85 85 ASP H H 84 8.440 8.440 8.459 -0.019 18533
11683 1 16 . 1 1 86 86 LEU N N 85 115.180 115.180 119.577 -4.397 18533
11684 1 16 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.862 -0.682 18533
11685 1 16 . 1 1 86 86 LEU CA C 85 55.040 55.040 54.117 0.923 18533
11686 1 16 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.742 0.427 18533
11687 1 16 . 1 1 86 86 LEU H H 85 7.280 7.280 8.245 -0.965 18533
11688 1 16 . 1 1 87 87 LEU N N 86 128.140 128.140 127.583 0.557 18533
11689 1 16 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.973 -0.283 18533
11690 1 16 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.782 1.599 18533
11691 1 16 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.632 -0.462 18533
11692 1 16 . 1 1 87 87 LEU H H 86 8.780 8.780 9.172 -0.392 18533
11693 1 16 . 1 1 88 88 VAL N N 87 122.630 122.630 127.120 -4.490 18533
11694 1 16 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.914 -0.284 18533
11695 1 16 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.926 -2.016 18533
11696 1 16 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.813 -0.973 18533
11697 1 16 . 1 1 88 88 VAL H H 87 9.010 9.010 9.075 -0.065 18533
11698 1 16 . 1 1 89 89 ALA N N 88 129.820 129.820 131.210 -1.390 18533
11699 1 16 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.821 -0.301 18533
11700 1 16 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.551 -0.771 18533
11701 1 16 . 1 1 89 89 ALA CB C 88 20.780 20.780 20.855 -0.075 18533
11702 1 16 . 1 1 89 89 ALA H H 88 8.590 8.590 9.170 -0.580 18533
11703 1 16 . 1 1 90 90 LEU N N 89 129.280 129.280 120.566 8.714 18533
11704 1 16 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.569 -0.259 18533
11705 1 16 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.721 0.729 18533
11706 1 16 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.689 -3.669 18533
11707 1 16 . 1 1 90 90 LEU H H 89 8.570 8.570 8.756 -0.186 18533
11708 1 16 . 1 1 91 91 ASP N N 90 126.910 126.910 115.962 10.948 18533
11709 1 16 . 1 1 91 91 ASP HA H 90 4.800 4.800 5.201 -0.401 18533
11710 1 16 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.543 0.407 18533
11711 1 16 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.688 0.122 18533
11712 1 16 . 1 1 91 91 ASP H H 90 11.450 11.450 7.552 3.898 18533
11713 1 16 . 1 1 92 92 ARG N N 91 116.950 116.950 121.941 -4.991 18533
11714 1 16 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.946 0.074 18533
11715 1 16 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.279 -0.449 18533
11716 1 16 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.818 0.462 18533
11717 1 16 . 1 1 92 92 ARG H H 91 8.650 8.650 8.339 0.311 18533
11718 1 16 . 1 1 93 93 ASN N N 92 120.740 120.740 118.364 2.376 18533
11719 1 16 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.505 -0.125 18533
11720 1 16 . 1 1 93 93 ASN CA C 92 56.130 56.130 56.133 -0.003 18533
11721 1 16 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.494 -0.874 18533
11722 1 16 . 1 1 93 93 ASN H H 92 8.610 8.610 8.075 0.535 18533
11723 1 16 . 1 1 94 94 HIS N N 93 121.170 121.170 120.310 0.860 18533
11724 1 16 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.201 -0.011 18533
11725 1 16 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.153 0.357 18533
11726 1 16 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.622 1.758 18533
11727 1 16 . 1 1 94 94 HIS H H 93 7.430 7.430 8.741 -1.311 18533
11728 1 16 . 1 1 95 95 ALA N N 94 118.270 118.270 121.290 -3.020 18533
11729 1 16 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.957 -0.217 18533
11730 1 16 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.474 0.027 18533
11731 1 16 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.377 -0.407 18533
11732 1 16 . 1 1 95 95 ALA H H 94 7.190 7.190 8.028 -0.838 18533
11733 1 16 . 1 1 96 96 ARG N N 95 117.190 117.190 119.173 -1.983 18533
11734 1 16 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.064 -0.154 18533
11735 1 16 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.217 0.283 18533
11736 1 16 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.035 0.195 18533
11737 1 16 . 1 1 96 96 ARG H H 95 7.600 7.600 7.632 -0.032 18533
11738 1 16 . 1 1 97 97 LEU N N 96 120.700 120.700 119.801 0.899 18533
11739 1 16 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.990 0.090 18533
11740 1 16 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.776 0.124 18533
11741 1 16 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.669 -0.329 18533
11742 1 16 . 1 1 97 97 LEU H H 96 7.990 7.990 8.194 -0.204 18533
11743 1 16 . 1 1 98 98 LEU N N 97 118.390 118.390 118.700 -0.310 18533
11744 1 16 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.865 0.045 18533
11745 1 16 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.144 -0.044 18533
11746 1 16 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.268 0.622 18533
11747 1 16 . 1 1 98 98 LEU H H 97 8.210 8.210 8.394 -0.184 18533
11748 1 16 . 1 1 99 99 ARG N N 98 117.470 117.470 117.893 -0.423 18533
11749 1 16 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.122 0.358 18533
11750 1 16 . 1 1 99 99 ARG CA C 98 58.360 58.360 58.989 -0.629 18533
11751 1 16 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.587 -0.847 18533
11752 1 16 . 1 1 99 99 ARG H H 98 7.740 7.740 7.834 -0.094 18533
11753 1 16 . 1 1 100 100 GLN N N 99 121.400 121.400 118.991 2.409 18533
11754 1 16 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.172 -0.102 18533
11755 1 16 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.211 0.469 18533
11756 1 16 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.176 0.144 18533
11757 1 16 . 1 1 100 100 GLN H H 99 8.030 8.030 8.068 -0.038 18533
11758 1 16 . 1 1 101 101 LEU N N 100 118.940 118.940 116.965 1.975 18533
11759 1 16 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.195 0.065 18533
11760 1 16 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.234 0.226 18533
11761 1 16 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.191 0.049 18533
11762 1 16 . 1 1 101 101 LEU H H 100 7.780 7.780 7.907 -0.127 18533
11763 1 16 . 1 1 102 102 GLY N N 101 105.740 105.740 104.531 1.209 18533
11764 1 16 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.391 0.639 18533
11765 1 16 . 1 1 102 102 GLY H H 101 7.700 7.700 7.600 0.100 18533
11766 1 16 . 1 1 103 103 VAL N N 102 122.330 122.330 121.487 0.843 18533
11767 1 16 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.088 -0.458 18533
11768 1 16 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.079 1.521 18533
11769 1 16 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.685 -2.195 18533
11770 1 16 . 1 1 103 103 VAL H H 102 7.520 7.520 7.886 -0.366 18533
11771 1 16 . 1 1 104 104 GLU N N 103 128.990 128.990 114.376 14.614 18533
11772 1 16 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.442 -0.272 18533
11773 1 16 . 1 1 104 104 GLU CA C 103 56.920 56.920 54.953 1.967 18533
11774 1 16 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.589 -3.639 18533
11775 1 16 . 1 1 104 104 GLU H H 103 9.210 9.210 7.991 1.219 18533
11776 1 16 . 1 1 105 105 ALA N N 104 124.410 124.410 122.638 1.772 18533
11777 1 16 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.214 -0.454 18533
11778 1 16 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.109 0.531 18533
11779 1 16 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.639 -0.499 18533
11780 1 16 . 1 1 105 105 ALA H H 104 8.500 8.500 8.722 -0.222 18533
11781 1 16 . 1 1 106 106 ALA N N 105 115.110 115.110 120.342 -5.232 18533
11782 1 16 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.186 -0.056 18533
11783 1 16 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.768 -0.728 18533
11784 1 16 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.507 0.553 18533
11785 1 16 . 1 1 106 106 ALA H H 105 8.270 8.270 8.403 -0.133 18533
11786 1 16 . 1 1 107 107 ARG N N 106 115.080 115.080 114.842 0.238 18533
11787 1 16 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.757 -0.297 18533
11788 1 16 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.803 -0.293 18533
11789 1 16 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.928 0.442 18533
11790 1 16 . 1 1 107 107 ARG H H 106 7.740 7.740 7.694 0.046 18533
11791 1 16 . 1 1 108 108 VAL N N 107 118.170 118.170 121.639 -3.469 18533
11792 1 16 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.159 0.911 18533
11793 1 16 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.308 -1.668 18533
11794 1 16 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.461 1.139 18533
11795 1 16 . 1 1 108 108 VAL H H 107 7.290 7.290 8.449 -1.159 18533
11796 1 16 . 1 1 109 109 ARG N N 108 124.250 124.250 128.315 -4.065 18533
11797 1 16 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.673 -0.053 18533
11798 1 16 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.752 -0.862 18533
11799 1 16 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.207 0.773 18533
11800 1 16 . 1 1 109 109 ARG H H 108 8.420 8.420 9.244 -0.824 18533
11801 1 16 . 1 1 110 110 MET N N 109 119.570 119.570 121.751 -2.181 18533
11802 1 16 . 1 1 110 110 MET HA H 109 4.960 4.960 4.849 0.111 18533
11803 1 16 . 1 1 110 110 MET CA C 109 53.820 53.820 54.124 -0.304 18533
11804 1 16 . 1 1 110 110 MET CB C 109 30.680 30.680 32.281 -1.601 18533
11805 1 16 . 1 1 110 110 MET H H 109 8.890 8.890 8.660 0.230 18533
11806 1 16 . 1 1 111 111 LEU N N 110 128.660 128.660 127.112 1.548 18533
11807 1 16 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.295 -0.335 18533
11808 1 16 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.917 0.683 18533
11809 1 16 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.957 -0.877 18533
11810 1 16 . 1 1 111 111 LEU H H 110 9.200 9.200 8.739 0.462 18533
11811 1 16 . 1 1 112 112 ARG N N 111 111.910 111.910 115.999 -4.089 18533
11812 1 16 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.093 -0.143 18533
11813 1 16 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.476 1.444 18533
11814 1 16 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.626 -1.126 18533
11815 1 16 . 1 1 112 112 ARG H H 111 8.930 8.930 8.649 0.281 18533
11816 1 16 . 1 1 113 113 SER N N 112 114.800 114.800 115.724 -0.924 18533
11817 1 16 . 1 1 113 113 SER HA H 112 4.290 4.290 4.268 0.022 18533
11818 1 16 . 1 1 113 113 SER CA C 112 60.880 60.880 59.722 1.158 18533
11819 1 16 . 1 1 113 113 SER CB C 112 63.190 63.190 62.482 0.708 18533
11820 1 16 . 1 1 113 113 SER H H 112 7.680 7.680 7.764 -0.084 18533
11821 1 16 . 1 1 114 114 PHE N N 113 119.260 119.260 117.489 1.771 18533
11822 1 16 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.495 -0.145 18533
11823 1 16 . 1 1 114 114 PHE CA C 113 59.930 59.930 58.980 0.951 18533
11824 1 16 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.693 0.027 18533
11825 1 16 . 1 1 114 114 PHE H H 113 7.600 7.600 7.582 0.018 18533
11826 1 16 . 1 1 115 115 ASP N N 114 121.170 121.170 121.627 -0.457 18533
11827 1 16 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.959 0.061 18533
11828 1 16 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.246 -1.146 18533
11829 1 16 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.940 0.570 18533
11830 1 16 . 1 1 115 115 ASP H H 114 7.430 7.430 7.482 -0.052 18533
11831 1 16 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.442 0.048 18533
11832 1 16 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.166 0.184 18533
11833 1 16 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.178 0.092 18533
11834 1 16 . 1 1 117 117 ARG N N 116 117.910 117.910 117.357 0.553 18533
11835 1 16 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.434 -0.164 18533
11836 1 16 . 1 1 117 117 ARG CA C 116 56.450 56.450 54.349 2.101 18533
11837 1 16 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.072 -0.112 18533
11838 1 16 . 1 1 117 117 ARG H H 116 8.580 8.580 8.311 0.269 18533
11839 1 16 . 1 1 118 118 SER N N 117 116.130 116.130 116.053 0.077 18533
11840 1 16 . 1 1 118 118 SER HA H 117 3.980 3.980 4.293 -0.313 18533
11841 1 16 . 1 1 118 118 SER CA C 117 59.790 59.790 58.980 0.810 18533
11842 1 16 . 1 1 118 118 SER CB C 117 63.760 63.760 62.528 1.232 18533
11843 1 16 . 1 1 118 118 SER H H 117 7.950 7.950 7.318 0.632 18533
11844 1 16 . 1 1 119 119 GLY N N 118 110.080 110.080 115.050 -4.970 18533
11845 1 16 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.737 -1.367 18533
11846 1 16 . 1 1 119 119 GLY H H 118 8.150 8.150 8.462 -0.312 18533
11847 1 16 . 1 1 120 120 THR HA H 119 4.020 4.020 4.521 -0.501 18533
11848 1 16 . 1 1 120 120 THR CA C 119 63.290 63.290 60.421 2.869 18533
11849 1 16 . 1 1 120 120 THR CB C 119 69.140 69.140 71.016 -1.876 18533
11850 1 16 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.520 0.050 18533
11851 1 16 . 1 1 121 121 HIS CA C 120 56.010 56.010 56.003 0.007 18533
11852 1 16 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.287 0.703 18533
11853 1 16 . 1 1 122 122 ALA N N 121 125.880 125.880 124.128 1.752 18533
11854 1 16 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.238 0.102 18533
11855 1 16 . 1 1 122 122 ALA CA C 121 51.510 51.510 52.281 -0.771 18533
11856 1 16 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.048 -1.448 18533
11857 1 16 . 1 1 122 122 ALA H H 121 7.980 7.980 8.397 -0.417 18533
11858 1 16 . 1 1 123 123 LEU N N 122 119.810 119.810 119.919 -0.109 18533
11859 1 16 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.548 -0.268 18533
11860 1 16 . 1 1 123 123 LEU CA C 122 54.490 54.490 55.467 -0.977 18533
11861 1 16 . 1 1 123 123 LEU CB C 122 43.700 43.700 43.731 -0.031 18533
11862 1 16 . 1 1 123 123 LEU H H 122 7.810 7.810 8.406 -0.596 18533
11863 1 16 . 1 1 124 124 ASP N N 123 119.050 119.050 116.935 2.115 18533
11864 1 16 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.649 -0.079 18533
11865 1 16 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.526 1.794 18533
11866 1 16 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.243 -0.573 18533
11867 1 16 . 1 1 124 124 ASP H H 123 8.270 8.270 7.491 0.779 18533
11868 1 16 . 1 1 125 125 VAL N N 124 121.970 121.970 122.611 -0.641 18533
11869 1 16 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.301 -0.041 18533
11870 1 16 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.929 1.381 18533
11871 1 16 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.696 -2.916 18533
11872 1 16 . 1 1 125 125 VAL H H 124 7.930 7.930 8.127 -0.197 18533
11873 1 16 . 1 1 126 126 GLU N N 125 129.490 129.490 125.854 3.636 18533
11874 1 16 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.206 -0.126 18533
11875 1 16 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.192 0.818 18533
11876 1 16 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.297 -0.497 18533
11877 1 16 . 1 1 126 126 GLU H H 125 9.100 9.100 8.454 0.646 18533
11878 1 16 . 1 1 127 127 ASP N N 126 122.300 122.300 118.154 4.146 18533
11879 1 16 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.783 -0.673 18533
11880 1 16 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.862 -0.142 18533
11881 1 16 . 1 1 127 127 ASP CB C 126 42.520 42.520 41.363 1.157 18533
11882 1 16 . 1 1 127 127 ASP H H 126 8.630 8.630 8.182 0.448 18533
11883 1 16 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.286 0.264 18533
11884 1 16 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.439 -0.839 18533
11885 1 16 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.088 -1.108 18533
11886 1 16 . 1 1 129 129 TYR N N 128 122.380 122.380 122.475 -0.095 18533
11887 1 16 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.265 -0.465 18533
11888 1 16 . 1 1 129 129 TYR CA C 128 63.120 63.120 60.289 2.831 18533
11889 1 16 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.859 -0.469 18533
11890 1 16 . 1 1 129 129 TYR H H 128 8.670 8.670 9.434 -0.764 18533
11891 1 16 . 1 1 130 130 TYR N N 129 116.300 116.300 112.287 4.013 18533
11892 1 16 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.846 -0.356 18533
11893 1 16 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.516 1.964 18533
11894 1 16 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.230 -2.570 18533
11895 1 16 . 1 1 130 130 TYR H H 129 8.680 8.680 7.721 0.959 18533
11896 1 16 . 1 1 131 131 GLY N N 130 110.870 110.870 110.915 -0.045 18533
11897 1 16 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.976 -0.896 18533
11898 1 16 . 1 1 131 131 GLY H H 130 8.060 8.060 8.335 -0.275 18533
11899 1 16 . 1 1 132 132 ASP N N 131 121.590 121.590 119.737 1.853 18533
11900 1 16 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.674 0.396 18533
11901 1 16 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.774 0.226 18533
11902 1 16 . 1 1 132 132 ASP CB C 131 43.600 43.600 43.023 0.577 18533
11903 1 16 . 1 1 132 132 ASP H H 131 9.290 9.290 8.176 1.114 18533
11904 1 16 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.303 -0.193 18533
11905 1 16 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.781 1.789 18533
11906 1 16 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.253 0.227 18533
11907 1 16 . 1 1 134 134 SER N N 133 115.370 115.370 115.715 -0.345 18533
11908 1 16 . 1 1 134 134 SER HA H 133 4.180 4.180 4.225 -0.045 18533
11909 1 16 . 1 1 134 134 SER CA C 133 62.070 62.070 62.666 -0.596 18533
11910 1 16 . 1 1 134 134 SER CB C 133 62.160 62.160 62.432 -0.272 18533
11911 1 16 . 1 1 134 134 SER H H 133 8.420 8.420 8.145 0.275 18533
11912 1 16 . 1 1 135 135 ASP N N 134 123.360 123.360 122.011 1.349 18533
11913 1 16 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.361 0.169 18533
11914 1 16 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.385 0.655 18533
11915 1 16 . 1 1 135 135 ASP CB C 134 40.810 40.810 39.997 0.813 18533
11916 1 16 . 1 1 135 135 ASP H H 134 7.980 7.980 8.537 -0.557 18533
11917 1 16 . 1 1 136 136 PHE N N 135 118.940 118.940 118.373 0.567 18533
11918 1 16 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.259 -0.459 18533
11919 1 16 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.413 3.406 18533
11920 1 16 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.115 1.234 18533
11921 1 16 . 1 1 136 136 PHE H H 135 7.850 7.850 7.228 0.622 18533
11922 1 16 . 1 1 137 137 GLU N N 136 121.410 121.410 118.074 3.336 18533
11923 1 16 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.182 -0.002 18533
11924 1 16 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.839 0.661 18533
11925 1 16 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.338 -0.348 18533
11926 1 16 . 1 1 137 137 GLU H H 136 8.150 8.150 8.064 0.086 18533
11927 1 16 . 1 1 138 138 GLU N N 137 121.530 121.530 121.685 -0.155 18533
11928 1 16 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.160 0.130 18533
11929 1 16 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.288 0.113 18533
11930 1 16 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.160 -0.270 18533
11931 1 16 . 1 1 138 138 GLU H H 137 7.870 7.870 8.379 -0.509 18533
11932 1 16 . 1 1 139 139 VAL N N 138 119.930 119.930 119.913 0.017 18533
11933 1 16 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.629 -0.149 18533
11934 1 16 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.279 0.801 18533
11935 1 16 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.607 -0.257 18533
11936 1 16 . 1 1 139 139 VAL H H 138 7.770 7.770 7.648 0.122 18533
11937 1 16 . 1 1 140 140 PHE N N 139 119.130 119.130 120.898 -1.768 18533
11938 1 16 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.988 -0.428 18533
11939 1 16 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.748 0.932 18533
11940 1 16 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.814 0.356 18533
11941 1 16 . 1 1 140 140 PHE H H 139 8.050 8.050 7.881 0.169 18533
11942 1 16 . 1 1 141 141 ALA N N 140 121.040 121.040 121.846 -0.806 18533
11943 1 16 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.366 -0.376 18533
11944 1 16 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.736 0.384 18533
11945 1 16 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.495 -0.196 18533
11946 1 16 . 1 1 141 141 ALA H H 140 8.010 8.010 8.050 -0.040 18533
11947 1 16 . 1 1 142 142 VAL N N 141 118.550 118.550 118.946 -0.396 18533
11948 1 16 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.592 0.218 18533
11949 1 16 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.439 -0.839 18533
11950 1 16 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.112 0.338 18533
11951 1 16 . 1 1 142 142 VAL H H 141 8.300 8.300 7.943 0.357 18533
11952 1 16 . 1 1 143 143 ILE N N 142 121.410 121.410 119.670 1.740 18533
11953 1 16 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.474 -0.084 18533
11954 1 16 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.503 0.547 18533
11955 1 16 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.756 -0.446 18533
11956 1 16 . 1 1 143 143 ILE H H 142 8.150 8.150 8.356 -0.206 18533
11957 1 16 . 1 1 144 144 GLU N N 143 119.630 119.630 119.356 0.274 18533
11958 1 16 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.782 -0.242 18533
11959 1 16 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.199 0.561 18533
11960 1 16 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.982 0.748 18533
11961 1 16 . 1 1 144 144 GLU H H 143 8.640 8.640 8.153 0.487 18533
11962 1 16 . 1 1 145 145 SER N N 144 110.920 110.920 113.930 -3.010 18533
11963 1 16 . 1 1 145 145 SER HA H 144 4.230 4.230 4.244 -0.014 18533
11964 1 16 . 1 1 145 145 SER CA C 144 60.810 60.810 60.607 0.203 18533
11965 1 16 . 1 1 145 145 SER CB C 144 63.610 63.610 63.494 0.116 18533
11966 1 16 . 1 1 145 145 SER H H 144 7.640 7.640 7.863 -0.223 18533
11967 1 16 . 1 1 146 146 ALA N N 145 123.110 123.110 124.521 -1.411 18533
11968 1 16 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.348 -0.228 18533
11969 1 16 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.076 -0.676 18533
11970 1 16 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.388 2.492 18533
11971 1 16 . 1 1 146 146 ALA H H 145 7.500 7.500 7.628 -0.128 18533
11972 1 16 . 1 1 147 147 LEU N N 146 114.220 114.220 119.914 -5.694 18533
11973 1 16 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.861 0.079 18533
11974 1 16 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.595 -0.545 18533
11975 1 16 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.407 0.052 18533
11976 1 16 . 1 1 147 147 LEU H H 146 7.410 7.410 8.269 -0.859 18533
11977 1 16 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.942 -0.492 18533
11978 1 16 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.688 3.152 18533
11979 1 16 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.342 -0.122 18533
11980 1 16 . 1 1 149 149 GLY N N 148 102.590 102.590 106.346 -3.756 18533
11981 1 16 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.333 1.927 18533
11982 1 16 . 1 1 149 149 GLY H H 148 7.960 7.960 7.796 0.164 18533
11983 1 16 . 1 1 150 150 LEU N N 149 128.060 128.060 124.188 3.872 18533
11984 1 16 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.060 0.570 18533
11985 1 16 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.316 0.034 18533
11986 1 16 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.388 -0.188 18533
11987 1 16 . 1 1 150 150 LEU H H 149 7.620 7.620 8.380 -0.760 18533
11988 1 16 . 1 1 151 151 HIS N N 150 120.730 120.730 117.881 2.849 18533
11989 1 16 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.027 0.143 18533
11990 1 16 . 1 1 151 151 HIS CA C 150 62.380 62.380 59.695 2.685 18533
11991 1 16 . 1 1 151 151 HIS CB C 150 30.510 30.510 28.845 1.665 18533
11992 1 16 . 1 1 151 151 HIS H H 150 8.430 8.430 8.364 0.066 18533
11993 1 16 . 1 1 152 152 ASP N N 151 118.170 118.170 120.259 -2.089 18533
11994 1 16 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.029 0.391 18533
11995 1 16 . 1 1 152 152 ASP CA C 151 57.810 57.810 58.066 -0.256 18533
11996 1 16 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.330 -0.300 18533
11997 1 16 . 1 1 152 152 ASP H H 151 7.820 7.820 7.617 0.203 18533
11998 1 16 . 1 1 153 153 TRP N N 152 122.780 122.780 122.048 0.732 18533
11999 1 16 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.592 -0.482 18533
12000 1 16 . 1 1 153 153 TRP CA C 152 62.610 62.610 60.990 1.620 18533
12001 1 16 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.192 -0.402 18533
12002 1 16 . 1 1 153 153 TRP H H 152 7.900 7.900 7.603 0.297 18533
12003 1 16 . 1 1 154 154 VAL N N 153 119.460 119.460 117.085 2.375 18533
12004 1 16 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.797 -0.447 18533
12005 1 16 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.425 0.555 18533
12006 1 16 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.587 0.312 18533
12007 1 16 . 1 1 154 154 VAL H H 153 8.560 8.560 8.740 -0.180 18533
12008 1 16 . 1 1 155 155 ASP N N 154 120.500 120.500 121.483 -0.983 18533
12009 1 16 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.312 -0.112 18533
12010 1 16 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.305 -0.735 18533
12011 1 16 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.788 -0.928 18533
12012 1 16 . 1 1 155 155 ASP H H 154 8.530 8.530 8.590 -0.060 18533
12013 1 16 . 1 1 156 156 GLU N N 155 120.090 120.090 119.556 0.534 18533
12014 1 16 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.899 0.031 18533
12015 1 16 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.258 -0.098 18533
12016 1 16 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.282 0.008 18533
12017 1 16 . 1 1 156 156 GLU H H 155 7.870 7.870 8.366 -0.496 18533
12018 1 16 . 1 1 157 157 ARG N N 156 119.230 119.230 119.123 0.107 18533
12019 1 16 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.992 -0.182 18533
12020 1 16 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.093 -0.102 18533
12021 1 16 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.254 -0.144 18533
12022 1 16 . 1 1 157 157 ARG H H 156 7.660 7.660 8.016 -0.356 18533
12023 1 16 . 1 1 158 158 LEU N N 157 118.790 118.790 117.207 1.583 18533
12024 1 16 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.085 0.015 18533
12025 1 16 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.551 -0.871 18533
12026 1 16 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.876 0.814 18533
12027 1 16 . 1 1 158 158 LEU H H 157 8.470 8.470 8.305 0.165 18533
12028 1 16 . 1 1 159 159 ALA N N 158 120.760 120.760 120.983 -0.223 18533
12029 1 16 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.186 0.004 18533
12030 1 16 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.324 -1.044 18533
12031 1 16 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.184 -0.794 18533
12032 1 16 . 1 1 159 159 ALA H H 158 7.490 7.490 7.755 -0.265 18533
12033 1 16 . 1 1 160 160 ARG N N 159 117.810 117.810 114.959 2.851 18533
12034 1 16 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.190 0.020 18533
12035 1 16 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.522 0.258 18533
12036 1 16 . 1 1 160 160 ARG CB C 159 30.530 30.530 30.006 0.524 18533
12037 1 16 . 1 1 160 160 ARG H H 159 7.650 7.650 7.806 -0.156 18533
12038 1 16 . 1 1 161 161 ASN N N 160 118.560 118.560 121.306 -2.746 18533
12039 1 16 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.649 0.091 18533
12040 1 16 . 1 1 161 161 ASN CA C 160 53.250 53.250 51.572 1.678 18533
12041 1 16 . 1 1 161 161 ASN CB C 160 39.170 39.170 37.474 1.696 18533
12042 1 16 . 1 1 161 161 ASN H H 160 8.100 8.100 8.275 -0.175 18533
12043 1 16 . 1 1 162 162 GLY N N 161 108.900 108.900 108.434 0.466 18533
12044 1 16 . 1 1 162 162 GLY CA C 161 44.730 44.730 43.358 1.372 18533
12045 1 16 . 1 1 162 162 GLY H H 161 7.980 7.980 7.715 0.265 18533
12046 1 16 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.584 -0.124 18533
12047 1 16 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.469 -0.019 18533
12048 1 16 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.186 1.014 18533
12049 1 17 . 1 1 2 2 MET N N 1 119.850 119.850 120.395 -0.545 18533
12050 1 17 . 1 1 2 2 MET HA H 1 4.500 4.500 4.287 0.213 18533
12051 1 17 . 1 1 2 2 MET CA C 1 55.450 55.450 55.128 0.322 18533
12052 1 17 . 1 1 2 2 MET CB C 1 33.170 33.170 32.357 0.813 18533
12053 1 17 . 1 1 2 2 MET H H 1 8.140 8.140 8.184 -0.044 18533
12054 1 17 . 1 1 3 3 SER N N 2 117.000 117.000 117.038 -0.038 18533
12055 1 17 . 1 1 3 3 SER HA H 2 4.430 4.430 4.602 -0.172 18533
12056 1 17 . 1 1 3 3 SER CA C 2 58.320 58.320 57.795 0.525 18533
12057 1 17 . 1 1 3 3 SER CB C 2 63.990 63.990 63.601 0.389 18533
12058 1 17 . 1 1 3 3 SER H H 2 8.340 8.340 7.894 0.446 18533
12059 1 17 . 1 1 4 4 ASP N N 3 123.200 123.200 126.036 -2.836 18533
12060 1 17 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.701 0.159 18533
12061 1 17 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.441 0.439 18533
12062 1 17 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.263 0.537 18533
12063 1 17 . 1 1 4 4 ASP H H 3 8.260 8.260 8.465 -0.205 18533
12064 1 17 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.450 -0.050 18533
12065 1 17 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.693 0.127 18533
12066 1 17 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.666 -0.756 18533
12067 1 17 . 1 1 6 6 LEU N N 5 123.160 123.160 120.794 2.366 18533
12068 1 17 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.427 -0.037 18533
12069 1 17 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.008 0.272 18533
12070 1 17 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.831 0.519 18533
12071 1 17 . 1 1 6 6 LEU H H 5 7.670 7.670 8.301 -0.631 18533
12072 1 17 . 1 1 7 7 HIS N N 6 127.160 127.160 118.351 8.809 18533
12073 1 17 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.086 0.944 18533
12074 1 17 . 1 1 7 7 HIS CA C 6 52.900 52.900 54.885 -1.985 18533
12075 1 17 . 1 1 7 7 HIS CB C 6 32.130 32.130 30.882 1.248 18533
12076 1 17 . 1 1 7 7 HIS H H 6 10.080 10.080 8.690 1.390 18533
12077 1 17 . 1 1 8 8 VAL N N 7 128.620 128.620 127.257 1.363 18533
12078 1 17 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.897 -0.397 18533
12079 1 17 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.791 0.009 18533
12080 1 17 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.391 3.409 18533
12081 1 17 . 1 1 8 8 VAL H H 7 8.930 8.930 8.443 0.487 18533
12082 1 17 . 1 1 9 9 THR N N 8 121.530 121.530 123.815 -2.285 18533
12083 1 17 . 1 1 9 9 THR HA H 8 5.270 5.270 4.598 0.672 18533
12084 1 17 . 1 1 9 9 THR CA C 8 58.520 58.520 59.381 -0.861 18533
12085 1 17 . 1 1 9 9 THR CB C 8 70.750 70.750 69.488 1.262 18533
12086 1 17 . 1 1 9 9 THR H H 8 7.970 7.970 8.967 -0.997 18533
12087 1 17 . 1 1 10 10 PHE N N 9 125.360 125.360 128.729 -3.369 18533
12088 1 17 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.009 0.201 18533
12089 1 17 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.821 0.489 18533
12090 1 17 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.131 3.699 18533
12091 1 17 . 1 1 10 10 PHE H H 9 8.180 8.180 8.214 -0.034 18533
12092 1 17 . 1 1 11 11 VAL N N 10 121.120 121.120 123.424 -2.304 18533
12093 1 17 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.195 0.165 18533
12094 1 17 . 1 1 11 11 VAL CA C 10 60.420 60.420 61.030 -0.610 18533
12095 1 17 . 1 1 11 11 VAL CB C 10 35.550 35.550 32.983 2.567 18533
12096 1 17 . 1 1 11 11 VAL H H 10 8.710 8.710 9.249 -0.539 18533
12097 1 17 . 1 1 12 12 CYS N N 11 123.270 123.270 126.920 -3.650 18533
12098 1 17 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.780 -1.520 18533
12099 1 17 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.487 1.143 18533
12100 1 17 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.484 -1.134 18533
12101 1 17 . 1 1 12 12 CYS H H 11 7.940 7.940 8.667 -0.727 18533
12102 1 17 . 1 1 13 13 THR HA H 12 5.010 5.010 3.941 1.069 18533
12103 1 17 . 1 1 13 13 THR CA C 12 64.870 64.870 65.000 -0.130 18533
12104 1 17 . 1 1 13 13 THR CB C 12 69.180 69.180 68.543 0.636 18533
12105 1 17 . 1 1 14 14 GLY CA C 13 44.960 44.960 43.517 1.443 18533
12106 1 17 . 1 1 15 15 ASN N N 14 119.960 119.960 120.860 -0.900 18533
12107 1 17 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.514 -0.584 18533
12108 1 17 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.287 0.583 18533
12109 1 17 . 1 1 15 15 ASN CB C 14 40.670 40.670 38.064 2.606 18533
12110 1 17 . 1 1 15 15 ASN H H 14 9.280 9.280 8.287 0.993 18533
12111 1 17 . 1 1 16 16 ILE N N 15 101.060 101.060 110.380 -9.320 18533
12112 1 17 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.777 -0.097 18533
12113 1 17 . 1 1 16 16 ILE CA C 15 62.790 62.790 60.978 1.812 18533
12114 1 17 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.094 3.046 18533
12115 1 17 . 1 1 16 16 ILE H H 15 7.100 7.100 7.443 -0.343 18533
12116 1 17 . 1 1 17 17 CYS N N 16 116.020 116.020 121.587 -5.567 18533
12117 1 17 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.679 0.261 18533
12118 1 17 . 1 1 17 17 CYS CA C 16 60.060 60.060 60.948 -0.888 18533
12119 1 17 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.207 0.743 18533
12120 1 17 . 1 1 17 17 CYS H H 16 7.700 7.700 8.424 -0.724 18533
12121 1 17 . 1 1 19 19 SER N N 18 122.340 122.340 115.025 7.315 18533
12122 1 17 . 1 1 19 19 SER HA H 18 3.810 3.810 4.206 -0.396 18533
12123 1 17 . 1 1 19 19 SER CA C 18 62.710 62.710 63.629 -0.919 18533
12124 1 17 . 1 1 19 19 SER CB C 18 64.860 64.860 61.306 3.554 18533
12125 1 17 . 1 1 19 19 SER H H 18 11.420 11.420 8.242 3.178 18533
12126 1 17 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.306 -0.336 18533
12127 1 17 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.950 0.080 18533
12128 1 17 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.884 -2.194 18533
12129 1 17 . 1 1 21 21 MET N N 20 112.430 112.430 119.196 -6.766 18533
12130 1 17 . 1 1 21 21 MET HA H 20 3.730 3.730 3.980 -0.250 18533
12131 1 17 . 1 1 21 21 MET CA C 20 60.160 60.160 58.191 1.969 18533
12132 1 17 . 1 1 21 21 MET CB C 20 33.040 33.040 31.393 1.647 18533
12133 1 17 . 1 1 21 21 MET H H 20 6.310 6.310 7.510 -1.200 18533
12134 1 17 . 1 1 22 22 ALA N N 21 117.800 117.800 119.562 -1.762 18533
12135 1 17 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.872 -0.472 18533
12136 1 17 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.293 0.697 18533
12137 1 17 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.598 -1.108 18533
12138 1 17 . 1 1 22 22 ALA H H 21 6.550 6.550 7.416 -0.866 18533
12139 1 17 . 1 1 23 23 GLU N N 22 115.520 115.520 118.615 -3.095 18533
12140 1 17 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.080 -0.400 18533
12141 1 17 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.700 -0.150 18533
12142 1 17 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.747 0.043 18533
12143 1 17 . 1 1 23 23 GLU H H 22 7.800 7.800 7.582 0.218 18533
12144 1 17 . 1 1 24 24 LYS N N 23 114.220 114.220 116.175 -1.955 18533
12145 1 17 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.127 -0.127 18533
12146 1 17 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.946 -0.186 18533
12147 1 17 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.358 -1.558 18533
12148 1 17 . 1 1 24 24 LYS H H 23 8.040 8.040 7.438 0.602 18533
12149 1 17 . 1 1 25 25 MET N N 24 115.250 115.250 119.602 -4.352 18533
12150 1 17 . 1 1 25 25 MET HA H 24 3.950 3.950 3.391 0.559 18533
12151 1 17 . 1 1 25 25 MET CA C 24 57.980 57.980 58.967 -0.987 18533
12152 1 17 . 1 1 25 25 MET CB C 24 35.500 35.500 32.520 2.980 18533
12153 1 17 . 1 1 25 25 MET H H 24 7.610 7.610 7.405 0.205 18533
12154 1 17 . 1 1 26 26 PHE N N 25 119.090 119.090 116.477 2.613 18533
12155 1 17 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.639 -0.299 18533
12156 1 17 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.900 0.130 18533
12157 1 17 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.537 1.923 18533
12158 1 17 . 1 1 26 26 PHE H H 25 8.560 8.560 7.730 0.830 18533
12159 1 17 . 1 1 27 27 ALA N N 26 117.830 117.830 122.269 -4.439 18533
12160 1 17 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.559 0.371 18533
12161 1 17 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.033 1.027 18533
12162 1 17 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.715 0.695 18533
12163 1 17 . 1 1 27 27 ALA H H 26 8.800 8.800 7.062 1.738 18533
12164 1 17 . 1 1 28 28 GLN N N 27 117.550 117.550 118.357 -0.807 18533
12165 1 17 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.921 0.129 18533
12166 1 17 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.805 0.805 18533
12167 1 17 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.794 0.656 18533
12168 1 17 . 1 1 28 28 GLN H H 27 7.690 7.690 7.704 -0.014 18533
12169 1 17 . 1 1 29 29 GLN N N 28 117.530 117.530 119.788 -2.258 18533
12170 1 17 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.040 0.100 18533
12171 1 17 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.734 0.446 18533
12172 1 17 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.857 -0.747 18533
12173 1 17 . 1 1 29 29 GLN H H 28 8.210 8.210 7.495 0.715 18533
12174 1 17 . 1 1 30 30 LEU N N 29 119.330 119.330 119.468 -0.138 18533
12175 1 17 . 1 1 30 30 LEU HA H 29 3.930 3.930 4.030 -0.100 18533
12176 1 17 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.912 0.168 18533
12177 1 17 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.500 0.400 18533
12178 1 17 . 1 1 30 30 LEU H H 29 8.540 8.540 8.340 0.200 18533
12179 1 17 . 1 1 31 31 ARG N N 30 120.880 120.880 118.268 2.612 18533
12180 1 17 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.087 -0.117 18533
12181 1 17 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.158 0.632 18533
12182 1 17 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.326 0.194 18533
12183 1 17 . 1 1 31 31 ARG H H 30 8.050 8.050 8.091 -0.041 18533
12184 1 17 . 1 1 32 32 HIS N N 31 119.770 119.770 118.442 1.328 18533
12185 1 17 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.431 0.119 18533
12186 1 17 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.258 -0.178 18533
12187 1 17 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.281 0.429 18533
12188 1 17 . 1 1 32 32 HIS H H 31 8.440 8.440 8.523 -0.083 18533
12189 1 17 . 1 1 33 33 ARG N N 32 115.430 115.430 117.532 -2.102 18533
12190 1 17 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.485 0.105 18533
12191 1 17 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.230 -0.260 18533
12192 1 17 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.885 -0.665 18533
12193 1 17 . 1 1 33 33 ARG H H 32 7.500 7.500 7.859 -0.359 18533
12194 1 17 . 1 1 34 34 GLY N N 33 106.730 106.730 109.082 -2.352 18533
