data_18497
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18497
_Entry.PDB_ID 2LTU
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 18497
_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 PRO HA H 2 4.430 4.430 4.390 0.040 18497
2 1 1 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.402 0.545 18497
3 1 1 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.440 -0.310 18497
4 1 1 . 1 1 3 3 HIS N N 3 119.985 119.985 118.115 1.870 18497
5 1 1 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.576 0.030 18497
6 1 1 . 1 1 3 3 HIS C C 3 176.587 176.587 175.890 0.697 18497
7 1 1 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.709 0.476 18497
8 1 1 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.133 0.338 18497
9 1 1 . 1 1 3 3 HIS H H 3 8.526 8.526 8.161 0.365 18497
10 1 1 . 1 1 4 4 MET N N 4 122.338 122.338 122.654 -0.316 18497
11 1 1 . 1 1 4 4 MET HA H 4 4.448 4.448 4.484 -0.036 18497
12 1 1 . 1 1 4 4 MET C C 4 175.108 175.108 176.605 -1.497 18497
13 1 1 . 1 1 4 4 MET CA C 4 55.562 55.562 55.217 0.345 18497
14 1 1 . 1 1 4 4 MET CB C 4 33.141 33.141 33.395 -0.254 18497
15 1 1 . 1 1 4 4 MET H H 4 8.337 8.337 8.556 -0.219 18497
16 1 1 . 1 1 5 5 SER N N 5 116.990 116.990 119.996 -3.006 18497
17 1 1 . 1 1 5 5 SER HA H 5 4.400 4.400 4.269 0.131 18497
18 1 1 . 1 1 5 5 SER C C 5 177.979 177.979 173.162 4.817 18497
19 1 1 . 1 1 5 5 SER CA C 5 58.039 58.039 58.401 -0.362 18497
20 1 1 . 1 1 5 5 SER CB C 5 63.797 63.797 63.236 0.561 18497
21 1 1 . 1 1 5 5 SER H H 5 8.330 8.330 8.828 -0.498 18497
22 1 1 . 1 1 6 6 TYR N N 6 122.027 122.027 119.284 2.743 18497
23 1 1 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.727 -0.217 18497
24 1 1 . 1 1 6 6 TYR C C 6 174.060 174.060 174.019 0.041 18497
25 1 1 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.066 0.734 18497
26 1 1 . 1 1 6 6 TYR CB C 6 38.685 38.685 41.618 -2.933 18497
27 1 1 . 1 1 6 6 TYR H H 6 8.201 8.201 7.334 0.867 18497
28 1 1 . 1 1 7 7 ASP N N 7 122.439 122.439 119.387 3.052 18497
29 1 1 . 1 1 7 7 ASP HA H 7 4.549 4.549 5.006 -0.457 18497
30 1 1 . 1 1 7 7 ASP C C 7 175.150 175.150 176.319 -1.169 18497
31 1 1 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.803 -0.163 18497
32 1 1 . 1 1 7 7 ASP CB C 7 41.300 41.300 43.099 -1.799 18497
33 1 1 . 1 1 7 7 ASP H H 7 8.119 8.119 8.514 -0.395 18497
34 1 1 . 1 1 8 8 ALA N N 8 124.655 124.655 125.315 -0.660 18497
35 1 1 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.103 0.127 18497
36 1 1 . 1 1 8 8 ALA C C 8 175.935 175.935 179.374 -3.439 18497
37 1 1 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.721 -1.828 18497
38 1 1 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.646 0.204 18497
39 1 1 . 1 1 8 8 ALA H H 8 8.235 8.235 8.701 -0.466 18497
40 1 1 . 1 1 9 9 ASN N N 9 116.133 116.133 116.614 -0.481 18497
41 1 1 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.608 0.082 18497
42 1 1 . 1 1 9 9 ASN C C 9 177.718 177.718 176.262 1.456 18497
43 1 1 . 1 1 9 9 ASN CA C 9 53.800 53.800 55.328 -1.528 18497
44 1 1 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.116 -0.346 18497
45 1 1 . 1 1 9 9 ASN H H 9 8.417 8.417 8.358 0.059 18497
46 1 1 . 1 1 10 10 VAL N N 10 119.557 119.557 113.456 6.101 18497
47 1 1 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.447 -0.270 18497
48 1 1 . 1 1 10 10 VAL C C 10 174.930 174.930 175.015 -0.085 18497
49 1 1 . 1 1 10 10 VAL CA C 10 61.880 61.880 61.558 0.322 18497
50 1 1 . 1 1 10 10 VAL CB C 10 32.660 32.660 31.162 1.498 18497
51 1 1 . 1 1 10 10 VAL H H 10 7.859 7.859 7.921 -0.062 18497
52 1 1 . 1 1 11 11 ILE N N 11 126.561 126.561 121.962 4.599 18497
53 1 1 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.636 -0.596 18497
54 1 1 . 1 1 11 11 ILE C C 11 175.935 175.935 174.771 1.164 18497
55 1 1 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.886 -0.386 18497
56 1 1 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.946 -4.246 18497
57 1 1 . 1 1 11 11 ILE H H 11 8.283 8.283 7.488 0.795 18497
58 1 1 . 1 1 12 12 ASP N N 12 128.161 128.161 128.145 0.016 18497
59 1 1 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.902 -0.172 18497
60 1 1 . 1 1 12 12 ASP C C 12 174.891 174.891 176.667 -1.776 18497
61 1 1 . 1 1 12 12 ASP CA C 12 53.427 53.427 54.309 -0.882 18497
62 1 1 . 1 1 12 12 ASP CB C 12 42.220 42.220 40.968 1.252 18497
63 1 1 . 1 1 12 12 ASP H H 12 8.477 8.477 8.581 -0.104 18497
64 1 1 . 1 1 13 13 ASP N N 13 127.435 127.435 126.152 1.283 18497
65 1 1 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.268 0.048 18497
66 1 1 . 1 1 13 13 ASP C C 13 175.369 175.369 177.607 -2.238 18497
67 1 1 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.779 -0.179 18497
68 1 1 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.345 -0.185 18497
69 1 1 . 1 1 13 13 ASP H H 13 8.698 8.698 8.702 -0.004 18497
70 1 1 . 1 1 14 14 GLU N N 14 119.796 119.796 120.923 -1.127 18497
71 1 1 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.025 0.010 18497
72 1 1 . 1 1 14 14 GLU C C 14 178.588 178.588 177.448 1.140 18497
73 1 1 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.632 -0.132 18497
74 1 1 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.170 -0.270 18497
75 1 1 . 1 1 14 14 GLU H H 14 8.205 8.205 8.707 -0.502 18497
76 1 1 . 1 1 15 15 ALA N N 15 124.156 124.156 122.556 1.600 18497
77 1 1 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.011 0.165 18497
78 1 1 . 1 1 15 15 ALA C C 15 179.502 179.502 179.493 0.009 18497
79 1 1 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.692 0.308 18497
80 1 1 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.118 0.782 18497
81 1 1 . 1 1 15 15 ALA H H 15 8.473 8.473 7.883 0.590 18497
82 1 1 . 1 1 16 16 VAL N N 16 117.585 117.585 119.173 -1.588 18497
83 1 1 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.646 -0.112 18497
84 1 1 . 1 1 16 16 VAL C C 16 179.545 179.545 178.280 1.265 18497
85 1 1 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.298 0.702 18497
86 1 1 . 1 1 16 16 VAL CB C 16 31.600 31.600 30.958 0.642 18497
87 1 1 . 1 1 16 16 VAL H H 16 8.181 8.181 8.753 -0.572 18497
88 1 1 . 1 1 17 17 LYS N N 17 119.377 119.377 120.579 -1.202 18497
89 1 1 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.891 0.065 18497
90 1 1 . 1 1 17 17 LYS C C 17 178.197 178.197 178.797 -0.600 18497
91 1 1 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.238 -0.218 18497
92 1 1 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.387 -0.257 18497
93 1 1 . 1 1 17 17 LYS H H 17 8.001 8.001 8.385 -0.384 18497
94 1 1 . 1 1 18 18 GLU N N 18 120.395 120.395 119.339 1.056 18497
95 1 1 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.043 0.097 18497
96 1 1 . 1 1 18 18 GLU C C 18 178.849 178.849 179.153 -0.304 18497
97 1 1 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.494 0.306 18497
98 1 1 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.777 -0.284 18497
99 1 1 . 1 1 18 18 GLU H H 18 7.943 7.943 8.184 -0.241 18497
100 1 1 . 1 1 19 19 VAL N N 19 121.088 121.088 120.463 0.625 18497
101 1 1 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.744 -0.094 18497
102 1 1 . 1 1 19 19 VAL C C 19 179.415 179.415 178.236 1.179 18497
103 1 1 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.931 1.049 18497
104 1 1 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.330 0.270 18497
105 1 1 . 1 1 19 19 VAL H H 19 8.335 8.335 8.692 -0.357 18497
106 1 1 . 1 1 20 20 CYS N N 20 117.290 117.290 118.152 -0.862 18497
107 1 1 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.286 0.394 18497
108 1 1 . 1 1 20 20 CYS C C 20 178.110 178.110 177.272 0.838 18497
109 1 1 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.963 -0.763 18497
110 1 1 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.044 -0.244 18497
111 1 1 . 1 1 20 20 CYS H H 20 8.434 8.434 8.203 0.231 18497
112 1 1 . 1 1 21 21 GLU N N 21 118.195 118.195 118.535 -0.340 18497
113 1 1 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.176 -0.037 18497
114 1 1 . 1 1 21 21 GLU C C 21 178.153 178.153 178.207 -0.054 18497
115 1 1 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.692 1.058 18497
116 1 1 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.164 0.336 18497
117 1 1 . 1 1 21 21 GLU H H 21 7.972 7.972 7.849 0.123 18497
118 1 1 . 1 1 22 22 LYS N N 22 119.095 119.095 119.037 0.058 18497
119 1 1 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.230 -0.225 18497
120 1 1 . 1 1 22 22 LYS C C 22 179.371 179.371 178.003 1.368 18497
121 1 1 . 1 1 22 22 LYS CA C 22 58.700 58.700 57.991 0.709 18497
122 1 1 . 1 1 22 22 LYS CB C 22 32.920 32.920 33.114 -0.194 18497
123 1 1 . 1 1 22 22 LYS H H 22 8.071 8.071 8.070 0.001 18497
124 1 1 . 1 1 23 23 PHE N N 23 114.252 114.252 118.313 -4.061 18497
125 1 1 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.423 0.007 18497
126 1 1 . 1 1 23 23 PHE C C 23 178.197 178.197 174.606 3.591 18497
127 1 1 . 1 1 23 23 PHE CA C 23 58.430 58.430 59.076 -0.646 18497
128 1 1 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.225 -1.455 18497
129 1 1 . 1 1 23 23 PHE H H 23 8.491 8.491 8.177 0.314 18497
130 1 1 . 1 1 24 24 GLU N N 24 119.819 119.819 117.329 2.490 18497
131 1 1 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.091 -0.021 18497
132 1 1 . 1 1 24 24 GLU C C 24 177.457 177.457 175.412 2.045 18497
133 1 1 . 1 1 24 24 GLU CA C 24 56.830 56.830 56.856 -0.026 18497
134 1 1 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.062 -0.262 18497
135 1 1 . 1 1 24 24 GLU H H 24 7.867 7.867 8.242 -0.375 18497
136 1 1 . 1 1 25 25 CYS N N 25 114.633 114.633 116.971 -2.338 18497
137 1 1 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.905 0.482 18497
138 1 1 . 1 1 25 25 CYS C C 25 174.760 174.760 173.389 1.371 18497
139 1 1 . 1 1 25 25 CYS CA C 25 54.761 54.761 55.924 -1.163 18497
140 1 1 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.322 0.278 18497
141 1 1 . 1 1 25 25 CYS H H 25 8.156 8.156 8.611 -0.455 18497
142 1 1 . 1 1 26 26 THR N N 26 109.312 109.312 113.291 -3.979 18497
143 1 1 . 1 1 26 26 THR HA H 26 4.770 4.770 4.684 0.086 18497
144 1 1 . 1 1 26 26 THR C C 26 173.499 173.499 175.535 -2.036 18497
145 1 1 . 1 1 26 26 THR CA C 26 60.723 60.723 61.058 -0.335 18497
146 1 1 . 1 1 26 26 THR CB C 26 72.000 72.000 71.778 0.222 18497
147 1 1 . 1 1 26 26 THR H H 26 8.460 8.460 9.275 -0.815 18497
148 1 1 . 1 1 27 27 GLU N N 27 122.233 122.233 123.572 -1.339 18497
149 1 1 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.949 -0.439 18497
150 1 1 . 1 1 27 27 GLU C C 27 176.544 176.544 178.777 -2.233 18497
151 1 1 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.454 0.096 18497
152 1 1 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.285 -0.335 18497
153 1 1 . 1 1 27 27 GLU H H 27 9.327 9.327 8.961 0.366 18497
154 1 1 . 1 1 28 28 SER N N 28 112.925 112.925 114.732 -1.807 18497
155 1 1 . 1 1 28 28 SER HA H 28 4.062 4.062 4.125 -0.063 18497
156 1 1 . 1 1 28 28 SER C C 28 178.545 178.545 176.804 1.741 18497
157 1 1 . 1 1 28 28 SER CA C 28 61.350 61.350 61.170 0.180 18497
158 1 1 . 1 1 28 28 SER CB C 28 62.400 62.400 62.597 -0.197 18497
159 1 1 . 1 1 28 28 SER H H 28 8.320 8.320 8.532 -0.212 18497
160 1 1 . 1 1 29 29 GLU N N 29 121.736 121.736 122.170 -0.434 18497
161 1 1 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.020 -0.030 18497
162 1 1 . 1 1 29 29 GLU C C 29 176.674 176.674 178.495 -1.821 18497
163 1 1 . 1 1 29 29 GLU CA C 29 59.750 59.750 59.216 0.534 18497
164 1 1 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.613 -0.143 18497
165 1 1 . 1 1 29 29 GLU H H 29 7.512 7.512 7.557 -0.045 18497
166 1 1 . 1 1 30 30 VAL N N 30 119.480 119.480 119.975 -0.495 18497
167 1 1 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.508 -0.131 18497
168 1 1 . 1 1 30 30 VAL C C 30 179.241 179.241 177.917 1.324 18497
169 1 1 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.689 -0.029 18497
170 1 1 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.646 -0.576 18497
171 1 1 . 1 1 30 30 VAL H H 30 7.492 7.492 7.602 -0.110 18497
172 1 1 . 1 1 31 31 MET N N 31 117.220 117.220 117.381 -0.161 18497
173 1 1 . 1 1 31 31 MET HA H 31 3.870 3.870 3.851 0.019 18497
174 1 1 . 1 1 31 31 MET C C 31 177.936 177.936 178.162 -0.226 18497
175 1 1 . 1 1 31 31 MET CA C 31 57.630 57.630 59.020 -1.390 18497
176 1 1 . 1 1 31 31 MET CB C 31 30.270 30.270 32.060 -1.790 18497
177 1 1 . 1 1 31 31 MET H H 31 8.302 8.302 8.571 -0.269 18497
178 1 1 . 1 1 32 32 ASN N N 32 116.672 116.672 118.883 -2.211 18497
179 1 1 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.349 0.041 18497
180 1 1 . 1 1 32 32 ASN C C 32 176.065 176.065 177.391 -1.326 18497
181 1 1 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.637 -0.607 18497
182 1 1 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.455 -0.745 18497
183 1 1 . 1 1 32 32 ASN H H 32 8.313 8.313 8.146 0.167 18497
184 1 1 . 1 1 33 33 SER N N 33 117.471 117.471 114.227 3.244 18497
185 1 1 . 1 1 33 33 SER HA H 33 4.150 4.150 4.212 -0.062 18497
186 1 1 . 1 1 33 33 SER C C 33 178.806 178.806 175.497 3.309 18497
187 1 1 . 1 1 33 33 SER CA C 33 62.950 62.950 60.675 2.276 18497
188 1 1 . 1 1 33 33 SER CB C 33 62.600 62.600 63.260 -0.660 18497
189 1 1 . 1 1 33 33 SER H H 33 7.851 7.851 7.600 0.251 18497
190 1 1 . 1 1 34 34 LEU N N 34 122.839 122.839 119.324 3.515 18497
191 1 1 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.105 -0.226 18497
192 1 1 . 1 1 34 34 LEU C C 34 177.892 177.892 177.278 0.614 18497
193 1 1 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.234 1.396 18497
194 1 1 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.436 -1.636 18497
195 1 1 . 1 1 34 34 LEU H H 34 8.128 8.128 7.299 0.829 18497
196 1 1 . 1 1 35 35 TYR N N 35 116.666 116.666 117.316 -0.650 18497
197 1 1 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.299 0.311 18497
198 1 1 . 1 1 35 35 TYR C C 35 179.067 179.067 175.864 3.203 18497
199 1 1 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.878 -1.988 18497
200 1 1 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.910 -4.199 18497
201 1 1 . 1 1 35 35 TYR H H 35 7.924 7.924 7.908 0.016 18497
202 1 1 . 1 1 36 36 SER N N 36 114.801 114.801 112.950 1.851 18497
203 1 1 . 1 1 36 36 SER HA H 36 4.080 4.080 4.457 -0.377 18497
204 1 1 . 1 1 36 36 SER C C 36 177.283 177.283 175.019 2.264 18497
205 1 1 . 1 1 36 36 SER CA C 36 60.519 60.519 58.499 2.020 18497
206 1 1 . 1 1 36 36 SER CB C 36 64.240 64.240 65.928 -1.688 18497
207 1 1 . 1 1 36 36 SER H H 36 7.715 7.715 8.656 -0.941 18497
208 1 1 . 1 1 37 37 GLY N N 37 109.803 109.803 111.480 -1.677 18497
209 1 1 . 1 1 37 37 GLY C C 37 175.978 175.978 172.604 3.374 18497
210 1 1 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.289 0.389 18497
211 1 1 . 1 1 37 37 GLY H H 37 8.017 8.017 7.904 0.113 18497
212 1 1 . 1 1 38 38 ASP N N 38 120.613 120.613 118.591 2.022 18497
213 1 1 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.941 0.084 18497
214 1 1 . 1 1 38 38 ASP C C 38 173.368 173.368 174.597 -1.229 18497
215 1 1 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.975 -1.256 18497
216 1 1 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.928 -1.508 18497
217 1 1 . 1 1 38 38 ASP H H 38 8.006 8.006 8.004 0.002 18497
218 1 1 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.214 0.126 18497
219 1 1 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.393 -0.643 18497
220 1 1 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.051 0.079 18497
221 1 1 . 1 1 40 40 GLN N N 40 115.056 115.056 114.474 0.582 18497
222 1 1 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.206 0.074 18497
223 1 1 . 1 1 40 40 GLN C C 40 177.066 177.066 176.261 0.805 18497
224 1 1 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.838 -1.128 18497
225 1 1 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.927 -0.247 18497
226 1 1 . 1 1 40 40 GLN H H 40 8.237 8.237 8.105 0.132 18497
227 1 1 . 1 1 41 41 ASP N N 41 122.839 122.839 121.451 1.388 18497
228 1 1 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.588 -0.275 18497
229 1 1 . 1 1 41 41 ASP C C 41 175.804 175.804 177.345 -1.541 18497
230 1 1 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.044 1.196 18497
231 1 1 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.666 -0.446 18497
232 1 1 . 1 1 41 41 ASP H H 41 7.211 7.211 7.764 -0.553 18497
233 1 1 . 1 1 42 42 GLN N N 42 124.547 124.547 122.733 1.814 18497
234 1 1 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.072 -0.212 18497
235 1 1 . 1 1 42 42 GLN C C 42 177.196 177.196 177.854 -0.658 18497
236 1 1 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.262 -0.042 18497
237 1 1 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.034 -0.634 18497
238 1 1 . 1 1 42 42 GLN H H 42 8.719 8.719 8.770 -0.051 18497
239 1 1 . 1 1 43 43 LEU N N 43 118.960 118.960 118.640 0.320 18497
240 1 1 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.378 0.307 18497
241 1 1 . 1 1 43 43 LEU C C 43 178.066 178.066 178.556 -0.490 18497
242 1 1 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.329 0.031 18497
243 1 1 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.379 -0.989 18497
244 1 1 . 1 1 43 43 LEU H H 43 8.206 8.206 8.092 0.114 18497
245 1 1 . 1 1 44 44 ALA N N 44 121.666 121.666 122.192 -0.526 18497
246 1 1 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.079 -0.200 18497
247 1 1 . 1 1 44 44 ALA C C 44 178.327 178.327 179.517 -1.190 18497
248 1 1 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.782 -0.072 18497
249 1 1 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.256 0.324 18497
250 1 1 . 1 1 44 44 ALA H H 44 7.402 7.402 7.534 -0.132 18497
251 1 1 . 1 1 45 45 VAL N N 45 118.589 118.589 120.241 -1.652 18497
252 1 1 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.722 -0.062 18497
253 1 1 . 1 1 45 45 VAL C C 45 179.893 179.893 178.088 1.805 18497
254 1 1 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.494 -0.094 18497
255 1 1 . 1 1 45 45 VAL CB C 45 32.131 32.131 30.932 1.199 18497
256 1 1 . 1 1 45 45 VAL H H 45 8.449 8.449 8.532 -0.083 18497
257 1 1 . 1 1 46 46 ALA N N 46 121.006 121.006 123.035 -2.029 18497
258 1 1 . 1 1 46 46 ALA HA H 46 4.130 4.130 4.047 0.083 18497
259 1 1 . 1 1 46 46 ALA C C 46 179.110 179.110 179.203 -0.093 18497
260 1 1 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.405 -0.435 18497
261 1 1 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.905 1.205 18497
262 1 1 . 1 1 46 46 ALA H H 46 7.654 7.654 8.254 -0.600 18497
263 1 1 . 1 1 47 47 TYR N N 47 119.140 119.140 119.826 -0.686 18497
264 1 1 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.997 -0.247 18497
265 1 1 . 1 1 47 47 TYR C C 47 179.328 179.328 177.460 1.868 18497
266 1 1 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.891 -0.011 18497
267 1 1 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.400 0.100 18497
268 1 1 . 1 1 47 47 TYR H H 47 8.077 8.077 7.773 0.304 18497
269 1 1 . 1 1 48 48 HIS N N 48 116.422 116.422 119.014 -2.592 18497
270 1 1 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.129 -0.029 18497
271 1 1 . 1 1 48 48 HIS C C 48 178.023 178.023 177.604 0.419 18497
272 1 1 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.113 -0.093 18497
273 1 1 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.511 -1.571 18497
274 1 1 . 1 1 48 48 HIS H H 48 8.326 8.326 8.472 -0.146 18497
275 1 1 . 1 1 49 49 LEU N N 49 120.974 120.974 120.073 0.901 18497
276 1 1 . 1 1 49 49 LEU HA H 49 4.155 4.155 3.946 0.209 18497
277 1 1 . 1 1 49 49 LEU C C 49 177.417 177.417 179.227 -1.810 18497
278 1 1 . 1 1 49 49 LEU CA C 49 57.890 57.890 57.873 0.017 18497
279 1 1 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.756 0.204 18497
280 1 1 . 1 1 49 49 LEU H H 49 8.237 8.237 8.451 -0.214 18497
281 1 1 . 1 1 50 50 ILE N N 50 119.715 119.715 119.682 0.033 18497
282 1 1 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.590 0.030 18497
283 1 1 . 1 1 50 50 ILE C C 50 179.502 179.502 177.706 1.796 18497
284 1 1 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.506 -0.446 18497
285 1 1 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.854 0.116 18497
286 1 1 . 1 1 50 50 ILE H H 50 7.543 7.543 8.610 -1.067 18497
287 1 1 . 1 1 51 51 ILE N N 51 117.995 117.995 121.337 -3.342 18497
288 1 1 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.497 0.043 18497
289 1 1 . 1 1 51 51 ILE C C 51 179.197 179.197 178.093 1.104 18497
290 1 1 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.490 -1.750 18497
291 1 1 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.447 -0.796 18497
292 1 1 . 1 1 51 51 ILE H H 51 7.475 7.475 8.050 -0.575 18497
293 1 1 . 1 1 52 52 ASP N N 52 121.642 121.642 120.564 1.078 18497
294 1 1 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.201 0.239 18497
295 1 1 . 1 1 52 52 ASP C C 52 179.197 179.197 177.966 1.231 18497
296 1 1 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.754 -0.654 18497
297 1 1 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.770 -0.470 18497
298 1 1 . 1 1 52 52 ASP H H 52 8.559 8.559 8.105 0.454 18497
299 1 1 . 1 1 53 53 ASN N N 53 117.131 117.131 118.502 -1.371 18497
300 1 1 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.301 0.309 18497
301 1 1 . 1 1 53 53 ASN C C 53 178.545 178.545 177.397 1.148 18497
302 1 1 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.398 -1.698 18497
303 1 1 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.799 -0.099 18497
304 1 1 . 1 1 53 53 ASN H H 53 8.106 8.106 8.048 0.058 18497
305 1 1 . 1 1 54 54 ARG N N 54 119.929 119.929 119.704 0.225 18497
306 1 1 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.028 0.092 18497
307 1 1 . 1 1 54 54 ARG C C 54 176.892 176.892 178.619 -1.727 18497
308 1 1 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.934 -0.774 18497
309 1 1 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.132 0.138 18497
310 1 1 . 1 1 54 54 ARG H H 54 7.797 7.797 8.280 -0.483 18497
311 1 1 . 1 1 55 55 ARG N N 55 119.227 119.227 116.900 2.327 18497
312 1 1 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.164 0.010 18497
313 1 1 . 1 1 55 55 ARG C C 55 175.108 175.108 178.095 -2.987 18497
314 1 1 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.633 3.247 18497
315 1 1 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.019 1.641 18497
316 1 1 . 1 1 55 55 ARG H H 55 7.857 7.857 7.665 0.192 18497
317 1 1 . 1 1 56 56 ILE N N 56 116.676 116.676 117.545 -0.869 18497
318 1 1 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.124 -0.114 18497
319 1 1 . 1 1 56 56 ILE C C 56 176.065 176.065 177.660 -1.595 18497
320 1 1 . 1 1 56 56 ILE CA C 56 62.140 62.140 61.966 0.174 18497
321 1 1 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.191 0.049 18497
322 1 1 . 1 1 56 56 ILE H H 56 8.317 8.317 8.370 -0.053 18497
323 1 1 . 1 1 57 57 MET N N 57 122.058 122.058 119.590 2.468 18497
324 1 1 . 1 1 57 57 MET HA H 57 4.420 4.420 4.033 0.387 18497
325 1 1 . 1 1 57 57 MET C C 57 177.283 177.283 178.453 -1.170 18497
326 1 1 . 1 1 57 57 MET CA C 57 56.030 56.030 59.398 -3.368 18497
327 1 1 . 1 1 57 57 MET CB C 57 32.515 32.515 32.156 0.359 18497
328 1 1 . 1 1 57 57 MET H H 57 8.177 8.177 7.797 0.380 18497
329 1 1 . 1 1 58 58 ASN N N 58 118.892 118.892 118.001 0.891 18497
330 1 1 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.509 0.181 18497
331 1 1 . 1 1 58 58 ASN C C 58 176.500 176.500 176.764 -0.264 18497
332 1 1 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.654 -2.001 18497
333 1 1 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.541 0.229 18497
334 1 1 . 1 1 58 58 ASN H H 58 8.238 8.238 8.419 -0.181 18497
335 1 1 . 1 1 59 59 GLN N N 59 120.456 120.456 116.488 3.968 18497
336 1 1 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.342 -0.032 18497
337 1 1 . 1 1 59 59 GLN C C 59 175.326 175.326 176.919 -1.593 18497
338 1 1 . 1 1 59 59 GLN CA C 59 56.030 56.030 56.607 -0.577 18497
339 1 1 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.141 -1.341 18497
340 1 1 . 1 1 59 59 GLN H H 59 8.196 8.196 7.791 0.405 18497
341 1 1 . 1 1 60 60 ALA N N 60 125.116 125.116 122.404 2.712 18497
342 1 1 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.241 0.141 18497
343 1 1 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.469 -1.169 18497
344 1 1 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.550 -0.440 18497
345 1 1 . 1 1 60 60 ALA H H 60 8.293 8.293 8.174 0.119 18497
346 1 1 . 1 1 61 61 SER N N 61 115.686 115.686 109.972 5.714 18497
347 1 1 . 1 1 61 61 SER HA H 61 4.470 4.470 4.650 -0.180 18497
348 1 1 . 1 1 61 61 SER C C 61 175.674 175.674 172.088 3.586 18497
349 1 1 . 1 1 61 61 SER CA C 61 58.160 58.160 57.950 0.210 18497
350 1 1 . 1 1 61 61 SER CB C 61 63.740 63.740 64.637 -0.897 18497
351 1 1 . 1 1 61 61 SER H H 61 8.290 8.290 7.541 0.749 18497
352 1 2 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.628 -0.198 18497
353 1 2 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.086 0.861 18497
354 1 2 . 1 1 2 2 PRO CB C 2 32.130 32.130 33.033 -0.903 18497
355 1 2 . 1 1 3 3 HIS N N 3 119.985 119.985 121.120 -1.135 18497
356 1 2 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.417 0.189 18497
357 1 2 . 1 1 3 3 HIS C C 3 176.587 176.587 176.457 0.130 18497
358 1 2 . 1 1 3 3 HIS CA C 3 56.185 56.185 57.931 -1.746 18497
359 1 2 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.328 0.143 18497
360 1 2 . 1 1 3 3 HIS H H 3 8.526 8.526 8.837 -0.311 18497
361 1 2 . 1 1 4 4 MET N N 4 122.338 122.338 117.818 4.520 18497
362 1 2 . 1 1 4 4 MET HA H 4 4.448 4.448 4.410 0.038 18497
363 1 2 . 1 1 4 4 MET C C 4 175.108 175.108 176.055 -0.947 18497
364 1 2 . 1 1 4 4 MET CA C 4 55.562 55.562 56.860 -1.298 18497
365 1 2 . 1 1 4 4 MET CB C 4 33.141 33.141 33.123 0.018 18497
366 1 2 . 1 1 4 4 MET H H 4 8.337 8.337 8.370 -0.033 18497
367 1 2 . 1 1 5 5 SER N N 5 116.990 116.990 112.117 4.873 18497
368 1 2 . 1 1 5 5 SER HA H 5 4.400 4.400 4.596 -0.196 18497
369 1 2 . 1 1 5 5 SER C C 5 177.979 177.979 172.683 5.296 18497
370 1 2 . 1 1 5 5 SER CA C 5 58.039 58.039 58.768 -0.729 18497
371 1 2 . 1 1 5 5 SER CB C 5 63.797 63.797 64.293 -0.496 18497
372 1 2 . 1 1 5 5 SER H H 5 8.330 8.330 7.720 0.610 18497
373 1 2 . 1 1 6 6 TYR N N 6 122.027 122.027 122.610 -0.583 18497
374 1 2 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.675 -0.165 18497
375 1 2 . 1 1 6 6 TYR C C 6 174.060 174.060 173.118 0.942 18497
376 1 2 . 1 1 6 6 TYR CA C 6 57.800 57.800 58.094 -0.294 18497
377 1 2 . 1 1 6 6 TYR CB C 6 38.685 38.685 41.355 -2.670 18497
378 1 2 . 1 1 6 6 TYR H H 6 8.201 8.201 7.996 0.205 18497
379 1 2 . 1 1 7 7 ASP N N 7 122.439 122.439 121.043 1.396 18497
380 1 2 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.562 -0.013 18497
381 1 2 . 1 1 7 7 ASP C C 7 175.150 175.150 173.723 1.427 18497
382 1 2 . 1 1 7 7 ASP CA C 7 53.640 53.640 52.883 0.757 18497
383 1 2 . 1 1 7 7 ASP CB C 7 41.300 41.300 43.502 -2.202 18497
384 1 2 . 1 1 7 7 ASP H H 7 8.119 8.119 7.075 1.044 18497
385 1 2 . 1 1 8 8 ALA N N 8 124.655 124.655 122.567 2.088 18497
386 1 2 . 1 1 8 8 ALA HA H 8 4.230 4.230 3.871 0.359 18497
387 1 2 . 1 1 8 8 ALA C C 8 175.935 175.935 178.536 -2.601 18497
388 1 2 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.352 -1.459 18497
389 1 2 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.053 -0.203 18497
390 1 2 . 1 1 8 8 ALA H H 8 8.235 8.235 8.382 -0.147 18497
391 1 2 . 1 1 9 9 ASN N N 9 116.133 116.133 116.215 -0.082 18497
392 1 2 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.572 0.118 18497
393 1 2 . 1 1 9 9 ASN C C 9 177.718 177.718 175.476 2.242 18497
394 1 2 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.130 -0.330 18497
395 1 2 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.671 -0.901 18497
396 1 2 . 1 1 9 9 ASN H H 9 8.417 8.417 7.760 0.657 18497
397 1 2 . 1 1 10 10 VAL N N 10 119.557 119.557 116.125 3.432 18497
398 1 2 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.640 0.537 18497
399 1 2 . 1 1 10 10 VAL C C 10 174.930 174.930 174.986 -0.056 18497
400 1 2 . 1 1 10 10 VAL CA C 10 61.880 61.880 62.962 -1.082 18497
401 1 2 . 1 1 10 10 VAL CB C 10 32.660 32.660 29.747 2.913 18497
402 1 2 . 1 1 10 10 VAL H H 10 7.859 7.859 8.528 -0.669 18497
403 1 2 . 1 1 11 11 ILE N N 11 126.561 126.561 125.067 1.494 18497
404 1 2 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.129 -0.089 18497
405 1 2 . 1 1 11 11 ILE C C 11 175.935 175.935 176.356 -0.421 18497
406 1 2 . 1 1 11 11 ILE CA C 11 59.500 59.500 61.039 -1.540 18497
407 1 2 . 1 1 11 11 ILE CB C 11 37.700 37.700 39.298 -1.598 18497
408 1 2 . 1 1 11 11 ILE H H 11 8.283 8.283 8.676 -0.393 18497
409 1 2 . 1 1 12 12 ASP N N 12 128.161 128.161 123.481 4.680 18497
410 1 2 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.919 -0.189 18497
411 1 2 . 1 1 12 12 ASP C C 12 174.891 174.891 175.886 -0.995 18497
412 1 2 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.279 0.148 18497
413 1 2 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.195 0.025 18497
414 1 2 . 1 1 12 12 ASP H H 12 8.477 8.477 8.469 0.008 18497
415 1 2 . 1 1 13 13 ASP N N 13 127.435 127.435 127.444 -0.009 18497
416 1 2 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.324 -0.008 18497
417 1 2 . 1 1 13 13 ASP C C 13 175.369 175.369 177.309 -1.940 18497
418 1 2 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.100 0.500 18497
419 1 2 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.353 -0.193 18497
420 1 2 . 1 1 13 13 ASP H H 13 8.698 8.698 8.923 -0.225 18497
421 1 2 . 1 1 14 14 GLU N N 14 119.796 119.796 119.262 0.534 18497
422 1 2 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.006 0.029 18497
423 1 2 . 1 1 14 14 GLU C C 14 178.588 178.588 178.133 0.455 18497
424 1 2 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.310 0.190 18497
425 1 2 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.630 -0.730 18497
426 1 2 . 1 1 14 14 GLU H H 14 8.205 8.205 8.647 -0.442 18497
427 1 2 . 1 1 15 15 ALA N N 15 124.156 124.156 123.048 1.108 18497
428 1 2 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.109 0.067 18497
429 1 2 . 1 1 15 15 ALA C C 15 179.502 179.502 179.794 -0.292 18497
430 1 2 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.216 -0.216 18497
431 1 2 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.208 0.692 18497
432 1 2 . 1 1 15 15 ALA H H 15 8.473 8.473 7.839 0.634 18497
433 1 2 . 1 1 16 16 VAL N N 16 117.585 117.585 118.318 -0.733 18497
434 1 2 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.642 -0.108 18497
435 1 2 . 1 1 16 16 VAL C C 16 179.545 179.545 178.236 1.309 18497
436 1 2 . 1 1 16 16 VAL CA C 16 68.000 68.000 66.811 1.190 18497
437 1 2 . 1 1 16 16 VAL CB C 16 31.600 31.600 30.872 0.728 18497
438 1 2 . 1 1 16 16 VAL H H 16 8.181 8.181 8.642 -0.461 18497
439 1 2 . 1 1 17 17 LYS N N 17 119.377 119.377 120.518 -1.141 18497
440 1 2 . 1 1 17 17 LYS HA H 17 3.956 3.956 4.032 -0.076 18497
441 1 2 . 1 1 17 17 LYS C C 17 178.197 178.197 179.215 -1.018 18497
442 1 2 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.290 0.730 18497
443 1 2 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.120 0.010 18497
444 1 2 . 1 1 17 17 LYS H H 17 8.001 8.001 8.041 -0.040 18497
445 1 2 . 1 1 18 18 GLU N N 18 120.395 120.395 119.462 0.933 18497
446 1 2 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.112 0.028 18497
447 1 2 . 1 1 18 18 GLU C C 18 178.849 178.849 179.133 -0.284 18497
448 1 2 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.211 0.589 18497
449 1 2 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.614 -0.121 18497
450 1 2 . 1 1 18 18 GLU H H 18 7.943 7.943 8.043 -0.100 18497
451 1 2 . 1 1 19 19 VAL N N 19 121.088 121.088 120.263 0.825 18497
452 1 2 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.769 -0.119 18497
453 1 2 . 1 1 19 19 VAL C C 19 179.415 179.415 178.351 1.064 18497
454 1 2 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.650 1.331 18497
455 1 2 . 1 1 19 19 VAL CB C 19 31.600 31.600 30.942 0.658 18497
456 1 2 . 1 1 19 19 VAL H H 19 8.335 8.335 8.702 -0.367 18497
457 1 2 . 1 1 20 20 CYS N N 20 117.290 117.290 118.445 -1.155 18497
458 1 2 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.060 0.620 18497
459 1 2 . 1 1 20 20 CYS C C 20 178.110 178.110 177.160 0.950 18497
460 1 2 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.017 0.183 18497
461 1 2 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.285 -0.485 18497
462 1 2 . 1 1 20 20 CYS H H 20 8.434 8.434 8.255 0.179 18497
463 1 2 . 1 1 21 21 GLU N N 21 118.195 118.195 119.153 -0.958 18497
464 1 2 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.123 0.016 18497
465 1 2 . 1 1 21 21 GLU C C 21 178.153 178.153 178.917 -0.764 18497
466 1 2 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.927 0.823 18497
467 1 2 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.535 -0.035 18497
468 1 2 . 1 1 21 21 GLU H H 21 7.972 7.972 7.865 0.107 18497
469 1 2 . 1 1 22 22 LYS N N 22 119.095 119.095 119.567 -0.472 18497
470 1 2 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.130 -0.125 18497
471 1 2 . 1 1 22 22 LYS C C 22 179.371 179.371 178.437 0.934 18497
472 1 2 . 1 1 22 22 LYS CA C 22 58.700 58.700 59.042 -0.342 18497
473 1 2 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.746 0.174 18497
474 1 2 . 1 1 22 22 LYS H H 22 8.071 8.071 8.324 -0.253 18497
475 1 2 . 1 1 23 23 PHE N N 23 114.252 114.252 117.327 -3.075 18497
476 1 2 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.515 -0.085 18497
477 1 2 . 1 1 23 23 PHE C C 23 178.197 178.197 174.743 3.454 18497
478 1 2 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.037 0.393 18497
479 1 2 . 1 1 23 23 PHE CB C 23 38.770 38.770 39.819 -1.049 18497
480 1 2 . 1 1 23 23 PHE H H 23 8.491 8.491 8.147 0.344 18497
481 1 2 . 1 1 24 24 GLU N N 24 119.819 119.819 115.977 3.842 18497
482 1 2 . 1 1 24 24 GLU HA H 24 4.070 4.070 3.917 0.153 18497
483 1 2 . 1 1 24 24 GLU C C 24 177.457 177.457 175.852 1.605 18497
484 1 2 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.325 -0.495 18497
485 1 2 . 1 1 24 24 GLU CB C 24 26.800 26.800 26.907 -0.107 18497
486 1 2 . 1 1 24 24 GLU H H 24 7.867 7.867 8.444 -0.577 18497
487 1 2 . 1 1 25 25 CYS N N 25 114.633 114.633 117.294 -2.661 18497
488 1 2 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.870 0.517 18497
489 1 2 . 1 1 25 25 CYS C C 25 174.760 174.760 174.198 0.562 18497
490 1 2 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.853 -2.092 18497
491 1 2 . 1 1 25 25 CYS CB C 25 31.600 31.600 29.962 1.638 18497
492 1 2 . 1 1 25 25 CYS H H 25 8.156 8.156 7.854 0.302 18497
493 1 2 . 1 1 26 26 THR N N 26 109.312 109.312 111.118 -1.806 18497
494 1 2 . 1 1 26 26 THR HA H 26 4.770 4.770 4.603 0.167 18497
495 1 2 . 1 1 26 26 THR C C 26 173.499 173.499 174.769 -1.270 18497
496 1 2 . 1 1 26 26 THR CA C 26 60.723 60.723 60.964 -0.241 18497
497 1 2 . 1 1 26 26 THR CB C 26 72.000 72.000 71.897 0.103 18497
498 1 2 . 1 1 26 26 THR H H 26 8.460 8.460 7.896 0.564 18497
499 1 2 . 1 1 27 27 GLU N N 27 122.233 122.233 124.188 -1.955 18497
500 1 2 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.881 -0.371 18497
501 1 2 . 1 1 27 27 GLU C C 27 176.544 176.544 178.173 -1.629 18497
502 1 2 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.840 -0.290 18497
503 1 2 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.381 -0.431 18497
504 1 2 . 1 1 27 27 GLU H H 27 9.327 9.327 9.060 0.267 18497
505 1 2 . 1 1 28 28 SER N N 28 112.925 112.925 114.451 -1.526 18497
506 1 2 . 1 1 28 28 SER HA H 28 4.062 4.062 4.170 -0.107 18497
507 1 2 . 1 1 28 28 SER C C 28 178.545 178.545 176.227 2.318 18497
508 1 2 . 1 1 28 28 SER CA C 28 61.350 61.350 61.150 0.200 18497
509 1 2 . 1 1 28 28 SER CB C 28 62.400 62.400 62.754 -0.354 18497
510 1 2 . 1 1 28 28 SER H H 28 8.320 8.320 8.507 -0.187 18497
511 1 2 . 1 1 29 29 GLU N N 29 121.736 121.736 121.654 0.082 18497
512 1 2 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.184 -0.194 18497
513 1 2 . 1 1 29 29 GLU C C 29 176.674 176.674 178.638 -1.964 18497
514 1 2 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.673 1.077 18497
515 1 2 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.474 -0.004 18497
516 1 2 . 1 1 29 29 GLU H H 29 7.512 7.512 7.526 -0.014 18497
517 1 2 . 1 1 30 30 VAL N N 30 119.480 119.480 120.568 -1.088 18497
518 1 2 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.627 -0.250 18497
519 1 2 . 1 1 30 30 VAL C C 30 179.241 179.241 178.182 1.059 18497
520 1 2 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.544 0.116 18497
521 1 2 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.610 -0.540 18497
522 1 2 . 1 1 30 30 VAL H H 30 7.492 7.492 8.057 -0.565 18497
523 1 2 . 1 1 31 31 MET N N 31 117.220 117.220 117.663 -0.443 18497
524 1 2 . 1 1 31 31 MET HA H 31 3.870 3.870 3.893 -0.023 18497
525 1 2 . 1 1 31 31 MET C C 31 177.936 177.936 178.309 -0.373 18497
526 1 2 . 1 1 31 31 MET CA C 31 57.630 57.630 59.252 -1.622 18497
527 1 2 . 1 1 31 31 MET CB C 31 30.270 30.270 32.117 -1.847 18497
528 1 2 . 1 1 31 31 MET H H 31 8.302 8.302 8.386 -0.084 18497
529 1 2 . 1 1 32 32 ASN N N 32 116.672 116.672 118.887 -2.215 18497
530 1 2 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.389 0.001 18497
531 1 2 . 1 1 32 32 ASN C C 32 176.065 176.065 177.793 -1.728 18497
532 1 2 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.951 -0.921 18497
533 1 2 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.429 -0.719 18497
534 1 2 . 1 1 32 32 ASN H H 32 8.313 8.313 8.178 0.135 18497
535 1 2 . 1 1 33 33 SER N N 33 117.471 117.471 115.382 2.089 18497
536 1 2 . 1 1 33 33 SER HA H 33 4.150 4.150 4.258 -0.108 18497
537 1 2 . 1 1 33 33 SER C C 33 178.806 178.806 175.734 3.072 18497
538 1 2 . 1 1 33 33 SER CA C 33 62.950 62.950 61.397 1.553 18497
539 1 2 . 1 1 33 33 SER CB C 33 62.600 62.600 63.256 -0.656 18497
540 1 2 . 1 1 33 33 SER H H 33 7.851 7.851 7.608 0.243 18497
541 1 2 . 1 1 34 34 LEU N N 34 122.839 122.839 121.070 1.769 18497
542 1 2 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.195 -0.316 18497
543 1 2 . 1 1 34 34 LEU C C 34 177.892 177.892 177.701 0.191 18497
544 1 2 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.447 1.183 18497
545 1 2 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.831 -1.031 18497
546 1 2 . 1 1 34 34 LEU H H 34 8.128 8.128 7.400 0.728 18497
547 1 2 . 1 1 35 35 TYR N N 35 116.666 116.666 121.399 -4.733 18497
548 1 2 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.100 0.510 18497
549 1 2 . 1 1 35 35 TYR C C 35 179.067 179.067 177.476 1.591 18497
550 1 2 . 1 1 35 35 TYR CA C 35 57.890 57.890 61.453 -3.563 18497
551 1 2 . 1 1 35 35 TYR CB C 35 37.710 37.710 38.952 -1.242 18497
552 1 2 . 1 1 35 35 TYR H H 35 7.924 7.924 8.285 -0.361 18497
553 1 2 . 1 1 36 36 SER N N 36 114.801 114.801 113.765 1.036 18497
554 1 2 . 1 1 36 36 SER HA H 36 4.080 4.080 4.261 -0.181 18497
555 1 2 . 1 1 36 36 SER C C 36 177.283 177.283 175.613 1.670 18497
556 1 2 . 1 1 36 36 SER CA C 36 60.519 60.519 59.729 0.790 18497
557 1 2 . 1 1 36 36 SER CB C 36 64.240 64.240 64.301 -0.061 18497
558 1 2 . 1 1 36 36 SER H H 36 7.715 7.715 8.432 -0.717 18497
559 1 2 . 1 1 37 37 GLY N N 37 109.803 109.803 111.031 -1.228 18497
560 1 2 . 1 1 37 37 GLY C C 37 175.978 175.978 173.769 2.209 18497
561 1 2 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.788 0.891 18497
562 1 2 . 1 1 37 37 GLY H H 37 8.017 8.017 7.685 0.332 18497
563 1 2 . 1 1 38 38 ASP N N 38 120.613 120.613 122.264 -1.651 18497
564 1 2 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.007 0.018 18497
565 1 2 . 1 1 38 38 ASP C C 38 173.368 173.368 176.428 -3.060 18497
566 1 2 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.854 -0.134 18497
567 1 2 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.387 -0.967 18497
568 1 2 . 1 1 38 38 ASP H H 38 8.006 8.006 8.149 -0.143 18497
569 1 2 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.478 -0.138 18497
570 1 2 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.814 -0.064 18497
571 1 2 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.353 -0.223 18497
572 1 2 . 1 1 40 40 GLN N N 40 115.056 115.056 116.703 -1.647 18497
573 1 2 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.242 0.038 18497
574 1 2 . 1 1 40 40 GLN C C 40 177.066 177.066 176.115 0.951 18497
575 1 2 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.945 -1.235 18497
576 1 2 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.922 -0.241 18497
577 1 2 . 1 1 40 40 GLN H H 40 8.237 8.237 8.104 0.133 18497
578 1 2 . 1 1 41 41 ASP N N 41 122.839 122.839 121.211 1.628 18497
579 1 2 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.495 -0.182 18497
580 1 2 . 1 1 41 41 ASP C C 41 175.804 175.804 177.664 -1.860 18497
581 1 2 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.160 1.080 18497
582 1 2 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.510 -0.290 18497
583 1 2 . 1 1 41 41 ASP H H 41 7.211 7.211 7.402 -0.191 18497
584 1 2 . 1 1 42 42 GLN N N 42 124.547 124.547 123.458 1.089 18497
585 1 2 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.050 -0.190 18497
586 1 2 . 1 1 42 42 GLN C C 42 177.196 177.196 177.652 -0.456 18497
587 1 2 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.296 -0.076 18497
588 1 2 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.100 -0.700 18497
589 1 2 . 1 1 42 42 GLN H H 42 8.719 8.719 8.838 -0.119 18497
590 1 2 . 1 1 43 43 LEU N N 43 118.960 118.960 118.447 0.513 18497
591 1 2 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.869 -0.184 18497
592 1 2 . 1 1 43 43 LEU C C 43 178.066 178.066 178.448 -0.382 18497
593 1 2 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.733 0.627 18497
594 1 2 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.337 -0.947 18497
595 1 2 . 1 1 43 43 LEU H H 43 8.206 8.206 8.132 0.074 18497
596 1 2 . 1 1 44 44 ALA N N 44 121.666 121.666 123.311 -1.645 18497
597 1 2 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.088 -0.209 18497
598 1 2 . 1 1 44 44 ALA C C 44 178.327 178.327 179.564 -1.237 18497
599 1 2 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.984 -0.274 18497
600 1 2 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.242 0.338 18497
601 1 2 . 1 1 44 44 ALA H H 44 7.402 7.402 7.662 -0.260 18497
602 1 2 . 1 1 45 45 VAL N N 45 118.589 118.589 120.130 -1.541 18497
603 1 2 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.604 0.056 18497
604 1 2 . 1 1 45 45 VAL C C 45 179.893 179.893 177.817 2.076 18497
605 1 2 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.880 -0.480 18497
606 1 2 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.238 0.893 18497
607 1 2 . 1 1 45 45 VAL H H 45 8.449 8.449 8.483 -0.034 18497
608 1 2 . 1 1 46 46 ALA N N 46 121.006 121.006 122.572 -1.566 18497
609 1 2 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.770 0.360 18497
610 1 2 . 1 1 46 46 ALA C C 46 179.110 179.110 179.112 -0.002 18497
611 1 2 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.057 -0.087 18497
612 1 2 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.210 1.900 18497
613 1 2 . 1 1 46 46 ALA H H 46 7.654 7.654 7.943 -0.289 18497
614 1 2 . 1 1 47 47 TYR N N 47 119.140 119.140 119.875 -0.735 18497
615 1 2 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.956 -0.206 18497
616 1 2 . 1 1 47 47 TYR C C 47 179.328 179.328 177.433 1.895 18497
617 1 2 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.687 0.193 18497
618 1 2 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.253 0.247 18497
619 1 2 . 1 1 47 47 TYR H H 47 8.077 8.077 8.076 0.001 18497
620 1 2 . 1 1 48 48 HIS N N 48 116.422 116.422 118.753 -2.331 18497
621 1 2 . 1 1 48 48 HIS HA H 48 4.100 4.100 3.990 0.110 18497
622 1 2 . 1 1 48 48 HIS C C 48 178.023 178.023 177.693 0.330 18497
623 1 2 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.837 0.183 18497
624 1 2 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.060 -1.120 18497
625 1 2 . 1 1 48 48 HIS H H 48 8.326 8.326 8.352 -0.026 18497
626 1 2 . 1 1 49 49 LEU N N 49 120.974 120.974 119.987 0.987 18497
627 1 2 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.242 -0.087 18497
628 1 2 . 1 1 49 49 LEU C C 49 177.417 177.417 179.748 -2.331 18497
629 1 2 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.079 -0.189 18497
630 1 2 . 1 1 49 49 LEU CB C 49 41.960 41.960 42.001 -0.041 18497