12195 1 17 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.057 1.143 18533
12196 1 17 . 1 1 34 34 GLY H H 33 7.750 7.750 8.368 -0.618 18533
12197 1 17 . 1 1 35 35 LEU N N 34 119.980 119.980 117.540 2.440 18533
12198 1 17 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.866 -0.186 18533
12199 1 17 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.691 0.459 18533
12200 1 17 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.473 0.717 18533
12201 1 17 . 1 1 35 35 LEU H H 34 7.980 7.980 8.544 -0.564 18533
12202 1 17 . 1 1 36 36 GLY N N 35 108.660 108.660 109.223 -0.563 18533
12203 1 17 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.608 -0.507 18533
12204 1 17 . 1 1 36 36 GLY H H 35 8.830 8.830 7.905 0.925 18533
12205 1 17 . 1 1 37 37 ASP N N 36 115.360 115.360 118.309 -2.949 18533
12206 1 17 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.576 0.194 18533
12207 1 17 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.219 -0.830 18533
12208 1 17 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.843 0.327 18533
12209 1 17 . 1 1 37 37 ASP H H 36 8.300 8.300 8.441 -0.141 18533
12210 1 17 . 1 1 38 38 ALA N N 37 121.460 121.460 119.424 2.036 18533
12211 1 17 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.272 0.038 18533
12212 1 17 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.320 -0.370 18533
12213 1 17 . 1 1 38 38 ALA CB C 37 20.850 20.850 19.824 1.026 18533
12214 1 17 . 1 1 38 38 ALA H H 37 7.380 7.380 7.139 0.241 18533
12215 1 17 . 1 1 39 39 VAL N N 38 115.660 115.660 117.471 -1.811 18533
12216 1 17 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.435 0.365 18533
12217 1 17 . 1 1 39 39 VAL CA C 38 60.040 60.040 61.194 -1.154 18533
12218 1 17 . 1 1 39 39 VAL CB C 38 35.190 35.190 33.955 1.235 18533
12219 1 17 . 1 1 39 39 VAL H H 38 7.100 7.100 7.777 -0.677 18533
12220 1 17 . 1 1 40 40 ARG N N 39 129.230 129.230 127.889 1.341 18533
12221 1 17 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.564 -0.024 18533
12222 1 17 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.452 1.258 18533
12223 1 17 . 1 1 40 40 ARG CB C 39 32.320 32.320 29.165 3.155 18533
12224 1 17 . 1 1 40 40 ARG H H 39 9.730 9.730 8.475 1.255 18533
12225 1 17 . 1 1 41 41 VAL N N 40 126.240 126.240 124.928 1.312 18533
12226 1 17 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.775 0.915 18533
12227 1 17 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.247 -0.687 18533
12228 1 17 . 1 1 41 41 VAL CB C 40 33.940 33.940 32.888 1.052 18533
12229 1 17 . 1 1 41 41 VAL H H 40 8.610 8.610 8.069 0.541 18533
12230 1 17 . 1 1 42 42 THR N N 41 117.310 117.310 119.545 -2.235 18533
12231 1 17 . 1 1 42 42 THR HA H 41 4.890 4.890 4.839 0.051 18533
12232 1 17 . 1 1 42 42 THR CA C 41 60.300 60.300 59.790 0.510 18533
12233 1 17 . 1 1 42 42 THR CB C 41 73.890 73.890 71.871 2.019 18533
12234 1 17 . 1 1 42 42 THR H H 41 8.870 8.870 8.808 0.062 18533
12235 1 17 . 1 1 43 43 SER N N 42 109.960 109.960 113.051 -3.091 18533
12236 1 17 . 1 1 43 43 SER HA H 42 5.720 5.720 4.926 0.794 18533
12237 1 17 . 1 1 43 43 SER CA C 42 58.090 58.090 57.780 0.310 18533
12238 1 17 . 1 1 43 43 SER CB C 42 65.870 65.870 66.522 -0.652 18533
12239 1 17 . 1 1 43 43 SER H H 42 8.060 8.060 8.650 -0.590 18533
12240 1 17 . 1 1 44 44 ALA N N 43 119.200 119.200 119.707 -0.507 18533
12241 1 17 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.221 -0.961 18533
12242 1 17 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.602 -0.422 18533
12243 1 17 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.052 -1.222 18533
12244 1 17 . 1 1 44 44 ALA H H 43 8.710 8.710 8.993 -0.283 18533
12245 1 17 . 1 1 45 45 GLY N N 44 104.090 104.090 106.442 -2.352 18533
12246 1 17 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.248 -1.708 18533
12247 1 17 . 1 1 45 45 GLY H H 44 8.670 8.670 8.147 0.523 18533
12248 1 17 . 1 1 46 46 THR N N 45 114.060 114.060 116.126 -2.066 18533
12249 1 17 . 1 1 46 46 THR HA H 45 4.080 4.080 4.118 -0.038 18533
12250 1 17 . 1 1 46 46 THR CA C 45 64.680 64.680 64.545 0.135 18533
12251 1 17 . 1 1 46 46 THR CB C 45 67.880 67.880 68.701 -0.821 18533
12252 1 17 . 1 1 46 46 THR H H 45 9.120 9.120 8.425 0.695 18533
12253 1 17 . 1 1 47 47 GLY N N 46 110.380 110.380 108.456 1.924 18533
12254 1 17 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.886 -0.056 18533
12255 1 17 . 1 1 47 47 GLY H H 46 8.930 8.930 8.186 0.744 18533
12256 1 17 . 1 1 48 48 ASN N N 47 113.440 113.440 117.179 -3.739 18533
12257 1 17 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.321 0.169 18533
12258 1 17 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.452 -2.692 18533
12259 1 17 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.300 2.550 18533
12260 1 17 . 1 1 48 48 ASN H H 47 7.600 7.600 7.540 0.060 18533
12261 1 17 . 1 1 49 49 TRP N N 48 117.300 117.300 121.721 -4.421 18533
12262 1 17 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.276 -0.376 18533
12263 1 17 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.876 -0.016 18533
12264 1 17 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.051 -0.531 18533
12265 1 17 . 1 1 49 49 TRP H H 48 6.920 6.920 8.119 -1.199 18533
12266 1 17 . 1 1 50 50 HIS N N 49 111.590 111.590 114.368 -2.778 18533
12267 1 17 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.823 0.057 18533
12268 1 17 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.351 -1.491 18533
12269 1 17 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.486 1.554 18533
12270 1 17 . 1 1 50 50 HIS H H 49 8.620 8.620 8.636 -0.016 18533
12271 1 17 . 1 1 51 51 VAL N N 50 119.010 119.010 120.664 -1.654 18533
12272 1 17 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.700 -0.500 18533
12273 1 17 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.624 1.056 18533
12274 1 17 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.198 0.192 18533
12275 1 17 . 1 1 51 51 VAL H H 50 6.880 6.880 7.356 -0.476 18533
12276 1 17 . 1 1 52 52 GLY N N 51 115.450 115.450 116.577 -1.127 18533
12277 1 17 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.813 -0.873 18533
12278 1 17 . 1 1 52 52 GLY H H 51 9.120 9.120 9.059 0.061 18533
12279 1 17 . 1 1 53 53 SER N N 52 116.620 116.620 115.188 1.432 18533
12280 1 17 . 1 1 53 53 SER HA H 52 4.610 4.610 4.760 -0.150 18533
12281 1 17 . 1 1 53 53 SER CA C 52 59.310 59.310 57.394 1.916 18533
12282 1 17 . 1 1 53 53 SER CB C 52 64.630 64.630 64.940 -0.310 18533
12283 1 17 . 1 1 53 53 SER H H 52 8.430 8.430 8.047 0.383 18533
12284 1 17 . 1 1 54 54 CYS N N 53 118.690 118.690 118.453 0.237 18533
12285 1 17 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.286 -0.186 18533
12286 1 17 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.169 1.501 18533
12287 1 17 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.116 -2.766 18533
12288 1 17 . 1 1 54 54 CYS H H 53 8.170 8.170 8.450 -0.280 18533
12289 1 17 . 1 1 55 55 ALA N N 54 118.580 118.580 124.257 -5.677 18533
12290 1 17 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.155 -0.035 18533
12291 1 17 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.931 -0.291 18533
12292 1 17 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.240 -2.610 18533
12293 1 17 . 1 1 55 55 ALA H H 54 8.420 8.420 8.568 -0.148 18533
12294 1 17 . 1 1 56 56 ASP N N 55 121.500 121.500 124.182 -2.682 18533
12295 1 17 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.326 0.014 18533
12296 1 17 . 1 1 56 56 ASP CA C 55 55.050 55.050 55.022 0.028 18533
12297 1 17 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.694 3.366 18533
12298 1 17 . 1 1 56 56 ASP H H 55 8.470 8.470 8.572 -0.102 18533
12299 1 17 . 1 1 57 57 GLU N N 56 127.840 127.840 126.754 1.086 18533
12300 1 17 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.857 0.183 18533
12301 1 17 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.130 0.510 18533
12302 1 17 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.307 0.193 18533
12303 1 17 . 1 1 57 57 GLU H H 56 9.230 9.230 8.858 0.372 18533
12304 1 17 . 1 1 58 58 ARG N N 57 120.820 120.820 119.440 1.380 18533
12305 1 17 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.566 0.244 18533
12306 1 17 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.503 -0.353 18533
12307 1 17 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.066 -1.796 18533
12308 1 17 . 1 1 58 58 ARG H H 57 9.220 9.220 8.636 0.584 18533
12309 1 17 . 1 1 59 59 ALA N N 58 121.590 121.590 122.323 -0.733 18533
12310 1 17 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.176 -0.016 18533
12311 1 17 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.514 0.266 18533
12312 1 17 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.112 0.378 18533
12313 1 17 . 1 1 59 59 ALA H H 58 6.680 6.680 7.548 -0.868 18533
12314 1 17 . 1 1 60 60 ALA N N 59 118.970 118.970 120.996 -2.026 18533
12315 1 17 . 1 1 60 60 ALA HA H 59 3.860 3.860 4.005 -0.145 18533
12316 1 17 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.352 -0.332 18533
12317 1 17 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.280 -0.210 18533
12318 1 17 . 1 1 60 60 ALA H H 59 8.540 8.540 8.579 -0.039 18533
12319 1 17 . 1 1 61 61 GLY N N 60 104.160 104.160 107.071 -2.911 18533
12320 1 17 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.093 0.177 18533
12321 1 17 . 1 1 61 61 GLY H H 60 8.210 8.210 7.833 0.377 18533
12322 1 17 . 1 1 62 62 VAL N N 61 122.820 122.820 123.121 -0.301 18533
12323 1 17 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.621 0.229 18533
12324 1 17 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.449 -0.199 18533
12325 1 17 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.291 0.599 18533
12326 1 17 . 1 1 62 62 VAL H H 61 7.310 7.310 8.163 -0.853 18533
12327 1 17 . 1 1 63 63 LEU N N 62 120.310 120.310 118.862 1.448 18533
12328 1 17 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.176 -0.196 18533
12329 1 17 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.433 0.517 18533
12330 1 17 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.385 0.115 18533
12331 1 17 . 1 1 63 63 LEU H H 62 8.090 8.090 8.558 -0.468 18533
12332 1 17 . 1 1 64 64 ARG N N 63 119.440 119.440 119.435 0.005 18533
12333 1 17 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.264 -0.084 18533
12334 1 17 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.823 0.627 18533
12335 1 17 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.595 0.785 18533
12336 1 17 . 1 1 64 64 ARG H H 63 8.740 8.740 8.428 0.312 18533
12337 1 17 . 1 1 65 65 ALA N N 64 122.560 122.560 121.894 0.666 18533
12338 1 17 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.074 -0.044 18533
12339 1 17 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.125 0.415 18533
12340 1 17 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.233 -0.153 18533
12341 1 17 . 1 1 65 65 ALA H H 64 7.910 7.910 8.075 -0.165 18533
12342 1 17 . 1 1 66 66 HIS N N 65 112.690 112.690 114.123 -1.433 18533
12343 1 17 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.589 0.051 18533
12344 1 17 . 1 1 66 66 HIS CA C 65 55.500 55.500 55.929 -0.429 18533
12345 1 17 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.053 0.267 18533
12346 1 17 . 1 1 66 66 HIS H H 65 7.410 7.410 7.577 -0.167 18533
12347 1 17 . 1 1 67 67 GLY N N 66 107.440 107.440 106.506 0.934 18533
12348 1 17 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.301 1.059 18533
12349 1 17 . 1 1 67 67 GLY H H 66 7.850 7.850 7.488 0.362 18533
12350 1 17 . 1 1 68 68 TYR N N 67 119.940 119.940 121.286 -1.346 18533
12351 1 17 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.825 -0.025 18533
12352 1 17 . 1 1 68 68 TYR CA C 67 57.100 57.100 55.949 1.151 18533
12353 1 17 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.940 0.920 18533
12354 1 17 . 1 1 68 68 TYR H H 67 8.380 8.380 8.229 0.151 18533
12355 1 17 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.569 -0.009 18533
12356 1 17 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.897 -0.297 18533
12357 1 17 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.462 0.348 18533
12358 1 17 . 1 1 70 70 THR N N 69 100.660 100.660 106.767 -6.107 18533
12359 1 17 . 1 1 70 70 THR HA H 69 4.300 4.300 4.379 -0.079 18533
12360 1 17 . 1 1 70 70 THR CA C 69 61.250 61.250 60.845 0.405 18533
12361 1 17 . 1 1 70 70 THR CB C 69 70.740 70.740 70.226 0.514 18533
12362 1 17 . 1 1 70 70 THR H H 69 7.860 7.860 8.006 -0.146 18533
12363 1 17 . 1 1 71 71 ASP N N 70 122.880 122.880 123.090 -0.210 18533
12364 1 17 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.515 -0.105 18533
12365 1 17 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.366 0.504 18533
12366 1 17 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.323 -0.353 18533
12367 1 17 . 1 1 71 71 ASP H H 70 7.940 7.940 7.877 0.063 18533
12368 1 17 . 1 1 72 72 HIS N N 71 121.720 121.720 123.709 -1.989 18533
12369 1 17 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.790 -0.090 18533
12370 1 17 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.376 1.014 18533
12371 1 17 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.510 2.830 18533
12372 1 17 . 1 1 72 72 HIS H H 71 8.000 8.000 8.296 -0.296 18533
12373 1 17 . 1 1 73 73 ARG N N 72 125.760 125.760 126.118 -0.358 18533
12374 1 17 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.001 -0.711 18533
12375 1 17 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.115 0.315 18533
12376 1 17 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.647 0.663 18533
12377 1 17 . 1 1 73 73 ARG H H 72 7.230 7.230 8.076 -0.846 18533
12378 1 17 . 1 1 74 74 ALA N N 73 127.970 127.970 128.858 -0.888 18533
12379 1 17 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.253 0.377 18533
12380 1 17 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.815 -0.635 18533
12381 1 17 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.091 -1.191 18533
12382 1 17 . 1 1 74 74 ALA H H 73 9.090 9.090 8.262 0.828 18533
12383 1 17 . 1 1 75 75 ALA N N 74 126.090 126.090 125.481 0.609 18533
12384 1 17 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.701 0.089 18533
12385 1 17 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.748 0.223 18533
12386 1 17 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.001 1.619 18533
12387 1 17 . 1 1 75 75 ALA H H 74 9.410 9.410 8.339 1.071 18533
12388 1 17 . 1 1 76 76 GLN N N 75 123.260 123.260 121.918 1.342 18533
12389 1 17 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.551 0.399 18533
12390 1 17 . 1 1 76 76 GLN CA C 75 53.550 53.550 54.382 -0.832 18533
12391 1 17 . 1 1 76 76 GLN CB C 75 30.050 30.050 30.216 -0.167 18533
12392 1 17 . 1 1 76 76 GLN H H 75 8.800 8.800 8.464 0.336 18533
12393 1 17 . 1 1 77 77 VAL N N 76 125.510 125.510 123.887 1.623 18533
12394 1 17 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.459 -0.159 18533
12395 1 17 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.461 0.120 18533
12396 1 17 . 1 1 77 77 VAL CB C 76 32.490 32.490 29.574 2.916 18533
12397 1 17 . 1 1 77 77 VAL H H 76 8.550 8.550 8.044 0.506 18533
12398 1 17 . 1 1 78 78 GLY N N 77 121.850 121.850 116.849 5.001 18533
12399 1 17 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.035 -0.195 18533
12400 1 17 . 1 1 78 78 GLY H H 77 10.930 10.930 8.286 2.644 18533
12401 1 17 . 1 1 79 79 THR N N 78 115.210 115.210 115.644 -0.434 18533
12402 1 17 . 1 1 79 79 THR HA H 78 3.700 3.700 3.953 -0.253 18533
12403 1 17 . 1 1 79 79 THR CA C 78 66.440 66.440 67.712 -1.272 18533
12404 1 17 . 1 1 79 79 THR CB C 78 68.770 68.770 68.826 -0.056 18533
12405 1 17 . 1 1 79 79 THR H H 78 8.540 8.540 8.445 0.095 18533
12406 1 17 . 1 1 80 80 GLU N N 79 119.360 119.360 118.525 0.835 18533
12407 1 17 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.986 -0.026 18533
12408 1 17 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.770 0.260 18533
12409 1 17 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.948 0.112 18533
12410 1 17 . 1 1 80 80 GLU H H 79 9.110 9.110 8.845 0.265 18533
12411 1 17 . 1 1 81 81 HIS N N 80 118.380 118.380 116.879 1.501 18533
12412 1 17 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.273 -0.333 18533
12413 1 17 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.855 1.565 18533
12414 1 17 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.299 0.631 18533
12415 1 17 . 1 1 81 81 HIS H H 80 7.040 7.040 7.544 -0.504 18533
12416 1 17 . 1 1 82 82 LEU N N 81 114.010 114.010 119.981 -5.971 18533
12417 1 17 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.070 -0.170 18533
12418 1 17 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.903 -0.223 18533
12419 1 17 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.553 -0.823 18533
12420 1 17 . 1 1 82 82 LEU H H 81 7.850 7.850 8.273 -0.423 18533
12421 1 17 . 1 1 83 83 ALA N N 82 119.050 119.050 118.269 0.781 18533
12422 1 17 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.348 0.042 18533
12423 1 17 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.730 -0.530 18533
12424 1 17 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.633 0.547 18533
12425 1 17 . 1 1 83 83 ALA H H 82 6.950 6.950 7.334 -0.384 18533
12426 1 17 . 1 1 84 84 ALA N N 83 122.500 122.500 122.390 0.110 18533
12427 1 17 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.286 -0.526 18533
12428 1 17 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.377 1.973 18533
12429 1 17 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.354 -2.034 18533
12430 1 17 . 1 1 84 84 ALA H H 83 7.280 7.280 7.294 -0.014 18533
12431 1 17 . 1 1 85 85 ASP N N 84 118.740 118.740 120.274 -1.534 18533
12432 1 17 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.723 -0.313 18533
12433 1 17 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.388 1.252 18533
12434 1 17 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.058 0.842 18533
12435 1 17 . 1 1 85 85 ASP H H 84 8.440 8.440 8.400 0.040 18533
12436 1 17 . 1 1 86 86 LEU N N 85 115.180 115.180 118.500 -3.320 18533
12437 1 17 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.774 -0.594 18533
12438 1 17 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.815 1.225 18533
12439 1 17 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.678 0.491 18533
12440 1 17 . 1 1 86 86 LEU H H 85 7.280 7.280 8.190 -0.910 18533
12441 1 17 . 1 1 87 87 LEU N N 86 128.140 128.140 127.562 0.578 18533
12442 1 17 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.899 -0.209 18533
12443 1 17 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.775 1.605 18533
12444 1 17 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.690 -0.520 18533
12445 1 17 . 1 1 87 87 LEU H H 86 8.780 8.780 8.967 -0.187 18533
12446 1 17 . 1 1 88 88 VAL N N 87 122.630 122.630 127.050 -4.420 18533
12447 1 17 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.941 -0.311 18533
12448 1 17 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.352 -1.442 18533
12449 1 17 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.902 -0.062 18533
12450 1 17 . 1 1 88 88 VAL H H 87 9.010 9.010 9.043 -0.033 18533
12451 1 17 . 1 1 89 89 ALA N N 88 129.820 129.820 131.652 -1.832 18533
12452 1 17 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.950 -0.430 18533
12453 1 17 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.360 -0.580 18533
12454 1 17 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.330 -0.550 18533
12455 1 17 . 1 1 89 89 ALA H H 88 8.590 8.590 9.123 -0.533 18533
12456 1 17 . 1 1 90 90 LEU N N 89 129.280 129.280 119.366 9.914 18533
12457 1 17 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.688 -0.378 18533
12458 1 17 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.566 0.885 18533
12459 1 17 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.833 -3.813 18533
12460 1 17 . 1 1 90 90 LEU H H 89 8.570 8.570 8.551 0.019 18533
12461 1 17 . 1 1 91 91 ASP N N 90 126.910 126.910 117.293 9.617 18533
12462 1 17 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.661 0.139 18533
12463 1 17 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.838 0.112 18533
12464 1 17 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.442 0.368 18533
12465 1 17 . 1 1 91 91 ASP H H 90 11.450 11.450 7.532 3.918 18533
12466 1 17 . 1 1 92 92 ARG N N 91 116.950 116.950 123.259 -6.309 18533
12467 1 17 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.964 0.056 18533
12468 1 17 . 1 1 92 92 ARG CA C 91 58.830 58.830 58.789 0.041 18533
12469 1 17 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.774 0.506 18533
12470 1 17 . 1 1 92 92 ARG H H 91 8.650 8.650 8.606 0.044 18533
12471 1 17 . 1 1 93 93 ASN N N 92 120.740 120.740 118.732 2.008 18533
12472 1 17 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.555 -0.175 18533
12473 1 17 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.688 0.442 18533
12474 1 17 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.751 -0.131 18533
12475 1 17 . 1 1 93 93 ASN H H 92 8.610 8.610 8.769 -0.159 18533
12476 1 17 . 1 1 94 94 HIS N N 93 121.170 121.170 119.701 1.469 18533
12477 1 17 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.312 -0.122 18533
12478 1 17 . 1 1 94 94 HIS CA C 93 59.510 59.510 58.929 0.581 18533
12479 1 17 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.525 1.855 18533
12480 1 17 . 1 1 94 94 HIS H H 93 7.430 7.430 7.618 -0.188 18533
12481 1 17 . 1 1 95 95 ALA N N 94 118.270 118.270 121.275 -3.005 18533
12482 1 17 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.951 -0.211 18533
12483 1 17 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.516 -0.016 18533
12484 1 17 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.306 -0.337 18533
12485 1 17 . 1 1 95 95 ALA H H 94 7.190 7.190 8.589 -1.399 18533
12486 1 17 . 1 1 96 96 ARG N N 95 117.190 117.190 119.262 -2.072 18533
12487 1 17 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.044 -0.134 18533
12488 1 17 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.301 0.199 18533
12489 1 17 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.009 0.221 18533
12490 1 17 . 1 1 96 96 ARG H H 95 7.600 7.600 7.741 -0.141 18533
12491 1 17 . 1 1 97 97 LEU N N 96 120.700 120.700 119.679 1.021 18533
12492 1 17 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.963 0.117 18533
12493 1 17 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.727 0.173 18533
12494 1 17 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.691 -0.351 18533
12495 1 17 . 1 1 97 97 LEU H H 96 7.990 7.990 7.816 0.174 18533
12496 1 17 . 1 1 98 98 LEU N N 97 118.390 118.390 118.066 0.324 18533
12497 1 17 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.840 0.070 18533
12498 1 17 . 1 1 98 98 LEU CA C 97 58.100 58.100 57.937 0.163 18533
12499 1 17 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.197 0.693 18533
12500 1 17 . 1 1 98 98 LEU H H 97 8.210 8.210 8.211 -0.001 18533
12501 1 17 . 1 1 99 99 ARG N N 98 117.470 117.470 118.023 -0.553 18533
12502 1 17 . 1 1 99 99 ARG HA H 98 4.480 4.480 3.918 0.562 18533
12503 1 17 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.061 -0.701 18533
12504 1 17 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.730 -0.990 18533
12505 1 17 . 1 1 99 99 ARG H H 98 7.740 7.740 7.848 -0.108 18533
12506 1 17 . 1 1 100 100 GLN N N 99 121.400 121.400 118.067 3.333 18533
12507 1 17 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.181 -0.111 18533
12508 1 17 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.102 0.578 18533
12509 1 17 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.374 -0.054 18533
12510 1 17 . 1 1 100 100 GLN H H 99 8.030 8.030 8.068 -0.038 18533
12511 1 17 . 1 1 101 101 LEU N N 100 118.940 118.940 117.567 1.373 18533
12512 1 17 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.207 0.053 18533
12513 1 17 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.207 0.253 18533
12514 1 17 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.118 0.122 18533
12515 1 17 . 1 1 101 101 LEU H H 100 7.780 7.780 7.709 0.071 18533
12516 1 17 . 1 1 102 102 GLY N N 101 105.740 105.740 104.771 0.969 18533
12517 1 17 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.440 0.590 18533
12518 1 17 . 1 1 102 102 GLY H H 101 7.700 7.700 7.793 -0.093 18533
12519 1 17 . 1 1 103 103 VAL N N 102 122.330 122.330 120.751 1.579 18533
12520 1 17 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.132 -0.502 18533
12521 1 17 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.286 1.314 18533
12522 1 17 . 1 1 103 103 VAL CB C 102 31.490 31.490 32.868 -1.378 18533
12523 1 17 . 1 1 103 103 VAL H H 102 7.520 7.520 7.679 -0.160 18533
12524 1 17 . 1 1 104 104 GLU N N 103 128.990 128.990 114.130 14.860 18533
12525 1 17 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.433 -0.263 18533
12526 1 17 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.437 1.483 18533
12527 1 17 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.538 -3.588 18533
12528 1 17 . 1 1 104 104 GLU H H 103 9.210 9.210 7.944 1.266 18533
12529 1 17 . 1 1 105 105 ALA N N 104 124.410 124.410 122.585 1.825 18533
12530 1 17 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.236 -0.476 18533
12531 1 17 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.975 0.665 18533
12532 1 17 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.660 -0.520 18533
12533 1 17 . 1 1 105 105 ALA H H 104 8.500 8.500 8.706 -0.206 18533
12534 1 17 . 1 1 106 106 ALA N N 105 115.110 115.110 120.725 -5.615 18533
12535 1 17 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.199 -0.069 18533
12536 1 17 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.934 -0.893 18533
12537 1 17 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.602 0.459 18533
12538 1 17 . 1 1 106 106 ALA H H 105 8.270 8.270 8.455 -0.185 18533
12539 1 17 . 1 1 107 107 ARG N N 106 115.080 115.080 115.237 -0.157 18533
12540 1 17 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.765 -0.305 18533
12541 1 17 . 1 1 107 107 ARG CA C 106 56.510 56.510 57.150 -0.640 18533
12542 1 17 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.581 0.789 18533
12543 1 17 . 1 1 107 107 ARG H H 106 7.740 7.740 7.704 0.036 18533
12544 1 17 . 1 1 108 108 VAL N N 107 118.170 118.170 121.760 -3.590 18533
12545 1 17 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.284 0.786 18533
12546 1 17 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.224 -1.584 18533
12547 1 17 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.770 0.830 18533
12548 1 17 . 1 1 108 108 VAL H H 107 7.290 7.290 8.319 -1.029 18533
12549 1 17 . 1 1 109 109 ARG N N 108 124.250 124.250 128.223 -3.973 18533
12550 1 17 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.596 0.024 18533
12551 1 17 . 1 1 109 109 ARG CA C 108 51.890 51.890 53.137 -1.247 18533
12552 1 17 . 1 1 109 109 ARG CB C 108 34.980 34.980 33.735 1.245 18533
12553 1 17 . 1 1 109 109 ARG H H 108 8.420 8.420 9.307 -0.887 18533
12554 1 17 . 1 1 110 110 MET N N 109 119.570 119.570 121.712 -2.142 18533
12555 1 17 . 1 1 110 110 MET HA H 109 4.960 4.960 5.006 -0.046 18533
12556 1 17 . 1 1 110 110 MET CA C 109 53.820 53.820 54.165 -0.345 18533
12557 1 17 . 1 1 110 110 MET CB C 109 30.680 30.680 32.632 -1.952 18533
12558 1 17 . 1 1 110 110 MET H H 109 8.890 8.890 8.508 0.382 18533
12559 1 17 . 1 1 111 111 LEU N N 110 128.660 128.660 125.760 2.900 18533
12560 1 17 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.362 -0.402 18533
12561 1 17 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.939 0.661 18533
12562 1 17 . 1 1 111 111 LEU CB C 110 41.080 41.080 42.109 -1.029 18533
12563 1 17 . 1 1 111 111 LEU H H 110 9.200 9.200 8.834 0.366 18533
12564 1 17 . 1 1 112 112 ARG N N 111 111.910 111.910 116.717 -4.807 18533
12565 1 17 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.061 -0.111 18533
12566 1 17 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.852 1.068 18533
12567 1 17 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.602 -1.101 18533
12568 1 17 . 1 1 112 112 ARG H H 111 8.930 8.930 8.648 0.282 18533
12569 1 17 . 1 1 113 113 SER N N 112 114.800 114.800 114.546 0.254 18533
12570 1 17 . 1 1 113 113 SER HA H 112 4.290 4.290 4.302 -0.012 18533
12571 1 17 . 1 1 113 113 SER CA C 112 60.880 60.880 59.580 1.300 18533
12572 1 17 . 1 1 113 113 SER CB C 112 63.190 63.190 62.493 0.697 18533
12573 1 17 . 1 1 113 113 SER H H 112 7.680 7.680 7.579 0.101 18533
12574 1 17 . 1 1 114 114 PHE N N 113 119.260 119.260 118.920 0.340 18533
12575 1 17 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.410 -0.060 18533
12576 1 17 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.346 0.584 18533
12577 1 17 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.348 0.372 18533
12578 1 17 . 1 1 114 114 PHE H H 113 7.600 7.600 7.535 0.065 18533
12579 1 17 . 1 1 115 115 ASP N N 114 121.170 121.170 121.551 -0.381 18533
12580 1 17 . 1 1 115 115 ASP HA H 114 5.020 5.020 5.006 0.014 18533
12581 1 17 . 1 1 115 115 ASP CA C 114 51.100 51.100 51.931 -0.831 18533
12582 1 17 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.501 1.009 18533
12583 1 17 . 1 1 115 115 ASP H H 114 7.430 7.430 7.528 -0.098 18533
12584 1 17 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.368 0.122 18533
12585 1 17 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.127 0.223 18533
12586 1 17 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.022 0.248 18533
12587 1 17 . 1 1 117 117 ARG N N 116 117.910 117.910 115.280 2.630 18533
12588 1 17 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.458 -0.188 18533
12589 1 17 . 1 1 117 117 ARG CA C 116 56.450 56.450 54.675 1.775 18533
12590 1 17 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.230 -0.270 18533
12591 1 17 . 1 1 117 117 ARG H H 116 8.580 8.580 8.571 0.009 18533
12592 1 17 . 1 1 118 118 SER N N 117 116.130 116.130 116.148 -0.018 18533
12593 1 17 . 1 1 118 118 SER HA H 117 3.980 3.980 4.322 -0.342 18533
12594 1 17 . 1 1 118 118 SER CA C 117 59.790 59.790 58.015 1.775 18533
12595 1 17 . 1 1 118 118 SER CB C 117 63.760 63.760 61.283 2.477 18533
12596 1 17 . 1 1 118 118 SER H H 117 7.950 7.950 7.571 0.379 18533
12597 1 17 . 1 1 119 119 GLY N N 118 110.080 110.080 113.548 -3.468 18533
12598 1 17 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.868 -1.498 18533
12599 1 17 . 1 1 119 119 GLY H H 118 8.150 8.150 8.656 -0.506 18533
12600 1 17 . 1 1 120 120 THR HA H 119 4.020 4.020 4.308 -0.288 18533
12601 1 17 . 1 1 120 120 THR CA C 119 63.290 63.290 62.611 0.679 18533
12602 1 17 . 1 1 120 120 THR CB C 119 69.140 69.140 70.951 -1.812 18533
12603 1 17 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.821 -0.251 18533
12604 1 17 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.328 0.682 18533
12605 1 17 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.779 -1.789 18533
12606 1 17 . 1 1 122 122 ALA N N 121 125.880 125.880 126.989 -1.109 18533
12607 1 17 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.629 -0.289 18533
12608 1 17 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.773 -0.263 18533
12609 1 17 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.188 -1.588 18533
12610 1 17 . 1 1 122 122 ALA H H 121 7.980 7.980 8.410 -0.430 18533
12611 1 17 . 1 1 123 123 LEU N N 122 119.810 119.810 122.211 -2.401 18533
12612 1 17 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.440 -0.160 18533
12613 1 17 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.300 0.190 18533
12614 1 17 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.166 2.534 18533
12615 1 17 . 1 1 123 123 LEU H H 122 7.810 7.810 8.432 -0.622 18533
12616 1 17 . 1 1 124 124 ASP N N 123 119.050 119.050 117.692 1.358 18533
12617 1 17 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.601 -0.031 18533
12618 1 17 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.883 1.437 18533
12619 1 17 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.838 -1.168 18533
12620 1 17 . 1 1 124 124 ASP H H 123 8.270 8.270 7.590 0.680 18533
12621 1 17 . 1 1 125 125 VAL N N 124 121.970 121.970 123.762 -1.792 18533
12622 1 17 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.485 -0.225 18533
12623 1 17 . 1 1 125 125 VAL CA C 124 62.310 62.310 59.609 2.701 18533
12624 1 17 . 1 1 125 125 VAL CB C 124 30.780 30.780 35.277 -4.497 18533
12625 1 17 . 1 1 125 125 VAL H H 124 7.930 7.930 7.853 0.077 18533
12626 1 17 . 1 1 126 126 GLU N N 125 129.490 129.490 123.346 6.144 18533
12627 1 17 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.162 -0.082 18533
12628 1 17 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.575 0.435 18533
12629 1 17 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.451 -0.651 18533
12630 1 17 . 1 1 126 126 GLU H H 125 9.100 9.100 8.365 0.735 18533
12631 1 17 . 1 1 127 127 ASP N N 126 122.300 122.300 119.025 3.275 18533
12632 1 17 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.846 -0.736 18533
12633 1 17 . 1 1 127 127 ASP CA C 126 51.720 51.720 52.237 -0.517 18533
12634 1 17 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.749 -0.229 18533
12635 1 17 . 1 1 127 127 ASP H H 126 8.630 8.630 8.448 0.182 18533
12636 1 17 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.516 0.034 18533
12637 1 17 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.651 -0.051 18533
12638 1 17 . 1 1 128 128 PRO CB C 127 30.980 30.980 30.584 0.396 18533
12639 1 17 . 1 1 129 129 TYR N N 128 122.380 122.380 125.578 -3.198 18533
12640 1 17 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.187 -0.387 18533
12641 1 17 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.672 3.448 18533
12642 1 17 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.273 0.117 18533
12643 1 17 . 1 1 129 129 TYR H H 128 8.670 8.670 7.566 1.104 18533
12644 1 17 . 1 1 130 130 TYR N N 129 116.300 116.300 117.136 -0.836 18533
12645 1 17 . 1 1 130 130 TYR HA H 129 4.490 4.490 3.787 0.703 18533
12646 1 17 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.812 1.669 18533
12647 1 17 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.035 -1.375 18533
12648 1 17 . 1 1 130 130 TYR H H 129 8.680 8.680 6.761 1.919 18533
12649 1 17 . 1 1 131 131 GLY N N 130 110.870 110.870 108.365 2.505 18533
12650 1 17 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.983 -0.903 18533
12651 1 17 . 1 1 131 131 GLY H H 130 8.060 8.060 7.979 0.081 18533
12652 1 17 . 1 1 132 132 ASP N N 131 121.590 121.590 118.859 2.731 18533
12653 1 17 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.528 0.542 18533
12654 1 17 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.752 0.249 18533
12655 1 17 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.497 1.103 18533
12656 1 17 . 1 1 132 132 ASP H H 131 9.290 9.290 7.949 1.341 18533
12657 1 17 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.082 0.028 18533
12658 1 17 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.260 2.310 18533
12659 1 17 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.558 -0.078 18533
12660 1 17 . 1 1 134 134 SER N N 133 115.370 115.370 115.774 -0.404 18533
12661 1 17 . 1 1 134 134 SER HA H 133 4.180 4.180 4.019 0.161 18533
12662 1 17 . 1 1 134 134 SER CA C 133 62.070 62.070 62.470 -0.400 18533
12663 1 17 . 1 1 134 134 SER CB C 133 62.160 62.160 62.697 -0.537 18533
12664 1 17 . 1 1 134 134 SER H H 133 8.420 8.420 7.868 0.552 18533
12665 1 17 . 1 1 135 135 ASP N N 134 123.360 123.360 121.817 1.543 18533
12666 1 17 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.476 0.054 18533
12667 1 17 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.151 0.889 18533
12668 1 17 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.528 0.282 18533
12669 1 17 . 1 1 135 135 ASP H H 134 7.980 7.980 8.457 -0.477 18533
12670 1 17 . 1 1 136 136 PHE N N 135 118.940 118.940 117.644 1.296 18533
12671 1 17 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.376 -0.576 18533
12672 1 17 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.501 3.319 18533
12673 1 17 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.500 0.850 18533
12674 1 17 . 1 1 136 136 PHE H H 135 7.850 7.850 7.330 0.520 18533
12675 1 17 . 1 1 137 137 GLU N N 136 121.410 121.410 118.687 2.723 18533
12676 1 17 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.112 0.068 18533
12677 1 17 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.030 0.470 18533
12678 1 17 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.243 -0.253 18533
12679 1 17 . 1 1 137 137 GLU H H 136 8.150 8.150 8.003 0.147 18533
12680 1 17 . 1 1 138 138 GLU N N 137 121.530 121.530 121.180 0.350 18533
12681 1 17 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.135 0.155 18533
12682 1 17 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.467 -0.067 18533
12683 1 17 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.206 -0.316 18533
12684 1 17 . 1 1 138 138 GLU H H 137 7.870 7.870 8.705 -0.835 18533
12685 1 17 . 1 1 139 139 VAL N N 138 119.930 119.930 119.538 0.392 18533
12686 1 17 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.728 -0.248 18533
12687 1 17 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.490 0.590 18533
12688 1 17 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.231 0.119 18533
12689 1 17 . 1 1 139 139 VAL H H 138 7.770 7.770 7.551 0.219 18533
12690 1 17 . 1 1 140 140 PHE N N 139 119.130 119.130 121.003 -1.873 18533
12691 1 17 . 1 1 140 140 PHE HA H 139 3.560 3.560 4.092 -0.532 18533
12692 1 17 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.483 1.197 18533
12693 1 17 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.823 0.347 18533
12694 1 17 . 1 1 140 140 PHE H H 139 8.050 8.050 7.769 0.281 18533
12695 1 17 . 1 1 141 141 ALA N N 140 121.040 121.040 122.280 -1.240 18533
12696 1 17 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.103 -0.113 18533
12697 1 17 . 1 1 141 141 ALA CA C 140 55.120 55.120 55.116 0.004 18533
12698 1 17 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.357 -0.057 18533
12699 1 17 . 1 1 141 141 ALA H H 140 8.010 8.010 8.291 -0.281 18533
12700 1 17 . 1 1 142 142 VAL N N 141 118.550 118.550 118.514 0.036 18533
12701 1 17 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.611 0.199 18533
12702 1 17 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.500 -0.900 18533
12703 1 17 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.048 0.402 18533
12704 1 17 . 1 1 142 142 VAL H H 141 8.300 8.300 8.053 0.247 18533
12705 1 17 . 1 1 143 143 ILE N N 142 121.410 121.410 119.616 1.794 18533
12706 1 17 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.474 -0.084 18533
12707 1 17 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.475 0.575 18533
12708 1 17 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.778 -0.468 18533
12709 1 17 . 1 1 143 143 ILE H H 142 8.150 8.150 7.831 0.319 18533
12710 1 17 . 1 1 144 144 GLU N N 143 119.630 119.630 120.141 -0.511 18533
12711 1 17 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.762 -0.222 18533
12712 1 17 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.283 0.477 18533
12713 1 17 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.857 0.873 18533
12714 1 17 . 1 1 144 144 GLU H H 143 8.640 8.640 8.225 0.415 18533
12715 1 17 . 1 1 145 145 SER N N 144 110.920 110.920 114.756 -3.836 18533
12716 1 17 . 1 1 145 145 SER HA H 144 4.230 4.230 4.288 -0.058 18533
12717 1 17 . 1 1 145 145 SER CA C 144 60.810 60.810 60.820 -0.010 18533
12718 1 17 . 1 1 145 145 SER CB C 144 63.610 63.610 63.125 0.485 18533
12719 1 17 . 1 1 145 145 SER H H 144 7.640 7.640 7.835 -0.195 18533
12720 1 17 . 1 1 146 146 ALA N N 145 123.110 123.110 124.452 -1.342 18533
12721 1 17 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.351 -0.231 18533
12722 1 17 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.105 -0.705 18533
12723 1 17 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.234 2.646 18533
12724 1 17 . 1 1 146 146 ALA H H 145 7.500 7.500 7.675 -0.175 18533
12725 1 17 . 1 1 147 147 LEU N N 146 114.220 114.220 119.568 -5.348 18533
12726 1 17 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.828 0.112 18533
12727 1 17 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.418 -0.368 18533
12728 1 17 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.355 0.105 18533
12729 1 17 . 1 1 147 147 LEU H H 146 7.410 7.410 8.170 -0.760 18533
12730 1 17 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.335 0.115 18533
12731 1 17 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.711 3.129 18533
12732 1 17 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.004 0.216 18533
12733 1 17 . 1 1 149 149 GLY N N 148 102.590 102.590 106.560 -3.970 18533
12734 1 17 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.659 1.601 18533
12735 1 17 . 1 1 149 149 GLY H H 148 7.960 7.960 7.936 0.024 18533
12736 1 17 . 1 1 150 150 LEU N N 149 128.060 128.060 123.386 4.674 18533
12737 1 17 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.048 0.582 18533
12738 1 17 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.104 0.246 18533
12739 1 17 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.229 -0.029 18533
12740 1 17 . 1 1 150 150 LEU H H 149 7.620 7.620 8.415 -0.795 18533
12741 1 17 . 1 1 151 151 HIS N N 150 120.730 120.730 118.424 2.306 18533
12742 1 17 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.117 0.053 18533
12743 1 17 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.501 0.879 18533
12744 1 17 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.810 0.700 18533
12745 1 17 . 1 1 151 151 HIS H H 150 8.430 8.430 8.358 0.072 18533
12746 1 17 . 1 1 152 152 ASP N N 151 118.170 118.170 119.826 -1.656 18533
12747 1 17 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.400 0.020 18533
12748 1 17 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.708 0.102 18533
12749 1 17 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.568 -0.538 18533
12750 1 17 . 1 1 152 152 ASP H H 151 7.820 7.820 8.102 -0.282 18533
12751 1 17 . 1 1 153 153 TRP N N 152 122.780 122.780 121.884 0.896 18533
12752 1 17 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.573 -0.463 18533
12753 1 17 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.207 1.403 18533
12754 1 17 . 1 1 153 153 TRP CB C 152 29.790 29.790 29.978 -0.188 18533
12755 1 17 . 1 1 153 153 TRP H H 152 7.900 7.900 7.798 0.102 18533
12756 1 17 . 1 1 154 154 VAL N N 153 119.460 119.460 117.098 2.362 18533
12757 1 17 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.884 -0.534 18533
12758 1 17 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.382 0.598 18533
12759 1 17 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.399 0.501 18533
12760 1 17 . 1 1 154 154 VAL H H 153 8.560 8.560 8.422 0.138 18533
12761 1 17 . 1 1 155 155 ASP N N 154 120.500 120.500 120.836 -0.336 18533
12762 1 17 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.327 -0.127 18533
12763 1 17 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.253 -0.683 18533
12764 1 17 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.746 -0.886 18533
12765 1 17 . 1 1 155 155 ASP H H 154 8.530 8.530 8.771 -0.241 18533
12766 1 17 . 1 1 156 156 GLU N N 155 120.090 120.090 119.616 0.474 18533
12767 1 17 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.920 0.010 18533
12768 1 17 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.212 -0.052 18533
12769 1 17 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.307 -0.017 18533
12770 1 17 . 1 1 156 156 GLU H H 155 7.870 7.870 8.398 -0.528 18533
12771 1 17 . 1 1 157 157 ARG N N 156 119.230 119.230 119.134 0.096 18533
12772 1 17 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.004 -0.194 18533
12773 1 17 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.077 -0.087 18533
12774 1 17 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.294 -0.184 18533
12775 1 17 . 1 1 157 157 ARG H H 156 7.660 7.660 8.067 -0.407 18533
12776 1 17 . 1 1 158 158 LEU N N 157 118.790 118.790 116.876 1.914 18533
12777 1 17 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.306 -0.206 18533
12778 1 17 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.484 -0.804 18533
12779 1 17 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.959 0.731 18533
12780 1 17 . 1 1 158 158 LEU H H 157 8.470 8.470 8.326 0.144 18533
12781 1 17 . 1 1 159 159 ALA N N 158 120.760 120.760 122.911 -2.151 18533
12782 1 17 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.185 0.005 18533
12783 1 17 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.477 -1.198 18533
12784 1 17 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.165 -0.775 18533
12785 1 17 . 1 1 159 159 ALA H H 158 7.490 7.490 7.825 -0.335 18533
12786 1 17 . 1 1 160 160 ARG N N 159 117.810 117.810 116.479 1.331 18533
12787 1 17 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.121 0.089 18533
12788 1 17 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.112 -0.332 18533
12789 1 17 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.163 1.367 18533
12790 1 17 . 1 1 160 160 ARG H H 159 7.650 7.650 7.840 -0.190 18533
12791 1 17 . 1 1 161 161 ASN N N 160 118.560 118.560 117.729 0.831 18533
12792 1 17 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.614 0.126 18533
12793 1 17 . 1 1 161 161 ASN CA C 160 53.250 53.250 53.970 -0.720 18533
12794 1 17 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.797 0.373 18533
12795 1 17 . 1 1 161 161 ASN H H 160 8.100 8.100 7.784 0.316 18533
12796 1 17 . 1 1 162 162 GLY N N 161 108.900 108.900 108.116 0.784 18533
12797 1 17 . 1 1 162 162 GLY CA C 161 44.730 44.730 43.094 1.636 18533
12798 1 17 . 1 1 162 162 GLY H H 161 7.980 7.980 7.355 0.625 18533
12799 1 17 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.636 -0.176 18533
12800 1 17 . 1 1 163 163 PRO CA C 162 63.450 63.450 63.108 0.342 18533
12801 1 17 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.506 0.694 18533
12802 1 18 . 1 1 2 2 MET N N 1 119.850 119.850 116.583 3.267 18533
12803 1 18 . 1 1 2 2 MET HA H 1 4.500 4.500 4.918 -0.418 18533
12804 1 18 . 1 1 2 2 MET CA C 1 55.450 55.450 55.144 0.306 18533
12805 1 18 . 1 1 2 2 MET CB C 1 33.170 33.170 35.703 -2.533 18533
12806 1 18 . 1 1 2 2 MET H H 1 8.140 8.140 7.970 0.170 18533
12807 1 18 . 1 1 3 3 SER N N 2 117.000 117.000 115.829 1.171 18533
12808 1 18 . 1 1 3 3 SER HA H 2 4.430 4.430 4.441 -0.011 18533
12809 1 18 . 1 1 3 3 SER CA C 2 58.320 58.320 59.882 -1.562 18533
12810 1 18 . 1 1 3 3 SER CB C 2 63.990 63.990 63.883 0.107 18533
12811 1 18 . 1 1 3 3 SER H H 2 8.340 8.340 8.719 -0.379 18533
12812 1 18 . 1 1 4 4 ASP N N 3 123.200 123.200 118.357 4.843 18533
12813 1 18 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.991 -0.131 18533
12814 1 18 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.253 0.627 18533
12815 1 18 . 1 1 4 4 ASP CB C 3 40.800 40.800 42.248 -1.448 18533
12816 1 18 . 1 1 4 4 ASP H H 3 8.260 8.260 7.967 0.293 18533
12817 1 18 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.466 -0.066 18533
12818 1 18 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.414 0.406 18533
12819 1 18 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.691 -0.781 18533
12820 1 18 . 1 1 6 6 LEU N N 5 123.160 123.160 119.875 3.285 18533
12821 1 18 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.371 0.019 18533
12822 1 18 . 1 1 6 6 LEU CA C 5 55.280 55.280 54.962 0.319 18533
12823 1 18 . 1 1 6 6 LEU CB C 5 44.350 44.350 42.994 1.356 18533
12824 1 18 . 1 1 6 6 LEU H H 5 7.670 7.670 8.154 -0.484 18533
12825 1 18 . 1 1 7 7 HIS N N 6 127.160 127.160 118.469 8.691 18533
12826 1 18 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.215 0.815 18533
12827 1 18 . 1 1 7 7 HIS CA C 6 52.900 52.900 54.956 -2.057 18533
12828 1 18 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.274 0.856 18533
12829 1 18 . 1 1 7 7 HIS H H 6 10.080 10.080 8.747 1.333 18533
12830 1 18 . 1 1 8 8 VAL N N 7 128.620 128.620 127.668 0.952 18533
12831 1 18 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.810 -0.310 18533
12832 1 18 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.008 -0.208 18533
12833 1 18 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.232 2.568 18533
12834 1 18 . 1 1 8 8 VAL H H 7 8.930 8.930 8.473 0.457 18533
12835 1 18 . 1 1 9 9 THR N N 8 121.530 121.530 122.894 -1.364 18533
12836 1 18 . 1 1 9 9 THR HA H 8 5.270 5.270 4.597 0.673 18533
12837 1 18 . 1 1 9 9 THR CA C 8 58.520 58.520 59.214 -0.694 18533
12838 1 18 . 1 1 9 9 THR CB C 8 70.750 70.750 69.734 1.016 18533
12839 1 18 . 1 1 9 9 THR H H 8 7.970 7.970 8.837 -0.867 18533
12840 1 18 . 1 1 10 10 PHE N N 9 125.360 125.360 128.929 -3.569 18533
12841 1 18 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.045 0.165 18533
12842 1 18 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.741 0.569 18533
12843 1 18 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.357 3.473 18533
12844 1 18 . 1 1 10 10 PHE H H 9 8.180 8.180 8.112 0.068 18533
12845 1 18 . 1 1 11 11 VAL N N 10 121.120 121.120 122.224 -1.104 18533
12846 1 18 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.205 0.155 18533
12847 1 18 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.763 -0.343 18533
12848 1 18 . 1 1 11 11 VAL CB C 10 35.550 35.550 32.303 3.247 18533
12849 1 18 . 1 1 11 11 VAL H H 10 8.710 8.710 9.258 -0.548 18533
12850 1 18 . 1 1 12 12 CYS N N 11 123.270 123.270 125.867 -2.597 18533
12851 1 18 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.443 -1.183 18533
12852 1 18 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.263 1.367 18533
12853 1 18 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.835 -1.486 18533
12854 1 18 . 1 1 12 12 CYS H H 11 7.940 7.940 8.651 -0.711 18533
12855 1 18 . 1 1 13 13 THR HA H 12 5.010 5.010 4.041 0.969 18533
12856 1 18 . 1 1 13 13 THR CA C 12 64.870 64.870 63.375 1.495 18533
12857 1 18 . 1 1 13 13 THR CB C 12 69.180 69.180 66.949 2.231 18533
12858 1 18 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.530 -0.570 18533
12859 1 18 . 1 1 15 15 ASN N N 14 119.960 119.960 117.083 2.877 18533
12860 1 18 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.395 -0.465 18533
12861 1 18 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.316 0.554 18533
12862 1 18 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.548 3.122 18533
12863 1 18 . 1 1 15 15 ASN H H 14 9.280 9.280 8.785 0.495 18533
12864 1 18 . 1 1 16 16 ILE N N 15 101.060 101.060 109.561 -8.501 18533
12865 1 18 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.783 -0.103 18533
12866 1 18 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.435 1.355 18533
12867 1 18 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.320 2.820 18533
12868 1 18 . 1 1 16 16 ILE H H 15 7.100 7.100 7.841 -0.741 18533
12869 1 18 . 1 1 17 17 CYS N N 16 116.020 116.020 119.743 -3.723 18533
12870 1 18 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.703 0.237 18533
12871 1 18 . 1 1 17 17 CYS CA C 16 60.060 60.060 60.288 -0.228 18533
12872 1 18 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.751 0.199 18533
12873 1 18 . 1 1 17 17 CYS H H 16 7.700 7.700 8.076 -0.376 18533
12874 1 18 . 1 1 19 19 SER N N 18 122.340 122.340 114.825 7.515 18533
12875 1 18 . 1 1 19 19 SER HA H 18 3.810 3.810 4.234 -0.424 18533
12876 1 18 . 1 1 19 19 SER CA C 18 62.710 62.710 63.495 -0.785 18533
12877 1 18 . 1 1 19 19 SER CB C 18 64.860 64.860 61.040 3.820 18533
12878 1 18 . 1 1 19 19 SER H H 18 11.420 11.420 8.528 2.892 18533
12879 1 18 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.073 -0.103 18533
12880 1 18 . 1 1 20 20 PRO CA C 19 65.030 65.030 65.018 0.012 18533
12881 1 18 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.973 -2.283 18533
12882 1 18 . 1 1 21 21 MET N N 20 112.430 112.430 118.224 -5.794 18533
12883 1 18 . 1 1 21 21 MET HA H 20 3.730 3.730 3.899 -0.169 18533
12884 1 18 . 1 1 21 21 MET CA C 20 60.160 60.160 59.712 0.448 18533
12885 1 18 . 1 1 21 21 MET CB C 20 33.040 33.040 32.163 0.877 18533
12886 1 18 . 1 1 21 21 MET H H 20 6.310 6.310 7.516 -1.206 18533
12887 1 18 . 1 1 22 22 ALA N N 21 117.800 117.800 119.807 -2.007 18533
12888 1 18 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.807 -0.407 18533
12889 1 18 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.572 0.418 18533
12890 1 18 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.606 -1.116 18533
12891 1 18 . 1 1 22 22 ALA H H 21 6.550 6.550 7.439 -0.889 18533
12892 1 18 . 1 1 23 23 GLU N N 22 115.520 115.520 118.723 -3.203 18533
12893 1 18 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.145 -0.465 18533
12894 1 18 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.740 -0.190 18533
12895 1 18 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.795 -0.005 18533
12896 1 18 . 1 1 23 23 GLU H H 22 7.800 7.800 7.629 0.171 18533
12897 1 18 . 1 1 24 24 LYS N N 23 114.220 114.220 116.386 -2.166 18533
12898 1 18 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.170 -0.170 18533
12899 1 18 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.081 -0.321 18533
12900 1 18 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.401 -1.601 18533
12901 1 18 . 1 1 24 24 LYS H H 23 8.040 8.040 7.530 0.510 18533
12902 1 18 . 1 1 25 25 MET N N 24 115.250 115.250 119.663 -4.413 18533
12903 1 18 . 1 1 25 25 MET HA H 24 3.950 3.950 3.717 0.233 18533
12904 1 18 . 1 1 25 25 MET CA C 24 57.980 57.980 58.961 -0.981 18533
12905 1 18 . 1 1 25 25 MET CB C 24 35.500 35.500 32.400 3.100 18533
12906 1 18 . 1 1 25 25 MET H H 24 7.610 7.610 7.571 0.039 18533
12907 1 18 . 1 1 26 26 PHE N N 25 119.090 119.090 116.395 2.695 18533
12908 1 18 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.622 -0.282 18533
12909 1 18 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.097 -0.067 18533
12910 1 18 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.479 1.981 18533
12911 1 18 . 1 1 26 26 PHE H H 25 8.560 8.560 7.968 0.592 18533
12912 1 18 . 1 1 27 27 ALA N N 26 117.830 117.830 122.405 -4.575 18533
12913 1 18 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.566 0.364 18533
12914 1 18 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.008 1.052 18533
12915 1 18 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.829 0.581 18533
12916 1 18 . 1 1 27 27 ALA H H 26 8.800 8.800 7.207 1.593 18533
12917 1 18 . 1 1 28 28 GLN N N 27 117.550 117.550 118.291 -0.741 18533
12918 1 18 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.051 -0.001 18533
12919 1 18 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.841 0.769 18533
12920 1 18 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.943 0.507 18533
12921 1 18 . 1 1 28 28 GLN H H 27 7.690 7.690 7.811 -0.121 18533
12922 1 18 . 1 1 29 29 GLN N N 28 117.530 117.530 119.779 -2.249 18533
12923 1 18 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.104 0.035 18533
12924 1 18 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.823 0.357 18533
12925 1 18 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.931 -0.821 18533
12926 1 18 . 1 1 29 29 GLN H H 28 8.210 8.210 7.574 0.636 18533
12927 1 18 . 1 1 30 30 LEU N N 29 119.330 119.330 120.591 -1.261 18533
12928 1 18 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.992 -0.062 18533
12929 1 18 . 1 1 30 30 LEU CA C 29 58.080 58.080 58.246 -0.166 18533
12930 1 18 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.344 0.556 18533
12931 1 18 . 1 1 30 30 LEU H H 29 8.540 8.540 8.409 0.131 18533
12932 1 18 . 1 1 31 31 ARG N N 30 120.880 120.880 118.017 2.863 18533
12933 1 18 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.048 -0.078 18533
12934 1 18 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.067 0.723 18533
12935 1 18 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.268 0.252 18533
12936 1 18 . 1 1 31 31 ARG H H 30 8.050 8.050 8.031 0.019 18533
12937 1 18 . 1 1 32 32 HIS N N 31 119.770 119.770 118.583 1.187 18533
12938 1 18 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.450 0.100 18533
12939 1 18 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.739 -0.659 18533
12940 1 18 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.260 0.450 18533
12941 1 18 . 1 1 32 32 HIS H H 31 8.440 8.440 8.121 0.319 18533
12942 1 18 . 1 1 33 33 ARG N N 32 115.430 115.430 116.989 -1.559 18533
12943 1 18 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.479 0.111 18533
12944 1 18 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.142 -0.172 18533
12945 1 18 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.727 -0.506 18533
12946 1 18 . 1 1 33 33 ARG H H 32 7.500 7.500 7.862 -0.362 18533
12947 1 18 . 1 1 34 34 GLY N N 33 106.730 106.730 108.625 -1.895 18533
12948 1 18 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.112 1.088 18533
12949 1 18 . 1 1 34 34 GLY H H 33 7.750 7.750 8.283 -0.533 18533
12950 1 18 . 1 1 35 35 LEU N N 34 119.980 119.980 117.818 2.162 18533
12951 1 18 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.847 -0.167 18533
12952 1 18 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.704 0.446 18533
12953 1 18 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.211 0.979 18533
12954 1 18 . 1 1 35 35 LEU H H 34 7.980 7.980 8.545 -0.565 18533
12955 1 18 . 1 1 36 36 GLY N N 35 108.660 108.660 109.084 -0.424 18533
12956 1 18 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.858 -0.758 18533
12957 1 18 . 1 1 36 36 GLY H H 35 8.830 8.830 7.860 0.970 18533
12958 1 18 . 1 1 37 37 ASP N N 36 115.360 115.360 118.490 -3.130 18533
12959 1 18 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.629 0.141 18533
12960 1 18 . 1 1 37 37 ASP CA C 36 54.390 54.390 54.971 -0.581 18533
12961 1 18 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.922 0.248 18533
12962 1 18 . 1 1 37 37 ASP H H 36 8.300 8.300 8.066 0.234 18533
12963 1 18 . 1 1 38 38 ALA N N 37 121.460 121.460 119.162 2.298 18533
12964 1 18 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.216 0.094 18533
12965 1 18 . 1 1 38 38 ALA CA C 37 52.950 52.950 52.981 -0.031 18533
12966 1 18 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.285 0.565 18533
12967 1 18 . 1 1 38 38 ALA H H 37 7.380 7.380 7.654 -0.274 18533
12968 1 18 . 1 1 39 39 VAL N N 38 115.660 115.660 115.686 -0.026 18533
12969 1 18 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.524 0.276 18533
12970 1 18 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.515 -0.475 18533
12971 1 18 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.856 0.334 18533
12972 1 18 . 1 1 39 39 VAL H H 38 7.100 7.100 8.056 -0.956 18533
12973 1 18 . 1 1 40 40 ARG N N 39 129.230 129.230 129.891 -0.661 18533
12974 1 18 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.529 0.011 18533
12975 1 18 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.027 1.683 18533
12976 1 18 . 1 1 40 40 ARG CB C 39 32.320 32.320 29.162 3.158 18533
12977 1 18 . 1 1 40 40 ARG H H 39 9.730 9.730 8.596 1.134 18533
12978 1 18 . 1 1 41 41 VAL N N 40 126.240 126.240 124.808 1.432 18533
12979 1 18 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.824 0.866 18533
12980 1 18 . 1 1 41 41 VAL CA C 40 60.560 60.560 60.773 -0.213 18533
12981 1 18 . 1 1 41 41 VAL CB C 40 33.940 33.940 32.959 0.981 18533
12982 1 18 . 1 1 41 41 VAL H H 40 8.610 8.610 8.178 0.432 18533
12983 1 18 . 1 1 42 42 THR N N 41 117.310 117.310 116.881 0.429 18533
12984 1 18 . 1 1 42 42 THR HA H 41 4.890 4.890 4.835 0.055 18533
12985 1 18 . 1 1 42 42 THR CA C 41 60.300 60.300 60.402 -0.102 18533
12986 1 18 . 1 1 42 42 THR CB C 41 73.890 73.890 71.159 2.731 18533
12987 1 18 . 1 1 42 42 THR H H 41 8.870 8.870 8.632 0.238 18533
12988 1 18 . 1 1 43 43 SER N N 42 109.960 109.960 113.961 -4.001 18533
12989 1 18 . 1 1 43 43 SER HA H 42 5.720 5.720 5.196 0.524 18533
12990 1 18 . 1 1 43 43 SER CA C 42 58.090 58.090 57.696 0.394 18533
12991 1 18 . 1 1 43 43 SER CB C 42 65.870 65.870 66.697 -0.827 18533
12992 1 18 . 1 1 43 43 SER H H 42 8.060 8.060 8.543 -0.483 18533
12993 1 18 . 1 1 44 44 ALA N N 43 119.200 119.200 120.253 -1.053 18533
12994 1 18 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.047 -0.787 18533
12995 1 18 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.797 -0.617 18533
12996 1 18 . 1 1 44 44 ALA CB C 43 20.830 20.830 22.082 -1.252 18533
12997 1 18 . 1 1 44 44 ALA H H 43 8.710 8.710 9.057 -0.347 18533
12998 1 18 . 1 1 45 45 GLY N N 44 104.090 104.090 106.481 -2.391 18533
12999 1 18 . 1 1 45 45 GLY CA C 44 42.540 42.540 43.949 -1.409 18533
13000 1 18 . 1 1 45 45 GLY H H 44 8.670 8.670 8.249 0.421 18533
13001 1 18 . 1 1 46 46 THR N N 45 114.060 114.060 116.861 -2.801 18533
13002 1 18 . 1 1 46 46 THR HA H 45 4.080 4.080 4.111 -0.031 18533
13003 1 18 . 1 1 46 46 THR CA C 45 64.680 64.680 64.786 -0.106 18533
13004 1 18 . 1 1 46 46 THR CB C 45 67.880 67.880 68.544 -0.664 18533
13005 1 18 . 1 1 46 46 THR H H 45 9.120 9.120 8.431 0.689 18533
13006 1 18 . 1 1 47 47 GLY N N 46 110.380 110.380 108.445 1.935 18533
13007 1 18 . 1 1 47 47 GLY CA C 46 43.830 43.830 44.036 -0.206 18533
13008 1 18 . 1 1 47 47 GLY H H 46 8.930 8.930 8.226 0.704 18533
13009 1 18 . 1 1 48 48 ASN N N 47 113.440 113.440 117.383 -3.943 18533
13010 1 18 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.333 0.157 18533
13011 1 18 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.187 -2.427 18533
13012 1 18 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.920 1.930 18533
13013 1 18 . 1 1 48 48 ASN H H 47 7.600 7.600 7.653 -0.053 18533
13014 1 18 . 1 1 49 49 TRP N N 48 117.300 117.300 121.349 -4.049 18533
13015 1 18 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.362 -0.462 18533
13016 1 18 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.112 0.748 18533
13017 1 18 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.076 -0.555 18533
13018 1 18 . 1 1 49 49 TRP H H 48 6.920 6.920 8.631 -1.711 18533
13019 1 18 . 1 1 50 50 HIS N N 49 111.590 111.590 114.545 -2.955 18533
13020 1 18 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.819 0.061 18533
13021 1 18 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.405 -1.545 18533
13022 1 18 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.771 1.268 18533
13023 1 18 . 1 1 50 50 HIS H H 49 8.620 8.620 8.452 0.168 18533
13024 1 18 . 1 1 51 51 VAL N N 50 119.010 119.010 121.094 -2.084 18533
13025 1 18 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.781 -0.581 18533
13026 1 18 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.751 0.929 18533
13027 1 18 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.297 0.093 18533
13028 1 18 . 1 1 51 51 VAL H H 50 6.880 6.880 7.361 -0.481 18533
13029 1 18 . 1 1 52 52 GLY N N 51 115.450 115.450 116.681 -1.231 18533
13030 1 18 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.326 -0.386 18533
13031 1 18 . 1 1 52 52 GLY H H 51 9.120 9.120 9.034 0.086 18533
13032 1 18 . 1 1 53 53 SER N N 52 116.620 116.620 115.620 1.000 18533
13033 1 18 . 1 1 53 53 SER HA H 52 4.610 4.610 4.630 -0.020 18533
13034 1 18 . 1 1 53 53 SER CA C 52 59.310 59.310 57.718 1.592 18533
13035 1 18 . 1 1 53 53 SER CB C 52 64.630 64.630 65.242 -0.612 18533
13036 1 18 . 1 1 53 53 SER H H 52 8.430 8.430 7.952 0.478 18533
13037 1 18 . 1 1 54 54 CYS N N 53 118.690 118.690 117.820 0.870 18533
13038 1 18 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.435 -0.335 18533
13039 1 18 . 1 1 54 54 CYS CA C 53 57.670 57.670 55.962 1.708 18533
13040 1 18 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.469 -3.119 18533
13041 1 18 . 1 1 54 54 CYS H H 53 8.170 8.170 8.358 -0.188 18533
13042 1 18 . 1 1 55 55 ALA N N 54 118.580 118.580 123.958 -5.378 18533
13043 1 18 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.245 -0.125 18533
13044 1 18 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.956 -0.316 18533
13045 1 18 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.387 -2.757 18533
13046 1 18 . 1 1 55 55 ALA H H 54 8.420 8.420 8.593 -0.173 18533
13047 1 18 . 1 1 56 56 ASP N N 55 121.500 121.500 122.760 -1.260 18533
13048 1 18 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.497 -0.157 18533
13049 1 18 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.367 0.683 18533
13050 1 18 . 1 1 56 56 ASP CB C 55 46.060 46.060 43.126 2.934 18533
13051 1 18 . 1 1 56 56 ASP H H 55 8.470 8.470 8.524 -0.054 18533
13052 1 18 . 1 1 57 57 GLU N N 56 127.840 127.840 126.226 1.614 18533
13053 1 18 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.822 0.218 18533
13054 1 18 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.283 0.357 18533
13055 1 18 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.288 0.212 18533
13056 1 18 . 1 1 57 57 GLU H H 56 9.230 9.230 8.814 0.416 18533
13057 1 18 . 1 1 58 58 ARG N N 57 120.820 120.820 118.073 2.747 18533
13058 1 18 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.656 0.154 18533
13059 1 18 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.503 -0.353 18533
13060 1 18 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.996 -1.726 18533
13061 1 18 . 1 1 58 58 ARG H H 57 9.220 9.220 8.958 0.262 18533
13062 1 18 . 1 1 59 59 ALA N N 58 121.590 121.590 122.202 -0.612 18533
13063 1 18 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.137 0.023 18533
13064 1 18 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.407 0.373 18533
13065 1 18 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.118 0.372 18533
13066 1 18 . 1 1 59 59 ALA H H 58 6.680 6.680 7.568 -0.888 18533
13067 1 18 . 1 1 60 60 ALA N N 59 118.970 118.970 121.693 -2.723 18533
13068 1 18 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.953 -0.093 18533
13069 1 18 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.210 -0.190 18533
13070 1 18 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.370 -0.300 18533
13071 1 18 . 1 1 60 60 ALA H H 59 8.540 8.540 8.223 0.317 18533
13072 1 18 . 1 1 61 61 GLY N N 60 104.160 104.160 107.063 -2.903 18533
13073 1 18 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.096 0.173 18533
13074 1 18 . 1 1 61 61 GLY H H 60 8.210 8.210 7.981 0.229 18533
13075 1 18 . 1 1 62 62 VAL N N 61 122.820 122.820 123.056 -0.236 18533
13076 1 18 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.694 0.156 18533
13077 1 18 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.230 0.020 18533
13078 1 18 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.209 0.681 18533
13079 1 18 . 1 1 62 62 VAL H H 61 7.310 7.310 8.060 -0.750 18533
13080 1 18 . 1 1 63 63 LEU N N 62 120.310 120.310 119.035 1.275 18533
13081 1 18 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.304 -0.324 18533
13082 1 18 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.601 0.349 18533
13083 1 18 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.292 0.208 18533
13084 1 18 . 1 1 63 63 LEU H H 62 8.090 8.090 8.399 -0.309 18533
13085 1 18 . 1 1 64 64 ARG N N 63 119.440 119.440 120.070 -0.630 18533
13086 1 18 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.255 -0.075 18533
13087 1 18 . 1 1 64 64 ARG CA C 63 59.450 59.450 59.033 0.417 18533
13088 1 18 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.599 0.781 18533
13089 1 18 . 1 1 64 64 ARG H H 63 8.740 8.740 8.475 0.265 18533
13090 1 18 . 1 1 65 65 ALA N N 64 122.560 122.560 121.534 1.026 18533
13091 1 18 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.102 -0.072 18533
13092 1 18 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.120 0.420 18533
13093 1 18 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.323 -0.243 18533
13094 1 18 . 1 1 65 65 ALA H H 64 7.910 7.910 7.897 0.013 18533
13095 1 18 . 1 1 66 66 HIS N N 65 112.690 112.690 115.055 -2.365 18533
13096 1 18 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.659 -0.019 18533
13097 1 18 . 1 1 66 66 HIS CA C 65 55.500 55.500 55.919 -0.419 18533
13098 1 18 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.960 0.360 18533
13099 1 18 . 1 1 66 66 HIS H H 65 7.410 7.410 7.902 -0.492 18533
13100 1 18 . 1 1 67 67 GLY N N 66 107.440 107.440 107.296 0.144 18533
13101 1 18 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.322 1.038 18533
13102 1 18 . 1 1 67 67 GLY H H 66 7.850 7.850 7.573 0.277 18533
13103 1 18 . 1 1 68 68 TYR N N 67 119.940 119.940 120.398 -0.458 18533
13104 1 18 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.723 0.077 18533
13105 1 18 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.493 0.607 18533
13106 1 18 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.756 1.104 18533
13107 1 18 . 1 1 68 68 TYR H H 67 8.380 8.380 8.307 0.073 18533
13108 1 18 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.454 0.106 18533
13109 1 18 . 1 1 69 69 PRO CA C 68 62.600 62.600 63.206 -0.606 18533
13110 1 18 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.370 0.440 18533
13111 1 18 . 1 1 70 70 THR N N 69 100.660 100.660 107.827 -7.167 18533
13112 1 18 . 1 1 70 70 THR HA H 69 4.300 4.300 4.455 -0.155 18533
13113 1 18 . 1 1 70 70 THR CA C 69 61.250 61.250 61.280 -0.030 18533
13114 1 18 . 1 1 70 70 THR CB C 69 70.740 70.740 69.801 0.939 18533
13115 1 18 . 1 1 70 70 THR H H 69 7.860 7.860 8.088 -0.228 18533
13116 1 18 . 1 1 71 71 ASP N N 70 122.880 122.880 122.710 0.170 18533
13117 1 18 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.979 -0.569 18533
13118 1 18 . 1 1 71 71 ASP CA C 70 55.870 55.870 53.781 2.089 18533
13119 1 18 . 1 1 71 71 ASP CB C 70 40.970 40.970 42.682 -1.712 18533
13120 1 18 . 1 1 71 71 ASP H H 70 7.940 7.940 7.953 -0.013 18533
13121 1 18 . 1 1 72 72 HIS N N 71 121.720 121.720 123.039 -1.319 18533
13122 1 18 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.876 -0.176 18533
13123 1 18 . 1 1 72 72 HIS CA C 71 57.390 57.390 55.474 1.916 18533
13124 1 18 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.833 2.507 18533
13125 1 18 . 1 1 72 72 HIS H H 71 8.000 8.000 8.111 -0.111 18533
13126 1 18 . 1 1 73 73 ARG N N 72 125.760 125.760 123.443 2.317 18533
13127 1 18 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.958 -0.668 18533
13128 1 18 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.010 0.420 18533
13129 1 18 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.834 0.476 18533
13130 1 18 . 1 1 73 73 ARG H H 72 7.230 7.230 8.194 -0.964 18533
13131 1 18 . 1 1 74 74 ALA N N 73 127.970 127.970 129.593 -1.623 18533
13132 1 18 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.275 0.355 18533
13133 1 18 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.604 -0.424 18533
13134 1 18 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.189 -1.289 18533
13135 1 18 . 1 1 74 74 ALA H H 73 9.090 9.090 8.017 1.073 18533
13136 1 18 . 1 1 75 75 ALA N N 74 126.090 126.090 125.205 0.885 18533
13137 1 18 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.801 -0.011 18533
13138 1 18 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.367 0.603 18533
13139 1 18 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.678 1.942 18533
13140 1 18 . 1 1 75 75 ALA H H 74 9.410 9.410 8.162 1.248 18533
13141 1 18 . 1 1 76 76 GLN N N 75 123.260 123.260 118.911 4.349 18533
13142 1 18 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.696 0.254 18533
13143 1 18 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.865 -0.315 18533
13144 1 18 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.358 -1.308 18533
13145 1 18 . 1 1 76 76 GLN H H 75 8.800 8.800 8.368 0.432 18533
13146 1 18 . 1 1 77 77 VAL N N 76 125.510 125.510 123.434 2.076 18533
13147 1 18 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.422 -0.122 18533
13148 1 18 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.661 -0.081 18533
13149 1 18 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.820 1.669 18533
13150 1 18 . 1 1 77 77 VAL H H 76 8.550 8.550 7.957 0.593 18533
13151 1 18 . 1 1 78 78 GLY N N 77 121.850 121.850 115.989 5.861 18533
13152 1 18 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.289 -0.449 18533
13153 1 18 . 1 1 78 78 GLY H H 77 10.930 10.930 8.253 2.677 18533
13154 1 18 . 1 1 79 79 THR N N 78 115.210 115.210 116.318 -1.108 18533
13155 1 18 . 1 1 79 79 THR HA H 78 3.700 3.700 3.994 -0.294 18533
13156 1 18 . 1 1 79 79 THR CA C 78 66.440 66.440 67.253 -0.813 18533
13157 1 18 . 1 1 79 79 THR CB C 78 68.770 68.770 68.582 0.188 18533
13158 1 18 . 1 1 79 79 THR H H 78 8.540 8.540 8.441 0.099 18533
13159 1 18 . 1 1 80 80 GLU N N 79 119.360 119.360 119.401 -0.041 18533
13160 1 18 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.041 -0.081 18533
13161 1 18 . 1 1 80 80 GLU CA C 79 59.030 59.030 59.027 0.003 18533
13162 1 18 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.450 0.610 18533
13163 1 18 . 1 1 80 80 GLU H H 79 9.110 9.110 8.953 0.157 18533
13164 1 18 . 1 1 81 81 HIS N N 80 118.380 118.380 117.443 0.937 18533
13165 1 18 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.254 -0.314 18533
13166 1 18 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.995 1.425 18533
13167 1 18 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.102 0.827 18533
13168 1 18 . 1 1 81 81 HIS H H 80 7.040 7.040 7.474 -0.434 18533
13169 1 18 . 1 1 82 82 LEU N N 81 114.010 114.010 120.085 -6.075 18533
13170 1 18 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.097 -0.197 18533
13171 1 18 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.874 -0.195 18533
13172 1 18 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.486 -0.756 18533
13173 1 18 . 1 1 82 82 LEU H H 81 7.850 7.850 8.285 -0.435 18533
13174 1 18 . 1 1 83 83 ALA N N 82 119.050 119.050 117.667 1.383 18533
13175 1 18 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.285 0.105 18533
13176 1 18 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.279 -0.079 18533
13177 1 18 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.944 0.236 18533
13178 1 18 . 1 1 83 83 ALA H H 82 6.950 6.950 7.402 -0.452 18533
13179 1 18 . 1 1 84 84 ALA N N 83 122.500 122.500 122.017 0.483 18533
13180 1 18 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.323 -0.563 18533
13181 1 18 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.542 1.808 18533
13182 1 18 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.538 -2.218 18533
13183 1 18 . 1 1 84 84 ALA H H 83 7.280 7.280 7.269 0.011 18533
13184 1 18 . 1 1 85 85 ASP N N 84 118.740 118.740 120.376 -1.636 18533
13185 1 18 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.736 -0.326 18533
13186 1 18 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.359 1.281 18533
13187 1 18 . 1 1 85 85 ASP CB C 84 42.900 42.900 41.984 0.916 18533
13188 1 18 . 1 1 85 85 ASP H H 84 8.440 8.440 8.998 -0.558 18533
13189 1 18 . 1 1 86 86 LEU N N 85 115.180 115.180 119.053 -3.873 18533
13190 1 18 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.884 -0.704 18533
13191 1 18 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.965 1.075 18533
13192 1 18 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.700 0.470 18533
13193 1 18 . 1 1 86 86 LEU H H 85 7.280 7.280 8.264 -0.984 18533
13194 1 18 . 1 1 87 87 LEU N N 86 128.140 128.140 127.470 0.670 18533
13195 1 18 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.916 -0.226 18533
13196 1 18 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.775 1.605 18533
13197 1 18 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.562 -0.392 18533
13198 1 18 . 1 1 87 87 LEU H H 86 8.780 8.780 9.138 -0.358 18533
13199 1 18 . 1 1 88 88 VAL N N 87 122.630 122.630 127.156 -4.526 18533
13200 1 18 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.834 -0.204 18533
13201 1 18 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.952 -2.042 18533
13202 1 18 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.789 -0.949 18533
13203 1 18 . 1 1 88 88 VAL H H 87 9.010 9.010 9.001 0.009 18533
13204 1 18 . 1 1 89 89 ALA N N 88 129.820 129.820 131.115 -1.295 18533
13205 1 18 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.868 -0.348 18533
13206 1 18 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.395 -0.615 18533
13207 1 18 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.029 -0.249 18533
13208 1 18 . 1 1 89 89 ALA H H 88 8.590 8.590 9.254 -0.664 18533
13209 1 18 . 1 1 90 90 LEU N N 89 129.280 129.280 120.689 8.591 18533
13210 1 18 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.508 -0.198 18533
13211 1 18 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.326 0.124 18533
13212 1 18 . 1 1 90 90 LEU CB C 89 38.020 38.020 42.009 -3.989 18533
13213 1 18 . 1 1 90 90 LEU H H 89 8.570 8.570 8.601 -0.031 18533
13214 1 18 . 1 1 91 91 ASP N N 90 126.910 126.910 115.818 11.092 18533
13215 1 18 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.848 -0.048 18533
13216 1 18 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.339 -0.389 18533
13217 1 18 . 1 1 91 91 ASP CB C 90 43.810 43.810 44.012 -0.202 18533
13218 1 18 . 1 1 91 91 ASP H H 90 11.450 11.450 7.507 3.943 18533
13219 1 18 . 1 1 92 92 ARG N N 91 116.950 116.950 121.039 -4.089 18533
13220 1 18 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.945 0.075 18533
13221 1 18 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.613 -0.783 18533
13222 1 18 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.936 0.344 18533
13223 1 18 . 1 1 92 92 ARG H H 91 8.650 8.650 8.180 0.470 18533
13224 1 18 . 1 1 93 93 ASN N N 92 120.740 120.740 118.332 2.408 18533
13225 1 18 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.478 -0.098 18533
13226 1 18 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.784 0.346 18533
13227 1 18 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.433 0.187 18533