631 1 2 . 1 1 49 49 LEU H H 49 8.237 8.237 8.402 -0.165 18497
632 1 2 . 1 1 50 50 ILE N N 50 119.715 119.715 119.661 0.054 18497
633 1 2 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.686 -0.066 18497
634 1 2 . 1 1 50 50 ILE C C 50 179.502 179.502 177.949 1.553 18497
635 1 2 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.581 -0.521 18497
636 1 2 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.940 0.030 18497
637 1 2 . 1 1 50 50 ILE H H 50 7.543 7.543 8.418 -0.874 18497
638 1 2 . 1 1 51 51 ILE N N 51 117.995 117.995 121.914 -3.919 18497
639 1 2 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.420 0.120 18497
640 1 2 . 1 1 51 51 ILE C C 51 179.197 179.197 177.468 1.729 18497
641 1 2 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.798 -2.058 18497
642 1 2 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.252 -0.602 18497
643 1 2 . 1 1 51 51 ILE H H 51 7.475 7.475 7.977 -0.502 18497
644 1 2 . 1 1 52 52 ASP N N 52 121.642 121.642 120.528 1.114 18497
645 1 2 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.266 0.174 18497
646 1 2 . 1 1 52 52 ASP C C 52 179.197 179.197 178.951 0.246 18497
647 1 2 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.881 -0.781 18497
648 1 2 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.036 0.264 18497
649 1 2 . 1 1 52 52 ASP H H 52 8.559 8.559 8.469 0.090 18497
650 1 2 . 1 1 53 53 ASN N N 53 117.131 117.131 118.523 -1.392 18497
651 1 2 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.426 0.184 18497
652 1 2 . 1 1 53 53 ASN C C 53 178.545 178.545 177.881 0.664 18497
653 1 2 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.179 -1.479 18497
654 1 2 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.709 -0.009 18497
655 1 2 . 1 1 53 53 ASN H H 53 8.106 8.106 8.205 -0.099 18497
656 1 2 . 1 1 54 54 ARG N N 54 119.929 119.929 120.275 -0.346 18497
657 1 2 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.006 0.114 18497
658 1 2 . 1 1 54 54 ARG C C 54 176.892 176.892 178.391 -1.499 18497
659 1 2 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.936 -0.776 18497
660 1 2 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.210 0.060 18497
661 1 2 . 1 1 54 54 ARG H H 54 7.797 7.797 8.192 -0.395 18497
662 1 2 . 1 1 55 55 ARG N N 55 119.227 119.227 117.217 2.010 18497
663 1 2 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.205 -0.031 18497
664 1 2 . 1 1 55 55 ARG C C 55 175.108 175.108 179.058 -3.950 18497
665 1 2 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.681 3.199 18497
666 1 2 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.855 1.805 18497
667 1 2 . 1 1 55 55 ARG H H 55 7.857 7.857 8.162 -0.305 18497
668 1 2 . 1 1 56 56 ILE N N 56 116.676 116.676 119.328 -2.652 18497
669 1 2 . 1 1 56 56 ILE HA H 56 4.010 4.010 3.940 0.070 18497
670 1 2 . 1 1 56 56 ILE C C 56 176.065 176.065 177.357 -1.292 18497
671 1 2 . 1 1 56 56 ILE CA C 56 62.140 62.140 63.947 -1.806 18497
672 1 2 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.768 -0.528 18497
673 1 2 . 1 1 56 56 ILE H H 56 8.317 8.317 8.361 -0.044 18497
674 1 2 . 1 1 57 57 MET N N 57 122.058 122.058 117.083 4.975 18497
675 1 2 . 1 1 57 57 MET HA H 57 4.420 4.420 4.555 -0.135 18497
676 1 2 . 1 1 57 57 MET C C 57 177.283 177.283 175.207 2.076 18497
677 1 2 . 1 1 57 57 MET CA C 57 56.030 56.030 54.278 1.752 18497
678 1 2 . 1 1 57 57 MET CB C 57 32.515 32.515 31.907 0.608 18497
679 1 2 . 1 1 57 57 MET H H 57 8.177 8.177 7.562 0.615 18497
680 1 2 . 1 1 58 58 ASN N N 58 118.892 118.892 119.989 -1.097 18497
681 1 2 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.553 0.137 18497
682 1 2 . 1 1 58 58 ASN C C 58 176.500 176.500 174.927 1.573 18497
683 1 2 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.504 -0.851 18497
684 1 2 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.070 -0.300 18497
685 1 2 . 1 1 58 58 ASN H H 58 8.238 8.238 8.002 0.236 18497
686 1 2 . 1 1 59 59 GLN N N 59 120.456 120.456 125.528 -5.072 18497
687 1 2 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.508 -0.198 18497
688 1 2 . 1 1 59 59 GLN C C 59 175.326 175.326 173.718 1.608 18497
689 1 2 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.506 0.524 18497
690 1 2 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.871 -2.071 18497
691 1 2 . 1 1 59 59 GLN H H 59 8.196 8.196 8.434 -0.238 18497
692 1 2 . 1 1 60 60 ALA N N 60 125.116 125.116 126.396 -1.280 18497
693 1 2 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.768 -0.386 18497
694 1 2 . 1 1 60 60 ALA CA C 60 52.300 52.300 52.110 0.190 18497
695 1 2 . 1 1 60 60 ALA CB C 60 19.110 19.110 20.415 -1.305 18497
696 1 2 . 1 1 60 60 ALA H H 60 8.293 8.293 8.496 -0.203 18497
697 1 2 . 1 1 61 61 SER N N 61 115.686 115.686 115.358 0.328 18497
698 1 2 . 1 1 61 61 SER HA H 61 4.470 4.470 4.412 0.058 18497
699 1 2 . 1 1 61 61 SER C C 61 175.674 175.674 174.667 1.007 18497
700 1 2 . 1 1 61 61 SER CA C 61 58.160 58.160 58.685 -0.525 18497
701 1 2 . 1 1 61 61 SER CB C 61 63.740 63.740 63.354 0.386 18497
702 1 2 . 1 1 61 61 SER H H 61 8.290 8.290 8.720 -0.430 18497
703 1 3 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.318 0.112 18497
704 1 3 . 1 1 2 2 PRO CA C 2 62.947 62.947 64.116 -1.169 18497
705 1 3 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.066 0.064 18497
706 1 3 . 1 1 3 3 HIS N N 3 119.985 119.985 112.281 7.704 18497
707 1 3 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.438 0.168 18497
708 1 3 . 1 1 3 3 HIS C C 3 176.587 176.587 175.734 0.853 18497
709 1 3 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.376 -0.191 18497
710 1 3 . 1 1 3 3 HIS CB C 3 30.471 30.471 28.880 1.591 18497
711 1 3 . 1 1 3 3 HIS H H 3 8.526 8.526 8.055 0.471 18497
712 1 3 . 1 1 4 4 MET N N 4 122.338 122.338 120.616 1.722 18497
713 1 3 . 1 1 4 4 MET HA H 4 4.448 4.448 4.398 0.050 18497
714 1 3 . 1 1 4 4 MET C C 4 175.108 175.108 176.162 -1.054 18497
715 1 3 . 1 1 4 4 MET CA C 4 55.562 55.562 55.553 0.009 18497
716 1 3 . 1 1 4 4 MET CB C 4 33.141 33.141 33.144 -0.003 18497
717 1 3 . 1 1 4 4 MET H H 4 8.337 8.337 7.279 1.058 18497
718 1 3 . 1 1 5 5 SER N N 5 116.990 116.990 118.569 -1.579 18497
719 1 3 . 1 1 5 5 SER HA H 5 4.400 4.400 4.481 -0.081 18497
720 1 3 . 1 1 5 5 SER C C 5 177.979 177.979 175.025 2.954 18497
721 1 3 . 1 1 5 5 SER CA C 5 58.039 58.039 57.967 0.072 18497
722 1 3 . 1 1 5 5 SER CB C 5 63.797 63.797 63.935 -0.138 18497
723 1 3 . 1 1 5 5 SER H H 5 8.330 8.330 8.338 -0.008 18497
724 1 3 . 1 1 6 6 TYR N N 6 122.027 122.027 123.516 -1.489 18497
725 1 3 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.382 0.128 18497
726 1 3 . 1 1 6 6 TYR C C 6 174.060 174.060 175.305 -1.245 18497
727 1 3 . 1 1 6 6 TYR CA C 6 57.800 57.800 59.905 -2.105 18497
728 1 3 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.313 -0.628 18497
729 1 3 . 1 1 6 6 TYR H H 6 8.201 8.201 8.654 -0.453 18497
730 1 3 . 1 1 7 7 ASP N N 7 122.439 122.439 114.301 8.138 18497
731 1 3 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.641 -0.092 18497
732 1 3 . 1 1 7 7 ASP C C 7 175.150 175.150 175.552 -0.402 18497
733 1 3 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.562 0.078 18497
734 1 3 . 1 1 7 7 ASP CB C 7 41.300 41.300 42.295 -0.995 18497
735 1 3 . 1 1 7 7 ASP H H 7 8.119 8.119 7.641 0.478 18497
736 1 3 . 1 1 8 8 ALA N N 8 124.655 124.655 125.439 -0.784 18497
737 1 3 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.178 0.052 18497
738 1 3 . 1 1 8 8 ALA C C 8 175.935 175.935 178.322 -2.387 18497
739 1 3 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.371 -1.478 18497
740 1 3 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.651 0.199 18497
741 1 3 . 1 1 8 8 ALA H H 8 8.235 8.235 8.562 -0.327 18497
742 1 3 . 1 1 9 9 ASN N N 9 116.133 116.133 115.653 0.480 18497
743 1 3 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.832 -0.142 18497
744 1 3 . 1 1 9 9 ASN C C 9 177.718 177.718 175.403 2.315 18497
745 1 3 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.047 0.753 18497
746 1 3 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.667 -0.897 18497
747 1 3 . 1 1 9 9 ASN H H 9 8.417 8.417 8.431 -0.014 18497
748 1 3 . 1 1 10 10 VAL N N 10 119.557 119.557 122.264 -2.707 18497
749 1 3 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.943 0.234 18497
750 1 3 . 1 1 10 10 VAL C C 10 174.930 174.930 176.259 -1.329 18497
751 1 3 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.607 -1.727 18497
752 1 3 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.651 0.009 18497
753 1 3 . 1 1 10 10 VAL H H 10 7.859 7.859 7.623 0.236 18497
754 1 3 . 1 1 11 11 ILE N N 11 126.561 126.561 128.539 -1.978 18497
755 1 3 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.101 -0.061 18497
756 1 3 . 1 1 11 11 ILE C C 11 175.935 175.935 175.583 0.352 18497
757 1 3 . 1 1 11 11 ILE CA C 11 59.500 59.500 61.145 -1.645 18497
758 1 3 . 1 1 11 11 ILE CB C 11 37.700 37.700 38.495 -0.795 18497
759 1 3 . 1 1 11 11 ILE H H 11 8.283 8.283 8.260 0.023 18497
760 1 3 . 1 1 12 12 ASP N N 12 128.161 128.161 127.973 0.188 18497
761 1 3 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.817 -0.087 18497
762 1 3 . 1 1 12 12 ASP C C 12 174.891 174.891 176.328 -1.437 18497
763 1 3 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.737 -0.310 18497
764 1 3 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.718 -0.498 18497
765 1 3 . 1 1 12 12 ASP H H 12 8.477 8.477 8.343 0.134 18497
766 1 3 . 1 1 13 13 ASP N N 13 127.435 127.435 128.362 -0.927 18497
767 1 3 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.341 -0.025 18497
768 1 3 . 1 1 13 13 ASP C C 13 175.369 175.369 177.480 -2.111 18497
769 1 3 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.211 0.390 18497
770 1 3 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.265 -0.105 18497
771 1 3 . 1 1 13 13 ASP H H 13 8.698 8.698 8.986 -0.288 18497
772 1 3 . 1 1 14 14 GLU N N 14 119.796 119.796 119.380 0.416 18497
773 1 3 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.071 -0.036 18497
774 1 3 . 1 1 14 14 GLU C C 14 178.588 178.588 178.242 0.346 18497
775 1 3 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.610 -0.110 18497
776 1 3 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.719 -0.819 18497
777 1 3 . 1 1 14 14 GLU H H 14 8.205 8.205 8.658 -0.453 18497
778 1 3 . 1 1 15 15 ALA N N 15 124.156 124.156 122.497 1.659 18497
779 1 3 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.030 0.146 18497
780 1 3 . 1 1 15 15 ALA C C 15 179.502 179.502 179.559 -0.057 18497
781 1 3 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.087 -0.088 18497
782 1 3 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.265 0.635 18497
783 1 3 . 1 1 15 15 ALA H H 15 8.473 8.473 7.737 0.736 18497
784 1 3 . 1 1 16 16 VAL N N 16 117.585 117.585 119.533 -1.948 18497
785 1 3 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.655 -0.121 18497
786 1 3 . 1 1 16 16 VAL C C 16 179.545 179.545 178.023 1.522 18497
787 1 3 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.411 0.589 18497
788 1 3 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.040 0.560 18497
789 1 3 . 1 1 16 16 VAL H H 16 8.181 8.181 8.711 -0.530 18497
790 1 3 . 1 1 17 17 LYS N N 17 119.377 119.377 120.194 -0.817 18497
791 1 3 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.873 0.083 18497
792 1 3 . 1 1 17 17 LYS C C 17 178.197 178.197 178.674 -0.477 18497
793 1 3 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.303 -0.283 18497
794 1 3 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.301 -0.171 18497
795 1 3 . 1 1 17 17 LYS H H 17 8.001 8.001 8.315 -0.314 18497
796 1 3 . 1 1 18 18 GLU N N 18 120.395 120.395 119.864 0.531 18497
797 1 3 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.088 0.052 18497
798 1 3 . 1 1 18 18 GLU C C 18 178.849 178.849 178.890 -0.041 18497
799 1 3 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.513 0.287 18497
800 1 3 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.728 -0.235 18497
801 1 3 . 1 1 18 18 GLU H H 18 7.943 7.943 8.109 -0.166 18497
802 1 3 . 1 1 19 19 VAL N N 19 121.088 121.088 119.763 1.325 18497
803 1 3 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.783 -0.133 18497
804 1 3 . 1 1 19 19 VAL C C 19 179.415 179.415 178.311 1.104 18497
805 1 3 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.845 1.135 18497
806 1 3 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.038 0.562 18497
807 1 3 . 1 1 19 19 VAL H H 19 8.335 8.335 8.665 -0.330 18497
808 1 3 . 1 1 20 20 CYS N N 20 117.290 117.290 119.682 -2.392 18497
809 1 3 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.457 0.223 18497
810 1 3 . 1 1 20 20 CYS C C 20 178.110 178.110 176.626 1.484 18497
811 1 3 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.508 0.692 18497
812 1 3 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.338 -0.538 18497
813 1 3 . 1 1 20 20 CYS H H 20 8.434 8.434 8.340 0.094 18497
814 1 3 . 1 1 21 21 GLU N N 21 118.195 118.195 119.518 -1.323 18497
815 1 3 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.107 0.032 18497
816 1 3 . 1 1 21 21 GLU C C 21 178.153 178.153 178.498 -0.345 18497
817 1 3 . 1 1 21 21 GLU CA C 21 59.750 59.750 59.002 0.748 18497
818 1 3 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.770 -0.270 18497
819 1 3 . 1 1 21 21 GLU H H 21 7.972 7.972 7.927 0.045 18497
820 1 3 . 1 1 22 22 LYS N N 22 119.095 119.095 117.805 1.290 18497
821 1 3 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.177 -0.172 18497
822 1 3 . 1 1 22 22 LYS C C 22 179.371 179.371 178.426 0.945 18497
823 1 3 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.683 0.017 18497
824 1 3 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.909 0.011 18497
825 1 3 . 1 1 22 22 LYS H H 22 8.071 8.071 8.272 -0.201 18497
826 1 3 . 1 1 23 23 PHE N N 23 114.252 114.252 118.197 -3.945 18497
827 1 3 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.507 -0.077 18497
828 1 3 . 1 1 23 23 PHE C C 23 178.197 178.197 174.859 3.338 18497
829 1 3 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.413 0.017 18497
830 1 3 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.216 -1.446 18497
831 1 3 . 1 1 23 23 PHE H H 23 8.491 8.491 8.098 0.393 18497
832 1 3 . 1 1 24 24 GLU N N 24 119.819 119.819 115.075 4.744 18497
833 1 3 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.095 -0.025 18497
834 1 3 . 1 1 24 24 GLU C C 24 177.457 177.457 175.448 2.009 18497
835 1 3 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.264 -0.434 18497
836 1 3 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.327 -0.527 18497
837 1 3 . 1 1 24 24 GLU H H 24 7.867 7.867 8.207 -0.340 18497
838 1 3 . 1 1 25 25 CYS N N 25 114.633 114.633 117.574 -2.941 18497
839 1 3 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.861 0.526 18497
840 1 3 . 1 1 25 25 CYS C C 25 174.760 174.760 175.112 -0.352 18497
841 1 3 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.081 -2.320 18497
842 1 3 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.613 0.987 18497
843 1 3 . 1 1 25 25 CYS H H 25 8.156 8.156 7.775 0.381 18497
844 1 3 . 1 1 26 26 THR N N 26 109.312 109.312 115.922 -6.610 18497
845 1 3 . 1 1 26 26 THR HA H 26 4.770 4.770 4.323 0.447 18497
846 1 3 . 1 1 26 26 THR C C 26 173.499 173.499 176.037 -2.538 18497
847 1 3 . 1 1 26 26 THR CA C 26 60.723 60.723 62.606 -1.883 18497
848 1 3 . 1 1 26 26 THR CB C 26 72.000 72.000 69.485 2.515 18497
849 1 3 . 1 1 26 26 THR H H 26 8.460 8.460 8.477 -0.017 18497
850 1 3 . 1 1 27 27 GLU N N 27 122.233 122.233 125.609 -3.376 18497
851 1 3 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.966 -0.456 18497
852 1 3 . 1 1 27 27 GLU C C 27 176.544 176.544 177.797 -1.253 18497
853 1 3 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.195 0.355 18497
854 1 3 . 1 1 27 27 GLU CB C 27 28.950 28.950 28.491 0.459 18497
855 1 3 . 1 1 27 27 GLU H H 27 9.327 9.327 8.900 0.427 18497
856 1 3 . 1 1 28 28 SER N N 28 112.925 112.925 116.941 -4.016 18497
857 1 3 . 1 1 28 28 SER HA H 28 4.062 4.062 4.178 -0.116 18497
858 1 3 . 1 1 28 28 SER C C 28 178.545 178.545 176.622 1.923 18497
859 1 3 . 1 1 28 28 SER CA C 28 61.350 61.350 62.193 -0.843 18497
860 1 3 . 1 1 28 28 SER CB C 28 62.400 62.400 62.483 -0.083 18497
861 1 3 . 1 1 28 28 SER H H 28 8.320 8.320 8.462 -0.142 18497
862 1 3 . 1 1 29 29 GLU N N 29 121.736 121.736 121.480 0.256 18497
863 1 3 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.191 -0.201 18497
864 1 3 . 1 1 29 29 GLU C C 29 176.674 176.674 178.731 -2.057 18497
865 1 3 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.885 0.866 18497
866 1 3 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.544 -0.074 18497
867 1 3 . 1 1 29 29 GLU H H 29 7.512 7.512 7.665 -0.153 18497
868 1 3 . 1 1 30 30 VAL N N 30 119.480 119.480 120.653 -1.173 18497
869 1 3 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.613 -0.236 18497
870 1 3 . 1 1 30 30 VAL C C 30 179.241 179.241 178.275 0.966 18497
871 1 3 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.609 0.051 18497
872 1 3 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.198 -0.128 18497
873 1 3 . 1 1 30 30 VAL H H 30 7.492 7.492 8.218 -0.726 18497
874 1 3 . 1 1 31 31 MET N N 31 117.220 117.220 117.598 -0.378 18497
875 1 3 . 1 1 31 31 MET HA H 31 3.870 3.870 3.880 -0.010 18497
876 1 3 . 1 1 31 31 MET C C 31 177.936 177.936 178.405 -0.469 18497
877 1 3 . 1 1 31 31 MET CA C 31 57.630 57.630 59.325 -1.695 18497
878 1 3 . 1 1 31 31 MET CB C 31 30.270 30.270 32.078 -1.808 18497
879 1 3 . 1 1 31 31 MET H H 31 8.302 8.302 8.491 -0.189 18497
880 1 3 . 1 1 32 32 ASN N N 32 116.672 116.672 118.980 -2.308 18497
881 1 3 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.423 -0.033 18497
882 1 3 . 1 1 32 32 ASN C C 32 176.065 176.065 177.883 -1.818 18497
883 1 3 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.873 -0.843 18497
884 1 3 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.404 -0.694 18497
885 1 3 . 1 1 32 32 ASN H H 32 8.313 8.313 8.177 0.136 18497
886 1 3 . 1 1 33 33 SER N N 33 117.471 117.471 114.921 2.550 18497
887 1 3 . 1 1 33 33 SER HA H 33 4.150 4.150 4.217 -0.067 18497
888 1 3 . 1 1 33 33 SER C C 33 178.806 178.806 175.606 3.200 18497
889 1 3 . 1 1 33 33 SER CA C 33 62.950 62.950 61.029 1.921 18497
890 1 3 . 1 1 33 33 SER CB C 33 62.600 62.600 63.257 -0.657 18497
891 1 3 . 1 1 33 33 SER H H 33 7.851 7.851 7.952 -0.101 18497
892 1 3 . 1 1 34 34 LEU N N 34 122.839 122.839 119.017 3.822 18497
893 1 3 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.209 -0.330 18497
894 1 3 . 1 1 34 34 LEU C C 34 177.892 177.892 177.459 0.433 18497
895 1 3 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.215 1.415 18497
896 1 3 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.516 -1.716 18497
897 1 3 . 1 1 34 34 LEU H H 34 8.128 8.128 7.356 0.772 18497
898 1 3 . 1 1 35 35 TYR N N 35 116.666 116.666 118.259 -1.593 18497
899 1 3 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.434 0.176 18497
900 1 3 . 1 1 35 35 TYR C C 35 179.067 179.067 175.822 3.245 18497
901 1 3 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.531 -1.641 18497
902 1 3 . 1 1 35 35 TYR CB C 35 37.710 37.710 40.626 -2.916 18497
903 1 3 . 1 1 35 35 TYR H H 35 7.924 7.924 7.927 -0.003 18497
904 1 3 . 1 1 36 36 SER N N 36 114.801 114.801 112.501 2.300 18497
905 1 3 . 1 1 36 36 SER HA H 36 4.080 4.080 4.495 -0.415 18497
906 1 3 . 1 1 36 36 SER C C 36 177.283 177.283 174.723 2.560 18497
907 1 3 . 1 1 36 36 SER CA C 36 60.519 60.519 58.152 2.367 18497
908 1 3 . 1 1 36 36 SER CB C 36 64.240 64.240 65.722 -1.482 18497
909 1 3 . 1 1 36 36 SER H H 36 7.715 7.715 8.377 -0.662 18497
910 1 3 . 1 1 37 37 GLY N N 37 109.803 109.803 111.116 -1.313 18497
911 1 3 . 1 1 37 37 GLY C C 37 175.978 175.978 172.685 3.293 18497
912 1 3 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.361 0.317 18497
913 1 3 . 1 1 37 37 GLY H H 37 8.017 8.017 7.957 0.060 18497
914 1 3 . 1 1 38 38 ASP N N 38 120.613 120.613 118.863 1.750 18497
915 1 3 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.991 0.034 18497
916 1 3 . 1 1 38 38 ASP C C 38 173.368 173.368 174.626 -1.258 18497
917 1 3 . 1 1 38 38 ASP CA C 38 50.720 50.720 52.002 -1.282 18497
918 1 3 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.024 -1.604 18497
919 1 3 . 1 1 38 38 ASP H H 38 8.006 8.006 8.041 -0.035 18497
920 1 3 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.262 0.078 18497
921 1 3 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.361 -0.610 18497
922 1 3 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.055 0.075 18497
923 1 3 . 1 1 40 40 GLN N N 40 115.056 115.056 114.431 0.625 18497
924 1 3 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.219 0.061 18497
925 1 3 . 1 1 40 40 GLN C C 40 177.066 177.066 176.162 0.904 18497
926 1 3 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.686 -0.976 18497
927 1 3 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.958 -0.278 18497
928 1 3 . 1 1 40 40 GLN H H 40 8.237 8.237 8.103 0.134 18497
929 1 3 . 1 1 41 41 ASP N N 41 122.839 122.839 121.538 1.301 18497
930 1 3 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.525 -0.212 18497
931 1 3 . 1 1 41 41 ASP C C 41 175.804 175.804 177.085 -1.281 18497
932 1 3 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.430 0.810 18497
933 1 3 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.572 -0.352 18497
934 1 3 . 1 1 41 41 ASP H H 41 7.211 7.211 7.734 -0.523 18497
935 1 3 . 1 1 42 42 GLN N N 42 124.547 124.547 123.799 0.748 18497
936 1 3 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.038 -0.178 18497
937 1 3 . 1 1 42 42 GLN C C 42 177.196 177.196 177.798 -0.602 18497
938 1 3 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.626 -0.406 18497
939 1 3 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.852 -0.452 18497
940 1 3 . 1 1 42 42 GLN H H 42 8.719 8.719 8.852 -0.133 18497
941 1 3 . 1 1 43 43 LEU N N 43 118.960 118.960 118.591 0.369 18497
942 1 3 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.884 -0.199 18497
943 1 3 . 1 1 43 43 LEU C C 43 178.066 178.066 178.399 -0.333 18497
944 1 3 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.886 0.474 18497
945 1 3 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.356 -0.966 18497
946 1 3 . 1 1 43 43 LEU H H 43 8.206 8.206 8.515 -0.309 18497
947 1 3 . 1 1 44 44 ALA N N 44 121.666 121.666 123.106 -1.440 18497
948 1 3 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.109 -0.230 18497
949 1 3 . 1 1 44 44 ALA C C 44 178.327 178.327 179.535 -1.208 18497
950 1 3 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.890 -0.180 18497
951 1 3 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.193 0.387 18497
952 1 3 . 1 1 44 44 ALA H H 44 7.402 7.402 7.692 -0.290 18497
953 1 3 . 1 1 45 45 VAL N N 45 118.589 118.589 119.895 -1.306 18497
954 1 3 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.537 0.123 18497
955 1 3 . 1 1 45 45 VAL C C 45 179.893 179.893 177.821 2.072 18497
956 1 3 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.897 -0.497 18497
957 1 3 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.582 0.549 18497
958 1 3 . 1 1 45 45 VAL H H 45 8.449 8.449 8.647 -0.198 18497
959 1 3 . 1 1 46 46 ALA N N 46 121.006 121.006 122.410 -1.404 18497
960 1 3 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.775 0.355 18497
961 1 3 . 1 1 46 46 ALA C C 46 179.110 179.110 179.010 0.100 18497
962 1 3 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.047 -0.077 18497
963 1 3 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.173 1.937 18497
964 1 3 . 1 1 46 46 ALA H H 46 7.654 7.654 7.969 -0.315 18497
965 1 3 . 1 1 47 47 TYR N N 47 119.140 119.140 119.927 -0.787 18497
966 1 3 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.978 -0.228 18497
967 1 3 . 1 1 47 47 TYR C C 47 179.328 179.328 177.392 1.936 18497
968 1 3 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.184 -0.304 18497
969 1 3 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.366 0.134 18497
970 1 3 . 1 1 47 47 TYR H H 47 8.077 8.077 8.042 0.035 18497
971 1 3 . 1 1 48 48 HIS N N 48 116.422 116.422 119.124 -2.702 18497
972 1 3 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.114 -0.014 18497
973 1 3 . 1 1 48 48 HIS C C 48 178.023 178.023 177.593 0.430 18497
974 1 3 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.511 -0.491 18497
975 1 3 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.840 -0.900 18497
976 1 3 . 1 1 48 48 HIS H H 48 8.326 8.326 8.506 -0.180 18497
977 1 3 . 1 1 49 49 LEU N N 49 120.974 120.974 119.657 1.317 18497
978 1 3 . 1 1 49 49 LEU HA H 49 4.155 4.155 3.932 0.223 18497
979 1 3 . 1 1 49 49 LEU C C 49 177.417 177.417 179.124 -1.707 18497
980 1 3 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.093 -0.203 18497
981 1 3 . 1 1 49 49 LEU CB C 49 41.960 41.960 42.009 -0.049 18497
982 1 3 . 1 1 49 49 LEU H H 49 8.237 8.237 8.270 -0.033 18497
983 1 3 . 1 1 50 50 ILE N N 50 119.715 119.715 119.574 0.141 18497
984 1 3 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.675 -0.055 18497
985 1 3 . 1 1 50 50 ILE C C 50 179.502 179.502 177.943 1.559 18497
986 1 3 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.123 -0.062 18497
987 1 3 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.970 -0.000 18497
988 1 3 . 1 1 50 50 ILE H H 50 7.543 7.543 8.380 -0.837 18497
989 1 3 . 1 1 51 51 ILE N N 51 117.995 117.995 121.251 -3.256 18497
990 1 3 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.448 0.092 18497
991 1 3 . 1 1 51 51 ILE C C 51 179.197 179.197 177.634 1.563 18497
992 1 3 . 1 1 51 51 ILE CA C 51 63.740 63.740 64.449 -0.709 18497
993 1 3 . 1 1 51 51 ILE CB C 51 36.650 36.650 36.369 0.281 18497
994 1 3 . 1 1 51 51 ILE H H 51 7.475 7.475 8.294 -0.819 18497
995 1 3 . 1 1 52 52 ASP N N 52 121.642 121.642 120.017 1.625 18497
996 1 3 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.232 0.208 18497
997 1 3 . 1 1 52 52 ASP C C 52 179.197 179.197 178.557 0.640 18497
998 1 3 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.676 -0.576 18497
999 1 3 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.877 -0.577 18497
1000 1 3 . 1 1 52 52 ASP H H 52 8.559 8.559 7.775 0.784 18497
1001 1 3 . 1 1 53 53 ASN N N 53 117.131 117.131 118.609 -1.478 18497
1002 1 3 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.286 0.324 18497
1003 1 3 . 1 1 53 53 ASN C C 53 178.545 178.545 177.332 1.213 18497
1004 1 3 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.512 -1.812 18497
1005 1 3 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.642 0.058 18497
1006 1 3 . 1 1 53 53 ASN H H 53 8.106 8.106 8.105 0.001 18497
1007 1 3 . 1 1 54 54 ARG N N 54 119.929 119.929 119.662 0.267 18497
1008 1 3 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.004 0.116 18497
1009 1 3 . 1 1 54 54 ARG C C 54 176.892 176.892 178.543 -1.651 18497
1010 1 3 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.922 -0.762 18497
1011 1 3 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.172 0.099 18497
1012 1 3 . 1 1 54 54 ARG H H 54 7.797 7.797 8.215 -0.418 18497
1013 1 3 . 1 1 55 55 ARG N N 55 119.227 119.227 116.990 2.237 18497
1014 1 3 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.174 -0.000 18497
1015 1 3 . 1 1 55 55 ARG C C 55 175.108 175.108 178.107 -2.999 18497
1016 1 3 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.436 3.444 18497
1017 1 3 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.210 1.450 18497
1018 1 3 . 1 1 55 55 ARG H H 55 7.857 7.857 7.992 -0.135 18497
1019 1 3 . 1 1 56 56 ILE N N 56 116.676 116.676 118.131 -1.455 18497
1020 1 3 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.083 -0.073 18497
1021 1 3 . 1 1 56 56 ILE C C 56 176.065 176.065 177.405 -1.340 18497
1022 1 3 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.685 -0.545 18497
1023 1 3 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.364 -0.124 18497
1024 1 3 . 1 1 56 56 ILE H H 56 8.317 8.317 8.321 -0.004 18497
1025 1 3 . 1 1 57 57 MET N N 57 122.058 122.058 117.718 4.340 18497
1026 1 3 . 1 1 57 57 MET HA H 57 4.420 4.420 4.374 0.046 18497
1027 1 3 . 1 1 57 57 MET C C 57 177.283 177.283 177.390 -0.107 18497
1028 1 3 . 1 1 57 57 MET CA C 57 56.030 56.030 57.256 -1.226 18497
1029 1 3 . 1 1 57 57 MET CB C 57 32.515 32.515 32.922 -0.408 18497
1030 1 3 . 1 1 57 57 MET H H 57 8.177 8.177 7.677 0.500 18497
1031 1 3 . 1 1 58 58 ASN N N 58 118.892 118.892 119.591 -0.699 18497
1032 1 3 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.639 0.051 18497
1033 1 3 . 1 1 58 58 ASN C C 58 176.500 176.500 174.442 2.058 18497
1034 1 3 . 1 1 58 58 ASN CA C 58 53.653 53.653 53.465 0.188 18497
1035 1 3 . 1 1 58 58 ASN CB C 58 38.770 38.770 37.092 1.678 18497
1036 1 3 . 1 1 58 58 ASN H H 58 8.238 8.238 7.763 0.475 18497
1037 1 3 . 1 1 59 59 GLN N N 59 120.456 120.456 119.282 1.174 18497
1038 1 3 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.540 -0.230 18497
1039 1 3 . 1 1 59 59 GLN C C 59 175.326 175.326 174.294 1.032 18497
1040 1 3 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.357 0.673 18497
1041 1 3 . 1 1 59 59 GLN CB C 59 28.800 28.800 31.833 -3.033 18497
1042 1 3 . 1 1 59 59 GLN H H 59 8.196 8.196 7.876 0.320 18497
1043 1 3 . 1 1 60 60 ALA N N 60 125.116 125.116 124.577 0.539 18497
1044 1 3 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.528 -0.146 18497
1045 1 3 . 1 1 60 60 ALA CA C 60 52.300 52.300 51.736 0.564 18497
1046 1 3 . 1 1 60 60 ALA CB C 60 19.110 19.110 20.288 -1.178 18497
1047 1 3 . 1 1 60 60 ALA H H 60 8.293 8.293 8.220 0.073 18497
1048 1 3 . 1 1 61 61 SER N N 61 115.686 115.686 116.332 -0.646 18497
1049 1 3 . 1 1 61 61 SER HA H 61 4.470 4.470 4.668 -0.198 18497
1050 1 3 . 1 1 61 61 SER C C 61 175.674 175.674 173.786 1.888 18497
1051 1 3 . 1 1 61 61 SER CA C 61 58.160 58.160 58.227 -0.068 18497
1052 1 3 . 1 1 61 61 SER CB C 61 63.740 63.740 63.719 0.021 18497
1053 1 3 . 1 1 61 61 SER H H 61 8.290 8.290 8.458 -0.168 18497
1054 1 4 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.984 -0.554 18497
1055 1 4 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.865 0.082 18497
1056 1 4 . 1 1 2 2 PRO CB C 2 32.130 32.130 33.473 -1.343 18497
1057 1 4 . 1 1 3 3 HIS N N 3 119.985 119.985 117.978 2.007 18497
1058 1 4 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.739 -0.133 18497
1059 1 4 . 1 1 3 3 HIS C C 3 176.587 176.587 174.238 2.349 18497
1060 1 4 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.340 0.845 18497
1061 1 4 . 1 1 3 3 HIS CB C 3 30.471 30.471 32.006 -1.535 18497
1062 1 4 . 1 1 3 3 HIS H H 3 8.526 8.526 8.500 0.026 18497
1063 1 4 . 1 1 4 4 MET N N 4 122.338 122.338 121.301 1.037 18497
1064 1 4 . 1 1 4 4 MET HA H 4 4.448 4.448 4.491 -0.043 18497
1065 1 4 . 1 1 4 4 MET C C 4 175.108 175.108 174.750 0.358 18497
1066 1 4 . 1 1 4 4 MET CA C 4 55.562 55.562 55.983 -0.421 18497
1067 1 4 . 1 1 4 4 MET CB C 4 33.141 33.141 33.454 -0.313 18497
1068 1 4 . 1 1 4 4 MET H H 4 8.337 8.337 7.920 0.417 18497
1069 1 4 . 1 1 5 5 SER N N 5 116.990 116.990 113.044 3.946 18497
1070 1 4 . 1 1 5 5 SER HA H 5 4.400 4.400 4.483 -0.083 18497
1071 1 4 . 1 1 5 5 SER C C 5 177.979 177.979 174.122 3.857 18497
1072 1 4 . 1 1 5 5 SER CA C 5 58.039 58.039 57.651 0.388 18497
1073 1 4 . 1 1 5 5 SER CB C 5 63.797 63.797 64.935 -1.138 18497
1074 1 4 . 1 1 5 5 SER H H 5 8.330 8.330 7.944 0.386 18497
1075 1 4 . 1 1 6 6 TYR N N 6 122.027 122.027 122.523 -0.496 18497
1076 1 4 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.144 0.366 18497
1077 1 4 . 1 1 6 6 TYR C C 6 174.060 174.060 177.422 -3.362 18497
1078 1 4 . 1 1 6 6 TYR CA C 6 57.800 57.800 61.794 -3.994 18497
1079 1 4 . 1 1 6 6 TYR CB C 6 38.685 38.685 38.053 0.632 18497
1080 1 4 . 1 1 6 6 TYR H H 6 8.201 8.201 8.649 -0.448 18497
1081 1 4 . 1 1 7 7 ASP N N 7 122.439 122.439 117.261 5.178 18497
1082 1 4 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.450 0.099 18497
1083 1 4 . 1 1 7 7 ASP C C 7 175.150 175.150 177.079 -1.929 18497
1084 1 4 . 1 1 7 7 ASP CA C 7 53.640 53.640 56.373 -2.733 18497
1085 1 4 . 1 1 7 7 ASP CB C 7 41.300 41.300 40.120 1.180 18497
1086 1 4 . 1 1 7 7 ASP H H 7 8.119 8.119 8.773 -0.654 18497
1087 1 4 . 1 1 8 8 ALA N N 8 124.655 124.655 122.546 2.109 18497
1088 1 4 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.204 0.026 18497
1089 1 4 . 1 1 8 8 ALA C C 8 175.935 175.935 179.227 -3.292 18497
1090 1 4 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.004 -0.111 18497
1091 1 4 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.601 -0.751 18497
1092 1 4 . 1 1 8 8 ALA H H 8 8.235 8.235 7.676 0.559 18497
1093 1 4 . 1 1 9 9 ASN N N 9 116.133 116.133 117.189 -1.056 18497
1094 1 4 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.586 0.104 18497
1095 1 4 . 1 1 9 9 ASN C C 9 177.718 177.718 175.685 2.033 18497
1096 1 4 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.587 -0.787 18497
1097 1 4 . 1 1 9 9 ASN CB C 9 38.770 38.770 40.046 -1.276 18497
1098 1 4 . 1 1 9 9 ASN H H 9 8.417 8.417 8.107 0.310 18497
1099 1 4 . 1 1 10 10 VAL N N 10 119.557 119.557 117.507 2.050 18497
1100 1 4 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.731 0.446 18497
1101 1 4 . 1 1 10 10 VAL C C 10 174.930 174.930 174.379 0.551 18497
1102 1 4 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.858 -1.978 18497
1103 1 4 . 1 1 10 10 VAL CB C 10 32.660 32.660 29.838 2.822 18497
1104 1 4 . 1 1 10 10 VAL H H 10 7.859 7.859 8.372 -0.513 18497
1105 1 4 . 1 1 11 11 ILE N N 11 126.561 126.561 124.758 1.803 18497
1106 1 4 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.736 -0.696 18497
1107 1 4 . 1 1 11 11 ILE C C 11 175.935 175.935 174.603 1.332 18497
1108 1 4 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.752 -0.252 18497
1109 1 4 . 1 1 11 11 ILE CB C 11 37.700 37.700 42.219 -4.519 18497
1110 1 4 . 1 1 11 11 ILE H H 11 8.283 8.283 8.082 0.201 18497
1111 1 4 . 1 1 12 12 ASP N N 12 128.161 128.161 128.447 -0.286 18497
1112 1 4 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.923 -0.193 18497
1113 1 4 . 1 1 12 12 ASP C C 12 174.891 174.891 175.947 -1.056 18497
1114 1 4 . 1 1 12 12 ASP CA C 12 53.427 53.427 54.586 -1.159 18497
1115 1 4 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.926 0.294 18497
1116 1 4 . 1 1 12 12 ASP H H 12 8.477 8.477 8.556 -0.079 18497
1117 1 4 . 1 1 13 13 ASP N N 13 127.435 127.435 125.245 2.190 18497
1118 1 4 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.230 0.086 18497
1119 1 4 . 1 1 13 13 ASP C C 13 175.369 175.369 177.251 -1.882 18497
1120 1 4 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.671 -0.071 18497
1121 1 4 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.117 0.043 18497
1122 1 4 . 1 1 13 13 ASP H H 13 8.698 8.698 8.829 -0.131 18497
1123 1 4 . 1 1 14 14 GLU N N 14 119.796 119.796 119.324 0.472 18497
1124 1 4 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.046 -0.011 18497
1125 1 4 . 1 1 14 14 GLU C C 14 178.588 178.588 178.295 0.293 18497
1126 1 4 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.452 0.048 18497
1127 1 4 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.292 -0.392 18497
1128 1 4 . 1 1 14 14 GLU H H 14 8.205 8.205 8.619 -0.414 18497
1129 1 4 . 1 1 15 15 ALA N N 15 124.156 124.156 123.409 0.747 18497
1130 1 4 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.160 0.016 18497
1131 1 4 . 1 1 15 15 ALA C C 15 179.502 179.502 179.844 -0.342 18497
1132 1 4 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.073 -0.073 18497
1133 1 4 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.058 0.842 18497
1134 1 4 . 1 1 15 15 ALA H H 15 8.473 8.473 7.518 0.955 18497
1135 1 4 . 1 1 16 16 VAL N N 16 117.585 117.585 117.993 -0.408 18497
1136 1 4 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.707 -0.173 18497
1137 1 4 . 1 1 16 16 VAL C C 16 179.545 179.545 177.550 1.995 18497
1138 1 4 . 1 1 16 16 VAL CA C 16 68.000 68.000 66.671 1.329 18497
1139 1 4 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.203 0.397 18497
1140 1 4 . 1 1 16 16 VAL H H 16 8.181 8.181 8.549 -0.368 18497
1141 1 4 . 1 1 17 17 LYS N N 17 119.377 119.377 117.977 1.400 18497
1142 1 4 . 1 1 17 17 LYS HA H 17 3.956 3.956 4.241 -0.285 18497
1143 1 4 . 1 1 17 17 LYS C C 17 178.197 178.197 178.735 -0.538 18497
1144 1 4 . 1 1 17 17 LYS CA C 17 60.020 60.020 58.774 1.246 18497
1145 1 4 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.545 -0.415 18497
1146 1 4 . 1 1 17 17 LYS H H 17 8.001 8.001 7.871 0.130 18497
1147 1 4 . 1 1 18 18 GLU N N 18 120.395 120.395 121.084 -0.689 18497
1148 1 4 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.141 -0.001 18497
1149 1 4 . 1 1 18 18 GLU C C 18 178.849 178.849 178.619 0.230 18497
1150 1 4 . 1 1 18 18 GLU CA C 18 59.800 59.800 58.776 1.024 18497
1151 1 4 . 1 1 18 18 GLU CB C 18 29.493 29.493 30.223 -0.730 18497
1152 1 4 . 1 1 18 18 GLU H H 18 7.943 7.943 8.078 -0.135 18497
1153 1 4 . 1 1 19 19 VAL N N 19 121.088 121.088 119.800 1.288 18497
1154 1 4 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.754 -0.104 18497
1155 1 4 . 1 1 19 19 VAL C C 19 179.415 179.415 177.536 1.879 18497
1156 1 4 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.125 1.855 18497
1157 1 4 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.898 -0.298 18497
1158 1 4 . 1 1 19 19 VAL H H 19 8.335 8.335 8.655 -0.320 18497
1159 1 4 . 1 1 20 20 CYS N N 20 117.290 117.290 117.545 -0.255 18497
1160 1 4 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.299 0.381 18497
1161 1 4 . 1 1 20 20 CYS C C 20 178.110 178.110 176.192 1.918 18497
1162 1 4 . 1 1 20 20 CYS CA C 20 63.200 63.200 61.973 1.227 18497
1163 1 4 . 1 1 20 20 CYS CB C 20 26.800 26.800 26.771 0.029 18497
1164 1 4 . 1 1 20 20 CYS H H 20 8.434 8.434 8.016 0.418 18497
1165 1 4 . 1 1 21 21 GLU N N 21 118.195 118.195 119.192 -0.997 18497
1166 1 4 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.200 -0.061 18497
1167 1 4 . 1 1 21 21 GLU C C 21 178.153 178.153 179.264 -1.111 18497
1168 1 4 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.629 1.121 18497
1169 1 4 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.387 0.113 18497
1170 1 4 . 1 1 21 21 GLU H H 21 7.972 7.972 7.806 0.166 18497
1171 1 4 . 1 1 22 22 LYS N N 22 119.095 119.095 119.453 -0.358 18497
1172 1 4 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.174 -0.169 18497
1173 1 4 . 1 1 22 22 LYS C C 22 179.371 179.371 178.123 1.248 18497
1174 1 4 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.647 0.053 18497
1175 1 4 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.803 0.117 18497
1176 1 4 . 1 1 22 22 LYS H H 22 8.071 8.071 8.246 -0.175 18497
1177 1 4 . 1 1 23 23 PHE N N 23 114.252 114.252 117.534 -3.282 18497
1178 1 4 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.553 -0.123 18497
1179 1 4 . 1 1 23 23 PHE C C 23 178.197 178.197 174.595 3.602 18497
1180 1 4 . 1 1 23 23 PHE CA C 23 58.430 58.430 57.979 0.451 18497
1181 1 4 . 1 1 23 23 PHE CB C 23 38.770 38.770 39.991 -1.221 18497
1182 1 4 . 1 1 23 23 PHE H H 23 8.491 8.491 7.984 0.507 18497
1183 1 4 . 1 1 24 24 GLU N N 24 119.819 119.819 115.824 3.995 18497
1184 1 4 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.022 0.048 18497
1185 1 4 . 1 1 24 24 GLU C C 24 177.457 177.457 175.799 1.658 18497
1186 1 4 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.244 -0.414 18497
1187 1 4 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.026 -0.226 18497
1188 1 4 . 1 1 24 24 GLU H H 24 7.867 7.867 8.263 -0.396 18497
1189 1 4 . 1 1 25 25 CYS N N 25 114.633 114.633 115.524 -0.891 18497
1190 1 4 . 1 1 25 25 CYS HA H 25 5.387 5.387 5.048 0.339 18497
1191 1 4 . 1 1 25 25 CYS C C 25 174.760 174.760 174.526 0.234 18497
1192 1 4 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.539 -1.778 18497
1193 1 4 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.575 1.025 18497
1194 1 4 . 1 1 25 25 CYS H H 25 8.156 8.156 7.736 0.420 18497
1195 1 4 . 1 1 26 26 THR N N 26 109.312 109.312 110.924 -1.612 18497
1196 1 4 . 1 1 26 26 THR HA H 26 4.770 4.770 4.610 0.160 18497
1197 1 4 . 1 1 26 26 THR C C 26 173.499 173.499 175.114 -1.615 18497
1198 1 4 . 1 1 26 26 THR CA C 26 60.723 60.723 60.775 -0.052 18497
1199 1 4 . 1 1 26 26 THR CB C 26 72.000 72.000 71.814 0.186 18497
1200 1 4 . 1 1 26 26 THR H H 26 8.460 8.460 8.161 0.299 18497
1201 1 4 . 1 1 27 27 GLU N N 27 122.233 122.233 125.290 -3.057 18497
1202 1 4 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.842 -0.332 18497
1203 1 4 . 1 1 27 27 GLU C C 27 176.544 176.544 177.904 -1.360 18497
1204 1 4 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.403 0.147 18497
1205 1 4 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.494 -0.544 18497
1206 1 4 . 1 1 27 27 GLU H H 27 9.327 9.327 9.036 0.291 18497
1207 1 4 . 1 1 28 28 SER N N 28 112.925 112.925 115.063 -2.138 18497
1208 1 4 . 1 1 28 28 SER HA H 28 4.062 4.062 4.173 -0.111 18497
1209 1 4 . 1 1 28 28 SER C C 28 178.545 178.545 176.349 2.196 18497
1210 1 4 . 1 1 28 28 SER CA C 28 61.350 61.350 61.227 0.123 18497
1211 1 4 . 1 1 28 28 SER CB C 28 62.400 62.400 62.774 -0.374 18497
1212 1 4 . 1 1 28 28 SER H H 28 8.320 8.320 8.520 -0.200 18497
1213 1 4 . 1 1 29 29 GLU N N 29 121.736 121.736 121.258 0.478 18497
1214 1 4 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.217 -0.227 18497
1215 1 4 . 1 1 29 29 GLU C C 29 176.674 176.674 178.799 -2.125 18497
1216 1 4 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.506 1.244 18497
1217 1 4 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.464 0.006 18497
1218 1 4 . 1 1 29 29 GLU H H 29 7.512 7.512 7.565 -0.053 18497
1219 1 4 . 1 1 30 30 VAL N N 30 119.480 119.480 121.395 -1.915 18497
1220 1 4 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.547 -0.170 18497
1221 1 4 . 1 1 30 30 VAL C C 30 179.241 179.241 177.942 1.299 18497
1222 1 4 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.706 -0.046 18497
1223 1 4 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.226 -0.156 18497
1224 1 4 . 1 1 30 30 VAL H H 30 7.492 7.492 8.118 -0.626 18497
1225 1 4 . 1 1 31 31 MET N N 31 117.220 117.220 117.873 -0.653 18497
1226 1 4 . 1 1 31 31 MET HA H 31 3.870 3.870 3.379 0.491 18497
1227 1 4 . 1 1 31 31 MET C C 31 177.936 177.936 177.852 0.084 18497
1228 1 4 . 1 1 31 31 MET CA C 31 57.630 57.630 59.401 -1.771 18497
1229 1 4 . 1 1 31 31 MET CB C 31 30.270 30.270 32.006 -1.736 18497
1230 1 4 . 1 1 31 31 MET H H 31 8.302 8.302 8.438 -0.136 18497
1231 1 4 . 1 1 32 32 ASN N N 32 116.672 116.672 117.689 -1.017 18497
1232 1 4 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.366 0.024 18497
1233 1 4 . 1 1 32 32 ASN C C 32 176.065 176.065 177.342 -1.277 18497
1234 1 4 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.347 -0.317 18497
1235 1 4 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.572 -0.862 18497
1236 1 4 . 1 1 32 32 ASN H H 32 8.313 8.313 8.278 0.035 18497
1237 1 4 . 1 1 33 33 SER N N 33 117.471 117.471 114.701 2.770 18497
1238 1 4 . 1 1 33 33 SER HA H 33 4.150 4.150 4.188 -0.038 18497
1239 1 4 . 1 1 33 33 SER C C 33 178.806 178.806 175.581 3.225 18497
1240 1 4 . 1 1 33 33 SER CA C 33 62.950 62.950 61.543 1.407 18497
1241 1 4 . 1 1 33 33 SER CB C 33 62.600 62.600 63.165 -0.565 18497
1242 1 4 . 1 1 33 33 SER H H 33 7.851 7.851 8.067 -0.216 18497
1243 1 4 . 1 1 34 34 LEU N N 34 122.839 122.839 118.960 3.879 18497
1244 1 4 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.154 -0.275 18497
1245 1 4 . 1 1 34 34 LEU C C 34 177.892 177.892 177.755 0.137 18497
1246 1 4 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.445 1.185 18497
1247 1 4 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.194 -1.394 18497
1248 1 4 . 1 1 34 34 LEU H H 34 8.128 8.128 7.158 0.970 18497
1249 1 4 . 1 1 35 35 TYR N N 35 116.666 116.666 115.401 1.265 18497
1250 1 4 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.593 0.017 18497
1251 1 4 . 1 1 35 35 TYR C C 35 179.067 179.067 176.729 2.338 18497
1252 1 4 . 1 1 35 35 TYR CA C 35 57.890 57.890 58.257 -0.367 18497
1253 1 4 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.527 -1.817 18497
1254 1 4 . 1 1 35 35 TYR H H 35 7.924 7.924 7.604 0.320 18497
1255 1 4 . 1 1 36 36 SER N N 36 114.801 114.801 112.728 2.073 18497
1256 1 4 . 1 1 36 36 SER HA H 36 4.080 4.080 4.600 -0.520 18497
1257 1 4 . 1 1 36 36 SER C C 36 177.283 177.283 175.365 1.918 18497
1258 1 4 . 1 1 36 36 SER CA C 36 60.519 60.519 58.474 2.045 18497
1259 1 4 . 1 1 36 36 SER CB C 36 64.240 64.240 65.430 -1.190 18497
1260 1 4 . 1 1 36 36 SER H H 36 7.715 7.715 8.591 -0.876 18497
1261 1 4 . 1 1 37 37 GLY N N 37 109.803 109.803 111.836 -2.033 18497
1262 1 4 . 1 1 37 37 GLY C C 37 175.978 175.978 173.005 2.973 18497
1263 1 4 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.230 0.448 18497
1264 1 4 . 1 1 37 37 GLY H H 37 8.017 8.017 7.770 0.247 18497
1265 1 4 . 1 1 38 38 ASP N N 38 120.613 120.613 118.919 1.694 18497
1266 1 4 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.989 0.036 18497
1267 1 4 . 1 1 38 38 ASP C C 38 173.368 173.368 174.655 -1.287 18497
1268 1 4 . 1 1 38 38 ASP CA C 38 50.720 50.720 52.027 -1.307 18497
1269 1 4 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.390 -1.970 18497
1270 1 4 . 1 1 38 38 ASP H H 38 8.006 8.006 7.831 0.175 18497
1271 1 4 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.281 0.059 18497
1272 1 4 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.243 -0.493 18497
1273 1 4 . 1 1 39 39 PRO CB C 39 32.130 32.130 31.770 0.360 18497
1274 1 4 . 1 1 40 40 GLN N N 40 115.056 115.056 114.355 0.701 18497
1275 1 4 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.264 0.016 18497
1276 1 4 . 1 1 40 40 GLN C C 40 177.066 177.066 176.038 1.028 18497
1277 1 4 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.593 -0.883 18497
1278 1 4 . 1 1 40 40 GLN CB C 40 28.680 28.680 29.001 -0.321 18497
1279 1 4 . 1 1 40 40 GLN H H 40 8.237 8.237 7.981 0.256 18497
1280 1 4 . 1 1 41 41 ASP N N 41 122.839 122.839 121.239 1.600 18497
1281 1 4 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.546 -0.233 18497
1282 1 4 . 1 1 41 41 ASP C C 41 175.804 175.804 177.024 -1.220 18497
1283 1 4 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.764 0.476 18497
1284 1 4 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.909 -0.689 18497
1285 1 4 . 1 1 41 41 ASP H H 41 7.211 7.211 7.704 -0.493 18497
1286 1 4 . 1 1 42 42 GLN N N 42 124.547 124.547 122.191 2.356 18497
1287 1 4 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.025 -0.165 18497
1288 1 4 . 1 1 42 42 GLN C C 42 177.196 177.196 178.144 -0.948 18497
1289 1 4 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.354 -0.134 18497
1290 1 4 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.967 -0.567 18497
1291 1 4 . 1 1 42 42 GLN H H 42 8.719 8.719 8.785 -0.066 18497
1292 1 4 . 1 1 43 43 LEU N N 43 118.960 118.960 118.533 0.427 18497
1293 1 4 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.963 -0.278 18497
1294 1 4 . 1 1 43 43 LEU C C 43 178.066 178.066 178.718 -0.652 18497
1295 1 4 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.452 -0.092 18497
1296 1 4 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.374 -0.985 18497
1297 1 4 . 1 1 43 43 LEU H H 43 8.206 8.206 8.794 -0.588 18497
1298 1 4 . 1 1 44 44 ALA N N 44 121.666 121.666 122.480 -0.814 18497
1299 1 4 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.068 -0.189 18497
1300 1 4 . 1 1 44 44 ALA C C 44 178.327 178.327 179.628 -1.301 18497
1301 1 4 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.935 -0.225 18497
1302 1 4 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.084 0.496 18497
1303 1 4 . 1 1 44 44 ALA H H 44 7.402 7.402 7.508 -0.106 18497
1304 1 4 . 1 1 45 45 VAL N N 45 118.589 118.589 119.913 -1.324 18497
1305 1 4 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.612 0.048 18497
1306 1 4 . 1 1 45 45 VAL C C 45 179.893 179.893 177.768 2.125 18497
1307 1 4 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.811 -0.411 18497
1308 1 4 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.221 0.910 18497
1309 1 4 . 1 1 45 45 VAL H H 45 8.449 8.449 8.460 -0.011 18497
1310 1 4 . 1 1 46 46 ALA N N 46 121.006 121.006 122.928 -1.922 18497
1311 1 4 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.687 0.443 18497
1312 1 4 . 1 1 46 46 ALA C C 46 179.110 179.110 179.047 0.063 18497
1313 1 4 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.007 -0.037 18497
1314 1 4 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.046 2.064 18497
1315 1 4 . 1 1 46 46 ALA H H 46 7.654 7.654 7.891 -0.237 18497
1316 1 4 . 1 1 47 47 TYR N N 47 119.140 119.140 119.944 -0.804 18497
1317 1 4 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.954 -0.204 18497
1318 1 4 . 1 1 47 47 TYR C C 47 179.328 179.328 177.418 1.910 18497
1319 1 4 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.683 0.197 18497
1320 1 4 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.151 0.349 18497
1321 1 4 . 1 1 47 47 TYR H H 47 8.077 8.077 7.805 0.272 18497
1322 1 4 . 1 1 48 48 HIS N N 48 116.422 116.422 118.839 -2.417 18497
1323 1 4 . 1 1 48 48 HIS HA H 48 4.100 4.100 3.936 0.164 18497
1324 1 4 . 1 1 48 48 HIS C C 48 178.023 178.023 177.466 0.557 18497
1325 1 4 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.175 -0.155 18497
1326 1 4 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.867 -0.927 18497
1327 1 4 . 1 1 48 48 HIS H H 48 8.326 8.326 8.391 -0.065 18497
1328 1 4 . 1 1 49 49 LEU N N 49 120.974 120.974 119.920 1.054 18497
1329 1 4 . 1 1 49 49 LEU HA H 49 4.155 4.155 3.903 0.252 18497
1330 1 4 . 1 1 49 49 LEU C C 49 177.417 177.417 179.027 -1.610 18497
1331 1 4 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.090 -0.200 18497
1332 1 4 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.884 0.076 18497
1333 1 4 . 1 1 49 49 LEU H H 49 8.237 8.237 8.460 -0.223 18497
1334 1 4 . 1 1 50 50 ILE N N 50 119.715 119.715 120.071 -0.356 18497
1335 1 4 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.583 0.037 18497
1336 1 4 . 1 1 50 50 ILE C C 50 179.502 179.502 178.024 1.478 18497
1337 1 4 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.692 -0.632 18497
1338 1 4 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.852 0.118 18497
1339 1 4 . 1 1 50 50 ILE H H 50 7.543 7.543 8.224 -0.681 18497
1340 1 4 . 1 1 51 51 ILE N N 51 117.995 117.995 121.037 -3.042 18497
1341 1 4 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.350 0.190 18497
1342 1 4 . 1 1 51 51 ILE C C 51 179.197 179.197 177.540 1.657 18497
1343 1 4 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.861 -2.121 18497
1344 1 4 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.298 -0.648 18497
1345 1 4 . 1 1 51 51 ILE H H 51 7.475 7.475 7.790 -0.315 18497
1346 1 4 . 1 1 52 52 ASP N N 52 121.642 121.642 119.213 2.429 18497
1347 1 4 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.170 0.270 18497
1348 1 4 . 1 1 52 52 ASP C C 52 179.197 179.197 178.264 0.933 18497
1349 1 4 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.623 -0.523 18497
1350 1 4 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.681 -0.381 18497
1351 1 4 . 1 1 52 52 ASP H H 52 8.559 8.559 8.040 0.519 18497
1352 1 4 . 1 1 53 53 ASN N N 53 117.131 117.131 118.266 -1.135 18497
1353 1 4 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.368 0.242 18497
1354 1 4 . 1 1 53 53 ASN C C 53 178.545 178.545 177.847 0.698 18497
1355 1 4 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.159 -1.459 18497
1356 1 4 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.876 -0.176 18497
1357 1 4 . 1 1 53 53 ASN H H 53 8.106 8.106 8.191 -0.085 18497
1358 1 4 . 1 1 54 54 ARG N N 54 119.929 119.929 119.798 0.131 18497
1359 1 4 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.017 0.103 18497
1360 1 4 . 1 1 54 54 ARG C C 54 176.892 176.892 178.221 -1.329 18497
1361 1 4 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.779 -0.619 18497
1362 1 4 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.182 0.088 18497
1363 1 4 . 1 1 54 54 ARG H H 54 7.797 7.797 8.231 -0.434 18497
1364 1 4 . 1 1 55 55 ARG N N 55 119.227 119.227 118.305 0.922 18497
1365 1 4 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.158 0.016 18497
1366 1 4 . 1 1 55 55 ARG C C 55 175.108 175.108 178.565 -3.457 18497
1367 1 4 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.727 3.154 18497
1368 1 4 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.715 1.945 18497
1369 1 4 . 1 1 55 55 ARG H H 55 7.857 7.857 8.105 -0.248 18497
1370 1 4 . 1 1 56 56 ILE N N 56 116.676 116.676 117.674 -0.998 18497
1371 1 4 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.115 -0.105 18497
1372 1 4 . 1 1 56 56 ILE C C 56 176.065 176.065 177.132 -1.067 18497
1373 1 4 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.128 0.012 18497
1374 1 4 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.681 -0.441 18497
1375 1 4 . 1 1 56 56 ILE H H 56 8.317 8.317 8.263 0.054 18497
1376 1 4 . 1 1 57 57 MET N N 57 122.058 122.058 117.257 4.801 18497
1377 1 4 . 1 1 57 57 MET HA H 57 4.420 4.420 4.456 -0.036 18497
1378 1 4 . 1 1 57 57 MET C C 57 177.283 177.283 175.957 1.326 18497
1379 1 4 . 1 1 57 57 MET CA C 57 56.030 56.030 55.066 0.965 18497
1380 1 4 . 1 1 57 57 MET CB C 57 32.515 32.515 31.789 0.726 18497
1381 1 4 . 1 1 57 57 MET H H 57 8.177 8.177 7.574 0.603 18497
1382 1 4 . 1 1 58 58 ASN N N 58 118.892 118.892 117.630 1.262 18497
1383 1 4 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.449 0.241 18497
1384 1 4 . 1 1 58 58 ASN C C 58 176.500 176.500 175.237 1.263 18497
1385 1 4 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.054 -1.401 18497
1386 1 4 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.830 -0.060 18497
1387 1 4 . 1 1 58 58 ASN H H 58 8.238 8.238 8.380 -0.142 18497
1388 1 4 . 1 1 59 59 GLN N N 59 120.456 120.456 116.143 4.313 18497
1389 1 4 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.431 -0.121 18497
1390 1 4 . 1 1 59 59 GLN C C 59 175.326 175.326 173.382 1.944 18497
1391 1 4 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.348 0.682 18497
1392 1 4 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.367 -1.567 18497
1393 1 4 . 1 1 59 59 GLN H H 59 8.196 8.196 7.835 0.361 18497
1394 1 4 . 1 1 60 60 ALA N N 60 125.116 125.116 122.944 2.172 18497
1395 1 4 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.885 -0.503 18497
1396 1 4 . 1 1 60 60 ALA CA C 60 52.300 52.300 51.706 0.594 18497
1397 1 4 . 1 1 60 60 ALA CB C 60 19.110 19.110 20.431 -1.321 18497
1398 1 4 . 1 1 60 60 ALA H H 60 8.293 8.293 8.286 0.007 18497
1399 1 4 . 1 1 61 61 SER N N 61 115.686 115.686 114.878 0.808 18497
1400 1 4 . 1 1 61 61 SER HA H 61 4.470 4.470 5.037 -0.567 18497
1401 1 4 . 1 1 61 61 SER C C 61 175.674 175.674 173.498 2.176 18497
1402 1 4 . 1 1 61 61 SER CA C 61 58.160 58.160 58.178 -0.018 18497
1403 1 4 . 1 1 61 61 SER CB C 61 63.740 63.740 64.575 -0.835 18497
1404 1 4 . 1 1 61 61 SER H H 61 8.290 8.290 8.918 -0.628 18497
1405 1 5 . 1 1 2 2 PRO HA H 2 4.430 4.430 5.006 -0.576 18497
1406 1 5 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.001 -0.054 18497
1407 1 5 . 1 1 2 2 PRO CB C 2 32.130 32.130 33.114 -0.984 18497
1408 1 5 . 1 1 3 3 HIS N N 3 119.985 119.985 115.515 4.470 18497
1409 1 5 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.756 -0.150 18497
1410 1 5 . 1 1 3 3 HIS C C 3 176.587 176.587 173.793 2.794 18497
1411 1 5 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.196 0.989 18497
1412 1 5 . 1 1 3 3 HIS CB C 3 30.471 30.471 31.014 -0.543 18497
1413 1 5 . 1 1 3 3 HIS H H 3 8.526 8.526 8.016 0.510 18497
1414 1 5 . 1 1 4 4 MET N N 4 122.338 122.338 120.937 1.401 18497
1415 1 5 . 1 1 4 4 MET HA H 4 4.448 4.448 4.372 0.076 18497
1416 1 5 . 1 1 4 4 MET C C 4 175.108 175.108 176.245 -1.137 18497
1417 1 5 . 1 1 4 4 MET CA C 4 55.562 55.562 55.068 0.494 18497
1418 1 5 . 1 1 4 4 MET CB C 4 33.141 33.141 33.307 -0.166 18497
1419 1 5 . 1 1 4 4 MET H H 4 8.337 8.337 8.583 -0.246 18497
1420 1 5 . 1 1 5 5 SER N N 5 116.990 116.990 116.798 0.192 18497
1421 1 5 . 1 1 5 5 SER HA H 5 4.400 4.400 4.329 0.071 18497
1422 1 5 . 1 1 5 5 SER C C 5 177.979 177.979 173.704 4.275 18497
1423 1 5 . 1 1 5 5 SER CA C 5 58.039 58.039 58.294 -0.255 18497
1424 1 5 . 1 1 5 5 SER CB C 5 63.797 63.797 63.225 0.572 18497
1425 1 5 . 1 1 5 5 SER H H 5 8.330 8.330 8.127 0.203 18497
1426 1 5 . 1 1 6 6 TYR N N 6 122.027 122.027 127.893 -5.866 18497
1427 1 5 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.594 -0.084 18497
1428 1 5 . 1 1 6 6 TYR C C 6 174.060 174.060 176.603 -2.543 18497
1429 1 5 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.555 0.245 18497
1430 1 5 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.062 -0.377 18497
1431 1 5 . 1 1 6 6 TYR H H 6 8.201 8.201 8.748 -0.547 18497
1432 1 5 . 1 1 7 7 ASP N N 7 122.439 122.439 120.415 2.024 18497
1433 1 5 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.285 0.264 18497
1434 1 5 . 1 1 7 7 ASP C C 7 175.150 175.150 176.906 -1.756 18497
1435 1 5 . 1 1 7 7 ASP CA C 7 53.640 53.640 57.440 -3.800 18497
1436 1 5 . 1 1 7 7 ASP CB C 7 41.300 41.300 41.010 0.290 18497
1437 1 5 . 1 1 7 7 ASP H H 7 8.119 8.119 9.025 -0.906 18497
1438 1 5 . 1 1 8 8 ALA N N 8 124.655 124.655 117.830 6.825 18497
1439 1 5 . 1 1 8 8 ALA HA H 8 4.230 4.230 3.826 0.404 18497
1440 1 5 . 1 1 8 8 ALA C C 8 175.935 175.935 179.265 -3.330 18497
1441 1 5 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.188 -1.296 18497
1442 1 5 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.558 0.291 18497
1443 1 5 . 1 1 8 8 ALA H H 8 8.235 8.235 8.463 -0.228 18497
1444 1 5 . 1 1 9 9 ASN N N 9 116.133 116.133 117.156 -1.023 18497
1445 1 5 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.729 -0.039 18497
1446 1 5 . 1 1 9 9 ASN C C 9 177.718 177.718 177.588 0.130 18497
1447 1 5 . 1 1 9 9 ASN CA C 9 53.800 53.800 55.831 -2.031 18497
1448 1 5 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.215 -0.445 18497
1449 1 5 . 1 1 9 9 ASN H H 9 8.417 8.417 7.861 0.556 18497
1450 1 5 . 1 1 10 10 VAL N N 10 119.557 119.557 115.495 4.062 18497
1451 1 5 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.134 0.043 18497
1452 1 5 . 1 1 10 10 VAL C C 10 174.930 174.930 175.602 -0.672 18497
1453 1 5 . 1 1 10 10 VAL CA C 10 61.880 61.880 61.648 0.232 18497
1454 1 5 . 1 1 10 10 VAL CB C 10 32.660 32.660 30.718 1.942 18497
1455 1 5 . 1 1 10 10 VAL H H 10 7.859 7.859 8.002 -0.143 18497
1456 1 5 . 1 1 11 11 ILE N N 11 126.561 126.561 121.545 5.016 18497
1457 1 5 . 1 1 11 11 ILE HA H 11 4.040 4.040 3.983 0.057 18497
1458 1 5 . 1 1 11 11 ILE C C 11 175.935 175.935 175.709 0.226 18497
1459 1 5 . 1 1 11 11 ILE CA C 11 59.500 59.500 61.447 -1.947 18497
1460 1 5 . 1 1 11 11 ILE CB C 11 37.700 37.700 39.279 -1.579 18497
1461 1 5 . 1 1 11 11 ILE H H 11 8.283 8.283 7.400 0.883 18497
1462 1 5 . 1 1 12 12 ASP N N 12 128.161 128.161 126.185 1.976 18497
1463 1 5 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.714 0.016 18497
1464 1 5 . 1 1 12 12 ASP C C 12 174.891 174.891 176.528 -1.637 18497
1465 1 5 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.931 -0.504 18497
1466 1 5 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.012 0.208 18497
1467 1 5 . 1 1 12 12 ASP H H 12 8.477 8.477 8.594 -0.117 18497
1468 1 5 . 1 1 13 13 ASP N N 13 127.435 127.435 127.006 0.429 18497
1469 1 5 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.320 -0.004 18497
1470 1 5 . 1 1 13 13 ASP C C 13 175.369 175.369 177.730 -2.361 18497
1471 1 5 . 1 1 13 13 ASP CA C 13 57.600 57.600 56.997 0.603 18497
1472 1 5 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.308 -0.148 18497
1473 1 5 . 1 1 13 13 ASP H H 13 8.698 8.698 8.945 -0.247 18497
1474 1 5 . 1 1 14 14 GLU N N 14 119.796 119.796 119.036 0.760 18497
1475 1 5 . 1 1 14 14 GLU HA H 14 4.035 4.035 3.943 0.092 18497
1476 1 5 . 1 1 14 14 GLU C C 14 178.588 178.588 178.718 -0.130 18497
1477 1 5 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.449 0.051 18497
1478 1 5 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.503 -0.603 18497
1479 1 5 . 1 1 14 14 GLU H H 14 8.205 8.205 8.525 -0.320 18497
1480 1 5 . 1 1 15 15 ALA N N 15 124.156 124.156 122.901 1.255 18497
1481 1 5 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.173 0.003 18497
1482 1 5 . 1 1 15 15 ALA C C 15 179.502 179.502 179.787 -0.285 18497
1483 1 5 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.067 -0.067 18497
1484 1 5 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.259 0.641 18497
1485 1 5 . 1 1 15 15 ALA H H 15 8.473 8.473 7.409 1.064 18497
1486 1 5 . 1 1 16 16 VAL N N 16 117.585 117.585 118.783 -1.198 18497
1487 1 5 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.554 -0.020 18497
1488 1 5 . 1 1 16 16 VAL C C 16 179.545 179.545 178.213 1.332 18497
1489 1 5 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.374 0.626 18497
1490 1 5 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.169 0.431 18497
1491 1 5 . 1 1 16 16 VAL H H 16 8.181 8.181 8.030 0.151 18497
1492 1 5 . 1 1 17 17 LYS N N 17 119.377 119.377 119.187 0.190 18497
1493 1 5 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.963 -0.007 18497
1494 1 5 . 1 1 17 17 LYS C C 17 178.197 178.197 179.191 -0.994 18497
1495 1 5 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.406 0.614 18497
1496 1 5 . 1 1 17 17 LYS CB C 17 32.130 32.130 31.650 0.480 18497
1497 1 5 . 1 1 17 17 LYS H H 17 8.001 8.001 8.450 -0.449 18497
1498 1 5 . 1 1 18 18 GLU N N 18 120.395 120.395 119.797 0.598 18497
1499 1 5 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.117 0.023 18497
1500 1 5 . 1 1 18 18 GLU C C 18 178.849 178.849 179.168 -0.319 18497
1501 1 5 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.246 0.554 18497
1502 1 5 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.468 0.024 18497
1503 1 5 . 1 1 18 18 GLU H H 18 7.943 7.943 8.182 -0.239 18497
1504 1 5 . 1 1 19 19 VAL N N 19 121.088 121.088 120.147 0.941 18497
1505 1 5 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.784 -0.134 18497
1506 1 5 . 1 1 19 19 VAL C C 19 179.415 179.415 178.332 1.083 18497
1507 1 5 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.673 1.307 18497
1508 1 5 . 1 1 19 19 VAL CB C 19 31.600 31.600 30.968 0.632 18497
1509 1 5 . 1 1 19 19 VAL H H 19 8.335 8.335 8.698 -0.363 18497
1510 1 5 . 1 1 20 20 CYS N N 20 117.290 117.290 119.713 -2.423 18497
1511 1 5 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.326 0.354 18497
1512 1 5 . 1 1 20 20 CYS C C 20 178.110 178.110 177.263 0.847 18497
1513 1 5 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.825 0.375 18497
1514 1 5 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.148 -0.348 18497
1515 1 5 . 1 1 20 20 CYS H H 20 8.434 8.434 8.339 0.095 18497
1516 1 5 . 1 1 21 21 GLU N N 21 118.195 118.195 120.109 -1.914 18497
1517 1 5 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.136 0.003 18497
1518 1 5 . 1 1 21 21 GLU C C 21 178.153 178.153 178.665 -0.512 18497
1519 1 5 . 1 1 21 21 GLU CA C 21 59.750 59.750 59.000 0.750 18497
1520 1 5 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.589 -0.089 18497
1521 1 5 . 1 1 21 21 GLU H H 21 7.972 7.972 8.112 -0.140 18497
1522 1 5 . 1 1 22 22 LYS N N 22 119.095 119.095 118.246 0.849 18497
1523 1 5 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.179 -0.174 18497
1524 1 5 . 1 1 22 22 LYS C C 22 179.371 179.371 178.347 1.024 18497
1525 1 5 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.402 0.298 18497
1526 1 5 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.873 0.047 18497
1527 1 5 . 1 1 22 22 LYS H H 22 8.071 8.071 8.002 0.069 18497
1528 1 5 . 1 1 23 23 PHE N N 23 114.252 114.252 117.685 -3.433 18497
1529 1 5 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.472 -0.042 18497
1530 1 5 . 1 1 23 23 PHE C C 23 178.197 178.197 174.477 3.720 18497
1531 1 5 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.849 -0.419 18497
1532 1 5 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.397 -1.627 18497
1533 1 5 . 1 1 23 23 PHE H H 23 8.491 8.491 7.908 0.583 18497
1534 1 5 . 1 1 24 24 GLU N N 24 119.819 119.819 117.330 2.489 18497
1535 1 5 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.097 -0.027 18497
1536 1 5 . 1 1 24 24 GLU C C 24 177.457 177.457 175.633 1.824 18497
1537 1 5 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.151 -0.321 18497
1538 1 5 . 1 1 24 24 GLU CB C 24 26.800 26.800 26.967 -0.167 18497
1539 1 5 . 1 1 24 24 GLU H H 24 7.867 7.867 8.092 -0.225 18497
1540 1 5 . 1 1 25 25 CYS N N 25 114.633 114.633 117.392 -2.759 18497
1541 1 5 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.908 0.479 18497
1542 1 5 . 1 1 25 25 CYS C C 25 174.760 174.760 174.152 0.608 18497
1543 1 5 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.721 -2.960 18497
1544 1 5 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.186 0.414 18497
1545 1 5 . 1 1 25 25 CYS H H 25 8.156 8.156 8.087 0.069 18497
1546 1 5 . 1 1 26 26 THR N N 26 109.312 109.312 114.498 -5.186 18497
1547 1 5 . 1 1 26 26 THR HA H 26 4.770 4.770 4.414 0.356 18497
1548 1 5 . 1 1 26 26 THR C C 26 173.499 173.499 175.681 -2.182 18497
1549 1 5 . 1 1 26 26 THR CA C 26 60.723 60.723 62.733 -2.010 18497
1550 1 5 . 1 1 26 26 THR CB C 26 72.000 72.000 69.602 2.398 18497
1551 1 5 . 1 1 26 26 THR H H 26 8.460 8.460 8.314 0.146 18497
1552 1 5 . 1 1 27 27 GLU N N 27 122.233 122.233 124.176 -1.943 18497
1553 1 5 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.900 -0.390 18497
1554 1 5 . 1 1 27 27 GLU C C 27 176.544 176.544 178.259 -1.715 18497
1555 1 5 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.119 0.431 18497
1556 1 5 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.421 -0.471 18497
1557 1 5 . 1 1 27 27 GLU H H 27 9.327 9.327 9.028 0.299 18497
1558 1 5 . 1 1 28 28 SER N N 28 112.925 112.925 114.465 -1.540 18497
1559 1 5 . 1 1 28 28 SER HA H 28 4.062 4.062 4.220 -0.158 18497
1560 1 5 . 1 1 28 28 SER C C 28 178.545 178.545 176.540 2.005 18497
1561 1 5 . 1 1 28 28 SER CA C 28 61.350 61.350 60.980 0.370 18497
1562 1 5 . 1 1 28 28 SER CB C 28 62.400 62.400 62.615 -0.215 18497
1563 1 5 . 1 1 28 28 SER H H 28 8.320 8.320 8.524 -0.204 18497
1564 1 5 . 1 1 29 29 GLU N N 29 121.736 121.736 121.354 0.382 18497
1565 1 5 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.308 -0.318 18497
1566 1 5 . 1 1 29 29 GLU C C 29 176.674 176.674 178.465 -1.791 18497
1567 1 5 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.148 1.602 18497
1568 1 5 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.432 0.038 18497
1569 1 5 . 1 1 29 29 GLU H H 29 7.512 7.512 7.845 -0.333 18497
1570 1 5 . 1 1 30 30 VAL N N 30 119.480 119.480 121.120 -1.640 18497
1571 1 5 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.493 -0.116 18497
1572 1 5 . 1 1 30 30 VAL C C 30 179.241 179.241 177.783 1.458 18497
1573 1 5 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.492 0.168 18497
1574 1 5 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.598 -0.528 18497
1575 1 5 . 1 1 30 30 VAL H H 30 7.492 7.492 7.693 -0.201 18497
1576 1 5 . 1 1 31 31 MET N N 31 117.220 117.220 117.674 -0.454 18497
1577 1 5 . 1 1 31 31 MET HA H 31 3.870 3.870 3.823 0.047 18497
1578 1 5 . 1 1 31 31 MET C C 31 177.936 177.936 178.612 -0.676 18497
1579 1 5 . 1 1 31 31 MET CA C 31 57.630 57.630 56.711 0.919 18497
1580 1 5 . 1 1 31 31 MET CB C 31 30.270 30.270 31.233 -0.963 18497
1581 1 5 . 1 1 31 31 MET H H 31 8.302 8.302 8.106 0.196 18497
1582 1 5 . 1 1 32 32 ASN N N 32 116.672 116.672 118.900 -2.228 18497
1583 1 5 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.587 -0.197 18497
1584 1 5 . 1 1 32 32 ASN C C 32 176.065 176.065 178.131 -2.066 18497
1585 1 5 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.054 -0.025 18497
1586 1 5 . 1 1 32 32 ASN CB C 32 37.710 37.710 37.784 -0.074 18497
1587 1 5 . 1 1 32 32 ASN H H 32 8.313 8.313 8.602 -0.289 18497
1588 1 5 . 1 1 33 33 SER N N 33 117.471 117.471 114.763 2.708 18497
1589 1 5 . 1 1 33 33 SER HA H 33 4.150 4.150 4.223 -0.073 18497
1590 1 5 . 1 1 33 33 SER C C 33 178.806 178.806 175.004 3.802 18497
1591 1 5 . 1 1 33 33 SER CA C 33 62.950 62.950 61.345 1.605 18497
1592 1 5 . 1 1 33 33 SER CB C 33 62.600 62.600 63.197 -0.598 18497
1593 1 5 . 1 1 33 33 SER H H 33 7.851 7.851 7.986 -0.135 18497
1594 1 5 . 1 1 34 34 LEU N N 34 122.839 122.839 118.602 4.237 18497
1595 1 5 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.170 -0.291 18497
1596 1 5 . 1 1 34 34 LEU C C 34 177.892 177.892 177.254 0.638 18497
1597 1 5 . 1 1 34 34 LEU CA C 34 57.630 57.630 55.836 1.794 18497
1598 1 5 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.321 -1.521 18497
1599 1 5 . 1 1 34 34 LEU H H 34 8.128 8.128 7.258 0.870 18497
1600 1 5 . 1 1 35 35 TYR N N 35 116.666 116.666 116.448 0.218 18497
1601 1 5 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.466 0.144 18497
1602 1 5 . 1 1 35 35 TYR C C 35 179.067 179.067 177.227 1.840 18497
1603 1 5 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.554 -1.664 18497
1604 1 5 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.516 -1.806 18497
1605 1 5 . 1 1 35 35 TYR H H 35 7.924 7.924 7.692 0.232 18497
1606 1 5 . 1 1 36 36 SER N N 36 114.801 114.801 113.148 1.653 18497
1607 1 5 . 1 1 36 36 SER HA H 36 4.080 4.080 4.551 -0.471 18497
1608 1 5 . 1 1 36 36 SER C C 36 177.283 177.283 175.302 1.981 18497
1609 1 5 . 1 1 36 36 SER CA C 36 60.519 60.519 58.600 1.919 18497
1610 1 5 . 1 1 36 36 SER CB C 36 64.240 64.240 64.859 -0.619 18497
1611 1 5 . 1 1 36 36 SER H H 36 7.715 7.715 8.493 -0.778 18497
1612 1 5 . 1 1 37 37 GLY N N 37 109.803 109.803 110.575 -0.772 18497
1613 1 5 . 1 1 37 37 GLY C C 37 175.978 175.978 172.472 3.506 18497
1614 1 5 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.543 1.135 18497
1615 1 5 . 1 1 37 37 GLY H H 37 8.017 8.017 7.674 0.343 18497
1616 1 5 . 1 1 38 38 ASP N N 38 120.613 120.613 117.308 3.305 18497
1617 1 5 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.169 -0.144 18497
1618 1 5 . 1 1 38 38 ASP C C 38 173.368 173.368 174.635 -1.267 18497
1619 1 5 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.624 -0.904 18497
1620 1 5 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.445 -2.025 18497
1621 1 5 . 1 1 38 38 ASP H H 38 8.006 8.006 8.506 -0.500 18497
1622 1 5 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.322 0.018 18497
1623 1 5 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.527 -0.777 18497
1624 1 5 . 1 1 39 39 PRO CB C 39 32.130 32.130 31.464 0.666 18497
1625 1 5 . 1 1 40 40 GLN N N 40 115.056 115.056 114.451 0.605 18497
1626 1 5 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.286 -0.006 18497
1627 1 5 . 1 1 40 40 GLN C C 40 177.066 177.066 176.232 0.834 18497
1628 1 5 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.233 -0.523 18497
1629 1 5 . 1 1 40 40 GLN CB C 40 28.680 28.680 29.010 -0.330 18497
1630 1 5 . 1 1 40 40 GLN H H 40 8.237 8.237 7.487 0.750 18497
1631 1 5 . 1 1 41 41 ASP N N 41 122.839 122.839 123.758 -0.919 18497
1632 1 5 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.601 -0.288 18497
1633 1 5 . 1 1 41 41 ASP C C 41 175.804 175.804 177.551 -1.747 18497
1634 1 5 . 1 1 41 41 ASP CA C 41 55.240 55.240 55.608 -0.368 18497
1635 1 5 . 1 1 41 41 ASP CB C 41 42.220 42.220 41.888 0.332 18497
1636 1 5 . 1 1 41 41 ASP H H 41 7.211 7.211 8.252 -1.041 18497
1637 1 5 . 1 1 42 42 GLN N N 42 124.547 124.547 123.602 0.945 18497
1638 1 5 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.015 -0.155 18497
1639 1 5 . 1 1 42 42 GLN C C 42 177.196 177.196 176.821 0.375 18497
1640 1 5 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.332 -0.112 18497
1641 1 5 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.034 0.366 18497
1642 1 5 . 1 1 42 42 GLN H H 42 8.719 8.719 8.917 -0.198 18497
1643 1 5 . 1 1 43 43 LEU N N 43 118.960 118.960 120.101 -1.141 18497
1644 1 5 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.813 -0.128 18497
1645 1 5 . 1 1 43 43 LEU C C 43 178.066 178.066 178.463 -0.397 18497
1646 1 5 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.236 1.124 18497
1647 1 5 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.269 -0.879 18497
1648 1 5 . 1 1 43 43 LEU H H 43 8.206 8.206 8.072 0.134 18497
1649 1 5 . 1 1 44 44 ALA N N 44 121.666 121.666 123.172 -1.506 18497
1650 1 5 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.098 -0.219 18497
1651 1 5 . 1 1 44 44 ALA C C 44 178.327 178.327 179.607 -1.280 18497
1652 1 5 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.968 -0.258 18497
1653 1 5 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.102 0.478 18497
1654 1 5 . 1 1 44 44 ALA H H 44 7.402 7.402 7.671 -0.269 18497
1655 1 5 . 1 1 45 45 VAL N N 45 118.589 118.589 119.927 -1.338 18497
1656 1 5 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.579 0.081 18497
1657 1 5 . 1 1 45 45 VAL C C 45 179.893 179.893 177.841 2.052 18497
1658 1 5 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.748 -0.348 18497
1659 1 5 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.644 0.487 18497
1660 1 5 . 1 1 45 45 VAL H H 45 8.449 8.449 8.568 -0.119 18497
1661 1 5 . 1 1 46 46 ALA N N 46 121.006 121.006 122.413 -1.407 18497
1662 1 5 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.936 0.194 18497
1663 1 5 . 1 1 46 46 ALA C C 46 179.110 179.110 179.039 0.071 18497
1664 1 5 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.160 -0.190 18497
1665 1 5 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.530 1.580 18497
1666 1 5 . 1 1 46 46 ALA H H 46 7.654 7.654 8.080 -0.426 18497
1667 1 5 . 1 1 47 47 TYR N N 47 119.140 119.140 119.971 -0.831 18497
1668 1 5 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.975 -0.225 18497
1669 1 5 . 1 1 47 47 TYR C C 47 179.328 179.328 177.307 2.021 18497
1670 1 5 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.497 0.383 18497
1671 1 5 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.179 0.321 18497
1672 1 5 . 1 1 47 47 TYR H H 47 8.077 8.077 8.075 0.002 18497
1673 1 5 . 1 1 48 48 HIS N N 48 116.422 116.422 118.709 -2.287 18497
1674 1 5 . 1 1 48 48 HIS HA H 48 4.100 4.100 3.959 0.141 18497
1675 1 5 . 1 1 48 48 HIS C C 48 178.023 178.023 177.359 0.664 18497
1676 1 5 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.895 0.125 18497
1677 1 5 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.016 -1.076 18497
1678 1 5 . 1 1 48 48 HIS H H 48 8.326 8.326 8.140 0.186 18497
1679 1 5 . 1 1 49 49 LEU N N 49 120.974 120.974 119.936 1.038 18497
1680 1 5 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.154 0.001 18497
1681 1 5 . 1 1 49 49 LEU C C 49 177.417 177.417 179.926 -2.509 18497
1682 1 5 . 1 1 49 49 LEU CA C 49 57.890 57.890 57.334 0.556 18497
1683 1 5 . 1 1 49 49 LEU CB C 49 41.960 41.960 40.601 1.359 18497
1684 1 5 . 1 1 49 49 LEU H H 49 8.237 8.237 8.455 -0.218 18497
1685 1 5 . 1 1 50 50 ILE N N 50 119.715 119.715 120.426 -0.711 18497
1686 1 5 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.646 -0.026 18497
1687 1 5 . 1 1 50 50 ILE C C 50 179.502 179.502 177.826 1.676 18497
1688 1 5 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.003 0.057 18497
1689 1 5 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.537 0.433 18497
1690 1 5 . 1 1 50 50 ILE H H 50 7.543 7.543 8.666 -1.123 18497
1691 1 5 . 1 1 51 51 ILE N N 51 117.995 117.995 120.882 -2.887 18497
1692 1 5 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.485 0.055 18497
1693 1 5 . 1 1 51 51 ILE C C 51 179.197 179.197 178.144 1.053 18497
1694 1 5 . 1 1 51 51 ILE CA C 51 63.740 63.740 64.784 -1.044 18497
1695 1 5 . 1 1 51 51 ILE CB C 51 36.650 36.650 36.223 0.427 18497
1696 1 5 . 1 1 51 51 ILE H H 51 7.475 7.475 8.163 -0.688 18497
1697 1 5 . 1 1 52 52 ASP N N 52 121.642 121.642 120.148 1.494 18497
1698 1 5 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.306 0.134 18497
1699 1 5 . 1 1 52 52 ASP C C 52 179.197 179.197 178.799 0.398 18497
1700 1 5 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.611 -0.511 18497
1701 1 5 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.095 0.205 18497
1702 1 5 . 1 1 52 52 ASP H H 52 8.559 8.559 8.535 0.024 18497
1703 1 5 . 1 1 53 53 ASN N N 53 117.131 117.131 119.346 -2.215 18497
1704 1 5 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.364 0.246 18497
1705 1 5 . 1 1 53 53 ASN C C 53 178.545 178.545 177.412 1.133 18497
1706 1 5 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.470 -1.770 18497
1707 1 5 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.914 -0.214 18497
1708 1 5 . 1 1 53 53 ASN H H 53 8.106 8.106 8.135 -0.029 18497
1709 1 5 . 1 1 54 54 ARG N N 54 119.929 119.929 119.054 0.875 18497
1710 1 5 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.045 0.075 18497
1711 1 5 . 1 1 54 54 ARG C C 54 176.892 176.892 178.691 -1.799 18497
1712 1 5 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.234 -1.074 18497
1713 1 5 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.174 0.096 18497
1714 1 5 . 1 1 54 54 ARG H H 54 7.797 7.797 8.177 -0.380 18497
1715 1 5 . 1 1 55 55 ARG N N 55 119.227 119.227 118.306 0.921 18497
1716 1 5 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.155 0.019 18497
1717 1 5 . 1 1 55 55 ARG C C 55 175.108 175.108 177.993 -2.885 18497
1718 1 5 . 1 1 55 55 ARG CA C 55 61.880 61.880 59.080 2.800 18497
1719 1 5 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.936 1.724 18497
1720 1 5 . 1 1 55 55 ARG H H 55 7.857 7.857 7.909 -0.052 18497
1721 1 5 . 1 1 56 56 ILE N N 56 116.676 116.676 117.014 -0.338 18497
1722 1 5 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.067 -0.057 18497
1723 1 5 . 1 1 56 56 ILE C C 56 176.065 176.065 177.371 -1.306 18497
1724 1 5 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.917 -0.777 18497
1725 1 5 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.670 -1.430 18497
1726 1 5 . 1 1 56 56 ILE H H 56 8.317 8.317 8.280 0.037 18497
1727 1 5 . 1 1 57 57 MET N N 57 122.058 122.058 118.345 3.713 18497
1728 1 5 . 1 1 57 57 MET HA H 57 4.420 4.420 4.334 0.086 18497
1729 1 5 . 1 1 57 57 MET C C 57 177.283 177.283 177.127 0.156 18497
1730 1 5 . 1 1 57 57 MET CA C 57 56.030 56.030 56.427 -0.397 18497
1731 1 5 . 1 1 57 57 MET CB C 57 32.515 32.515 33.158 -0.643 18497
1732 1 5 . 1 1 57 57 MET H H 57 8.177 8.177 7.642 0.535 18497
1733 1 5 . 1 1 58 58 ASN N N 58 118.892 118.892 119.853 -0.961 18497
1734 1 5 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.473 0.217 18497
1735 1 5 . 1 1 58 58 ASN C C 58 176.500 176.500 174.213 2.287 18497
1736 1 5 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.351 -0.698 18497
1737 1 5 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.426 0.344 18497
1738 1 5 . 1 1 58 58 ASN H H 58 8.238 8.238 7.875 0.363 18497
1739 1 5 . 1 1 59 59 GLN N N 59 120.456 120.456 121.445 -0.989 18497
1740 1 5 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.551 -0.241 18497
1741 1 5 . 1 1 59 59 GLN C C 59 175.326 175.326 174.239 1.087 18497
1742 1 5 . 1 1 59 59 GLN CA C 59 56.030 56.030 54.879 1.151 18497
1743 1 5 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.662 -0.862 18497
1744 1 5 . 1 1 59 59 GLN H H 59 8.196 8.196 7.815 0.381 18497
1745 1 5 . 1 1 60 60 ALA N N 60 125.116 125.116 124.240 0.876 18497
1746 1 5 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.469 -0.087 18497
1747 1 5 . 1 1 60 60 ALA CA C 60 52.300 52.300 52.027 0.273 18497
1748 1 5 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.500 -0.390 18497
1749 1 5 . 1 1 60 60 ALA H H 60 8.293 8.293 8.389 -0.096 18497
1750 1 5 . 1 1 61 61 SER N N 61 115.686 115.686 114.505 1.181 18497
1751 1 5 . 1 1 61 61 SER HA H 61 4.470 4.470 4.460 0.010 18497
1752 1 5 . 1 1 61 61 SER C C 61 175.674 175.674 175.059 0.615 18497
1753 1 5 . 1 1 61 61 SER CA C 61 58.160 58.160 58.906 -0.746 18497
1754 1 5 . 1 1 61 61 SER CB C 61 63.740 63.740 63.468 0.272 18497
1755 1 5 . 1 1 61 61 SER H H 61 8.290 8.290 8.867 -0.577 18497
1756 1 6 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.539 -0.109 18497
1757 1 6 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.276 -0.329 18497
1758 1 6 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.611 -0.481 18497
1759 1 6 . 1 1 3 3 HIS N N 3 119.985 119.985 120.311 -0.326 18497
1760 1 6 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.554 0.052 18497
1761 1 6 . 1 1 3 3 HIS C C 3 176.587 176.587 175.879 0.708 18497
1762 1 6 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.754 0.431 18497
1763 1 6 . 1 1 3 3 HIS CB C 3 30.471 30.471 29.737 0.734 18497
1764 1 6 . 1 1 3 3 HIS H H 3 8.526 8.526 8.672 -0.146 18497
1765 1 6 . 1 1 4 4 MET N N 4 122.338 122.338 119.436 2.902 18497
1766 1 6 . 1 1 4 4 MET HA H 4 4.448 4.448 4.358 0.090 18497
1767 1 6 . 1 1 4 4 MET C C 4 175.108 175.108 176.556 -1.448 18497
1768 1 6 . 1 1 4 4 MET CA C 4 55.562 55.562 55.019 0.543 18497
1769 1 6 . 1 1 4 4 MET CB C 4 33.141 33.141 32.760 0.382 18497
1770 1 6 . 1 1 4 4 MET H H 4 8.337 8.337 7.623 0.714 18497
1771 1 6 . 1 1 5 5 SER N N 5 116.990 116.990 116.271 0.719 18497
1772 1 6 . 1 1 5 5 SER HA H 5 4.400 4.400 4.340 0.060 18497
1773 1 6 . 1 1 5 5 SER C C 5 177.979 177.979 174.394 3.585 18497
1774 1 6 . 1 1 5 5 SER CA C 5 58.039 58.039 59.065 -1.026 18497
1775 1 6 . 1 1 5 5 SER CB C 5 63.797 63.797 63.166 0.631 18497
1776 1 6 . 1 1 5 5 SER H H 5 8.330 8.330 8.256 0.074 18497
1777 1 6 . 1 1 6 6 TYR N N 6 122.027 122.027 119.934 2.093 18497
1778 1 6 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.830 -0.320 18497
1779 1 6 . 1 1 6 6 TYR C C 6 174.060 174.060 174.595 -0.535 18497
1780 1 6 . 1 1 6 6 TYR CA C 6 57.800 57.800 55.889 1.911 18497
1781 1 6 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.037 -0.352 18497
1782 1 6 . 1 1 6 6 TYR H H 6 8.201 8.201 7.165 1.036 18497
1783 1 6 . 1 1 7 7 ASP N N 7 122.439 122.439 120.218 2.221 18497
1784 1 6 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.613 -0.064 18497
1785 1 6 . 1 1 7 7 ASP C C 7 175.150 175.150 176.589 -1.439 18497
1786 1 6 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.873 -0.233 18497
1787 1 6 . 1 1 7 7 ASP CB C 7 41.300 41.300 41.953 -0.653 18497
1788 1 6 . 1 1 7 7 ASP H H 7 8.119 8.119 8.582 -0.463 18497
1789 1 6 . 1 1 8 8 ALA N N 8 124.655 124.655 128.093 -3.438 18497
1790 1 6 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.335 -0.105 18497
1791 1 6 . 1 1 8 8 ALA C C 8 175.935 175.935 177.605 -1.670 18497
1792 1 6 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.203 -0.310 18497
1793 1 6 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.298 -0.448 18497
1794 1 6 . 1 1 8 8 ALA H H 8 8.235 8.235 8.665 -0.430 18497
1795 1 6 . 1 1 9 9 ASN N N 9 116.133 116.133 117.378 -1.245 18497
1796 1 6 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.743 -0.053 18497
1797 1 6 . 1 1 9 9 ASN C C 9 177.718 177.718 176.254 1.464 18497
1798 1 6 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.780 0.020 18497
1799 1 6 . 1 1 9 9 ASN CB C 9 38.770 38.770 40.176 -1.406 18497
1800 1 6 . 1 1 9 9 ASN H H 9 8.417 8.417 8.186 0.231 18497
1801 1 6 . 1 1 10 10 VAL N N 10 119.557 119.557 122.997 -3.440 18497
1802 1 6 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.053 0.124 18497
1803 1 6 . 1 1 10 10 VAL C C 10 174.930 174.930 175.759 -0.829 18497
1804 1 6 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.379 -1.499 18497
1805 1 6 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.611 0.049 18497
1806 1 6 . 1 1 10 10 VAL H H 10 7.859 7.859 8.495 -0.636 18497
1807 1 6 . 1 1 11 11 ILE N N 11 126.561 126.561 128.189 -1.628 18497
1808 1 6 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.196 -0.156 18497
1809 1 6 . 1 1 11 11 ILE C C 11 175.935 175.935 175.571 0.364 18497
1810 1 6 . 1 1 11 11 ILE CA C 11 59.500 59.500 60.118 -0.619 18497
1811 1 6 . 1 1 11 11 ILE CB C 11 37.700 37.700 39.499 -1.799 18497
1812 1 6 . 1 1 11 11 ILE H H 11 8.283 8.283 8.116 0.167 18497
1813 1 6 . 1 1 12 12 ASP N N 12 128.161 128.161 128.618 -0.457 18497
1814 1 6 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.748 -0.018 18497
1815 1 6 . 1 1 12 12 ASP C C 12 174.891 174.891 176.050 -1.159 18497
1816 1 6 . 1 1 12 12 ASP CA C 12 53.427 53.427 55.008 -1.581 18497
1817 1 6 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.577 0.644 18497
1818 1 6 . 1 1 12 12 ASP H H 12 8.477 8.477 8.442 0.035 18497
1819 1 6 . 1 1 13 13 ASP N N 13 127.435 127.435 125.907 1.528 18497
1820 1 6 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.251 0.065 18497
1821 1 6 . 1 1 13 13 ASP C C 13 175.369 175.369 177.517 -2.148 18497
1822 1 6 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.782 -0.182 18497
1823 1 6 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.228 -0.068 18497
1824 1 6 . 1 1 13 13 ASP H H 13 8.698 8.698 8.750 -0.052 18497
1825 1 6 . 1 1 14 14 GLU N N 14 119.796 119.796 119.890 -0.094 18497
1826 1 6 . 1 1 14 14 GLU HA H 14 4.035 4.035 3.930 0.105 18497
1827 1 6 . 1 1 14 14 GLU C C 14 178.588 178.588 177.913 0.675 18497
1828 1 6 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.588 -0.088 18497
1829 1 6 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.165 -0.265 18497
1830 1 6 . 1 1 14 14 GLU H H 14 8.205 8.205 8.916 -0.711 18497
1831 1 6 . 1 1 15 15 ALA N N 15 124.156 124.156 122.515 1.641 18497
1832 1 6 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.030 0.146 18497
1833 1 6 . 1 1 15 15 ALA C C 15 179.502 179.502 179.442 0.060 18497
1834 1 6 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.624 0.376 18497
1835 1 6 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.104 0.796 18497
1836 1 6 . 1 1 15 15 ALA H H 15 8.473 8.473 7.917 0.556 18497
1837 1 6 . 1 1 16 16 VAL N N 16 117.585 117.585 119.462 -1.877 18497
1838 1 6 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.629 -0.095 18497
1839 1 6 . 1 1 16 16 VAL C C 16 179.545 179.545 177.904 1.641 18497
1840 1 6 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.724 0.276 18497
1841 1 6 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.231 0.369 18497
1842 1 6 . 1 1 16 16 VAL H H 16 8.181 8.181 8.653 -0.472 18497
1843 1 6 . 1 1 17 17 LYS N N 17 119.377 119.377 119.821 -0.444 18497
1844 1 6 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.968 -0.012 18497
1845 1 6 . 1 1 17 17 LYS C C 17 178.197 178.197 178.905 -0.708 18497
1846 1 6 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.635 0.385 18497
1847 1 6 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.079 0.051 18497
1848 1 6 . 1 1 17 17 LYS H H 17 8.001 8.001 8.230 -0.229 18497
1849 1 6 . 1 1 18 18 GLU N N 18 120.395 120.395 119.401 0.994 18497
1850 1 6 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.094 0.046 18497
1851 1 6 . 1 1 18 18 GLU C C 18 178.849 178.849 179.170 -0.321 18497
1852 1 6 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.312 0.488 18497
1853 1 6 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.387 0.106 18497
1854 1 6 . 1 1 18 18 GLU H H 18 7.943 7.943 8.206 -0.263 18497
1855 1 6 . 1 1 19 19 VAL N N 19 121.088 121.088 120.421 0.667 18497
1856 1 6 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.762 -0.112 18497
1857 1 6 . 1 1 19 19 VAL C C 19 179.415 179.415 178.202 1.213 18497
1858 1 6 . 1 1 19 19 VAL CA C 19 67.980 67.980 67.135 0.845 18497
1859 1 6 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.286 0.314 18497
1860 1 6 . 1 1 19 19 VAL H H 19 8.335 8.335 8.718 -0.383 18497
1861 1 6 . 1 1 20 20 CYS N N 20 117.290 117.290 119.830 -2.540 18497
1862 1 6 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.274 0.406 18497
1863 1 6 . 1 1 20 20 CYS C C 20 178.110 178.110 176.431 1.679 18497
1864 1 6 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.680 0.520 18497
1865 1 6 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.114 -0.314 18497
1866 1 6 . 1 1 20 20 CYS H H 20 8.434 8.434 8.321 0.113 18497
1867 1 6 . 1 1 21 21 GLU N N 21 118.195 118.195 119.374 -1.179 18497
1868 1 6 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.128 0.011 18497
1869 1 6 . 1 1 21 21 GLU C C 21 178.153 178.153 178.682 -0.529 18497
1870 1 6 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.850 0.900 18497
1871 1 6 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.588 -0.088 18497
1872 1 6 . 1 1 21 21 GLU H H 21 7.972 7.972 7.921 0.051 18497
1873 1 6 . 1 1 22 22 LYS N N 22 119.095 119.095 117.936 1.159 18497
1874 1 6 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.166 -0.161 18497
1875 1 6 . 1 1 22 22 LYS C C 22 179.371 179.371 178.490 0.881 18497
1876 1 6 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.607 0.093 18497
1877 1 6 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.854 0.066 18497
1878 1 6 . 1 1 22 22 LYS H H 22 8.071 8.071 8.195 -0.124 18497
1879 1 6 . 1 1 23 23 PHE N N 23 114.252 114.252 117.046 -2.794 18497
1880 1 6 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.487 -0.057 18497