13228 1 18 . 1 1 93 93 ASN H H 92 8.610 8.610 8.522 0.088 18533
13229 1 18 . 1 1 94 94 HIS N N 93 121.170 121.170 120.293 0.877 18533
13230 1 18 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.295 -0.105 18533
13231 1 18 . 1 1 94 94 HIS CA C 93 59.510 59.510 58.773 0.737 18533
13232 1 18 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.427 1.953 18533
13233 1 18 . 1 1 94 94 HIS H H 93 7.430 7.430 7.727 -0.297 18533
13234 1 18 . 1 1 95 95 ALA N N 94 118.270 118.270 121.140 -2.870 18533
13235 1 18 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.951 -0.211 18533
13236 1 18 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.468 0.032 18533
13237 1 18 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.332 -0.362 18533
13238 1 18 . 1 1 95 95 ALA H H 94 7.190 7.190 7.952 -0.762 18533
13239 1 18 . 1 1 96 96 ARG N N 95 117.190 117.190 119.210 -2.020 18533
13240 1 18 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.044 -0.134 18533
13241 1 18 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.273 0.227 18533
13242 1 18 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.059 0.171 18533
13243 1 18 . 1 1 96 96 ARG H H 95 7.600 7.600 7.568 0.032 18533
13244 1 18 . 1 1 97 97 LEU N N 96 120.700 120.700 119.568 1.132 18533
13245 1 18 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.993 0.087 18533
13246 1 18 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.703 0.197 18533
13247 1 18 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.702 -0.362 18533
13248 1 18 . 1 1 97 97 LEU H H 96 7.990 7.990 8.032 -0.042 18533
13249 1 18 . 1 1 98 98 LEU N N 97 118.390 118.390 118.685 -0.295 18533
13250 1 18 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.843 0.067 18533
13251 1 18 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.101 -0.001 18533
13252 1 18 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.193 0.697 18533
13253 1 18 . 1 1 98 98 LEU H H 97 8.210 8.210 8.311 -0.101 18533
13254 1 18 . 1 1 99 99 ARG N N 98 117.470 117.470 118.106 -0.636 18533
13255 1 18 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.058 0.422 18533
13256 1 18 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.018 -0.658 18533
13257 1 18 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.573 -0.833 18533
13258 1 18 . 1 1 99 99 ARG H H 98 7.740 7.740 7.820 -0.080 18533
13259 1 18 . 1 1 100 100 GLN N N 99 121.400 121.400 118.792 2.608 18533
13260 1 18 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.175 -0.105 18533
13261 1 18 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.159 0.521 18533
13262 1 18 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.216 0.104 18533
13263 1 18 . 1 1 100 100 GLN H H 99 8.030 8.030 7.901 0.129 18533
13264 1 18 . 1 1 101 101 LEU N N 100 118.940 118.940 116.979 1.961 18533
13265 1 18 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.219 0.041 18533
13266 1 18 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.316 0.144 18533
13267 1 18 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.347 -0.107 18533
13268 1 18 . 1 1 101 101 LEU H H 100 7.780 7.780 7.982 -0.202 18533
13269 1 18 . 1 1 102 102 GLY N N 101 105.740 105.740 103.993 1.747 18533
13270 1 18 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.313 0.717 18533
13271 1 18 . 1 1 102 102 GLY H H 101 7.700 7.700 7.567 0.133 18533
13272 1 18 . 1 1 103 103 VAL N N 102 122.330 122.330 121.171 1.159 18533
13273 1 18 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.050 -0.420 18533
13274 1 18 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.408 1.192 18533
13275 1 18 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.189 -1.699 18533
13276 1 18 . 1 1 103 103 VAL H H 102 7.520 7.520 7.937 -0.417 18533
13277 1 18 . 1 1 104 104 GLU N N 103 128.990 128.990 114.512 14.478 18533
13278 1 18 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.439 -0.269 18533
13279 1 18 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.038 1.882 18533
13280 1 18 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.792 -3.842 18533
13281 1 18 . 1 1 104 104 GLU H H 103 9.210 9.210 8.070 1.140 18533
13282 1 18 . 1 1 105 105 ALA N N 104 124.410 124.410 123.354 1.056 18533
13283 1 18 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.157 -0.397 18533
13284 1 18 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.929 0.711 18533
13285 1 18 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.391 -0.251 18533
13286 1 18 . 1 1 105 105 ALA H H 104 8.500 8.500 8.725 -0.225 18533
13287 1 18 . 1 1 106 106 ALA N N 105 115.110 115.110 119.608 -4.498 18533
13288 1 18 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.255 -0.125 18533
13289 1 18 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.578 -0.538 18533
13290 1 18 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.403 0.657 18533
13291 1 18 . 1 1 106 106 ALA H H 105 8.270 8.270 8.250 0.020 18533
13292 1 18 . 1 1 107 107 ARG N N 106 115.080 115.080 114.359 0.721 18533
13293 1 18 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.850 -0.390 18533
13294 1 18 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.701 -0.191 18533
13295 1 18 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.834 0.536 18533
13296 1 18 . 1 1 107 107 ARG H H 106 7.740 7.740 7.748 -0.008 18533
13297 1 18 . 1 1 108 108 VAL N N 107 118.170 118.170 121.616 -3.446 18533
13298 1 18 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.080 0.990 18533
13299 1 18 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.408 -1.768 18533
13300 1 18 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.670 0.930 18533
13301 1 18 . 1 1 108 108 VAL H H 107 7.290 7.290 8.227 -0.937 18533
13302 1 18 . 1 1 109 109 ARG N N 108 124.250 124.250 127.708 -3.458 18533
13303 1 18 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.607 0.013 18533
13304 1 18 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.907 -1.017 18533
13305 1 18 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.141 0.839 18533
13306 1 18 . 1 1 109 109 ARG H H 108 8.420 8.420 9.194 -0.774 18533
13307 1 18 . 1 1 110 110 MET N N 109 119.570 119.570 121.434 -1.864 18533
13308 1 18 . 1 1 110 110 MET HA H 109 4.960 4.960 4.975 -0.015 18533
13309 1 18 . 1 1 110 110 MET CA C 109 53.820 53.820 54.269 -0.449 18533
13310 1 18 . 1 1 110 110 MET CB C 109 30.680 30.680 32.378 -1.698 18533
13311 1 18 . 1 1 110 110 MET H H 109 8.890 8.890 8.551 0.339 18533
13312 1 18 . 1 1 111 111 LEU N N 110 128.660 128.660 126.674 1.986 18533
13313 1 18 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.295 -0.335 18533
13314 1 18 . 1 1 111 111 LEU CA C 110 59.600 59.600 58.837 0.763 18533
13315 1 18 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.968 -0.888 18533
13316 1 18 . 1 1 111 111 LEU H H 110 9.200 9.200 8.945 0.255 18533
13317 1 18 . 1 1 112 112 ARG N N 111 111.910 111.910 116.247 -4.337 18533
13318 1 18 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.075 -0.125 18533
13319 1 18 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.642 1.278 18533
13320 1 18 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.639 -1.139 18533
13321 1 18 . 1 1 112 112 ARG H H 111 8.930 8.930 8.653 0.277 18533
13322 1 18 . 1 1 113 113 SER N N 112 114.800 114.800 115.622 -0.822 18533
13323 1 18 . 1 1 113 113 SER HA H 112 4.290 4.290 4.278 0.012 18533
13324 1 18 . 1 1 113 113 SER CA C 112 60.880 60.880 59.889 0.991 18533
13325 1 18 . 1 1 113 113 SER CB C 112 63.190 63.190 62.560 0.630 18533
13326 1 18 . 1 1 113 113 SER H H 112 7.680 7.680 7.651 0.029 18533
13327 1 18 . 1 1 114 114 PHE N N 113 119.260 119.260 118.444 0.816 18533
13328 1 18 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.480 -0.130 18533
13329 1 18 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.262 0.668 18533
13330 1 18 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.733 -0.013 18533
13331 1 18 . 1 1 114 114 PHE H H 113 7.600 7.600 7.567 0.033 18533
13332 1 18 . 1 1 115 115 ASP N N 114 121.170 121.170 121.504 -0.334 18533
13333 1 18 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.904 0.116 18533
13334 1 18 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.592 -1.492 18533
13335 1 18 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.604 0.906 18533
13336 1 18 . 1 1 115 115 ASP H H 114 7.430 7.430 7.530 -0.100 18533
13337 1 18 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.376 0.114 18533
13338 1 18 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.249 0.101 18533
13339 1 18 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.178 0.092 18533
13340 1 18 . 1 1 117 117 ARG N N 116 117.910 117.910 117.202 0.708 18533
13341 1 18 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.373 -0.103 18533
13342 1 18 . 1 1 117 117 ARG CA C 116 56.450 56.450 56.164 0.286 18533
13343 1 18 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.416 -0.456 18533
13344 1 18 . 1 1 117 117 ARG H H 116 8.580 8.580 7.895 0.685 18533
13345 1 18 . 1 1 118 118 SER N N 117 116.130 116.130 116.711 -0.581 18533
13346 1 18 . 1 1 118 118 SER HA H 117 3.980 3.980 4.354 -0.374 18533
13347 1 18 . 1 1 118 118 SER CA C 117 59.790 59.790 59.198 0.592 18533
13348 1 18 . 1 1 118 118 SER CB C 117 63.760 63.760 62.138 1.622 18533
13349 1 18 . 1 1 118 118 SER H H 117 7.950 7.950 7.411 0.539 18533
13350 1 18 . 1 1 119 119 GLY N N 118 110.080 110.080 115.716 -5.636 18533
13351 1 18 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.558 -1.188 18533
13352 1 18 . 1 1 119 119 GLY H H 118 8.150 8.150 8.154 -0.004 18533
13353 1 18 . 1 1 120 120 THR HA H 119 4.020 4.020 4.268 -0.248 18533
13354 1 18 . 1 1 120 120 THR CA C 119 63.290 63.290 61.405 1.885 18533
13355 1 18 . 1 1 120 120 THR CB C 119 69.140 69.140 70.015 -0.875 18533
13356 1 18 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.465 0.105 18533
13357 1 18 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.830 0.180 18533
13358 1 18 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.195 0.795 18533
13359 1 18 . 1 1 122 122 ALA N N 121 125.880 125.880 128.932 -3.052 18533
13360 1 18 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.429 -0.089 18533
13361 1 18 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.313 0.197 18533
13362 1 18 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.873 -0.273 18533
13363 1 18 . 1 1 122 122 ALA H H 121 7.980 7.980 8.641 -0.661 18533
13364 1 18 . 1 1 123 123 LEU N N 122 119.810 119.810 121.682 -1.872 18533
13365 1 18 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.469 -0.189 18533
13366 1 18 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.259 0.231 18533
13367 1 18 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.346 2.353 18533
13368 1 18 . 1 1 123 123 LEU H H 122 7.810 7.810 8.196 -0.386 18533
13369 1 18 . 1 1 124 124 ASP N N 123 119.050 119.050 116.532 2.518 18533
13370 1 18 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.564 0.006 18533
13371 1 18 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.783 1.537 18533
13372 1 18 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.662 -0.992 18533
13373 1 18 . 1 1 124 124 ASP H H 123 8.270 8.270 7.485 0.785 18533
13374 1 18 . 1 1 125 125 VAL N N 124 121.970 121.970 122.142 -0.172 18533
13375 1 18 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.394 -0.134 18533
13376 1 18 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.062 2.248 18533
13377 1 18 . 1 1 125 125 VAL CB C 124 30.780 30.780 34.608 -3.828 18533
13378 1 18 . 1 1 125 125 VAL H H 124 7.930 7.930 7.983 -0.053 18533
13379 1 18 . 1 1 126 126 GLU N N 125 129.490 129.490 123.412 6.078 18533
13380 1 18 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.197 -0.117 18533
13381 1 18 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.197 0.813 18533
13382 1 18 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.768 -0.968 18533
13383 1 18 . 1 1 126 126 GLU H H 125 9.100 9.100 8.356 0.744 18533
13384 1 18 . 1 1 127 127 ASP N N 126 122.300 122.300 119.800 2.500 18533
13385 1 18 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.773 -0.663 18533
13386 1 18 . 1 1 127 127 ASP CA C 126 51.720 51.720 52.024 -0.304 18533
13387 1 18 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.986 -0.466 18533
13388 1 18 . 1 1 127 127 ASP H H 126 8.630 8.630 8.399 0.231 18533
13389 1 18 . 1 1 128 128 PRO HA H 127 4.550 4.550 3.228 1.322 18533
13390 1 18 . 1 1 128 128 PRO CA C 127 62.600 62.600 62.553 0.047 18533
13391 1 18 . 1 1 128 128 PRO CB C 127 30.980 30.980 29.832 1.148 18533
13392 1 18 . 1 1 129 129 TYR N N 128 122.380 122.380 121.789 0.591 18533
13393 1 18 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.556 -0.756 18533
13394 1 18 . 1 1 129 129 TYR CA C 128 63.120 63.120 55.496 7.624 18533
13395 1 18 . 1 1 129 129 TYR CB C 128 39.390 39.390 36.147 3.243 18533
13396 1 18 . 1 1 129 129 TYR H H 128 8.670 8.670 7.093 1.577 18533
13397 1 18 . 1 1 130 130 TYR N N 129 116.300 116.300 118.435 -2.135 18533
13398 1 18 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.875 -0.385 18533
13399 1 18 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.845 1.635 18533
13400 1 18 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.732 -2.072 18533
13401 1 18 . 1 1 130 130 TYR H H 129 8.680 8.680 7.028 1.652 18533
13402 1 18 . 1 1 131 131 GLY N N 130 110.870 110.870 109.694 1.176 18533
13403 1 18 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.378 -1.298 18533
13404 1 18 . 1 1 131 131 GLY H H 130 8.060 8.060 8.009 0.051 18533
13405 1 18 . 1 1 132 132 ASP N N 131 121.590 121.590 119.125 2.465 18533
13406 1 18 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.692 0.378 18533
13407 1 18 . 1 1 132 132 ASP CA C 131 52.000 52.000 52.268 -0.268 18533
13408 1 18 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.587 1.013 18533
13409 1 18 . 1 1 132 132 ASP H H 131 9.290 9.290 7.835 1.455 18533
13410 1 18 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.720 0.390 18533
13411 1 18 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.456 2.114 18533
13412 1 18 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.203 0.277 18533
13413 1 18 . 1 1 134 134 SER N N 133 115.370 115.370 112.972 2.398 18533
13414 1 18 . 1 1 134 134 SER HA H 133 4.180 4.180 3.947 0.233 18533
13415 1 18 . 1 1 134 134 SER CA C 133 62.070 62.070 60.856 1.214 18533
13416 1 18 . 1 1 134 134 SER CB C 133 62.160 62.160 62.659 -0.499 18533
13417 1 18 . 1 1 134 134 SER H H 133 8.420 8.420 8.393 0.027 18533
13418 1 18 . 1 1 135 135 ASP N N 134 123.360 123.360 123.062 0.298 18533
13419 1 18 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.371 0.159 18533
13420 1 18 . 1 1 135 135 ASP CA C 134 58.040 58.040 56.751 1.289 18533
13421 1 18 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.351 0.459 18533
13422 1 18 . 1 1 135 135 ASP H H 134 7.980 7.980 7.545 0.435 18533
13423 1 18 . 1 1 136 136 PHE N N 135 118.940 118.940 118.180 0.760 18533
13424 1 18 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.299 -0.499 18533
13425 1 18 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.139 3.681 18533
13426 1 18 . 1 1 136 136 PHE CB C 135 39.350 39.350 37.863 1.487 18533
13427 1 18 . 1 1 136 136 PHE H H 135 7.850 7.850 6.953 0.897 18533
13428 1 18 . 1 1 137 137 GLU N N 136 121.410 121.410 118.856 2.554 18533
13429 1 18 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.044 0.136 18533
13430 1 18 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.123 0.377 18533
13431 1 18 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.017 -0.027 18533
13432 1 18 . 1 1 137 137 GLU H H 136 8.150 8.150 7.871 0.279 18533
13433 1 18 . 1 1 138 138 GLU N N 137 121.530 121.530 121.464 0.066 18533
13434 1 18 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.065 0.225 18533
13435 1 18 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.848 -0.448 18533
13436 1 18 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.457 -0.567 18533
13437 1 18 . 1 1 138 138 GLU H H 137 7.870 7.870 8.260 -0.390 18533
13438 1 18 . 1 1 139 139 VAL N N 138 119.930 119.930 119.355 0.575 18533
13439 1 18 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.652 -0.172 18533
13440 1 18 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.940 0.140 18533
13441 1 18 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.464 -0.114 18533
13442 1 18 . 1 1 139 139 VAL H H 138 7.770 7.770 7.640 0.130 18533
13443 1 18 . 1 1 140 140 PHE N N 139 119.130 119.130 121.135 -2.005 18533
13444 1 18 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.924 -0.364 18533
13445 1 18 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.730 0.950 18533
13446 1 18 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.755 0.415 18533
13447 1 18 . 1 1 140 140 PHE H H 139 8.050 8.050 8.211 -0.161 18533
13448 1 18 . 1 1 141 141 ALA N N 140 121.040 121.040 122.435 -1.395 18533
13449 1 18 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.140 -0.150 18533
13450 1 18 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.690 0.430 18533
13451 1 18 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.346 -0.046 18533
13452 1 18 . 1 1 141 141 ALA H H 140 8.010 8.010 8.320 -0.310 18533
13453 1 18 . 1 1 142 142 VAL N N 141 118.550 118.550 118.915 -0.365 18533
13454 1 18 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.620 0.190 18533
13455 1 18 . 1 1 142 142 VAL CA C 141 65.600 65.600 65.858 -0.258 18533
13456 1 18 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.422 0.028 18533
13457 1 18 . 1 1 142 142 VAL H H 141 8.300 8.300 8.181 0.119 18533
13458 1 18 . 1 1 143 143 ILE N N 142 121.410 121.410 119.566 1.844 18533
13459 1 18 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.457 -0.067 18533
13460 1 18 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.420 0.630 18533
13461 1 18 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.878 -0.568 18533
13462 1 18 . 1 1 143 143 ILE H H 142 8.150 8.150 8.091 0.059 18533
13463 1 18 . 1 1 144 144 GLU N N 143 119.630 119.630 118.833 0.797 18533
13464 1 18 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.705 -0.165 18533
13465 1 18 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.054 0.706 18533
13466 1 18 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.882 0.848 18533
13467 1 18 . 1 1 144 144 GLU H H 143 8.640 8.640 8.053 0.587 18533
13468 1 18 . 1 1 145 145 SER N N 144 110.920 110.920 114.021 -3.101 18533
13469 1 18 . 1 1 145 145 SER HA H 144 4.230 4.230 4.208 0.022 18533
13470 1 18 . 1 1 145 145 SER CA C 144 60.810 60.810 60.616 0.194 18533
13471 1 18 . 1 1 145 145 SER CB C 144 63.610 63.610 63.506 0.104 18533
13472 1 18 . 1 1 145 145 SER H H 144 7.640 7.640 8.008 -0.368 18533
13473 1 18 . 1 1 146 146 ALA N N 145 123.110 123.110 124.311 -1.201 18533
13474 1 18 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.267 -0.147 18533
13475 1 18 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.079 -0.679 18533
13476 1 18 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.392 2.489 18533
13477 1 18 . 1 1 146 146 ALA H H 145 7.500 7.500 7.686 -0.186 18533
13478 1 18 . 1 1 147 147 LEU N N 146 114.220 114.220 119.613 -5.393 18533
13479 1 18 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.844 0.096 18533
13480 1 18 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.462 -0.411 18533
13481 1 18 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.402 0.058 18533
13482 1 18 . 1 1 147 147 LEU H H 146 7.410 7.410 8.117 -0.707 18533
13483 1 18 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.315 0.135 18533
13484 1 18 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.315 3.525 18533
13485 1 18 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.009 0.210 18533
13486 1 18 . 1 1 149 149 GLY N N 148 102.590 102.590 106.240 -3.650 18533
13487 1 18 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.402 1.858 18533
13488 1 18 . 1 1 149 149 GLY H H 148 7.960 7.960 7.920 0.040 18533
13489 1 18 . 1 1 150 150 LEU N N 149 128.060 128.060 123.646 4.414 18533
13490 1 18 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.226 0.404 18533
13491 1 18 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.327 0.023 18533
13492 1 18 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.326 -0.126 18533
13493 1 18 . 1 1 150 150 LEU H H 149 7.620 7.620 8.316 -0.696 18533
13494 1 18 . 1 1 151 151 HIS N N 150 120.730 120.730 117.866 2.864 18533
13495 1 18 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.165 0.005 18533
13496 1 18 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.264 1.116 18533
13497 1 18 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.730 0.780 18533
13498 1 18 . 1 1 151 151 HIS H H 150 8.430 8.430 8.449 -0.019 18533
13499 1 18 . 1 1 152 152 ASP N N 151 118.170 118.170 119.674 -1.504 18533
13500 1 18 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.423 -0.003 18533
13501 1 18 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.925 -0.115 18533
13502 1 18 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.638 -0.608 18533
13503 1 18 . 1 1 152 152 ASP H H 151 7.820 7.820 8.291 -0.471 18533
13504 1 18 . 1 1 153 153 TRP N N 152 122.780 122.780 122.204 0.576 18533
13505 1 18 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.698 -0.588 18533
13506 1 18 . 1 1 153 153 TRP CA C 152 62.610 62.610 60.762 1.848 18533
13507 1 18 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.153 -0.363 18533
13508 1 18 . 1 1 153 153 TRP H H 152 7.900 7.900 7.899 0.001 18533
13509 1 18 . 1 1 154 154 VAL N N 153 119.460 119.460 116.908 2.552 18533
13510 1 18 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.932 -0.582 18533
13511 1 18 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.224 0.756 18533
13512 1 18 . 1 1 154 154 VAL CB C 153 31.900 31.900 30.886 1.014 18533
13513 1 18 . 1 1 154 154 VAL H H 153 8.560 8.560 8.346 0.214 18533
13514 1 18 . 1 1 155 155 ASP N N 154 120.500 120.500 121.351 -0.851 18533
13515 1 18 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.342 -0.142 18533
13516 1 18 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.375 -0.805 18533
13517 1 18 . 1 1 155 155 ASP CB C 154 39.860 39.860 41.112 -1.252 18533
13518 1 18 . 1 1 155 155 ASP H H 154 8.530 8.530 8.340 0.190 18533
13519 1 18 . 1 1 156 156 GLU N N 155 120.090 120.090 119.330 0.760 18533
13520 1 18 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.954 -0.024 18533
13521 1 18 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.286 -0.126 18533
13522 1 18 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.349 -0.059 18533
13523 1 18 . 1 1 156 156 GLU H H 155 7.870 7.870 8.472 -0.602 18533
13524 1 18 . 1 1 157 157 ARG N N 156 119.230 119.230 119.217 0.013 18533
13525 1 18 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.001 -0.191 18533
13526 1 18 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.338 -0.348 18533
13527 1 18 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.324 -0.214 18533
13528 1 18 . 1 1 157 157 ARG H H 156 7.660 7.660 7.927 -0.267 18533
13529 1 18 . 1 1 158 158 LEU N N 157 118.790 118.790 117.166 1.624 18533
13530 1 18 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.179 -0.079 18533
13531 1 18 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.696 -1.016 18533
13532 1 18 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.747 0.943 18533
13533 1 18 . 1 1 158 158 LEU H H 157 8.470 8.470 8.321 0.149 18533
13534 1 18 . 1 1 159 159 ALA N N 158 120.760 120.760 122.724 -1.964 18533
13535 1 18 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.143 0.047 18533
13536 1 18 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.804 -1.524 18533
13537 1 18 . 1 1 159 159 ALA CB C 158 18.390 18.390 18.719 -0.329 18533
13538 1 18 . 1 1 159 159 ALA H H 158 7.490 7.490 7.896 -0.406 18533
13539 1 18 . 1 1 160 160 ARG N N 159 117.810 117.810 116.759 1.051 18533
13540 1 18 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.167 0.043 18533
13541 1 18 . 1 1 160 160 ARG CA C 159 56.780 56.780 56.922 -0.143 18533
13542 1 18 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.709 0.821 18533
13543 1 18 . 1 1 160 160 ARG H H 159 7.650 7.650 8.123 -0.473 18533
13544 1 18 . 1 1 161 161 ASN N N 160 118.560 118.560 118.245 0.315 18533
13545 1 18 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.511 0.229 18533
13546 1 18 . 1 1 161 161 ASN CA C 160 53.250 53.250 54.788 -1.538 18533
13547 1 18 . 1 1 161 161 ASN CB C 160 39.170 39.170 39.050 0.120 18533
13548 1 18 . 1 1 161 161 ASN H H 160 8.100 8.100 7.936 0.164 18533
13549 1 18 . 1 1 162 162 GLY N N 161 108.900 108.900 107.102 1.798 18533
13550 1 18 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.877 -0.147 18533
13551 1 18 . 1 1 162 162 GLY H H 161 7.980 7.980 7.738 0.242 18533
13552 1 18 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.594 -0.134 18533
13553 1 18 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.516 0.934 18533
13554 1 18 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.520 0.680 18533
13555 1 19 . 1 1 2 2 MET N N 1 119.850 119.850 119.187 0.663 18533
13556 1 19 . 1 1 2 2 MET HA H 1 4.500 4.500 4.769 -0.269 18533
13557 1 19 . 1 1 2 2 MET CA C 1 55.450 55.450 54.989 0.461 18533
13558 1 19 . 1 1 2 2 MET CB C 1 33.170 33.170 34.883 -1.713 18533
13559 1 19 . 1 1 2 2 MET H H 1 8.140 8.140 8.348 -0.208 18533
13560 1 19 . 1 1 3 3 SER N N 2 117.000 117.000 114.062 2.938 18533
13561 1 19 . 1 1 3 3 SER HA H 2 4.430 4.430 4.713 -0.283 18533
13562 1 19 . 1 1 3 3 SER CA C 2 58.320 58.320 56.939 1.381 18533
13563 1 19 . 1 1 3 3 SER CB C 2 63.990 63.990 64.393 -0.403 18533
13564 1 19 . 1 1 3 3 SER H H 2 8.340 8.340 8.138 0.202 18533
13565 1 19 . 1 1 4 4 ASP N N 3 123.200 123.200 122.968 0.232 18533
13566 1 19 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.805 0.055 18533
13567 1 19 . 1 1 4 4 ASP CA C 3 52.880 52.880 53.105 -0.225 18533
13568 1 19 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.537 0.263 18533
13569 1 19 . 1 1 4 4 ASP H H 3 8.260 8.260 8.342 -0.082 18533
13570 1 19 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.516 -0.116 18533
13571 1 19 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.498 0.322 18533
13572 1 19 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.711 -0.801 18533
13573 1 19 . 1 1 6 6 LEU N N 5 123.160 123.160 119.720 3.440 18533
13574 1 19 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.399 -0.009 18533
13575 1 19 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.049 0.231 18533
13576 1 19 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.644 0.706 18533
13577 1 19 . 1 1 6 6 LEU H H 5 7.670 7.670 7.946 -0.276 18533
13578 1 19 . 1 1 7 7 HIS N N 6 127.160 127.160 117.783 9.377 18533
13579 1 19 . 1 1 7 7 HIS HA H 6 6.030 6.030 4.966 1.064 18533
13580 1 19 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.269 -2.369 18533
13581 1 19 . 1 1 7 7 HIS CB C 6 32.130 32.130 30.874 1.256 18533
13582 1 19 . 1 1 7 7 HIS H H 6 10.080 10.080 8.594 1.486 18533
13583 1 19 . 1 1 8 8 VAL N N 7 128.620 128.620 126.993 1.627 18533
13584 1 19 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.983 -0.483 18533
13585 1 19 . 1 1 8 8 VAL CA C 7 60.800 60.800 60.881 -0.081 18533
13586 1 19 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.586 3.214 18533
13587 1 19 . 1 1 8 8 VAL H H 7 8.930 8.930 9.132 -0.202 18533
13588 1 19 . 1 1 9 9 THR N N 8 121.530 121.530 123.499 -1.969 18533
13589 1 19 . 1 1 9 9 THR HA H 8 5.270 5.270 4.682 0.588 18533
13590 1 19 . 1 1 9 9 THR CA C 8 58.520 58.520 59.470 -0.950 18533
13591 1 19 . 1 1 9 9 THR CB C 8 70.750 70.750 69.742 1.008 18533
13592 1 19 . 1 1 9 9 THR H H 8 7.970 7.970 8.920 -0.950 18533
13593 1 19 . 1 1 10 10 PHE N N 9 125.360 125.360 127.719 -2.359 18533
13594 1 19 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.014 0.196 18533
13595 1 19 . 1 1 10 10 PHE CA C 9 56.310 56.310 56.100 0.210 18533
13596 1 19 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.641 3.189 18533
13597 1 19 . 1 1 10 10 PHE H H 9 8.180 8.180 8.107 0.073 18533
13598 1 19 . 1 1 11 11 VAL N N 10 121.120 121.120 121.570 -0.450 18533
13599 1 19 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.274 0.086 18533
13600 1 19 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.684 -0.264 18533
13601 1 19 . 1 1 11 11 VAL CB C 10 35.550 35.550 32.794 2.756 18533
13602 1 19 . 1 1 11 11 VAL H H 10 8.710 8.710 9.218 -0.508 18533
13603 1 19 . 1 1 12 12 CYS N N 11 123.270 123.270 124.606 -1.336 18533
13604 1 19 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.194 -0.934 18533
13605 1 19 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.295 1.335 18533
13606 1 19 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.170 -0.820 18533
13607 1 19 . 1 1 12 12 CYS H H 11 7.940 7.940 8.529 -0.589 18533
13608 1 19 . 1 1 13 13 THR HA H 12 5.010 5.010 4.047 0.963 18533
13609 1 19 . 1 1 13 13 THR CA C 12 64.870 64.870 63.251 1.619 18533
13610 1 19 . 1 1 13 13 THR CB C 12 69.180 69.180 66.295 2.885 18533
13611 1 19 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.047 -0.087 18533
13612 1 19 . 1 1 15 15 ASN N N 14 119.960 119.960 116.485 3.475 18533
13613 1 19 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.356 -0.426 18533
13614 1 19 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.313 0.557 18533
13615 1 19 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.906 2.764 18533
13616 1 19 . 1 1 15 15 ASN H H 14 9.280 9.280 8.685 0.595 18533
13617 1 19 . 1 1 16 16 ILE N N 15 101.060 101.060 109.746 -8.686 18533
13618 1 19 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.576 0.104 18533
13619 1 19 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.858 0.932 18533
13620 1 19 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.446 3.694 18533
13621 1 19 . 1 1 16 16 ILE H H 15 7.100 7.100 7.981 -0.881 18533
13622 1 19 . 1 1 17 17 CYS N N 16 116.020 116.020 118.082 -2.062 18533
13623 1 19 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.570 0.370 18533
13624 1 19 . 1 1 17 17 CYS CA C 16 60.060 60.060 58.837 1.222 18533
13625 1 19 . 1 1 17 17 CYS CB C 16 28.950 28.950 29.067 -0.117 18533
13626 1 19 . 1 1 17 17 CYS H H 16 7.700 7.700 7.862 -0.162 18533
13627 1 19 . 1 1 19 19 SER N N 18 122.340 122.340 114.819 7.521 18533
13628 1 19 . 1 1 19 19 SER HA H 18 3.810 3.810 4.146 -0.336 18533
13629 1 19 . 1 1 19 19 SER CA C 18 62.710 62.710 63.186 -0.476 18533
13630 1 19 . 1 1 19 19 SER CB C 18 64.860 64.860 61.250 3.610 18533
13631 1 19 . 1 1 19 19 SER H H 18 11.420 11.420 8.549 2.871 18533
13632 1 19 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.194 -0.224 18533
13633 1 19 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.820 0.210 18533
13634 1 19 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.834 -2.144 18533
13635 1 19 . 1 1 21 21 MET N N 20 112.430 112.430 118.304 -5.874 18533
13636 1 19 . 1 1 21 21 MET HA H 20 3.730 3.730 3.994 -0.264 18533
13637 1 19 . 1 1 21 21 MET CA C 20 60.160 60.160 58.328 1.832 18533
13638 1 19 . 1 1 21 21 MET CB C 20 33.040 33.040 31.562 1.478 18533
13639 1 19 . 1 1 21 21 MET H H 20 6.310 6.310 7.414 -1.104 18533
13640 1 19 . 1 1 22 22 ALA N N 21 117.800 117.800 119.519 -1.719 18533
13641 1 19 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.821 -0.421 18533
13642 1 19 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.245 0.745 18533
13643 1 19 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.746 -1.256 18533
13644 1 19 . 1 1 22 22 ALA H H 21 6.550 6.550 7.410 -0.860 18533
13645 1 19 . 1 1 23 23 GLU N N 22 115.520 115.520 118.839 -3.319 18533
13646 1 19 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.135 -0.455 18533
13647 1 19 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.748 -0.198 18533
13648 1 19 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.781 0.009 18533
13649 1 19 . 1 1 23 23 GLU H H 22 7.800 7.800 7.531 0.269 18533
13650 1 19 . 1 1 24 24 LYS N N 23 114.220 114.220 116.233 -2.013 18533
13651 1 19 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.155 -0.155 18533
13652 1 19 . 1 1 24 24 LYS CA C 23 57.760 57.760 57.977 -0.217 18533
13653 1 19 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.353 -1.553 18533
13654 1 19 . 1 1 24 24 LYS H H 23 8.040 8.040 7.430 0.610 18533
13655 1 19 . 1 1 25 25 MET N N 24 115.250 115.250 119.837 -4.587 18533
13656 1 19 . 1 1 25 25 MET HA H 24 3.950 3.950 3.611 0.339 18533
13657 1 19 . 1 1 25 25 MET CA C 24 57.980 57.980 58.496 -0.516 18533
13658 1 19 . 1 1 25 25 MET CB C 24 35.500 35.500 32.139 3.361 18533
13659 1 19 . 1 1 25 25 MET H H 24 7.610 7.610 7.364 0.246 18533
13660 1 19 . 1 1 26 26 PHE N N 25 119.090 119.090 115.742 3.348 18533
13661 1 19 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.546 -0.206 18533
13662 1 19 . 1 1 26 26 PHE CA C 25 60.030 60.030 60.074 -0.044 18533
13663 1 19 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.481 1.979 18533
13664 1 19 . 1 1 26 26 PHE H H 25 8.560 8.560 7.754 0.806 18533
13665 1 19 . 1 1 27 27 ALA N N 26 117.830 117.830 122.528 -4.698 18533
13666 1 19 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.721 0.209 18533
13667 1 19 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.162 0.898 18533
13668 1 19 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.485 0.925 18533
13669 1 19 . 1 1 27 27 ALA H H 26 8.800 8.800 7.324 1.476 18533
13670 1 19 . 1 1 28 28 GLN N N 27 117.550 117.550 118.303 -0.753 18533
13671 1 19 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.927 0.123 18533
13672 1 19 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.823 0.787 18533
13673 1 19 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.919 0.531 18533
13674 1 19 . 1 1 28 28 GLN H H 27 7.690 7.690 7.726 -0.036 18533
13675 1 19 . 1 1 29 29 GLN N N 28 117.530 117.530 119.969 -2.439 18533
13676 1 19 . 1 1 29 29 GLN HA H 28 4.140 4.140 3.991 0.149 18533
13677 1 19 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.838 0.342 18533
13678 1 19 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.939 -0.829 18533
13679 1 19 . 1 1 29 29 GLN H H 28 8.210 8.210 7.485 0.725 18533
13680 1 19 . 1 1 30 30 LEU N N 29 119.330 119.330 119.235 0.095 18533
13681 1 19 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.984 -0.054 18533
13682 1 19 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.919 0.161 18533
13683 1 19 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.491 0.409 18533
13684 1 19 . 1 1 30 30 LEU H H 29 8.540 8.540 8.558 -0.018 18533
13685 1 19 . 1 1 31 31 ARG N N 30 120.880 120.880 117.800 3.080 18533
13686 1 19 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.101 -0.131 18533
13687 1 19 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.078 0.712 18533
13688 1 19 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.516 0.004 18533
13689 1 19 . 1 1 31 31 ARG H H 30 8.050 8.050 7.913 0.137 18533
13690 1 19 . 1 1 32 32 HIS N N 31 119.770 119.770 118.205 1.565 18533
13691 1 19 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.429 0.121 18533
13692 1 19 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.086 -0.005 18533
13693 1 19 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.117 0.593 18533
13694 1 19 . 1 1 32 32 HIS H H 31 8.440 8.440 8.444 -0.004 18533
13695 1 19 . 1 1 33 33 ARG N N 32 115.430 115.430 117.026 -1.596 18533
13696 1 19 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.514 0.076 18533
13697 1 19 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.048 -0.078 18533
13698 1 19 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.647 -0.427 18533
13699 1 19 . 1 1 33 33 ARG H H 32 7.500 7.500 7.696 -0.196 18533
13700 1 19 . 1 1 34 34 GLY N N 33 106.730 106.730 108.775 -2.045 18533
13701 1 19 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.137 1.063 18533
13702 1 19 . 1 1 34 34 GLY H H 33 7.750 7.750 8.191 -0.441 18533
13703 1 19 . 1 1 35 35 LEU N N 34 119.980 119.980 116.697 3.283 18533
13704 1 19 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.842 -0.162 18533
13705 1 19 . 1 1 35 35 LEU CA C 34 54.150 54.150 54.053 0.097 18533
13706 1 19 . 1 1 35 35 LEU CB C 34 43.190 43.190 43.020 0.170 18533
13707 1 19 . 1 1 35 35 LEU H H 34 7.980 7.980 8.585 -0.605 18533
13708 1 19 . 1 1 36 36 GLY N N 35 108.660 108.660 108.761 -0.101 18533
13709 1 19 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.465 -0.365 18533
13710 1 19 . 1 1 36 36 GLY H H 35 8.830 8.830 7.757 1.073 18533
13711 1 19 . 1 1 37 37 ASP N N 36 115.360 115.360 119.671 -4.311 18533
13712 1 19 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.458 0.312 18533
13713 1 19 . 1 1 37 37 ASP CA C 36 54.390 54.390 56.815 -2.425 18533
13714 1 19 . 1 1 37 37 ASP CB C 36 41.170 41.170 41.070 0.100 18533
13715 1 19 . 1 1 37 37 ASP H H 36 8.300 8.300 8.369 -0.069 18533
13716 1 19 . 1 1 38 38 ALA N N 37 121.460 121.460 120.466 0.994 18533
13717 1 19 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.277 0.033 18533
13718 1 19 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.408 -0.458 18533
13719 1 19 . 1 1 38 38 ALA CB C 37 20.850 20.850 19.431 1.419 18533
13720 1 19 . 1 1 38 38 ALA H H 37 7.380 7.380 7.237 0.143 18533
13721 1 19 . 1 1 39 39 VAL N N 38 115.660 115.660 117.288 -1.628 18533
13722 1 19 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.378 0.422 18533
13723 1 19 . 1 1 39 39 VAL CA C 38 60.040 60.040 61.217 -1.177 18533
13724 1 19 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.209 0.981 18533
13725 1 19 . 1 1 39 39 VAL H H 38 7.100 7.100 7.992 -0.892 18533
13726 1 19 . 1 1 40 40 ARG N N 39 129.230 129.230 126.637 2.593 18533
13727 1 19 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.499 0.041 18533
13728 1 19 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.351 1.359 18533
13729 1 19 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.922 1.398 18533
13730 1 19 . 1 1 40 40 ARG H H 39 9.730 9.730 7.963 1.767 18533
13731 1 19 . 1 1 41 41 VAL N N 40 126.240 126.240 125.976 0.264 18533
13732 1 19 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.998 0.692 18533
13733 1 19 . 1 1 41 41 VAL CA C 40 60.560 60.560 60.993 -0.433 18533
13734 1 19 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.223 -0.283 18533
13735 1 19 . 1 1 41 41 VAL H H 40 8.610 8.610 8.440 0.170 18533
13736 1 19 . 1 1 42 42 THR N N 41 117.310 117.310 118.965 -1.655 18533
13737 1 19 . 1 1 42 42 THR HA H 41 4.890 4.890 4.873 0.017 18533
13738 1 19 . 1 1 42 42 THR CA C 41 60.300 60.300 59.873 0.427 18533
13739 1 19 . 1 1 42 42 THR CB C 41 73.890 73.890 71.711 2.179 18533
13740 1 19 . 1 1 42 42 THR H H 41 8.870 8.870 9.164 -0.294 18533
13741 1 19 . 1 1 43 43 SER N N 42 109.960 109.960 113.241 -3.281 18533
13742 1 19 . 1 1 43 43 SER HA H 42 5.720 5.720 4.876 0.844 18533