1881 1 6 . 1 1 23 23 PHE C C 23 178.197 178.197 174.697 3.500 18497
1882 1 6 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.146 0.284 18497
1883 1 6 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.035 -1.265 18497
1884 1 6 . 1 1 23 23 PHE H H 23 8.491 8.491 8.161 0.330 18497
1885 1 6 . 1 1 24 24 GLU N N 24 119.819 119.819 115.666 4.153 18497
1886 1 6 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.074 -0.004 18497
1887 1 6 . 1 1 24 24 GLU C C 24 177.457 177.457 175.710 1.747 18497
1888 1 6 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.237 -0.407 18497
1889 1 6 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.144 -0.344 18497
1890 1 6 . 1 1 24 24 GLU H H 24 7.867 7.867 8.054 -0.187 18497
1891 1 6 . 1 1 25 25 CYS N N 25 114.633 114.633 117.487 -2.854 18497
1892 1 6 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.870 0.517 18497
1893 1 6 . 1 1 25 25 CYS C C 25 174.760 174.760 174.600 0.160 18497
1894 1 6 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.406 -2.645 18497
1895 1 6 . 1 1 25 25 CYS CB C 25 31.600 31.600 29.978 1.622 18497
1896 1 6 . 1 1 25 25 CYS H H 25 8.156 8.156 7.910 0.246 18497
1897 1 6 . 1 1 26 26 THR N N 26 109.312 109.312 112.985 -3.673 18497
1898 1 6 . 1 1 26 26 THR HA H 26 4.770 4.770 4.663 0.107 18497
1899 1 6 . 1 1 26 26 THR C C 26 173.499 173.499 175.447 -1.948 18497
1900 1 6 . 1 1 26 26 THR CA C 26 60.723 60.723 61.169 -0.446 18497
1901 1 6 . 1 1 26 26 THR CB C 26 72.000 72.000 70.826 1.174 18497
1902 1 6 . 1 1 26 26 THR H H 26 8.460 8.460 8.231 0.229 18497
1903 1 6 . 1 1 27 27 GLU N N 27 122.233 122.233 123.815 -1.582 18497
1904 1 6 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.908 -0.398 18497
1905 1 6 . 1 1 27 27 GLU C C 27 176.544 176.544 178.296 -1.752 18497
1906 1 6 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.391 0.159 18497
1907 1 6 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.502 -0.552 18497
1908 1 6 . 1 1 27 27 GLU H H 27 9.327 9.327 9.080 0.247 18497
1909 1 6 . 1 1 28 28 SER N N 28 112.925 112.925 113.919 -0.994 18497
1910 1 6 . 1 1 28 28 SER HA H 28 4.062 4.062 4.216 -0.154 18497
1911 1 6 . 1 1 28 28 SER C C 28 178.545 178.545 176.391 2.154 18497
1912 1 6 . 1 1 28 28 SER CA C 28 61.350 61.350 60.905 0.445 18497
1913 1 6 . 1 1 28 28 SER CB C 28 62.400 62.400 62.482 -0.082 18497
1914 1 6 . 1 1 28 28 SER H H 28 8.320 8.320 8.399 -0.079 18497
1915 1 6 . 1 1 29 29 GLU N N 29 121.736 121.736 122.549 -0.813 18497
1916 1 6 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.208 -0.218 18497
1917 1 6 . 1 1 29 29 GLU C C 29 176.674 176.674 178.843 -2.169 18497
1918 1 6 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.625 1.125 18497
1919 1 6 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.621 -0.151 18497
1920 1 6 . 1 1 29 29 GLU H H 29 7.512 7.512 7.649 -0.137 18497
1921 1 6 . 1 1 30 30 VAL N N 30 119.480 119.480 120.767 -1.287 18497
1922 1 6 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.531 -0.154 18497
1923 1 6 . 1 1 30 30 VAL C C 30 179.241 179.241 178.180 1.061 18497
1924 1 6 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.628 0.032 18497
1925 1 6 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.809 -0.739 18497
1926 1 6 . 1 1 30 30 VAL H H 30 7.492 7.492 8.390 -0.898 18497
1927 1 6 . 1 1 31 31 MET N N 31 117.220 117.220 117.359 -0.139 18497
1928 1 6 . 1 1 31 31 MET HA H 31 3.870 3.870 3.924 -0.054 18497
1929 1 6 . 1 1 31 31 MET C C 31 177.936 177.936 178.164 -0.228 18497
1930 1 6 . 1 1 31 31 MET CA C 31 57.630 57.630 59.019 -1.389 18497
1931 1 6 . 1 1 31 31 MET CB C 31 30.270 30.270 32.200 -1.930 18497
1932 1 6 . 1 1 31 31 MET H H 31 8.302 8.302 8.415 -0.113 18497
1933 1 6 . 1 1 32 32 ASN N N 32 116.672 116.672 118.714 -2.042 18497
1934 1 6 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.399 -0.009 18497
1935 1 6 . 1 1 32 32 ASN C C 32 176.065 176.065 177.527 -1.462 18497
1936 1 6 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.787 -0.757 18497
1937 1 6 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.421 -0.711 18497
1938 1 6 . 1 1 32 32 ASN H H 32 8.313 8.313 8.016 0.297 18497
1939 1 6 . 1 1 33 33 SER N N 33 117.471 117.471 115.283 2.188 18497
1940 1 6 . 1 1 33 33 SER HA H 33 4.150 4.150 4.256 -0.106 18497
1941 1 6 . 1 1 33 33 SER C C 33 178.806 178.806 175.802 3.004 18497
1942 1 6 . 1 1 33 33 SER CA C 33 62.950 62.950 61.157 1.792 18497
1943 1 6 . 1 1 33 33 SER CB C 33 62.600 62.600 63.285 -0.685 18497
1944 1 6 . 1 1 33 33 SER H H 33 7.851 7.851 7.657 0.194 18497
1945 1 6 . 1 1 34 34 LEU N N 34 122.839 122.839 121.154 1.685 18497
1946 1 6 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.131 -0.252 18497
1947 1 6 . 1 1 34 34 LEU C C 34 177.892 177.892 178.630 -0.738 18497
1948 1 6 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.700 0.930 18497
1949 1 6 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.900 -1.100 18497
1950 1 6 . 1 1 34 34 LEU H H 34 8.128 8.128 7.356 0.772 18497
1951 1 6 . 1 1 35 35 TYR N N 35 116.666 116.666 120.324 -3.658 18497
1952 1 6 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.206 0.404 18497
1953 1 6 . 1 1 35 35 TYR C C 35 179.067 179.067 177.473 1.594 18497
1954 1 6 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.432 -2.542 18497
1955 1 6 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.469 -1.759 18497
1956 1 6 . 1 1 35 35 TYR H H 35 7.924 7.924 8.146 -0.222 18497
1957 1 6 . 1 1 36 36 SER N N 36 114.801 114.801 113.407 1.394 18497
1958 1 6 . 1 1 36 36 SER HA H 36 4.080 4.080 4.186 -0.106 18497
1959 1 6 . 1 1 36 36 SER C C 36 177.283 177.283 175.831 1.452 18497
1960 1 6 . 1 1 36 36 SER CA C 36 60.519 60.519 59.314 1.205 18497
1961 1 6 . 1 1 36 36 SER CB C 36 64.240 64.240 64.334 -0.094 18497
1962 1 6 . 1 1 36 36 SER H H 36 7.715 7.715 8.408 -0.693 18497
1963 1 6 . 1 1 37 37 GLY N N 37 109.803 109.803 110.556 -0.753 18497
1964 1 6 . 1 1 37 37 GLY C C 37 175.978 175.978 173.842 2.136 18497
1965 1 6 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.870 0.808 18497
1966 1 6 . 1 1 37 37 GLY H H 37 8.017 8.017 7.663 0.354 18497
1967 1 6 . 1 1 38 38 ASP N N 38 120.613 120.613 121.889 -1.276 18497
1968 1 6 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.008 0.017 18497
1969 1 6 . 1 1 38 38 ASP C C 38 173.368 173.368 175.888 -2.520 18497
1970 1 6 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.681 0.039 18497
1971 1 6 . 1 1 38 38 ASP CB C 38 41.420 41.420 41.626 -0.206 18497
1972 1 6 . 1 1 38 38 ASP H H 38 8.006 8.006 7.864 0.142 18497
1973 1 6 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.488 -0.148 18497
1974 1 6 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.788 -0.038 18497
1975 1 6 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.233 -0.103 18497
1976 1 6 . 1 1 40 40 GLN N N 40 115.056 115.056 116.734 -1.678 18497
1977 1 6 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.217 0.063 18497
1978 1 6 . 1 1 40 40 GLN C C 40 177.066 177.066 176.095 0.971 18497
1979 1 6 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.889 -1.179 18497
1980 1 6 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.954 -0.274 18497
1981 1 6 . 1 1 40 40 GLN H H 40 8.237 8.237 8.080 0.157 18497
1982 1 6 . 1 1 41 41 ASP N N 41 122.839 122.839 121.348 1.491 18497
1983 1 6 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.529 -0.216 18497
1984 1 6 . 1 1 41 41 ASP C C 41 175.804 175.804 177.685 -1.881 18497
1985 1 6 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.193 1.048 18497
1986 1 6 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.423 -0.203 18497
1987 1 6 . 1 1 41 41 ASP H H 41 7.211 7.211 7.450 -0.239 18497
1988 1 6 . 1 1 42 42 GLN N N 42 124.547 124.547 123.469 1.078 18497
1989 1 6 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.042 -0.182 18497
1990 1 6 . 1 1 42 42 GLN C C 42 177.196 177.196 177.757 -0.561 18497
1991 1 6 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.276 -0.056 18497
1992 1 6 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.045 -0.645 18497
1993 1 6 . 1 1 42 42 GLN H H 42 8.719 8.719 8.834 -0.115 18497
1994 1 6 . 1 1 43 43 LEU N N 43 118.960 118.960 118.830 0.130 18497
1995 1 6 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.862 -0.177 18497
1996 1 6 . 1 1 43 43 LEU C C 43 178.066 178.066 178.334 -0.268 18497
1997 1 6 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.935 0.424 18497
1998 1 6 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.494 -1.104 18497
1999 1 6 . 1 1 43 43 LEU H H 43 8.206 8.206 8.099 0.107 18497
2000 1 6 . 1 1 44 44 ALA N N 44 121.666 121.666 122.576 -0.910 18497
2001 1 6 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.154 -0.275 18497
2002 1 6 . 1 1 44 44 ALA C C 44 178.327 178.327 180.026 -1.699 18497
2003 1 6 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.831 -0.121 18497
2004 1 6 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.358 0.222 18497
2005 1 6 . 1 1 44 44 ALA H H 44 7.402 7.402 7.590 -0.188 18497
2006 1 6 . 1 1 45 45 VAL N N 45 118.589 118.589 120.802 -2.213 18497
2007 1 6 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.576 0.084 18497
2008 1 6 . 1 1 45 45 VAL C C 45 179.893 179.893 177.726 2.167 18497
2009 1 6 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.804 -0.404 18497
2010 1 6 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.627 0.504 18497
2011 1 6 . 1 1 45 45 VAL H H 45 8.449 8.449 8.598 -0.149 18497
2012 1 6 . 1 1 46 46 ALA N N 46 121.006 121.006 122.081 -1.075 18497
2013 1 6 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.784 0.346 18497
2014 1 6 . 1 1 46 46 ALA C C 46 179.110 179.110 179.061 0.049 18497
2015 1 6 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.042 -0.072 18497
2016 1 6 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.262 1.849 18497
2017 1 6 . 1 1 46 46 ALA H H 46 7.654 7.654 7.945 -0.291 18497
2018 1 6 . 1 1 47 47 TYR N N 47 119.140 119.140 120.019 -0.879 18497
2019 1 6 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.954 -0.204 18497
2020 1 6 . 1 1 47 47 TYR C C 47 179.328 179.328 177.662 1.666 18497
2021 1 6 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.292 -0.412 18497
2022 1 6 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.324 0.176 18497
2023 1 6 . 1 1 47 47 TYR H H 47 8.077 8.077 8.092 -0.015 18497
2024 1 6 . 1 1 48 48 HIS N N 48 116.422 116.422 118.159 -1.737 18497
2025 1 6 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.125 -0.025 18497
2026 1 6 . 1 1 48 48 HIS C C 48 178.023 178.023 177.729 0.294 18497
2027 1 6 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.951 -0.931 18497
2028 1 6 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.567 -0.627 18497
2029 1 6 . 1 1 48 48 HIS H H 48 8.326 8.326 8.491 -0.165 18497
2030 1 6 . 1 1 49 49 LEU N N 49 120.974 120.974 120.376 0.598 18497
2031 1 6 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.043 0.112 18497
2032 1 6 . 1 1 49 49 LEU C C 49 177.417 177.417 178.982 -1.565 18497
2033 1 6 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.344 -0.454 18497
2034 1 6 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.478 0.482 18497
2035 1 6 . 1 1 49 49 LEU H H 49 8.237 8.237 8.456 -0.219 18497
2036 1 6 . 1 1 50 50 ILE N N 50 119.715 119.715 119.866 -0.151 18497
2037 1 6 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.678 -0.058 18497
2038 1 6 . 1 1 50 50 ILE C C 50 179.502 179.502 177.981 1.521 18497
2039 1 6 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.391 -0.331 18497
2040 1 6 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.876 0.094 18497
2041 1 6 . 1 1 50 50 ILE H H 50 7.543 7.543 8.410 -0.867 18497
2042 1 6 . 1 1 51 51 ILE N N 51 117.995 117.995 121.482 -3.487 18497
2043 1 6 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.411 0.129 18497
2044 1 6 . 1 1 51 51 ILE C C 51 179.197 179.197 177.915 1.282 18497
2045 1 6 . 1 1 51 51 ILE CA C 51 63.740 63.740 64.771 -1.031 18497
2046 1 6 . 1 1 51 51 ILE CB C 51 36.650 36.650 36.376 0.274 18497
2047 1 6 . 1 1 51 51 ILE H H 51 7.475 7.475 8.344 -0.869 18497
2048 1 6 . 1 1 52 52 ASP N N 52 121.642 121.642 119.782 1.860 18497
2049 1 6 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.243 0.197 18497
2050 1 6 . 1 1 52 52 ASP C C 52 179.197 179.197 178.384 0.813 18497
2051 1 6 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.795 -0.695 18497
2052 1 6 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.972 -0.672 18497
2053 1 6 . 1 1 52 52 ASP H H 52 8.559 8.559 8.111 0.448 18497
2054 1 6 . 1 1 53 53 ASN N N 53 117.131 117.131 118.355 -1.224 18497
2055 1 6 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.362 0.248 18497
2056 1 6 . 1 1 53 53 ASN C C 53 178.545 178.545 177.836 0.709 18497
2057 1 6 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.171 -1.471 18497
2058 1 6 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.833 -0.133 18497
2059 1 6 . 1 1 53 53 ASN H H 53 8.106 8.106 8.089 0.017 18497
2060 1 6 . 1 1 54 54 ARG N N 54 119.929 119.929 119.969 -0.040 18497
2061 1 6 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.997 0.123 18497
2062 1 6 . 1 1 54 54 ARG C C 54 176.892 176.892 178.238 -1.346 18497
2063 1 6 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.590 -0.430 18497
2064 1 6 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.074 0.196 18497
2065 1 6 . 1 1 54 54 ARG H H 54 7.797 7.797 8.230 -0.433 18497
2066 1 6 . 1 1 55 55 ARG N N 55 119.227 119.227 117.725 1.502 18497
2067 1 6 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.170 0.004 18497
2068 1 6 . 1 1 55 55 ARG C C 55 175.108 175.108 177.708 -2.600 18497
2069 1 6 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.666 3.214 18497
2070 1 6 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.158 1.502 18497
2071 1 6 . 1 1 55 55 ARG H H 55 7.857 7.857 8.031 -0.174 18497
2072 1 6 . 1 1 56 56 ILE N N 56 116.676 116.676 117.489 -0.813 18497
2073 1 6 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.164 -0.154 18497
2074 1 6 . 1 1 56 56 ILE C C 56 176.065 176.065 176.896 -0.831 18497
2075 1 6 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.586 -0.446 18497
2076 1 6 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.398 -1.158 18497
2077 1 6 . 1 1 56 56 ILE H H 56 8.317 8.317 8.464 -0.147 18497
2078 1 6 . 1 1 57 57 MET N N 57 122.058 122.058 118.448 3.610 18497
2079 1 6 . 1 1 57 57 MET HA H 57 4.420 4.420 4.618 -0.198 18497
2080 1 6 . 1 1 57 57 MET C C 57 177.283 177.283 175.035 2.248 18497
2081 1 6 . 1 1 57 57 MET CA C 57 56.030 56.030 53.724 2.306 18497
2082 1 6 . 1 1 57 57 MET CB C 57 32.515 32.515 31.254 1.261 18497
2083 1 6 . 1 1 57 57 MET H H 57 8.177 8.177 7.527 0.650 18497
2084 1 6 . 1 1 58 58 ASN N N 58 118.892 118.892 118.485 0.407 18497
2085 1 6 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.685 0.005 18497
2086 1 6 . 1 1 58 58 ASN C C 58 176.500 176.500 176.301 0.199 18497
2087 1 6 . 1 1 58 58 ASN CA C 58 53.653 53.653 53.943 -0.290 18497
2088 1 6 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.012 -0.242 18497
2089 1 6 . 1 1 58 58 ASN H H 58 8.238 8.238 7.675 0.563 18497
2090 1 6 . 1 1 59 59 GLN N N 59 120.456 120.456 125.583 -5.127 18497
2091 1 6 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.243 0.067 18497
2092 1 6 . 1 1 59 59 GLN C C 59 175.326 175.326 175.867 -0.541 18497
2093 1 6 . 1 1 59 59 GLN CA C 59 56.030 56.030 57.371 -1.341 18497
2094 1 6 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.542 -0.742 18497
2095 1 6 . 1 1 59 59 GLN H H 59 8.196 8.196 8.772 -0.576 18497
2096 1 6 . 1 1 60 60 ALA N N 60 125.116 125.116 119.943 5.173 18497
2097 1 6 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.429 -0.047 18497
2098 1 6 . 1 1 60 60 ALA CA C 60 52.300 52.300 52.049 0.251 18497
2099 1 6 . 1 1 60 60 ALA CB C 60 19.110 19.110 20.536 -1.426 18497
2100 1 6 . 1 1 60 60 ALA H H 60 8.293 8.293 7.668 0.625 18497
2101 1 6 . 1 1 61 61 SER N N 61 115.686 115.686 115.456 0.230 18497
2102 1 6 . 1 1 61 61 SER HA H 61 4.470 4.470 4.730 -0.260 18497
2103 1 6 . 1 1 61 61 SER C C 61 175.674 175.674 172.528 3.146 18497
2104 1 6 . 1 1 61 61 SER CA C 61 58.160 58.160 57.955 0.205 18497
2105 1 6 . 1 1 61 61 SER CB C 61 63.740 63.740 64.929 -1.189 18497
2106 1 6 . 1 1 61 61 SER H H 61 8.290 8.290 8.188 0.102 18497
2107 1 7 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.621 -0.191 18497
2108 1 7 . 1 1 2 2 PRO CA C 2 62.947 62.947 61.893 1.054 18497
2109 1 7 . 1 1 2 2 PRO CB C 2 32.130 32.130 33.215 -1.085 18497
2110 1 7 . 1 1 3 3 HIS N N 3 119.985 119.985 119.889 0.096 18497
2111 1 7 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.199 0.407 18497
2112 1 7 . 1 1 3 3 HIS C C 3 176.587 176.587 175.197 1.390 18497
2113 1 7 . 1 1 3 3 HIS CA C 3 56.185 56.185 57.292 -1.107 18497
2114 1 7 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.064 0.407 18497
2115 1 7 . 1 1 3 3 HIS H H 3 8.526 8.526 8.815 -0.289 18497
2116 1 7 . 1 1 4 4 MET N N 4 122.338 122.338 115.817 6.521 18497
2117 1 7 . 1 1 4 4 MET HA H 4 4.448 4.448 4.129 0.319 18497
2118 1 7 . 1 1 4 4 MET C C 4 175.108 175.108 177.480 -2.372 18497
2119 1 7 . 1 1 4 4 MET CA C 4 55.562 55.562 56.629 -1.067 18497
2120 1 7 . 1 1 4 4 MET CB C 4 33.141 33.141 32.659 0.482 18497
2121 1 7 . 1 1 4 4 MET H H 4 8.337 8.337 7.899 0.438 18497
2122 1 7 . 1 1 5 5 SER N N 5 116.990 116.990 115.932 1.058 18497
2123 1 7 . 1 1 5 5 SER HA H 5 4.400 4.400 4.575 -0.175 18497
2124 1 7 . 1 1 5 5 SER C C 5 177.979 177.979 173.930 4.049 18497
2125 1 7 . 1 1 5 5 SER CA C 5 58.039 58.039 57.827 0.212 18497
2126 1 7 . 1 1 5 5 SER CB C 5 63.797 63.797 61.771 2.026 18497
2127 1 7 . 1 1 5 5 SER H H 5 8.330 8.330 7.383 0.947 18497
2128 1 7 . 1 1 6 6 TYR N N 6 122.027 122.027 122.463 -0.436 18497
2129 1 7 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.309 0.201 18497
2130 1 7 . 1 1 6 6 TYR C C 6 174.060 174.060 176.714 -2.654 18497
2131 1 7 . 1 1 6 6 TYR CA C 6 57.800 57.800 59.214 -1.414 18497
2132 1 7 . 1 1 6 6 TYR CB C 6 38.685 38.685 38.619 0.066 18497
2133 1 7 . 1 1 6 6 TYR H H 6 8.201 8.201 7.654 0.547 18497
2134 1 7 . 1 1 7 7 ASP N N 7 122.439 122.439 120.573 1.866 18497
2135 1 7 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.401 0.148 18497
2136 1 7 . 1 1 7 7 ASP C C 7 175.150 175.150 176.907 -1.757 18497
2137 1 7 . 1 1 7 7 ASP CA C 7 53.640 53.640 56.845 -3.205 18497
2138 1 7 . 1 1 7 7 ASP CB C 7 41.300 41.300 41.043 0.257 18497
2139 1 7 . 1 1 7 7 ASP H H 7 8.119 8.119 8.954 -0.835 18497
2140 1 7 . 1 1 8 8 ALA N N 8 124.655 124.655 119.541 5.114 18497
2141 1 7 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.282 -0.052 18497
2142 1 7 . 1 1 8 8 ALA C C 8 175.935 175.935 178.302 -2.367 18497
2143 1 7 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.124 -1.231 18497
2144 1 7 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.958 -0.108 18497
2145 1 7 . 1 1 8 8 ALA H H 8 8.235 8.235 7.971 0.264 18497
2146 1 7 . 1 1 9 9 ASN N N 9 116.133 116.133 116.836 -0.703 18497
2147 1 7 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.898 -0.208 18497
2148 1 7 . 1 1 9 9 ASN C C 9 177.718 177.718 176.020 1.698 18497
2149 1 7 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.398 -0.598 18497
2150 1 7 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.964 -1.194 18497
2151 1 7 . 1 1 9 9 ASN H H 9 8.417 8.417 7.619 0.798 18497
2152 1 7 . 1 1 10 10 VAL N N 10 119.557 119.557 121.412 -1.855 18497
2153 1 7 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.099 0.078 18497
2154 1 7 . 1 1 10 10 VAL C C 10 174.930 174.930 174.696 0.234 18497
2155 1 7 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.924 -2.044 18497
2156 1 7 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.277 0.383 18497
2157 1 7 . 1 1 10 10 VAL H H 10 7.859 7.859 8.044 -0.185 18497
2158 1 7 . 1 1 11 11 ILE N N 11 126.561 126.561 127.477 -0.916 18497
2159 1 7 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.511 -0.471 18497
2160 1 7 . 1 1 11 11 ILE C C 11 175.935 175.935 174.712 1.223 18497
2161 1 7 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.530 -0.030 18497
2162 1 7 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.570 -3.870 18497
2163 1 7 . 1 1 11 11 ILE H H 11 8.283 8.283 8.166 0.117 18497
2164 1 7 . 1 1 12 12 ASP N N 12 128.161 128.161 128.298 -0.137 18497
2165 1 7 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.894 -0.164 18497
2166 1 7 . 1 1 12 12 ASP C C 12 174.891 174.891 175.779 -0.888 18497
2167 1 7 . 1 1 12 12 ASP CA C 12 53.427 53.427 54.555 -1.128 18497
2168 1 7 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.584 0.636 18497
2169 1 7 . 1 1 12 12 ASP H H 12 8.477 8.477 8.592 -0.115 18497
2170 1 7 . 1 1 13 13 ASP N N 13 127.435 127.435 126.193 1.242 18497
2171 1 7 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.262 0.054 18497
2172 1 7 . 1 1 13 13 ASP C C 13 175.369 175.369 177.347 -1.978 18497
2173 1 7 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.721 -0.121 18497
2174 1 7 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.342 -0.182 18497
2175 1 7 . 1 1 13 13 ASP H H 13 8.698 8.698 8.857 -0.159 18497
2176 1 7 . 1 1 14 14 GLU N N 14 119.796 119.796 119.832 -0.036 18497
2177 1 7 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.067 -0.032 18497
2178 1 7 . 1 1 14 14 GLU C C 14 178.588 178.588 177.900 0.688 18497
2179 1 7 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.426 0.074 18497
2180 1 7 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.460 -0.561 18497
2181 1 7 . 1 1 14 14 GLU H H 14 8.205 8.205 8.589 -0.384 18497
2182 1 7 . 1 1 15 15 ALA N N 15 124.156 124.156 122.528 1.628 18497
2183 1 7 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.117 0.059 18497
2184 1 7 . 1 1 15 15 ALA C C 15 179.502 179.502 179.843 -0.341 18497
2185 1 7 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.938 0.062 18497
2186 1 7 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.044 0.856 18497
2187 1 7 . 1 1 15 15 ALA H H 15 8.473 8.473 7.408 1.065 18497
2188 1 7 . 1 1 16 16 VAL N N 16 117.585 117.585 119.161 -1.576 18497
2189 1 7 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.590 -0.056 18497
2190 1 7 . 1 1 16 16 VAL C C 16 179.545 179.545 177.971 1.574 18497
2191 1 7 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.704 0.296 18497
2192 1 7 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.341 0.259 18497
2193 1 7 . 1 1 16 16 VAL H H 16 8.181 8.181 8.618 -0.437 18497
2194 1 7 . 1 1 17 17 LYS N N 17 119.377 119.377 120.123 -0.746 18497
2195 1 7 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.999 -0.043 18497
2196 1 7 . 1 1 17 17 LYS C C 17 178.197 178.197 179.022 -0.825 18497
2197 1 7 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.402 0.618 18497
2198 1 7 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.389 -0.259 18497
2199 1 7 . 1 1 17 17 LYS H H 17 8.001 8.001 8.038 -0.037 18497
2200 1 7 . 1 1 18 18 GLU N N 18 120.395 120.395 119.470 0.925 18497
2201 1 7 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.070 0.070 18497
2202 1 7 . 1 1 18 18 GLU C C 18 178.849 178.849 178.916 -0.067 18497
2203 1 7 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.358 0.442 18497
2204 1 7 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.925 -0.432 18497
2205 1 7 . 1 1 18 18 GLU H H 18 7.943 7.943 8.116 -0.173 18497
2206 1 7 . 1 1 19 19 VAL N N 19 121.088 121.088 120.628 0.460 18497
2207 1 7 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.711 -0.061 18497
2208 1 7 . 1 1 19 19 VAL C C 19 179.415 179.415 177.392 2.023 18497
2209 1 7 . 1 1 19 19 VAL CA C 19 67.980 67.980 65.973 2.007 18497
2210 1 7 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.799 -0.199 18497
2211 1 7 . 1 1 19 19 VAL H H 19 8.335 8.335 8.630 -0.295 18497
2212 1 7 . 1 1 20 20 CYS N N 20 117.290 117.290 117.881 -0.591 18497
2213 1 7 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.080 0.600 18497
2214 1 7 . 1 1 20 20 CYS C C 20 178.110 178.110 176.198 1.912 18497
2215 1 7 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.692 0.508 18497
2216 1 7 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.184 -0.384 18497
2217 1 7 . 1 1 20 20 CYS H H 20 8.434 8.434 7.693 0.741 18497
2218 1 7 . 1 1 21 21 GLU N N 21 118.195 118.195 118.505 -0.310 18497
2219 1 7 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.231 -0.092 18497
2220 1 7 . 1 1 21 21 GLU C C 21 178.153 178.153 179.198 -1.045 18497
2221 1 7 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.361 1.389 18497
2222 1 7 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.673 -0.173 18497
2223 1 7 . 1 1 21 21 GLU H H 21 7.972 7.972 7.899 0.073 18497
2224 1 7 . 1 1 22 22 LYS N N 22 119.095 119.095 119.945 -0.850 18497
2225 1 7 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.138 -0.133 18497
2226 1 7 . 1 1 22 22 LYS C C 22 179.371 179.371 178.200 1.171 18497
2227 1 7 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.909 -0.209 18497
2228 1 7 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.674 0.246 18497
2229 1 7 . 1 1 22 22 LYS H H 22 8.071 8.071 8.400 -0.329 18497
2230 1 7 . 1 1 23 23 PHE N N 23 114.252 114.252 117.178 -2.926 18497
2231 1 7 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.547 -0.117 18497
2232 1 7 . 1 1 23 23 PHE C C 23 178.197 178.197 174.660 3.537 18497
2233 1 7 . 1 1 23 23 PHE CA C 23 58.430 58.430 57.687 0.743 18497
2234 1 7 . 1 1 23 23 PHE CB C 23 38.770 38.770 39.925 -1.155 18497
2235 1 7 . 1 1 23 23 PHE H H 23 8.491 8.491 8.044 0.447 18497
2236 1 7 . 1 1 24 24 GLU N N 24 119.819 119.819 116.140 3.679 18497
2237 1 7 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.008 0.062 18497
2238 1 7 . 1 1 24 24 GLU C C 24 177.457 177.457 175.853 1.604 18497
2239 1 7 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.248 -0.418 18497
2240 1 7 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.008 -0.208 18497
2241 1 7 . 1 1 24 24 GLU H H 24 7.867 7.867 8.236 -0.369 18497
2242 1 7 . 1 1 25 25 CYS N N 25 114.633 114.633 116.531 -1.898 18497
2243 1 7 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.874 0.513 18497
2244 1 7 . 1 1 25 25 CYS C C 25 174.760 174.760 174.320 0.440 18497
2245 1 7 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.661 -1.900 18497
2246 1 7 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.247 1.353 18497
2247 1 7 . 1 1 25 25 CYS H H 25 8.156 8.156 7.647 0.509 18497
2248 1 7 . 1 1 26 26 THR N N 26 109.312 109.312 111.319 -2.007 18497
2249 1 7 . 1 1 26 26 THR HA H 26 4.770 4.770 4.641 0.129 18497
2250 1 7 . 1 1 26 26 THR C C 26 173.499 173.499 174.913 -1.414 18497
2251 1 7 . 1 1 26 26 THR CA C 26 60.723 60.723 61.215 -0.492 18497
2252 1 7 . 1 1 26 26 THR CB C 26 72.000 72.000 72.055 -0.055 18497
2253 1 7 . 1 1 26 26 THR H H 26 8.460 8.460 7.873 0.587 18497
2254 1 7 . 1 1 27 27 GLU N N 27 122.233 122.233 124.134 -1.901 18497
2255 1 7 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.895 -0.385 18497
2256 1 7 . 1 1 27 27 GLU C C 27 176.544 176.544 178.126 -1.582 18497
2257 1 7 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.566 -0.016 18497
2258 1 7 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.373 -0.423 18497
2259 1 7 . 1 1 27 27 GLU H H 27 9.327 9.327 9.050 0.277 18497
2260 1 7 . 1 1 28 28 SER N N 28 112.925 112.925 114.539 -1.614 18497
2261 1 7 . 1 1 28 28 SER HA H 28 4.062 4.062 4.211 -0.149 18497
2262 1 7 . 1 1 28 28 SER C C 28 178.545 178.545 176.423 2.122 18497
2263 1 7 . 1 1 28 28 SER CA C 28 61.350 61.350 61.967 -0.617 18497
2264 1 7 . 1 1 28 28 SER CB C 28 62.400 62.400 62.644 -0.244 18497
2265 1 7 . 1 1 28 28 SER H H 28 8.320 8.320 8.505 -0.185 18497
2266 1 7 . 1 1 29 29 GLU N N 29 121.736 121.736 121.432 0.304 18497
2267 1 7 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.259 -0.269 18497
2268 1 7 . 1 1 29 29 GLU C C 29 176.674 176.674 178.902 -2.228 18497
2269 1 7 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.537 1.213 18497
2270 1 7 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.574 -0.104 18497
2271 1 7 . 1 1 29 29 GLU H H 29 7.512 7.512 7.696 -0.184 18497
2272 1 7 . 1 1 30 30 VAL N N 30 119.480 119.480 121.843 -2.363 18497
2273 1 7 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.523 -0.146 18497
2274 1 7 . 1 1 30 30 VAL C C 30 179.241 179.241 177.945 1.296 18497
2275 1 7 . 1 1 30 30 VAL CA C 30 66.660 66.660 67.079 -0.419 18497
2276 1 7 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.608 -0.538 18497
2277 1 7 . 1 1 30 30 VAL H H 30 7.492 7.492 8.342 -0.850 18497
2278 1 7 . 1 1 31 31 MET N N 31 117.220 117.220 117.595 -0.375 18497
2279 1 7 . 1 1 31 31 MET HA H 31 3.870 3.870 3.642 0.228 18497
2280 1 7 . 1 1 31 31 MET C C 31 177.936 177.936 178.195 -0.259 18497
2281 1 7 . 1 1 31 31 MET CA C 31 57.630 57.630 59.195 -1.565 18497
2282 1 7 . 1 1 31 31 MET CB C 31 30.270 30.270 32.143 -1.873 18497
2283 1 7 . 1 1 31 31 MET H H 31 8.302 8.302 8.422 -0.120 18497
2284 1 7 . 1 1 32 32 ASN N N 32 116.672 116.672 118.809 -2.137 18497
2285 1 7 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.442 -0.052 18497
2286 1 7 . 1 1 32 32 ASN C C 32 176.065 176.065 177.518 -1.453 18497
2287 1 7 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.296 -0.266 18497
2288 1 7 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.219 -0.509 18497
2289 1 7 . 1 1 32 32 ASN H H 32 8.313 8.313 8.165 0.148 18497
2290 1 7 . 1 1 33 33 SER N N 33 117.471 117.471 114.558 2.913 18497
2291 1 7 . 1 1 33 33 SER HA H 33 4.150 4.150 4.204 -0.054 18497
2292 1 7 . 1 1 33 33 SER C C 33 178.806 178.806 175.772 3.034 18497
2293 1 7 . 1 1 33 33 SER CA C 33 62.950 62.950 60.805 2.145 18497
2294 1 7 . 1 1 33 33 SER CB C 33 62.600 62.600 63.236 -0.636 18497
2295 1 7 . 1 1 33 33 SER H H 33 7.851 7.851 8.080 -0.229 18497
2296 1 7 . 1 1 34 34 LEU N N 34 122.839 122.839 118.689 4.150 18497
2297 1 7 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.071 -0.192 18497
2298 1 7 . 1 1 34 34 LEU C C 34 177.892 177.892 177.378 0.514 18497
2299 1 7 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.285 1.345 18497
2300 1 7 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.129 -1.329 18497
2301 1 7 . 1 1 34 34 LEU H H 34 8.128 8.128 7.152 0.976 18497
2302 1 7 . 1 1 35 35 TYR N N 35 116.666 116.666 114.635 2.031 18497
2303 1 7 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.629 -0.019 18497
2304 1 7 . 1 1 35 35 TYR C C 35 179.067 179.067 176.818 2.249 18497
2305 1 7 . 1 1 35 35 TYR CA C 35 57.890 57.890 58.641 -0.751 18497
2306 1 7 . 1 1 35 35 TYR CB C 35 37.710 37.710 40.020 -2.310 18497
2307 1 7 . 1 1 35 35 TYR H H 35 7.924 7.924 7.802 0.122 18497
2308 1 7 . 1 1 36 36 SER N N 36 114.801 114.801 112.976 1.825 18497
2309 1 7 . 1 1 36 36 SER HA H 36 4.080 4.080 4.607 -0.527 18497
2310 1 7 . 1 1 36 36 SER C C 36 177.283 177.283 175.287 1.996 18497
2311 1 7 . 1 1 36 36 SER CA C 36 60.519 60.519 58.526 1.993 18497
2312 1 7 . 1 1 36 36 SER CB C 36 64.240 64.240 65.467 -1.227 18497
2313 1 7 . 1 1 36 36 SER H H 36 7.715 7.715 8.626 -0.911 18497
2314 1 7 . 1 1 37 37 GLY N N 37 109.803 109.803 111.522 -1.719 18497
2315 1 7 . 1 1 37 37 GLY C C 37 175.978 175.978 172.694 3.284 18497
2316 1 7 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.371 0.307 18497
2317 1 7 . 1 1 37 37 GLY H H 37 8.017 8.017 7.958 0.059 18497
2318 1 7 . 1 1 38 38 ASP N N 38 120.613 120.613 118.804 1.809 18497
2319 1 7 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.003 0.022 18497
2320 1 7 . 1 1 38 38 ASP C C 38 173.368 173.368 174.610 -1.242 18497
2321 1 7 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.969 -1.250 18497
2322 1 7 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.015 -1.595 18497
2323 1 7 . 1 1 38 38 ASP H H 38 8.006 8.006 8.040 -0.034 18497
2324 1 7 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.337 0.003 18497
2325 1 7 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.419 -0.669 18497
2326 1 7 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.150 -0.020 18497
2327 1 7 . 1 1 40 40 GLN N N 40 115.056 115.056 114.350 0.706 18497
2328 1 7 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.330 -0.050 18497
2329 1 7 . 1 1 40 40 GLN C C 40 177.066 177.066 176.484 0.582 18497
2330 1 7 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.117 -0.407 18497
2331 1 7 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.586 0.094 18497
2332 1 7 . 1 1 40 40 GLN H H 40 8.237 8.237 8.280 -0.043 18497
2333 1 7 . 1 1 41 41 ASP N N 41 122.839 122.839 121.580 1.259 18497
2334 1 7 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.586 -0.273 18497
2335 1 7 . 1 1 41 41 ASP C C 41 175.804 175.804 177.441 -1.637 18497
2336 1 7 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.648 0.593 18497
2337 1 7 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.928 -0.708 18497
2338 1 7 . 1 1 41 41 ASP H H 41 7.211 7.211 7.797 -0.586 18497
2339 1 7 . 1 1 42 42 GLN N N 42 124.547 124.547 124.721 -0.174 18497
2340 1 7 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.021 -0.161 18497
2341 1 7 . 1 1 42 42 GLN C C 42 177.196 177.196 177.300 -0.104 18497
2342 1 7 . 1 1 42 42 GLN CA C 42 59.220 59.220 58.854 0.366 18497
2343 1 7 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.642 -0.242 18497
2344 1 7 . 1 1 42 42 GLN H H 42 8.719 8.719 8.708 0.011 18497
2345 1 7 . 1 1 43 43 LEU N N 43 118.960 118.960 119.651 -0.691 18497
2346 1 7 . 1 1 43 43 LEU HA H 43 3.685 3.685 4.004 -0.319 18497
2347 1 7 . 1 1 43 43 LEU C C 43 178.066 178.066 178.826 -0.760 18497
2348 1 7 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.667 0.693 18497
2349 1 7 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.422 -1.032 18497
2350 1 7 . 1 1 43 43 LEU H H 43 8.206 8.206 8.398 -0.192 18497
2351 1 7 . 1 1 44 44 ALA N N 44 121.666 121.666 122.989 -1.323 18497
2352 1 7 . 1 1 44 44 ALA HA H 44 3.879 3.879 3.893 -0.014 18497
2353 1 7 . 1 1 44 44 ALA C C 44 178.327 178.327 179.462 -1.135 18497
2354 1 7 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.893 -0.183 18497
2355 1 7 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.031 0.549 18497
2356 1 7 . 1 1 44 44 ALA H H 44 7.402 7.402 7.579 -0.177 18497
2357 1 7 . 1 1 45 45 VAL N N 45 118.589 118.589 120.211 -1.622 18497
2358 1 7 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.682 -0.022 18497
2359 1 7 . 1 1 45 45 VAL C C 45 179.893 179.893 177.899 1.994 18497
2360 1 7 . 1 1 45 45 VAL CA C 45 66.400 66.400 67.134 -0.734 18497
2361 1 7 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.251 0.880 18497
2362 1 7 . 1 1 45 45 VAL H H 45 8.449 8.449 8.572 -0.123 18497
2363 1 7 . 1 1 46 46 ALA N N 46 121.006 121.006 122.288 -1.282 18497
2364 1 7 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.673 0.457 18497
2365 1 7 . 1 1 46 46 ALA C C 46 179.110 179.110 179.042 0.068 18497
2366 1 7 . 1 1 46 46 ALA CA C 46 54.970 54.970 54.949 0.021 18497
2367 1 7 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.053 2.057 18497
2368 1 7 . 1 1 46 46 ALA H H 46 7.654 7.654 7.866 -0.212 18497
2369 1 7 . 1 1 47 47 TYR N N 47 119.140 119.140 119.774 -0.634 18497
2370 1 7 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.894 -0.144 18497
2371 1 7 . 1 1 47 47 TYR C C 47 179.328 179.328 177.626 1.702 18497
2372 1 7 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.610 0.270 18497
2373 1 7 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.199 0.301 18497
2374 1 7 . 1 1 47 47 TYR H H 47 8.077 8.077 7.658 0.419 18497
2375 1 7 . 1 1 48 48 HIS N N 48 116.422 116.422 117.161 -0.739 18497
2376 1 7 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.052 0.048 18497
2377 1 7 . 1 1 48 48 HIS C C 48 178.023 178.023 177.823 0.200 18497
2378 1 7 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.735 0.285 18497
2379 1 7 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.728 -0.788 18497
2380 1 7 . 1 1 48 48 HIS H H 48 8.326 8.326 8.324 0.002 18497
2381 1 7 . 1 1 49 49 LEU N N 49 120.974 120.974 120.761 0.213 18497
2382 1 7 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.055 0.100 18497
2383 1 7 . 1 1 49 49 LEU C C 49 177.417 177.417 179.056 -1.639 18497
2384 1 7 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.084 -0.194 18497
2385 1 7 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.456 0.504 18497
2386 1 7 . 1 1 49 49 LEU H H 49 8.237 8.237 8.537 -0.300 18497
2387 1 7 . 1 1 50 50 ILE N N 50 119.715 119.715 119.524 0.191 18497
2388 1 7 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.559 0.061 18497
2389 1 7 . 1 1 50 50 ILE C C 50 179.502 179.502 177.688 1.814 18497
2390 1 7 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.579 -0.519 18497
2391 1 7 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.766 0.204 18497
2392 1 7 . 1 1 50 50 ILE H H 50 7.543 7.543 8.373 -0.830 18497
2393 1 7 . 1 1 51 51 ILE N N 51 117.995 117.995 120.925 -2.930 18497
2394 1 7 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.504 0.036 18497
2395 1 7 . 1 1 51 51 ILE C C 51 179.197 179.197 178.046 1.151 18497
2396 1 7 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.471 -1.731 18497
2397 1 7 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.433 -0.783 18497
2398 1 7 . 1 1 51 51 ILE H H 51 7.475 7.475 7.792 -0.317 18497
2399 1 7 . 1 1 52 52 ASP N N 52 121.642 121.642 120.709 0.933 18497
2400 1 7 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.278 0.162 18497
2401 1 7 . 1 1 52 52 ASP C C 52 179.197 179.197 178.028 1.169 18497
2402 1 7 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.841 -0.741 18497
2403 1 7 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.895 -0.595 18497
2404 1 7 . 1 1 52 52 ASP H H 52 8.559 8.559 8.091 0.468 18497
2405 1 7 . 1 1 53 53 ASN N N 53 117.131 117.131 118.549 -1.418 18497
2406 1 7 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.319 0.291 18497
2407 1 7 . 1 1 53 53 ASN C C 53 178.545 178.545 177.353 1.192 18497
2408 1 7 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.380 -1.680 18497
2409 1 7 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.870 -0.170 18497
2410 1 7 . 1 1 53 53 ASN H H 53 8.106 8.106 8.207 -0.101 18497
2411 1 7 . 1 1 54 54 ARG N N 54 119.929 119.929 119.466 0.463 18497
2412 1 7 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.025 0.095 18497
2413 1 7 . 1 1 54 54 ARG C C 54 176.892 176.892 178.697 -1.805 18497
2414 1 7 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.027 -0.867 18497
2415 1 7 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.186 0.084 18497
2416 1 7 . 1 1 54 54 ARG H H 54 7.797 7.797 8.250 -0.453 18497
2417 1 7 . 1 1 55 55 ARG N N 55 119.227 119.227 117.165 2.062 18497
2418 1 7 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.158 0.016 18497
2419 1 7 . 1 1 55 55 ARG C C 55 175.108 175.108 178.189 -3.081 18497
2420 1 7 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.455 3.425 18497
2421 1 7 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.065 1.595 18497
2422 1 7 . 1 1 55 55 ARG H H 55 7.857 7.857 7.672 0.185 18497
2423 1 7 . 1 1 56 56 ILE N N 56 116.676 116.676 117.986 -1.310 18497
2424 1 7 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.126 -0.116 18497
2425 1 7 . 1 1 56 56 ILE C C 56 176.065 176.065 177.999 -1.934 18497
2426 1 7 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.389 -0.249 18497
2427 1 7 . 1 1 56 56 ILE CB C 56 38.240 38.240 37.935 0.305 18497
2428 1 7 . 1 1 56 56 ILE H H 56 8.317 8.317 8.479 -0.162 18497
2429 1 7 . 1 1 57 57 MET N N 57 122.058 122.058 117.474 4.584 18497
2430 1 7 . 1 1 57 57 MET HA H 57 4.420 4.420 4.191 0.229 18497
2431 1 7 . 1 1 57 57 MET C C 57 177.283 177.283 177.449 -0.166 18497
2432 1 7 . 1 1 57 57 MET CA C 57 56.030 56.030 58.011 -1.981 18497
2433 1 7 . 1 1 57 57 MET CB C 57 32.515 32.515 32.329 0.186 18497
2434 1 7 . 1 1 57 57 MET H H 57 8.177 8.177 7.719 0.458 18497
2435 1 7 . 1 1 58 58 ASN N N 58 118.892 118.892 116.431 2.461 18497
2436 1 7 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.564 0.126 18497
2437 1 7 . 1 1 58 58 ASN C C 58 176.500 176.500 175.556 0.944 18497
2438 1 7 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.341 -0.688 18497
2439 1 7 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.228 -0.458 18497
2440 1 7 . 1 1 58 58 ASN H H 58 8.238 8.238 7.754 0.484 18497
2441 1 7 . 1 1 59 59 GLN N N 59 120.456 120.456 121.146 -0.690 18497
2442 1 7 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.280 0.030 18497
2443 1 7 . 1 1 59 59 GLN C C 59 175.326 175.326 175.265 0.061 18497
2444 1 7 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.791 0.238 18497
2445 1 7 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.661 -0.861 18497
2446 1 7 . 1 1 59 59 GLN H H 59 8.196 8.196 7.414 0.782 18497
2447 1 7 . 1 1 60 60 ALA N N 60 125.116 125.116 127.565 -2.449 18497
2448 1 7 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.367 0.015 18497
2449 1 7 . 1 1 60 60 ALA CA C 60 52.300 52.300 51.984 0.316 18497
2450 1 7 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.299 -0.189 18497
2451 1 7 . 1 1 60 60 ALA H H 60 8.293 8.293 8.319 -0.026 18497
2452 1 7 . 1 1 61 61 SER N N 61 115.686 115.686 114.403 1.283 18497
2453 1 7 . 1 1 61 61 SER HA H 61 4.470 4.470 4.448 0.022 18497
2454 1 7 . 1 1 61 61 SER C C 61 175.674 175.674 174.485 1.189 18497
2455 1 7 . 1 1 61 61 SER CA C 61 58.160 58.160 58.992 -0.832 18497
2456 1 7 . 1 1 61 61 SER CB C 61 63.740 63.740 63.454 0.286 18497
2457 1 7 . 1 1 61 61 SER H H 61 8.290 8.290 8.701 -0.411 18497
2458 1 8 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.472 -0.042 18497
2459 1 8 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.595 -0.648 18497
2460 1 8 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.349 -0.219 18497
2461 1 8 . 1 1 3 3 HIS N N 3 119.985 119.985 119.826 0.159 18497
2462 1 8 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.685 -0.079 18497
2463 1 8 . 1 1 3 3 HIS C C 3 176.587 176.587 174.264 2.323 18497
2464 1 8 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.198 0.987 18497
2465 1 8 . 1 1 3 3 HIS CB C 3 30.471 30.471 31.722 -1.251 18497
2466 1 8 . 1 1 3 3 HIS H H 3 8.526 8.526 7.859 0.667 18497
2467 1 8 . 1 1 4 4 MET N N 4 122.338 122.338 121.455 0.883 18497
2468 1 8 . 1 1 4 4 MET HA H 4 4.448 4.448 4.490 -0.042 18497
2469 1 8 . 1 1 4 4 MET C C 4 175.108 175.108 176.416 -1.308 18497
2470 1 8 . 1 1 4 4 MET CA C 4 55.562 55.562 54.554 1.008 18497
2471 1 8 . 1 1 4 4 MET CB C 4 33.141 33.141 33.539 -0.398 18497
2472 1 8 . 1 1 4 4 MET H H 4 8.337 8.337 7.934 0.403 18497
2473 1 8 . 1 1 5 5 SER N N 5 116.990 116.990 115.493 1.497 18497
2474 1 8 . 1 1 5 5 SER HA H 5 4.400 4.400 4.398 0.002 18497
2475 1 8 . 1 1 5 5 SER C C 5 177.979 177.979 174.919 3.060 18497
2476 1 8 . 1 1 5 5 SER CA C 5 58.039 58.039 60.307 -2.268 18497
2477 1 8 . 1 1 5 5 SER CB C 5 63.797 63.797 63.449 0.348 18497
2478 1 8 . 1 1 5 5 SER H H 5 8.330 8.330 8.471 -0.141 18497
2479 1 8 . 1 1 6 6 TYR N N 6 122.027 122.027 121.167 0.860 18497
2480 1 8 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.786 -0.276 18497
2481 1 8 . 1 1 6 6 TYR C C 6 174.060 174.060 174.788 -0.728 18497
2482 1 8 . 1 1 6 6 TYR CA C 6 57.800 57.800 58.762 -0.962 18497
2483 1 8 . 1 1 6 6 TYR CB C 6 38.685 38.685 40.015 -1.330 18497
2484 1 8 . 1 1 6 6 TYR H H 6 8.201 8.201 7.968 0.233 18497
2485 1 8 . 1 1 7 7 ASP N N 7 122.439 122.439 116.975 5.464 18497
2486 1 8 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.586 -0.037 18497
2487 1 8 . 1 1 7 7 ASP C C 7 175.150 175.150 174.452 0.698 18497
2488 1 8 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.979 -0.339 18497
2489 1 8 . 1 1 7 7 ASP CB C 7 41.300 41.300 42.240 -0.941 18497
2490 1 8 . 1 1 7 7 ASP H H 7 8.119 8.119 7.642 0.477 18497
2491 1 8 . 1 1 8 8 ALA N N 8 124.655 124.655 127.060 -2.405 18497
2492 1 8 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.029 0.201 18497
2493 1 8 . 1 1 8 8 ALA C C 8 175.935 175.935 178.488 -2.553 18497
2494 1 8 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.070 -1.177 18497
2495 1 8 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.385 -0.535 18497
2496 1 8 . 1 1 8 8 ALA H H 8 8.235 8.235 7.917 0.318 18497
2497 1 8 . 1 1 9 9 ASN N N 9 116.133 116.133 116.786 -0.653 18497
2498 1 8 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.455 0.235 18497
2499 1 8 . 1 1 9 9 ASN C C 9 177.718 177.718 176.644 1.074 18497
2500 1 8 . 1 1 9 9 ASN CA C 9 53.800 53.800 55.254 -1.454 18497
2501 1 8 . 1 1 9 9 ASN CB C 9 38.770 38.770 38.642 0.128 18497
2502 1 8 . 1 1 9 9 ASN H H 9 8.417 8.417 7.933 0.484 18497
2503 1 8 . 1 1 10 10 VAL N N 10 119.557 119.557 118.082 1.475 18497
2504 1 8 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.036 0.141 18497
2505 1 8 . 1 1 10 10 VAL C C 10 174.930 174.930 174.055 0.875 18497
2506 1 8 . 1 1 10 10 VAL CA C 10 61.880 61.880 62.852 -0.973 18497
2507 1 8 . 1 1 10 10 VAL CB C 10 32.660 32.660 31.259 1.401 18497
2508 1 8 . 1 1 10 10 VAL H H 10 7.859 7.859 8.453 -0.594 18497
2509 1 8 . 1 1 11 11 ILE N N 11 126.561 126.561 118.089 8.472 18497
2510 1 8 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.116 -0.076 18497
2511 1 8 . 1 1 11 11 ILE C C 11 175.935 175.935 173.622 2.313 18497
2512 1 8 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.890 -0.390 18497
2513 1 8 . 1 1 11 11 ILE CB C 11 37.700 37.700 42.090 -4.390 18497
2514 1 8 . 1 1 11 11 ILE H H 11 8.283 8.283 7.011 1.272 18497
2515 1 8 . 1 1 12 12 ASP N N 12 128.161 128.161 123.430 4.731 18497
2516 1 8 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.980 -0.250 18497
2517 1 8 . 1 1 12 12 ASP C C 12 174.891 174.891 176.013 -1.122 18497
2518 1 8 . 1 1 12 12 ASP CA C 12 53.427 53.427 52.971 0.456 18497
2519 1 8 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.892 -0.672 18497
2520 1 8 . 1 1 12 12 ASP H H 12 8.477 8.477 8.553 -0.076 18497
2521 1 8 . 1 1 13 13 ASP N N 13 127.435 127.435 126.218 1.217 18497
2522 1 8 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.343 -0.027 18497
2523 1 8 . 1 1 13 13 ASP C C 13 175.369 175.369 177.718 -2.349 18497
2524 1 8 . 1 1 13 13 ASP CA C 13 57.600 57.600 56.704 0.896 18497
2525 1 8 . 1 1 13 13 ASP CB C 13 41.160 41.160 40.783 0.377 18497
2526 1 8 . 1 1 13 13 ASP H H 13 8.698 8.698 8.872 -0.174 18497
2527 1 8 . 1 1 14 14 GLU N N 14 119.796 119.796 119.948 -0.152 18497
2528 1 8 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.265 -0.230 18497
2529 1 8 . 1 1 14 14 GLU C C 14 178.588 178.588 178.408 0.180 18497
2530 1 8 . 1 1 14 14 GLU CA C 14 59.500 59.500 58.610 0.890 18497
2531 1 8 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.709 -0.809 18497
2532 1 8 . 1 1 14 14 GLU H H 14 8.205 8.205 8.822 -0.617 18497
2533 1 8 . 1 1 15 15 ALA N N 15 124.156 124.156 123.657 0.499 18497
2534 1 8 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.191 -0.015 18497
2535 1 8 . 1 1 15 15 ALA C C 15 179.502 179.502 179.773 -0.271 18497
2536 1 8 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.009 -0.009 18497
2537 1 8 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.329 0.571 18497
2538 1 8 . 1 1 15 15 ALA H H 15 8.473 8.473 7.725 0.748 18497
2539 1 8 . 1 1 16 16 VAL N N 16 117.585 117.585 117.862 -0.277 18497
2540 1 8 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.666 -0.132 18497
2541 1 8 . 1 1 16 16 VAL C C 16 179.545 179.545 177.871 1.674 18497
2542 1 8 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.331 0.670 18497
2543 1 8 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.381 0.218 18497
2544 1 8 . 1 1 16 16 VAL H H 16 8.181 8.181 8.812 -0.631 18497
2545 1 8 . 1 1 17 17 LYS N N 17 119.377 119.377 120.290 -0.913 18497
2546 1 8 . 1 1 17 17 LYS HA H 17 3.956 3.956 4.028 -0.072 18497
2547 1 8 . 1 1 17 17 LYS C C 17 178.197 178.197 178.450 -0.253 18497
2548 1 8 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.260 0.760 18497
2549 1 8 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.376 -0.246 18497
2550 1 8 . 1 1 17 17 LYS H H 17 8.001 8.001 7.522 0.479 18497
2551 1 8 . 1 1 18 18 GLU N N 18 120.395 120.395 119.895 0.500 18497
2552 1 8 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.110 0.030 18497
2553 1 8 . 1 1 18 18 GLU C C 18 178.849 178.849 178.878 -0.029 18497
2554 1 8 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.240 0.560 18497
2555 1 8 . 1 1 18 18 GLU CB C 18 29.493 29.493 30.034 -0.541 18497
2556 1 8 . 1 1 18 18 GLU H H 18 7.943 7.943 8.135 -0.192 18497
2557 1 8 . 1 1 19 19 VAL N N 19 121.088 121.088 119.645 1.443 18497
2558 1 8 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.868 -0.218 18497
2559 1 8 . 1 1 19 19 VAL C C 19 179.415 179.415 177.758 1.657 18497
2560 1 8 . 1 1 19 19 VAL CA C 19 67.980 67.980 65.424 2.556 18497
2561 1 8 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.218 0.383 18497
2562 1 8 . 1 1 19 19 VAL H H 19 8.335 8.335 8.679 -0.344 18497
2563 1 8 . 1 1 20 20 CYS N N 20 117.290 117.290 117.838 -0.548 18497
2564 1 8 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.550 0.130 18497
2565 1 8 . 1 1 20 20 CYS C C 20 178.110 178.110 175.844 2.266 18497
2566 1 8 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.046 1.154 18497
2567 1 8 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.616 -0.816 18497
2568 1 8 . 1 1 20 20 CYS H H 20 8.434 8.434 7.646 0.788 18497
2569 1 8 . 1 1 21 21 GLU N N 21 118.195 118.195 118.257 -0.062 18497
2570 1 8 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.215 -0.076 18497
2571 1 8 . 1 1 21 21 GLU C C 21 178.153 178.153 178.274 -0.121 18497
2572 1 8 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.252 1.498 18497
2573 1 8 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.434 0.066 18497
2574 1 8 . 1 1 21 21 GLU H H 21 7.972 7.972 7.811 0.161 18497
2575 1 8 . 1 1 22 22 LYS N N 22 119.095 119.095 119.118 -0.023 18497
2576 1 8 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.217 -0.212 18497
2577 1 8 . 1 1 22 22 LYS C C 22 179.371 179.371 177.486 1.885 18497
2578 1 8 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.031 0.669 18497
2579 1 8 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.860 0.060 18497
2580 1 8 . 1 1 22 22 LYS H H 22 8.071 8.071 8.319 -0.248 18497
2581 1 8 . 1 1 23 23 PHE N N 23 114.252 114.252 117.710 -3.458 18497
2582 1 8 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.688 -0.258 18497
2583 1 8 . 1 1 23 23 PHE C C 23 178.197 178.197 174.787 3.410 18497
2584 1 8 . 1 1 23 23 PHE CA C 23 58.430 58.430 57.806 0.624 18497
2585 1 8 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.187 -1.417 18497
2586 1 8 . 1 1 23 23 PHE H H 23 8.491 8.491 7.762 0.729 18497
2587 1 8 . 1 1 24 24 GLU N N 24 119.819 119.819 115.655 4.164 18497
2588 1 8 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.084 -0.014 18497
2589 1 8 . 1 1 24 24 GLU C C 24 177.457 177.457 175.716 1.741 18497
2590 1 8 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.489 -0.659 18497
2591 1 8 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.209 -0.409 18497
2592 1 8 . 1 1 24 24 GLU H H 24 7.867 7.867 8.502 -0.635 18497
2593 1 8 . 1 1 25 25 CYS N N 25 114.633 114.633 116.654 -2.021 18497
2594 1 8 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.810 0.577 18497
2595 1 8 . 1 1 25 25 CYS C C 25 174.760 174.760 174.652 0.108 18497
2596 1 8 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.144 -2.383 18497
2597 1 8 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.706 -0.106 18497
2598 1 8 . 1 1 25 25 CYS H H 25 8.156 8.156 7.670 0.486 18497
2599 1 8 . 1 1 26 26 THR N N 26 109.312 109.312 114.001 -4.689 18497
2600 1 8 . 1 1 26 26 THR HA H 26 4.770 4.770 4.662 0.108 18497
2601 1 8 . 1 1 26 26 THR C C 26 173.499 173.499 175.793 -2.294 18497
2602 1 8 . 1 1 26 26 THR CA C 26 60.723 60.723 61.435 -0.712 18497
2603 1 8 . 1 1 26 26 THR CB C 26 72.000 72.000 70.246 1.754 18497
2604 1 8 . 1 1 26 26 THR H H 26 8.460 8.460 9.177 -0.717 18497
2605 1 8 . 1 1 27 27 GLU N N 27 122.233 122.233 123.418 -1.185 18497
2606 1 8 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.886 -0.376 18497
2607 1 8 . 1 1 27 27 GLU C C 27 176.544 176.544 178.468 -1.924 18497
2608 1 8 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.438 0.112 18497
2609 1 8 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.474 -0.524 18497
2610 1 8 . 1 1 27 27 GLU H H 27 9.327 9.327 9.037 0.290 18497
2611 1 8 . 1 1 28 28 SER N N 28 112.925 112.925 113.751 -0.826 18497
2612 1 8 . 1 1 28 28 SER HA H 28 4.062 4.062 4.225 -0.163 18497
2613 1 8 . 1 1 28 28 SER C C 28 178.545 178.545 176.494 2.051 18497
2614 1 8 . 1 1 28 28 SER CA C 28 61.350 61.350 60.750 0.600 18497
2615 1 8 . 1 1 28 28 SER CB C 28 62.400 62.400 62.582 -0.182 18497
2616 1 8 . 1 1 28 28 SER H H 28 8.320 8.320 8.531 -0.211 18497
2617 1 8 . 1 1 29 29 GLU N N 29 121.736 121.736 123.029 -1.293 18497
2618 1 8 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.133 -0.143 18497
2619 1 8 . 1 1 29 29 GLU C C 29 176.674 176.674 178.703 -2.029 18497
2620 1 8 . 1 1 29 29 GLU CA C 29 59.750 59.750 59.058 0.692 18497
2621 1 8 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.715 -0.245 18497
2622 1 8 . 1 1 29 29 GLU H H 29 7.512 7.512 7.428 0.084 18497
2623 1 8 . 1 1 30 30 VAL N N 30 119.480 119.480 119.853 -0.373 18497
2624 1 8 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.712 -0.335 18497
2625 1 8 . 1 1 30 30 VAL C C 30 179.241 179.241 177.901 1.340 18497
2626 1 8 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.305 0.355 18497
2627 1 8 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.673 -0.603 18497
2628 1 8 . 1 1 30 30 VAL H H 30 7.492 7.492 7.820 -0.328 18497
2629 1 8 . 1 1 31 31 MET N N 31 117.220 117.220 118.518 -1.298 18497
2630 1 8 . 1 1 31 31 MET HA H 31 3.870 3.870 3.827 0.043 18497
2631 1 8 . 1 1 31 31 MET C C 31 177.936 177.936 178.060 -0.124 18497
2632 1 8 . 1 1 31 31 MET CA C 31 57.630 57.630 59.743 -2.113 18497
2633 1 8 . 1 1 31 31 MET CB C 31 30.270 30.270 32.221 -1.951 18497
2634 1 8 . 1 1 31 31 MET H H 31 8.302 8.302 8.649 -0.347 18497
2635 1 8 . 1 1 32 32 ASN N N 32 116.672 116.672 118.163 -1.491 18497
2636 1 8 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.493 -0.103 18497
2637 1 8 . 1 1 32 32 ASN C C 32 176.065 176.065 177.558 -1.493 18497
2638 1 8 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.714 -0.684 18497
2639 1 8 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.592 -0.882 18497
2640 1 8 . 1 1 32 32 ASN H H 32 8.313 8.313 7.933 0.380 18497
2641 1 8 . 1 1 33 33 SER N N 33 117.471 117.471 114.863 2.608 18497
2642 1 8 . 1 1 33 33 SER HA H 33 4.150 4.150 4.239 -0.089 18497
2643 1 8 . 1 1 33 33 SER C C 33 178.806 178.806 175.486 3.320 18497
2644 1 8 . 1 1 33 33 SER CA C 33 62.950 62.950 60.979 1.971 18497
2645 1 8 . 1 1 33 33 SER CB C 33 62.600 62.600 63.261 -0.661 18497
2646 1 8 . 1 1 33 33 SER H H 33 7.851 7.851 7.710 0.141 18497
2647 1 8 . 1 1 34 34 LEU N N 34 122.839 122.839 119.676 3.163 18497
2648 1 8 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.214 -0.335 18497
2649 1 8 . 1 1 34 34 LEU C C 34 177.892 177.892 177.000 0.892 18497
2650 1 8 . 1 1 34 34 LEU CA C 34 57.630 57.630 55.746 1.883 18497
2651 1 8 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.448 -1.648 18497
2652 1 8 . 1 1 34 34 LEU H H 34 8.128 8.128 7.433 0.695 18497
2653 1 8 . 1 1 35 35 TYR N N 35 116.666 116.666 118.935 -2.269 18497
2654 1 8 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.460 0.150 18497
2655 1 8 . 1 1 35 35 TYR C C 35 179.067 179.067 175.749 3.318 18497
2656 1 8 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.851 -1.961 18497
2657 1 8 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.280 -3.570 18497
2658 1 8 . 1 1 35 35 TYR H H 35 7.924 7.924 7.867 0.057 18497
2659 1 8 . 1 1 36 36 SER N N 36 114.801 114.801 110.653 4.148 18497
2660 1 8 . 1 1 36 36 SER HA H 36 4.080 4.080 4.220 -0.140 18497
2661 1 8 . 1 1 36 36 SER C C 36 177.283 177.283 175.405 1.878 18497
2662 1 8 . 1 1 36 36 SER CA C 36 60.519 60.519 57.985 2.534 18497
2663 1 8 . 1 1 36 36 SER CB C 36 64.240 64.240 65.678 -1.438 18497
2664 1 8 . 1 1 36 36 SER H H 36 7.715 7.715 8.201 -0.486 18497
2665 1 8 . 1 1 37 37 GLY N N 37 109.803 109.803 111.176 -1.373 18497
2666 1 8 . 1 1 37 37 GLY C C 37 175.978 175.978 173.215 2.763 18497
2667 1 8 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.705 0.973 18497
2668 1 8 . 1 1 37 37 GLY H H 37 8.017 8.017 7.856 0.161 18497
2669 1 8 . 1 1 38 38 ASP N N 38 120.613 120.613 120.020 0.593 18497
2670 1 8 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.703 0.322 18497
2671 1 8 . 1 1 38 38 ASP C C 38 173.368 173.368 176.682 -3.314 18497
2672 1 8 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.968 -1.248 18497
2673 1 8 . 1 1 38 38 ASP CB C 38 41.420 41.420 41.986 -0.566 18497
2674 1 8 . 1 1 38 38 ASP H H 38 8.006 8.006 8.299 -0.293 18497
2675 1 8 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.491 -0.151 18497
2676 1 8 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.950 -0.200 18497
2677 1 8 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.108 0.022 18497
2678 1 8 . 1 1 40 40 GLN N N 40 115.056 115.056 116.252 -1.196 18497
2679 1 8 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.460 -0.180 18497
2680 1 8 . 1 1 40 40 GLN C C 40 177.066 177.066 175.986 1.080 18497
2681 1 8 . 1 1 40 40 GLN CA C 40 54.710 54.710 54.795 -0.085 18497
2682 1 8 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.921 -0.241 18497
2683 1 8 . 1 1 40 40 GLN H H 40 8.237 8.237 8.228 0.009 18497
2684 1 8 . 1 1 41 41 ASP N N 41 122.839 122.839 121.933 0.906 18497
2685 1 8 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.524 -0.211 18497
2686 1 8 . 1 1 41 41 ASP C C 41 175.804 175.804 177.391 -1.587 18497
2687 1 8 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.749 0.491 18497
2688 1 8 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.867 -0.646 18497
2689 1 8 . 1 1 41 41 ASP H H 41 7.211 7.211 7.713 -0.502 18497
2690 1 8 . 1 1 42 42 GLN N N 42 124.547 124.547 123.928 0.619 18497
2691 1 8 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.016 -0.156 18497
2692 1 8 . 1 1 42 42 GLN C C 42 177.196 177.196 177.089 0.107 18497
2693 1 8 . 1 1 42 42 GLN CA C 42 59.220 59.220 58.813 0.407 18497
2694 1 8 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.709 -0.309 18497
2695 1 8 . 1 1 42 42 GLN H H 42 8.719 8.719 8.726 -0.007 18497
2696 1 8 . 1 1 43 43 LEU N N 43 118.960 118.960 119.506 -0.546 18497
2697 1 8 . 1 1 43 43 LEU HA H 43 3.685 3.685 4.007 -0.322 18497
2698 1 8 . 1 1 43 43 LEU C C 43 178.066 178.066 178.578 -0.512 18497
2699 1 8 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.579 0.781 18497
2700 1 8 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.543 -1.153 18497
2701 1 8 . 1 1 43 43 LEU H H 43 8.206 8.206 8.525 -0.319 18497
2702 1 8 . 1 1 44 44 ALA N N 44 121.666 121.666 122.903 -1.237 18497
2703 1 8 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.098 -0.219 18497
2704 1 8 . 1 1 44 44 ALA C C 44 178.327 178.327 179.667 -1.340 18497
2705 1 8 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.983 -0.272 18497
2706 1 8 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.206 0.374 18497
2707 1 8 . 1 1 44 44 ALA H H 44 7.402 7.402 7.666 -0.264 18497
2708 1 8 . 1 1 45 45 VAL N N 45 118.589 118.589 119.515 -0.926 18497
2709 1 8 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.530 0.130 18497
2710 1 8 . 1 1 45 45 VAL C C 45 179.893 179.893 177.660 2.233 18497
2711 1 8 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.807 -0.407 18497
2712 1 8 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.581 0.550 18497
2713 1 8 . 1 1 45 45 VAL H H 45 8.449 8.449 8.584 -0.135 18497
2714 1 8 . 1 1 46 46 ALA N N 46 121.006 121.006 122.606 -1.600 18497
2715 1 8 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.662 0.468 18497
2716 1 8 . 1 1 46 46 ALA C C 46 179.110 179.110 179.035 0.075 18497
2717 1 8 . 1 1 46 46 ALA CA C 46 54.970 54.970 54.968 0.002 18497
2718 1 8 . 1 1 46 46 ALA CB C 46 19.110 19.110 16.991 2.119 18497
2719 1 8 . 1 1 46 46 ALA H H 46 7.654 7.654 7.848 -0.194 18497
2720 1 8 . 1 1 47 47 TYR N N 47 119.140 119.140 119.936 -0.796 18497
2721 1 8 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.967 -0.217 18497
2722 1 8 . 1 1 47 47 TYR C C 47 179.328 179.328 177.379 1.949 18497
2723 1 8 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.625 0.255 18497
2724 1 8 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.286 0.214 18497
2725 1 8 . 1 1 47 47 TYR H H 47 8.077 8.077 8.024 0.053 18497
2726 1 8 . 1 1 48 48 HIS N N 48 116.422 116.422 118.853 -2.431 18497
2727 1 8 . 1 1 48 48 HIS HA H 48 4.100 4.100 3.987 0.113 18497
2728 1 8 . 1 1 48 48 HIS C C 48 178.023 178.023 177.624 0.399 18497
2729 1 8 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.866 0.154 18497
2730 1 8 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.013 -1.073 18497
2731 1 8 . 1 1 48 48 HIS H H 48 8.326 8.326 8.395 -0.069 18497
2732 1 8 . 1 1 49 49 LEU N N 49 120.974 120.974 120.384 0.590 18497
2733 1 8 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.302 -0.147 18497
2734 1 8 . 1 1 49 49 LEU C C 49 177.417 177.417 179.615 -2.198 18497
2735 1 8 . 1 1 49 49 LEU CA C 49 57.890 57.890 57.908 -0.018 18497
2736 1 8 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.524 0.436 18497
2737 1 8 . 1 1 49 49 LEU H H 49 8.237 8.237 8.510 -0.273 18497
2738 1 8 . 1 1 50 50 ILE N N 50 119.715 119.715 120.033 -0.318 18497
2739 1 8 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.607 0.013 18497
2740 1 8 . 1 1 50 50 ILE C C 50 179.502 179.502 178.060 1.442 18497
2741 1 8 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.588 -0.528 18497
2742 1 8 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.836 0.134 18497
2743 1 8 . 1 1 50 50 ILE H H 50 7.543 7.543 8.063 -0.520 18497
2744 1 8 . 1 1 51 51 ILE N N 51 117.995 117.995 121.712 -3.717 18497
2745 1 8 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.459 0.080 18497
2746 1 8 . 1 1 51 51 ILE C C 51 179.197 179.197 177.801 1.396 18497
2747 1 8 . 1 1 51 51 ILE CA C 51 63.740 63.740 64.413 -0.673 18497
2748 1 8 . 1 1 51 51 ILE CB C 51 36.650 36.650 36.101 0.549 18497
2749 1 8 . 1 1 51 51 ILE H H 51 7.475 7.475 8.282 -0.807 18497
2750 1 8 . 1 1 52 52 ASP N N 52 121.642 121.642 120.184 1.458 18497
2751 1 8 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.298 0.142 18497
2752 1 8 . 1 1 52 52 ASP C C 52 179.197 179.197 179.197 0.000 18497
2753 1 8 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.575 -0.475 18497
2754 1 8 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.135 0.165 18497
2755 1 8 . 1 1 52 52 ASP H H 52 8.559 8.559 8.490 0.069 18497
2756 1 8 . 1 1 53 53 ASN N N 53 117.131 117.131 119.014 -1.883 18497
2757 1 8 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.484 0.126 18497
2758 1 8 . 1 1 53 53 ASN C C 53 178.545 178.545 177.322 1.223 18497
2759 1 8 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.188 -1.488 18497
2760 1 8 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.708 -0.008 18497
2761 1 8 . 1 1 53 53 ASN H H 53 8.106 8.106 8.195 -0.089 18497
2762 1 8 . 1 1 54 54 ARG N N 54 119.929 119.929 119.688 0.241 18497
2763 1 8 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.998 0.122 18497
2764 1 8 . 1 1 54 54 ARG C C 54 176.892 176.892 178.635 -1.743 18497
2765 1 8 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.708 -0.548 18497
2766 1 8 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.242 0.028 18497
2767 1 8 . 1 1 54 54 ARG H H 54 7.797 7.797 8.200 -0.403 18497
2768 1 8 . 1 1 55 55 ARG N N 55 119.227 119.227 116.643 2.584 18497
2769 1 8 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.302 -0.128 18497
2770 1 8 . 1 1 55 55 ARG C C 55 175.108 175.108 177.705 -2.597 18497
2771 1 8 . 1 1 55 55 ARG CA C 55 61.880 61.880 57.944 3.936 18497
2772 1 8 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.323 1.337 18497
2773 1 8 . 1 1 55 55 ARG H H 55 7.857 7.857 8.279 -0.422 18497
2774 1 8 . 1 1 56 56 ILE N N 56 116.676 116.676 117.911 -1.235 18497
2775 1 8 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.179 -0.169 18497
2776 1 8 . 1 1 56 56 ILE C C 56 176.065 176.065 176.797 -0.732 18497
2777 1 8 . 1 1 56 56 ILE CA C 56 62.140 62.140 61.374 0.766 18497
2778 1 8 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.896 -0.656 18497
2779 1 8 . 1 1 56 56 ILE H H 56 8.317 8.317 7.832 0.485 18497
2780 1 8 . 1 1 57 57 MET N N 57 122.058 122.058 115.744 6.314 18497
2781 1 8 . 1 1 57 57 MET HA H 57 4.420 4.420 4.242 0.178 18497
2782 1 8 . 1 1 57 57 MET C C 57 177.283 177.283 174.074 3.209 18497
2783 1 8 . 1 1 57 57 MET CA C 57 56.030 56.030 56.699 -0.669 18497
2784 1 8 . 1 1 57 57 MET CB C 57 32.515 32.515 32.422 0.093 18497
2785 1 8 . 1 1 57 57 MET H H 57 8.177 8.177 8.101 0.076 18497
2786 1 8 . 1 1 58 58 ASN N N 58 118.892 118.892 115.767 3.125 18497
2787 1 8 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.898 -0.208 18497
2788 1 8 . 1 1 58 58 ASN C C 58 176.500 176.500 172.930 3.570 18497
2789 1 8 . 1 1 58 58 ASN CA C 58 53.653 53.653 52.368 1.284 18497
2790 1 8 . 1 1 58 58 ASN CB C 58 38.770 38.770 40.561 -1.791 18497
2791 1 8 . 1 1 58 58 ASN H H 58 8.238 8.238 7.660 0.578 18497
2792 1 8 . 1 1 59 59 GLN N N 59 120.456 120.456 117.601 2.855 18497
2793 1 8 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.284 0.026 18497
2794 1 8 . 1 1 59 59 GLN C C 59 175.326 175.326 176.213 -0.887 18497
2795 1 8 . 1 1 59 59 GLN CA C 59 56.030 56.030 56.098 -0.068 18497
2796 1 8 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.279 -0.479 18497
2797 1 8 . 1 1 59 59 GLN H H 59 8.196 8.196 8.414 -0.218 18497
2798 1 8 . 1 1 60 60 ALA N N 60 125.116 125.116 126.102 -0.986 18497
2799 1 8 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.226 0.156 18497
2800 1 8 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.018 -0.718 18497
2801 1 8 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.159 -0.049 18497
2802 1 8 . 1 1 60 60 ALA H H 60 8.293 8.293 8.785 -0.492 18497
2803 1 8 . 1 1 61 61 SER N N 61 115.686 115.686 111.612 4.074 18497
2804 1 8 . 1 1 61 61 SER HA H 61 4.470 4.470 4.559 -0.089 18497
2805 1 8 . 1 1 61 61 SER C C 61 175.674 175.674 172.838 2.836 18497
2806 1 8 . 1 1 61 61 SER CA C 61 58.160 58.160 57.389 0.771 18497
2807 1 8 . 1 1 61 61 SER CB C 61 63.740 63.740 64.369 -0.629 18497
2808 1 8 . 1 1 61 61 SER H H 61 8.290 8.290 7.783 0.507 18497
2809 1 9 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.519 -0.089 18497
2810 1 9 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.567 -0.620 18497
2811 1 9 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.352 -0.222 18497
2812 1 9 . 1 1 3 3 HIS N N 3 119.985 119.985 119.226 0.759 18497
2813 1 9 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.659 -0.053 18497
2814 1 9 . 1 1 3 3 HIS C C 3 176.587 176.587 176.886 -0.299 18497
2815 1 9 . 1 1 3 3 HIS CA C 3 56.185 56.185 58.038 -1.853 18497
2816 1 9 . 1 1 3 3 HIS CB C 3 30.471 30.471 29.570 0.901 18497
2817 1 9 . 1 1 3 3 HIS H H 3 8.526 8.526 8.714 -0.188 18497
2818 1 9 . 1 1 4 4 MET N N 4 122.338 122.338 117.617 4.721 18497
2819 1 9 . 1 1 4 4 MET HA H 4 4.448 4.448 4.382 0.066 18497
2820 1 9 . 1 1 4 4 MET C C 4 175.108 175.108 176.880 -1.772 18497
2821 1 9 . 1 1 4 4 MET CA C 4 55.562 55.562 58.235 -2.673 18497
2822 1 9 . 1 1 4 4 MET CB C 4 33.141 33.141 32.157 0.984 18497
2823 1 9 . 1 1 4 4 MET H H 4 8.337 8.337 7.645 0.692 18497
2824 1 9 . 1 1 5 5 SER N N 5 116.990 116.990 113.789 3.201 18497
2825 1 9 . 1 1 5 5 SER HA H 5 4.400 4.400 4.148 0.252 18497
2826 1 9 . 1 1 5 5 SER C C 5 177.979 177.979 174.898 3.081 18497
2827 1 9 . 1 1 5 5 SER CA C 5 58.039 58.039 60.684 -2.645 18497
2828 1 9 . 1 1 5 5 SER CB C 5 63.797 63.797 62.896 0.901 18497
2829 1 9 . 1 1 5 5 SER H H 5 8.330 8.330 7.917 0.413 18497
2830 1 9 . 1 1 6 6 TYR N N 6 122.027 122.027 117.597 4.430 18497
2831 1 9 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.736 -0.226 18497
2832 1 9 . 1 1 6 6 TYR C C 6 174.060 174.060 175.659 -1.599 18497
2833 1 9 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.927 -0.127 18497
2834 1 9 . 1 1 6 6 TYR CB C 6 38.685 38.685 40.104 -1.419 18497
2835 1 9 . 1 1 6 6 TYR H H 6 8.201 8.201 7.773 0.428 18497
2836 1 9 . 1 1 7 7 ASP N N 7 122.439 122.439 121.498 0.941 18497
2837 1 9 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.719 -0.170 18497
2838 1 9 . 1 1 7 7 ASP C C 7 175.150 175.150 177.547 -2.397 18497
2839 1 9 . 1 1 7 7 ASP CA C 7 53.640 53.640 54.454 -0.814 18497
2840 1 9 . 1 1 7 7 ASP CB C 7 41.300 41.300 43.118 -1.818 18497
2841 1 9 . 1 1 7 7 ASP H H 7 8.119 8.119 8.272 -0.153 18497
2842 1 9 . 1 1 8 8 ALA N N 8 124.655 124.655 126.800 -2.145 18497
2843 1 9 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.161 0.069 18497
2844 1 9 . 1 1 8 8 ALA C C 8 175.935 175.935 177.963 -2.028 18497
2845 1 9 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.572 -1.679 18497
2846 1 9 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.763 0.087 18497
2847 1 9 . 1 1 8 8 ALA H H 8 8.235 8.235 8.636 -0.401 18497
2848 1 9 . 1 1 9 9 ASN N N 9 116.133 116.133 115.489 0.644 18497
2849 1 9 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.605 0.085 18497
2850 1 9 . 1 1 9 9 ASN C C 9 177.718 177.718 176.475 1.243 18497
2851 1 9 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.877 -0.077 18497
2852 1 9 . 1 1 9 9 ASN CB C 9 38.770 38.770 38.403 0.367 18497
2853 1 9 . 1 1 9 9 ASN H H 9 8.417 8.417 8.122 0.295 18497
2854 1 9 . 1 1 10 10 VAL N N 10 119.557 119.557 120.593 -1.036 18497
2855 1 9 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.825 0.352 18497
2856 1 9 . 1 1 10 10 VAL C C 10 174.930 174.930 174.817 0.113 18497
2857 1 9 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.687 -1.807 18497
2858 1 9 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.519 0.141 18497
2859 1 9 . 1 1 10 10 VAL H H 10 7.859 7.859 7.719 0.140 18497
2860 1 9 . 1 1 11 11 ILE N N 11 126.561 126.561 127.226 -0.665 18497
2861 1 9 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.150 -0.110 18497
2862 1 9 . 1 1 11 11 ILE C C 11 175.935 175.935 173.694 2.241 18497
2863 1 9 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.687 -0.187 18497
2864 1 9 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.690 -3.990 18497
2865 1 9 . 1 1 11 11 ILE H H 11 8.283 8.283 8.237 0.046 18497
2866 1 9 . 1 1 12 12 ASP N N 12 128.161 128.161 123.120 5.041 18497
2867 1 9 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.938 -0.208 18497
2868 1 9 . 1 1 12 12 ASP C C 12 174.891 174.891 175.557 -0.666 18497
2869 1 9 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.644 -0.217 18497
2870 1 9 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.720 -0.500 18497
2871 1 9 . 1 1 12 12 ASP H H 12 8.477 8.477 8.463 0.014 18497
2872 1 9 . 1 1 13 13 ASP N N 13 127.435 127.435 125.686 1.749 18497
2873 1 9 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.365 -0.049 18497
2874 1 9 . 1 1 13 13 ASP C C 13 175.369 175.369 177.581 -2.212 18497
2875 1 9 . 1 1 13 13 ASP CA C 13 57.600 57.600 56.917 0.683 18497
2876 1 9 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.211 -0.050 18497
2877 1 9 . 1 1 13 13 ASP H H 13 8.698 8.698 8.887 -0.189 18497
2878 1 9 . 1 1 14 14 GLU N N 14 119.796 119.796 119.032 0.764 18497
2879 1 9 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.037 -0.002 18497
2880 1 9 . 1 1 14 14 GLU C C 14 178.588 178.588 178.622 -0.034 18497
2881 1 9 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.177 0.323 18497
2882 1 9 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.283 -0.383 18497
2883 1 9 . 1 1 14 14 GLU H H 14 8.205 8.205 8.717 -0.512 18497
2884 1 9 . 1 1 15 15 ALA N N 15 124.156 124.156 122.951 1.205 18497
2885 1 9 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.160 0.016 18497
2886 1 9 . 1 1 15 15 ALA C C 15 179.502 179.502 179.837 -0.335 18497
2887 1 9 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.042 -0.042 18497
2888 1 9 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.306 0.594 18497
2889 1 9 . 1 1 15 15 ALA H H 15 8.473 8.473 7.720 0.753 18497
2890 1 9 . 1 1 16 16 VAL N N 16 117.585 117.585 119.342 -1.757 18497
2891 1 9 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.520 0.014 18497
2892 1 9 . 1 1 16 16 VAL C C 16 179.545 179.545 177.906 1.639 18497
2893 1 9 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.298 0.702 18497
2894 1 9 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.465 0.135 18497
2895 1 9 . 1 1 16 16 VAL H H 16 8.181 8.181 8.725 -0.544 18497
2896 1 9 . 1 1 17 17 LYS N N 17 119.377 119.377 119.794 -0.417 18497
2897 1 9 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.914 0.042 18497
2898 1 9 . 1 1 17 17 LYS C C 17 178.197 178.197 178.990 -0.793 18497
2899 1 9 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.769 0.251 18497
2900 1 9 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.302 -0.172 18497
2901 1 9 . 1 1 17 17 LYS H H 17 8.001 8.001 8.043 -0.042 18497
2902 1 9 . 1 1 18 18 GLU N N 18 120.395 120.395 119.081 1.314 18497
2903 1 9 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.102 0.038 18497
2904 1 9 . 1 1 18 18 GLU C C 18 178.849 178.849 179.168 -0.319 18497
2905 1 9 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.214 0.586 18497
2906 1 9 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.584 -0.091 18497
2907 1 9 . 1 1 18 18 GLU H H 18 7.943 7.943 8.059 -0.116 18497
2908 1 9 . 1 1 19 19 VAL N N 19 121.088 121.088 120.339 0.749 18497
2909 1 9 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.789 -0.139 18497
2910 1 9 . 1 1 19 19 VAL C C 19 179.415 179.415 178.643 0.772 18497
2911 1 9 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.761 1.219 18497
2912 1 9 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.303 0.297 18497
2913 1 9 . 1 1 19 19 VAL H H 19 8.335 8.335 8.843 -0.508 18497
2914 1 9 . 1 1 20 20 CYS N N 20 117.290 117.290 118.433 -1.143 18497
2915 1 9 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.439 0.241 18497
2916 1 9 . 1 1 20 20 CYS C C 20 178.110 178.110 176.283 1.827 18497
2917 1 9 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.410 0.790 18497
2918 1 9 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.203 -0.403 18497
2919 1 9 . 1 1 20 20 CYS H H 20 8.434 8.434 8.183 0.251 18497
2920 1 9 . 1 1 21 21 GLU N N 21 118.195 118.195 119.445 -1.250 18497
2921 1 9 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.219 -0.080 18497
2922 1 9 . 1 1 21 21 GLU C C 21 178.153 178.153 178.468 -0.315 18497
2923 1 9 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.591 1.159 18497
2924 1 9 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.772 -0.272 18497
2925 1 9 . 1 1 21 21 GLU H H 21 7.972 7.972 7.608 0.364 18497
2926 1 9 . 1 1 22 22 LYS N N 22 119.095 119.095 119.199 -0.104 18497
2927 1 9 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.201 -0.196 18497
2928 1 9 . 1 1 22 22 LYS C C 22 179.371 179.371 177.949 1.422 18497
2929 1 9 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.432 0.268 18497
2930 1 9 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.661 0.259 18497
2931 1 9 . 1 1 22 22 LYS H H 22 8.071 8.071 8.348 -0.277 18497
2932 1 9 . 1 1 23 23 PHE N N 23 114.252 114.252 117.482 -3.230 18497
2933 1 9 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.692 -0.262 18497
2934 1 9 . 1 1 23 23 PHE C C 23 178.197 178.197 174.686 3.511 18497
2935 1 9 . 1 1 23 23 PHE CA C 23 58.430 58.430 57.640 0.790 18497
2936 1 9 . 1 1 23 23 PHE CB C 23 38.770 38.770 39.917 -1.147 18497
2937 1 9 . 1 1 23 23 PHE H H 23 8.491 8.491 7.910 0.581 18497
2938 1 9 . 1 1 24 24 GLU N N 24 119.819 119.819 116.162 3.657 18497
2939 1 9 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.077 -0.007 18497
2940 1 9 . 1 1 24 24 GLU C C 24 177.457 177.457 175.847 1.610 18497
2941 1 9 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.367 -0.537 18497
2942 1 9 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.376 -0.576 18497
2943 1 9 . 1 1 24 24 GLU H H 24 7.867 7.867 8.168 -0.301 18497
2944 1 9 . 1 1 25 25 CYS N N 25 114.633 114.633 117.013 -2.380 18497
2945 1 9 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.758 0.629 18497
2946 1 9 . 1 1 25 25 CYS C C 25 174.760 174.760 174.640 0.120 18497
2947 1 9 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.562 -2.801 18497
2948 1 9 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.231 0.369 18497
2949 1 9 . 1 1 25 25 CYS H H 25 8.156 8.156 7.755 0.401 18497
2950 1 9 . 1 1 26 26 THR N N 26 109.312 109.312 114.386 -5.074 18497
2951 1 9 . 1 1 26 26 THR HA H 26 4.770 4.770 4.551 0.219 18497
2952 1 9 . 1 1 26 26 THR C C 26 173.499 173.499 175.719 -2.220 18497
2953 1 9 . 1 1 26 26 THR CA C 26 60.723 60.723 61.938 -1.215 18497
2954 1 9 . 1 1 26 26 THR CB C 26 72.000 72.000 70.026 1.974 18497
2955 1 9 . 1 1 26 26 THR H H 26 8.460 8.460 9.153 -0.693 18497
2956 1 9 . 1 1 27 27 GLU N N 27 122.233 122.233 124.317 -2.084 18497
2957 1 9 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.910 -0.400 18497
2958 1 9 . 1 1 27 27 GLU C C 27 176.544 176.544 178.345 -1.801 18497
2959 1 9 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.558 -0.008 18497
2960 1 9 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.248 -0.298 18497
2961 1 9 . 1 1 27 27 GLU H H 27 9.327 9.327 9.026 0.301 18497
2962 1 9 . 1 1 28 28 SER N N 28 112.925 112.925 114.668 -1.743 18497
2963 1 9 . 1 1 28 28 SER HA H 28 4.062 4.062 4.147 -0.085 18497
2964 1 9 . 1 1 28 28 SER C C 28 178.545 178.545 176.409 2.136 18497
2965 1 9 . 1 1 28 28 SER CA C 28 61.350 61.350 61.013 0.337 18497
2966 1 9 . 1 1 28 28 SER CB C 28 62.400 62.400 62.735 -0.335 18497
2967 1 9 . 1 1 28 28 SER H H 28 8.320 8.320 8.507 -0.187 18497
2968 1 9 . 1 1 29 29 GLU N N 29 121.736 121.736 121.178 0.558 18497
2969 1 9 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.104 -0.114 18497
2970 1 9 . 1 1 29 29 GLU C C 29 176.674 176.674 178.330 -1.656 18497
2971 1 9 . 1 1 29 29 GLU CA C 29 59.750 59.750 59.139 0.611 18497
2972 1 9 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.570 -0.100 18497
2973 1 9 . 1 1 29 29 GLU H H 29 7.512 7.512 7.699 -0.187 18497
2974 1 9 . 1 1 30 30 VAL N N 30 119.480 119.480 119.365 0.115 18497
2975 1 9 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.698 -0.321 18497
2976 1 9 . 1 1 30 30 VAL C C 30 179.241 179.241 177.755 1.486 18497
2977 1 9 . 1 1 30 30 VAL CA C 30 66.660 66.660 65.760 0.900 18497
2978 1 9 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.345 -0.275 18497
2979 1 9 . 1 1 30 30 VAL H H 30 7.492 7.492 7.577 -0.085 18497
2980 1 9 . 1 1 31 31 MET N N 31 117.220 117.220 118.125 -0.905 18497
2981 1 9 . 1 1 31 31 MET HA H 31 3.870 3.870 3.875 -0.005 18497
2982 1 9 . 1 1 31 31 MET C C 31 177.936 177.936 178.154 -0.218 18497
2983 1 9 . 1 1 31 31 MET CA C 31 57.630 57.630 59.394 -1.764 18497
2984 1 9 . 1 1 31 31 MET CB C 31 30.270 30.270 32.264 -1.994 18497
2985 1 9 . 1 1 31 31 MET H H 31 8.302 8.302 8.064 0.238 18497
2986 1 9 . 1 1 32 32 ASN N N 32 116.672 116.672 118.698 -2.026 18497
2987 1 9 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.439 -0.049 18497
2988 1 9 . 1 1 32 32 ASN C C 32 176.065 176.065 177.723 -1.658 18497
2989 1 9 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.662 -0.632 18497
2990 1 9 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.662 -0.952 18497
2991 1 9 . 1 1 32 32 ASN H H 32 8.313 8.313 8.370 -0.057 18497
2992 1 9 . 1 1 33 33 SER N N 33 117.471 117.471 114.241 3.230 18497
2993 1 9 . 1 1 33 33 SER HA H 33 4.150 4.150 4.288 -0.138 18497
2994 1 9 . 1 1 33 33 SER C C 33 178.806 178.806 175.603 3.203 18497
2995 1 9 . 1 1 33 33 SER CA C 33 62.950 62.950 60.786 2.164 18497
2996 1 9 . 1 1 33 33 SER CB C 33 62.600 62.600 63.373 -0.773 18497
2997 1 9 . 1 1 33 33 SER H H 33 7.851 7.851 7.700 0.151 18497
2998 1 9 . 1 1 34 34 LEU N N 34 122.839 122.839 119.533 3.306 18497
2999 1 9 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.325 -0.446 18497
3000 1 9 . 1 1 34 34 LEU C C 34 177.892 177.892 177.597 0.295 18497
3001 1 9 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.112 1.518 18497
3002 1 9 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.583 -1.783 18497
3003 1 9 . 1 1 34 34 LEU H H 34 8.128 8.128 7.432 0.696 18497
3004 1 9 . 1 1 35 35 TYR N N 35 116.666 116.666 119.940 -3.274 18497
3005 1 9 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.384 0.226 18497
3006 1 9 . 1 1 35 35 TYR C C 35 179.067 179.067 176.369 2.698 18497
3007 1 9 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.741 -2.851 18497
3008 1 9 . 1 1 35 35 TYR CB C 35 37.710 37.710 40.512 -2.802 18497
3009 1 9 . 1 1 35 35 TYR H H 35 7.924 7.924 8.095 -0.171 18497
3010 1 9 . 1 1 36 36 SER N N 36 114.801 114.801 110.500 4.301 18497
3011 1 9 . 1 1 36 36 SER HA H 36 4.080 4.080 4.523 -0.443 18497
3012 1 9 . 1 1 36 36 SER C C 36 177.283 177.283 175.526 1.757 18497
3013 1 9 . 1 1 36 36 SER CA C 36 60.519 60.519 58.090 2.429 18497
3014 1 9 . 1 1 36 36 SER CB C 36 64.240 64.240 65.851 -1.611 18497
3015 1 9 . 1 1 36 36 SER H H 36 7.715 7.715 8.625 -0.910 18497
3016 1 9 . 1 1 37 37 GLY N N 37 109.803 109.803 111.937 -2.134 18497
3017 1 9 . 1 1 37 37 GLY C C 37 175.978 175.978 172.720 3.258 18497
3018 1 9 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.148 0.530 18497
3019 1 9 . 1 1 37 37 GLY H H 37 8.017 8.017 7.960 0.057 18497
3020 1 9 . 1 1 38 38 ASP N N 38 120.613 120.613 118.787 1.826 18497
3021 1 9 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.009 0.016 18497
3022 1 9 . 1 1 38 38 ASP C C 38 173.368 173.368 174.704 -1.336 18497
3023 1 9 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.823 -1.103 18497
3024 1 9 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.062 -1.641 18497
3025 1 9 . 1 1 38 38 ASP H H 38 8.006 8.006 8.095 -0.089 18497
3026 1 9 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.330 0.010 18497
3027 1 9 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.343 -0.593 18497
3028 1 9 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.084 0.046 18497
3029 1 9 . 1 1 40 40 GLN N N 40 115.056 115.056 114.479 0.577 18497
3030 1 9 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.339 -0.059 18497
3031 1 9 . 1 1 40 40 GLN C C 40 177.066 177.066 176.458 0.608 18497
3032 1 9 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.184 -0.474 18497
3033 1 9 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.760 -0.080 18497
3034 1 9 . 1 1 40 40 GLN H H 40 8.237 8.237 8.309 -0.072 18497
3035 1 9 . 1 1 41 41 ASP N N 41 122.839 122.839 121.843 0.996 18497
3036 1 9 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.612 -0.299 18497
3037 1 9 . 1 1 41 41 ASP C C 41 175.804 175.804 177.241 -1.437 18497
3038 1 9 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.198 1.042 18497
3039 1 9 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.791 -0.571 18497
3040 1 9 . 1 1 41 41 ASP H H 41 7.211 7.211 7.793 -0.582 18497
3041 1 9 . 1 1 42 42 GLN N N 42 124.547 124.547 122.665 1.882 18497
3042 1 9 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.017 -0.157 18497
3043 1 9 . 1 1 42 42 GLN C C 42 177.196 177.196 177.899 -0.703 18497
3044 1 9 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.353 -0.133 18497
3045 1 9 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.057 -0.657 18497
3046 1 9 . 1 1 42 42 GLN H H 42 8.719 8.719 8.822 -0.103 18497
3047 1 9 . 1 1 43 43 LEU N N 43 118.960 118.960 118.979 -0.019 18497
3048 1 9 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.999 -0.314 18497
3049 1 9 . 1 1 43 43 LEU C C 43 178.066 178.066 178.427 -0.361 18497
3050 1 9 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.543 -0.183 18497
3051 1 9 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.657 -1.267 18497
3052 1 9 . 1 1 43 43 LEU H H 43 8.206 8.206 8.451 -0.245 18497
3053 1 9 . 1 1 44 44 ALA N N 44 121.666 121.666 122.658 -0.992 18497
3054 1 9 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.143 -0.264 18497
3055 1 9 . 1 1 44 44 ALA C C 44 178.327 178.327 179.681 -1.354 18497
3056 1 9 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.907 -0.197 18497
3057 1 9 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.211 0.369 18497
3058 1 9 . 1 1 44 44 ALA H H 44 7.402 7.402 7.613 -0.211 18497
3059 1 9 . 1 1 45 45 VAL N N 45 118.589 118.589 119.905 -1.316 18497
3060 1 9 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.525 0.135 18497
3061 1 9 . 1 1 45 45 VAL C C 45 179.893 179.893 177.746 2.147 18497
3062 1 9 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.878 -0.478 18497
3063 1 9 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.568 0.563 18497
3064 1 9 . 1 1 45 45 VAL H H 45 8.449 8.449 8.562 -0.113 18497
3065 1 9 . 1 1 46 46 ALA N N 46 121.006 121.006 122.412 -1.406 18497
3066 1 9 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.675 0.455 18497
3067 1 9 . 1 1 46 46 ALA C C 46 179.110 179.110 178.981 0.129 18497
3068 1 9 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.021 -0.051 18497
3069 1 9 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.111 1.999 18497
3070 1 9 . 1 1 46 46 ALA H H 46 7.654 7.654 7.977 -0.323 18497
3071 1 9 . 1 1 47 47 TYR N N 47 119.140 119.140 119.953 -0.813 18497
3072 1 9 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.967 -0.217 18497
3073 1 9 . 1 1 47 47 TYR C C 47 179.328 179.328 177.364 1.964 18497
3074 1 9 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.741 0.139 18497
3075 1 9 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.261 0.239 18497
3076 1 9 . 1 1 47 47 TYR H H 47 8.077 8.077 7.860 0.217 18497
3077 1 9 . 1 1 48 48 HIS N N 48 116.422 116.422 118.736 -2.314 18497
3078 1 9 . 1 1 48 48 HIS HA H 48 4.100 4.100 3.999 0.101 18497
3079 1 9 . 1 1 48 48 HIS C C 48 178.023 178.023 177.652 0.371 18497
3080 1 9 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.764 0.256 18497
3081 1 9 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.978 -1.038 18497
3082 1 9 . 1 1 48 48 HIS H H 48 8.326 8.326 8.471 -0.145 18497
3083 1 9 . 1 1 49 49 LEU N N 49 120.974 120.974 120.095 0.879 18497
3084 1 9 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.158 -0.003 18497
3085 1 9 . 1 1 49 49 LEU C C 49 177.417 177.417 179.645 -2.228 18497
3086 1 9 . 1 1 49 49 LEU CA C 49 57.890 57.890 57.858 0.032 18497
3087 1 9 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.572 0.388 18497
3088 1 9 . 1 1 49 49 LEU H H 49 8.237 8.237 8.457 -0.220 18497
3089 1 9 . 1 1 50 50 ILE N N 50 119.715 119.715 119.709 0.006 18497
3090 1 9 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.595 0.025 18497
3091 1 9 . 1 1 50 50 ILE C C 50 179.502 179.502 177.742 1.760 18497
3092 1 9 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.362 -0.302 18497
3093 1 9 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.910 0.061 18497
3094 1 9 . 1 1 50 50 ILE H H 50 7.543 7.543 8.260 -0.717 18497
3095 1 9 . 1 1 51 51 ILE N N 51 117.995 117.995 121.844 -3.849 18497
3096 1 9 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.439 0.101 18497
3097 1 9 . 1 1 51 51 ILE C C 51 179.197 179.197 177.953 1.244 18497
3098 1 9 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.106 -1.367 18497
3099 1 9 . 1 1 51 51 ILE CB C 51 36.650 36.650 36.297 0.353 18497
3100 1 9 . 1 1 51 51 ILE H H 51 7.475 7.475 8.330 -0.855 18497
3101 1 9 . 1 1 52 52 ASP N N 52 121.642 121.642 119.966 1.676 18497
3102 1 9 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.307 0.133 18497
3103 1 9 . 1 1 52 52 ASP C C 52 179.197 179.197 178.772 0.425 18497
3104 1 9 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.813 -0.713 18497
3105 1 9 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.147 0.153 18497
3106 1 9 . 1 1 52 52 ASP H H 52 8.559 8.559 8.404 0.155 18497
3107 1 9 . 1 1 53 53 ASN N N 53 117.131 117.131 119.515 -2.384 18497
3108 1 9 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.473 0.137 18497
3109 1 9 . 1 1 53 53 ASN C C 53 178.545 178.545 177.803 0.742 18497
3110 1 9 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.303 -1.603 18497
3111 1 9 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.935 -0.235 18497
3112 1 9 . 1 1 53 53 ASN H H 53 8.106 8.106 8.220 -0.114 18497
3113 1 9 . 1 1 54 54 ARG N N 54 119.929 119.929 120.394 -0.465 18497
3114 1 9 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.045 0.075 18497
3115 1 9 . 1 1 54 54 ARG C C 54 176.892 176.892 178.380 -1.488 18497
3116 1 9 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.084 -0.924 18497
3117 1 9 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.334 -0.064 18497
3118 1 9 . 1 1 54 54 ARG H H 54 7.797 7.797 8.211 -0.414 18497
3119 1 9 . 1 1 55 55 ARG N N 55 119.227 119.227 118.472 0.755 18497
3120 1 9 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.229 -0.055 18497
3121 1 9 . 1 1 55 55 ARG C C 55 175.108 175.108 178.269 -3.161 18497