13743 1 19 . 1 1 43 43 SER CA C 42 58.090 58.090 57.955 0.135 18533
13744 1 19 . 1 1 43 43 SER CB C 42 65.870 65.870 66.383 -0.513 18533
13745 1 19 . 1 1 43 43 SER H H 42 8.060 8.060 8.625 -0.565 18533
13746 1 19 . 1 1 44 44 ALA N N 43 119.200 119.200 119.577 -0.377 18533
13747 1 19 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.422 -1.162 18533
13748 1 19 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.689 -0.509 18533
13749 1 19 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.918 -1.088 18533
13750 1 19 . 1 1 44 44 ALA H H 43 8.710 8.710 9.050 -0.340 18533
13751 1 19 . 1 1 45 45 GLY N N 44 104.090 104.090 105.800 -1.710 18533
13752 1 19 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.310 -1.770 18533
13753 1 19 . 1 1 45 45 GLY H H 44 8.670 8.670 8.240 0.430 18533
13754 1 19 . 1 1 46 46 THR N N 45 114.060 114.060 116.670 -2.610 18533
13755 1 19 . 1 1 46 46 THR HA H 45 4.080 4.080 4.221 -0.141 18533
13756 1 19 . 1 1 46 46 THR CA C 45 64.680 64.680 64.532 0.148 18533
13757 1 19 . 1 1 46 46 THR CB C 45 67.880 67.880 69.035 -1.155 18533
13758 1 19 . 1 1 46 46 THR H H 45 9.120 9.120 8.139 0.981 18533
13759 1 19 . 1 1 47 47 GLY N N 46 110.380 110.380 108.525 1.855 18533
13760 1 19 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.786 0.044 18533
13761 1 19 . 1 1 47 47 GLY H H 46 8.930 8.930 8.493 0.437 18533
13762 1 19 . 1 1 48 48 ASN N N 47 113.440 113.440 117.543 -4.103 18533
13763 1 19 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.372 0.118 18533
13764 1 19 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.243 -2.483 18533
13765 1 19 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.890 1.960 18533
13766 1 19 . 1 1 48 48 ASN H H 47 7.600 7.600 7.676 -0.076 18533
13767 1 19 . 1 1 49 49 TRP N N 48 117.300 117.300 121.342 -4.042 18533
13768 1 19 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.427 -0.527 18533
13769 1 19 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.401 0.459 18533
13770 1 19 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.980 -0.460 18533
13771 1 19 . 1 1 49 49 TRP H H 48 6.920 6.920 8.630 -1.710 18533
13772 1 19 . 1 1 50 50 HIS N N 49 111.590 111.590 115.110 -3.520 18533
13773 1 19 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.788 0.092 18533
13774 1 19 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.325 -1.465 18533
13775 1 19 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.881 1.159 18533
13776 1 19 . 1 1 50 50 HIS H H 49 8.620 8.620 8.474 0.146 18533
13777 1 19 . 1 1 51 51 VAL N N 50 119.010 119.010 120.586 -1.576 18533
13778 1 19 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.672 -0.472 18533
13779 1 19 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.197 1.483 18533
13780 1 19 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.854 -0.464 18533
13781 1 19 . 1 1 51 51 VAL H H 50 6.880 6.880 7.457 -0.577 18533
13782 1 19 . 1 1 52 52 GLY N N 51 115.450 115.450 116.407 -0.957 18533
13783 1 19 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.014 -0.074 18533
13784 1 19 . 1 1 52 52 GLY H H 51 9.120 9.120 9.270 -0.150 18533
13785 1 19 . 1 1 53 53 SER N N 52 116.620 116.620 116.122 0.498 18533
13786 1 19 . 1 1 53 53 SER HA H 52 4.610 4.610 4.741 -0.131 18533
13787 1 19 . 1 1 53 53 SER CA C 52 59.310 59.310 57.623 1.687 18533
13788 1 19 . 1 1 53 53 SER CB C 52 64.630 64.630 65.374 -0.744 18533
13789 1 19 . 1 1 53 53 SER H H 52 8.430 8.430 8.162 0.268 18533
13790 1 19 . 1 1 54 54 CYS N N 53 118.690 118.690 118.003 0.687 18533
13791 1 19 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.378 -0.278 18533
13792 1 19 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.240 1.430 18533
13793 1 19 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.503 -3.153 18533
13794 1 19 . 1 1 54 54 CYS H H 53 8.170 8.170 8.439 -0.269 18533
13795 1 19 . 1 1 55 55 ALA N N 54 118.580 118.580 123.815 -5.235 18533
13796 1 19 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.100 0.020 18533
13797 1 19 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.991 -0.351 18533
13798 1 19 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.268 -2.638 18533
13799 1 19 . 1 1 55 55 ALA H H 54 8.420 8.420 8.571 -0.151 18533
13800 1 19 . 1 1 56 56 ASP N N 55 121.500 121.500 123.009 -1.509 18533
13801 1 19 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.397 -0.057 18533
13802 1 19 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.725 0.325 18533
13803 1 19 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.942 3.118 18533
13804 1 19 . 1 1 56 56 ASP H H 55 8.470 8.470 8.429 0.041 18533
13805 1 19 . 1 1 57 57 GLU N N 56 127.840 127.840 125.724 2.116 18533
13806 1 19 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.830 0.210 18533
13807 1 19 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.378 0.262 18533
13808 1 19 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.460 0.040 18533
13809 1 19 . 1 1 57 57 GLU H H 56 9.230 9.230 8.865 0.365 18533
13810 1 19 . 1 1 58 58 ARG N N 57 120.820 120.820 119.466 1.354 18533
13811 1 19 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.787 0.023 18533
13812 1 19 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.649 -0.499 18533
13813 1 19 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.087 -1.817 18533
13814 1 19 . 1 1 58 58 ARG H H 57 9.220 9.220 8.706 0.514 18533
13815 1 19 . 1 1 59 59 ALA N N 58 121.590 121.590 121.715 -0.125 18533
13816 1 19 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.182 -0.022 18533
13817 1 19 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.555 0.225 18533
13818 1 19 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.209 0.281 18533
13819 1 19 . 1 1 59 59 ALA H H 58 6.680 6.680 7.596 -0.916 18533
13820 1 19 . 1 1 60 60 ALA N N 59 118.970 118.970 121.591 -2.621 18533
13821 1 19 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.968 -0.108 18533
13822 1 19 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.208 -0.188 18533
13823 1 19 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.422 -0.352 18533
13824 1 19 . 1 1 60 60 ALA H H 59 8.540 8.540 8.593 -0.053 18533
13825 1 19 . 1 1 61 61 GLY N N 60 104.160 104.160 107.090 -2.930 18533
13826 1 19 . 1 1 61 61 GLY CA C 60 47.270 47.270 46.910 0.360 18533
13827 1 19 . 1 1 61 61 GLY H H 60 8.210 8.210 7.985 0.225 18533
13828 1 19 . 1 1 62 62 VAL N N 61 122.820 122.820 123.259 -0.439 18533
13829 1 19 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.539 0.311 18533
13830 1 19 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.721 -0.471 18533
13831 1 19 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.887 0.003 18533
13832 1 19 . 1 1 62 62 VAL H H 61 7.310 7.310 8.137 -0.827 18533
13833 1 19 . 1 1 63 63 LEU N N 62 120.310 120.310 118.384 1.926 18533
13834 1 19 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.225 -0.245 18533
13835 1 19 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.119 0.831 18533
13836 1 19 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.590 -0.090 18533
13837 1 19 . 1 1 63 63 LEU H H 62 8.090 8.090 8.235 -0.145 18533
13838 1 19 . 1 1 64 64 ARG N N 63 119.440 119.440 119.237 0.203 18533
13839 1 19 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.321 -0.141 18533
13840 1 19 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.849 0.601 18533
13841 1 19 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.612 0.768 18533
13842 1 19 . 1 1 64 64 ARG H H 63 8.740 8.740 8.500 0.240 18533
13843 1 19 . 1 1 65 65 ALA N N 64 122.560 122.560 121.772 0.788 18533
13844 1 19 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.106 -0.076 18533
13845 1 19 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.111 0.429 18533
13846 1 19 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.312 -0.232 18533
13847 1 19 . 1 1 65 65 ALA H H 64 7.910 7.910 7.924 -0.014 18533
13848 1 19 . 1 1 66 66 HIS N N 65 112.690 112.690 114.861 -2.171 18533
13849 1 19 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.674 -0.034 18533
13850 1 19 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.014 -0.514 18533
13851 1 19 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.940 0.380 18533
13852 1 19 . 1 1 66 66 HIS H H 65 7.410 7.410 7.899 -0.489 18533
13853 1 19 . 1 1 67 67 GLY N N 66 107.440 107.440 106.363 1.077 18533
13854 1 19 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.227 1.133 18533
13855 1 19 . 1 1 67 67 GLY H H 66 7.850 7.850 7.623 0.227 18533
13856 1 19 . 1 1 68 68 TYR N N 67 119.940 119.940 121.744 -1.804 18533
13857 1 19 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.830 -0.030 18533
13858 1 19 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.300 0.800 18533
13859 1 19 . 1 1 68 68 TYR CB C 67 39.860 39.860 39.017 0.843 18533
13860 1 19 . 1 1 68 68 TYR H H 67 8.380 8.380 8.304 0.076 18533
13861 1 19 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.558 0.002 18533
13862 1 19 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.886 -0.286 18533
13863 1 19 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.430 0.380 18533
13864 1 19 . 1 1 70 70 THR N N 69 100.660 100.660 106.856 -6.196 18533
13865 1 19 . 1 1 70 70 THR HA H 69 4.300 4.300 4.465 -0.165 18533
13866 1 19 . 1 1 70 70 THR CA C 69 61.250 61.250 60.596 0.654 18533
13867 1 19 . 1 1 70 70 THR CB C 69 70.740 70.740 69.793 0.947 18533
13868 1 19 . 1 1 70 70 THR H H 69 7.860 7.860 8.025 -0.165 18533
13869 1 19 . 1 1 71 71 ASP N N 70 122.880 122.880 122.376 0.504 18533
13870 1 19 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.518 -0.108 18533
13871 1 19 . 1 1 71 71 ASP CA C 70 55.870 55.870 55.294 0.576 18533
13872 1 19 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.661 -0.691 18533
13873 1 19 . 1 1 71 71 ASP H H 70 7.940 7.940 7.797 0.143 18533
13874 1 19 . 1 1 72 72 HIS N N 71 121.720 121.720 124.178 -2.458 18533
13875 1 19 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.707 -0.007 18533
13876 1 19 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.182 1.208 18533
13877 1 19 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.420 2.920 18533
13878 1 19 . 1 1 72 72 HIS H H 71 8.000 8.000 8.262 -0.262 18533
13879 1 19 . 1 1 73 73 ARG N N 72 125.760 125.760 126.707 -0.947 18533
13880 1 19 . 1 1 73 73 ARG HA H 72 4.290 4.290 5.043 -0.753 18533
13881 1 19 . 1 1 73 73 ARG CA C 72 54.430 54.430 53.771 0.659 18533
13882 1 19 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.909 0.401 18533
13883 1 19 . 1 1 73 73 ARG H H 72 7.230 7.230 7.944 -0.714 18533
13884 1 19 . 1 1 74 74 ALA N N 73 127.970 127.970 129.527 -1.557 18533
13885 1 19 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.581 0.049 18533
13886 1 19 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.439 -0.259 18533
13887 1 19 . 1 1 74 74 ALA CB C 73 18.900 18.900 19.997 -1.097 18533
13888 1 19 . 1 1 74 74 ALA H H 73 9.090 9.090 8.151 0.939 18533
13889 1 19 . 1 1 75 75 ALA N N 74 126.090 126.090 125.532 0.558 18533
13890 1 19 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.795 -0.005 18533
13891 1 19 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.855 0.115 18533
13892 1 19 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.413 1.207 18533
13893 1 19 . 1 1 75 75 ALA H H 74 9.410 9.410 9.555 -0.145 18533
13894 1 19 . 1 1 76 76 GLN N N 75 123.260 123.260 121.402 1.858 18533
13895 1 19 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.602 0.348 18533
13896 1 19 . 1 1 76 76 GLN CA C 75 53.550 53.550 54.900 -1.350 18533
13897 1 19 . 1 1 76 76 GLN CB C 75 30.050 30.050 30.179 -0.129 18533
13898 1 19 . 1 1 76 76 GLN H H 75 8.800 8.800 8.442 0.358 18533
13899 1 19 . 1 1 77 77 VAL N N 76 125.510 125.510 124.447 1.063 18533
13900 1 19 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.443 -0.143 18533
13901 1 19 . 1 1 77 77 VAL CA C 76 63.580 63.580 64.064 -0.484 18533
13902 1 19 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.827 1.663 18533
13903 1 19 . 1 1 77 77 VAL H H 76 8.550 8.550 8.170 0.380 18533
13904 1 19 . 1 1 78 78 GLY N N 77 121.850 121.850 116.225 5.625 18533
13905 1 19 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.144 -0.304 18533
13906 1 19 . 1 1 78 78 GLY H H 77 10.930 10.930 8.244 2.686 18533
13907 1 19 . 1 1 79 79 THR N N 78 115.210 115.210 115.712 -0.502 18533
13908 1 19 . 1 1 79 79 THR HA H 78 3.700 3.700 3.915 -0.215 18533
13909 1 19 . 1 1 79 79 THR CA C 78 66.440 66.440 67.427 -0.987 18533
13910 1 19 . 1 1 79 79 THR CB C 78 68.770 68.770 68.835 -0.065 18533
13911 1 19 . 1 1 79 79 THR H H 78 8.540 8.540 8.433 0.107 18533
13912 1 19 . 1 1 80 80 GLU N N 79 119.360 119.360 118.702 0.658 18533
13913 1 19 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.942 0.018 18533
13914 1 19 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.625 0.405 18533
13915 1 19 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.910 0.150 18533
13916 1 19 . 1 1 80 80 GLU H H 79 9.110 9.110 8.822 0.288 18533
13917 1 19 . 1 1 81 81 HIS N N 80 118.380 118.380 116.792 1.588 18533
13918 1 19 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.272 -0.332 18533
13919 1 19 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.888 1.532 18533
13920 1 19 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.299 0.631 18533
13921 1 19 . 1 1 81 81 HIS H H 80 7.040 7.040 7.534 -0.494 18533
13922 1 19 . 1 1 82 82 LEU N N 81 114.010 114.010 119.954 -5.944 18533
13923 1 19 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.115 -0.215 18533
13924 1 19 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.696 -0.016 18533
13925 1 19 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.404 -0.674 18533
13926 1 19 . 1 1 82 82 LEU H H 81 7.850 7.850 8.263 -0.413 18533
13927 1 19 . 1 1 83 83 ALA N N 82 119.050 119.050 118.178 0.872 18533
13928 1 19 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.218 0.172 18533
13929 1 19 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.303 -0.103 18533
13930 1 19 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.834 0.346 18533
13931 1 19 . 1 1 83 83 ALA H H 82 6.950 6.950 7.326 -0.376 18533
13932 1 19 . 1 1 84 84 ALA N N 83 122.500 122.500 121.695 0.805 18533
13933 1 19 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.109 -0.349 18533
13934 1 19 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.518 1.832 18533
13935 1 19 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.569 -2.249 18533
13936 1 19 . 1 1 84 84 ALA H H 83 7.280 7.280 7.225 0.055 18533
13937 1 19 . 1 1 85 85 ASP N N 84 118.740 118.740 120.435 -1.695 18533
13938 1 19 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.767 -0.357 18533
13939 1 19 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.243 1.397 18533
13940 1 19 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.247 0.653 18533
13941 1 19 . 1 1 85 85 ASP H H 84 8.440 8.440 8.447 -0.007 18533
13942 1 19 . 1 1 86 86 LEU N N 85 115.180 115.180 118.881 -3.701 18533
13943 1 19 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.881 -0.701 18533
13944 1 19 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.748 1.292 18533
13945 1 19 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.609 0.561 18533
13946 1 19 . 1 1 86 86 LEU H H 85 7.280 7.280 8.082 -0.802 18533
13947 1 19 . 1 1 87 87 LEU N N 86 128.140 128.140 127.703 0.437 18533
13948 1 19 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.909 -0.219 18533
13949 1 19 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.299 2.081 18533
13950 1 19 . 1 1 87 87 LEU CB C 86 42.170 42.170 41.856 0.314 18533
13951 1 19 . 1 1 87 87 LEU H H 86 8.780 8.780 8.993 -0.213 18533
13952 1 19 . 1 1 88 88 VAL N N 87 122.630 122.630 126.854 -4.224 18533
13953 1 19 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.526 0.104 18533
13954 1 19 . 1 1 88 88 VAL CA C 87 59.910 59.910 62.509 -2.599 18533
13955 1 19 . 1 1 88 88 VAL CB C 87 30.840 30.840 30.455 0.385 18533
13956 1 19 . 1 1 88 88 VAL H H 87 9.010 9.010 7.910 1.100 18533
13957 1 19 . 1 1 89 89 ALA N N 88 129.820 129.820 131.841 -2.021 18533
13958 1 19 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.880 -0.360 18533
13959 1 19 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.517 -0.737 18533
13960 1 19 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.231 -0.451 18533
13961 1 19 . 1 1 89 89 ALA H H 88 8.590 8.590 9.205 -0.615 18533
13962 1 19 . 1 1 90 90 LEU N N 89 129.280 129.280 119.819 9.461 18533
13963 1 19 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.667 -0.357 18533
13964 1 19 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.107 0.343 18533
13965 1 19 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.990 -3.970 18533
13966 1 19 . 1 1 90 90 LEU H H 89 8.570 8.570 8.700 -0.130 18533
13967 1 19 . 1 1 91 91 ASP N N 90 126.910 126.910 116.410 10.500 18533
13968 1 19 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.932 -0.132 18533
13969 1 19 . 1 1 91 91 ASP CA C 90 52.950 52.950 52.910 0.040 18533
13970 1 19 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.256 0.554 18533
13971 1 19 . 1 1 91 91 ASP H H 90 11.450 11.450 7.536 3.914 18533
13972 1 19 . 1 1 92 92 ARG N N 91 116.950 116.950 120.772 -3.822 18533
13973 1 19 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.924 0.096 18533
13974 1 19 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.168 -0.338 18533
13975 1 19 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.797 0.483 18533
13976 1 19 . 1 1 92 92 ARG H H 91 8.650 8.650 8.369 0.281 18533
13977 1 19 . 1 1 93 93 ASN N N 92 120.740 120.740 118.549 2.191 18533
13978 1 19 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.548 -0.168 18533
13979 1 19 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.432 0.698 18533
13980 1 19 . 1 1 93 93 ASN CB C 92 37.620 37.620 38.238 -0.618 18533
13981 1 19 . 1 1 93 93 ASN H H 92 8.610 8.610 8.497 0.113 18533
13982 1 19 . 1 1 94 94 HIS N N 93 121.170 121.170 120.256 0.914 18533
13983 1 19 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.213 -0.023 18533
13984 1 19 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.242 0.268 18533
13985 1 19 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.659 1.721 18533
13986 1 19 . 1 1 94 94 HIS H H 93 7.430 7.430 8.488 -1.058 18533
13987 1 19 . 1 1 95 95 ALA N N 94 118.270 118.270 121.246 -2.976 18533
13988 1 19 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.974 -0.234 18533
13989 1 19 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.435 0.065 18533
13990 1 19 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.392 -0.422 18533
13991 1 19 . 1 1 95 95 ALA H H 94 7.190 7.190 7.973 -0.783 18533
13992 1 19 . 1 1 96 96 ARG N N 95 117.190 117.190 119.133 -1.943 18533
13993 1 19 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.064 -0.154 18533
13994 1 19 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.223 0.277 18533
13995 1 19 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.049 0.181 18533
13996 1 19 . 1 1 96 96 ARG H H 95 7.600 7.600 7.573 0.027 18533
13997 1 19 . 1 1 97 97 LEU N N 96 120.700 120.700 119.887 0.813 18533
13998 1 19 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.999 0.081 18533
13999 1 19 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.789 0.111 18533
14000 1 19 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.725 -0.385 18533
14001 1 19 . 1 1 97 97 LEU H H 96 7.990 7.990 8.008 -0.018 18533
14002 1 19 . 1 1 98 98 LEU N N 97 118.390 118.390 118.591 -0.201 18533
14003 1 19 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.846 0.064 18533
14004 1 19 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.142 -0.042 18533
14005 1 19 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.193 0.697 18533
14006 1 19 . 1 1 98 98 LEU H H 97 8.210 8.210 8.372 -0.162 18533
14007 1 19 . 1 1 99 99 ARG N N 98 117.470 117.470 118.156 -0.686 18533
14008 1 19 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.063 0.417 18533
14009 1 19 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.039 -0.679 18533
14010 1 19 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.614 -0.874 18533
14011 1 19 . 1 1 99 99 ARG H H 98 7.740 7.740 7.833 -0.093 18533
14012 1 19 . 1 1 100 100 GLN N N 99 121.400 121.400 119.145 2.255 18533
14013 1 19 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.177 -0.107 18533
14014 1 19 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.008 0.672 18533
14015 1 19 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.214 0.106 18533
14016 1 19 . 1 1 100 100 GLN H H 99 8.030 8.030 8.043 -0.013 18533
14017 1 19 . 1 1 101 101 LEU N N 100 118.940 118.940 117.870 1.070 18533
14018 1 19 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.174 0.086 18533
14019 1 19 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.585 -0.125 18533
14020 1 19 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.268 -0.028 18533
14021 1 19 . 1 1 101 101 LEU H H 100 7.780 7.780 8.087 -0.307 18533
14022 1 19 . 1 1 102 102 GLY N N 101 105.740 105.740 104.221 1.519 18533
14023 1 19 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.355 0.675 18533
14024 1 19 . 1 1 102 102 GLY H H 101 7.700 7.700 7.535 0.165 18533
14025 1 19 . 1 1 103 103 VAL N N 102 122.330 122.330 121.401 0.929 18533
14026 1 19 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.082 -0.452 18533
14027 1 19 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.119 1.481 18533
14028 1 19 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.584 -2.094 18533
14029 1 19 . 1 1 103 103 VAL H H 102 7.520 7.520 7.899 -0.379 18533
14030 1 19 . 1 1 104 104 GLU N N 103 128.990 128.990 114.474 14.516 18533
14031 1 19 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.439 -0.269 18533
14032 1 19 . 1 1 104 104 GLU CA C 103 56.920 56.920 54.887 2.033 18533
14033 1 19 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.691 -3.741 18533
14034 1 19 . 1 1 104 104 GLU H H 103 9.210 9.210 8.025 1.185 18533
14035 1 19 . 1 1 105 105 ALA N N 104 124.410 124.410 123.243 1.167 18533
14036 1 19 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.193 -0.433 18533
14037 1 19 . 1 1 105 105 ALA CA C 104 55.640 55.640 55.113 0.527 18533
14038 1 19 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.682 -0.542 18533
14039 1 19 . 1 1 105 105 ALA H H 104 8.500 8.500 8.718 -0.218 18533
14040 1 19 . 1 1 106 106 ALA N N 105 115.110 115.110 120.593 -5.483 18533
14041 1 19 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.211 -0.081 18533
14042 1 19 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.899 -0.859 18533
14043 1 19 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.624 0.436 18533
14044 1 19 . 1 1 106 106 ALA H H 105 8.270 8.270 8.579 -0.309 18533
14045 1 19 . 1 1 107 107 ARG N N 106 115.080 115.080 115.993 -0.913 18533
14046 1 19 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.988 -0.528 18533
14047 1 19 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.707 -0.197 18533
14048 1 19 . 1 1 107 107 ARG CB C 106 32.370 32.370 32.114 0.256 18533
14049 1 19 . 1 1 107 107 ARG H H 106 7.740 7.740 8.012 -0.272 18533
14050 1 19 . 1 1 108 108 VAL N N 107 118.170 118.170 121.673 -3.503 18533
14051 1 19 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.071 0.999 18533
14052 1 19 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.221 -1.581 18533
14053 1 19 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.424 1.176 18533
14054 1 19 . 1 1 108 108 VAL H H 107 7.290 7.290 8.364 -1.074 18533
14055 1 19 . 1 1 109 109 ARG N N 108 124.250 124.250 128.181 -3.931 18533
14056 1 19 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.687 -0.067 18533
14057 1 19 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.943 -1.052 18533
14058 1 19 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.398 0.582 18533
14059 1 19 . 1 1 109 109 ARG H H 108 8.420 8.420 8.892 -0.472 18533
14060 1 19 . 1 1 110 110 MET N N 109 119.570 119.570 121.963 -2.393 18533
14061 1 19 . 1 1 110 110 MET HA H 109 4.960 4.960 4.914 0.046 18533
14062 1 19 . 1 1 110 110 MET CA C 109 53.820 53.820 54.098 -0.278 18533
14063 1 19 . 1 1 110 110 MET CB C 109 30.680 30.680 32.111 -1.431 18533
14064 1 19 . 1 1 110 110 MET H H 109 8.890 8.890 8.700 0.190 18533
14065 1 19 . 1 1 111 111 LEU N N 110 128.660 128.660 127.686 0.974 18533
14066 1 19 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.236 -0.276 18533
14067 1 19 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.098 0.502 18533
14068 1 19 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.938 -0.858 18533
14069 1 19 . 1 1 111 111 LEU H H 110 9.200 9.200 8.930 0.270 18533
14070 1 19 . 1 1 112 112 ARG N N 111 111.910 111.910 116.263 -4.353 18533
14071 1 19 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.086 -0.136 18533
14072 1 19 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.673 1.247 18533
14073 1 19 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.709 -1.209 18533
14074 1 19 . 1 1 112 112 ARG H H 111 8.930 8.930 8.668 0.262 18533
14075 1 19 . 1 1 113 113 SER N N 112 114.800 114.800 115.076 -0.276 18533
14076 1 19 . 1 1 113 113 SER HA H 112 4.290 4.290 4.331 -0.041 18533
14077 1 19 . 1 1 113 113 SER CA C 112 60.880 60.880 59.491 1.389 18533
14078 1 19 . 1 1 113 113 SER CB C 112 63.190 63.190 62.668 0.522 18533
14079 1 19 . 1 1 113 113 SER H H 112 7.680 7.680 7.815 -0.135 18533
14080 1 19 . 1 1 114 114 PHE N N 113 119.260 119.260 118.753 0.507 18533
14081 1 19 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.491 -0.141 18533
14082 1 19 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.129 0.801 18533
14083 1 19 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.994 -0.274 18533
14084 1 19 . 1 1 114 114 PHE H H 113 7.600 7.600 7.645 -0.045 18533
14085 1 19 . 1 1 115 115 ASP N N 114 121.170 121.170 121.746 -0.576 18533
14086 1 19 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.955 0.065 18533
14087 1 19 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.300 -1.200 18533
14088 1 19 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.522 0.988 18533
14089 1 19 . 1 1 115 115 ASP H H 114 7.430 7.430 7.478 -0.048 18533
14090 1 19 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.342 0.148 18533
14091 1 19 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.171 0.179 18533
14092 1 19 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.037 0.233 18533
14093 1 19 . 1 1 117 117 ARG N N 116 117.910 117.910 116.206 1.704 18533
14094 1 19 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.400 -0.130 18533
14095 1 19 . 1 1 117 117 ARG CA C 116 56.450 56.450 54.929 1.520 18533
14096 1 19 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.151 -0.191 18533
14097 1 19 . 1 1 117 117 ARG H H 116 8.580 8.580 8.090 0.490 18533
14098 1 19 . 1 1 118 118 SER N N 117 116.130 116.130 116.794 -0.664 18533
14099 1 19 . 1 1 118 118 SER HA H 117 3.980 3.980 4.316 -0.336 18533
14100 1 19 . 1 1 118 118 SER CA C 117 59.790 59.790 58.647 1.143 18533
14101 1 19 . 1 1 118 118 SER CB C 117 63.760 63.760 62.288 1.472 18533
14102 1 19 . 1 1 118 118 SER H H 117 7.950 7.950 7.545 0.405 18533
14103 1 19 . 1 1 119 119 GLY N N 118 110.080 110.080 114.124 -4.044 18533
14104 1 19 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.082 -0.712 18533
14105 1 19 . 1 1 119 119 GLY H H 118 8.150 8.150 7.966 0.184 18533
14106 1 19 . 1 1 120 120 THR HA H 119 4.020 4.020 4.318 -0.298 18533
14107 1 19 . 1 1 120 120 THR CA C 119 63.290 63.290 61.456 1.834 18533
14108 1 19 . 1 1 120 120 THR CB C 119 69.140 69.140 69.917 -0.777 18533
14109 1 19 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.441 0.129 18533
14110 1 19 . 1 1 121 121 HIS CA C 120 56.010 56.010 57.162 -1.152 18533
14111 1 19 . 1 1 121 121 HIS CB C 120 30.990 30.990 30.547 0.443 18533
14112 1 19 . 1 1 122 122 ALA N N 121 125.880 125.880 128.112 -2.232 18533
14113 1 19 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.420 -0.080 18533
14114 1 19 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.198 0.312 18533
14115 1 19 . 1 1 122 122 ALA CB C 121 18.600 18.600 18.991 -0.391 18533
14116 1 19 . 1 1 122 122 ALA H H 121 7.980 7.980 8.667 -0.687 18533
14117 1 19 . 1 1 123 123 LEU N N 122 119.810 119.810 120.976 -1.166 18533
14118 1 19 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.373 -0.093 18533
14119 1 19 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.570 -0.080 18533
14120 1 19 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.979 1.721 18533
14121 1 19 . 1 1 123 123 LEU H H 122 7.810 7.810 7.972 -0.162 18533
14122 1 19 . 1 1 124 124 ASP N N 123 119.050 119.050 116.095 2.955 18533
14123 1 19 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.623 -0.053 18533
14124 1 19 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.654 1.666 18533
14125 1 19 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.838 -1.168 18533
14126 1 19 . 1 1 124 124 ASP H H 123 8.270 8.270 7.345 0.925 18533
14127 1 19 . 1 1 125 125 VAL N N 124 121.970 121.970 121.975 -0.005 18533
14128 1 19 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.316 -0.056 18533
14129 1 19 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.567 1.743 18533
14130 1 19 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.668 -2.888 18533
14131 1 19 . 1 1 125 125 VAL H H 124 7.930 7.930 7.933 -0.003 18533
14132 1 19 . 1 1 126 126 GLU N N 125 129.490 129.490 126.375 3.115 18533
14133 1 19 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.151 -0.071 18533
14134 1 19 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.542 0.468 18533
14135 1 19 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.364 -0.564 18533
14136 1 19 . 1 1 126 126 GLU H H 125 9.100 9.100 8.574 0.526 18533
14137 1 19 . 1 1 127 127 ASP N N 126 122.300 122.300 118.041 4.259 18533
14138 1 19 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.779 -0.669 18533
14139 1 19 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.977 -0.257 18533
14140 1 19 . 1 1 127 127 ASP CB C 126 42.520 42.520 41.290 1.230 18533
14141 1 19 . 1 1 127 127 ASP H H 126 8.630 8.630 8.206 0.424 18533
14142 1 19 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.270 0.280 18533
14143 1 19 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.263 -0.663 18533
14144 1 19 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.100 -1.120 18533
14145 1 19 . 1 1 129 129 TYR N N 128 122.380 122.380 122.136 0.244 18533
14146 1 19 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.277 -0.477 18533
14147 1 19 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.950 3.170 18533
14148 1 19 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.907 -0.517 18533
14149 1 19 . 1 1 129 129 TYR H H 128 8.670 8.670 9.147 -0.477 18533
14150 1 19 . 1 1 130 130 TYR N N 129 116.300 116.300 111.752 4.548 18533
14151 1 19 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.767 -0.277 18533
14152 1 19 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.166 1.314 18533
14153 1 19 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.428 -2.768 18533
14154 1 19 . 1 1 130 130 TYR H H 129 8.680 8.680 7.778 0.902 18533
14155 1 19 . 1 1 131 131 GLY N N 130 110.870 110.870 110.971 -0.101 18533
14156 1 19 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.128 -1.048 18533
14157 1 19 . 1 1 131 131 GLY H H 130 8.060 8.060 8.659 -0.599 18533
14158 1 19 . 1 1 132 132 ASP N N 131 121.590 121.590 119.288 2.302 18533
14159 1 19 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.675 0.395 18533
14160 1 19 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.724 0.276 18533
14161 1 19 . 1 1 132 132 ASP CB C 131 43.600 43.600 43.236 0.364 18533
14162 1 19 . 1 1 132 132 ASP H H 131 9.290 9.290 8.045 1.245 18533
14163 1 19 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.134 -0.024 18533
14164 1 19 . 1 1 133 133 HIS CA C 132 61.570 61.570 60.005 1.565 18533
14165 1 19 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.335 0.145 18533
14166 1 19 . 1 1 134 134 SER N N 133 115.370 115.370 113.361 2.009 18533
14167 1 19 . 1 1 134 134 SER HA H 133 4.180 4.180 4.010 0.170 18533
14168 1 19 . 1 1 134 134 SER CA C 133 62.070 62.070 61.274 0.796 18533
14169 1 19 . 1 1 134 134 SER CB C 133 62.160 62.160 62.636 -0.476 18533
14170 1 19 . 1 1 134 134 SER H H 133 8.420 8.420 8.484 -0.064 18533
14171 1 19 . 1 1 135 135 ASP N N 134 123.360 123.360 123.166 0.194 18533
14172 1 19 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.365 0.165 18533
14173 1 19 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.253 0.787 18533
14174 1 19 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.172 0.638 18533
14175 1 19 . 1 1 135 135 ASP H H 134 7.980 7.980 7.427 0.553 18533
14176 1 19 . 1 1 136 136 PHE N N 135 118.940 118.940 118.662 0.278 18533
14177 1 19 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.339 -0.539 18533
14178 1 19 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.653 3.167 18533
14179 1 19 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.274 1.076 18533
14180 1 19 . 1 1 136 136 PHE H H 135 7.850 7.850 7.244 0.606 18533
14181 1 19 . 1 1 137 137 GLU N N 136 121.410 121.410 118.425 2.985 18533
14182 1 19 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.040 0.140 18533
14183 1 19 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.123 0.377 18533
14184 1 19 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.118 -0.128 18533
14185 1 19 . 1 1 137 137 GLU H H 136 8.150 8.150 7.849 0.301 18533
14186 1 19 . 1 1 138 138 GLU N N 137 121.530 121.530 120.955 0.575 18533
14187 1 19 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.107 0.183 18533
14188 1 19 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.147 0.253 18533
14189 1 19 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.108 -0.218 18533
14190 1 19 . 1 1 138 138 GLU H H 137 7.870 7.870 7.811 0.059 18533
14191 1 19 . 1 1 139 139 VAL N N 138 119.930 119.930 119.853 0.077 18533
14192 1 19 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.608 -0.128 18533
14193 1 19 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.282 0.798 18533
14194 1 19 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.582 -0.233 18533
14195 1 19 . 1 1 139 139 VAL H H 138 7.770 7.770 7.606 0.164 18533
14196 1 19 . 1 1 140 140 PHE N N 139 119.130 119.130 121.005 -1.875 18533
14197 1 19 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.952 -0.392 18533
14198 1 19 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.638 1.042 18533
14199 1 19 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.727 0.443 18533
14200 1 19 . 1 1 140 140 PHE H H 139 8.050 8.050 7.919 0.131 18533
14201 1 19 . 1 1 141 141 ALA N N 140 121.040 121.040 121.641 -0.601 18533
14202 1 19 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.310 -0.320 18533
14203 1 19 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.675 0.445 18533
14204 1 19 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.311 -0.012 18533
14205 1 19 . 1 1 141 141 ALA H H 140 8.010 8.010 8.115 -0.105 18533
14206 1 19 . 1 1 142 142 VAL N N 141 118.550 118.550 119.373 -0.823 18533
14207 1 19 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.536 0.274 18533
14208 1 19 . 1 1 142 142 VAL CA C 141 65.600 65.600 67.096 -1.496 18533
14209 1 19 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.463 -0.013 18533
14210 1 19 . 1 1 142 142 VAL H H 141 8.300 8.300 7.897 0.403 18533
14211 1 19 . 1 1 143 143 ILE N N 142 121.410 121.410 119.186 2.224 18533
14212 1 19 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.427 -0.037 18533
14213 1 19 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.412 0.638 18533
14214 1 19 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.675 -0.364 18533
14215 1 19 . 1 1 143 143 ILE H H 142 8.150 8.150 8.230 -0.080 18533
14216 1 19 . 1 1 144 144 GLU N N 143 119.630 119.630 119.215 0.415 18533
14217 1 19 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.759 -0.219 18533
14218 1 19 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.179 0.580 18533
14219 1 19 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.889 0.841 18533
14220 1 19 . 1 1 144 144 GLU H H 143 8.640 8.640 8.129 0.511 18533
14221 1 19 . 1 1 145 145 SER N N 144 110.920 110.920 113.761 -2.841 18533
14222 1 19 . 1 1 145 145 SER HA H 144 4.230 4.230 4.228 0.002 18533
14223 1 19 . 1 1 145 145 SER CA C 144 60.810 60.810 60.459 0.351 18533
14224 1 19 . 1 1 145 145 SER CB C 144 63.610 63.610 63.454 0.156 18533
14225 1 19 . 1 1 145 145 SER H H 144 7.640 7.640 7.649 -0.009 18533
14226 1 19 . 1 1 146 146 ALA N N 145 123.110 123.110 124.504 -1.394 18533
14227 1 19 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.338 -0.218 18533
14228 1 19 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.110 -0.710 18533
14229 1 19 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.363 2.517 18533
14230 1 19 . 1 1 146 146 ALA H H 145 7.500 7.500 7.623 -0.123 18533
14231 1 19 . 1 1 147 147 LEU N N 146 114.220 114.220 119.675 -5.455 18533
14232 1 19 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.842 0.098 18533
14233 1 19 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.508 -0.458 18533
14234 1 19 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.415 0.045 18533
14235 1 19 . 1 1 147 147 LEU H H 146 7.410 7.410 8.237 -0.827 18533
14236 1 19 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.338 0.112 18533
14237 1 19 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.400 3.440 18533
14238 1 19 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.016 0.204 18533
14239 1 19 . 1 1 149 149 GLY N N 148 102.590 102.590 106.543 -3.953 18533
14240 1 19 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.574 1.686 18533
14241 1 19 . 1 1 149 149 GLY H H 148 7.960 7.960 7.911 0.049 18533
14242 1 19 . 1 1 150 150 LEU N N 149 128.060 128.060 123.518 4.542 18533
14243 1 19 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.573 0.057 18533
14244 1 19 . 1 1 150 150 LEU CA C 149 57.350 57.350 56.573 0.777 18533
14245 1 19 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.086 0.114 18533
14246 1 19 . 1 1 150 150 LEU H H 149 7.620 7.620 8.301 -0.681 18533
14247 1 19 . 1 1 151 151 HIS N N 150 120.730 120.730 118.931 1.799 18533
14248 1 19 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.115 0.055 18533
14249 1 19 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.565 0.816 18533
14250 1 19 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.837 0.673 18533
14251 1 19 . 1 1 151 151 HIS H H 150 8.430 8.430 8.439 -0.009 18533
14252 1 19 . 1 1 152 152 ASP N N 151 118.170 118.170 119.805 -1.635 18533
14253 1 19 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.412 0.008 18533
14254 1 19 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.986 -0.176 18533
14255 1 19 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.621 -0.591 18533
14256 1 19 . 1 1 152 152 ASP H H 151 7.820 7.820 8.059 -0.239 18533
14257 1 19 . 1 1 153 153 TRP N N 152 122.780 122.780 122.014 0.766 18533
14258 1 19 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.636 -0.526 18533
14259 1 19 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.217 1.393 18533
14260 1 19 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.317 -0.527 18533
14261 1 19 . 1 1 153 153 TRP H H 152 7.900 7.900 7.957 -0.057 18533
14262 1 19 . 1 1 154 154 VAL N N 153 119.460 119.460 116.696 2.764 18533
14263 1 19 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.781 -0.431 18533
14264 1 19 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.317 0.663 18533
14265 1 19 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.500 0.400 18533
14266 1 19 . 1 1 154 154 VAL H H 153 8.560 8.560 8.577 -0.017 18533
14267 1 19 . 1 1 155 155 ASP N N 154 120.500 120.500 121.576 -1.076 18533
14268 1 19 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.281 -0.081 18533
14269 1 19 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.695 -1.125 18533
14270 1 19 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.660 -0.800 18533
14271 1 19 . 1 1 155 155 ASP H H 154 8.530 8.530 8.579 -0.049 18533
14272 1 19 . 1 1 156 156 GLU N N 155 120.090 120.090 119.686 0.404 18533
14273 1 19 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.887 0.043 18533
14274 1 19 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.324 -0.164 18533
14275 1 19 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.368 -0.078 18533
14276 1 19 . 1 1 156 156 GLU H H 155 7.870 7.870 8.510 -0.640 18533
14277 1 19 . 1 1 157 157 ARG N N 156 119.230 119.230 119.065 0.165 18533
14278 1 19 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.972 -0.162 18533
14279 1 19 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.501 -0.511 18533
14280 1 19 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.461 -0.351 18533
14281 1 19 . 1 1 157 157 ARG H H 156 7.660 7.660 7.912 -0.252 18533
14282 1 19 . 1 1 158 158 LEU N N 157 118.790 118.790 116.206 2.584 18533
14283 1 19 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.206 -0.106 18533
14284 1 19 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.047 -0.367 18533
14285 1 19 . 1 1 158 158 LEU CB C 157 41.690 41.690 41.039 0.651 18533
14286 1 19 . 1 1 158 158 LEU H H 157 8.470 8.470 8.127 0.343 18533
14287 1 19 . 1 1 159 159 ALA N N 158 120.760 120.760 121.436 -0.676 18533
14288 1 19 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.255 -0.065 18533
14289 1 19 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.151 -0.871 18533
14290 1 19 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.399 -1.009 18533
14291 1 19 . 1 1 159 159 ALA H H 158 7.490 7.490 7.880 -0.390 18533
14292 1 19 . 1 1 160 160 ARG N N 159 117.810 117.810 116.941 0.869 18533
14293 1 19 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.119 0.091 18533
14294 1 19 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.468 -0.688 18533
14295 1 19 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.425 1.105 18533
14296 1 19 . 1 1 160 160 ARG H H 159 7.650 7.650 8.260 -0.610 18533
14297 1 19 . 1 1 161 161 ASN N N 160 118.560 118.560 118.743 -0.183 18533
14298 1 19 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.525 0.215 18533
14299 1 19 . 1 1 161 161 ASN CA C 160 53.250 53.250 53.409 -0.159 18533
14300 1 19 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.739 0.431 18533
14301 1 19 . 1 1 161 161 ASN H H 160 8.100 8.100 7.596 0.504 18533
14302 1 19 . 1 1 162 162 GLY N N 161 108.900 108.900 109.276 -0.376 18533
14303 1 19 . 1 1 162 162 GLY CA C 161 44.730 44.730 46.019 -1.289 18533
14304 1 19 . 1 1 162 162 GLY H H 161 7.980 7.980 7.576 0.404 18533
14305 1 19 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.721 -0.261 18533
14306 1 19 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.858 0.592 18533
14307 1 19 . 1 1 163 163 PRO CB C 162 32.200 32.200 32.607 -0.407 18533
14308 1 20 . 1 1 2 2 MET N N 1 119.850 119.850 119.380 0.470 18533
14309 1 20 . 1 1 2 2 MET HA H 1 4.500 4.500 3.936 0.564 18533
14310 1 20 . 1 1 2 2 MET CA C 1 55.450 55.450 55.782 -0.332 18533
14311 1 20 . 1 1 2 2 MET CB C 1 33.170 33.170 31.404 1.766 18533
14312 1 20 . 1 1 2 2 MET H H 1 8.140 8.140 8.227 -0.087 18533
14313 1 20 . 1 1 3 3 SER N N 2 117.000 117.000 118.432 -1.432 18533
14314 1 20 . 1 1 3 3 SER HA H 2 4.430 4.430 4.606 -0.176 18533
14315 1 20 . 1 1 3 3 SER CA C 2 58.320 58.320 57.846 0.474 18533
14316 1 20 . 1 1 3 3 SER CB C 2 63.990 63.990 64.005 -0.015 18533
14317 1 20 . 1 1 3 3 SER H H 2 8.340 8.340 8.503 -0.163 18533
14318 1 20 . 1 1 4 4 ASP N N 3 123.200 123.200 121.302 1.898 18533
14319 1 20 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.647 0.213 18533
14320 1 20 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.645 0.235 18533
14321 1 20 . 1 1 4 4 ASP CB C 3 40.800 40.800 39.914 0.886 18533
14322 1 20 . 1 1 4 4 ASP H H 3 8.260 8.260 8.372 -0.112 18533
14323 1 20 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.331 0.069 18533
14324 1 20 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.833 -0.013 18533
14325 1 20 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.579 -0.669 18533
14326 1 20 . 1 1 6 6 LEU N N 5 123.160 123.160 120.375 2.785 18533
14327 1 20 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.386 0.004 18533
14328 1 20 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.294 -0.014 18533
14329 1 20 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.680 0.670 18533
14330 1 20 . 1 1 6 6 LEU H H 5 7.670 7.670 8.110 -0.440 18533
14331 1 20 . 1 1 7 7 HIS N N 6 127.160 127.160 117.638 9.522 18533
14332 1 20 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.175 0.855 18533
14333 1 20 . 1 1 7 7 HIS CA C 6 52.900 52.900 54.965 -2.065 18533
14334 1 20 . 1 1 7 7 HIS CB C 6 32.130 32.130 30.942 1.188 18533
14335 1 20 . 1 1 7 7 HIS H H 6 10.080 10.080 8.688 1.392 18533
14336 1 20 . 1 1 8 8 VAL N N 7 128.620 128.620 127.834 0.786 18533
14337 1 20 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.886 -0.386 18533
14338 1 20 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.532 -0.732 18533
14339 1 20 . 1 1 8 8 VAL CB C 7 34.800 34.800 32.171 2.629 18533
14340 1 20 . 1 1 8 8 VAL H H 7 8.930 8.930 8.484 0.446 18533
14341 1 20 . 1 1 9 9 THR N N 8 121.530 121.530 122.538 -1.008 18533
14342 1 20 . 1 1 9 9 THR HA H 8 5.270 5.270 4.734 0.536 18533
14343 1 20 . 1 1 9 9 THR CA C 8 58.520 58.520 58.857 -0.337 18533
14344 1 20 . 1 1 9 9 THR CB C 8 70.750 70.750 69.542 1.208 18533
14345 1 20 . 1 1 9 9 THR H H 8 7.970 7.970 8.912 -0.942 18533
14346 1 20 . 1 1 10 10 PHE N N 9 125.360 125.360 128.075 -2.715 18533
14347 1 20 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.181 0.029 18533
14348 1 20 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.587 0.723 18533
14349 1 20 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.412 3.418 18533
14350 1 20 . 1 1 10 10 PHE H H 9 8.180 8.180 8.222 -0.042 18533
14351 1 20 . 1 1 11 11 VAL N N 10 121.120 121.120 122.580 -1.460 18533
14352 1 20 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.182 0.178 18533
14353 1 20 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.972 -0.552 18533
14354 1 20 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.484 2.066 18533
14355 1 20 . 1 1 11 11 VAL H H 10 8.710 8.710 9.266 -0.556 18533
14356 1 20 . 1 1 12 12 CYS N N 11 123.270 123.270 126.373 -3.103 18533
14357 1 20 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.467 -1.207 18533
14358 1 20 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.388 1.242 18533
14359 1 20 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.472 -1.122 18533
14360 1 20 . 1 1 12 12 CYS H H 11 7.940 7.940 8.719 -0.779 18533
14361 1 20 . 1 1 13 13 THR HA H 12 5.010 5.010 4.135 0.875 18533
14362 1 20 . 1 1 13 13 THR CA C 12 64.870 64.870 63.233 1.637 18533
14363 1 20 . 1 1 13 13 THR CB C 12 69.180 69.180 67.197 1.984 18533
14364 1 20 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.322 -0.362 18533
14365 1 20 . 1 1 15 15 ASN N N 14 119.960 119.960 116.952 3.008 18533
14366 1 20 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.299 -0.369 18533
14367 1 20 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.519 0.351 18533
14368 1 20 . 1 1 15 15 ASN CB C 14 40.670 40.670 36.484 4.186 18533
14369 1 20 . 1 1 15 15 ASN H H 14 9.280 9.280 8.156 1.124 18533
14370 1 20 . 1 1 16 16 ILE N N 15 101.060 101.060 109.851 -8.791 18533
14371 1 20 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.851 -0.171 18533
14372 1 20 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.314 1.476 18533
14373 1 20 . 1 1 16 16 ILE CB C 15 42.140 42.140 39.134 3.006 18533
14374 1 20 . 1 1 16 16 ILE H H 15 7.100 7.100 7.816 -0.716 18533
14375 1 20 . 1 1 17 17 CYS N N 16 116.020 116.020 120.825 -4.805 18533
14376 1 20 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.601 0.339 18533
14377 1 20 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.499 0.561 18533
14378 1 20 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.942 0.008 18533
14379 1 20 . 1 1 17 17 CYS H H 16 7.700 7.700 8.114 -0.414 18533
14380 1 20 . 1 1 19 19 SER N N 18 122.340 122.340 115.284 7.056 18533
14381 1 20 . 1 1 19 19 SER HA H 18 3.810 3.810 4.373 -0.563 18533
14382 1 20 . 1 1 19 19 SER CA C 18 62.710 62.710 63.345 -0.635 18533
14383 1 20 . 1 1 19 19 SER CB C 18 64.860 64.860 61.187 3.674 18533
14384 1 20 . 1 1 19 19 SER H H 18 11.420 11.420 8.533 2.887 18533
14385 1 20 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.172 -0.202 18533
14386 1 20 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.966 0.064 18533
14387 1 20 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.907 -2.217 18533
14388 1 20 . 1 1 21 21 MET N N 20 112.430 112.430 118.213 -5.783 18533
14389 1 20 . 1 1 21 21 MET HA H 20 3.730 3.730 3.964 -0.234 18533
14390 1 20 . 1 1 21 21 MET CA C 20 60.160 60.160 58.418 1.742 18533
14391 1 20 . 1 1 21 21 MET CB C 20 33.040 33.040 31.467 1.573 18533
14392 1 20 . 1 1 21 21 MET H H 20 6.310 6.310 7.539 -1.229 18533
14393 1 20 . 1 1 22 22 ALA N N 21 117.800 117.800 119.572 -1.772 18533
14394 1 20 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.811 -0.411 18533
14395 1 20 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.309 0.681 18533
14396 1 20 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.750 -1.260 18533
14397 1 20 . 1 1 22 22 ALA H H 21 6.550 6.550 7.488 -0.938 18533
14398 1 20 . 1 1 23 23 GLU N N 22 115.520 115.520 119.019 -3.499 18533
14399 1 20 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.177 -0.497 18533
14400 1 20 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.812 -0.262 18533
14401 1 20 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.844 -0.054 18533
14402 1 20 . 1 1 23 23 GLU H H 22 7.800 7.800 7.694 0.106 18533
14403 1 20 . 1 1 24 24 LYS N N 23 114.220 114.220 116.214 -1.994 18533
14404 1 20 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.180 -0.180 18533
14405 1 20 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.032 -0.272 18533
14406 1 20 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.340 -1.540 18533
14407 1 20 . 1 1 24 24 LYS H H 23 8.040 8.040 7.576 0.464 18533
14408 1 20 . 1 1 25 25 MET N N 24 115.250 115.250 119.665 -4.415 18533
14409 1 20 . 1 1 25 25 MET HA H 24 3.950 3.950 3.497 0.453 18533
14410 1 20 . 1 1 25 25 MET CA C 24 57.980 57.980 58.838 -0.858 18533
14411 1 20 . 1 1 25 25 MET CB C 24 35.500 35.500 32.230 3.269 18533
14412 1 20 . 1 1 25 25 MET H H 24 7.610 7.610 7.422 0.188 18533
14413 1 20 . 1 1 26 26 PHE N N 25 119.090 119.090 116.099 2.991 18533
14414 1 20 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.619 -0.279 18533
14415 1 20 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.897 0.133 18533
14416 1 20 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.462 1.998 18533
14417 1 20 . 1 1 26 26 PHE H H 25 8.560 8.560 7.861 0.699 18533
14418 1 20 . 1 1 27 27 ALA N N 26 117.830 117.830 122.261 -4.431 18533
14419 1 20 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.574 0.356 18533
14420 1 20 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.023 1.038 18533
14421 1 20 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.435 0.975 18533
14422 1 20 . 1 1 27 27 ALA H H 26 8.800 8.800 7.292 1.508 18533
14423 1 20 . 1 1 28 28 GLN N N 27 117.550 117.550 118.232 -0.682 18533
14424 1 20 . 1 1 28 28 GLN HA H 27 4.050 4.050 4.031 0.019 18533
14425 1 20 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.840 0.770 18533
14426 1 20 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.925 0.525 18533
14427 1 20 . 1 1 28 28 GLN H H 27 7.690 7.690 7.786 -0.096 18533
14428 1 20 . 1 1 29 29 GLN N N 28 117.530 117.530 119.810 -2.280 18533
14429 1 20 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.079 0.061 18533
14430 1 20 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.866 0.314 18533
14431 1 20 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.972 -0.862 18533
14432 1 20 . 1 1 29 29 GLN H H 28 8.210 8.210 7.546 0.664 18533
14433 1 20 . 1 1 30 30 LEU N N 29 119.330 119.330 119.705 -0.375 18533
14434 1 20 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.963 -0.033 18533
14435 1 20 . 1 1 30 30 LEU CA C 29 58.080 58.080 58.181 -0.101 18533
14436 1 20 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.392 0.508 18533
14437 1 20 . 1 1 30 30 LEU H H 29 8.540 8.540 8.337 0.203 18533
14438 1 20 . 1 1 31 31 ARG N N 30 120.880 120.880 118.243 2.637 18533
14439 1 20 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.058 -0.088 18533
14440 1 20 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.102 0.688 18533
14441 1 20 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.264 0.256 18533
14442 1 20 . 1 1 31 31 ARG H H 30 8.050 8.050 8.037 0.013 18533
14443 1 20 . 1 1 32 32 HIS N N 31 119.770 119.770 118.456 1.314 18533
14444 1 20 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.443 0.107 18533
14445 1 20 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.605 -0.525 18533
14446 1 20 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.296 0.414 18533
14447 1 20 . 1 1 32 32 HIS H H 31 8.440 8.440 8.328 0.112 18533
14448 1 20 . 1 1 33 33 ARG N N 32 115.430 115.430 117.331 -1.901 18533
14449 1 20 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.480 0.110 18533
14450 1 20 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.258 -0.288 18533
14451 1 20 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.892 -0.672 18533
14452 1 20 . 1 1 33 33 ARG H H 32 7.500 7.500 7.832 -0.332 18533
14453 1 20 . 1 1 34 34 GLY N N 33 106.730 106.730 108.829 -2.099 18533
14454 1 20 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.038 1.163 18533
14455 1 20 . 1 1 34 34 GLY H H 33 7.750 7.750 8.340 -0.590 18533
14456 1 20 . 1 1 35 35 LEU N N 34 119.980 119.980 117.647 2.333 18533
14457 1 20 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.857 -0.177 18533
14458 1 20 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.706 0.444 18533
14459 1 20 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.469 0.720 18533
14460 1 20 . 1 1 35 35 LEU H H 34 7.980 7.980 8.531 -0.551 18533
14461 1 20 . 1 1 36 36 GLY N N 35 108.660 108.660 109.128 -0.468 18533
14462 1 20 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.613 -0.513 18533
14463 1 20 . 1 1 36 36 GLY H H 35 8.830 8.830 7.902 0.928 18533
14464 1 20 . 1 1 37 37 ASP N N 36 115.360 115.360 118.246 -2.886 18533
14465 1 20 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.538 0.232 18533
14466 1 20 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.529 -1.139 18533
14467 1 20 . 1 1 37 37 ASP CB C 36 41.170 41.170 41.008 0.162 18533
14468 1 20 . 1 1 37 37 ASP H H 36 8.300 8.300 8.417 -0.117 18533
14469 1 20 . 1 1 38 38 ALA N N 37 121.460 121.460 119.691 1.769 18533
14470 1 20 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.275 0.035 18533
14471 1 20 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.314 -0.364 18533
14472 1 20 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.080 0.770 18533
14473 1 20 . 1 1 38 38 ALA H H 37 7.380 7.380 7.154 0.226 18533
14474 1 20 . 1 1 39 39 VAL N N 38 115.660 115.660 116.163 -0.503 18533
14475 1 20 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.416 0.384 18533
14476 1 20 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.731 -0.691 18533
14477 1 20 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.096 1.095 18533
14478 1 20 . 1 1 39 39 VAL H H 38 7.100 7.100 7.972 -0.872 18533
14479 1 20 . 1 1 40 40 ARG N N 39 129.230 129.230 127.724 1.506 18533
14480 1 20 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.573 -0.033 18533
14481 1 20 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.349 1.361 18533
14482 1 20 . 1 1 40 40 ARG CB C 39 32.320 32.320 28.986 3.334 18533
14483 1 20 . 1 1 40 40 ARG H H 39 9.730 9.730 8.387 1.343 18533
14484 1 20 . 1 1 41 41 VAL N N 40 126.240 126.240 124.224 2.016 18533
14485 1 20 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.836 0.854 18533
14486 1 20 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.311 -0.751 18533
14487 1 20 . 1 1 41 41 VAL CB C 40 33.940 33.940 33.195 0.745 18533
14488 1 20 . 1 1 41 41 VAL H H 40 8.610 8.610 8.113 0.497 18533
14489 1 20 . 1 1 42 42 THR N N 41 117.310 117.310 118.034 -0.724 18533
14490 1 20 . 1 1 42 42 THR HA H 41 4.890 4.890 4.792 0.098 18533
14491 1 20 . 1 1 42 42 THR CA C 41 60.300 60.300 60.160 0.140 18533
14492 1 20 . 1 1 42 42 THR CB C 41 73.890 73.890 71.321 2.569 18533
14493 1 20 . 1 1 42 42 THR H H 41 8.870 8.870 8.750 0.120 18533
14494 1 20 . 1 1 43 43 SER N N 42 109.960 109.960 113.522 -3.562 18533
14495 1 20 . 1 1 43 43 SER HA H 42 5.720 5.720 5.150 0.570 18533
14496 1 20 . 1 1 43 43 SER CA C 42 58.090 58.090 57.820 0.270 18533
14497 1 20 . 1 1 43 43 SER CB C 42 65.870 65.870 66.603 -0.733 18533
14498 1 20 . 1 1 43 43 SER H H 42 8.060 8.060 8.619 -0.559 18533
14499 1 20 . 1 1 44 44 ALA N N 43 119.200 119.200 120.012 -0.812 18533
14500 1 20 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.133 -0.873 18533
14501 1 20 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.859 -0.679 18533
14502 1 20 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.964 -1.134 18533
14503 1 20 . 1 1 44 44 ALA H H 43 8.710 8.710 9.126 -0.416 18533
14504 1 20 . 1 1 45 45 GLY N N 44 104.090 104.090 106.117 -2.027 18533
14505 1 20 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.173 -1.633 18533
14506 1 20 . 1 1 45 45 GLY H H 44 8.670 8.670 8.270 0.400 18533
14507 1 20 . 1 1 46 46 THR N N 45 114.060 114.060 117.028 -2.968 18533
14508 1 20 . 1 1 46 46 THR HA H 45 4.080 4.080 4.105 -0.025 18533
14509 1 20 . 1 1 46 46 THR CA C 45 64.680 64.680 64.383 0.297 18533
14510 1 20 . 1 1 46 46 THR CB C 45 67.880 67.880 68.606 -0.727 18533
14511 1 20 . 1 1 46 46 THR H H 45 9.120 9.120 8.420 0.700 18533
14512 1 20 . 1 1 47 47 GLY N N 46 110.380 110.380 107.883 2.497 18533
14513 1 20 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.853 -0.023 18533
14514 1 20 . 1 1 47 47 GLY H H 46 8.930 8.930 8.263 0.667 18533
14515 1 20 . 1 1 48 48 ASN N N 47 113.440 113.440 117.503 -4.063 18533
14516 1 20 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.335 0.155 18533
14517 1 20 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.181 -2.421 18533
14518 1 20 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.723 2.127 18533
14519 1 20 . 1 1 48 48 ASN H H 47 7.600 7.600 7.707 -0.107 18533
14520 1 20 . 1 1 49 49 TRP N N 48 117.300 117.300 121.464 -4.164 18533
14521 1 20 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.304 -0.404 18533
14522 1 20 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.127 0.733 18533
14523 1 20 . 1 1 49 49 TRP CB C 48 28.520 28.520 28.996 -0.476 18533
14524 1 20 . 1 1 49 49 TRP H H 48 6.920 6.920 8.531 -1.611 18533
14525 1 20 . 1 1 50 50 HIS N N 49 111.590 111.590 114.737 -3.147 18533
14526 1 20 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.830 0.050 18533
14527 1 20 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.604 -1.744 18533
14528 1 20 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.187 1.853 18533
14529 1 20 . 1 1 50 50 HIS H H 49 8.620 8.620 8.448 0.172 18533
14530 1 20 . 1 1 51 51 VAL N N 50 119.010 119.010 119.718 -0.708 18533
14531 1 20 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.650 -0.450 18533
14532 1 20 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.638 1.042 18533
14533 1 20 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.754 -0.364 18533
14534 1 20 . 1 1 51 51 VAL H H 50 6.880 6.880 7.505 -0.625 18533
14535 1 20 . 1 1 52 52 GLY N N 51 115.450 115.450 116.045 -0.595 18533
14536 1 20 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.160 -0.220 18533
14537 1 20 . 1 1 52 52 GLY H H 51 9.120 9.120 9.129 -0.009 18533
14538 1 20 . 1 1 53 53 SER N N 52 116.620 116.620 115.693 0.927 18533
14539 1 20 . 1 1 53 53 SER HA H 52 4.610 4.610 4.702 -0.092 18533
14540 1 20 . 1 1 53 53 SER CA C 52 59.310 59.310 58.767 0.543 18533
14541 1 20 . 1 1 53 53 SER CB C 52 64.630 64.630 64.967 -0.337 18533
14542 1 20 . 1 1 53 53 SER H H 52 8.430 8.430 8.195 0.235 18533
14543 1 20 . 1 1 54 54 CYS N N 53 118.690 118.690 117.896 0.794 18533
14544 1 20 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.551 -0.451 18533
14545 1 20 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.005 1.665 18533
14546 1 20 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.775 -3.425 18533
14547 1 20 . 1 1 54 54 CYS H H 53 8.170 8.170 8.366 -0.196 18533
14548 1 20 . 1 1 55 55 ALA N N 54 118.580 118.580 124.721 -6.141 18533
14549 1 20 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.190 -0.070 18533
14550 1 20 . 1 1 55 55 ALA CA C 54 52.640 52.640 53.209 -0.569 18533
14551 1 20 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.171 -2.541 18533
14552 1 20 . 1 1 55 55 ALA H H 54 8.420 8.420 8.463 -0.043 18533
14553 1 20 . 1 1 56 56 ASP N N 55 121.500 121.500 123.833 -2.333 18533
14554 1 20 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.429 -0.089 18533
14555 1 20 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.681 0.368 18533
14556 1 20 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.943 3.117 18533
14557 1 20 . 1 1 56 56 ASP H H 55 8.470 8.470 8.529 -0.059 18533
14558 1 20 . 1 1 57 57 GLU N N 56 127.840 127.840 126.677 1.163 18533
14559 1 20 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.850 0.190 18533
14560 1 20 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.213 0.427 18533
14561 1 20 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.289 0.211 18533
14562 1 20 . 1 1 57 57 GLU H H 56 9.230 9.230 8.862 0.368 18533
14563 1 20 . 1 1 58 58 ARG N N 57 120.820 120.820 118.072 2.748 18533
14564 1 20 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.790 0.020 18533
14565 1 20 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.439 -0.289 18533
14566 1 20 . 1 1 58 58 ARG CB C 57 27.270 27.270 29.061 -1.791 18533
14567 1 20 . 1 1 58 58 ARG H H 57 9.220 9.220 8.829 0.391 18533
14568 1 20 . 1 1 59 59 ALA N N 58 121.590 121.590 122.718 -1.128 18533
14569 1 20 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.137 0.023 18533
14570 1 20 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.483 0.297 18533
14571 1 20 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.209 0.281 18533
14572 1 20 . 1 1 59 59 ALA H H 58 6.680 6.680 7.531 -0.851 18533
14573 1 20 . 1 1 60 60 ALA N N 59 118.970 118.970 121.349 -2.379 18533
14574 1 20 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.950 -0.090 18533
14575 1 20 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.157 -0.137 18533
14576 1 20 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.366 -0.296 18533
14577 1 20 . 1 1 60 60 ALA H H 59 8.540 8.540 8.516 0.024 18533
14578 1 20 . 1 1 61 61 GLY N N 60 104.160 104.160 106.700 -2.540 18533
14579 1 20 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.219 0.051 18533
14580 1 20 . 1 1 61 61 GLY H H 60 8.210 8.210 8.236 -0.026 18533
14581 1 20 . 1 1 62 62 VAL N N 61 122.820 122.820 120.038 2.782 18533
14582 1 20 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.811 0.039 18533
14583 1 20 . 1 1 62 62 VAL CA C 61 66.250 66.250 65.070 1.180 18533
14584 1 20 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.593 0.297 18533
14585 1 20 . 1 1 62 62 VAL H H 61 7.310 7.310 7.472 -0.162 18533
14586 1 20 . 1 1 63 63 LEU N N 62 120.310 120.310 121.237 -0.927 18533
14587 1 20 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.251 -0.271 18533
14588 1 20 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.425 0.525 18533
14589 1 20 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.433 0.067 18533
14590 1 20 . 1 1 63 63 LEU H H 62 8.090 8.090 8.345 -0.255 18533
14591 1 20 . 1 1 64 64 ARG N N 63 119.440 119.440 119.374 0.066 18533
14592 1 20 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.289 -0.109 18533
14593 1 20 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.929 0.521 18533
14594 1 20 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.594 0.786 18533
14595 1 20 . 1 1 64 64 ARG H H 63 8.740 8.740 8.488 0.252 18533
14596 1 20 . 1 1 65 65 ALA N N 64 122.560 122.560 121.550 1.010 18533
14597 1 20 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.081 -0.051 18533
14598 1 20 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.174 0.366 18533
14599 1 20 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.275 -0.195 18533
14600 1 20 . 1 1 65 65 ALA H H 64 7.910 7.910 7.802 0.108 18533
14601 1 20 . 1 1 66 66 HIS N N 65 112.690 112.690 114.898 -2.208 18533
14602 1 20 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.665 -0.025 18533
14603 1 20 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.067 -0.567 18533
14604 1 20 . 1 1 66 66 HIS CB C 65 30.320 30.320 29.871 0.449 18533
14605 1 20 . 1 1 66 66 HIS H H 65 7.410 7.410 7.891 -0.481 18533
14606 1 20 . 1 1 67 67 GLY N N 66 107.440 107.440 106.316 1.124 18533
14607 1 20 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.234 1.126 18533
14608 1 20 . 1 1 67 67 GLY H H 66 7.850 7.850 7.672 0.178 18533
14609 1 20 . 1 1 68 68 TYR N N 67 119.940 119.940 121.497 -1.557 18533
14610 1 20 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.846 -0.046 18533
14611 1 20 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.101 0.999 18533
14612 1 20 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.989 0.872 18533
14613 1 20 . 1 1 68 68 TYR H H 67 8.380 8.380 8.253 0.127 18533
14614 1 20 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.498 0.062 18533
14615 1 20 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.870 -0.270 18533
14616 1 20 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.459 0.351 18533
14617 1 20 . 1 1 70 70 THR N N 69 100.660 100.660 107.139 -6.479 18533
14618 1 20 . 1 1 70 70 THR HA H 69 4.300 4.300 4.419 -0.119 18533
14619 1 20 . 1 1 70 70 THR CA C 69 61.250 61.250 61.175 0.075 18533
14620 1 20 . 1 1 70 70 THR CB C 69 70.740 70.740 69.368 1.372 18533
14621 1 20 . 1 1 70 70 THR H H 69 7.860 7.860 8.022 -0.162 18533
14622 1 20 . 1 1 71 71 ASP N N 70 122.880 122.880 122.568 0.312 18533
14623 1 20 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.652 -0.242 18533
14624 1 20 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.681 1.189 18533
14625 1 20 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.371 -0.401 18533
14626 1 20 . 1 1 71 71 ASP H H 70 7.940 7.940 7.785 0.155 18533
14627 1 20 . 1 1 72 72 HIS N N 71 121.720 121.720 123.778 -2.058 18533
14628 1 20 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.855 -0.155 18533
14629 1 20 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.431 0.959 18533
14630 1 20 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.700 2.640 18533
14631 1 20 . 1 1 72 72 HIS H H 71 8.000 8.000 7.873 0.127 18533
14632 1 20 . 1 1 73 73 ARG N N 72 125.760 125.760 127.141 -1.381 18533
14633 1 20 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.931 -0.641 18533
14634 1 20 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.107 0.323 18533
14635 1 20 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.583 0.727 18533
14636 1 20 . 1 1 73 73 ARG H H 72 7.230 7.230 8.193 -0.963 18533
14637 1 20 . 1 1 74 74 ALA N N 73 127.970 127.970 129.704 -1.734 18533
14638 1 20 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.217 0.413 18533
14639 1 20 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.586 -0.406 18533
14640 1 20 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.254 -1.354 18533
14641 1 20 . 1 1 74 74 ALA H H 73 9.090 9.090 8.302 0.788 18533
14642 1 20 . 1 1 75 75 ALA N N 74 126.090 126.090 124.920 1.170 18533
14643 1 20 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.771 0.019 18533
14644 1 20 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.784 0.186 18533
14645 1 20 . 1 1 75 75 ALA CB C 74 23.620 23.620 21.860 1.760 18533
14646 1 20 . 1 1 75 75 ALA H H 74 9.410 9.410 8.210 1.200 18533
14647 1 20 . 1 1 76 76 GLN N N 75 123.260 123.260 119.883 3.377 18533
14648 1 20 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.663 0.287 18533
14649 1 20 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.679 -0.129 18533
14650 1 20 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.166 -1.116 18533
14651 1 20 . 1 1 76 76 GLN H H 75 8.800 8.800 8.392 0.408 18533
14652 1 20 . 1 1 77 77 VAL N N 76 125.510 125.510 124.085 1.425 18533
14653 1 20 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.375 -0.075 18533
14654 1 20 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.063 0.517 18533
14655 1 20 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.820 1.670 18533
14656 1 20 . 1 1 77 77 VAL H H 76 8.550 8.550 7.843 0.707 18533
14657 1 20 . 1 1 78 78 GLY N N 77 121.850 121.850 116.318 5.532 18533
14658 1 20 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.299 -0.459 18533
14659 1 20 . 1 1 78 78 GLY H H 77 10.930 10.930 8.162 2.768 18533
14660 1 20 . 1 1 79 79 THR N N 78 115.210 115.210 116.456 -1.246 18533
14661 1 20 . 1 1 79 79 THR HA H 78 3.700 3.700 3.975 -0.275 18533
14662 1 20 . 1 1 79 79 THR CA C 78 66.440 66.440 67.286 -0.846 18533
14663 1 20 . 1 1 79 79 THR CB C 78 68.770 68.770 68.596 0.174 18533
14664 1 20 . 1 1 79 79 THR H H 78 8.540 8.540 8.445 0.094 18533
14665 1 20 . 1 1 80 80 GLU N N 79 119.360 119.360 119.317 0.043 18533
14666 1 20 . 1 1 80 80 GLU HA H 79 3.960 3.960 4.023 -0.063 18533
14667 1 20 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.998 0.032 18533
14668 1 20 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.356 0.704 18533
14669 1 20 . 1 1 80 80 GLU H H 79 9.110 9.110 8.928 0.182 18533
14670 1 20 . 1 1 81 81 HIS N N 80 118.380 118.380 117.125 1.255 18533
14671 1 20 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.231 -0.291 18533
14672 1 20 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.850 1.570 18533
14673 1 20 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.071 0.859 18533
14674 1 20 . 1 1 81 81 HIS H H 80 7.040 7.040 7.493 -0.453 18533
14675 1 20 . 1 1 82 82 LEU N N 81 114.010 114.010 119.766 -5.756 18533
14676 1 20 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.077 -0.177 18533
14677 1 20 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.898 -0.218 18533
14678 1 20 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.607 -0.877 18533
14679 1 20 . 1 1 82 82 LEU H H 81 7.850 7.850 8.311 -0.461 18533
14680 1 20 . 1 1 83 83 ALA N N 82 119.050 119.050 118.218 0.832 18533
14681 1 20 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.333 0.057 18533
14682 1 20 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.772 -0.572 18533
14683 1 20 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.667 0.513 18533
14684 1 20 . 1 1 83 83 ALA H H 82 6.950 6.950 7.363 -0.413 18533
14685 1 20 . 1 1 84 84 ALA N N 83 122.500 122.500 121.889 0.611 18533
14686 1 20 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.150 -0.390 18533
14687 1 20 . 1 1 84 84 ALA CA C 83 53.350 53.350 52.120 1.230 18533
14688 1 20 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.316 -1.996 18533
14689 1 20 . 1 1 84 84 ALA H H 83 7.280 7.280 7.154 0.126 18533
14690 1 20 . 1 1 85 85 ASP N N 84 118.740 118.740 120.350 -1.610 18533
14691 1 20 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.720 -0.310 18533
14692 1 20 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.046 1.594 18533
14693 1 20 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.005 0.895 18533
14694 1 20 . 1 1 85 85 ASP H H 84 8.440 8.440 8.414 0.026 18533
14695 1 20 . 1 1 86 86 LEU N N 85 115.180 115.180 119.570 -4.390 18533
14696 1 20 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.745 -0.565 18533
14697 1 20 . 1 1 86 86 LEU CA C 85 55.040 55.040 54.094 0.946 18533
14698 1 20 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.719 0.451 18533
14699 1 20 . 1 1 86 86 LEU H H 85 7.280 7.280 8.227 -0.947 18533
14700 1 20 . 1 1 87 87 LEU N N 86 128.140 128.140 127.632 0.508 18533
14701 1 20 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.908 -0.218 18533
14702 1 20 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.864 1.516 18533
14703 1 20 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.512 -0.342 18533
14704 1 20 . 1 1 87 87 LEU H H 86 8.780 8.780 9.142 -0.362 18533
14705 1 20 . 1 1 88 88 VAL N N 87 122.630 122.630 126.901 -4.271 18533
14706 1 20 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.918 -0.288 18533
14707 1 20 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.823 -1.913 18533
14708 1 20 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.910 -1.070 18533
14709 1 20 . 1 1 88 88 VAL H H 87 9.010 9.010 9.096 -0.086 18533
14710 1 20 . 1 1 89 89 ALA N N 88 129.820 129.820 131.090 -1.270 18533
14711 1 20 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.937 -0.417 18533
14712 1 20 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.206 -0.426 18533
14713 1 20 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.139 -0.359 18533
14714 1 20 . 1 1 89 89 ALA H H 88 8.590 8.590 9.243 -0.653 18533
14715 1 20 . 1 1 90 90 LEU N N 89 129.280 129.280 120.787 8.493 18533
14716 1 20 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.522 -0.212 18533
14717 1 20 . 1 1 90 90 LEU CA C 89 55.450 55.450 55.173 0.277 18533
14718 1 20 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.930 -3.910 18533
14719 1 20 . 1 1 90 90 LEU H H 89 8.570 8.570 8.631 -0.061 18533
14720 1 20 . 1 1 91 91 ASP N N 90 126.910 126.910 116.915 9.995 18533
14721 1 20 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.827 -0.027 18533
14722 1 20 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.374 -0.424 18533
14723 1 20 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.961 -0.151 18533
14724 1 20 . 1 1 91 91 ASP H H 90 11.450 11.450 7.478 3.972 18533
14725 1 20 . 1 1 92 92 ARG N N 91 116.950 116.950 120.985 -4.035 18533
14726 1 20 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.928 0.092 18533
14727 1 20 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.592 -0.762 18533
14728 1 20 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.896 0.384 18533
14729 1 20 . 1 1 92 92 ARG H H 91 8.650 8.650 8.165 0.485 18533
14730 1 20 . 1 1 93 93 ASN N N 92 120.740 120.740 118.638 2.102 18533
14731 1 20 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.479 -0.099 18533
14732 1 20 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.757 0.373 18533
14733 1 20 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.408 0.212 18533
14734 1 20 . 1 1 93 93 ASN H H 92 8.610 8.610 8.177 0.433 18533
14735 1 20 . 1 1 94 94 HIS N N 93 121.170 121.170 119.784 1.386 18533
14736 1 20 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.332 -0.142 18533
14737 1 20 . 1 1 94 94 HIS CA C 93 59.510 59.510 58.873 0.637 18533
14738 1 20 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.475 1.905 18533
14739 1 20 . 1 1 94 94 HIS H H 93 7.430 7.430 7.621 -0.191 18533
14740 1 20 . 1 1 95 95 ALA N N 94 118.270 118.270 121.735 -3.465 18533
14741 1 20 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.958 -0.218 18533
14742 1 20 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.496 0.004 18533
14743 1 20 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.307 -0.337 18533
14744 1 20 . 1 1 95 95 ALA H H 94 7.190 7.190 8.354 -1.164 18533
14745 1 20 . 1 1 96 96 ARG N N 95 117.190 117.190 119.241 -2.051 18533
14746 1 20 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.031 -0.121 18533
14747 1 20 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.331 0.169 18533
14748 1 20 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.028 0.202 18533
14749 1 20 . 1 1 96 96 ARG H H 95 7.600 7.600 7.840 -0.240 18533
14750 1 20 . 1 1 97 97 LEU N N 96 120.700 120.700 119.704 0.996 18533
14751 1 20 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.978 0.102 18533
14752 1 20 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.667 0.233 18533
14753 1 20 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.738 -0.398 18533
14754 1 20 . 1 1 97 97 LEU H H 96 7.990 7.990 7.840 0.150 18533
14755 1 20 . 1 1 98 98 LEU N N 97 118.390 118.390 118.370 0.020 18533
14756 1 20 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.824 0.086 18533
14757 1 20 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.002 0.098 18533
14758 1 20 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.250 0.640 18533
14759 1 20 . 1 1 98 98 LEU H H 97 8.210 8.210 8.270 -0.060 18533
14760 1 20 . 1 1 99 99 ARG N N 98 117.470 117.470 117.664 -0.194 18533
14761 1 20 . 1 1 99 99 ARG HA H 98 4.480 4.480 3.918 0.562 18533
14762 1 20 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.080 -0.720 18533
14763 1 20 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.728 -0.988 18533
14764 1 20 . 1 1 99 99 ARG H H 98 7.740 7.740 7.858 -0.118 18533
14765 1 20 . 1 1 100 100 GLN N N 99 121.400 121.400 118.433 2.967 18533
14766 1 20 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.197 -0.127 18533
14767 1 20 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.096 0.584 18533
14768 1 20 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.163 0.157 18533
14769 1 20 . 1 1 100 100 GLN H H 99 8.030 8.030 7.876 0.154 18533
14770 1 20 . 1 1 101 101 LEU N N 100 118.940 118.940 117.470 1.470 18533
14771 1 20 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.178 0.082 18533
14772 1 20 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.187 0.273 18533