3122 1 9 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.152 3.728 18497
3123 1 9 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.418 2.242 18497
3124 1 9 . 1 1 55 55 ARG H H 55 7.857 7.857 8.030 -0.173 18497
3125 1 9 . 1 1 56 56 ILE N N 56 116.676 116.676 118.373 -1.697 18497
3126 1 9 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.031 -0.021 18497
3127 1 9 . 1 1 56 56 ILE C C 56 176.065 176.065 176.676 -0.611 18497
3128 1 9 . 1 1 56 56 ILE CA C 56 62.140 62.140 61.755 0.385 18497
3129 1 9 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.480 -0.240 18497
3130 1 9 . 1 1 56 56 ILE H H 56 8.317 8.317 8.197 0.120 18497
3131 1 9 . 1 1 57 57 MET N N 57 122.058 122.058 118.862 3.196 18497
3132 1 9 . 1 1 57 57 MET HA H 57 4.420 4.420 4.064 0.356 18497
3133 1 9 . 1 1 57 57 MET C C 57 177.283 177.283 174.399 2.884 18497
3134 1 9 . 1 1 57 57 MET CA C 57 56.030 56.030 56.088 -0.058 18497
3135 1 9 . 1 1 57 57 MET CB C 57 32.515 32.515 30.897 1.618 18497
3136 1 9 . 1 1 57 57 MET H H 57 8.177 8.177 7.784 0.393 18497
3137 1 9 . 1 1 58 58 ASN N N 58 118.892 118.892 114.394 4.498 18497
3138 1 9 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.347 0.343 18497
3139 1 9 . 1 1 58 58 ASN C C 58 176.500 176.500 174.909 1.591 18497
3140 1 9 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.186 -0.533 18497
3141 1 9 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.519 0.251 18497
3142 1 9 . 1 1 58 58 ASN H H 58 8.238 8.238 8.238 -0.000 18497
3143 1 9 . 1 1 59 59 GLN N N 59 120.456 120.456 121.785 -1.329 18497
3144 1 9 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.355 -0.045 18497
3145 1 9 . 1 1 59 59 GLN C C 59 175.326 175.326 175.591 -0.265 18497
3146 1 9 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.905 0.125 18497
3147 1 9 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.434 -0.634 18497
3148 1 9 . 1 1 59 59 GLN H H 59 8.196 8.196 8.356 -0.160 18497
3149 1 9 . 1 1 60 60 ALA N N 60 125.116 125.116 125.025 0.091 18497
3150 1 9 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.455 -0.073 18497
3151 1 9 . 1 1 60 60 ALA CA C 60 52.300 52.300 51.953 0.346 18497
3152 1 9 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.277 -0.167 18497
3153 1 9 . 1 1 60 60 ALA H H 60 8.293 8.293 8.328 -0.035 18497
3154 1 9 . 1 1 61 61 SER N N 61 115.686 115.686 114.877 0.809 18497
3155 1 9 . 1 1 61 61 SER HA H 61 4.470 4.470 4.300 0.170 18497
3156 1 9 . 1 1 61 61 SER C C 61 175.674 175.674 174.410 1.264 18497
3157 1 9 . 1 1 61 61 SER CA C 61 58.160 58.160 59.039 -0.879 18497
3158 1 9 . 1 1 61 61 SER CB C 61 63.740 63.740 63.235 0.505 18497
3159 1 9 . 1 1 61 61 SER H H 61 8.290 8.290 8.492 -0.202 18497
3160 1 10 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.645 -0.215 18497
3161 1 10 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.314 -0.367 18497
3162 1 10 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.119 0.011 18497
3163 1 10 . 1 1 3 3 HIS N N 3 119.985 119.985 119.191 0.794 18497
3164 1 10 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.743 -0.137 18497
3165 1 10 . 1 1 3 3 HIS C C 3 176.587 176.587 175.578 1.009 18497
3166 1 10 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.237 -0.052 18497
3167 1 10 . 1 1 3 3 HIS CB C 3 30.471 30.471 31.291 -0.820 18497
3168 1 10 . 1 1 3 3 HIS H H 3 8.526 8.526 8.153 0.373 18497
3169 1 10 . 1 1 4 4 MET N N 4 122.338 122.338 121.588 0.750 18497
3170 1 10 . 1 1 4 4 MET HA H 4 4.448 4.448 3.767 0.681 18497
3171 1 10 . 1 1 4 4 MET C C 4 175.108 175.108 176.291 -1.183 18497
3172 1 10 . 1 1 4 4 MET CA C 4 55.562 55.562 57.614 -2.052 18497
3173 1 10 . 1 1 4 4 MET CB C 4 33.141 33.141 31.737 1.404 18497
3174 1 10 . 1 1 4 4 MET H H 4 8.337 8.337 8.106 0.231 18497
3175 1 10 . 1 1 5 5 SER N N 5 116.990 116.990 115.659 1.331 18497
3176 1 10 . 1 1 5 5 SER HA H 5 4.400 4.400 4.089 0.311 18497
3177 1 10 . 1 1 5 5 SER C C 5 177.979 177.979 174.540 3.439 18497
3178 1 10 . 1 1 5 5 SER CA C 5 58.039 58.039 60.539 -2.500 18497
3179 1 10 . 1 1 5 5 SER CB C 5 63.797 63.797 63.186 0.611 18497
3180 1 10 . 1 1 5 5 SER H H 5 8.330 8.330 7.968 0.362 18497
3181 1 10 . 1 1 6 6 TYR N N 6 122.027 122.027 117.768 4.259 18497
3182 1 10 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.446 0.064 18497
3183 1 10 . 1 1 6 6 TYR C C 6 174.060 174.060 176.123 -2.063 18497
3184 1 10 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.854 -0.054 18497
3185 1 10 . 1 1 6 6 TYR CB C 6 38.685 38.685 38.171 0.514 18497
3186 1 10 . 1 1 6 6 TYR H H 6 8.201 8.201 7.566 0.635 18497
3187 1 10 . 1 1 7 7 ASP N N 7 122.439 122.439 120.422 2.017 18497
3188 1 10 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.798 -0.249 18497
3189 1 10 . 1 1 7 7 ASP C C 7 175.150 175.150 176.752 -1.602 18497
3190 1 10 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.467 0.173 18497
3191 1 10 . 1 1 7 7 ASP CB C 7 41.300 41.300 43.068 -1.768 18497
3192 1 10 . 1 1 7 7 ASP H H 7 8.119 8.119 7.712 0.407 18497
3193 1 10 . 1 1 8 8 ALA N N 8 124.655 124.655 129.390 -4.735 18497
3194 1 10 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.075 0.155 18497
3195 1 10 . 1 1 8 8 ALA C C 8 175.935 175.935 177.693 -1.758 18497
3196 1 10 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.251 -1.358 18497
3197 1 10 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.778 0.072 18497
3198 1 10 . 1 1 8 8 ALA H H 8 8.235 8.235 8.841 -0.606 18497
3199 1 10 . 1 1 9 9 ASN N N 9 116.133 116.133 116.252 -0.119 18497
3200 1 10 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.145 0.545 18497
3201 1 10 . 1 1 9 9 ASN C C 9 177.718 177.718 175.198 2.520 18497
3202 1 10 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.633 -0.833 18497
3203 1 10 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.764 -0.994 18497
3204 1 10 . 1 1 9 9 ASN H H 9 8.417 8.417 8.426 -0.009 18497
3205 1 10 . 1 1 10 10 VAL N N 10 119.557 119.557 112.275 7.282 18497
3206 1 10 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.349 -0.172 18497
3207 1 10 . 1 1 10 10 VAL C C 10 174.930 174.930 173.855 1.075 18497
3208 1 10 . 1 1 10 10 VAL CA C 10 61.880 61.880 60.944 0.936 18497
3209 1 10 . 1 1 10 10 VAL CB C 10 32.660 32.660 34.829 -2.169 18497
3210 1 10 . 1 1 10 10 VAL H H 10 7.859 7.859 7.433 0.426 18497
3211 1 10 . 1 1 11 11 ILE N N 11 126.561 126.561 122.164 4.397 18497
3212 1 10 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.315 -0.275 18497
3213 1 10 . 1 1 11 11 ILE C C 11 175.935 175.935 174.623 1.312 18497
3214 1 10 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.951 -0.451 18497
3215 1 10 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.855 -4.155 18497
3216 1 10 . 1 1 11 11 ILE H H 11 8.283 8.283 7.941 0.342 18497
3217 1 10 . 1 1 12 12 ASP N N 12 128.161 128.161 124.274 3.887 18497
3218 1 10 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.765 -0.035 18497
3219 1 10 . 1 1 12 12 ASP C C 12 174.891 174.891 176.528 -1.637 18497
3220 1 10 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.882 -0.455 18497
3221 1 10 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.708 0.512 18497
3222 1 10 . 1 1 12 12 ASP H H 12 8.477 8.477 8.776 -0.299 18497
3223 1 10 . 1 1 13 13 ASP N N 13 127.435 127.435 127.700 -0.265 18497
3224 1 10 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.317 -0.001 18497
3225 1 10 . 1 1 13 13 ASP C C 13 175.369 175.369 177.677 -2.308 18497
3226 1 10 . 1 1 13 13 ASP CA C 13 57.600 57.600 56.966 0.634 18497
3227 1 10 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.482 -0.322 18497
3228 1 10 . 1 1 13 13 ASP H H 13 8.698 8.698 8.870 -0.172 18497
3229 1 10 . 1 1 14 14 GLU N N 14 119.796 119.796 119.293 0.503 18497
3230 1 10 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.008 0.027 18497
3231 1 10 . 1 1 14 14 GLU C C 14 178.588 178.588 178.068 0.520 18497
3232 1 10 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.236 0.264 18497
3233 1 10 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.593 -0.694 18497
3234 1 10 . 1 1 14 14 GLU H H 14 8.205 8.205 8.542 -0.337 18497
3235 1 10 . 1 1 15 15 ALA N N 15 124.156 124.156 123.091 1.065 18497
3236 1 10 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.083 0.093 18497
3237 1 10 . 1 1 15 15 ALA C C 15 179.502 179.502 179.753 -0.251 18497
3238 1 10 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.207 -0.207 18497
3239 1 10 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.201 0.699 18497
3240 1 10 . 1 1 15 15 ALA H H 15 8.473 8.473 7.758 0.715 18497
3241 1 10 . 1 1 16 16 VAL N N 16 117.585 117.585 118.390 -0.805 18497
3242 1 10 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.715 -0.181 18497
3243 1 10 . 1 1 16 16 VAL C C 16 179.545 179.545 178.115 1.430 18497
3244 1 10 . 1 1 16 16 VAL CA C 16 68.000 68.000 66.662 1.338 18497
3245 1 10 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.047 0.553 18497
3246 1 10 . 1 1 16 16 VAL H H 16 8.181 8.181 8.418 -0.237 18497
3247 1 10 . 1 1 17 17 LYS N N 17 119.377 119.377 120.736 -1.359 18497
3248 1 10 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.957 -0.001 18497
3249 1 10 . 1 1 17 17 LYS C C 17 178.197 178.197 178.668 -0.471 18497
3250 1 10 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.358 0.662 18497
3251 1 10 . 1 1 17 17 LYS CB C 17 32.130 32.130 31.946 0.184 18497
3252 1 10 . 1 1 17 17 LYS H H 17 8.001 8.001 8.177 -0.176 18497
3253 1 10 . 1 1 18 18 GLU N N 18 120.395 120.395 118.987 1.408 18497
3254 1 10 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.067 0.073 18497
3255 1 10 . 1 1 18 18 GLU C C 18 178.849 178.849 179.237 -0.388 18497
3256 1 10 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.341 0.459 18497
3257 1 10 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.499 -0.006 18497
3258 1 10 . 1 1 18 18 GLU H H 18 7.943 7.943 8.055 -0.112 18497
3259 1 10 . 1 1 19 19 VAL N N 19 121.088 121.088 120.188 0.900 18497
3260 1 10 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.736 -0.086 18497
3261 1 10 . 1 1 19 19 VAL C C 19 179.415 179.415 178.244 1.171 18497
3262 1 10 . 1 1 19 19 VAL CA C 19 67.980 67.980 67.100 0.881 18497
3263 1 10 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.369 0.231 18497
3264 1 10 . 1 1 19 19 VAL H H 19 8.335 8.335 8.567 -0.232 18497
3265 1 10 . 1 1 20 20 CYS N N 20 117.290 117.290 119.836 -2.546 18497
3266 1 10 . 1 1 20 20 CYS HA H 20 4.680 4.680 3.971 0.709 18497
3267 1 10 . 1 1 20 20 CYS C C 20 178.110 178.110 176.117 1.993 18497
3268 1 10 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.654 -0.454 18497
3269 1 10 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.417 -0.617 18497
3270 1 10 . 1 1 20 20 CYS H H 20 8.434 8.434 8.299 0.135 18497
3271 1 10 . 1 1 21 21 GLU N N 21 118.195 118.195 118.424 -0.229 18497
3272 1 10 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.222 -0.083 18497
3273 1 10 . 1 1 21 21 GLU C C 21 178.153 178.153 177.923 0.230 18497
3274 1 10 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.224 1.526 18497
3275 1 10 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.439 0.061 18497
3276 1 10 . 1 1 21 21 GLU H H 21 7.972 7.972 7.783 0.189 18497
3277 1 10 . 1 1 22 22 LYS N N 22 119.095 119.095 119.614 -0.519 18497
3278 1 10 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.200 -0.195 18497
3279 1 10 . 1 1 22 22 LYS C C 22 179.371 179.371 178.032 1.339 18497
3280 1 10 . 1 1 22 22 LYS CA C 22 58.700 58.700 57.966 0.734 18497
3281 1 10 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.709 0.211 18497
3282 1 10 . 1 1 22 22 LYS H H 22 8.071 8.071 8.467 -0.396 18497
3283 1 10 . 1 1 23 23 PHE N N 23 114.252 114.252 118.101 -3.849 18497
3284 1 10 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.578 -0.148 18497
3285 1 10 . 1 1 23 23 PHE C C 23 178.197 178.197 174.522 3.675 18497
3286 1 10 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.299 0.131 18497
3287 1 10 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.257 -1.487 18497
3288 1 10 . 1 1 23 23 PHE H H 23 8.491 8.491 7.952 0.539 18497
3289 1 10 . 1 1 24 24 GLU N N 24 119.819 119.819 117.755 2.064 18497
3290 1 10 . 1 1 24 24 GLU HA H 24 4.070 4.070 3.989 0.081 18497
3291 1 10 . 1 1 24 24 GLU C C 24 177.457 177.457 175.135 2.322 18497
3292 1 10 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.144 -0.314 18497
3293 1 10 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.277 -0.478 18497
3294 1 10 . 1 1 24 24 GLU H H 24 7.867 7.867 8.254 -0.387 18497
3295 1 10 . 1 1 25 25 CYS N N 25 114.633 114.633 120.162 -5.529 18497
3296 1 10 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.896 0.491 18497
3297 1 10 . 1 1 25 25 CYS C C 25 174.760 174.760 173.279 1.481 18497
3298 1 10 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.108 -2.347 18497
3299 1 10 . 1 1 25 25 CYS CB C 25 31.600 31.600 29.497 2.103 18497
3300 1 10 . 1 1 25 25 CYS H H 25 8.156 8.156 8.752 -0.596 18497
3301 1 10 . 1 1 26 26 THR N N 26 109.312 109.312 112.423 -3.111 18497
3302 1 10 . 1 1 26 26 THR HA H 26 4.770 4.770 4.780 -0.010 18497
3303 1 10 . 1 1 26 26 THR C C 26 173.499 173.499 174.612 -1.113 18497
3304 1 10 . 1 1 26 26 THR CA C 26 60.723 60.723 60.434 0.289 18497
3305 1 10 . 1 1 26 26 THR CB C 26 72.000 72.000 71.949 0.051 18497
3306 1 10 . 1 1 26 26 THR H H 26 8.460 8.460 7.909 0.551 18497
3307 1 10 . 1 1 27 27 GLU N N 27 122.233 122.233 123.704 -1.471 18497
3308 1 10 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.919 -0.409 18497
3309 1 10 . 1 1 27 27 GLU C C 27 176.544 176.544 178.192 -1.648 18497
3310 1 10 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.841 -0.291 18497
3311 1 10 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.393 -0.443 18497
3312 1 10 . 1 1 27 27 GLU H H 27 9.327 9.327 9.077 0.250 18497
3313 1 10 . 1 1 28 28 SER N N 28 112.925 112.925 113.962 -1.037 18497
3314 1 10 . 1 1 28 28 SER HA H 28 4.062 4.062 4.174 -0.112 18497
3315 1 10 . 1 1 28 28 SER C C 28 178.545 178.545 176.373 2.172 18497
3316 1 10 . 1 1 28 28 SER CA C 28 61.350 61.350 61.035 0.315 18497
3317 1 10 . 1 1 28 28 SER CB C 28 62.400 62.400 62.571 -0.171 18497
3318 1 10 . 1 1 28 28 SER H H 28 8.320 8.320 8.425 -0.105 18497
3319 1 10 . 1 1 29 29 GLU N N 29 121.736 121.736 122.527 -0.791 18497
3320 1 10 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.115 -0.125 18497
3321 1 10 . 1 1 29 29 GLU C C 29 176.674 176.674 178.914 -2.240 18497
3322 1 10 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.524 1.226 18497
3323 1 10 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.446 0.024 18497
3324 1 10 . 1 1 29 29 GLU H H 29 7.512 7.512 7.534 -0.022 18497
3325 1 10 . 1 1 30 30 VAL N N 30 119.480 119.480 120.696 -1.216 18497
3326 1 10 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.515 -0.138 18497
3327 1 10 . 1 1 30 30 VAL C C 30 179.241 179.241 178.226 1.015 18497
3328 1 10 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.730 -0.070 18497
3329 1 10 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.765 -0.695 18497
3330 1 10 . 1 1 30 30 VAL H H 30 7.492 7.492 8.272 -0.780 18497
3331 1 10 . 1 1 31 31 MET N N 31 117.220 117.220 117.682 -0.462 18497
3332 1 10 . 1 1 31 31 MET HA H 31 3.870 3.870 3.830 0.040 18497
3333 1 10 . 1 1 31 31 MET C C 31 177.936 177.936 178.250 -0.314 18497
3334 1 10 . 1 1 31 31 MET CA C 31 57.630 57.630 59.570 -1.940 18497
3335 1 10 . 1 1 31 31 MET CB C 31 30.270 30.270 32.303 -2.033 18497
3336 1 10 . 1 1 31 31 MET H H 31 8.302 8.302 8.448 -0.146 18497
3337 1 10 . 1 1 32 32 ASN N N 32 116.672 116.672 119.117 -2.445 18497
3338 1 10 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.480 -0.090 18497
3339 1 10 . 1 1 32 32 ASN C C 32 176.065 176.065 178.118 -2.053 18497
3340 1 10 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.981 -0.951 18497
3341 1 10 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.599 -0.889 18497
3342 1 10 . 1 1 32 32 ASN H H 32 8.313 8.313 8.382 -0.069 18497
3343 1 10 . 1 1 33 33 SER N N 33 117.471 117.471 115.244 2.227 18497
3344 1 10 . 1 1 33 33 SER HA H 33 4.150 4.150 4.208 -0.058 18497
3345 1 10 . 1 1 33 33 SER C C 33 178.806 178.806 175.428 3.378 18497
3346 1 10 . 1 1 33 33 SER CA C 33 62.950 62.950 61.081 1.869 18497
3347 1 10 . 1 1 33 33 SER CB C 33 62.600 62.600 63.145 -0.545 18497
3348 1 10 . 1 1 33 33 SER H H 33 7.851 7.851 7.914 -0.063 18497
3349 1 10 . 1 1 34 34 LEU N N 34 122.839 122.839 119.226 3.613 18497
3350 1 10 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.142 -0.263 18497
3351 1 10 . 1 1 34 34 LEU C C 34 177.892 177.892 177.531 0.361 18497
3352 1 10 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.548 1.082 18497
3353 1 10 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.456 -1.655 18497
3354 1 10 . 1 1 34 34 LEU H H 34 8.128 8.128 7.334 0.794 18497
3355 1 10 . 1 1 35 35 TYR N N 35 116.666 116.666 118.088 -1.422 18497
3356 1 10 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.546 0.064 18497
3357 1 10 . 1 1 35 35 TYR C C 35 179.067 179.067 175.824 3.243 18497
3358 1 10 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.539 -1.649 18497
3359 1 10 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.857 -4.147 18497
3360 1 10 . 1 1 35 35 TYR H H 35 7.924 7.924 7.860 0.064 18497
3361 1 10 . 1 1 36 36 SER N N 36 114.801 114.801 112.079 2.722 18497
3362 1 10 . 1 1 36 36 SER HA H 36 4.080 4.080 4.473 -0.394 18497
3363 1 10 . 1 1 36 36 SER C C 36 177.283 177.283 175.661 1.622 18497
3364 1 10 . 1 1 36 36 SER CA C 36 60.519 60.519 58.042 2.477 18497
3365 1 10 . 1 1 36 36 SER CB C 36 64.240 64.240 65.689 -1.449 18497
3366 1 10 . 1 1 36 36 SER H H 36 7.715 7.715 8.461 -0.746 18497
3367 1 10 . 1 1 37 37 GLY N N 37 109.803 109.803 111.837 -2.034 18497
3368 1 10 . 1 1 37 37 GLY C C 37 175.978 175.978 172.782 3.196 18497
3369 1 10 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.144 0.534 18497
3370 1 10 . 1 1 37 37 GLY H H 37 8.017 8.017 8.114 -0.097 18497
3371 1 10 . 1 1 38 38 ASP N N 38 120.613 120.613 118.722 1.891 18497
3372 1 10 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.965 0.060 18497
3373 1 10 . 1 1 38 38 ASP C C 38 173.368 173.368 174.587 -1.219 18497
3374 1 10 . 1 1 38 38 ASP CA C 38 50.720 50.720 52.020 -1.300 18497
3375 1 10 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.975 -1.555 18497
3376 1 10 . 1 1 38 38 ASP H H 38 8.006 8.006 8.027 -0.021 18497
3377 1 10 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.269 0.071 18497
3378 1 10 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.302 -0.552 18497
3379 1 10 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.039 0.091 18497
3380 1 10 . 1 1 40 40 GLN N N 40 115.056 115.056 114.500 0.556 18497
3381 1 10 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.242 0.038 18497
3382 1 10 . 1 1 40 40 GLN C C 40 177.066 177.066 176.183 0.883 18497
3383 1 10 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.675 -0.965 18497
3384 1 10 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.982 -0.302 18497
3385 1 10 . 1 1 40 40 GLN H H 40 8.237 8.237 8.069 0.168 18497
3386 1 10 . 1 1 41 41 ASP N N 41 122.839 122.839 121.760 1.079 18497
3387 1 10 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.518 -0.205 18497
3388 1 10 . 1 1 41 41 ASP C C 41 175.804 175.804 177.354 -1.550 18497
3389 1 10 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.204 1.036 18497
3390 1 10 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.543 -0.323 18497
3391 1 10 . 1 1 41 41 ASP H H 41 7.211 7.211 7.742 -0.531 18497
3392 1 10 . 1 1 42 42 GLN N N 42 124.547 124.547 122.925 1.622 18497
3393 1 10 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.058 -0.198 18497
3394 1 10 . 1 1 42 42 GLN C C 42 177.196 177.196 177.728 -0.532 18497
3395 1 10 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.356 -0.136 18497
3396 1 10 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.794 -0.394 18497
3397 1 10 . 1 1 42 42 GLN H H 42 8.719 8.719 8.848 -0.129 18497
3398 1 10 . 1 1 43 43 LEU N N 43 118.960 118.960 118.675 0.285 18497
3399 1 10 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.875 -0.190 18497
3400 1 10 . 1 1 43 43 LEU C C 43 178.066 178.066 178.444 -0.378 18497
3401 1 10 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.019 0.341 18497
3402 1 10 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.279 -0.889 18497
3403 1 10 . 1 1 43 43 LEU H H 43 8.206 8.206 8.477 -0.271 18497
3404 1 10 . 1 1 44 44 ALA N N 44 121.666 121.666 122.824 -1.158 18497
3405 1 10 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.098 -0.219 18497
3406 1 10 . 1 1 44 44 ALA C C 44 178.327 178.327 179.535 -1.208 18497
3407 1 10 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.836 -0.126 18497
3408 1 10 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.199 0.381 18497
3409 1 10 . 1 1 44 44 ALA H H 44 7.402 7.402 7.561 -0.159 18497
3410 1 10 . 1 1 45 45 VAL N N 45 118.589 118.589 120.211 -1.622 18497
3411 1 10 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.566 0.094 18497
3412 1 10 . 1 1 45 45 VAL C C 45 179.893 179.893 177.750 2.143 18497
3413 1 10 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.827 -0.427 18497
3414 1 10 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.662 0.469 18497
3415 1 10 . 1 1 45 45 VAL H H 45 8.449 8.449 8.616 -0.167 18497
3416 1 10 . 1 1 46 46 ALA N N 46 121.006 121.006 122.371 -1.365 18497
3417 1 10 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.749 0.381 18497
3418 1 10 . 1 1 46 46 ALA C C 46 179.110 179.110 178.926 0.184 18497
3419 1 10 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.066 -0.096 18497
3420 1 10 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.131 1.979 18497
3421 1 10 . 1 1 46 46 ALA H H 46 7.654 7.654 7.984 -0.330 18497
3422 1 10 . 1 1 47 47 TYR N N 47 119.140 119.140 119.779 -0.639 18497
3423 1 10 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.947 -0.197 18497
3424 1 10 . 1 1 47 47 TYR C C 47 179.328 179.328 177.401 1.927 18497
3425 1 10 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.885 -0.005 18497
3426 1 10 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.312 0.188 18497
3427 1 10 . 1 1 47 47 TYR H H 47 8.077 8.077 7.920 0.157 18497
3428 1 10 . 1 1 48 48 HIS N N 48 116.422 116.422 118.755 -2.333 18497
3429 1 10 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.068 0.032 18497
3430 1 10 . 1 1 48 48 HIS C C 48 178.023 178.023 177.593 0.430 18497
3431 1 10 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.012 0.008 18497
3432 1 10 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.487 -1.547 18497
3433 1 10 . 1 1 48 48 HIS H H 48 8.326 8.326 8.383 -0.057 18497
3434 1 10 . 1 1 49 49 LEU N N 49 120.974 120.974 120.136 0.838 18497
3435 1 10 . 1 1 49 49 LEU HA H 49 4.155 4.155 3.927 0.228 18497
3436 1 10 . 1 1 49 49 LEU C C 49 177.417 177.417 179.195 -1.778 18497
3437 1 10 . 1 1 49 49 LEU CA C 49 57.890 57.890 57.909 -0.019 18497
3438 1 10 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.750 0.210 18497
3439 1 10 . 1 1 49 49 LEU H H 49 8.237 8.237 8.339 -0.102 18497
3440 1 10 . 1 1 50 50 ILE N N 50 119.715 119.715 119.645 0.070 18497
3441 1 10 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.526 0.094 18497
3442 1 10 . 1 1 50 50 ILE C C 50 179.502 179.502 177.855 1.647 18497
3443 1 10 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.623 -0.562 18497
3444 1 10 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.821 0.149 18497
3445 1 10 . 1 1 50 50 ILE H H 50 7.543 7.543 8.481 -0.938 18497
3446 1 10 . 1 1 51 51 ILE N N 51 117.995 117.995 121.347 -3.352 18497
3447 1 10 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.392 0.148 18497
3448 1 10 . 1 1 51 51 ILE C C 51 179.197 179.197 177.385 1.812 18497
3449 1 10 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.838 -2.098 18497
3450 1 10 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.355 -0.705 18497
3451 1 10 . 1 1 51 51 ILE H H 51 7.475 7.475 7.932 -0.457 18497
3452 1 10 . 1 1 52 52 ASP N N 52 121.642 121.642 119.906 1.736 18497
3453 1 10 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.174 0.266 18497
3454 1 10 . 1 1 52 52 ASP C C 52 179.197 179.197 178.484 0.713 18497
3455 1 10 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.965 -0.865 18497
3456 1 10 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.678 -0.378 18497
3457 1 10 . 1 1 52 52 ASP H H 52 8.559 8.559 7.961 0.598 18497
3458 1 10 . 1 1 53 53 ASN N N 53 117.131 117.131 118.067 -0.936 18497
3459 1 10 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.414 0.196 18497
3460 1 10 . 1 1 53 53 ASN C C 53 178.545 178.545 177.794 0.751 18497
3461 1 10 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.340 -1.640 18497
3462 1 10 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.695 0.005 18497
3463 1 10 . 1 1 53 53 ASN H H 53 8.106 8.106 8.062 0.044 18497
3464 1 10 . 1 1 54 54 ARG N N 54 119.929 119.929 119.757 0.172 18497
3465 1 10 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.973 0.147 18497
3466 1 10 . 1 1 54 54 ARG C C 54 176.892 176.892 178.038 -1.146 18497
3467 1 10 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.746 -0.586 18497
3468 1 10 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.258 0.012 18497
3469 1 10 . 1 1 54 54 ARG H H 54 7.797 7.797 8.246 -0.449 18497
3470 1 10 . 1 1 55 55 ARG N N 55 119.227 119.227 117.619 1.608 18497
3471 1 10 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.219 -0.045 18497
3472 1 10 . 1 1 55 55 ARG C C 55 175.108 175.108 178.137 -3.029 18497
3473 1 10 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.083 3.797 18497
3474 1 10 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.564 2.096 18497
3475 1 10 . 1 1 55 55 ARG H H 55 7.857 7.857 8.082 -0.225 18497
3476 1 10 . 1 1 56 56 ILE N N 56 116.676 116.676 117.168 -0.492 18497
3477 1 10 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.088 -0.078 18497
3478 1 10 . 1 1 56 56 ILE C C 56 176.065 176.065 176.615 -0.550 18497
3479 1 10 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.400 -0.260 18497
3480 1 10 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.583 -1.343 18497
3481 1 10 . 1 1 56 56 ILE H H 56 8.317 8.317 8.063 0.254 18497
3482 1 10 . 1 1 57 57 MET N N 57 122.058 122.058 117.225 4.833 18497
3483 1 10 . 1 1 57 57 MET HA H 57 4.420 4.420 4.677 -0.257 18497
3484 1 10 . 1 1 57 57 MET C C 57 177.283 177.283 174.601 2.682 18497
3485 1 10 . 1 1 57 57 MET CA C 57 56.030 56.030 53.997 2.033 18497
3486 1 10 . 1 1 57 57 MET CB C 57 32.515 32.515 33.290 -0.775 18497
3487 1 10 . 1 1 57 57 MET H H 57 8.177 8.177 7.544 0.633 18497
3488 1 10 . 1 1 58 58 ASN N N 58 118.892 118.892 120.533 -1.641 18497
3489 1 10 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.751 -0.061 18497
3490 1 10 . 1 1 58 58 ASN C C 58 176.500 176.500 176.209 0.291 18497
3491 1 10 . 1 1 58 58 ASN CA C 58 53.653 53.653 53.896 -0.243 18497
3492 1 10 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.900 -0.130 18497
3493 1 10 . 1 1 58 58 ASN H H 58 8.238 8.238 8.344 -0.106 18497
3494 1 10 . 1 1 59 59 GLN N N 59 120.456 120.456 125.186 -4.730 18497
3495 1 10 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.584 -0.274 18497
3496 1 10 . 1 1 59 59 GLN C C 59 175.326 175.326 177.064 -1.738 18497
3497 1 10 . 1 1 59 59 GLN CA C 59 56.030 56.030 58.483 -2.453 18497
3498 1 10 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.041 -0.241 18497
3499 1 10 . 1 1 59 59 GLN H H 59 8.196 8.196 8.735 -0.539 18497
3500 1 10 . 1 1 60 60 ALA N N 60 125.116 125.116 122.850 2.266 18497
3501 1 10 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.206 0.176 18497
3502 1 10 . 1 1 60 60 ALA CA C 60 52.300 52.300 54.159 -1.859 18497
3503 1 10 . 1 1 60 60 ALA CB C 60 19.110 19.110 18.956 0.155 18497
3504 1 10 . 1 1 60 60 ALA H H 60 8.293 8.293 8.273 0.020 18497
3505 1 10 . 1 1 61 61 SER N N 61 115.686 115.686 112.039 3.647 18497
3506 1 10 . 1 1 61 61 SER HA H 61 4.470 4.470 4.373 0.097 18497
3507 1 10 . 1 1 61 61 SER C C 61 175.674 175.674 175.167 0.507 18497
3508 1 10 . 1 1 61 61 SER CA C 61 58.160 58.160 57.947 0.213 18497
3509 1 10 . 1 1 61 61 SER CB C 61 63.740 63.740 63.388 0.352 18497
3510 1 10 . 1 1 61 61 SER H H 61 8.290 8.290 8.204 0.086 18497
3511 1 11 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.466 -0.036 18497
3512 1 11 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.384 0.563 18497
3513 1 11 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.714 -0.584 18497
3514 1 11 . 1 1 3 3 HIS N N 3 119.985 119.985 119.272 0.713 18497
3515 1 11 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.611 -0.005 18497
3516 1 11 . 1 1 3 3 HIS C C 3 176.587 176.587 175.648 0.939 18497
3517 1 11 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.075 0.110 18497
3518 1 11 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.590 -0.119 18497
3519 1 11 . 1 1 3 3 HIS H H 3 8.526 8.526 8.384 0.142 18497
3520 1 11 . 1 1 4 4 MET N N 4 122.338 122.338 122.549 -0.211 18497
3521 1 11 . 1 1 4 4 MET HA H 4 4.448 4.448 4.465 -0.017 18497
3522 1 11 . 1 1 4 4 MET C C 4 175.108 175.108 177.233 -2.125 18497
3523 1 11 . 1 1 4 4 MET CA C 4 55.562 55.562 54.945 0.617 18497
3524 1 11 . 1 1 4 4 MET CB C 4 33.141 33.141 33.721 -0.580 18497
3525 1 11 . 1 1 4 4 MET H H 4 8.337 8.337 8.414 -0.077 18497
3526 1 11 . 1 1 5 5 SER N N 5 116.990 116.990 117.551 -0.561 18497
3527 1 11 . 1 1 5 5 SER HA H 5 4.400 4.400 4.103 0.297 18497
3528 1 11 . 1 1 5 5 SER C C 5 177.979 177.979 176.208 1.771 18497
3529 1 11 . 1 1 5 5 SER CA C 5 58.039 58.039 61.419 -3.380 18497
3530 1 11 . 1 1 5 5 SER CB C 5 63.797 63.797 62.890 0.907 18497
3531 1 11 . 1 1 5 5 SER H H 5 8.330 8.330 8.747 -0.417 18497
3532 1 11 . 1 1 6 6 TYR N N 6 122.027 122.027 117.160 4.867 18497
3533 1 11 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.357 0.153 18497
3534 1 11 . 1 1 6 6 TYR C C 6 174.060 174.060 177.457 -3.397 18497
3535 1 11 . 1 1 6 6 TYR CA C 6 57.800 57.800 59.221 -1.421 18497
3536 1 11 . 1 1 6 6 TYR CB C 6 38.685 38.685 37.312 1.373 18497
3537 1 11 . 1 1 6 6 TYR H H 6 8.201 8.201 8.217 -0.016 18497
3538 1 11 . 1 1 7 7 ASP N N 7 122.439 122.439 120.883 1.556 18497
3539 1 11 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.415 0.134 18497
3540 1 11 . 1 1 7 7 ASP C C 7 175.150 175.150 177.567 -2.417 18497
3541 1 11 . 1 1 7 7 ASP CA C 7 53.640 53.640 55.440 -1.800 18497
3542 1 11 . 1 1 7 7 ASP CB C 7 41.300 41.300 40.523 0.777 18497
3543 1 11 . 1 1 7 7 ASP H H 7 8.119 8.119 7.209 0.910 18497
3544 1 11 . 1 1 8 8 ALA N N 8 124.655 124.655 121.817 2.838 18497
3545 1 11 . 1 1 8 8 ALA HA H 8 4.230 4.230 3.837 0.393 18497
3546 1 11 . 1 1 8 8 ALA C C 8 175.935 175.935 179.190 -3.255 18497
3547 1 11 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.294 -1.401 18497
3548 1 11 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.853 -0.003 18497
3549 1 11 . 1 1 8 8 ALA H H 8 8.235 8.235 8.308 -0.073 18497
3550 1 11 . 1 1 9 9 ASN N N 9 116.133 116.133 116.421 -0.288 18497
3551 1 11 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.598 0.092 18497
3552 1 11 . 1 1 9 9 ASN C C 9 177.718 177.718 175.495 2.223 18497
3553 1 11 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.505 -0.705 18497
3554 1 11 . 1 1 9 9 ASN CB C 9 38.770 38.770 40.005 -1.235 18497
3555 1 11 . 1 1 9 9 ASN H H 9 8.417 8.417 7.813 0.604 18497
3556 1 11 . 1 1 10 10 VAL N N 10 119.557 119.557 117.857 1.700 18497
3557 1 11 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.720 0.457 18497
3558 1 11 . 1 1 10 10 VAL C C 10 174.930 174.930 174.493 0.437 18497
3559 1 11 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.662 -1.782 18497
3560 1 11 . 1 1 10 10 VAL CB C 10 32.660 32.660 30.679 1.981 18497
3561 1 11 . 1 1 10 10 VAL H H 10 7.859 7.859 8.036 -0.177 18497
3562 1 11 . 1 1 11 11 ILE N N 11 126.561 126.561 126.092 0.469 18497
3563 1 11 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.393 -0.353 18497
3564 1 11 . 1 1 11 11 ILE C C 11 175.935 175.935 174.627 1.308 18497
3565 1 11 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.694 -0.194 18497
3566 1 11 . 1 1 11 11 ILE CB C 11 37.700 37.700 42.961 -5.261 18497
3567 1 11 . 1 1 11 11 ILE H H 11 8.283 8.283 8.107 0.176 18497
3568 1 11 . 1 1 12 12 ASP N N 12 128.161 128.161 129.301 -1.140 18497
3569 1 11 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.836 -0.106 18497
3570 1 11 . 1 1 12 12 ASP C C 12 174.891 174.891 176.093 -1.202 18497
3571 1 11 . 1 1 12 12 ASP CA C 12 53.427 53.427 54.775 -1.348 18497
3572 1 11 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.340 0.880 18497
3573 1 11 . 1 1 12 12 ASP H H 12 8.477 8.477 8.739 -0.262 18497
3574 1 11 . 1 1 13 13 ASP N N 13 127.435 127.435 125.525 1.910 18497
3575 1 11 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.292 0.024 18497
3576 1 11 . 1 1 13 13 ASP C C 13 175.369 175.369 177.526 -2.157 18497
3577 1 11 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.322 0.278 18497
3578 1 11 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.293 -0.133 18497
3579 1 11 . 1 1 13 13 ASP H H 13 8.698 8.698 8.657 0.041 18497
3580 1 11 . 1 1 14 14 GLU N N 14 119.796 119.796 120.016 -0.220 18497
3581 1 11 . 1 1 14 14 GLU HA H 14 4.035 4.035 3.898 0.137 18497
3582 1 11 . 1 1 14 14 GLU C C 14 178.588 178.588 178.176 0.412 18497
3583 1 11 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.532 -0.033 18497
3584 1 11 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.139 -0.239 18497
3585 1 11 . 1 1 14 14 GLU H H 14 8.205 8.205 8.884 -0.679 18497
3586 1 11 . 1 1 15 15 ALA N N 15 124.156 124.156 122.457 1.699 18497
3587 1 11 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.065 0.111 18497
3588 1 11 . 1 1 15 15 ALA C C 15 179.502 179.502 179.380 0.122 18497
3589 1 11 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.685 0.314 18497
3590 1 11 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.051 0.849 18497
3591 1 11 . 1 1 15 15 ALA H H 15 8.473 8.473 8.140 0.333 18497
3592 1 11 . 1 1 16 16 VAL N N 16 117.585 117.585 119.509 -1.924 18497
3593 1 11 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.609 -0.075 18497
3594 1 11 . 1 1 16 16 VAL C C 16 179.545 179.545 177.936 1.609 18497
3595 1 11 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.206 0.794 18497
3596 1 11 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.475 0.125 18497
3597 1 11 . 1 1 16 16 VAL H H 16 8.181 8.181 8.320 -0.139 18497
3598 1 11 . 1 1 17 17 LYS N N 17 119.377 119.377 119.794 -0.417 18497
3599 1 11 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.911 0.045 18497
3600 1 11 . 1 1 17 17 LYS C C 17 178.197 178.197 178.323 -0.126 18497
3601 1 11 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.021 -0.001 18497
3602 1 11 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.206 -0.076 18497
3603 1 11 . 1 1 17 17 LYS H H 17 8.001 8.001 8.199 -0.198 18497
3604 1 11 . 1 1 18 18 GLU N N 18 120.395 120.395 119.490 0.905 18497
3605 1 11 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.052 0.088 18497
3606 1 11 . 1 1 18 18 GLU C C 18 178.849 178.849 179.037 -0.188 18497
3607 1 11 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.586 0.214 18497
3608 1 11 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.662 -0.169 18497
3609 1 11 . 1 1 18 18 GLU H H 18 7.943 7.943 8.019 -0.076 18497
3610 1 11 . 1 1 19 19 VAL N N 19 121.088 121.088 119.492 1.596 18497
3611 1 11 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.757 -0.107 18497
3612 1 11 . 1 1 19 19 VAL C C 19 179.415 179.415 178.371 1.044 18497
3613 1 11 . 1 1 19 19 VAL CA C 19 67.980 67.980 67.114 0.866 18497
3614 1 11 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.493 0.107 18497
3615 1 11 . 1 1 19 19 VAL H H 19 8.335 8.335 8.572 -0.237 18497
3616 1 11 . 1 1 20 20 CYS N N 20 117.290 117.290 119.505 -2.215 18497
3617 1 11 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.298 0.382 18497
3618 1 11 . 1 1 20 20 CYS C C 20 178.110 178.110 176.950 1.160 18497
3619 1 11 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.467 0.733 18497
3620 1 11 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.420 -0.620 18497
3621 1 11 . 1 1 20 20 CYS H H 20 8.434 8.434 8.033 0.401 18497
3622 1 11 . 1 1 21 21 GLU N N 21 118.195 118.195 118.762 -0.567 18497
3623 1 11 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.167 -0.028 18497
3624 1 11 . 1 1 21 21 GLU C C 21 178.153 178.153 178.062 0.091 18497
3625 1 11 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.685 1.065 18497
3626 1 11 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.328 0.172 18497
3627 1 11 . 1 1 21 21 GLU H H 21 7.972 7.972 8.155 -0.183 18497
3628 1 11 . 1 1 22 22 LYS N N 22 119.095 119.095 118.369 0.726 18497
3629 1 11 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.248 -0.243 18497
3630 1 11 . 1 1 22 22 LYS C C 22 179.371 179.371 177.900 1.471 18497
3631 1 11 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.203 0.498 18497
3632 1 11 . 1 1 22 22 LYS CB C 22 32.920 32.920 33.239 -0.319 18497
3633 1 11 . 1 1 22 22 LYS H H 22 8.071 8.071 8.311 -0.240 18497
3634 1 11 . 1 1 23 23 PHE N N 23 114.252 114.252 118.662 -4.410 18497
3635 1 11 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.481 -0.051 18497
3636 1 11 . 1 1 23 23 PHE C C 23 178.197 178.197 174.512 3.685 18497
3637 1 11 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.638 -0.208 18497
3638 1 11 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.007 -1.237 18497
3639 1 11 . 1 1 23 23 PHE H H 23 8.491 8.491 7.854 0.637 18497
3640 1 11 . 1 1 24 24 GLU N N 24 119.819 119.819 117.668 2.151 18497
3641 1 11 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.049 0.021 18497
3642 1 11 . 1 1 24 24 GLU C C 24 177.457 177.457 175.398 2.059 18497
3643 1 11 . 1 1 24 24 GLU CA C 24 56.830 56.830 56.916 -0.086 18497
3644 1 11 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.170 -0.370 18497
3645 1 11 . 1 1 24 24 GLU H H 24 7.867 7.867 8.252 -0.385 18497
3646 1 11 . 1 1 25 25 CYS N N 25 114.633 114.633 115.641 -1.008 18497
3647 1 11 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.963 0.424 18497
3648 1 11 . 1 1 25 25 CYS C C 25 174.760 174.760 173.510 1.250 18497
3649 1 11 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.623 -1.862 18497
3650 1 11 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.319 0.281 18497
3651 1 11 . 1 1 25 25 CYS H H 25 8.156 8.156 8.382 -0.226 18497
3652 1 11 . 1 1 26 26 THR N N 26 109.312 109.312 111.907 -2.595 18497
3653 1 11 . 1 1 26 26 THR HA H 26 4.770 4.770 4.672 0.098 18497
3654 1 11 . 1 1 26 26 THR C C 26 173.499 173.499 175.768 -2.269 18497
3655 1 11 . 1 1 26 26 THR CA C 26 60.723 60.723 60.599 0.124 18497
3656 1 11 . 1 1 26 26 THR CB C 26 72.000 72.000 70.594 1.406 18497
3657 1 11 . 1 1 26 26 THR H H 26 8.460 8.460 8.735 -0.275 18497
3658 1 11 . 1 1 27 27 GLU N N 27 122.233 122.233 124.849 -2.616 18497
3659 1 11 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.922 -0.412 18497
3660 1 11 . 1 1 27 27 GLU C C 27 176.544 176.544 178.025 -1.481 18497
3661 1 11 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.668 -0.118 18497
3662 1 11 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.452 -0.502 18497
3663 1 11 . 1 1 27 27 GLU H H 27 9.327 9.327 9.041 0.286 18497
3664 1 11 . 1 1 28 28 SER N N 28 112.925 112.925 115.761 -2.836 18497
3665 1 11 . 1 1 28 28 SER HA H 28 4.062 4.062 4.184 -0.122 18497
3666 1 11 . 1 1 28 28 SER C C 28 178.545 178.545 176.718 1.827 18497
3667 1 11 . 1 1 28 28 SER CA C 28 61.350 61.350 61.227 0.123 18497
3668 1 11 . 1 1 28 28 SER CB C 28 62.400 62.400 62.774 -0.374 18497
3669 1 11 . 1 1 28 28 SER H H 28 8.320 8.320 8.475 -0.155 18497
3670 1 11 . 1 1 29 29 GLU N N 29 121.736 121.736 122.463 -0.727 18497
3671 1 11 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.089 -0.099 18497
3672 1 11 . 1 1 29 29 GLU C C 29 176.674 176.674 178.832 -2.158 18497
3673 1 11 . 1 1 29 29 GLU CA C 29 59.750 59.750 59.144 0.606 18497
3674 1 11 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.738 -0.268 18497
3675 1 11 . 1 1 29 29 GLU H H 29 7.512 7.512 7.535 -0.023 18497
3676 1 11 . 1 1 30 30 VAL N N 30 119.480 119.480 120.304 -0.824 18497
3677 1 11 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.537 -0.160 18497
3678 1 11 . 1 1 30 30 VAL C C 30 179.241 179.241 177.930 1.311 18497
3679 1 11 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.467 0.193 18497
3680 1 11 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.875 -0.805 18497
3681 1 11 . 1 1 30 30 VAL H H 30 7.492 7.492 8.137 -0.645 18497
3682 1 11 . 1 1 31 31 MET N N 31 117.220 117.220 116.787 0.433 18497
3683 1 11 . 1 1 31 31 MET HA H 31 3.870 3.870 4.064 -0.194 18497
3684 1 11 . 1 1 31 31 MET C C 31 177.936 177.936 178.164 -0.228 18497
3685 1 11 . 1 1 31 31 MET CA C 31 57.630 57.630 56.380 1.250 18497
3686 1 11 . 1 1 31 31 MET CB C 31 30.270 30.270 31.176 -0.906 18497
3687 1 11 . 1 1 31 31 MET H H 31 8.302 8.302 8.416 -0.114 18497
3688 1 11 . 1 1 32 32 ASN N N 32 116.672 116.672 119.486 -2.814 18497
3689 1 11 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.351 0.038 18497
3690 1 11 . 1 1 32 32 ASN C C 32 176.065 176.065 177.495 -1.430 18497
3691 1 11 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.968 -0.938 18497
3692 1 11 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.469 -0.759 18497
3693 1 11 . 1 1 32 32 ASN H H 32 8.313 8.313 8.184 0.129 18497
3694 1 11 . 1 1 33 33 SER N N 33 117.471 117.471 115.754 1.717 18497
3695 1 11 . 1 1 33 33 SER HA H 33 4.150 4.150 4.204 -0.054 18497
3696 1 11 . 1 1 33 33 SER C C 33 178.806 178.806 176.273 2.533 18497
3697 1 11 . 1 1 33 33 SER CA C 33 62.950 62.950 61.426 1.524 18497
3698 1 11 . 1 1 33 33 SER CB C 33 62.600 62.600 63.155 -0.555 18497
3699 1 11 . 1 1 33 33 SER H H 33 7.851 7.851 7.759 0.092 18497
3700 1 11 . 1 1 34 34 LEU N N 34 122.839 122.839 121.229 1.610 18497
3701 1 11 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.115 -0.236 18497
3702 1 11 . 1 1 34 34 LEU C C 34 177.892 177.892 178.593 -0.701 18497
3703 1 11 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.809 0.821 18497
3704 1 11 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.866 -1.066 18497
3705 1 11 . 1 1 34 34 LEU H H 34 8.128 8.128 7.306 0.822 18497
3706 1 11 . 1 1 35 35 TYR N N 35 116.666 116.666 120.020 -3.354 18497
3707 1 11 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.167 0.443 18497
3708 1 11 . 1 1 35 35 TYR C C 35 179.067 179.067 177.363 1.704 18497
3709 1 11 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.353 -2.463 18497
3710 1 11 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.465 -1.755 18497
3711 1 11 . 1 1 35 35 TYR H H 35 7.924 7.924 8.182 -0.258 18497
3712 1 11 . 1 1 36 36 SER N N 36 114.801 114.801 114.362 0.439 18497
3713 1 11 . 1 1 36 36 SER HA H 36 4.080 4.080 4.183 -0.103 18497
3714 1 11 . 1 1 36 36 SER C C 36 177.283 177.283 175.226 2.057 18497
3715 1 11 . 1 1 36 36 SER CA C 36 60.519 60.519 60.177 0.342 18497
3716 1 11 . 1 1 36 36 SER CB C 36 64.240 64.240 64.081 0.159 18497
3717 1 11 . 1 1 36 36 SER H H 36 7.715 7.715 8.487 -0.772 18497
3718 1 11 . 1 1 37 37 GLY N N 37 109.803 109.803 109.246 0.557 18497
3719 1 11 . 1 1 37 37 GLY C C 37 175.978 175.978 173.781 2.197 18497
3720 1 11 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.981 0.697 18497
3721 1 11 . 1 1 37 37 GLY H H 37 8.017 8.017 7.660 0.357 18497
3722 1 11 . 1 1 38 38 ASP N N 38 120.613 120.613 121.822 -1.209 18497
3723 1 11 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.017 0.008 18497
3724 1 11 . 1 1 38 38 ASP C C 38 173.368 173.368 175.837 -2.469 18497
3725 1 11 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.800 -0.080 18497
3726 1 11 . 1 1 38 38 ASP CB C 38 41.420 41.420 41.708 -0.288 18497
3727 1 11 . 1 1 38 38 ASP H H 38 8.006 8.006 8.011 -0.005 18497
3728 1 11 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.496 -0.156 18497
3729 1 11 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.799 -0.049 18497
3730 1 11 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.470 -0.340 18497
3731 1 11 . 1 1 40 40 GLN N N 40 115.056 115.056 116.449 -1.393 18497
3732 1 11 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.345 -0.065 18497
3733 1 11 . 1 1 40 40 GLN C C 40 177.066 177.066 176.245 0.821 18497
3734 1 11 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.327 -0.617 18497
3735 1 11 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.747 -0.067 18497