14773 1 20 . 1 1 101 101 LEU CB C 100 42.240 42.240 41.950 0.290 18533
14774 1 20 . 1 1 101 101 LEU H H 100 7.780 7.780 7.812 -0.032 18533
14775 1 20 . 1 1 102 102 GLY N N 101 105.740 105.740 104.898 0.842 18533
14776 1 20 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.367 0.663 18533
14777 1 20 . 1 1 102 102 GLY H H 101 7.700 7.700 7.637 0.063 18533
14778 1 20 . 1 1 103 103 VAL N N 102 122.330 122.330 121.031 1.299 18533
14779 1 20 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.177 -0.547 18533
14780 1 20 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.014 1.586 18533
14781 1 20 . 1 1 103 103 VAL CB C 102 31.490 31.490 32.785 -1.295 18533
14782 1 20 . 1 1 103 103 VAL H H 102 7.520 7.520 7.676 -0.156 18533
14783 1 20 . 1 1 104 104 GLU N N 103 128.990 128.990 114.342 14.648 18533
14784 1 20 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.438 -0.268 18533
14785 1 20 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.283 1.637 18533
14786 1 20 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.785 -3.835 18533
14787 1 20 . 1 1 104 104 GLU H H 103 9.210 9.210 7.950 1.260 18533
14788 1 20 . 1 1 105 105 ALA N N 104 124.410 124.410 122.709 1.701 18533
14789 1 20 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.245 -0.485 18533
14790 1 20 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.614 1.026 18533
14791 1 20 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.505 -0.365 18533
14792 1 20 . 1 1 105 105 ALA H H 104 8.500 8.500 8.703 -0.203 18533
14793 1 20 . 1 1 106 106 ALA N N 105 115.110 115.110 120.114 -5.004 18533
14794 1 20 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.106 0.024 18533
14795 1 20 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.538 -0.497 18533
14796 1 20 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.765 0.295 18533
14797 1 20 . 1 1 106 106 ALA H H 105 8.270 8.270 8.259 0.011 18533
14798 1 20 . 1 1 107 107 ARG N N 106 115.080 115.080 115.626 -0.546 18533
14799 1 20 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.703 -0.243 18533
14800 1 20 . 1 1 107 107 ARG CA C 106 56.510 56.510 57.160 -0.650 18533
14801 1 20 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.533 0.837 18533
14802 1 20 . 1 1 107 107 ARG H H 106 7.740 7.740 7.942 -0.202 18533
14803 1 20 . 1 1 108 108 VAL N N 107 118.170 118.170 121.131 -2.961 18533
14804 1 20 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.337 0.733 18533
14805 1 20 . 1 1 108 108 VAL CA C 107 60.640 60.640 63.022 -2.382 18533
14806 1 20 . 1 1 108 108 VAL CB C 107 33.600 33.600 30.709 2.890 18533
14807 1 20 . 1 1 108 108 VAL H H 107 7.290 7.290 7.924 -0.634 18533
14808 1 20 . 1 1 109 109 ARG N N 108 124.250 124.250 127.406 -3.156 18533
14809 1 20 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.614 0.006 18533
14810 1 20 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.551 -0.661 18533
14811 1 20 . 1 1 109 109 ARG CB C 108 34.980 34.980 33.884 1.096 18533
14812 1 20 . 1 1 109 109 ARG H H 108 8.420 8.420 9.191 -0.771 18533
14813 1 20 . 1 1 110 110 MET N N 109 119.570 119.570 121.835 -2.265 18533
14814 1 20 . 1 1 110 110 MET HA H 109 4.960 4.960 4.918 0.042 18533
14815 1 20 . 1 1 110 110 MET CA C 109 53.820 53.820 54.299 -0.479 18533
14816 1 20 . 1 1 110 110 MET CB C 109 30.680 30.680 32.398 -1.718 18533
14817 1 20 . 1 1 110 110 MET H H 109 8.890 8.890 8.682 0.208 18533
14818 1 20 . 1 1 111 111 LEU N N 110 128.660 128.660 126.797 1.863 18533
14819 1 20 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.271 -0.311 18533
14820 1 20 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.168 0.432 18533
14821 1 20 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.666 -0.586 18533
14822 1 20 . 1 1 111 111 LEU H H 110 9.200 9.200 9.191 0.009 18533
14823 1 20 . 1 1 112 112 ARG N N 111 111.910 111.910 116.209 -4.299 18533
14824 1 20 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.124 -0.174 18533
14825 1 20 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.007 1.913 18533
14826 1 20 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.213 -0.713 18533
14827 1 20 . 1 1 112 112 ARG H H 111 8.930 8.930 8.572 0.358 18533
14828 1 20 . 1 1 113 113 SER N N 112 114.800 114.800 115.125 -0.325 18533
14829 1 20 . 1 1 113 113 SER HA H 112 4.290 4.290 4.302 -0.012 18533
14830 1 20 . 1 1 113 113 SER CA C 112 60.880 60.880 59.630 1.250 18533
14831 1 20 . 1 1 113 113 SER CB C 112 63.190 63.190 62.500 0.690 18533
14832 1 20 . 1 1 113 113 SER H H 112 7.680 7.680 7.713 -0.033 18533
14833 1 20 . 1 1 114 114 PHE N N 113 119.260 119.260 118.464 0.796 18533
14834 1 20 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.479 -0.129 18533
14835 1 20 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.133 0.797 18533
14836 1 20 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.885 -0.165 18533
14837 1 20 . 1 1 114 114 PHE H H 113 7.600 7.600 7.681 -0.081 18533
14838 1 20 . 1 1 115 115 ASP N N 114 121.170 121.170 121.495 -0.325 18533
14839 1 20 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.952 0.068 18533
14840 1 20 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.178 -1.077 18533
14841 1 20 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.656 0.854 18533
14842 1 20 . 1 1 115 115 ASP H H 114 7.430 7.430 7.495 -0.065 18533
14843 1 20 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.379 0.111 18533
14844 1 20 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.105 0.245 18533
14845 1 20 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.027 0.243 18533
14846 1 20 . 1 1 117 117 ARG N N 116 117.910 117.910 117.152 0.758 18533
14847 1 20 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.501 -0.231 18533
14848 1 20 . 1 1 117 117 ARG CA C 116 56.450 56.450 54.593 1.857 18533
14849 1 20 . 1 1 117 117 ARG CB C 116 29.960 29.960 29.562 0.398 18533
14850 1 20 . 1 1 117 117 ARG H H 116 8.580 8.580 8.371 0.209 18533
14851 1 20 . 1 1 118 118 SER N N 117 116.130 116.130 114.743 1.387 18533
14852 1 20 . 1 1 118 118 SER HA H 117 3.980 3.980 4.208 -0.228 18533
14853 1 20 . 1 1 118 118 SER CA C 117 59.790 59.790 60.776 -0.987 18533
14854 1 20 . 1 1 118 118 SER CB C 117 63.760 63.760 63.611 0.149 18533
14855 1 20 . 1 1 118 118 SER H H 117 7.950 7.950 7.654 0.296 18533
14856 1 20 . 1 1 119 119 GLY N N 118 110.080 110.080 107.634 2.446 18533
14857 1 20 . 1 1 119 119 GLY CA C 118 45.370 45.370 44.951 0.419 18533
14858 1 20 . 1 1 119 119 GLY H H 118 8.150 8.150 8.448 -0.298 18533
14859 1 20 . 1 1 120 120 THR HA H 119 4.020 4.020 4.443 -0.423 18533
14860 1 20 . 1 1 120 120 THR CA C 119 63.290 63.290 62.901 0.389 18533
14861 1 20 . 1 1 120 120 THR CB C 119 69.140 69.140 69.984 -0.844 18533
14862 1 20 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.776 -0.206 18533
14863 1 20 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.349 0.660 18533
14864 1 20 . 1 1 121 121 HIS CB C 120 30.990 30.990 32.797 -1.807 18533
14865 1 20 . 1 1 122 122 ALA N N 121 125.880 125.880 125.251 0.629 18533
14866 1 20 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.644 -0.304 18533
14867 1 20 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.517 -0.007 18533
14868 1 20 . 1 1 122 122 ALA CB C 121 18.600 18.600 20.918 -2.318 18533
14869 1 20 . 1 1 122 122 ALA H H 121 7.980 7.980 8.159 -0.179 18533
14870 1 20 . 1 1 123 123 LEU N N 122 119.810 119.810 118.414 1.396 18533
14871 1 20 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.616 -0.336 18533
14872 1 20 . 1 1 123 123 LEU CA C 122 54.490 54.490 55.443 -0.953 18533
14873 1 20 . 1 1 123 123 LEU CB C 122 43.700 43.700 42.941 0.759 18533
14874 1 20 . 1 1 123 123 LEU H H 122 7.810 7.810 8.286 -0.476 18533
14875 1 20 . 1 1 124 124 ASP N N 123 119.050 119.050 114.623 4.427 18533
14876 1 20 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.589 -0.019 18533
14877 1 20 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.140 2.180 18533
14878 1 20 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.041 -0.371 18533
14879 1 20 . 1 1 124 124 ASP H H 123 8.270 8.270 7.487 0.783 18533
14880 1 20 . 1 1 125 125 VAL N N 124 121.970 121.970 121.500 0.470 18533
14881 1 20 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.263 -0.003 18533
14882 1 20 . 1 1 125 125 VAL CA C 124 62.310 62.310 61.067 1.243 18533
14883 1 20 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.105 -2.325 18533
14884 1 20 . 1 1 125 125 VAL H H 124 7.930 7.930 8.412 -0.482 18533
14885 1 20 . 1 1 126 126 GLU N N 125 129.490 129.490 126.782 2.708 18533
14886 1 20 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.122 -0.042 18533
14887 1 20 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.479 0.531 18533
14888 1 20 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.537 -0.737 18533
14889 1 20 . 1 1 126 126 GLU H H 125 9.100 9.100 8.461 0.639 18533
14890 1 20 . 1 1 127 127 ASP N N 126 122.300 122.300 117.432 4.868 18533
14891 1 20 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.735 -0.625 18533
14892 1 20 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.687 0.033 18533
14893 1 20 . 1 1 127 127 ASP CB C 126 42.520 42.520 41.745 0.775 18533
14894 1 20 . 1 1 127 127 ASP H H 126 8.630 8.630 8.298 0.332 18533
14895 1 20 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.255 0.295 18533
14896 1 20 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.532 -0.932 18533
14897 1 20 . 1 1 128 128 PRO CB C 127 30.980 30.980 32.116 -1.136 18533
14898 1 20 . 1 1 129 129 TYR N N 128 122.380 122.380 122.219 0.161 18533
14899 1 20 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.291 -0.491 18533
14900 1 20 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.671 3.449 18533
14901 1 20 . 1 1 129 129 TYR CB C 128 39.390 39.390 40.474 -1.084 18533
14902 1 20 . 1 1 129 129 TYR H H 128 8.670 8.670 9.379 -0.709 18533
14903 1 20 . 1 1 130 130 TYR N N 129 116.300 116.300 112.183 4.117 18533
14904 1 20 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.861 -0.371 18533
14905 1 20 . 1 1 130 130 TYR CA C 129 58.480 58.480 56.910 1.570 18533
14906 1 20 . 1 1 130 130 TYR CB C 129 36.660 36.660 39.400 -2.740 18533
14907 1 20 . 1 1 130 130 TYR H H 129 8.680 8.680 7.861 0.819 18533
14908 1 20 . 1 1 131 131 GLY N N 130 110.870 110.870 111.367 -0.497 18533
14909 1 20 . 1 1 131 131 GLY CA C 130 44.080 44.080 44.984 -0.904 18533
14910 1 20 . 1 1 131 131 GLY H H 130 8.060 8.060 8.141 -0.081 18533
14911 1 20 . 1 1 132 132 ASP N N 131 121.590 121.590 121.277 0.313 18533
14912 1 20 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.554 0.516 18533
14913 1 20 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.977 0.023 18533
14914 1 20 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.952 0.648 18533
14915 1 20 . 1 1 132 132 ASP H H 131 9.290 9.290 7.943 1.347 18533
14916 1 20 . 1 1 133 133 HIS HA H 132 4.110 4.110 4.167 -0.057 18533
14917 1 20 . 1 1 133 133 HIS CA C 132 61.570 61.570 60.351 1.219 18533
14918 1 20 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.116 0.364 18533
14919 1 20 . 1 1 134 134 SER N N 133 115.370 115.370 115.357 0.013 18533
14920 1 20 . 1 1 134 134 SER HA H 133 4.180 4.180 4.121 0.059 18533
14921 1 20 . 1 1 134 134 SER CA C 133 62.070 62.070 62.265 -0.195 18533
14922 1 20 . 1 1 134 134 SER CB C 133 62.160 62.160 62.377 -0.217 18533
14923 1 20 . 1 1 134 134 SER H H 133 8.420 8.420 8.256 0.164 18533
14924 1 20 . 1 1 135 135 ASP N N 134 123.360 123.360 122.337 1.023 18533
14925 1 20 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.381 0.149 18533
14926 1 20 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.835 0.205 18533
14927 1 20 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.023 0.787 18533
14928 1 20 . 1 1 135 135 ASP H H 134 7.980 7.980 8.375 -0.395 18533
14929 1 20 . 1 1 136 136 PHE N N 135 118.940 118.940 118.663 0.277 18533
14930 1 20 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.284 -0.484 18533
14931 1 20 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.081 3.739 18533
14932 1 20 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.107 1.243 18533
14933 1 20 . 1 1 136 136 PHE H H 135 7.850 7.850 7.369 0.481 18533
14934 1 20 . 1 1 137 137 GLU N N 136 121.410 121.410 118.285 3.125 18533
14935 1 20 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.208 -0.028 18533
14936 1 20 . 1 1 137 137 GLU CA C 136 59.500 59.500 58.778 0.722 18533
14937 1 20 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.334 -0.344 18533
14938 1 20 . 1 1 137 137 GLU H H 136 8.150 8.150 8.389 -0.239 18533
14939 1 20 . 1 1 138 138 GLU N N 137 121.530 121.530 121.664 -0.134 18533
14940 1 20 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.165 0.125 18533
14941 1 20 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.395 0.005 18533
14942 1 20 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.191 -0.301 18533
14943 1 20 . 1 1 138 138 GLU H H 137 7.870 7.870 8.737 -0.867 18533
14944 1 20 . 1 1 139 139 VAL N N 138 119.930 119.930 119.579 0.351 18533
14945 1 20 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.626 -0.146 18533
14946 1 20 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.531 0.549 18533
14947 1 20 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.720 -0.370 18533
14948 1 20 . 1 1 139 139 VAL H H 138 7.770 7.770 7.520 0.250 18533
14949 1 20 . 1 1 140 140 PHE N N 139 119.130 119.130 120.402 -1.272 18533
14950 1 20 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.945 -0.385 18533
14951 1 20 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.802 0.878 18533
14952 1 20 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.846 0.323 18533
14953 1 20 . 1 1 140 140 PHE H H 139 8.050 8.050 7.947 0.103 18533
14954 1 20 . 1 1 141 141 ALA N N 140 121.040 121.040 122.251 -1.211 18533
14955 1 20 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.419 -0.429 18533
14956 1 20 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.824 0.296 18533
14957 1 20 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.408 -0.108 18533
14958 1 20 . 1 1 141 141 ALA H H 140 8.010 8.010 8.421 -0.411 18533
14959 1 20 . 1 1 142 142 VAL N N 141 118.550 118.550 118.769 -0.219 18533
14960 1 20 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.597 0.213 18533
14961 1 20 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.609 -1.009 18533
14962 1 20 . 1 1 142 142 VAL CB C 141 31.450 31.450 30.986 0.464 18533
14963 1 20 . 1 1 142 142 VAL H H 141 8.300 8.300 8.135 0.165 18533
14964 1 20 . 1 1 143 143 ILE N N 142 121.410 121.410 119.656 1.754 18533
14965 1 20 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.451 -0.061 18533
14966 1 20 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.494 0.556 18533
14967 1 20 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.769 -0.459 18533
14968 1 20 . 1 1 143 143 ILE H H 142 8.150 8.150 8.027 0.123 18533
14969 1 20 . 1 1 144 144 GLU N N 143 119.630 119.630 118.985 0.645 18533
14970 1 20 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.756 -0.216 18533
14971 1 20 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.178 0.582 18533
14972 1 20 . 1 1 144 144 GLU CB C 143 29.730 29.730 29.074 0.656 18533
14973 1 20 . 1 1 144 144 GLU H H 143 8.640 8.640 8.324 0.316 18533
14974 1 20 . 1 1 145 145 SER N N 144 110.920 110.920 114.312 -3.392 18533
14975 1 20 . 1 1 145 145 SER HA H 144 4.230 4.230 4.223 0.007 18533
14976 1 20 . 1 1 145 145 SER CA C 144 60.810 60.810 61.586 -0.776 18533
14977 1 20 . 1 1 145 145 SER CB C 144 63.610 63.610 63.465 0.145 18533
14978 1 20 . 1 1 145 145 SER H H 144 7.640 7.640 7.975 -0.335 18533
14979 1 20 . 1 1 146 146 ALA N N 145 123.110 123.110 124.269 -1.159 18533
14980 1 20 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.354 -0.234 18533
14981 1 20 . 1 1 146 146 ALA CA C 145 53.400 53.400 53.989 -0.589 18533
14982 1 20 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.266 2.614 18533
14983 1 20 . 1 1 146 146 ALA H H 145 7.500 7.500 7.695 -0.195 18533
14984 1 20 . 1 1 147 147 LEU N N 146 114.220 114.220 119.675 -5.455 18533
14985 1 20 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.874 0.066 18533
14986 1 20 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.489 -0.439 18533
14987 1 20 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.406 0.054 18533
14988 1 20 . 1 1 147 147 LEU H H 146 7.410 7.410 8.067 -0.657 18533
14989 1 20 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.313 0.137 18533
14990 1 20 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.429 3.411 18533
14991 1 20 . 1 1 148 148 PRO CB C 147 31.220 31.220 30.985 0.235 18533
14992 1 20 . 1 1 149 149 GLY N N 148 102.590 102.590 106.385 -3.795 18533
14993 1 20 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.481 1.779 18533
14994 1 20 . 1 1 149 149 GLY H H 148 7.960 7.960 7.931 0.029 18533
14995 1 20 . 1 1 150 150 LEU N N 149 128.060 128.060 123.725 4.335 18533
14996 1 20 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.420 0.210 18533
14997 1 20 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.267 0.083 18533
14998 1 20 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.329 -0.129 18533
14999 1 20 . 1 1 150 150 LEU H H 149 7.620 7.620 8.331 -0.711 18533
15000 1 20 . 1 1 151 151 HIS N N 150 120.730 120.730 118.091 2.639 18533
15001 1 20 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.165 0.005 18533
15002 1 20 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.424 0.956 18533
15003 1 20 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.917 0.593 18533
15004 1 20 . 1 1 151 151 HIS H H 150 8.430 8.430 8.662 -0.232 18533
15005 1 20 . 1 1 152 152 ASP N N 151 118.170 118.170 119.684 -1.514 18533
15006 1 20 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.425 -0.005 18533
15007 1 20 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.855 -0.044 18533
15008 1 20 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.635 -0.605 18533
15009 1 20 . 1 1 152 152 ASP H H 151 7.820 7.820 8.231 -0.411 18533
15010 1 20 . 1 1 153 153 TRP N N 152 122.780 122.780 122.145 0.635 18533
15011 1 20 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.723 -0.613 18533
15012 1 20 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.058 1.552 18533
15013 1 20 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.219 -0.429 18533
15014 1 20 . 1 1 153 153 TRP H H 152 7.900 7.900 7.862 0.038 18533
15015 1 20 . 1 1 154 154 VAL N N 153 119.460 119.460 116.094 3.366 18533
15016 1 20 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.834 -0.484 18533
15017 1 20 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.509 0.471 18533
15018 1 20 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.555 0.344 18533
15019 1 20 . 1 1 154 154 VAL H H 153 8.560 8.560 8.416 0.144 18533
15020 1 20 . 1 1 155 155 ASP N N 154 120.500 120.500 121.388 -0.888 18533
15021 1 20 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.325 -0.125 18533
15022 1 20 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.350 -0.780 18533
15023 1 20 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.988 -1.128 18533
15024 1 20 . 1 1 155 155 ASP H H 154 8.530 8.530 8.332 0.198 18533
15025 1 20 . 1 1 156 156 GLU N N 155 120.090 120.090 119.454 0.636 18533
15026 1 20 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.937 -0.007 18533
15027 1 20 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.270 -0.110 18533
15028 1 20 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.298 -0.008 18533
15029 1 20 . 1 1 156 156 GLU H H 155 7.870 7.870 8.495 -0.625 18533
15030 1 20 . 1 1 157 157 ARG N N 156 119.230 119.230 118.990 0.240 18533
15031 1 20 . 1 1 157 157 ARG HA H 156 3.810 3.810 4.012 -0.202 18533
15032 1 20 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.196 -0.205 18533
15033 1 20 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.394 -0.284 18533
15034 1 20 . 1 1 157 157 ARG H H 156 7.660 7.660 7.950 -0.290 18533
15035 1 20 . 1 1 158 158 LEU N N 157 118.790 118.790 116.884 1.906 18533
15036 1 20 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.139 -0.039 18533
15037 1 20 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.153 -0.473 18533
15038 1 20 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.884 0.806 18533
15039 1 20 . 1 1 158 158 LEU H H 157 8.470 8.470 8.181 0.289 18533
15040 1 20 . 1 1 159 159 ALA N N 158 120.760 120.760 121.076 -0.316 18533
15041 1 20 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.213 -0.023 18533
15042 1 20 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.170 -0.890 18533
15043 1 20 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.098 -0.708 18533
15044 1 20 . 1 1 159 159 ALA H H 158 7.490 7.490 7.835 -0.345 18533
15045 1 20 . 1 1 160 160 ARG N N 159 117.810 117.810 116.260 1.550 18533
15046 1 20 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.194 0.016 18533
15047 1 20 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.125 -0.345 18533
15048 1 20 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.949 0.581 18533
15049 1 20 . 1 1 160 160 ARG H H 159 7.650 7.650 7.738 -0.088 18533
15050 1 20 . 1 1 161 161 ASN N N 160 118.560 118.560 119.318 -0.758 18533
15051 1 20 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.609 0.131 18533
15052 1 20 . 1 1 161 161 ASN CA C 160 53.250 53.250 53.276 -0.027 18533
15053 1 20 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.258 0.912 18533
15054 1 20 . 1 1 161 161 ASN H H 160 8.100 8.100 7.564 0.536 18533
15055 1 20 . 1 1 162 162 GLY N N 161 108.900 108.900 107.468 1.432 18533
15056 1 20 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.330 0.400 18533
15057 1 20 . 1 1 162 162 GLY H H 161 7.980 7.980 7.539 0.441 18533
15058 1 20 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.535 -0.075 18533
15059 1 20 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.979 0.471 18533
15060 1 20 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.926 0.274 18533
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 149 3.198 0.209 3.202 18533
2 1 1 "Average Difference" HA 175 0.369 0.025 0.369 18533
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18533
4 1 1 "Average Difference" CA 161 1.061 -0.264 1.031 18533
5 1 1 "Average Difference" CB 147 1.364 -0.212 1.352 18533
6 1 1 "Average Difference" HN 149 0.746 -0.078 0.745 18533
7 1 2 "Average Difference" N 149 3.236 -0.023 3.247 18533
8 1 2 "Average Difference" HA 175 0.370 0.048 0.368 18533
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18533
10 1 2 "Average Difference" CA 161 0.993 -0.255 0.963 18533
11 1 2 "Average Difference" CB 147 1.385 -0.159 1.381 18533
12 1 2 "Average Difference" HN 149 0.697 -0.040 0.698 18533
13 1 3 "Average Difference" N 149 3.258 0.079 3.268 18533
14 1 3 "Average Difference" HA 175 0.379 0.030 0.379 18533
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18533
16 1 3 "Average Difference" CA 161 1.063 -0.288 1.026 18533
17 1 3 "Average Difference" CB 147 1.368 -0.188 1.359 18533
18 1 3 "Average Difference" HN 149 0.711 -0.057 0.711 18533
19 1 4 "Average Difference" N 149 3.351 0.107 3.360 18533
20 1 4 "Average Difference" HA 175 0.379 0.029 0.378 18533
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18533
22 1 4 "Average Difference" CA 161 1.048 -0.197 1.033 18533
23 1 4 "Average Difference" CB 147 1.395 -0.135 1.393 18533
24 1 4 "Average Difference" HN 149 0.723 -0.057 0.723 18533
25 1 5 "Average Difference" N 149 3.264 0.205 3.268 18533
26 1 5 "Average Difference" HA 175 0.398 0.027 0.398 18533
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18533
28 1 5 "Average Difference" CA 161 1.005 -0.237 0.980 18533
29 1 5 "Average Difference" CB 147 1.362 -0.156 1.358 18533
30 1 5 "Average Difference" HN 149 0.705 -0.033 0.707 18533
31 1 6 "Average Difference" N 149 3.297 0.000 3.308 18533
32 1 6 "Average Difference" HA 175 0.380 0.046 0.378 18533
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18533
34 1 6 "Average Difference" CA 161 1.082 -0.292 1.046 18533
35 1 6 "Average Difference" CB 147 1.422 -0.160 1.418 18533
36 1 6 "Average Difference" HN 149 0.742 -0.073 0.741 18533
37 1 7 "Average Difference" N 149 3.243 -0.024 3.253 18533
38 1 7 "Average Difference" HA 175 0.381 0.043 0.380 18533
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18533
40 1 7 "Average Difference" CA 161 1.023 -0.289 0.985 18533
41 1 7 "Average Difference" CB 147 1.389 -0.126 1.388 18533
42 1 7 "Average Difference" HN 149 0.751 -0.052 0.752 18533
43 1 8 "Average Difference" N 149 3.206 0.203 3.210 18533
44 1 8 "Average Difference" HA 175 0.374 0.041 0.373 18533
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18533
46 1 8 "Average Difference" CA 161 0.994 -0.230 0.970 18533
47 1 8 "Average Difference" CB 147 1.366 -0.170 1.360 18533
48 1 8 "Average Difference" HN 149 0.705 -0.042 0.706 18533
49 1 9 "Average Difference" N 149 3.382 -0.038 3.393 18533
50 1 9 "Average Difference" HA 175 0.370 0.056 0.367 18533
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18533
52 1 9 "Average Difference" CA 161 1.057 -0.285 1.021 18533
53 1 9 "Average Difference" CB 147 1.395 -0.143 1.393 18533
54 1 9 "Average Difference" HN 149 0.751 -0.052 0.751 18533
55 1 10 "Average Difference" N 149 3.239 0.081 3.249 18533
56 1 10 "Average Difference" HA 175 0.391 0.033 0.391 18533
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18533
58 1 10 "Average Difference" CA 161 1.079 -0.295 1.041 18533
59 1 10 "Average Difference" CB 147 1.388 -0.160 1.383 18533
60 1 10 "Average Difference" HN 149 0.727 -0.059 0.728 18533
61 1 11 "Average Difference" N 149 3.176 0.099 3.185 18533
62 1 11 "Average Difference" HA 175 0.370 0.038 0.369 18533
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18533
64 1 11 "Average Difference" CA 161 1.010 -0.253 0.980 18533
65 1 11 "Average Difference" CB 147 1.410 -0.214 1.399 18533
66 1 11 "Average Difference" HN 149 0.703 -0.060 0.702 18533
67 1 12 "Average Difference" N 149 3.144 0.251 3.145 18533
68 1 12 "Average Difference" HA 175 0.367 0.048 0.365 18533
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18533
70 1 12 "Average Difference" CA 161 1.008 -0.233 0.984 18533
71 1 12 "Average Difference" CB 147 1.375 -0.187 1.367 18533
72 1 12 "Average Difference" HN 149 0.696 -0.047 0.697 18533
73 1 13 "Average Difference" N 149 3.203 0.064 3.213 18533
74 1 13 "Average Difference" HA 175 0.390 0.038 0.389 18533
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18533
76 1 13 "Average Difference" CA 161 1.029 -0.258 0.999 18533
77 1 13 "Average Difference" CB 147 1.373 -0.182 1.365 18533
78 1 13 "Average Difference" HN 149 0.702 -0.047 0.703 18533
79 1 14 "Average Difference" N 149 3.203 0.029 3.214 18533
80 1 14 "Average Difference" HA 175 0.368 0.052 0.366 18533
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18533
82 1 14 "Average Difference" CA 161 0.991 -0.242 0.964 18533
83 1 14 "Average Difference" CB 147 1.349 -0.145 1.346 18533
84 1 14 "Average Difference" HN 149 0.692 -0.038 0.693 18533
85 1 15 "Average Difference" N 149 3.125 0.277 3.123 18533
86 1 15 "Average Difference" HA 175 0.377 0.029 0.377 18533
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18533
88 1 15 "Average Difference" CA 161 1.060 -0.245 1.035 18533
89 1 15 "Average Difference" CB 147 1.339 -0.139 1.336 18533
90 1 15 "Average Difference" HN 149 0.721 -0.051 0.722 18533
91 1 16 "Average Difference" N 149 3.220 0.086 3.230 18533
92 1 16 "Average Difference" HA 175 0.371 0.046 0.369 18533
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18533
94 1 16 "Average Difference" CA 161 1.052 -0.294 1.013 18533
95 1 16 "Average Difference" CB 147 1.379 -0.146 1.376 18533
96 1 16 "Average Difference" HN 149 0.722 -0.032 0.724 18533
97 1 17 "Average Difference" N 149 3.244 0.357 3.235 18533
98 1 17 "Average Difference" HA 175 0.387 0.039 0.386 18533
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18533
100 1 17 "Average Difference" CA 161 1.019 -0.257 0.989 18533
101 1 17 "Average Difference" CB 147 1.410 -0.236 1.395 18533
102 1 17 "Average Difference" HN 149 0.734 -0.076 0.732 18533
103 1 18 "Average Difference" N 149 3.232 0.140 3.240 18533
104 1 18 "Average Difference" HA 175 0.389 0.032 0.389 18533
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18533
106 1 18 "Average Difference" CA 161 1.168 -0.267 1.140 18533
107 1 18 "Average Difference" CB 147 1.439 -0.195 1.430 18533
108 1 18 "Average Difference" HN 149 0.726 -0.076 0.724 18533
109 1 19 "Average Difference" N 149 3.172 0.164 3.179 18533
110 1 19 "Average Difference" HA 175 0.372 0.029 0.372 18533
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18533
112 1 19 "Average Difference" CA 161 1.042 -0.247 1.015 18533
113 1 19 "Average Difference" CB 147 1.353 -0.151 1.349 18533
114 1 19 "Average Difference" HN 149 0.707 -0.052 0.707 18533
115 1 20 "Average Difference" N 149 3.160 0.090 3.170 18533
116 1 20 "Average Difference" HA 175 0.372 0.039 0.371 18533
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18533
118 1 20 "Average Difference" CA 161 0.996 -0.227 0.972 18533
119 1 20 "Average Difference" CB 147 1.409 -0.209 1.398 18533
120 1 20 "Average Difference" HN 149 0.705 -0.047 0.706 18533
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 18533
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 MET N N 1 119.850 119.850 120.052 -0.202 18533
2 1 . 1 1 2 2 MET HA H 1 4.500 4.500 4.585 -0.085 18533
3 1 . 1 1 2 2 MET CA C 1 55.450 55.450 55.342 0.108 18533
4 1 . 1 1 2 2 MET CB C 1 33.170 33.170 33.032 0.138 18533
5 1 . 1 1 2 2 MET H H 1 8.140 8.140 8.287 -0.147 18533
6 1 . 1 1 3 3 SER N N 2 117.000 117.000 116.282 0.718 18533
7 1 . 1 1 3 3 SER HA H 2 4.430 4.430 4.601 -0.171 18533
8 1 . 1 1 3 3 SER CA C 2 58.320 58.320 57.966 0.354 18533
9 1 . 1 1 3 3 SER CB C 2 63.990 63.990 64.461 -0.471 18533
10 1 . 1 1 3 3 SER H H 2 8.340 8.340 8.106 0.234 18533
11 1 . 1 1 4 4 ASP N N 3 123.200 123.200 122.363 0.837 18533
12 1 . 1 1 4 4 ASP HA H 3 4.860 4.860 4.805 0.055 18533
13 1 . 1 1 4 4 ASP CA C 3 52.880 52.880 52.739 0.141 18533
14 1 . 1 1 4 4 ASP CB C 3 40.800 40.800 40.656 0.144 18533
15 1 . 1 1 4 4 ASP H H 3 8.260 8.260 8.265 -0.005 18533
16 1 . 1 1 5 5 PRO HA H 4 4.400 4.400 4.479 -0.079 18533
17 1 . 1 1 5 5 PRO CA C 4 62.820 62.820 62.546 0.274 18533
18 1 . 1 1 5 5 PRO CB C 4 31.910 31.910 32.663 -0.753 18533
19 1 . 1 1 6 6 LEU N N 5 123.160 123.160 120.126 3.034 18533
20 1 . 1 1 6 6 LEU HA H 5 4.390 4.390 4.381 0.009 18533
21 1 . 1 1 6 6 LEU CA C 5 55.280 55.280 55.020 0.260 18533
22 1 . 1 1 6 6 LEU CB C 5 44.350 44.350 43.234 1.116 18533
23 1 . 1 1 6 6 LEU H H 5 7.670 7.670 8.068 -0.398 18533
24 1 . 1 1 7 7 HIS N N 6 127.160 127.160 118.170 8.990 18533
25 1 . 1 1 7 7 HIS HA H 6 6.030 6.030 5.041 0.989 18533
26 1 . 1 1 7 7 HIS CA C 6 52.900 52.900 55.131 -2.231 18533
27 1 . 1 1 7 7 HIS CB C 6 32.130 32.130 31.262 0.868 18533
28 1 . 1 1 7 7 HIS H H 6 10.080 10.080 8.664 1.416 18533
29 1 . 1 1 8 8 VAL N N 7 128.620 128.620 127.310 1.310 18533
30 1 . 1 1 8 8 VAL HA H 7 4.500 4.500 4.892 -0.392 18533
31 1 . 1 1 8 8 VAL CA C 7 60.800 60.800 61.024 -0.224 18533
32 1 . 1 1 8 8 VAL CB C 7 34.800 34.800 31.917 2.883 18533
33 1 . 1 1 8 8 VAL H H 7 8.930 8.930 8.946 -0.016 18533
34 1 . 1 1 9 9 THR N N 8 121.530 121.530 123.036 -1.506 18533
35 1 . 1 1 9 9 THR HA H 8 5.270 5.270 4.706 0.564 18533
36 1 . 1 1 9 9 THR CA C 8 58.520 58.520 59.222 -0.702 18533
37 1 . 1 1 9 9 THR CB C 8 70.750 70.750 69.669 1.081 18533
38 1 . 1 1 9 9 THR H H 8 7.970 7.970 8.947 -0.977 18533
39 1 . 1 1 10 10 PHE N N 9 125.360 125.360 128.353 -2.993 18533
40 1 . 1 1 10 10 PHE HA H 9 5.210 5.210 5.054 0.156 18533
41 1 . 1 1 10 10 PHE CA C 9 56.310 56.310 55.991 0.319 18533
42 1 . 1 1 10 10 PHE CB C 9 42.830 42.830 39.547 3.283 18533
43 1 . 1 1 10 10 PHE H H 9 8.180 8.180 8.162 0.018 18533
44 1 . 1 1 11 11 VAL N N 10 121.120 121.120 122.210 -1.090 18533
45 1 . 1 1 11 11 VAL HA H 10 5.360 5.360 5.280 0.080 18533
46 1 . 1 1 11 11 VAL CA C 10 60.420 60.420 60.987 -0.567 18533
47 1 . 1 1 11 11 VAL CB C 10 35.550 35.550 33.294 2.256 18533
48 1 . 1 1 11 11 VAL H H 10 8.710 8.710 9.218 -0.508 18533
49 1 . 1 1 12 12 CYS N N 11 123.270 123.270 125.564 -2.294 18533
50 1 . 1 1 12 12 CYS HA H 11 3.260 3.260 4.411 -1.151 18533
51 1 . 1 1 12 12 CYS CA C 11 57.630 57.630 56.240 1.390 18533
52 1 . 1 1 12 12 CYS CB C 11 30.350 30.350 31.511 -1.161 18533
53 1 . 1 1 12 12 CYS H H 11 7.940 7.940 8.648 -0.708 18533
54 1 . 1 1 13 13 THR HA H 12 5.010 5.010 4.058 0.952 18533
55 1 . 1 1 13 13 THR CA C 12 64.870 64.870 63.359 1.511 18533
56 1 . 1 1 13 13 THR CB C 12 69.180 69.180 67.342 1.838 18533
57 1 . 1 1 14 14 GLY CA C 13 44.960 44.960 45.009 -0.049 18533
58 1 . 1 1 15 15 ASN N N 14 119.960 119.960 117.359 2.601 18533
59 1 . 1 1 15 15 ASN HA H 14 3.930 3.930 4.356 -0.426 18533
60 1 . 1 1 15 15 ASN CA C 14 54.870 54.870 54.292 0.578 18533
61 1 . 1 1 15 15 ASN CB C 14 40.670 40.670 37.562 3.108 18533
62 1 . 1 1 15 15 ASN H H 14 9.280 9.280 8.468 0.812 18533
63 1 . 1 1 16 16 ILE N N 15 101.060 101.060 109.914 -8.854 18533
64 1 . 1 1 16 16 ILE HA H 15 4.680 4.680 4.707 -0.027 18533
65 1 . 1 1 16 16 ILE CA C 15 62.790 62.790 61.210 1.580 18533
66 1 . 1 1 16 16 ILE CB C 15 42.140 42.140 38.690 3.450 18533
67 1 . 1 1 16 16 ILE H H 15 7.100 7.100 7.883 -0.783 18533
68 1 . 1 1 17 17 CYS N N 16 116.020 116.020 119.151 -3.131 18533
69 1 . 1 1 17 17 CYS HA H 16 4.940 4.940 4.756 0.184 18533
70 1 . 1 1 17 17 CYS CA C 16 60.060 60.060 59.157 0.903 18533
71 1 . 1 1 17 17 CYS CB C 16 28.950 28.950 28.875 0.075 18533
72 1 . 1 1 17 17 CYS H H 16 7.700 7.700 7.957 -0.257 18533
73 1 . 1 1 19 19 SER N N 18 122.340 122.340 115.271 7.069 18533
74 1 . 1 1 19 19 SER HA H 18 3.810 3.810 4.199 -0.389 18533
75 1 . 1 1 19 19 SER CA C 18 62.710 62.710 63.338 -0.628 18533
76 1 . 1 1 19 19 SER CB C 18 64.860 64.860 61.195 3.665 18533
77 1 . 1 1 19 19 SER H H 18 11.420 11.420 8.394 3.026 18533
78 1 . 1 1 20 20 PRO HA H 19 3.970 3.970 4.164 -0.194 18533
79 1 . 1 1 20 20 PRO CA C 19 65.030 65.030 64.931 0.099 18533
80 1 . 1 1 20 20 PRO CB C 19 28.690 28.690 30.894 -2.204 18533
81 1 . 1 1 21 21 MET N N 20 112.430 112.430 118.361 -5.931 18533
82 1 . 1 1 21 21 MET HA H 20 3.730 3.730 3.934 -0.204 18533
83 1 . 1 1 21 21 MET CA C 20 60.160 60.160 59.079 1.082 18533
84 1 . 1 1 21 21 MET CB C 20 33.040 33.040 31.837 1.204 18533
85 1 . 1 1 21 21 MET H H 20 6.310 6.310 7.488 -1.178 18533
86 1 . 1 1 22 22 ALA N N 21 117.800 117.800 119.736 -1.936 18533
87 1 . 1 1 22 22 ALA HA H 21 3.400 3.400 3.808 -0.408 18533
88 1 . 1 1 22 22 ALA CA C 21 54.990 54.990 54.396 0.594 18533
89 1 . 1 1 22 22 ALA CB C 21 16.490 16.490 17.616 -1.126 18533
90 1 . 1 1 22 22 ALA H H 21 6.550 6.550 7.443 -0.893 18533
91 1 . 1 1 23 23 GLU N N 22 115.520 115.520 118.735 -3.215 18533
92 1 . 1 1 23 23 GLU HA H 22 3.680 3.680 4.143 -0.463 18533
93 1 . 1 1 23 23 GLU CA C 22 59.550 59.550 59.750 -0.200 18533
94 1 . 1 1 23 23 GLU CB C 22 29.790 29.790 29.803 -0.013 18533
95 1 . 1 1 23 23 GLU H H 22 7.800 7.800 7.671 0.129 18533
96 1 . 1 1 24 24 LYS N N 23 114.220 114.220 116.291 -2.071 18533
97 1 . 1 1 24 24 LYS HA H 23 4.000 4.000 4.164 -0.164 18533
98 1 . 1 1 24 24 LYS CA C 23 57.760 57.760 58.033 -0.273 18533
99 1 . 1 1 24 24 LYS CB C 23 30.800 30.800 32.377 -1.577 18533
100 1 . 1 1 24 24 LYS H H 23 8.040 8.040 7.522 0.518 18533
101 1 . 1 1 25 25 MET N N 24 115.250 115.250 119.634 -4.384 18533
102 1 . 1 1 25 25 MET HA H 24 3.950 3.950 3.578 0.372 18533
103 1 . 1 1 25 25 MET CA C 24 57.980 57.980 58.907 -0.927 18533
104 1 . 1 1 25 25 MET CB C 24 35.500 35.500 32.336 3.163 18533
105 1 . 1 1 25 25 MET H H 24 7.610 7.610 7.535 0.075 18533
106 1 . 1 1 26 26 PHE N N 25 119.090 119.090 116.240 2.850 18533
107 1 . 1 1 26 26 PHE HA H 25 4.340 4.340 4.586 -0.246 18533
108 1 . 1 1 26 26 PHE CA C 25 60.030 60.030 59.776 0.254 18533
109 1 . 1 1 26 26 PHE CB C 25 39.460 39.460 37.440 2.020 18533
110 1 . 1 1 26 26 PHE H H 25 8.560 8.560 7.859 0.701 18533
111 1 . 1 1 27 27 ALA N N 26 117.830 117.830 122.564 -4.734 18533
112 1 . 1 1 27 27 ALA HA H 26 3.930 3.930 3.659 0.271 18533
113 1 . 1 1 27 27 ALA CA C 26 56.060 56.060 55.104 0.956 18533
114 1 . 1 1 27 27 ALA CB C 26 18.410 18.410 17.787 0.623 18533
115 1 . 1 1 27 27 ALA H H 26 8.800 8.800 7.276 1.524 18533
116 1 . 1 1 28 28 GLN N N 27 117.550 117.550 118.349 -0.799 18533
117 1 . 1 1 28 28 GLN HA H 27 4.050 4.050 3.992 0.058 18533
118 1 . 1 1 28 28 GLN CA C 27 59.610 59.610 58.884 0.726 18533
119 1 . 1 1 28 28 GLN CB C 27 28.450 28.450 27.910 0.540 18533
120 1 . 1 1 28 28 GLN H H 27 7.690 7.690 7.795 -0.105 18533
121 1 . 1 1 29 29 GLN N N 28 117.530 117.530 119.821 -2.291 18533
122 1 . 1 1 29 29 GLN HA H 28 4.140 4.140 4.055 0.085 18533
123 1 . 1 1 29 29 GLN CA C 28 59.180 59.180 58.811 0.369 18533
124 1 . 1 1 29 29 GLN CB C 28 28.110 28.110 28.913 -0.802 18533
125 1 . 1 1 29 29 GLN H H 28 8.210 8.210 7.551 0.659 18533
126 1 . 1 1 30 30 LEU N N 29 119.330 119.330 119.789 -0.459 18533
127 1 . 1 1 30 30 LEU HA H 29 3.930 3.930 3.992 -0.062 18533
128 1 . 1 1 30 30 LEU CA C 29 58.080 58.080 57.981 0.099 18533
129 1 . 1 1 30 30 LEU CB C 29 41.900 41.900 41.440 0.460 18533
130 1 . 1 1 30 30 LEU H H 29 8.540 8.540 8.395 0.145 18533
131 1 . 1 1 31 31 ARG N N 30 120.880 120.880 117.876 3.004 18533
132 1 . 1 1 31 31 ARG HA H 30 3.970 3.970 4.061 -0.091 18533
133 1 . 1 1 31 31 ARG CA C 30 59.790 59.790 59.110 0.680 18533
134 1 . 1 1 31 31 ARG CB C 30 29.520 29.520 29.374 0.146 18533
135 1 . 1 1 31 31 ARG H H 30 8.050 8.050 7.990 0.060 18533
136 1 . 1 1 32 32 HIS N N 31 119.770 119.770 118.460 1.310 18533
137 1 . 1 1 32 32 HIS HA H 31 4.550 4.550 4.431 0.119 18533
138 1 . 1 1 32 32 HIS CA C 31 58.080 58.080 58.475 -0.395 18533
139 1 . 1 1 32 32 HIS CB C 31 30.710 30.710 30.229 0.481 18533
140 1 . 1 1 32 32 HIS H H 31 8.440 8.440 8.394 0.046 18533
141 1 . 1 1 33 33 ARG N N 32 115.430 115.430 117.130 -1.700 18533
142 1 . 1 1 33 33 ARG HA H 32 4.590 4.590 4.483 0.107 18533
143 1 . 1 1 33 33 ARG CA C 32 55.970 55.970 56.117 -0.147 18533
144 1 . 1 1 33 33 ARG CB C 32 31.220 31.220 31.691 -0.471 18533
145 1 . 1 1 33 33 ARG H H 32 7.500 7.500 7.801 -0.301 18533
146 1 . 1 1 34 34 GLY N N 33 106.730 106.730 108.817 -2.087 18533
147 1 . 1 1 34 34 GLY CA C 33 46.200 46.200 45.107 1.093 18533
148 1 . 1 1 34 34 GLY H H 33 7.750 7.750 8.241 -0.491 18533
149 1 . 1 1 35 35 LEU N N 34 119.980 119.980 117.394 2.586 18533
150 1 . 1 1 35 35 LEU HA H 34 4.680 4.680 4.835 -0.155 18533
151 1 . 1 1 35 35 LEU CA C 34 54.150 54.150 53.770 0.380 18533
152 1 . 1 1 35 35 LEU CB C 34 43.190 43.190 42.514 0.676 18533
153 1 . 1 1 35 35 LEU H H 34 7.980 7.980 8.503 -0.523 18533
154 1 . 1 1 36 36 GLY N N 35 108.660 108.660 109.009 -0.349 18533
155 1 . 1 1 36 36 GLY CA C 35 47.100 47.100 47.656 -0.556 18533
156 1 . 1 1 36 36 GLY H H 35 8.830 8.830 7.881 0.949 18533
157 1 . 1 1 37 37 ASP N N 36 115.360 115.360 118.967 -3.607 18533
158 1 . 1 1 37 37 ASP HA H 36 4.770 4.770 4.587 0.183 18533
159 1 . 1 1 37 37 ASP CA C 36 54.390 54.390 55.512 -1.122 18533
160 1 . 1 1 37 37 ASP CB C 36 41.170 41.170 40.867 0.303 18533
161 1 . 1 1 37 37 ASP H H 36 8.300 8.300 8.221 0.079 18533
162 1 . 1 1 38 38 ALA N N 37 121.460 121.460 120.228 1.232 18533
163 1 . 1 1 38 38 ALA HA H 37 4.310 4.310 4.283 0.027 18533
164 1 . 1 1 38 38 ALA CA C 37 52.950 52.950 53.246 -0.296 18533
165 1 . 1 1 38 38 ALA CB C 37 20.850 20.850 20.132 0.718 18533
166 1 . 1 1 38 38 ALA H H 37 7.380 7.380 7.566 -0.186 18533
167 1 . 1 1 39 39 VAL N N 38 115.660 115.660 116.800 -1.140 18533
168 1 . 1 1 39 39 VAL HA H 38 4.800 4.800 4.497 0.303 18533
169 1 . 1 1 39 39 VAL CA C 38 60.040 60.040 60.494 -0.454 18533
170 1 . 1 1 39 39 VAL CB C 38 35.190 35.190 34.605 0.585 18533
171 1 . 1 1 39 39 VAL H H 38 7.100 7.100 7.867 -0.767 18533
172 1 . 1 1 40 40 ARG N N 39 129.230 129.230 127.952 1.278 18533
173 1 . 1 1 40 40 ARG HA H 39 4.540 4.540 4.529 0.011 18533
174 1 . 1 1 40 40 ARG CA C 39 54.710 54.710 53.344 1.366 18533
175 1 . 1 1 40 40 ARG CB C 39 32.320 32.320 30.524 1.796 18533
176 1 . 1 1 40 40 ARG H H 39 9.730 9.730 8.393 1.337 18533
177 1 . 1 1 41 41 VAL N N 40 126.240 126.240 124.175 2.065 18533
178 1 . 1 1 41 41 VAL HA H 40 5.690 5.690 4.837 0.853 18533
179 1 . 1 1 41 41 VAL CA C 40 60.560 60.560 61.084 -0.524 18533
180 1 . 1 1 41 41 VAL CB C 40 33.940 33.940 34.004 -0.064 18533
181 1 . 1 1 41 41 VAL H H 40 8.610 8.610 8.389 0.221 18533
182 1 . 1 1 42 42 THR N N 41 117.310 117.310 118.136 -0.826 18533
183 1 . 1 1 42 42 THR HA H 41 4.890 4.890 4.851 0.039 18533
184 1 . 1 1 42 42 THR CA C 41 60.300 60.300 59.739 0.561 18533
185 1 . 1 1 42 42 THR CB C 41 73.890 73.890 71.535 2.355 18533
186 1 . 1 1 42 42 THR H H 41 8.870 8.870 8.949 -0.079 18533
187 1 . 1 1 43 43 SER N N 42 109.960 109.960 113.385 -3.425 18533
188 1 . 1 1 43 43 SER HA H 42 5.720 5.720 5.031 0.689 18533
189 1 . 1 1 43 43 SER CA C 42 58.090 58.090 57.836 0.255 18533
190 1 . 1 1 43 43 SER CB C 42 65.870 65.870 66.540 -0.670 18533
191 1 . 1 1 43 43 SER H H 42 8.060 8.060 8.608 -0.548 18533
192 1 . 1 1 44 44 ALA N N 43 119.200 119.200 119.840 -0.640 18533
193 1 . 1 1 44 44 ALA HA H 43 4.260 4.260 5.177 -0.917 18533
194 1 . 1 1 44 44 ALA CA C 43 51.180 51.180 51.755 -0.575 18533
195 1 . 1 1 44 44 ALA CB C 43 20.830 20.830 21.992 -1.162 18533
196 1 . 1 1 44 44 ALA H H 43 8.710 8.710 9.060 -0.350 18533
197 1 . 1 1 45 45 GLY N N 44 104.090 104.090 106.403 -2.313 18533
198 1 . 1 1 45 45 GLY CA C 44 42.540 42.540 44.166 -1.626 18533
199 1 . 1 1 45 45 GLY H H 44 8.670 8.670 8.211 0.459 18533
200 1 . 1 1 46 46 THR N N 45 114.060 114.060 116.626 -2.566 18533
201 1 . 1 1 46 46 THR HA H 45 4.080 4.080 4.133 -0.053 18533
202 1 . 1 1 46 46 THR CA C 45 64.680 64.680 64.530 0.151 18533
203 1 . 1 1 46 46 THR CB C 45 67.880 67.880 68.684 -0.805 18533
204 1 . 1 1 46 46 THR H H 45 9.120 9.120 8.389 0.731 18533
205 1 . 1 1 47 47 GLY N N 46 110.380 110.380 108.354 2.026 18533
206 1 . 1 1 47 47 GLY CA C 46 43.830 43.830 43.925 -0.095 18533
207 1 . 1 1 47 47 GLY H H 46 8.930 8.930 8.331 0.600 18533
208 1 . 1 1 48 48 ASN N N 47 113.440 113.440 117.412 -3.972 18533
209 1 . 1 1 48 48 ASN HA H 47 4.490 4.490 4.345 0.145 18533
210 1 . 1 1 48 48 ASN CA C 47 51.760 51.760 54.285 -2.524 18533
211 1 . 1 1 48 48 ASN CB C 47 38.850 38.850 36.728 2.122 18533
212 1 . 1 1 48 48 ASN H H 47 7.600 7.600 7.648 -0.048 18533
213 1 . 1 1 49 49 TRP N N 48 117.300 117.300 121.368 -4.068 18533
214 1 . 1 1 49 49 TRP HA H 48 3.900 3.900 4.375 -0.475 18533
215 1 . 1 1 49 49 TRP CA C 48 60.860 60.860 60.427 0.433 18533
216 1 . 1 1 49 49 TRP CB C 48 28.520 28.520 29.018 -0.497 18533
217 1 . 1 1 49 49 TRP H H 48 6.920 6.920 8.560 -1.640 18533
218 1 . 1 1 50 50 HIS N N 49 111.590 111.590 114.916 -3.326 18533
219 1 . 1 1 50 50 HIS HA H 49 4.880 4.880 4.816 0.064 18533
220 1 . 1 1 50 50 HIS CA C 49 53.860 53.860 55.402 -1.542 18533
221 1 . 1 1 50 50 HIS CB C 49 31.040 31.040 29.754 1.286 18533
222 1 . 1 1 50 50 HIS H H 49 8.620 8.620 8.439 0.181 18533
223 1 . 1 1 51 51 VAL N N 50 119.010 119.010 120.405 -1.395 18533
224 1 . 1 1 51 51 VAL HA H 50 3.200 3.200 3.700 -0.500 18533
225 1 . 1 1 51 51 VAL CA C 50 65.680 65.680 64.575 1.105 18533
226 1 . 1 1 51 51 VAL CB C 50 31.390 31.390 31.651 -0.261 18533
227 1 . 1 1 51 51 VAL H H 50 6.880 6.880 7.437 -0.557 18533
228 1 . 1 1 52 52 GLY N N 51 115.450 115.450 116.337 -0.887 18533
229 1 . 1 1 52 52 GLY CA C 51 44.940 44.940 45.367 -0.427 18533
230 1 . 1 1 52 52 GLY H H 51 9.120 9.120 9.079 0.041 18533
231 1 . 1 1 53 53 SER N N 52 116.620 116.620 115.634 0.986 18533
232 1 . 1 1 53 53 SER HA H 52 4.610 4.610 4.701 -0.091 18533
233 1 . 1 1 53 53 SER CA C 52 59.310 59.310 57.819 1.491 18533
234 1 . 1 1 53 53 SER CB C 52 64.630 64.630 65.078 -0.448 18533
235 1 . 1 1 53 53 SER H H 52 8.430 8.430 8.055 0.375 18533
236 1 . 1 1 54 54 CYS N N 53 118.690 118.690 118.033 0.657 18533
237 1 . 1 1 54 54 CYS HA H 53 5.100 5.100 5.380 -0.280 18533
238 1 . 1 1 54 54 CYS CA C 53 57.670 57.670 56.108 1.562 18533
239 1 . 1 1 54 54 CYS CB C 53 28.350 28.350 31.347 -2.997 18533
240 1 . 1 1 54 54 CYS H H 53 8.170 8.170 8.436 -0.266 18533
241 1 . 1 1 55 55 ALA N N 54 118.580 118.580 124.148 -5.568 18533
242 1 . 1 1 55 55 ALA HA H 54 4.120 4.120 4.182 -0.062 18533
243 1 . 1 1 55 55 ALA CA C 54 52.640 52.640 52.886 -0.246 18533
244 1 . 1 1 55 55 ALA CB C 54 16.630 16.630 19.289 -2.659 18533
245 1 . 1 1 55 55 ALA H H 54 8.420 8.420 8.541 -0.121 18533
246 1 . 1 1 56 56 ASP N N 55 121.500 121.500 122.916 -1.416 18533
247 1 . 1 1 56 56 ASP HA H 55 4.340 4.340 4.402 -0.062 18533
248 1 . 1 1 56 56 ASP CA C 55 55.050 55.050 54.586 0.464 18533
249 1 . 1 1 56 56 ASP CB C 55 46.060 46.060 42.483 3.577 18533
250 1 . 1 1 56 56 ASP H H 55 8.470 8.470 8.390 0.080 18533
251 1 . 1 1 57 57 GLU N N 56 127.840 127.840 125.795 2.045 18533
252 1 . 1 1 57 57 GLU HA H 56 4.040 4.040 3.826 0.214 18533
253 1 . 1 1 57 57 GLU CA C 56 59.640 59.640 59.318 0.322 18533
254 1 . 1 1 57 57 GLU CB C 56 29.500 29.500 29.268 0.232 18533
255 1 . 1 1 57 57 GLU H H 56 9.230 9.230 8.852 0.378 18533
256 1 . 1 1 58 58 ARG N N 57 120.820 120.820 118.580 2.240 18533
257 1 . 1 1 58 58 ARG HA H 57 3.810 3.810 3.717 0.093 18533
258 1 . 1 1 58 58 ARG CA C 57 58.150 58.150 58.337 -0.187 18533
259 1 . 1 1 58 58 ARG CB C 57 27.270 27.270 28.892 -1.622 18533
260 1 . 1 1 58 58 ARG H H 57 9.220 9.220 8.570 0.650 18533
261 1 . 1 1 59 59 ALA N N 58 121.590 121.590 122.279 -0.689 18533
262 1 . 1 1 59 59 ALA HA H 58 4.160 4.160 4.142 0.018 18533
263 1 . 1 1 59 59 ALA CA C 58 54.780 54.780 54.450 0.330 18533
264 1 . 1 1 59 59 ALA CB C 58 18.490 18.490 18.182 0.308 18533
265 1 . 1 1 59 59 ALA H H 58 6.680 6.680 7.646 -0.966 18533
266 1 . 1 1 60 60 ALA N N 59 118.970 118.970 121.522 -2.552 18533
267 1 . 1 1 60 60 ALA HA H 59 3.860 3.860 3.952 -0.092 18533
268 1 . 1 1 60 60 ALA CA C 59 55.020 55.020 55.222 -0.202 18533
269 1 . 1 1 60 60 ALA CB C 59 18.070 18.070 18.350 -0.280 18533
270 1 . 1 1 60 60 ALA H H 59 8.540 8.540 8.459 0.081 18533
271 1 . 1 1 61 61 GLY N N 60 104.160 104.160 106.771 -2.611 18533
272 1 . 1 1 61 61 GLY CA C 60 47.270 47.270 47.048 0.222 18533
273 1 . 1 1 61 61 GLY H H 60 8.210 8.210 8.024 0.186 18533
274 1 . 1 1 62 62 VAL N N 61 122.820 122.820 122.039 0.781 18533
275 1 . 1 1 62 62 VAL HA H 61 3.850 3.850 3.667 0.183 18533
276 1 . 1 1 62 62 VAL CA C 61 66.250 66.250 66.097 0.152 18533
277 1 . 1 1 62 62 VAL CB C 61 31.890 31.890 31.598 0.292 18533
278 1 . 1 1 62 62 VAL H H 61 7.310 7.310 7.684 -0.374 18533
279 1 . 1 1 63 63 LEU N N 62 120.310 120.310 119.696 0.614 18533
280 1 . 1 1 63 63 LEU HA H 62 3.980 3.980 4.228 -0.248 18533
281 1 . 1 1 63 63 LEU CA C 62 58.950 58.950 58.361 0.589 18533
282 1 . 1 1 63 63 LEU CB C 62 41.500 41.500 41.378 0.122 18533
283 1 . 1 1 63 63 LEU H H 62 8.090 8.090 8.440 -0.350 18533
284 1 . 1 1 64 64 ARG N N 63 119.440 119.440 119.456 -0.017 18533
285 1 . 1 1 64 64 ARG HA H 63 4.180 4.180 4.306 -0.126 18533
286 1 . 1 1 64 64 ARG CA C 63 59.450 59.450 58.875 0.575 18533
287 1 . 1 1 64 64 ARG CB C 63 30.380 30.380 29.576 0.804 18533
288 1 . 1 1 64 64 ARG H H 63 8.740 8.740 8.495 0.245 18533
289 1 . 1 1 65 65 ALA N N 64 122.560 122.560 121.698 0.862 18533
290 1 . 1 1 65 65 ALA HA H 64 4.030 4.030 4.097 -0.067 18533
291 1 . 1 1 65 65 ALA CA C 64 54.540 54.540 54.099 0.441 18533
292 1 . 1 1 65 65 ALA CB C 64 18.080 18.080 18.284 -0.204 18533
293 1 . 1 1 65 65 ALA H H 64 7.910 7.910 7.840 0.070 18533
294 1 . 1 1 66 66 HIS N N 65 112.690 112.690 114.833 -2.143 18533
295 1 . 1 1 66 66 HIS HA H 65 4.640 4.640 4.656 -0.016 18533
296 1 . 1 1 66 66 HIS CA C 65 55.500 55.500 56.064 -0.564 18533
297 1 . 1 1 66 66 HIS CB C 65 30.320 30.320 30.005 0.315 18533
298 1 . 1 1 66 66 HIS H H 65 7.410 7.410 7.821 -0.411 18533
299 1 . 1 1 67 67 GLY N N 66 107.440 107.440 106.696 0.744 18533
300 1 . 1 1 67 67 GLY CA C 66 46.360 46.360 45.217 1.143 18533
301 1 . 1 1 67 67 GLY H H 66 7.850 7.850 7.614 0.236 18533
302 1 . 1 1 68 68 TYR N N 67 119.940 119.940 121.124 -1.184 18533
303 1 . 1 1 68 68 TYR HA H 67 4.800 4.800 4.801 -0.001 18533
304 1 . 1 1 68 68 TYR CA C 67 57.100 57.100 56.265 0.835 18533
305 1 . 1 1 68 68 TYR CB C 67 39.860 39.860 38.963 0.897 18533
306 1 . 1 1 68 68 TYR H H 67 8.380 8.380 8.299 0.081 18533
307 1 . 1 1 69 69 PRO HA H 68 4.560 4.560 4.526 0.034 18533
308 1 . 1 1 69 69 PRO CA C 68 62.600 62.600 62.905 -0.305 18533
309 1 . 1 1 69 69 PRO CB C 68 32.810 32.810 32.531 0.280 18533
310 1 . 1 1 70 70 THR N N 69 100.660 100.660 107.081 -6.421 18533
311 1 . 1 1 70 70 THR HA H 69 4.300 4.300 4.426 -0.126 18533
312 1 . 1 1 70 70 THR CA C 69 61.250 61.250 61.150 0.100 18533
313 1 . 1 1 70 70 THR CB C 69 70.740 70.740 69.677 1.063 18533
314 1 . 1 1 70 70 THR H H 69 7.860 7.860 8.035 -0.175 18533
315 1 . 1 1 71 71 ASP N N 70 122.880 122.880 122.638 0.242 18533
316 1 . 1 1 71 71 ASP HA H 70 4.410 4.410 4.647 -0.237 18533
317 1 . 1 1 71 71 ASP CA C 70 55.870 55.870 54.807 1.063 18533
318 1 . 1 1 71 71 ASP CB C 70 40.970 40.970 41.700 -0.730 18533
319 1 . 1 1 71 71 ASP H H 70 7.940 7.940 7.885 0.055 18533
320 1 . 1 1 72 72 HIS N N 71 121.720 121.720 123.654 -1.934 18533
321 1 . 1 1 72 72 HIS HA H 71 4.700 4.700 4.783 -0.083 18533
322 1 . 1 1 72 72 HIS CA C 71 57.390 57.390 56.191 1.199 18533
323 1 . 1 1 72 72 HIS CB C 71 35.340 35.340 32.712 2.628 18533
324 1 . 1 1 72 72 HIS H H 71 8.000 8.000 8.130 -0.130 18533
325 1 . 1 1 73 73 ARG N N 72 125.760 125.760 125.901 -0.141 18533
326 1 . 1 1 73 73 ARG HA H 72 4.290 4.290 4.989 -0.699 18533
327 1 . 1 1 73 73 ARG CA C 72 54.430 54.430 54.114 0.316 18533
328 1 . 1 1 73 73 ARG CB C 72 32.310 32.310 31.837 0.473 18533
329 1 . 1 1 73 73 ARG H H 72 7.230 7.230 8.098 -0.868 18533
330 1 . 1 1 74 74 ALA N N 73 127.970 127.970 129.277 -1.307 18533
331 1 . 1 1 74 74 ALA HA H 73 4.630 4.630 4.400 0.230 18533
332 1 . 1 1 74 74 ALA CA C 73 52.180 52.180 52.596 -0.416 18533
333 1 . 1 1 74 74 ALA CB C 73 18.900 18.900 20.124 -1.224 18533
334 1 . 1 1 74 74 ALA H H 73 9.090 9.090 8.228 0.862 18533
335 1 . 1 1 75 75 ALA N N 74 126.090 126.090 125.223 0.867 18533
336 1 . 1 1 75 75 ALA HA H 74 4.790 4.790 4.792 -0.002 18533
337 1 . 1 1 75 75 ALA CA C 74 50.970 50.970 50.542 0.428 18533
338 1 . 1 1 75 75 ALA CB C 74 23.620 23.620 22.017 1.603 18533
339 1 . 1 1 75 75 ALA H H 74 9.410 9.410 8.824 0.586 18533
340 1 . 1 1 76 76 GLN N N 75 123.260 123.260 119.857 3.403 18533
341 1 . 1 1 76 76 GLN HA H 75 4.950 4.950 4.672 0.278 18533
342 1 . 1 1 76 76 GLN CA C 75 53.550 53.550 53.896 -0.346 18533
343 1 . 1 1 76 76 GLN CB C 75 30.050 30.050 31.155 -1.105 18533
344 1 . 1 1 76 76 GLN H H 75 8.800 8.800 8.401 0.399 18533
345 1 . 1 1 77 77 VAL N N 76 125.510 125.510 123.667 1.843 18533
346 1 . 1 1 77 77 VAL HA H 76 3.300 3.300 3.445 -0.145 18533
347 1 . 1 1 77 77 VAL CA C 76 63.580 63.580 63.494 0.086 18533
348 1 . 1 1 77 77 VAL CB C 76 32.490 32.490 30.362 2.128 18533
349 1 . 1 1 77 77 VAL H H 76 8.550 8.550 7.987 0.563 18533
350 1 . 1 1 78 78 GLY N N 77 121.850 121.850 116.345 5.505 18533
351 1 . 1 1 78 78 GLY CA C 77 43.840 43.840 44.172 -0.332 18533
352 1 . 1 1 78 78 GLY H H 77 10.930 10.930 8.194 2.736 18533
353 1 . 1 1 79 79 THR N N 78 115.210 115.210 116.017 -0.807 18533
354 1 . 1 1 79 79 THR HA H 78 3.700 3.700 3.956 -0.256 18533
355 1 . 1 1 79 79 THR CA C 78 66.440 66.440 67.412 -0.972 18533
356 1 . 1 1 79 79 THR CB C 78 68.770 68.770 68.753 0.017 18533
357 1 . 1 1 79 79 THR H H 78 8.540 8.540 8.436 0.104 18533
358 1 . 1 1 80 80 GLU N N 79 119.360 119.360 119.019 0.341 18533
359 1 . 1 1 80 80 GLU HA H 79 3.960 3.960 3.998 -0.038 18533
360 1 . 1 1 80 80 GLU CA C 79 59.030 59.030 58.847 0.183 18533
361 1 . 1 1 80 80 GLU CB C 79 29.060 29.060 28.696 0.364 18533
362 1 . 1 1 80 80 GLU H H 79 9.110 9.110 8.890 0.220 18533
363 1 . 1 1 81 81 HIS N N 80 118.380 118.380 117.109 1.271 18533
364 1 . 1 1 81 81 HIS HA H 80 3.940 3.940 4.257 -0.317 18533
365 1 . 1 1 81 81 HIS CA C 80 60.420 60.420 58.953 1.467 18533
366 1 . 1 1 81 81 HIS CB C 80 30.930 30.930 30.215 0.715 18533
367 1 . 1 1 81 81 HIS H H 80 7.040 7.040 7.508 -0.468 18533
368 1 . 1 1 82 82 LEU N N 81 114.010 114.010 119.793 -5.783 18533
369 1 . 1 1 82 82 LEU HA H 81 3.900 3.900 4.086 -0.186 18533
370 1 . 1 1 82 82 LEU CA C 81 56.680 56.680 56.863 -0.183 18533
371 1 . 1 1 82 82 LEU CB C 81 40.730 40.730 41.471 -0.741 18533
372 1 . 1 1 82 82 LEU H H 81 7.850 7.850 8.311 -0.461 18533
373 1 . 1 1 83 83 ALA N N 82 119.050 119.050 118.200 0.850 18533
374 1 . 1 1 83 83 ALA HA H 82 4.390 4.390 4.280 0.110 18533
375 1 . 1 1 83 83 ALA CA C 82 51.200 51.200 51.481 -0.281 18533
376 1 . 1 1 83 83 ALA CB C 82 19.180 19.180 18.783 0.397 18533
377 1 . 1 1 83 83 ALA H H 82 6.950 6.950 7.386 -0.436 18533
378 1 . 1 1 84 84 ALA N N 83 122.500 122.500 121.776 0.724 18533
379 1 . 1 1 84 84 ALA HA H 83 3.760 3.760 4.166 -0.406 18533
380 1 . 1 1 84 84 ALA CA C 83 53.350 53.350 51.834 1.516 18533
381 1 . 1 1 84 84 ALA CB C 83 17.320 17.320 19.428 -2.108 18533
382 1 . 1 1 84 84 ALA H H 83 7.280 7.280 7.243 0.037 18533
383 1 . 1 1 85 85 ASP N N 84 118.740 118.740 120.307 -1.567 18533
384 1 . 1 1 85 85 ASP HA H 84 4.410 4.410 4.719 -0.309 18533
385 1 . 1 1 85 85 ASP CA C 84 57.640 57.640 56.286 1.354 18533
386 1 . 1 1 85 85 ASP CB C 84 42.900 42.900 42.071 0.829 18533
387 1 . 1 1 85 85 ASP H H 84 8.440 8.440 8.498 -0.058 18533
388 1 . 1 1 86 86 LEU N N 85 115.180 115.180 118.636 -3.456 18533
389 1 . 1 1 86 86 LEU HA H 85 4.180 4.180 4.869 -0.689 18533
390 1 . 1 1 86 86 LEU CA C 85 55.040 55.040 53.882 1.158 18533
391 1 . 1 1 86 86 LEU CB C 85 45.170 45.170 44.765 0.405 18533
392 1 . 1 1 86 86 LEU H H 85 7.280 7.280 8.170 -0.890 18533
393 1 . 1 1 87 87 LEU N N 86 128.140 128.140 127.528 0.612 18533
394 1 . 1 1 87 87 LEU HA H 86 4.690 4.690 4.940 -0.250 18533
395 1 . 1 1 87 87 LEU CA C 86 55.380 55.380 53.659 1.721 18533
396 1 . 1 1 87 87 LEU CB C 86 42.170 42.170 42.465 -0.295 18533
397 1 . 1 1 87 87 LEU H H 86 8.780 8.780 9.040 -0.260 18533
398 1 . 1 1 88 88 VAL N N 87 122.630 122.630 127.043 -4.413 18533
399 1 . 1 1 88 88 VAL HA H 87 4.630 4.630 4.844 -0.214 18533
400 1 . 1 1 88 88 VAL CA C 87 59.910 59.910 61.850 -1.940 18533
401 1 . 1 1 88 88 VAL CB C 87 30.840 30.840 31.204 -0.364 18533
402 1 . 1 1 88 88 VAL H H 87 9.010 9.010 8.811 0.199 18533
403 1 . 1 1 89 89 ALA N N 88 129.820 129.820 131.419 -1.599 18533
404 1 . 1 1 89 89 ALA HA H 88 4.520 4.520 4.902 -0.382 18533
405 1 . 1 1 89 89 ALA CA C 88 50.780 50.780 51.380 -0.600 18533
406 1 . 1 1 89 89 ALA CB C 88 20.780 20.780 21.163 -0.383 18533
407 1 . 1 1 89 89 ALA H H 88 8.590 8.590 9.148 -0.558 18533
408 1 . 1 1 90 90 LEU N N 89 129.280 129.280 119.904 9.376 18533
409 1 . 1 1 90 90 LEU HA H 89 4.310 4.310 4.616 -0.306 18533
410 1 . 1 1 90 90 LEU CA C 89 55.450 55.450 54.945 0.505 18533
411 1 . 1 1 90 90 LEU CB C 89 38.020 38.020 41.898 -3.878 18533
412 1 . 1 1 90 90 LEU H H 89 8.570 8.570 8.612 -0.042 18533
413 1 . 1 1 91 91 ASP N N 90 126.910 126.910 116.435 10.475 18533
414 1 . 1 1 91 91 ASP HA H 90 4.800 4.800 4.815 -0.015 18533
415 1 . 1 1 91 91 ASP CA C 90 52.950 52.950 53.066 -0.116 18533
416 1 . 1 1 91 91 ASP CB C 90 43.810 43.810 43.371 0.439 18533
417 1 . 1 1 91 91 ASP H H 90 11.450 11.450 7.511 3.939 18533
418 1 . 1 1 92 92 ARG N N 91 116.950 116.950 120.974 -4.024 18533
419 1 . 1 1 92 92 ARG HA H 91 4.020 4.020 3.923 0.097 18533
420 1 . 1 1 92 92 ARG CA C 91 58.830 58.830 59.274 -0.444 18533
421 1 . 1 1 92 92 ARG CB C 91 30.280 30.280 29.789 0.491 18533
422 1 . 1 1 92 92 ARG H H 91 8.650 8.650 8.457 0.193 18533
423 1 . 1 1 93 93 ASN N N 92 120.740 120.740 118.594 2.146 18533
424 1 . 1 1 93 93 ASN HA H 92 4.380 4.380 4.527 -0.147 18533
425 1 . 1 1 93 93 ASN CA C 92 56.130 56.130 55.788 0.342 18533
426 1 . 1 1 93 93 ASN CB C 92 37.620 37.620 37.932 -0.312 18533
427 1 . 1 1 93 93 ASN H H 92 8.610 8.610 8.315 0.295 18533
428 1 . 1 1 94 94 HIS N N 93 121.170 121.170 120.097 1.073 18533
429 1 . 1 1 94 94 HIS HA H 93 4.190 4.190 4.236 -0.046 18533
430 1 . 1 1 94 94 HIS CA C 93 59.510 59.510 59.104 0.406 18533
431 1 . 1 1 94 94 HIS CB C 93 31.380 31.380 29.616 1.764 18533
432 1 . 1 1 94 94 HIS H H 93 7.430 7.430 8.319 -0.889 18533
433 1 . 1 1 95 95 ALA N N 94 118.270 118.270 121.267 -2.997 18533
434 1 . 1 1 95 95 ALA HA H 94 3.740 3.740 3.957 -0.217 18533
435 1 . 1 1 95 95 ALA CA C 94 55.500 55.500 55.460 0.040 18533
436 1 . 1 1 95 95 ALA CB C 94 17.970 17.970 18.337 -0.367 18533
437 1 . 1 1 95 95 ALA H H 94 7.190 7.190 8.138 -0.948 18533
438 1 . 1 1 96 96 ARG N N 95 117.190 117.190 119.232 -2.042 18533
439 1 . 1 1 96 96 ARG HA H 95 3.910 3.910 4.040 -0.130 18533
440 1 . 1 1 96 96 ARG CA C 95 59.500 59.500 59.295 0.205 18533
441 1 . 1 1 96 96 ARG CB C 95 30.230 30.230 30.015 0.215 18533
442 1 . 1 1 96 96 ARG H H 95 7.600 7.600 7.675 -0.075 18533
443 1 . 1 1 97 97 LEU N N 96 120.700 120.700 119.669 1.031 18533
444 1 . 1 1 97 97 LEU HA H 96 4.080 4.080 3.979 0.101 18533
445 1 . 1 1 97 97 LEU CA C 96 57.900 57.900 57.720 0.180 18533
446 1 . 1 1 97 97 LEU CB C 96 41.340 41.340 41.699 -0.359 18533
447 1 . 1 1 97 97 LEU H H 96 7.990 7.990 7.950 0.041 18533
448 1 . 1 1 98 98 LEU N N 97 118.390 118.390 118.410 -0.020 18533
449 1 . 1 1 98 98 LEU HA H 97 3.910 3.910 3.844 0.066 18533
450 1 . 1 1 98 98 LEU CA C 97 58.100 58.100 58.066 0.034 18533
451 1 . 1 1 98 98 LEU CB C 97 41.890 41.890 41.218 0.672 18533
452 1 . 1 1 98 98 LEU H H 97 8.210 8.210 8.224 -0.014 18533
453 1 . 1 1 99 99 ARG N N 98 117.470 117.470 118.043 -0.573 18533
454 1 . 1 1 99 99 ARG HA H 98 4.480 4.480 4.027 0.453 18533
455 1 . 1 1 99 99 ARG CA C 98 58.360 58.360 59.038 -0.677 18533
456 1 . 1 1 99 99 ARG CB C 98 28.740 28.740 29.656 -0.916 18533
457 1 . 1 1 99 99 ARG H H 98 7.740 7.740 7.847 -0.107 18533
458 1 . 1 1 100 100 GLN N N 99 121.400 121.400 118.584 2.816 18533
459 1 . 1 1 100 100 GLN HA H 99 4.070 4.070 4.183 -0.113 18533
460 1 . 1 1 100 100 GLN CA C 99 58.680 58.680 58.134 0.546 18533
461 1 . 1 1 100 100 GLN CB C 99 28.320 28.320 28.265 0.054 18533
462 1 . 1 1 100 100 GLN H H 99 8.030 8.030 8.038 -0.008 18533
463 1 . 1 1 101 101 LEU N N 100 118.940 118.940 117.416 1.524 18533
464 1 . 1 1 101 101 LEU HA H 100 4.260 4.260 4.202 0.058 18533
465 1 . 1 1 101 101 LEU CA C 100 55.460 55.460 55.326 0.134 18533
466 1 . 1 1 101 101 LEU CB C 100 42.240 42.240 42.195 0.045 18533
467 1 . 1 1 101 101 LEU H H 100 7.780 7.780 7.910 -0.130 18533
468 1 . 1 1 102 102 GLY N N 101 105.740 105.740 104.357 1.383 18533
469 1 . 1 1 102 102 GLY CA C 101 45.030 45.030 44.504 0.526 18533
470 1 . 1 1 102 102 GLY H H 101 7.700 7.700 7.613 0.087 18533
471 1 . 1 1 103 103 VAL N N 102 122.330 122.330 120.897 1.433 18533
472 1 . 1 1 103 103 VAL HA H 102 3.630 3.630 4.075 -0.445 18533
473 1 . 1 1 103 103 VAL CA C 102 63.600 63.600 62.138 1.462 18533
474 1 . 1 1 103 103 VAL CB C 102 31.490 31.490 33.270 -1.780 18533
475 1 . 1 1 103 103 VAL H H 102 7.520 7.520 7.795 -0.275 18533
476 1 . 1 1 104 104 GLU N N 103 128.990 128.990 114.369 14.621 18533
477 1 . 1 1 104 104 GLU HA H 103 4.170 4.170 4.436 -0.266 18533
478 1 . 1 1 104 104 GLU CA C 103 56.920 56.920 55.124 1.796 18533
479 1 . 1 1 104 104 GLU CB C 103 28.950 28.950 32.655 -3.705 18533
480 1 . 1 1 104 104 GLU H H 103 9.210 9.210 7.984 1.226 18533
481 1 . 1 1 105 105 ALA N N 104 124.410 124.410 122.722 1.688 18533
482 1 . 1 1 105 105 ALA HA H 104 3.760 3.760 4.221 -0.461 18533
483 1 . 1 1 105 105 ALA CA C 104 55.640 55.640 54.940 0.700 18533
484 1 . 1 1 105 105 ALA CB C 104 18.140 18.140 18.634 -0.494 18533
485 1 . 1 1 105 105 ALA H H 104 8.500 8.500 8.696 -0.196 18533
486 1 . 1 1 106 106 ALA N N 105 115.110 115.110 120.240 -5.130 18533
487 1 . 1 1 106 106 ALA HA H 105 4.130 4.130 4.194 -0.064 18533
488 1 . 1 1 106 106 ALA CA C 105 54.040 54.040 54.756 -0.716 18533
489 1 . 1 1 106 106 ALA CB C 105 19.060 19.060 18.574 0.486 18533
490 1 . 1 1 106 106 ALA H H 105 8.270 8.270 8.354 -0.084 18533
491 1 . 1 1 107 107 ARG N N 106 115.080 115.080 114.941 0.139 18533
492 1 . 1 1 107 107 ARG HA H 106 4.460 4.460 4.819 -0.359 18533
493 1 . 1 1 107 107 ARG CA C 106 56.510 56.510 56.882 -0.372 18533
494 1 . 1 1 107 107 ARG CB C 106 32.370 32.370 31.750 0.620 18533
495 1 . 1 1 107 107 ARG H H 106 7.740 7.740 7.739 0.001 18533
496 1 . 1 1 108 108 VAL N N 107 118.170 118.170 121.715 -3.545 18533
497 1 . 1 1 108 108 VAL HA H 107 5.070 5.070 4.180 0.890 18533
498 1 . 1 1 108 108 VAL CA C 107 60.640 60.640 62.285 -1.645 18533
499 1 . 1 1 108 108 VAL CB C 107 33.600 33.600 32.266 1.334 18533
500 1 . 1 1 108 108 VAL H H 107 7.290 7.290 8.269 -0.979 18533
501 1 . 1 1 109 109 ARG N N 108 124.250 124.250 128.150 -3.900 18533
502 1 . 1 1 109 109 ARG HA H 108 4.620 4.620 4.621 -0.001 18533
503 1 . 1 1 109 109 ARG CA C 108 51.890 51.890 52.930 -1.040 18533
504 1 . 1 1 109 109 ARG CB C 108 34.980 34.980 34.162 0.818 18533
505 1 . 1 1 109 109 ARG H H 108 8.420 8.420 9.135 -0.715 18533
506 1 . 1 1 110 110 MET N N 109 119.570 119.570 121.693 -2.123 18533
507 1 . 1 1 110 110 MET HA H 109 4.960 4.960 4.917 0.043 18533
508 1 . 1 1 110 110 MET CA C 109 53.820 53.820 54.286 -0.466 18533
509 1 . 1 1 110 110 MET CB C 109 30.680 30.680 32.335 -1.655 18533
510 1 . 1 1 110 110 MET H H 109 8.890 8.890 8.584 0.306 18533
511 1 . 1 1 111 111 LEU N N 110 128.660 128.660 126.612 2.048 18533
512 1 . 1 1 111 111 LEU HA H 110 3.960 3.960 4.293 -0.333 18533
513 1 . 1 1 111 111 LEU CA C 110 59.600 59.600 59.019 0.581 18533
514 1 . 1 1 111 111 LEU CB C 110 41.080 41.080 41.857 -0.777 18533
515 1 . 1 1 111 111 LEU H H 110 9.200 9.200 8.979 0.221 18533
516 1 . 1 1 112 112 ARG N N 111 111.910 111.910 116.319 -4.409 18533
517 1 . 1 1 112 112 ARG HA H 111 3.950 3.950 4.078 -0.128 18533
518 1 . 1 1 112 112 ARG CA C 111 59.920 59.920 58.627 1.293 18533
519 1 . 1 1 112 112 ARG CB C 111 28.500 28.500 29.584 -1.084 18533
520 1 . 1 1 112 112 ARG H H 111 8.930 8.930 8.638 0.292 18533
521 1 . 1 1 113 113 SER N N 112 114.800 114.800 115.132 -0.332 18533
522 1 . 1 1 113 113 SER HA H 112 4.290 4.290 4.289 0.001 18533
523 1 . 1 1 113 113 SER CA C 112 60.880 60.880 59.751 1.129 18533
524 1 . 1 1 113 113 SER CB C 112 63.190 63.190 62.519 0.671 18533
525 1 . 1 1 113 113 SER H H 112 7.680 7.680 7.674 0.006 18533
526 1 . 1 1 114 114 PHE N N 113 119.260 119.260 118.522 0.738 18533
527 1 . 1 1 114 114 PHE HA H 113 4.350 4.350 4.475 -0.125 18533
528 1 . 1 1 114 114 PHE CA C 113 59.930 59.930 59.080 0.850 18533
529 1 . 1 1 114 114 PHE CB C 113 39.720 39.720 39.688 0.032 18533
530 1 . 1 1 114 114 PHE H H 113 7.600 7.600 7.608 -0.008 18533
531 1 . 1 1 115 115 ASP N N 114 121.170 121.170 121.496 -0.326 18533
532 1 . 1 1 115 115 ASP HA H 114 5.020 5.020 4.973 0.047 18533
533 1 . 1 1 115 115 ASP CA C 114 51.100 51.100 52.207 -1.107 18533
534 1 . 1 1 115 115 ASP CB C 114 42.510 42.510 41.772 0.738 18533
535 1 . 1 1 115 115 ASP H H 114 7.430 7.430 7.533 -0.103 18533
536 1 . 1 1 116 116 PRO HA H 115 4.490 4.490 4.388 0.102 18533
537 1 . 1 1 116 116 PRO CA C 115 64.350 64.350 64.253 0.097 18533
538 1 . 1 1 116 116 PRO CB C 115 32.270 32.270 32.136 0.134 18533
539 1 . 1 1 117 117 ARG N N 116 117.910 117.910 116.824 1.086 18533
540 1 . 1 1 117 117 ARG HA H 116 4.270 4.270 4.418 -0.148 18533
541 1 . 1 1 117 117 ARG CA C 116 56.450 56.450 55.619 0.831 18533
542 1 . 1 1 117 117 ARG CB C 116 29.960 29.960 30.219 -0.259 18533
543 1 . 1 1 117 117 ARG H H 116 8.580 8.580 8.174 0.406 18533
544 1 . 1 1 118 118 SER N N 117 116.130 116.130 115.960 0.170 18533
545 1 . 1 1 118 118 SER HA H 117 3.980 3.980 4.309 -0.329 18533
546 1 . 1 1 118 118 SER CA C 117 59.790 59.790 59.343 0.447 18533
547 1 . 1 1 118 118 SER CB C 117 63.760 63.760 62.493 1.267 18533
548 1 . 1 1 118 118 SER H H 117 7.950 7.950 7.555 0.395 18533
549 1 . 1 1 119 119 GLY N N 118 110.080 110.080 112.190 -2.110 18533
550 1 . 1 1 119 119 GLY CA C 118 45.370 45.370 46.159 -0.789 18533
551 1 . 1 1 119 119 GLY H H 118 8.150 8.150 8.398 -0.248 18533
552 1 . 1 1 120 120 THR HA H 119 4.020 4.020 4.428 -0.408 18533
553 1 . 1 1 120 120 THR CA C 119 63.290 63.290 61.767 1.523 18533
554 1 . 1 1 120 120 THR CB C 119 69.140 69.140 70.463 -1.323 18533
555 1 . 1 1 121 121 HIS HA H 120 4.570 4.570 4.598 -0.028 18533
556 1 . 1 1 121 121 HIS CA C 120 56.010 56.010 55.409 0.601 18533
557 1 . 1 1 121 121 HIS CB C 120 30.990 30.990 31.304 -0.314 18533
558 1 . 1 1 122 122 ALA N N 121 125.880 125.880 126.404 -0.524 18533
559 1 . 1 1 122 122 ALA HA H 121 4.340 4.340 4.468 -0.128 18533
560 1 . 1 1 122 122 ALA CA C 121 51.510 51.510 51.499 0.011 18533
561 1 . 1 1 122 122 ALA CB C 121 18.600 18.600 19.794 -1.194 18533
562 1 . 1 1 122 122 ALA H H 121 7.980 7.980 8.489 -0.509 18533
563 1 . 1 1 123 123 LEU N N 122 119.810 119.810 121.064 -1.254 18533
564 1 . 1 1 123 123 LEU HA H 122 4.280 4.280 4.449 -0.169 18533
565 1 . 1 1 123 123 LEU CA C 122 54.490 54.490 54.537 -0.047 18533
566 1 . 1 1 123 123 LEU CB C 122 43.700 43.700 41.839 1.861 18533
567 1 . 1 1 123 123 LEU H H 122 7.810 7.810 8.264 -0.454 18533
568 1 . 1 1 124 124 ASP N N 123 119.050 119.050 116.062 2.987 18533
569 1 . 1 1 124 124 ASP HA H 123 4.570 4.570 4.600 -0.030 18533
570 1 . 1 1 124 124 ASP CA C 123 55.320 55.320 53.587 1.733 18533
571 1 . 1 1 124 124 ASP CB C 123 42.670 42.670 43.349 -0.679 18533
572 1 . 1 1 124 124 ASP H H 123 8.270 8.270 7.465 0.805 18533
573 1 . 1 1 125 125 VAL N N 124 121.970 121.970 122.206 -0.236 18533
574 1 . 1 1 125 125 VAL HA H 124 4.260 4.260 4.310 -0.050 18533
575 1 . 1 1 125 125 VAL CA C 124 62.310 62.310 60.955 1.355 18533
576 1 . 1 1 125 125 VAL CB C 124 30.780 30.780 33.878 -3.098 18533
577 1 . 1 1 125 125 VAL H H 124 7.930 7.930 8.038 -0.108 18533
578 1 . 1 1 126 126 GLU N N 125 129.490 129.490 124.162 5.328 18533
579 1 . 1 1 126 126 GLU HA H 125 4.080 4.080 4.179 -0.099 18533
580 1 . 1 1 126 126 GLU CA C 125 57.010 57.010 56.149 0.861 18533
581 1 . 1 1 126 126 GLU CB C 125 29.800 29.800 30.624 -0.824 18533
582 1 . 1 1 126 126 GLU H H 125 9.100 9.100 8.399 0.701 18533
583 1 . 1 1 127 127 ASP N N 126 122.300 122.300 118.534 3.766 18533
584 1 . 1 1 127 127 ASP HA H 126 4.110 4.110 4.795 -0.685 18533
585 1 . 1 1 127 127 ASP CA C 126 51.720 51.720 51.792 -0.072 18533
586 1 . 1 1 127 127 ASP CB C 126 42.520 42.520 42.440 0.080 18533
587 1 . 1 1 127 127 ASP H H 126 8.630 8.630 8.289 0.341 18533
588 1 . 1 1 128 128 PRO HA H 127 4.550 4.550 4.197 0.353 18533
589 1 . 1 1 128 128 PRO CA C 127 62.600 62.600 63.073 -0.473 18533
590 1 . 1 1 128 128 PRO CB C 127 30.980 30.980 31.955 -0.975 18533
591 1 . 1 1 129 129 TYR N N 128 122.380 122.380 121.252 1.128 18533
592 1 . 1 1 129 129 TYR HA H 128 3.800 3.800 4.306 -0.506 18533
593 1 . 1 1 129 129 TYR CA C 128 63.120 63.120 59.371 3.749 18533
594 1 . 1 1 129 129 TYR CB C 128 39.390 39.390 39.181 0.209 18533
595 1 . 1 1 129 129 TYR H H 128 8.670 8.670 8.413 0.257 18533
596 1 . 1 1 130 130 TYR N N 129 116.300 116.300 114.617 1.683 18533
597 1 . 1 1 130 130 TYR HA H 129 4.490 4.490 4.713 -0.223 18533
598 1 . 1 1 130 130 TYR CA C 129 58.480 58.480 57.310 1.170 18533
599 1 . 1 1 130 130 TYR CB C 129 36.660 36.660 38.955 -2.295 18533
600 1 . 1 1 130 130 TYR H H 129 8.680 8.680 7.657 1.023 18533
601 1 . 1 1 131 131 GLY N N 130 110.870 110.870 110.002 0.868 18533
602 1 . 1 1 131 131 GLY CA C 130 44.080 44.080 45.068 -0.988 18533
603 1 . 1 1 131 131 GLY H H 130 8.060 8.060 8.406 -0.346 18533
604 1 . 1 1 132 132 ASP N N 131 121.590 121.590 119.402 2.188 18533
605 1 . 1 1 132 132 ASP HA H 131 5.070 5.070 4.654 0.416 18533
606 1 . 1 1 132 132 ASP CA C 131 52.000 52.000 51.925 0.075 18533
607 1 . 1 1 132 132 ASP CB C 131 43.600 43.600 42.657 0.943 18533
608 1 . 1 1 132 132 ASP H H 131 9.290 9.290 7.883 1.407 18533
609 1 . 1 1 133 133 HIS HA H 132 4.110 4.110 3.885 0.225 18533
610 1 . 1 1 133 133 HIS CA C 132 61.570 61.570 59.640 1.930 18533
611 1 . 1 1 133 133 HIS CB C 132 30.480 30.480 30.276 0.204 18533
612 1 . 1 1 134 134 SER N N 133 115.370 115.370 114.086 1.284 18533
613 1 . 1 1 134 134 SER HA H 133 4.180 4.180 4.024 0.157 18533
614 1 . 1 1 134 134 SER CA C 133 62.070 62.070 61.800 0.270 18533
615 1 . 1 1 134 134 SER CB C 133 62.160 62.160 62.703 -0.543 18533
616 1 . 1 1 134 134 SER H H 133 8.420 8.420 8.355 0.065 18533
617 1 . 1 1 135 135 ASP N N 134 123.360 123.360 122.090 1.270 18533
618 1 . 1 1 135 135 ASP HA H 134 4.530 4.530 4.385 0.145 18533
619 1 . 1 1 135 135 ASP CA C 134 58.040 58.040 57.117 0.923 18533
620 1 . 1 1 135 135 ASP CB C 134 40.810 40.810 40.232 0.578 18533
621 1 . 1 1 135 135 ASP H H 134 7.980 7.980 7.951 0.029 18533
622 1 . 1 1 136 136 PHE N N 135 118.940 118.940 118.332 0.608 18533
623 1 . 1 1 136 136 PHE HA H 135 3.800 3.800 4.322 -0.522 18533
624 1 . 1 1 136 136 PHE CA C 135 62.820 62.820 59.458 3.362 18533
625 1 . 1 1 136 136 PHE CB C 135 39.350 39.350 38.106 1.244 18533
626 1 . 1 1 136 136 PHE H H 135 7.850 7.850 7.358 0.491 18533
627 1 . 1 1 137 137 GLU N N 136 121.410 121.410 118.629 2.781 18533
628 1 . 1 1 137 137 GLU HA H 136 4.180 4.180 4.146 0.034 18533
629 1 . 1 1 137 137 GLU CA C 136 59.500 59.500 59.029 0.471 18533
630 1 . 1 1 137 137 GLU CB C 136 28.990 28.990 29.192 -0.202 18533
631 1 . 1 1 137 137 GLU H H 136 8.150 8.150 7.978 0.172 18533
632 1 . 1 1 138 138 GLU N N 137 121.530 121.530 121.506 0.024 18533
633 1 . 1 1 138 138 GLU HA H 137 4.290 4.290 4.100 0.190 18533
634 1 . 1 1 138 138 GLU CA C 137 59.400 59.400 59.452 -0.052 18533
635 1 . 1 1 138 138 GLU CB C 137 28.890 28.890 29.224 -0.334 18533
636 1 . 1 1 138 138 GLU H H 137 7.870 7.870 8.229 -0.359 18533
637 1 . 1 1 139 139 VAL N N 138 119.930 119.930 119.697 0.233 18533
638 1 . 1 1 139 139 VAL HA H 138 3.480 3.480 3.646 -0.166 18533
639 1 . 1 1 139 139 VAL CA C 138 67.080 67.080 66.440 0.640 18533
640 1 . 1 1 139 139 VAL CB C 138 31.350 31.350 31.447 -0.098 18533
641 1 . 1 1 139 139 VAL H H 138 7.770 7.770 7.645 0.125 18533
642 1 . 1 1 140 140 PHE N N 139 119.130 119.130 120.986 -1.856 18533
643 1 . 1 1 140 140 PHE HA H 139 3.560 3.560 3.998 -0.438 18533
644 1 . 1 1 140 140 PHE CA C 139 62.680 62.680 61.661 1.019 18533
645 1 . 1 1 140 140 PHE CB C 139 39.170 39.170 38.791 0.379 18533
646 1 . 1 1 140 140 PHE H H 139 8.050 8.050 7.951 0.099 18533
647 1 . 1 1 141 141 ALA N N 140 121.040 121.040 122.093 -1.053 18533
648 1 . 1 1 141 141 ALA HA H 140 3.990 3.990 4.249 -0.259 18533
649 1 . 1 1 141 141 ALA CA C 140 55.120 55.120 54.817 0.303 18533
650 1 . 1 1 141 141 ALA CB C 140 18.300 18.300 18.348 -0.048 18533
651 1 . 1 1 141 141 ALA H H 140 8.010 8.010 8.171 -0.161 18533
652 1 . 1 1 142 142 VAL N N 141 118.550 118.550 118.931 -0.381 18533
653 1 . 1 1 142 142 VAL HA H 141 3.810 3.810 3.548 0.262 18533
654 1 . 1 1 142 142 VAL CA C 141 65.600 65.600 66.625 -1.025 18533
655 1 . 1 1 142 142 VAL CB C 141 31.450 31.450 31.383 0.067 18533
656 1 . 1 1 142 142 VAL H H 141 8.300 8.300 7.992 0.308 18533
657 1 . 1 1 143 143 ILE N N 142 121.410 121.410 119.404 2.006 18533
658 1 . 1 1 143 143 ILE HA H 142 3.390 3.390 3.442 -0.052 18533
659 1 . 1 1 143 143 ILE CA C 142 66.050 66.050 65.396 0.654 18533
660 1 . 1 1 143 143 ILE CB C 142 37.310 37.310 37.747 -0.437 18533
661 1 . 1 1 143 143 ILE H H 142 8.150 8.150 8.100 0.050 18533
662 1 . 1 1 144 144 GLU N N 143 119.630 119.630 119.282 0.348 18533
663 1 . 1 1 144 144 GLU HA H 143 3.540 3.540 3.754 -0.214 18533
664 1 . 1 1 144 144 GLU CA C 143 59.760 59.760 59.159 0.601 18533
665 1 . 1 1 144 144 GLU CB C 143 29.730 29.730 28.879 0.851 18533
666 1 . 1 1 144 144 GLU H H 143 8.640 8.640 8.144 0.496 18533
667 1 . 1 1 145 145 SER N N 144 110.920 110.920 114.139 -3.219 18533
668 1 . 1 1 145 145 SER HA H 144 4.230 4.230 4.240 -0.010 18533
669 1 . 1 1 145 145 SER CA C 144 60.810 60.810 60.748 0.062 18533
670 1 . 1 1 145 145 SER CB C 144 63.610 63.610 63.435 0.175 18533
671 1 . 1 1 145 145 SER H H 144 7.640 7.640 7.841 -0.201 18533
672 1 . 1 1 146 146 ALA N N 145 123.110 123.110 124.398 -1.288 18533
673 1 . 1 1 146 146 ALA HA H 145 4.120 4.120 4.323 -0.203 18533
674 1 . 1 1 146 146 ALA CA C 145 53.400 53.400 54.068 -0.668 18533
675 1 . 1 1 146 146 ALA CB C 145 20.880 20.880 18.348 2.532 18533
676 1 . 1 1 146 146 ALA H H 145 7.500 7.500 7.661 -0.161 18533
677 1 . 1 1 147 147 LEU N N 146 114.220 114.220 119.677 -5.457 18533
678 1 . 1 1 147 147 LEU HA H 146 3.940 3.940 3.858 0.082 18533
679 1 . 1 1 147 147 LEU CA C 146 59.050 59.050 59.467 -0.417 18533
680 1 . 1 1 147 147 LEU CB C 146 39.460 39.460 39.388 0.072 18533
681 1 . 1 1 147 147 LEU H H 146 7.410 7.410 8.166 -0.756 18533
682 1 . 1 1 148 148 PRO HA H 147 4.450 4.450 4.398 0.052 18533
683 1 . 1 1 148 148 PRO CA C 147 67.840 67.840 64.525 3.315 18533
684 1 . 1 1 148 148 PRO CB C 147 31.220 31.220 31.057 0.163 18533
685 1 . 1 1 149 149 GLY N N 148 102.590 102.590 106.450 -3.860 18533
686 1 . 1 1 149 149 GLY CA C 148 47.260 47.260 45.520 1.740 18533
687 1 . 1 1 149 149 GLY H H 148 7.960 7.960 7.920 0.040 18533
688 1 . 1 1 150 150 LEU N N 149 128.060 128.060 123.594 4.466 18533
689 1 . 1 1 150 150 LEU HA H 149 3.630 3.630 3.265 0.365 18533
690 1 . 1 1 150 150 LEU CA C 149 57.350 57.350 57.180 0.170 18533
691 1 . 1 1 150 150 LEU CB C 149 41.200 41.200 41.327 -0.127 18533
692 1 . 1 1 150 150 LEU H H 149 7.620 7.620 8.405 -0.785 18533
693 1 . 1 1 151 151 HIS N N 150 120.730 120.730 118.362 2.368 18533
694 1 . 1 1 151 151 HIS HA H 150 4.170 4.170 4.119 0.051 18533
695 1 . 1 1 151 151 HIS CA C 150 62.380 62.380 61.136 1.244 18533
696 1 . 1 1 151 151 HIS CB C 150 30.510 30.510 29.699 0.811 18533
697 1 . 1 1 151 151 HIS H H 150 8.430 8.430 8.484 -0.054 18533
698 1 . 1 1 152 152 ASP N N 151 118.170 118.170 119.772 -1.602 18533
699 1 . 1 1 152 152 ASP HA H 151 4.420 4.420 4.378 0.042 18533
700 1 . 1 1 152 152 ASP CA C 151 57.810 57.810 57.915 -0.105 18533
701 1 . 1 1 152 152 ASP CB C 151 40.030 40.030 40.586 -0.556 18533
702 1 . 1 1 152 152 ASP H H 151 7.820 7.820 8.164 -0.344 18533
703 1 . 1 1 153 153 TRP N N 152 122.780 122.780 122.001 0.779 18533
704 1 . 1 1 153 153 TRP HA H 152 4.110 4.110 4.563 -0.453 18533
705 1 . 1 1 153 153 TRP CA C 152 62.610 62.610 61.118 1.492 18533
706 1 . 1 1 153 153 TRP CB C 152 29.790 29.790 30.160 -0.370 18533
707 1 . 1 1 153 153 TRP H H 152 7.900 7.900 7.844 0.056 18533
708 1 . 1 1 154 154 VAL N N 153 119.460 119.460 117.014 2.446 18533
709 1 . 1 1 154 154 VAL HA H 153 3.350 3.350 3.850 -0.500 18533
710 1 . 1 1 154 154 VAL CA C 153 66.980 66.980 66.291 0.689 18533
711 1 . 1 1 154 154 VAL CB C 153 31.900 31.900 31.266 0.634 18533
712 1 . 1 1 154 154 VAL H H 153 8.560 8.560 8.571 -0.011 18533
713 1 . 1 1 155 155 ASP N N 154 120.500 120.500 121.392 -0.892 18533
714 1 . 1 1 155 155 ASP HA H 154 4.200 4.200 4.316 -0.116 18533
715 1 . 1 1 155 155 ASP CA C 154 57.570 57.570 58.393 -0.823 18533
716 1 . 1 1 155 155 ASP CB C 154 39.860 39.860 40.817 -0.957 18533
717 1 . 1 1 155 155 ASP H H 154 8.530 8.530 8.641 -0.111 18533
718 1 . 1 1 156 156 GLU N N 155 120.090 120.090 119.621 0.469 18533
719 1 . 1 1 156 156 GLU HA H 155 3.930 3.930 3.932 -0.002 18533
720 1 . 1 1 156 156 GLU CA C 155 59.160 59.160 59.263 -0.103 18533
721 1 . 1 1 156 156 GLU CB C 155 29.290 29.290 29.328 -0.038 18533
722 1 . 1 1 156 156 GLU H H 155 7.870 7.870 8.403 -0.533 18533
723 1 . 1 1 157 157 ARG N N 156 119.230 119.230 119.098 0.132 18533
724 1 . 1 1 157 157 ARG HA H 156 3.810 3.810 3.998 -0.188 18533
725 1 . 1 1 157 157 ARG CA C 156 56.990 56.990 57.200 -0.210 18533
726 1 . 1 1 157 157 ARG CB C 156 29.110 29.110 29.321 -0.211 18533
727 1 . 1 1 157 157 ARG H H 156 7.660 7.660 7.981 -0.321 18533
728 1 . 1 1 158 158 LEU N N 157 118.790 118.790 117.119 1.671 18533
729 1 . 1 1 158 158 LEU HA H 157 4.100 4.100 4.181 -0.081 18533
730 1 . 1 1 158 158 LEU CA C 157 56.680 56.680 57.550 -0.870 18533
731 1 . 1 1 158 158 LEU CB C 157 41.690 41.690 40.825 0.865 18533
732 1 . 1 1 158 158 LEU H H 157 8.470 8.470 8.304 0.166 18533
733 1 . 1 1 159 159 ALA N N 158 120.760 120.760 121.943 -1.183 18533
734 1 . 1 1 159 159 ALA HA H 158 4.190 4.190 4.169 0.021 18533
735 1 . 1 1 159 159 ALA CA C 158 53.280 53.280 54.451 -1.171 18533
736 1 . 1 1 159 159 ALA CB C 158 18.390 18.390 19.017 -0.627 18533
737 1 . 1 1 159 159 ALA H H 158 7.490 7.490 7.718 -0.228 18533
738 1 . 1 1 160 160 ARG N N 159 117.810 117.810 116.526 1.284 18533
739 1 . 1 1 160 160 ARG HA H 159 4.210 4.210 4.143 0.067 18533
740 1 . 1 1 160 160 ARG CA C 159 56.780 56.780 57.208 -0.428 18533
741 1 . 1 1 160 160 ARG CB C 159 30.530 30.530 29.757 0.773 18533
742 1 . 1 1 160 160 ARG H H 159 7.650 7.650 7.979 -0.329 18533
743 1 . 1 1 161 161 ASN N N 160 118.560 118.560 118.729 -0.169 18533
744 1 . 1 1 161 161 ASN HA H 160 4.740 4.740 4.586 0.154 18533
745 1 . 1 1 161 161 ASN CA C 160 53.250 53.250 53.902 -0.652 18533
746 1 . 1 1 161 161 ASN CB C 160 39.170 39.170 38.622 0.548 18533
747 1 . 1 1 161 161 ASN H H 160 8.100 8.100 7.889 0.211 18533
748 1 . 1 1 162 162 GLY N N 161 108.900 108.900 107.487 1.413 18533
749 1 . 1 1 162 162 GLY CA C 161 44.730 44.730 44.047 0.683 18533
750 1 . 1 1 162 162 GLY H H 161 7.980 7.980 7.529 0.451 18533
751 1 . 1 1 163 163 PRO HA H 162 4.460 4.460 4.634 -0.174 18533
752 1 . 1 1 163 163 PRO CA C 162 63.450 63.450 62.894 0.557 18533
753 1 . 1 1 163 163 PRO CB C 162 32.200 32.200 31.689 0.511 18533
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