3736 1 11 . 1 1 40 40 GLN H H 40 8.237 8.237 8.314 -0.077 18497
3737 1 11 . 1 1 41 41 ASP N N 41 122.839 122.839 121.720 1.119 18497
3738 1 11 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.582 -0.269 18497
3739 1 11 . 1 1 41 41 ASP C C 41 175.804 175.804 177.478 -1.674 18497
3740 1 11 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.359 0.881 18497
3741 1 11 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.722 -0.502 18497
3742 1 11 . 1 1 41 41 ASP H H 41 7.211 7.211 7.421 -0.210 18497
3743 1 11 . 1 1 42 42 GLN N N 42 124.547 124.547 123.141 1.406 18497
3744 1 11 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.097 -0.237 18497
3745 1 11 . 1 1 42 42 GLN C C 42 177.196 177.196 177.769 -0.573 18497
3746 1 11 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.291 -0.071 18497
3747 1 11 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.825 -0.425 18497
3748 1 11 . 1 1 42 42 GLN H H 42 8.719 8.719 8.867 -0.148 18497
3749 1 11 . 1 1 43 43 LEU N N 43 118.960 118.960 118.362 0.598 18497
3750 1 11 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.919 -0.234 18497
3751 1 11 . 1 1 43 43 LEU C C 43 178.066 178.066 178.563 -0.497 18497
3752 1 11 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.648 0.712 18497
3753 1 11 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.188 -0.798 18497
3754 1 11 . 1 1 43 43 LEU H H 43 8.206 8.206 8.251 -0.045 18497
3755 1 11 . 1 1 44 44 ALA N N 44 121.666 121.666 123.172 -1.506 18497
3756 1 11 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.103 -0.224 18497
3757 1 11 . 1 1 44 44 ALA C C 44 178.327 178.327 179.439 -1.112 18497
3758 1 11 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.998 -0.289 18497
3759 1 11 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.235 0.345 18497
3760 1 11 . 1 1 44 44 ALA H H 44 7.402 7.402 7.575 -0.173 18497
3761 1 11 . 1 1 45 45 VAL N N 45 118.589 118.589 120.004 -1.415 18497
3762 1 11 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.629 0.031 18497
3763 1 11 . 1 1 45 45 VAL C C 45 179.893 179.893 177.998 1.895 18497
3764 1 11 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.552 -0.152 18497
3765 1 11 . 1 1 45 45 VAL CB C 45 32.131 32.131 30.804 1.327 18497
3766 1 11 . 1 1 45 45 VAL H H 45 8.449 8.449 8.584 -0.135 18497
3767 1 11 . 1 1 46 46 ALA N N 46 121.006 121.006 122.570 -1.564 18497
3768 1 11 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.712 0.418 18497
3769 1 11 . 1 1 46 46 ALA C C 46 179.110 179.110 179.193 -0.083 18497
3770 1 11 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.043 -0.073 18497
3771 1 11 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.160 1.950 18497
3772 1 11 . 1 1 46 46 ALA H H 46 7.654 7.654 8.007 -0.353 18497
3773 1 11 . 1 1 47 47 TYR N N 47 119.140 119.140 119.666 -0.526 18497
3774 1 11 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.993 -0.243 18497
3775 1 11 . 1 1 47 47 TYR C C 47 179.328 179.328 177.630 1.698 18497
3776 1 11 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.120 -0.240 18497
3777 1 11 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.483 0.017 18497
3778 1 11 . 1 1 47 47 TYR H H 47 8.077 8.077 8.034 0.043 18497
3779 1 11 . 1 1 48 48 HIS N N 48 116.422 116.422 119.087 -2.665 18497
3780 1 11 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.196 -0.096 18497
3781 1 11 . 1 1 48 48 HIS C C 48 178.023 178.023 177.680 0.343 18497
3782 1 11 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.061 -0.041 18497
3783 1 11 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.080 -1.140 18497
3784 1 11 . 1 1 48 48 HIS H H 48 8.326 8.326 8.470 -0.144 18497
3785 1 11 . 1 1 49 49 LEU N N 49 120.974 120.974 120.347 0.627 18497
3786 1 11 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.312 -0.157 18497
3787 1 11 . 1 1 49 49 LEU C C 49 177.417 177.417 179.814 -2.397 18497
3788 1 11 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.027 -0.137 18497
3789 1 11 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.560 0.400 18497
3790 1 11 . 1 1 49 49 LEU H H 49 8.237 8.237 8.430 -0.193 18497
3791 1 11 . 1 1 50 50 ILE N N 50 119.715 119.715 119.769 -0.054 18497
3792 1 11 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.889 -0.269 18497
3793 1 11 . 1 1 50 50 ILE C C 50 179.502 179.502 178.147 1.355 18497
3794 1 11 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.202 -0.142 18497
3795 1 11 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.916 0.054 18497
3796 1 11 . 1 1 50 50 ILE H H 50 7.543 7.543 8.498 -0.955 18497
3797 1 11 . 1 1 51 51 ILE N N 51 117.995 117.995 122.472 -4.477 18497
3798 1 11 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.397 0.143 18497
3799 1 11 . 1 1 51 51 ILE C C 51 179.197 179.197 177.325 1.872 18497
3800 1 11 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.673 -1.933 18497
3801 1 11 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.335 -0.685 18497
3802 1 11 . 1 1 51 51 ILE H H 51 7.475 7.475 8.038 -0.563 18497
3803 1 11 . 1 1 52 52 ASP N N 52 121.642 121.642 120.366 1.276 18497
3804 1 11 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.280 0.160 18497
3805 1 11 . 1 1 52 52 ASP C C 52 179.197 179.197 178.802 0.395 18497
3806 1 11 . 1 1 52 52 ASP CA C 52 57.100 57.100 58.016 -0.916 18497
3807 1 11 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.048 0.252 18497
3808 1 11 . 1 1 52 52 ASP H H 52 8.559 8.559 8.457 0.102 18497
3809 1 11 . 1 1 53 53 ASN N N 53 117.131 117.131 119.564 -2.433 18497
3810 1 11 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.351 0.259 18497
3811 1 11 . 1 1 53 53 ASN C C 53 178.545 178.545 177.415 1.130 18497
3812 1 11 . 1 1 53 53 ASN CA C 53 54.700 54.700 55.884 -1.184 18497
3813 1 11 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.580 0.120 18497
3814 1 11 . 1 1 53 53 ASN H H 53 8.106 8.106 8.187 -0.081 18497
3815 1 11 . 1 1 54 54 ARG N N 54 119.929 119.929 119.924 0.005 18497
3816 1 11 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.981 0.139 18497
3817 1 11 . 1 1 54 54 ARG C C 54 176.892 176.892 178.316 -1.424 18497
3818 1 11 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.060 -0.900 18497
3819 1 11 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.244 0.026 18497
3820 1 11 . 1 1 54 54 ARG H H 54 7.797 7.797 8.221 -0.424 18497
3821 1 11 . 1 1 55 55 ARG N N 55 119.227 119.227 115.240 3.987 18497
3822 1 11 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.344 -0.170 18497
3823 1 11 . 1 1 55 55 ARG C C 55 175.108 175.108 178.087 -2.979 18497
3824 1 11 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.061 3.819 18497
3825 1 11 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.839 0.821 18497
3826 1 11 . 1 1 55 55 ARG H H 55 7.857 7.857 8.057 -0.201 18497
3827 1 11 . 1 1 56 56 ILE N N 56 116.676 116.676 119.100 -2.424 18497
3828 1 11 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.044 -0.034 18497
3829 1 11 . 1 1 56 56 ILE C C 56 176.065 176.065 177.151 -1.086 18497
3830 1 11 . 1 1 56 56 ILE CA C 56 62.140 62.140 63.843 -1.703 18497
3831 1 11 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.653 -0.413 18497
3832 1 11 . 1 1 56 56 ILE H H 56 8.317 8.317 8.369 -0.052 18497
3833 1 11 . 1 1 57 57 MET N N 57 122.058 122.058 118.296 3.762 18497
3834 1 11 . 1 1 57 57 MET HA H 57 4.420 4.420 4.244 0.176 18497
3835 1 11 . 1 1 57 57 MET C C 57 177.283 177.283 177.919 -0.636 18497
3836 1 11 . 1 1 57 57 MET CA C 57 56.030 56.030 57.835 -1.805 18497
3837 1 11 . 1 1 57 57 MET CB C 57 32.515 32.515 32.313 0.202 18497
3838 1 11 . 1 1 57 57 MET H H 57 8.177 8.177 7.899 0.278 18497
3839 1 11 . 1 1 58 58 ASN N N 58 118.892 118.892 116.578 2.314 18497
3840 1 11 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.499 0.191 18497
3841 1 11 . 1 1 58 58 ASN C C 58 176.500 176.500 176.206 0.294 18497
3842 1 11 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.506 -1.853 18497
3843 1 11 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.835 -0.065 18497
3844 1 11 . 1 1 58 58 ASN H H 58 8.238 8.238 7.998 0.240 18497
3845 1 11 . 1 1 59 59 GLN N N 59 120.456 120.456 118.757 1.699 18497
3846 1 11 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.377 -0.067 18497
3847 1 11 . 1 1 59 59 GLN C C 59 175.326 175.326 176.042 -0.716 18497
3848 1 11 . 1 1 59 59 GLN CA C 59 56.030 56.030 56.044 -0.014 18497
3849 1 11 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.602 -1.802 18497
3850 1 11 . 1 1 59 59 GLN H H 59 8.196 8.196 7.585 0.611 18497
3851 1 11 . 1 1 60 60 ALA N N 60 125.116 125.116 123.712 1.404 18497
3852 1 11 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.257 0.125 18497
3853 1 11 . 1 1 60 60 ALA CA C 60 52.300 52.300 52.444 -0.144 18497
3854 1 11 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.488 -0.378 18497
3855 1 11 . 1 1 60 60 ALA H H 60 8.293 8.293 7.857 0.436 18497
3856 1 11 . 1 1 61 61 SER N N 61 115.686 115.686 115.801 -0.115 18497
3857 1 11 . 1 1 61 61 SER HA H 61 4.470 4.470 4.412 0.058 18497
3858 1 11 . 1 1 61 61 SER C C 61 175.674 175.674 174.436 1.238 18497
3859 1 11 . 1 1 61 61 SER CA C 61 58.160 58.160 58.429 -0.269 18497
3860 1 11 . 1 1 61 61 SER CB C 61 63.740 63.740 63.304 0.436 18497
3861 1 11 . 1 1 61 61 SER H H 61 8.290 8.290 8.389 -0.099 18497
3862 1 12 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.811 -0.381 18497
3863 1 12 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.423 -0.476 18497
3864 1 12 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.434 -0.304 18497
3865 1 12 . 1 1 3 3 HIS N N 3 119.985 119.985 117.512 2.473 18497
3866 1 12 . 1 1 3 3 HIS HA H 3 4.606 4.606 5.038 -0.432 18497
3867 1 12 . 1 1 3 3 HIS C C 3 176.587 176.587 173.454 3.133 18497
3868 1 12 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.027 1.158 18497
3869 1 12 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.918 -0.447 18497
3870 1 12 . 1 1 3 3 HIS H H 3 8.526 8.526 8.331 0.195 18497
3871 1 12 . 1 1 4 4 MET N N 4 122.338 122.338 120.310 2.028 18497
3872 1 12 . 1 1 4 4 MET HA H 4 4.448 4.448 4.740 -0.292 18497
3873 1 12 . 1 1 4 4 MET C C 4 175.108 175.108 177.389 -2.281 18497
3874 1 12 . 1 1 4 4 MET CA C 4 55.562 55.562 54.594 0.968 18497
3875 1 12 . 1 1 4 4 MET CB C 4 33.141 33.141 35.614 -2.473 18497
3876 1 12 . 1 1 4 4 MET H H 4 8.337 8.337 8.426 -0.089 18497
3877 1 12 . 1 1 5 5 SER N N 5 116.990 116.990 116.850 0.140 18497
3878 1 12 . 1 1 5 5 SER HA H 5 4.400 4.400 4.397 0.003 18497
3879 1 12 . 1 1 5 5 SER C C 5 177.979 177.979 175.832 2.147 18497
3880 1 12 . 1 1 5 5 SER CA C 5 58.039 58.039 59.670 -1.631 18497
3881 1 12 . 1 1 5 5 SER CB C 5 63.797 63.797 63.297 0.499 18497
3882 1 12 . 1 1 5 5 SER H H 5 8.330 8.330 8.820 -0.490 18497
3883 1 12 . 1 1 6 6 TYR N N 6 122.027 122.027 123.744 -1.717 18497
3884 1 12 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.154 0.356 18497
3885 1 12 . 1 1 6 6 TYR C C 6 174.060 174.060 176.986 -2.926 18497
3886 1 12 . 1 1 6 6 TYR CA C 6 57.800 57.800 60.719 -2.919 18497
3887 1 12 . 1 1 6 6 TYR CB C 6 38.685 38.685 38.471 0.214 18497
3888 1 12 . 1 1 6 6 TYR H H 6 8.201 8.201 8.296 -0.095 18497
3889 1 12 . 1 1 7 7 ASP N N 7 122.439 122.439 119.473 2.966 18497
3890 1 12 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.324 0.225 18497
3891 1 12 . 1 1 7 7 ASP C C 7 175.150 175.150 177.234 -2.084 18497
3892 1 12 . 1 1 7 7 ASP CA C 7 53.640 53.640 56.622 -2.982 18497
3893 1 12 . 1 1 7 7 ASP CB C 7 41.300 41.300 40.648 0.652 18497
3894 1 12 . 1 1 7 7 ASP H H 7 8.119 8.119 8.296 -0.177 18497
3895 1 12 . 1 1 8 8 ALA N N 8 124.655 124.655 120.609 4.046 18497
3896 1 12 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.139 0.091 18497
3897 1 12 . 1 1 8 8 ALA C C 8 175.935 175.935 178.845 -2.910 18497
3898 1 12 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.942 -1.049 18497
3899 1 12 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.559 -0.709 18497
3900 1 12 . 1 1 8 8 ALA H H 8 8.235 8.235 7.566 0.669 18497
3901 1 12 . 1 1 9 9 ASN N N 9 116.133 116.133 117.435 -1.302 18497
3902 1 12 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.592 0.098 18497
3903 1 12 . 1 1 9 9 ASN C C 9 177.718 177.718 176.154 1.564 18497
3904 1 12 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.514 -0.714 18497
3905 1 12 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.279 -0.509 18497
3906 1 12 . 1 1 9 9 ASN H H 9 8.417 8.417 7.986 0.431 18497
3907 1 12 . 1 1 10 10 VAL N N 10 119.557 119.557 121.236 -1.679 18497
3908 1 12 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.740 0.437 18497
3909 1 12 . 1 1 10 10 VAL C C 10 174.930 174.930 175.450 -0.520 18497
3910 1 12 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.526 -1.646 18497
3911 1 12 . 1 1 10 10 VAL CB C 10 32.660 32.660 31.746 0.914 18497
3912 1 12 . 1 1 10 10 VAL H H 10 7.859 7.859 7.592 0.267 18497
3913 1 12 . 1 1 11 11 ILE N N 11 126.561 126.561 127.190 -0.629 18497
3914 1 12 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.481 -0.441 18497
3915 1 12 . 1 1 11 11 ILE C C 11 175.935 175.935 174.717 1.218 18497
3916 1 12 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.522 -0.022 18497
3917 1 12 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.757 -4.057 18497
3918 1 12 . 1 1 11 11 ILE H H 11 8.283 8.283 7.998 0.285 18497
3919 1 12 . 1 1 12 12 ASP N N 12 128.161 128.161 126.494 1.667 18497
3920 1 12 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.827 -0.097 18497
3921 1 12 . 1 1 12 12 ASP C C 12 174.891 174.891 177.030 -2.139 18497
3922 1 12 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.840 -0.413 18497
3923 1 12 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.985 0.235 18497
3924 1 12 . 1 1 12 12 ASP H H 12 8.477 8.477 8.532 -0.055 18497
3925 1 12 . 1 1 13 13 ASP N N 13 127.435 127.435 127.014 0.421 18497
3926 1 12 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.295 0.021 18497
3927 1 12 . 1 1 13 13 ASP C C 13 175.369 175.369 177.763 -2.394 18497
3928 1 12 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.404 0.196 18497
3929 1 12 . 1 1 13 13 ASP CB C 13 41.160 41.160 40.877 0.283 18497
3930 1 12 . 1 1 13 13 ASP H H 13 8.698 8.698 8.861 -0.163 18497
3931 1 12 . 1 1 14 14 GLU N N 14 119.796 119.796 119.861 -0.065 18497
3932 1 12 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.151 -0.116 18497
3933 1 12 . 1 1 14 14 GLU C C 14 178.588 178.588 178.710 -0.122 18497
3934 1 12 . 1 1 14 14 GLU CA C 14 59.500 59.500 58.738 0.762 18497
3935 1 12 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.297 -0.397 18497
3936 1 12 . 1 1 14 14 GLU H H 14 8.205 8.205 7.960 0.245 18497
3937 1 12 . 1 1 15 15 ALA N N 15 124.156 124.156 123.621 0.535 18497
3938 1 12 . 1 1 15 15 ALA HA H 15 4.176 4.176 3.980 0.196 18497
3939 1 12 . 1 1 15 15 ALA C C 15 179.502 179.502 179.468 0.034 18497
3940 1 12 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.366 -0.366 18497
3941 1 12 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.193 0.707 18497
3942 1 12 . 1 1 15 15 ALA H H 15 8.473 8.473 8.272 0.201 18497
3943 1 12 . 1 1 16 16 VAL N N 16 117.585 117.585 118.774 -1.189 18497
3944 1 12 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.531 0.003 18497
3945 1 12 . 1 1 16 16 VAL C C 16 179.545 179.545 178.275 1.270 18497
3946 1 12 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.157 0.843 18497
3947 1 12 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.677 -0.077 18497
3948 1 12 . 1 1 16 16 VAL H H 16 8.181 8.181 8.441 -0.260 18497
3949 1 12 . 1 1 17 17 LYS N N 17 119.377 119.377 119.208 0.169 18497
3950 1 12 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.950 0.006 18497
3951 1 12 . 1 1 17 17 LYS C C 17 178.197 178.197 179.219 -1.022 18497
3952 1 12 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.796 0.224 18497
3953 1 12 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.152 -0.022 18497
3954 1 12 . 1 1 17 17 LYS H H 17 8.001 8.001 8.206 -0.205 18497
3955 1 12 . 1 1 18 18 GLU N N 18 120.395 120.395 119.588 0.807 18497
3956 1 12 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.093 0.047 18497
3957 1 12 . 1 1 18 18 GLU C C 18 178.849 178.849 179.088 -0.239 18497
3958 1 12 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.305 0.495 18497
3959 1 12 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.613 -0.120 18497
3960 1 12 . 1 1 18 18 GLU H H 18 7.943 7.943 7.989 -0.046 18497
3961 1 12 . 1 1 19 19 VAL N N 19 121.088 121.088 119.811 1.277 18497
3962 1 12 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.765 -0.115 18497
3963 1 12 . 1 1 19 19 VAL C C 19 179.415 179.415 178.707 0.708 18497
3964 1 12 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.574 1.406 18497
3965 1 12 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.233 0.367 18497
3966 1 12 . 1 1 19 19 VAL H H 19 8.335 8.335 8.735 -0.400 18497
3967 1 12 . 1 1 20 20 CYS N N 20 117.290 117.290 119.094 -1.804 18497
3968 1 12 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.281 0.399 18497
3969 1 12 . 1 1 20 20 CYS C C 20 178.110 178.110 176.558 1.552 18497
3970 1 12 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.956 0.244 18497
3971 1 12 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.127 -0.327 18497
3972 1 12 . 1 1 20 20 CYS H H 20 8.434 8.434 7.736 0.698 18497
3973 1 12 . 1 1 21 21 GLU N N 21 118.195 118.195 118.210 -0.015 18497
3974 1 12 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.214 -0.075 18497
3975 1 12 . 1 1 21 21 GLU C C 21 178.153 178.153 178.104 0.049 18497
3976 1 12 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.324 1.426 18497
3977 1 12 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.325 0.175 18497
3978 1 12 . 1 1 21 21 GLU H H 21 7.972 7.972 7.975 -0.003 18497
3979 1 12 . 1 1 22 22 LYS N N 22 119.095 119.095 119.236 -0.141 18497
3980 1 12 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.213 -0.208 18497
3981 1 12 . 1 1 22 22 LYS C C 22 179.371 179.371 177.649 1.722 18497
3982 1 12 . 1 1 22 22 LYS CA C 22 58.700 58.700 57.806 0.894 18497
3983 1 12 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.761 0.159 18497
3984 1 12 . 1 1 22 22 LYS H H 22 8.071 8.071 8.266 -0.195 18497
3985 1 12 . 1 1 23 23 PHE N N 23 114.252 114.252 118.492 -4.240 18497
3986 1 12 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.552 -0.122 18497
3987 1 12 . 1 1 23 23 PHE C C 23 178.197 178.197 174.508 3.689 18497
3988 1 12 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.283 0.147 18497
3989 1 12 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.208 -1.438 18497
3990 1 12 . 1 1 23 23 PHE H H 23 8.491 8.491 7.720 0.771 18497
3991 1 12 . 1 1 24 24 GLU N N 24 119.819 119.819 117.782 2.037 18497
3992 1 12 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.050 0.020 18497
3993 1 12 . 1 1 24 24 GLU C C 24 177.457 177.457 175.274 2.183 18497
3994 1 12 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.145 -0.314 18497
3995 1 12 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.412 -0.612 18497
3996 1 12 . 1 1 24 24 GLU H H 24 7.867 7.867 8.264 -0.397 18497
3997 1 12 . 1 1 25 25 CYS N N 25 114.633 114.633 119.082 -4.449 18497
3998 1 12 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.921 0.466 18497
3999 1 12 . 1 1 25 25 CYS C C 25 174.760 174.760 173.884 0.876 18497
4000 1 12 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.108 -2.348 18497
4001 1 12 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.850 0.750 18497
4002 1 12 . 1 1 25 25 CYS H H 25 8.156 8.156 8.548 -0.392 18497
4003 1 12 . 1 1 26 26 THR N N 26 109.312 109.312 113.587 -4.275 18497
4004 1 12 . 1 1 26 26 THR HA H 26 4.770 4.770 4.585 0.185 18497
4005 1 12 . 1 1 26 26 THR C C 26 173.499 173.499 175.057 -1.558 18497
4006 1 12 . 1 1 26 26 THR CA C 26 60.723 60.723 61.228 -0.505 18497
4007 1 12 . 1 1 26 26 THR CB C 26 72.000 72.000 70.485 1.515 18497
4008 1 12 . 1 1 26 26 THR H H 26 8.460 8.460 8.325 0.135 18497
4009 1 12 . 1 1 27 27 GLU N N 27 122.233 122.233 124.062 -1.829 18497
4010 1 12 . 1 1 27 27 GLU HA H 27 3.510 3.510 4.001 -0.491 18497
4011 1 12 . 1 1 27 27 GLU C C 27 176.544 176.544 177.449 -0.905 18497
4012 1 12 . 1 1 27 27 GLU CA C 27 60.550 60.550 59.690 0.860 18497
4013 1 12 . 1 1 27 27 GLU CB C 27 28.950 28.950 28.899 0.051 18497
4014 1 12 . 1 1 27 27 GLU H H 27 9.327 9.327 8.986 0.341 18497
4015 1 12 . 1 1 28 28 SER N N 28 112.925 112.925 116.485 -3.560 18497
4016 1 12 . 1 1 28 28 SER HA H 28 4.062 4.062 4.184 -0.122 18497
4017 1 12 . 1 1 28 28 SER C C 28 178.545 178.545 176.083 2.462 18497
4018 1 12 . 1 1 28 28 SER CA C 28 61.350 61.350 61.904 -0.555 18497
4019 1 12 . 1 1 28 28 SER CB C 28 62.400 62.400 62.440 -0.040 18497
4020 1 12 . 1 1 28 28 SER H H 28 8.320 8.320 8.392 -0.072 18497
4021 1 12 . 1 1 29 29 GLU N N 29 121.736 121.736 120.925 0.811 18497
4022 1 12 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.103 -0.113 18497
4023 1 12 . 1 1 29 29 GLU C C 29 176.674 176.674 178.249 -1.575 18497
4024 1 12 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.459 1.291 18497
4025 1 12 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.288 0.182 18497
4026 1 12 . 1 1 29 29 GLU H H 29 7.512 7.512 7.719 -0.207 18497
4027 1 12 . 1 1 30 30 VAL N N 30 119.480 119.480 120.574 -1.094 18497
4028 1 12 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.679 -0.302 18497
4029 1 12 . 1 1 30 30 VAL C C 30 179.241 179.241 178.254 0.987 18497
4030 1 12 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.136 0.524 18497
4031 1 12 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.599 -0.530 18497
4032 1 12 . 1 1 30 30 VAL H H 30 7.492 7.492 7.716 -0.224 18497
4033 1 12 . 1 1 31 31 MET N N 31 117.220 117.220 118.110 -0.890 18497
4034 1 12 . 1 1 31 31 MET HA H 31 3.870 3.870 3.764 0.106 18497
4035 1 12 . 1 1 31 31 MET C C 31 177.936 177.936 178.194 -0.258 18497
4036 1 12 . 1 1 31 31 MET CA C 31 57.630 57.630 59.563 -1.933 18497
4037 1 12 . 1 1 31 31 MET CB C 31 30.270 30.270 32.178 -1.908 18497
4038 1 12 . 1 1 31 31 MET H H 31 8.302 8.302 7.769 0.533 18497
4039 1 12 . 1 1 32 32 ASN N N 32 116.672 116.672 118.105 -1.433 18497
4040 1 12 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.449 -0.059 18497
4041 1 12 . 1 1 32 32 ASN C C 32 176.065 176.065 177.600 -1.535 18497
4042 1 12 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.703 -0.673 18497
4043 1 12 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.825 -1.115 18497
4044 1 12 . 1 1 32 32 ASN H H 32 8.313 8.313 8.317 -0.004 18497
4045 1 12 . 1 1 33 33 SER N N 33 117.471 117.471 114.280 3.191 18497
4046 1 12 . 1 1 33 33 SER HA H 33 4.150 4.150 4.260 -0.110 18497
4047 1 12 . 1 1 33 33 SER C C 33 178.806 178.806 175.954 2.852 18497
4048 1 12 . 1 1 33 33 SER CA C 33 62.950 62.950 60.683 2.267 18497
4049 1 12 . 1 1 33 33 SER CB C 33 62.600 62.600 63.318 -0.718 18497
4050 1 12 . 1 1 33 33 SER H H 33 7.851 7.851 7.903 -0.052 18497
4051 1 12 . 1 1 34 34 LEU N N 34 122.839 122.839 120.149 2.690 18497
4052 1 12 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.229 -0.350 18497
4053 1 12 . 1 1 34 34 LEU C C 34 177.892 177.892 177.163 0.729 18497
4054 1 12 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.188 1.442 18497
4055 1 12 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.281 -1.480 18497
4056 1 12 . 1 1 34 34 LEU H H 34 8.128 8.128 7.222 0.906 18497
4057 1 12 . 1 1 35 35 TYR N N 35 116.666 116.666 119.069 -2.403 18497
4058 1 12 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.453 0.157 18497
4059 1 12 . 1 1 35 35 TYR C C 35 179.067 179.067 176.411 2.656 18497
4060 1 12 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.395 -1.505 18497
4061 1 12 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.011 -3.301 18497
4062 1 12 . 1 1 35 35 TYR H H 35 7.924 7.924 7.733 0.191 18497
4063 1 12 . 1 1 36 36 SER N N 36 114.801 114.801 111.063 3.738 18497
4064 1 12 . 1 1 36 36 SER HA H 36 4.080 4.080 4.441 -0.361 18497
4065 1 12 . 1 1 36 36 SER C C 36 177.283 177.283 175.589 1.694 18497
4066 1 12 . 1 1 36 36 SER CA C 36 60.519 60.519 57.969 2.550 18497
4067 1 12 . 1 1 36 36 SER CB C 36 64.240 64.240 65.641 -1.401 18497
4068 1 12 . 1 1 36 36 SER H H 36 7.715 7.715 8.510 -0.795 18497
4069 1 12 . 1 1 37 37 GLY N N 37 109.803 109.803 111.842 -2.039 18497
4070 1 12 . 1 1 37 37 GLY C C 37 175.978 175.978 172.706 3.272 18497
4071 1 12 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.058 0.620 18497
4072 1 12 . 1 1 37 37 GLY H H 37 8.017 8.017 7.787 0.230 18497
4073 1 12 . 1 1 38 38 ASP N N 38 120.613 120.613 118.882 1.731 18497
4074 1 12 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.993 0.032 18497
4075 1 12 . 1 1 38 38 ASP C C 38 173.368 173.368 174.617 -1.249 18497
4076 1 12 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.840 -1.120 18497
4077 1 12 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.138 -1.718 18497
4078 1 12 . 1 1 38 38 ASP H H 38 8.006 8.006 8.085 -0.079 18497
4079 1 12 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.335 0.005 18497
4080 1 12 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.308 -0.558 18497
4081 1 12 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.156 -0.026 18497
4082 1 12 . 1 1 40 40 GLN N N 40 115.056 115.056 114.750 0.306 18497
4083 1 12 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.325 -0.045 18497
4084 1 12 . 1 1 40 40 GLN C C 40 177.066 177.066 176.365 0.701 18497
4085 1 12 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.378 -0.668 18497
4086 1 12 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.323 0.357 18497
4087 1 12 . 1 1 40 40 GLN H H 40 8.237 8.237 8.015 0.222 18497
4088 1 12 . 1 1 41 41 ASP N N 41 122.839 122.839 120.552 2.287 18497
4089 1 12 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.541 -0.228 18497
4090 1 12 . 1 1 41 41 ASP C C 41 175.804 175.804 177.354 -1.550 18497
4091 1 12 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.647 0.593 18497
4092 1 12 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.548 -0.328 18497
4093 1 12 . 1 1 41 41 ASP H H 41 7.211 7.211 7.721 -0.510 18497
4094 1 12 . 1 1 42 42 GLN N N 42 124.547 124.547 122.656 1.891 18497
4095 1 12 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.031 -0.171 18497
4096 1 12 . 1 1 42 42 GLN C C 42 177.196 177.196 177.831 -0.635 18497
4097 1 12 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.439 -0.219 18497
4098 1 12 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.001 -0.601 18497
4099 1 12 . 1 1 42 42 GLN H H 42 8.719 8.719 8.857 -0.138 18497
4100 1 12 . 1 1 43 43 LEU N N 43 118.960 118.960 119.173 -0.213 18497
4101 1 12 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.792 -0.107 18497
4102 1 12 . 1 1 43 43 LEU C C 43 178.066 178.066 178.313 -0.247 18497
4103 1 12 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.938 0.422 18497
4104 1 12 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.433 -1.043 18497
4105 1 12 . 1 1 43 43 LEU H H 43 8.206 8.206 8.277 -0.071 18497
4106 1 12 . 1 1 44 44 ALA N N 44 121.666 121.666 123.155 -1.489 18497
4107 1 12 . 1 1 44 44 ALA HA H 44 3.879 3.879 3.875 0.004 18497
4108 1 12 . 1 1 44 44 ALA C C 44 178.327 178.327 179.528 -1.201 18497
4109 1 12 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.984 -0.274 18497
4110 1 12 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.153 0.427 18497
4111 1 12 . 1 1 44 44 ALA H H 44 7.402 7.402 7.759 -0.357 18497
4112 1 12 . 1 1 45 45 VAL N N 45 118.589 118.589 119.919 -1.330 18497
4113 1 12 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.693 -0.033 18497
4114 1 12 . 1 1 45 45 VAL C C 45 179.893 179.893 177.937 1.956 18497
4115 1 12 . 1 1 45 45 VAL CA C 45 66.400 66.400 67.033 -0.633 18497
4116 1 12 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.241 0.890 18497
4117 1 12 . 1 1 45 45 VAL H H 45 8.449 8.449 8.516 -0.067 18497
4118 1 12 . 1 1 46 46 ALA N N 46 121.006 121.006 122.530 -1.524 18497
4119 1 12 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.774 0.356 18497
4120 1 12 . 1 1 46 46 ALA C C 46 179.110 179.110 179.141 -0.031 18497
4121 1 12 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.007 -0.036 18497
4122 1 12 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.262 1.848 18497
4123 1 12 . 1 1 46 46 ALA H H 46 7.654 7.654 7.780 -0.126 18497
4124 1 12 . 1 1 47 47 TYR N N 47 119.140 119.140 119.905 -0.765 18497
4125 1 12 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.904 -0.154 18497
4126 1 12 . 1 1 47 47 TYR C C 47 179.328 179.328 177.573 1.755 18497
4127 1 12 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.845 0.035 18497
4128 1 12 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.280 0.220 18497
4129 1 12 . 1 1 47 47 TYR H H 47 8.077 8.077 8.199 -0.122 18497
4130 1 12 . 1 1 48 48 HIS N N 48 116.422 116.422 117.389 -0.967 18497
4131 1 12 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.170 -0.070 18497
4132 1 12 . 1 1 48 48 HIS C C 48 178.023 178.023 177.994 0.029 18497
4133 1 12 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.140 -0.120 18497
4134 1 12 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.753 -0.813 18497
4135 1 12 . 1 1 48 48 HIS H H 48 8.326 8.326 8.358 -0.032 18497
4136 1 12 . 1 1 49 49 LEU N N 49 120.974 120.974 120.695 0.279 18497
4137 1 12 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.097 0.058 18497
4138 1 12 . 1 1 49 49 LEU C C 49 177.417 177.417 179.532 -2.115 18497
4139 1 12 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.011 -0.121 18497
4140 1 12 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.810 0.150 18497
4141 1 12 . 1 1 49 49 LEU H H 49 8.237 8.237 8.557 -0.320 18497
4142 1 12 . 1 1 50 50 ILE N N 50 119.715 119.715 119.914 -0.199 18497
4143 1 12 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.617 0.003 18497
4144 1 12 . 1 1 50 50 ILE C C 50 179.502 179.502 177.943 1.559 18497
4145 1 12 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.670 -0.610 18497
4146 1 12 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.982 -0.012 18497
4147 1 12 . 1 1 50 50 ILE H H 50 7.543 7.543 8.475 -0.932 18497
4148 1 12 . 1 1 51 51 ILE N N 51 117.995 117.995 121.390 -3.395 18497
4149 1 12 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.405 0.135 18497
4150 1 12 . 1 1 51 51 ILE C C 51 179.197 179.197 177.781 1.416 18497
4151 1 12 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.910 -2.171 18497
4152 1 12 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.377 -0.727 18497
4153 1 12 . 1 1 51 51 ILE H H 51 7.475 7.475 7.952 -0.477 18497
4154 1 12 . 1 1 52 52 ASP N N 52 121.642 121.642 120.614 1.028 18497
4155 1 12 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.297 0.143 18497
4156 1 12 . 1 1 52 52 ASP C C 52 179.197 179.197 178.769 0.428 18497
4157 1 12 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.691 -0.591 18497
4158 1 12 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.021 0.279 18497
4159 1 12 . 1 1 52 52 ASP H H 52 8.559 8.559 8.475 0.084 18497
4160 1 12 . 1 1 53 53 ASN N N 53 117.131 117.131 118.627 -1.496 18497
4161 1 12 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.479 0.131 18497
4162 1 12 . 1 1 53 53 ASN C C 53 178.545 178.545 178.202 0.343 18497
4163 1 12 . 1 1 53 53 ASN CA C 53 54.700 54.700 55.730 -1.030 18497
4164 1 12 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.263 0.437 18497
4165 1 12 . 1 1 53 53 ASN H H 53 8.106 8.106 8.336 -0.230 18497
4166 1 12 . 1 1 54 54 ARG N N 54 119.929 119.929 119.846 0.083 18497
4167 1 12 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.971 0.149 18497
4168 1 12 . 1 1 54 54 ARG C C 54 176.892 176.892 177.347 -0.455 18497
4169 1 12 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.211 -1.051 18497
4170 1 12 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.008 0.262 18497
4171 1 12 . 1 1 54 54 ARG H H 54 7.797 7.797 8.185 -0.388 18497
4172 1 12 . 1 1 55 55 ARG N N 55 119.227 119.227 118.126 1.101 18497
4173 1 12 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.139 0.035 18497
4174 1 12 . 1 1 55 55 ARG C C 55 175.108 175.108 177.628 -2.520 18497
4175 1 12 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.894 2.986 18497
4176 1 12 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.226 1.434 18497
4177 1 12 . 1 1 55 55 ARG H H 55 7.857 7.857 7.807 0.050 18497
4178 1 12 . 1 1 56 56 ILE N N 56 116.676 116.676 112.564 4.112 18497
4179 1 12 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.331 -0.321 18497
4180 1 12 . 1 1 56 56 ILE C C 56 176.065 176.065 176.847 -0.782 18497
4181 1 12 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.124 0.016 18497
4182 1 12 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.520 -1.280 18497
4183 1 12 . 1 1 56 56 ILE H H 56 8.317 8.317 8.107 0.210 18497
4184 1 12 . 1 1 57 57 MET N N 57 122.058 122.058 117.314 4.744 18497
4185 1 12 . 1 1 57 57 MET HA H 57 4.420 4.420 4.459 -0.039 18497
4186 1 12 . 1 1 57 57 MET C C 57 177.283 177.283 177.526 -0.243 18497
4187 1 12 . 1 1 57 57 MET CA C 57 56.030 56.030 56.511 -0.481 18497
4188 1 12 . 1 1 57 57 MET CB C 57 32.515 32.515 33.516 -1.001 18497
4189 1 12 . 1 1 57 57 MET H H 57 8.177 8.177 7.727 0.450 18497
4190 1 12 . 1 1 58 58 ASN N N 58 118.892 118.892 119.105 -0.213 18497
4191 1 12 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.524 0.166 18497
4192 1 12 . 1 1 58 58 ASN C C 58 176.500 176.500 174.996 1.504 18497
4193 1 12 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.920 -1.267 18497
4194 1 12 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.387 -0.617 18497
4195 1 12 . 1 1 58 58 ASN H H 58 8.238 8.238 7.901 0.337 18497
4196 1 12 . 1 1 59 59 GLN N N 59 120.456 120.456 117.608 2.848 18497
4197 1 12 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.389 -0.079 18497
4198 1 12 . 1 1 59 59 GLN C C 59 175.326 175.326 174.608 0.718 18497
4199 1 12 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.757 0.273 18497
4200 1 12 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.572 -1.772 18497
4201 1 12 . 1 1 59 59 GLN H H 59 8.196 8.196 7.654 0.542 18497
4202 1 12 . 1 1 60 60 ALA N N 60 125.116 125.116 128.614 -3.498 18497
4203 1 12 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.417 -0.035 18497
4204 1 12 . 1 1 60 60 ALA CA C 60 52.300 52.300 52.260 0.041 18497
4205 1 12 . 1 1 60 60 ALA CB C 60 19.110 19.110 17.059 2.051 18497
4206 1 12 . 1 1 60 60 ALA H H 60 8.293 8.293 8.684 -0.391 18497
4207 1 12 . 1 1 61 61 SER N N 61 115.686 115.686 114.945 0.741 18497
4208 1 12 . 1 1 61 61 SER HA H 61 4.470 4.470 4.225 0.245 18497
4209 1 12 . 1 1 61 61 SER C C 61 175.674 175.674 174.907 0.767 18497
4210 1 12 . 1 1 61 61 SER CA C 61 58.160 58.160 59.581 -1.421 18497
4211 1 12 . 1 1 61 61 SER CB C 61 63.740 63.740 63.636 0.104 18497
4212 1 12 . 1 1 61 61 SER H H 61 8.290 8.290 8.298 -0.008 18497
4213 1 13 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.539 -0.109 18497
4214 1 13 . 1 1 2 2 PRO CA C 2 62.947 62.947 61.945 1.002 18497
4215 1 13 . 1 1 2 2 PRO CB C 2 32.130 32.130 33.070 -0.940 18497
4216 1 13 . 1 1 3 3 HIS N N 3 119.985 119.985 119.683 0.302 18497
4217 1 13 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.360 0.246 18497
4218 1 13 . 1 1 3 3 HIS C C 3 176.587 176.587 176.939 -0.352 18497
4219 1 13 . 1 1 3 3 HIS CA C 3 56.185 56.185 58.457 -2.272 18497
4220 1 13 . 1 1 3 3 HIS CB C 3 30.471 30.471 29.681 0.790 18497
4221 1 13 . 1 1 3 3 HIS H H 3 8.526 8.526 8.576 -0.050 18497
4222 1 13 . 1 1 4 4 MET N N 4 122.338 122.338 118.235 4.103 18497
4223 1 13 . 1 1 4 4 MET HA H 4 4.448 4.448 4.339 0.109 18497
4224 1 13 . 1 1 4 4 MET C C 4 175.108 175.108 178.455 -3.347 18497
4225 1 13 . 1 1 4 4 MET CA C 4 55.562 55.562 56.864 -1.302 18497
4226 1 13 . 1 1 4 4 MET CB C 4 33.141 33.141 30.807 2.334 18497
4227 1 13 . 1 1 4 4 MET H H 4 8.337 8.337 8.355 -0.018 18497
4228 1 13 . 1 1 5 5 SER N N 5 116.990 116.990 114.421 2.569 18497
4229 1 13 . 1 1 5 5 SER HA H 5 4.400 4.400 4.161 0.239 18497
4230 1 13 . 1 1 5 5 SER C C 5 177.979 177.979 175.197 2.782 18497
4231 1 13 . 1 1 5 5 SER CA C 5 58.039 58.039 60.373 -2.334 18497
4232 1 13 . 1 1 5 5 SER CB C 5 63.797 63.797 63.425 0.372 18497
4233 1 13 . 1 1 5 5 SER H H 5 8.330 8.330 7.924 0.406 18497
4234 1 13 . 1 1 6 6 TYR N N 6 122.027 122.027 120.101 1.926 18497
4235 1 13 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.647 -0.137 18497
4236 1 13 . 1 1 6 6 TYR C C 6 174.060 174.060 176.532 -2.472 18497
4237 1 13 . 1 1 6 6 TYR CA C 6 57.800 57.800 59.167 -1.367 18497
4238 1 13 . 1 1 6 6 TYR CB C 6 38.685 38.685 40.530 -1.845 18497
4239 1 13 . 1 1 6 6 TYR H H 6 8.201 8.201 7.783 0.418 18497
4240 1 13 . 1 1 7 7 ASP N N 7 122.439 122.439 121.958 0.481 18497
4241 1 13 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.229 0.320 18497
4242 1 13 . 1 1 7 7 ASP C C 7 175.150 175.150 178.246 -3.096 18497
4243 1 13 . 1 1 7 7 ASP CA C 7 53.640 53.640 57.657 -4.017 18497
4244 1 13 . 1 1 7 7 ASP CB C 7 41.300 41.300 40.691 0.610 18497
4245 1 13 . 1 1 7 7 ASP H H 7 8.119 8.119 8.624 -0.505 18497
4246 1 13 . 1 1 8 8 ALA N N 8 124.655 124.655 121.023 3.632 18497
4247 1 13 . 1 1 8 8 ALA HA H 8 4.230 4.230 3.899 0.331 18497
4248 1 13 . 1 1 8 8 ALA C C 8 175.935 175.935 179.050 -3.115 18497
4249 1 13 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.426 -1.533 18497
4250 1 13 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.253 0.597 18497
4251 1 13 . 1 1 8 8 ALA H H 8 8.235 8.235 7.791 0.444 18497
4252 1 13 . 1 1 9 9 ASN N N 9 116.133 116.133 115.172 0.961 18497
4253 1 13 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.709 -0.019 18497
4254 1 13 . 1 1 9 9 ASN C C 9 177.718 177.718 175.306 2.412 18497
4255 1 13 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.687 0.113 18497
4256 1 13 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.240 -0.470 18497
4257 1 13 . 1 1 9 9 ASN H H 9 8.417 8.417 7.659 0.758 18497
4258 1 13 . 1 1 10 10 VAL N N 10 119.557 119.557 120.858 -1.301 18497
4259 1 13 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.950 0.227 18497
4260 1 13 . 1 1 10 10 VAL C C 10 174.930 174.930 174.841 0.089 18497
4261 1 13 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.372 -1.492 18497
4262 1 13 . 1 1 10 10 VAL CB C 10 32.660 32.660 31.688 0.972 18497
4263 1 13 . 1 1 10 10 VAL H H 10 7.859 7.859 7.583 0.276 18497
4264 1 13 . 1 1 11 11 ILE N N 11 126.561 126.561 127.837 -1.276 18497
4265 1 13 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.424 -0.384 18497
4266 1 13 . 1 1 11 11 ILE C C 11 175.935 175.935 174.761 1.174 18497
4267 1 13 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.754 -0.254 18497
4268 1 13 . 1 1 11 11 ILE CB C 11 37.700 37.700 43.002 -5.302 18497
4269 1 13 . 1 1 11 11 ILE H H 11 8.283 8.283 8.259 0.024 18497
4270 1 13 . 1 1 12 12 ASP N N 12 128.161 128.161 127.528 0.633 18497
4271 1 13 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.829 -0.099 18497
4272 1 13 . 1 1 12 12 ASP C C 12 174.891 174.891 175.963 -1.072 18497
4273 1 13 . 1 1 12 12 ASP CA C 12 53.427 53.427 54.698 -1.271 18497
4274 1 13 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.415 0.805 18497
4275 1 13 . 1 1 12 12 ASP H H 12 8.477 8.477 8.541 -0.064 18497
4276 1 13 . 1 1 13 13 ASP N N 13 127.435 127.435 126.432 1.003 18497
4277 1 13 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.297 0.019 18497
4278 1 13 . 1 1 13 13 ASP C C 13 175.369 175.369 177.404 -2.035 18497
4279 1 13 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.592 0.008 18497
4280 1 13 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.442 -0.282 18497
4281 1 13 . 1 1 13 13 ASP H H 13 8.698 8.698 8.748 -0.050 18497
4282 1 13 . 1 1 14 14 GLU N N 14 119.796 119.796 120.781 -0.985 18497
4283 1 13 . 1 1 14 14 GLU HA H 14 4.035 4.035 3.900 0.135 18497
4284 1 13 . 1 1 14 14 GLU C C 14 178.588 178.588 177.822 0.766 18497
4285 1 13 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.711 -0.211 18497
4286 1 13 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.243 -0.343 18497
4287 1 13 . 1 1 14 14 GLU H H 14 8.205 8.205 8.970 -0.765 18497
4288 1 13 . 1 1 15 15 ALA N N 15 124.156 124.156 122.676 1.480 18497
4289 1 13 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.018 0.158 18497
4290 1 13 . 1 1 15 15 ALA C C 15 179.502 179.502 179.466 0.036 18497
4291 1 13 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.606 0.394 18497
4292 1 13 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.172 0.728 18497
4293 1 13 . 1 1 15 15 ALA H H 15 8.473 8.473 7.910 0.563 18497
4294 1 13 . 1 1 16 16 VAL N N 16 117.585 117.585 119.180 -1.595 18497
4295 1 13 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.536 -0.002 18497
4296 1 13 . 1 1 16 16 VAL C C 16 179.545 179.545 177.923 1.622 18497
4297 1 13 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.137 0.863 18497
4298 1 13 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.500 0.100 18497
4299 1 13 . 1 1 16 16 VAL H H 16 8.181 8.181 8.658 -0.477 18497
4300 1 13 . 1 1 17 17 LYS N N 17 119.377 119.377 120.027 -0.650 18497
4301 1 13 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.904 0.052 18497
4302 1 13 . 1 1 17 17 LYS C C 17 178.197 178.197 178.566 -0.369 18497
4303 1 13 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.030 -0.010 18497
4304 1 13 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.225 -0.095 18497
4305 1 13 . 1 1 17 17 LYS H H 17 8.001 8.001 8.290 -0.289 18497
4306 1 13 . 1 1 18 18 GLU N N 18 120.395 120.395 119.665 0.730 18497
4307 1 13 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.034 0.106 18497
4308 1 13 . 1 1 18 18 GLU C C 18 178.849 178.849 179.117 -0.268 18497
4309 1 13 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.513 0.287 18497
4310 1 13 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.754 -0.261 18497
4311 1 13 . 1 1 18 18 GLU H H 18 7.943 7.943 8.208 -0.265 18497
4312 1 13 . 1 1 19 19 VAL N N 19 121.088 121.088 119.777 1.311 18497
4313 1 13 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.771 -0.121 18497
4314 1 13 . 1 1 19 19 VAL C C 19 179.415 179.415 178.549 0.866 18497
4315 1 13 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.417 1.563 18497
4316 1 13 . 1 1 19 19 VAL CB C 19 31.600 31.600 30.980 0.620 18497
4317 1 13 . 1 1 19 19 VAL H H 19 8.335 8.335 8.726 -0.391 18497
4318 1 13 . 1 1 20 20 CYS N N 20 117.290 117.290 119.582 -2.292 18497
4319 1 13 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.176 0.504 18497
4320 1 13 . 1 1 20 20 CYS C C 20 178.110 178.110 176.674 1.436 18497
4321 1 13 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.365 -0.165 18497
4322 1 13 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.394 -0.594 18497
4323 1 13 . 1 1 20 20 CYS H H 20 8.434 8.434 8.140 0.294 18497
4324 1 13 . 1 1 21 21 GLU N N 21 118.195 118.195 118.753 -0.558 18497
4325 1 13 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.146 -0.007 18497
4326 1 13 . 1 1 21 21 GLU C C 21 178.153 178.153 178.143 0.010 18497
4327 1 13 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.581 1.169 18497
4328 1 13 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.418 0.083 18497
4329 1 13 . 1 1 21 21 GLU H H 21 7.972 7.972 7.964 0.008 18497
4330 1 13 . 1 1 22 22 LYS N N 22 119.095 119.095 119.239 -0.144 18497
4331 1 13 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.218 -0.213 18497
4332 1 13 . 1 1 22 22 LYS C C 22 179.371 179.371 177.907 1.464 18497
4333 1 13 . 1 1 22 22 LYS CA C 22 58.700 58.700 57.816 0.884 18497
4334 1 13 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.781 0.139 18497
4335 1 13 . 1 1 22 22 LYS H H 22 8.071 8.071 8.338 -0.267 18497
4336 1 13 . 1 1 23 23 PHE N N 23 114.252 114.252 117.213 -2.961 18497
4337 1 13 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.564 -0.134 18497
4338 1 13 . 1 1 23 23 PHE C C 23 178.197 178.197 174.596 3.601 18497
4339 1 13 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.491 -0.061 18497
4340 1 13 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.258 -1.488 18497
4341 1 13 . 1 1 23 23 PHE H H 23 8.491 8.491 7.916 0.575 18497
4342 1 13 . 1 1 24 24 GLU N N 24 119.819 119.819 118.678 1.141 18497
4343 1 13 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.110 -0.040 18497
4344 1 13 . 1 1 24 24 GLU C C 24 177.457 177.457 175.424 2.033 18497
4345 1 13 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.121 -0.291 18497
4346 1 13 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.109 -0.309 18497
4347 1 13 . 1 1 24 24 GLU H H 24 7.867 7.867 8.098 -0.231 18497
4348 1 13 . 1 1 25 25 CYS N N 25 114.633 114.633 118.911 -4.278 18497
4349 1 13 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.956 0.431 18497
4350 1 13 . 1 1 25 25 CYS C C 25 174.760 174.760 173.736 1.024 18497
4351 1 13 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.791 -3.030 18497
4352 1 13 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.805 0.795 18497
4353 1 13 . 1 1 25 25 CYS H H 25 8.156 8.156 8.405 -0.249 18497
4354 1 13 . 1 1 26 26 THR N N 26 109.312 109.312 113.076 -3.764 18497
4355 1 13 . 1 1 26 26 THR HA H 26 4.770 4.770 4.755 0.015 18497
4356 1 13 . 1 1 26 26 THR C C 26 173.499 173.499 175.017 -1.518 18497
4357 1 13 . 1 1 26 26 THR CA C 26 60.723 60.723 60.734 -0.011 18497
4358 1 13 . 1 1 26 26 THR CB C 26 72.000 72.000 71.046 0.954 18497
4359 1 13 . 1 1 26 26 THR H H 26 8.460 8.460 8.205 0.255 18497
4360 1 13 . 1 1 27 27 GLU N N 27 122.233 122.233 124.414 -2.181 18497
4361 1 13 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.909 -0.399 18497
4362 1 13 . 1 1 27 27 GLU C C 27 176.544 176.544 178.174 -1.630 18497
4363 1 13 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.865 -0.315 18497
4364 1 13 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.313 -0.363 18497
4365 1 13 . 1 1 27 27 GLU H H 27 9.327 9.327 9.073 0.254 18497
4366 1 13 . 1 1 28 28 SER N N 28 112.925 112.925 114.444 -1.519 18497
4367 1 13 . 1 1 28 28 SER HA H 28 4.062 4.062 4.185 -0.123 18497
4368 1 13 . 1 1 28 28 SER C C 28 178.545 178.545 176.545 2.000 18497
4369 1 13 . 1 1 28 28 SER CA C 28 61.350 61.350 60.902 0.448 18497
4370 1 13 . 1 1 28 28 SER CB C 28 62.400 62.400 62.697 -0.297 18497
4371 1 13 . 1 1 28 28 SER H H 28 8.320 8.320 8.309 0.011 18497
4372 1 13 . 1 1 29 29 GLU N N 29 121.736 121.736 122.452 -0.716 18497
4373 1 13 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.242 -0.252 18497
4374 1 13 . 1 1 29 29 GLU C C 29 176.674 176.674 178.770 -2.096 18497
4375 1 13 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.606 1.144 18497
4376 1 13 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.641 -0.171 18497
4377 1 13 . 1 1 29 29 GLU H H 29 7.512 7.512 7.615 -0.103 18497
4378 1 13 . 1 1 30 30 VAL N N 30 119.480 119.480 120.728 -1.248 18497
4379 1 13 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.622 -0.245 18497
4380 1 13 . 1 1 30 30 VAL C C 30 179.241 179.241 178.039 1.202 18497
4381 1 13 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.278 0.382 18497
4382 1 13 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.285 -0.215 18497
4383 1 13 . 1 1 30 30 VAL H H 30 7.492 7.492 8.554 -1.062 18497
4384 1 13 . 1 1 31 31 MET N N 31 117.220 117.220 117.277 -0.057 18497
4385 1 13 . 1 1 31 31 MET HA H 31 3.870 3.870 3.948 -0.078 18497
4386 1 13 . 1 1 31 31 MET C C 31 177.936 177.936 178.200 -0.264 18497
4387 1 13 . 1 1 31 31 MET CA C 31 57.630 57.630 57.276 0.354 18497
4388 1 13 . 1 1 31 31 MET CB C 31 30.270 30.270 31.135 -0.865 18497
4389 1 13 . 1 1 31 31 MET H H 31 8.302 8.302 8.426 -0.124 18497
4390 1 13 . 1 1 32 32 ASN N N 32 116.672 116.672 119.069 -2.397 18497
4391 1 13 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.364 0.025 18497
4392 1 13 . 1 1 32 32 ASN C C 32 176.065 176.065 177.781 -1.716 18497
4393 1 13 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.609 -0.579 18497
4394 1 13 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.091 -0.381 18497
4395 1 13 . 1 1 32 32 ASN H H 32 8.313 8.313 8.191 0.122 18497
4396 1 13 . 1 1 33 33 SER N N 33 117.471 117.471 115.950 1.521 18497
4397 1 13 . 1 1 33 33 SER HA H 33 4.150 4.150 4.197 -0.047 18497
4398 1 13 . 1 1 33 33 SER C C 33 178.806 178.806 176.588 2.218 18497
4399 1 13 . 1 1 33 33 SER CA C 33 62.950 62.950 61.466 1.484 18497
4400 1 13 . 1 1 33 33 SER CB C 33 62.600 62.600 63.098 -0.498 18497
4401 1 13 . 1 1 33 33 SER H H 33 7.851 7.851 7.687 0.164 18497
4402 1 13 . 1 1 34 34 LEU N N 34 122.839 122.839 121.504 1.335 18497
4403 1 13 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.057 -0.178 18497
4404 1 13 . 1 1 34 34 LEU C C 34 177.892 177.892 178.718 -0.826 18497
4405 1 13 . 1 1 34 34 LEU CA C 34 57.630 57.630 57.018 0.612 18497
4406 1 13 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.819 -1.019 18497
4407 1 13 . 1 1 34 34 LEU H H 34 8.128 8.128 7.393 0.735 18497
4408 1 13 . 1 1 35 35 TYR N N 35 116.666 116.666 120.387 -3.721 18497
4409 1 13 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.521 0.089 18497
4410 1 13 . 1 1 35 35 TYR C C 35 179.067 179.067 177.123 1.944 18497
4411 1 13 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.123 -2.233 18497
4412 1 13 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.354 -1.644 18497
4413 1 13 . 1 1 35 35 TYR H H 35 7.924 7.924 8.338 -0.414 18497
4414 1 13 . 1 1 36 36 SER N N 36 114.801 114.801 115.186 -0.385 18497
4415 1 13 . 1 1 36 36 SER HA H 36 4.080 4.080 4.320 -0.240 18497
4416 1 13 . 1 1 36 36 SER C C 36 177.283 177.283 174.827 2.456 18497
4417 1 13 . 1 1 36 36 SER CA C 36 60.519 60.519 60.455 0.065 18497
4418 1 13 . 1 1 36 36 SER CB C 36 64.240 64.240 63.869 0.371 18497
4419 1 13 . 1 1 36 36 SER H H 36 7.715 7.715 8.524 -0.809 18497
4420 1 13 . 1 1 37 37 GLY N N 37 109.803 109.803 108.157 1.646 18497
4421 1 13 . 1 1 37 37 GLY C C 37 175.978 175.978 173.659 2.319 18497
4422 1 13 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.944 0.734 18497
4423 1 13 . 1 1 37 37 GLY H H 37 8.017 8.017 7.699 0.318 18497
4424 1 13 . 1 1 38 38 ASP N N 38 120.613 120.613 121.925 -1.312 18497
4425 1 13 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.040 -0.015 18497
4426 1 13 . 1 1 38 38 ASP C C 38 173.368 173.368 175.806 -2.438 18497
4427 1 13 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.830 -0.110 18497
4428 1 13 . 1 1 38 38 ASP CB C 38 41.420 41.420 41.770 -0.350 18497
4429 1 13 . 1 1 38 38 ASP H H 38 8.006 8.006 8.010 -0.004 18497
4430 1 13 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.529 -0.189 18497
4431 1 13 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.886 -0.136 18497
4432 1 13 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.504 -0.374 18497
4433 1 13 . 1 1 40 40 GLN N N 40 115.056 115.056 116.549 -1.493 18497
4434 1 13 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.297 -0.017 18497
4435 1 13 . 1 1 40 40 GLN C C 40 177.066 177.066 175.915 1.151 18497
4436 1 13 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.216 -0.506 18497
4437 1 13 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.653 0.027 18497
4438 1 13 . 1 1 40 40 GLN H H 40 8.237 8.237 8.323 -0.086 18497
4439 1 13 . 1 1 41 41 ASP N N 41 122.839 122.839 120.450 2.389 18497
4440 1 13 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.475 -0.162 18497
4441 1 13 . 1 1 41 41 ASP C C 41 175.804 175.804 177.887 -2.083 18497
4442 1 13 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.564 0.676 18497
4443 1 13 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.380 -0.160 18497
4444 1 13 . 1 1 41 41 ASP H H 41 7.211 7.211 7.661 -0.450 18497
4445 1 13 . 1 1 42 42 GLN N N 42 124.547 124.547 124.964 -0.417 18497
4446 1 13 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.030 -0.170 18497
4447 1 13 . 1 1 42 42 GLN C C 42 177.196 177.196 177.213 -0.017 18497
4448 1 13 . 1 1 42 42 GLN CA C 42 59.220 59.220 58.881 0.339 18497
4449 1 13 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.671 -0.271 18497
4450 1 13 . 1 1 42 42 GLN H H 42 8.719 8.719 8.727 -0.008 18497
4451 1 13 . 1 1 43 43 LEU N N 43 118.960 118.960 119.459 -0.499 18497
4452 1 13 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.990 -0.305 18497
4453 1 13 . 1 1 43 43 LEU C C 43 178.066 178.066 178.679 -0.613 18497
4454 1 13 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.497 0.863 18497
4455 1 13 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.511 -1.121 18497
4456 1 13 . 1 1 43 43 LEU H H 43 8.206 8.206 8.309 -0.103 18497
4457 1 13 . 1 1 44 44 ALA N N 44 121.666 121.666 122.859 -1.193 18497
4458 1 13 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.146 -0.267 18497
4459 1 13 . 1 1 44 44 ALA C C 44 178.327 178.327 179.927 -1.600 18497
4460 1 13 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.831 -0.122 18497
4461 1 13 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.363 0.218 18497
4462 1 13 . 1 1 44 44 ALA H H 44 7.402 7.402 7.713 -0.311 18497
4463 1 13 . 1 1 45 45 VAL N N 45 118.589 118.589 121.035 -2.446 18497
4464 1 13 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.671 -0.011 18497
4465 1 13 . 1 1 45 45 VAL C C 45 179.893 179.893 177.739 2.154 18497
4466 1 13 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.566 -0.166 18497
4467 1 13 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.287 0.844 18497
4468 1 13 . 1 1 45 45 VAL H H 45 8.449 8.449 8.549 -0.100 18497
4469 1 13 . 1 1 46 46 ALA N N 46 121.006 121.006 122.371 -1.365 18497
4470 1 13 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.752 0.378 18497
4471 1 13 . 1 1 46 46 ALA C C 46 179.110 179.110 179.096 0.014 18497
4472 1 13 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.024 -0.054 18497
4473 1 13 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.223 1.887 18497
4474 1 13 . 1 1 46 46 ALA H H 46 7.654 7.654 7.894 -0.240 18497
4475 1 13 . 1 1 47 47 TYR N N 47 119.140 119.140 119.949 -0.809 18497
4476 1 13 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.946 -0.196 18497
4477 1 13 . 1 1 47 47 TYR C C 47 179.328 179.328 177.762 1.566 18497
4478 1 13 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.177 -0.297 18497
4479 1 13 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.261 0.239 18497
4480 1 13 . 1 1 47 47 TYR H H 47 8.077 8.077 8.067 0.010 18497
4481 1 13 . 1 1 48 48 HIS N N 48 116.422 116.422 118.081 -1.659 18497
4482 1 13 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.114 -0.014 18497
4483 1 13 . 1 1 48 48 HIS C C 48 178.023 178.023 177.763 0.260 18497
4484 1 13 . 1 1 48 48 HIS CA C 48 60.020 60.020 61.093 -1.073 18497
4485 1 13 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.694 -0.754 18497
4486 1 13 . 1 1 48 48 HIS H H 48 8.326 8.326 8.378 -0.052 18497
4487 1 13 . 1 1 49 49 LEU N N 49 120.974 120.974 120.310 0.664 18497
4488 1 13 . 1 1 49 49 LEU HA H 49 4.155 4.155 3.977 0.178 18497
4489 1 13 . 1 1 49 49 LEU C C 49 177.417 177.417 179.025 -1.608 18497
4490 1 13 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.182 -0.292 18497
4491 1 13 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.827 0.133 18497
4492 1 13 . 1 1 49 49 LEU H H 49 8.237 8.237 8.367 -0.130 18497
4493 1 13 . 1 1 50 50 ILE N N 50 119.715 119.715 119.270 0.445 18497
4494 1 13 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.659 -0.039 18497
4495 1 13 . 1 1 50 50 ILE C C 50 179.502 179.502 177.882 1.620 18497
4496 1 13 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.270 -0.210 18497
4497 1 13 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.890 0.080 18497
4498 1 13 . 1 1 50 50 ILE H H 50 7.543 7.543 8.573 -1.030 18497
4499 1 13 . 1 1 51 51 ILE N N 51 117.995 117.995 122.078 -4.083 18497
4500 1 13 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.419 0.121 18497
4501 1 13 . 1 1 51 51 ILE C C 51 179.197 179.197 177.558 1.639 18497
4502 1 13 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.904 -2.164 18497
4503 1 13 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.449 -0.799 18497
4504 1 13 . 1 1 51 51 ILE H H 51 7.475 7.475 8.061 -0.586 18497
4505 1 13 . 1 1 52 52 ASP N N 52 121.642 121.642 119.738 1.904 18497
4506 1 13 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.227 0.213 18497
4507 1 13 . 1 1 52 52 ASP C C 52 179.197 179.197 178.361 0.836 18497
4508 1 13 . 1 1 52 52 ASP CA C 52 57.100 57.100 58.213 -1.113 18497
4509 1 13 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.834 -0.534 18497
4510 1 13 . 1 1 52 52 ASP H H 52 8.559 8.559 8.174 0.385 18497
4511 1 13 . 1 1 53 53 ASN N N 53 117.131 117.131 118.107 -0.976 18497
4512 1 13 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.391 0.219 18497
4513 1 13 . 1 1 53 53 ASN C C 53 178.545 178.545 177.598 0.947 18497
4514 1 13 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.090 -1.389 18497
4515 1 13 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.923 -0.223 18497
4516 1 13 . 1 1 53 53 ASN H H 53 8.106 8.106 8.085 0.021 18497
4517 1 13 . 1 1 54 54 ARG N N 54 119.929 119.929 119.455 0.474 18497
4518 1 13 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.056 0.064 18497
4519 1 13 . 1 1 54 54 ARG C C 54 176.892 176.892 178.413 -1.521 18497
4520 1 13 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.030 -0.870 18497
4521 1 13 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.262 0.009 18497
4522 1 13 . 1 1 54 54 ARG H H 54 7.797 7.797 8.231 -0.434 18497
4523 1 13 . 1 1 55 55 ARG N N 55 119.227 119.227 117.811 1.416 18497
4524 1 13 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.337 -0.163 18497
4525 1 13 . 1 1 55 55 ARG C C 55 175.108 175.108 177.759 -2.651 18497
4526 1 13 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.059 3.821 18497
4527 1 13 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.232 1.428 18497
4528 1 13 . 1 1 55 55 ARG H H 55 7.857 7.857 8.187 -0.330 18497
4529 1 13 . 1 1 56 56 ILE N N 56 116.676 116.676 116.787 -0.111 18497
4530 1 13 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.207 -0.197 18497
4531 1 13 . 1 1 56 56 ILE C C 56 176.065 176.065 175.670 0.395 18497
4532 1 13 . 1 1 56 56 ILE CA C 56 62.140 62.140 61.469 0.671 18497
4533 1 13 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.897 -1.657 18497
4534 1 13 . 1 1 56 56 ILE H H 56 8.317 8.317 8.033 0.284 18497
4535 1 13 . 1 1 57 57 MET N N 57 122.058 122.058 115.199 6.859 18497
4536 1 13 . 1 1 57 57 MET HA H 57 4.420 4.420 4.077 0.343 18497
4537 1 13 . 1 1 57 57 MET C C 57 177.283 177.283 176.156 1.127 18497
4538 1 13 . 1 1 57 57 MET CA C 57 56.030 56.030 57.147 -1.117 18497
4539 1 13 . 1 1 57 57 MET CB C 57 32.515 32.515 31.965 0.550 18497
4540 1 13 . 1 1 57 57 MET H H 57 8.177 8.177 7.813 0.364 18497
4541 1 13 . 1 1 58 58 ASN N N 58 118.892 118.892 116.980 1.912 18497
4542 1 13 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.527 0.163 18497
4543 1 13 . 1 1 58 58 ASN C C 58 176.500 176.500 174.716 1.784 18497
4544 1 13 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.722 -2.069 18497
4545 1 13 . 1 1 58 58 ASN CB C 58 38.770 38.770 37.611 1.159 18497
4546 1 13 . 1 1 58 58 ASN H H 58 8.238 8.238 8.579 -0.341 18497
4547 1 13 . 1 1 59 59 GLN N N 59 120.456 120.456 119.625 0.831 18497
4548 1 13 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.456 -0.146 18497
4549 1 13 . 1 1 59 59 GLN C C 59 175.326 175.326 174.479 0.847 18497
4550 1 13 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.288 0.742 18497
4551 1 13 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.916 -2.116 18497
4552 1 13 . 1 1 59 59 GLN H H 59 8.196 8.196 7.912 0.284 18497
4553 1 13 . 1 1 60 60 ALA N N 60 125.116 125.116 122.118 2.998 18497
4554 1 13 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.066 0.316 18497
4555 1 13 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.193 -0.893 18497
4556 1 13 . 1 1 60 60 ALA CB C 60 19.110 19.110 17.634 1.476 18497
4557 1 13 . 1 1 60 60 ALA H H 60 8.293 8.293 8.624 -0.331 18497
4558 1 13 . 1 1 61 61 SER N N 61 115.686 115.686 114.284 1.402 18497
4559 1 13 . 1 1 61 61 SER HA H 61 4.470 4.470 4.290 0.180 18497
4560 1 13 . 1 1 61 61 SER C C 61 175.674 175.674 174.780 0.894 18497
4561 1 13 . 1 1 61 61 SER CA C 61 58.160 58.160 58.273 -0.113 18497
4562 1 13 . 1 1 61 61 SER CB C 61 63.740 63.740 63.694 0.046 18497
4563 1 13 . 1 1 61 61 SER H H 61 8.290 8.290 8.630 -0.340 18497
4564 1 14 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.663 -0.233 18497
4565 1 14 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.255 0.692 18497
4566 1 14 . 1 1 2 2 PRO CB C 2 32.130 32.130 33.299 -1.169 18497
4567 1 14 . 1 1 3 3 HIS N N 3 119.985 119.985 117.375 2.610 18497
4568 1 14 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.450 0.156 18497
4569 1 14 . 1 1 3 3 HIS C C 3 176.587 176.587 174.807 1.780 18497
4570 1 14 . 1 1 3 3 HIS CA C 3 56.185 56.185 57.521 -1.336 18497
4571 1 14 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.093 0.378 18497
4572 1 14 . 1 1 3 3 HIS H H 3 8.526 8.526 8.309 0.217 18497
4573 1 14 . 1 1 4 4 MET N N 4 122.338 122.338 115.059 7.279 18497
4574 1 14 . 1 1 4 4 MET HA H 4 4.448 4.448 4.681 -0.233 18497
4575 1 14 . 1 1 4 4 MET C C 4 175.108 175.108 174.960 0.148 18497
4576 1 14 . 1 1 4 4 MET CA C 4 55.562 55.562 54.611 0.951 18497
4577 1 14 . 1 1 4 4 MET CB C 4 33.141 33.141 35.742 -2.601 18497
4578 1 14 . 1 1 4 4 MET H H 4 8.337 8.337 7.807 0.530 18497
4579 1 14 . 1 1 5 5 SER N N 5 116.990 116.990 115.469 1.521 18497
4580 1 14 . 1 1 5 5 SER HA H 5 4.400 4.400 4.509 -0.109 18497
4581 1 14 . 1 1 5 5 SER C C 5 177.979 177.979 173.210 4.769 18497
4582 1 14 . 1 1 5 5 SER CA C 5 58.039 58.039 59.325 -1.286 18497
4583 1 14 . 1 1 5 5 SER CB C 5 63.797 63.797 63.230 0.567 18497
4584 1 14 . 1 1 5 5 SER H H 5 8.330 8.330 8.735 -0.405 18497
4585 1 14 . 1 1 6 6 TYR N N 6 122.027 122.027 118.573 3.454 18497
4586 1 14 . 1 1 6 6 TYR HA H 6 4.510 4.510 5.096 -0.586 18497
4587 1 14 . 1 1 6 6 TYR C C 6 174.060 174.060 173.576 0.484 18497
4588 1 14 . 1 1 6 6 TYR CA C 6 57.800 57.800 56.683 1.117 18497
4589 1 14 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.841 -1.156 18497
4590 1 14 . 1 1 6 6 TYR H H 6 8.201 8.201 7.737 0.464 18497
4591 1 14 . 1 1 7 7 ASP N N 7 122.439 122.439 120.141 2.298 18497
4592 1 14 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.778 -0.229 18497
4593 1 14 . 1 1 7 7 ASP C C 7 175.150 175.150 174.799 0.351 18497
4594 1 14 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.414 0.226 18497
4595 1 14 . 1 1 7 7 ASP CB C 7 41.300 41.300 42.250 -0.950 18497
4596 1 14 . 1 1 7 7 ASP H H 7 8.119 8.119 8.331 -0.212 18497
4597 1 14 . 1 1 8 8 ALA N N 8 124.655 124.655 121.430 3.225 18497
4598 1 14 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.257 -0.027 18497
4599 1 14 . 1 1 8 8 ALA C C 8 175.935 175.935 177.615 -1.680 18497
4600 1 14 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.296 -0.403 18497
4601 1 14 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.295 -0.445 18497
4602 1 14 . 1 1 8 8 ALA H H 8 8.235 8.235 8.291 -0.056 18497
4603 1 14 . 1 1 9 9 ASN N N 9 116.133 116.133 116.873 -0.740 18497
4604 1 14 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.725 -0.035 18497
4605 1 14 . 1 1 9 9 ASN C C 9 177.718 177.718 175.975 1.743 18497
4606 1 14 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.776 0.024 18497
4607 1 14 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.233 -0.462 18497
4608 1 14 . 1 1 9 9 ASN H H 9 8.417 8.417 8.017 0.400 18497
4609 1 14 . 1 1 10 10 VAL N N 10 119.557 119.557 121.485 -1.928 18497
4610 1 14 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.868 0.309 18497
4611 1 14 . 1 1 10 10 VAL C C 10 174.930 174.930 175.537 -0.607 18497
4612 1 14 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.654 -1.774 18497
4613 1 14 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.666 -0.006 18497
4614 1 14 . 1 1 10 10 VAL H H 10 7.859 7.859 8.330 -0.471 18497
4615 1 14 . 1 1 11 11 ILE N N 11 126.561 126.561 128.159 -1.598 18497
4616 1 14 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.302 -0.262 18497
4617 1 14 . 1 1 11 11 ILE C C 11 175.935 175.935 175.194 0.741 18497
4618 1 14 . 1 1 11 11 ILE CA C 11 59.500 59.500 60.906 -1.406 18497
4619 1 14 . 1 1 11 11 ILE CB C 11 37.700 37.700 39.252 -1.552 18497
4620 1 14 . 1 1 11 11 ILE H H 11 8.283 8.283 8.166 0.117 18497
4621 1 14 . 1 1 12 12 ASP N N 12 128.161 128.161 126.060 2.101 18497
4622 1 14 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.878 -0.148 18497
4623 1 14 . 1 1 12 12 ASP C C 12 174.891 174.891 176.455 -1.564 18497
4624 1 14 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.107 0.320 18497
4625 1 14 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.388 -0.168 18497
4626 1 14 . 1 1 12 12 ASP H H 12 8.477 8.477 8.366 0.111 18497
4627 1 14 . 1 1 13 13 ASP N N 13 127.435 127.435 127.747 -0.312 18497
4628 1 14 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.350 -0.034 18497
4629 1 14 . 1 1 13 13 ASP C C 13 175.369 175.369 177.721 -2.352 18497
4630 1 14 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.498 0.102 18497
4631 1 14 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.059 0.101 18497
4632 1 14 . 1 1 13 13 ASP H H 13 8.698 8.698 8.915 -0.217 18497
4633 1 14 . 1 1 14 14 GLU N N 14 119.796 119.796 119.815 -0.019 18497
4634 1 14 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.081 -0.046 18497
4635 1 14 . 1 1 14 14 GLU C C 14 178.588 178.588 178.185 0.403 18497
4636 1 14 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.434 0.066 18497
4637 1 14 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.713 -0.813 18497
4638 1 14 . 1 1 14 14 GLU H H 14 8.205 8.205 8.661 -0.456 18497
4639 1 14 . 1 1 15 15 ALA N N 15 124.156 124.156 122.880 1.276 18497
4640 1 14 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.014 0.162 18497
4641 1 14 . 1 1 15 15 ALA C C 15 179.502 179.502 179.625 -0.123 18497
4642 1 14 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.019 -0.019 18497
4643 1 14 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.241 0.659 18497
4644 1 14 . 1 1 15 15 ALA H H 15 8.473 8.473 7.795 0.678 18497
4645 1 14 . 1 1 16 16 VAL N N 16 117.585 117.585 119.459 -1.874 18497
4646 1 14 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.568 -0.034 18497
4647 1 14 . 1 1 16 16 VAL C C 16 179.545 179.545 178.163 1.382 18497
4648 1 14 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.668 0.332 18497
4649 1 14 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.461 0.139 18497
4650 1 14 . 1 1 16 16 VAL H H 16 8.181 8.181 8.545 -0.364 18497
4651 1 14 . 1 1 17 17 LYS N N 17 119.377 119.377 119.128 0.249 18497
4652 1 14 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.920 0.036 18497
4653 1 14 . 1 1 17 17 LYS C C 17 178.197 178.197 178.927 -0.730 18497
4654 1 14 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.059 -0.039 18497
4655 1 14 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.139 -0.009 18497
4656 1 14 . 1 1 17 17 LYS H H 17 8.001 8.001 8.255 -0.254 18497
4657 1 14 . 1 1 18 18 GLU N N 18 120.395 120.395 120.180 0.215 18497
4658 1 14 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.085 0.055 18497
4659 1 14 . 1 1 18 18 GLU C C 18 178.849 178.849 178.862 -0.013 18497
4660 1 14 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.435 0.365 18497
4661 1 14 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.727 -0.234 18497
4662 1 14 . 1 1 18 18 GLU H H 18 7.943 7.943 7.991 -0.048 18497
4663 1 14 . 1 1 19 19 VAL N N 19 121.088 121.088 120.089 0.999 18497
4664 1 14 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.692 -0.042 18497
4665 1 14 . 1 1 19 19 VAL C C 19 179.415 179.415 178.326 1.089 18497
4666 1 14 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.845 1.135 18497
4667 1 14 . 1 1 19 19 VAL CB C 19 31.600 31.600 30.988 0.612 18497
4668 1 14 . 1 1 19 19 VAL H H 19 8.335 8.335 8.688 -0.353 18497
4669 1 14 . 1 1 20 20 CYS N N 20 117.290 117.290 118.008 -0.718 18497
4670 1 14 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.197 0.483 18497
4671 1 14 . 1 1 20 20 CYS C C 20 178.110 178.110 176.946 1.164 18497
4672 1 14 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.521 -0.321 18497
4673 1 14 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.283 -0.483 18497
4674 1 14 . 1 1 20 20 CYS H H 20 8.434 8.434 8.455 -0.021 18497
4675 1 14 . 1 1 21 21 GLU N N 21 118.195 118.195 119.684 -1.489 18497
4676 1 14 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.158 -0.019 18497
4677 1 14 . 1 1 21 21 GLU C C 21 178.153 178.153 178.391 -0.238 18497
4678 1 14 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.893 0.857 18497
4679 1 14 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.466 0.034 18497
4680 1 14 . 1 1 21 21 GLU H H 21 7.972 7.972 7.572 0.400 18497
4681 1 14 . 1 1 22 22 LYS N N 22 119.095 119.095 118.263 0.832 18497
4682 1 14 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.160 -0.155 18497
4683 1 14 . 1 1 22 22 LYS C C 22 179.371 179.371 178.570 0.801 18497
4684 1 14 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.684 0.016 18497
4685 1 14 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.819 0.101 18497
4686 1 14 . 1 1 22 22 LYS H H 22 8.071 8.071 8.230 -0.159 18497
4687 1 14 . 1 1 23 23 PHE N N 23 114.252 114.252 117.305 -3.053 18497
4688 1 14 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.544 -0.114 18497
4689 1 14 . 1 1 23 23 PHE C C 23 178.197 178.197 174.799 3.398 18497
4690 1 14 . 1 1 23 23 PHE CA C 23 58.430 58.430 57.828 0.602 18497
4691 1 14 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.011 -1.240 18497
4692 1 14 . 1 1 23 23 PHE H H 23 8.491 8.491 8.306 0.185 18497
4693 1 14 . 1 1 24 24 GLU N N 24 119.819 119.819 114.890 4.929 18497
4694 1 14 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.020 0.050 18497
4695 1 14 . 1 1 24 24 GLU C C 24 177.457 177.457 175.600 1.857 18497
4696 1 14 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.256 -0.426 18497
4697 1 14 . 1 1 24 24 GLU CB C 24 26.800 26.800 26.853 -0.053 18497
4698 1 14 . 1 1 24 24 GLU H H 24 7.867 7.867 8.398 -0.531 18497
4699 1 14 . 1 1 25 25 CYS N N 25 114.633 114.633 115.675 -1.042 18497
4700 1 14 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.816 0.571 18497
4701 1 14 . 1 1 25 25 CYS C C 25 174.760 174.760 174.740 0.020 18497
4702 1 14 . 1 1 25 25 CYS CA C 25 54.761 54.761 55.512 -0.751 18497
4703 1 14 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.020 0.581 18497
4704 1 14 . 1 1 25 25 CYS H H 25 8.156 8.156 7.442 0.714 18497
4705 1 14 . 1 1 26 26 THR N N 26 109.312 109.312 112.370 -3.058 18497
4706 1 14 . 1 1 26 26 THR HA H 26 4.770 4.770 4.646 0.124 18497
4707 1 14 . 1 1 26 26 THR C C 26 173.499 173.499 175.484 -1.985 18497
4708 1 14 . 1 1 26 26 THR CA C 26 60.723 60.723 60.607 0.116 18497
4709 1 14 . 1 1 26 26 THR CB C 26 72.000 72.000 71.792 0.208 18497
4710 1 14 . 1 1 26 26 THR H H 26 8.460 8.460 9.234 -0.774 18497
4711 1 14 . 1 1 27 27 GLU N N 27 122.233 122.233 122.731 -0.498 18497
4712 1 14 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.926 -0.416 18497
4713 1 14 . 1 1 27 27 GLU C C 27 176.544 176.544 178.713 -2.169 18497
4714 1 14 . 1 1 27 27 GLU CA C 27 60.550 60.550 61.001 -0.451 18497
4715 1 14 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.171 -0.220 18497
4716 1 14 . 1 1 27 27 GLU H H 27 9.327 9.327 8.967 0.360 18497
4717 1 14 . 1 1 28 28 SER N N 28 112.925 112.925 114.523 -1.598 18497
4718 1 14 . 1 1 28 28 SER HA H 28 4.062 4.062 4.134 -0.072 18497
4719 1 14 . 1 1 28 28 SER C C 28 178.545 178.545 176.873 1.672 18497
4720 1 14 . 1 1 28 28 SER CA C 28 61.350 61.350 61.118 0.232 18497
4721 1 14 . 1 1 28 28 SER CB C 28 62.400 62.400 62.586 -0.186 18497
4722 1 14 . 1 1 28 28 SER H H 28 8.320 8.320 8.545 -0.225 18497
4723 1 14 . 1 1 29 29 GLU N N 29 121.736 121.736 121.846 -0.110 18497
4724 1 14 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.107 -0.117 18497
4725 1 14 . 1 1 29 29 GLU C C 29 176.674 176.674 178.470 -1.796 18497
4726 1 14 . 1 1 29 29 GLU CA C 29 59.750 59.750 59.169 0.582 18497
4727 1 14 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.676 -0.206 18497
4728 1 14 . 1 1 29 29 GLU H H 29 7.512 7.512 7.726 -0.214 18497
4729 1 14 . 1 1 30 30 VAL N N 30 119.480 119.480 119.959 -0.479 18497
4730 1 14 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.641 -0.264 18497
4731 1 14 . 1 1 30 30 VAL C C 30 179.241 179.241 177.759 1.482 18497
4732 1 14 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.026 0.634 18497
4733 1 14 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.265 -0.195 18497
4734 1 14 . 1 1 30 30 VAL H H 30 7.492 7.492 7.422 0.070 18497
4735 1 14 . 1 1 31 31 MET N N 31 117.220 117.220 117.774 -0.554 18497
4736 1 14 . 1 1 31 31 MET HA H 31 3.870 3.870 3.941 -0.071 18497
4737 1 14 . 1 1 31 31 MET C C 31 177.936 177.936 178.417 -0.481 18497
4738 1 14 . 1 1 31 31 MET CA C 31 57.630 57.630 57.924 -0.294 18497
4739 1 14 . 1 1 31 31 MET CB C 31 30.270 30.270 31.112 -0.842 18497
4740 1 14 . 1 1 31 31 MET H H 31 8.302 8.302 8.674 -0.372 18497
4741 1 14 . 1 1 32 32 ASN N N 32 116.672 116.672 118.822 -2.150 18497
4742 1 14 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.437 -0.047 18497
4743 1 14 . 1 1 32 32 ASN C C 32 176.065 176.065 177.566 -1.501 18497
4744 1 14 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.573 -0.543 18497
4745 1 14 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.495 -0.785 18497
4746 1 14 . 1 1 32 32 ASN H H 32 8.313 8.313 8.145 0.168 18497
4747 1 14 . 1 1 33 33 SER N N 33 117.471 117.471 114.260 3.211 18497
4748 1 14 . 1 1 33 33 SER HA H 33 4.150 4.150 4.295 -0.145 18497
4749 1 14 . 1 1 33 33 SER C C 33 178.806 178.806 175.560 3.246 18497
4750 1 14 . 1 1 33 33 SER CA C 33 62.950 62.950 60.701 2.249 18497
4751 1 14 . 1 1 33 33 SER CB C 33 62.600 62.600 63.371 -0.771 18497
4752 1 14 . 1 1 33 33 SER H H 33 7.851 7.851 7.663 0.188 18497
4753 1 14 . 1 1 34 34 LEU N N 34 122.839 122.839 119.311 3.528 18497
4754 1 14 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.277 -0.398 18497
4755 1 14 . 1 1 34 34 LEU C C 34 177.892 177.892 177.423 0.469 18497
4756 1 14 . 1 1 34 34 LEU CA C 34 57.630 57.630 55.880 1.750 18497
4757 1 14 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.486 -1.686 18497
4758 1 14 . 1 1 34 34 LEU H H 34 8.128 8.128 7.367 0.761 18497
4759 1 14 . 1 1 35 35 TYR N N 35 116.666 116.666 117.661 -0.995 18497
4760 1 14 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.567 0.043 18497
4761 1 14 . 1 1 35 35 TYR C C 35 179.067 179.067 175.935 3.132 18497
4762 1 14 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.909 -2.019 18497
4763 1 14 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.522 -3.812 18497
4764 1 14 . 1 1 35 35 TYR H H 35 7.924 7.924 7.915 0.009 18497
4765 1 14 . 1 1 36 36 SER N N 36 114.801 114.801 112.748 2.053 18497
4766 1 14 . 1 1 36 36 SER HA H 36 4.080 4.080 4.445 -0.365 18497
4767 1 14 . 1 1 36 36 SER C C 36 177.283 177.283 175.020 2.263 18497
4768 1 14 . 1 1 36 36 SER CA C 36 60.519 60.519 58.836 1.683 18497
4769 1 14 . 1 1 36 36 SER CB C 36 64.240 64.240 66.716 -2.476 18497
4770 1 14 . 1 1 36 36 SER H H 36 7.715 7.715 8.584 -0.869 18497
4771 1 14 . 1 1 37 37 GLY N N 37 109.803 109.803 111.777 -1.974 18497
4772 1 14 . 1 1 37 37 GLY C C 37 175.978 175.978 172.691 3.287 18497
4773 1 14 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.216 0.462 18497
4774 1 14 . 1 1 37 37 GLY H H 37 8.017 8.017 7.944 0.073 18497
4775 1 14 . 1 1 38 38 ASP N N 38 120.613 120.613 118.648 1.965 18497
4776 1 14 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.995 0.030 18497
4777 1 14 . 1 1 38 38 ASP C C 38 173.368 173.368 174.659 -1.291 18497
4778 1 14 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.998 -1.278 18497
4779 1 14 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.952 -1.532 18497
4780 1 14 . 1 1 38 38 ASP H H 38 8.006 8.006 8.053 -0.048 18497
4781 1 14 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.294 0.046 18497
4782 1 14 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.576 -0.826 18497
4783 1 14 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.082 0.048 18497
4784 1 14 . 1 1 40 40 GLN N N 40 115.056 115.056 115.573 -0.517 18497
4785 1 14 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.169 0.111 18497
4786 1 14 . 1 1 40 40 GLN C C 40 177.066 177.066 176.117 0.949 18497
4787 1 14 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.881 -1.171 18497
4788 1 14 . 1 1 40 40 GLN CB C 40 28.680 28.680 29.194 -0.514 18497
4789 1 14 . 1 1 40 40 GLN H H 40 8.237 8.237 8.243 -0.006 18497
4790 1 14 . 1 1 41 41 ASP N N 41 122.839 122.839 121.205 1.634 18497
4791 1 14 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.597 -0.284 18497
4792 1 14 . 1 1 41 41 ASP C C 41 175.804 175.804 177.303 -1.499 18497
4793 1 14 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.255 0.985 18497
4794 1 14 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.678 -0.458 18497
4795 1 14 . 1 1 41 41 ASP H H 41 7.211 7.211 7.839 -0.628 18497
4796 1 14 . 1 1 42 42 GLN N N 42 124.547 124.547 123.079 1.468 18497
4797 1 14 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.056 -0.196 18497
4798 1 14 . 1 1 42 42 GLN C C 42 177.196 177.196 177.943 -0.747 18497
4799 1 14 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.468 -0.248 18497
4800 1 14 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.078 -0.678 18497
4801 1 14 . 1 1 42 42 GLN H H 42 8.719 8.719 8.827 -0.108 18497
4802 1 14 . 1 1 43 43 LEU N N 43 118.960 118.960 118.261 0.699 18497
4803 1 14 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.912 -0.227 18497
4804 1 14 . 1 1 43 43 LEU C C 43 178.066 178.066 178.764 -0.698 18497
4805 1 14 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.517 -0.157 18497
4806 1 14 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.642 -1.252 18497
4807 1 14 . 1 1 43 43 LEU H H 43 8.206 8.206 8.317 -0.111 18497
4808 1 14 . 1 1 44 44 ALA N N 44 121.666 121.666 122.156 -0.490 18497
4809 1 14 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.210 -0.331 18497
4810 1 14 . 1 1 44 44 ALA C C 44 178.327 178.327 179.998 -1.671 18497
4811 1 14 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.680 0.030 18497
4812 1 14 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.482 0.098 18497
4813 1 14 . 1 1 44 44 ALA H H 44 7.402 7.402 7.570 -0.168 18497
4814 1 14 . 1 1 45 45 VAL N N 45 118.589 118.589 121.077 -2.488 18497
4815 1 14 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.640 0.020 18497
4816 1 14 . 1 1 45 45 VAL C C 45 179.893 179.893 177.660 2.233 18497
4817 1 14 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.725 -0.325 18497
4818 1 14 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.693 0.438 18497
4819 1 14 . 1 1 45 45 VAL H H 45 8.449 8.449 8.616 -0.167 18497
4820 1 14 . 1 1 46 46 ALA N N 46 121.006 121.006 122.438 -1.432 18497
4821 1 14 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.743 0.387 18497
4822 1 14 . 1 1 46 46 ALA C C 46 179.110 179.110 178.875 0.235 18497
4823 1 14 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.146 -0.176 18497
4824 1 14 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.130 1.980 18497
4825 1 14 . 1 1 46 46 ALA H H 46 7.654 7.654 8.086 -0.432 18497
4826 1 14 . 1 1 47 47 TYR N N 47 119.140 119.140 119.816 -0.676 18497
4827 1 14 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.941 -0.191 18497
4828 1 14 . 1 1 47 47 TYR C C 47 179.328 179.328 177.722 1.606 18497
4829 1 14 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.086 -0.206 18497
4830 1 14 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.268 0.232 18497
4831 1 14 . 1 1 47 47 TYR H H 47 8.077 8.077 7.598 0.479 18497
4832 1 14 . 1 1 48 48 HIS N N 48 116.422 116.422 118.135 -1.713 18497
4833 1 14 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.101 -0.001 18497
4834 1 14 . 1 1 48 48 HIS C C 48 178.023 178.023 177.732 0.291 18497
4835 1 14 . 1 1 48 48 HIS CA C 48 60.020 60.020 61.131 -1.111 18497
4836 1 14 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.696 -0.756 18497
4837 1 14 . 1 1 48 48 HIS H H 48 8.326 8.326 8.397 -0.071 18497
4838 1 14 . 1 1 49 49 LEU N N 49 120.974 120.974 120.559 0.415 18497
4839 1 14 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.027 0.128 18497
4840 1 14 . 1 1 49 49 LEU C C 49 177.417 177.417 179.179 -1.762 18497
4841 1 14 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.028 -0.138 18497
4842 1 14 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.757 0.203 18497
4843 1 14 . 1 1 49 49 LEU H H 49 8.237 8.237 8.388 -0.151 18497
4844 1 14 . 1 1 50 50 ILE N N 50 119.715 119.715 119.656 0.059 18497
4845 1 14 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.657 -0.037 18497
4846 1 14 . 1 1 50 50 ILE C C 50 179.502 179.502 178.079 1.423 18497
4847 1 14 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.530 -0.470 18497
4848 1 14 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.925 0.045 18497
4849 1 14 . 1 1 50 50 ILE H H 50 7.543 7.543 8.429 -0.886 18497
4850 1 14 . 1 1 51 51 ILE N N 51 117.995 117.995 121.924 -3.929 18497
4851 1 14 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.386 0.154 18497
4852 1 14 . 1 1 51 51 ILE C C 51 179.197 179.197 177.484 1.713 18497
4853 1 14 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.793 -2.053 18497
4854 1 14 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.214 -0.564 18497
4855 1 14 . 1 1 51 51 ILE H H 51 7.475 7.475 8.053 -0.578 18497
4856 1 14 . 1 1 52 52 ASP N N 52 121.642 121.642 120.445 1.197 18497
4857 1 14 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.273 0.167 18497
4858 1 14 . 1 1 52 52 ASP C C 52 179.197 179.197 178.909 0.288 18497
4859 1 14 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.886 -0.786 18497
4860 1 14 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.118 0.182 18497
4861 1 14 . 1 1 52 52 ASP H H 52 8.559 8.559 8.261 0.298 18497
4862 1 14 . 1 1 53 53 ASN N N 53 117.131 117.131 118.434 -1.303 18497
4863 1 14 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.393 0.217 18497
4864 1 14 . 1 1 53 53 ASN C C 53 178.545 178.545 177.855 0.690 18497
4865 1 14 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.273 -1.573 18497
4866 1 14 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.666 0.034 18497
4867 1 14 . 1 1 53 53 ASN H H 53 8.106 8.106 8.285 -0.179 18497
4868 1 14 . 1 1 54 54 ARG N N 54 119.929 119.929 120.143 -0.214 18497
4869 1 14 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.994 0.126 18497
4870 1 14 . 1 1 54 54 ARG C C 54 176.892 176.892 177.807 -0.915 18497
4871 1 14 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.858 -0.698 18497
4872 1 14 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.331 -0.061 18497
4873 1 14 . 1 1 54 54 ARG H H 54 7.797 7.797 8.192 -0.395 18497
4874 1 14 . 1 1 55 55 ARG N N 55 119.227 119.227 116.865 2.362 18497
4875 1 14 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.313 -0.139 18497
4876 1 14 . 1 1 55 55 ARG C C 55 175.108 175.108 178.343 -3.235 18497
4877 1 14 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.017 3.863 18497
4878 1 14 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.829 1.831 18497
4879 1 14 . 1 1 55 55 ARG H H 55 7.857 7.857 8.112 -0.255 18497
4880 1 14 . 1 1 56 56 ILE N N 56 116.676 116.676 119.396 -2.720 18497
4881 1 14 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.137 -0.127 18497
4882 1 14 . 1 1 56 56 ILE C C 56 176.065 176.065 176.835 -0.770 18497
4883 1 14 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.250 -0.110 18497
4884 1 14 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.624 -0.384 18497
4885 1 14 . 1 1 56 56 ILE H H 56 8.317 8.317 8.471 -0.154 18497
4886 1 14 . 1 1 57 57 MET N N 57 122.058 122.058 118.566 3.492 18497
4887 1 14 . 1 1 57 57 MET HA H 57 4.420 4.420 4.725 -0.305 18497
4888 1 14 . 1 1 57 57 MET C C 57 177.283 177.283 175.393 1.890 18497
4889 1 14 . 1 1 57 57 MET CA C 57 56.030 56.030 53.221 2.809 18497
4890 1 14 . 1 1 57 57 MET CB C 57 32.515 32.515 32.125 0.390 18497
4891 1 14 . 1 1 57 57 MET H H 57 8.177 8.177 7.802 0.375 18497
4892 1 14 . 1 1 58 58 ASN N N 58 118.892 118.892 120.308 -1.416 18497
4893 1 14 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.454 0.236 18497
4894 1 14 . 1 1 58 58 ASN C C 58 176.500 176.500 176.253 0.247 18497
4895 1 14 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.073 -1.420 18497
4896 1 14 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.617 0.153 18497
4897 1 14 . 1 1 58 58 ASN H H 58 8.238 8.238 8.821 -0.583 18497
4898 1 14 . 1 1 59 59 GLN N N 59 120.456 120.456 117.629 2.827 18497
4899 1 14 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.209 0.101 18497
4900 1 14 . 1 1 59 59 GLN C C 59 175.326 175.326 175.674 -0.348 18497
4901 1 14 . 1 1 59 59 GLN CA C 59 56.030 56.030 56.294 -0.264 18497
4902 1 14 . 1 1 59 59 GLN CB C 59 28.800 28.800 28.773 0.027 18497
4903 1 14 . 1 1 59 59 GLN H H 59 8.196 8.196 8.160 0.036 18497
4904 1 14 . 1 1 60 60 ALA N N 60 125.116 125.116 123.507 1.609 18497
4905 1 14 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.183 0.199 18497
4906 1 14 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.091 -0.791 18497
4907 1 14 . 1 1 60 60 ALA CB C 60 19.110 19.110 18.660 0.451 18497
4908 1 14 . 1 1 60 60 ALA H H 60 8.293 8.293 7.574 0.719 18497
4909 1 14 . 1 1 61 61 SER N N 61 115.686 115.686 117.142 -1.456 18497
4910 1 14 . 1 1 61 61 SER HA H 61 4.470 4.470 4.554 -0.084 18497
4911 1 14 . 1 1 61 61 SER C C 61 175.674 175.674 173.835 1.839 18497
4912 1 14 . 1 1 61 61 SER CA C 61 58.160 58.160 58.897 -0.737 18497
4913 1 14 . 1 1 61 61 SER CB C 61 63.740 63.740 63.852 -0.112 18497
4914 1 14 . 1 1 61 61 SER H H 61 8.290 8.290 8.630 -0.340 18497
4915 1 15 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.588 -0.158 18497
4916 1 15 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.896 0.051 18497
4917 1 15 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.160 -0.030 18497
4918 1 15 . 1 1 3 3 HIS N N 3 119.985 119.985 118.278 1.707 18497
4919 1 15 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.778 -0.172 18497
4920 1 15 . 1 1 3 3 HIS C C 3 176.587 176.587 173.718 2.869 18497
4921 1 15 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.140 1.045 18497
4922 1 15 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.481 -0.010 18497
4923 1 15 . 1 1 3 3 HIS H H 3 8.526 8.526 8.093 0.433 18497
4924 1 15 . 1 1 4 4 MET N N 4 122.338 122.338 121.508 0.830 18497
4925 1 15 . 1 1 4 4 MET HA H 4 4.448 4.448 4.418 0.030 18497
4926 1 15 . 1 1 4 4 MET C C 4 175.108 175.108 176.083 -0.975 18497
4927 1 15 . 1 1 4 4 MET CA C 4 55.562 55.562 56.959 -1.397 18497
4928 1 15 . 1 1 4 4 MET CB C 4 33.141 33.141 31.744 1.397 18497
4929 1 15 . 1 1 4 4 MET H H 4 8.337 8.337 8.936 -0.599 18497
4930 1 15 . 1 1 5 5 SER N N 5 116.990 116.990 120.176 -3.186 18497
4931 1 15 . 1 1 5 5 SER HA H 5 4.400 4.400 4.569 -0.169 18497
4932 1 15 . 1 1 5 5 SER C C 5 177.979 177.979 173.615 4.364 18497
4933 1 15 . 1 1 5 5 SER CA C 5 58.039 58.039 58.827 -0.788 18497
4934 1 15 . 1 1 5 5 SER CB C 5 63.797 63.797 65.981 -2.184 18497
4935 1 15 . 1 1 5 5 SER H H 5 8.330 8.330 9.621 -1.291 18497
4936 1 15 . 1 1 6 6 TYR N N 6 122.027 122.027 121.672 0.355 18497
4937 1 15 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.781 -0.271 18497
4938 1 15 . 1 1 6 6 TYR C C 6 174.060 174.060 174.172 -0.112 18497
4939 1 15 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.330 0.470 18497
4940 1 15 . 1 1 6 6 TYR CB C 6 38.685 38.685 40.934 -2.249 18497
4941 1 15 . 1 1 6 6 TYR H H 6 8.201 8.201 8.482 -0.281 18497
4942 1 15 . 1 1 7 7 ASP N N 7 122.439 122.439 124.725 -2.286 18497
4943 1 15 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.186 0.363 18497
4944 1 15 . 1 1 7 7 ASP C C 7 175.150 175.150 176.188 -1.038 18497
4945 1 15 . 1 1 7 7 ASP CA C 7 53.640 53.640 56.638 -2.998 18497
4946 1 15 . 1 1 7 7 ASP CB C 7 41.300 41.300 40.430 0.870 18497
4947 1 15 . 1 1 7 7 ASP H H 7 8.119 8.119 7.844 0.275 18497
4948 1 15 . 1 1 8 8 ALA N N 8 124.655 124.655 118.320 6.335 18497
4949 1 15 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.096 0.134 18497
4950 1 15 . 1 1 8 8 ALA C C 8 175.935 175.935 178.010 -2.075 18497
4951 1 15 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.878 -0.985 18497
4952 1 15 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.191 -0.341 18497
4953 1 15 . 1 1 8 8 ALA H H 8 8.235 8.235 7.288 0.947 18497
4954 1 15 . 1 1 9 9 ASN N N 9 116.133 116.133 116.916 -0.783 18497
4955 1 15 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.798 -0.108 18497
4956 1 15 . 1 1 9 9 ASN C C 9 177.718 177.718 176.488 1.230 18497
4957 1 15 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.524 0.276 18497
4958 1 15 . 1 1 9 9 ASN CB C 9 38.770 38.770 40.421 -1.651 18497
4959 1 15 . 1 1 9 9 ASN H H 9 8.417 8.417 7.934 0.483 18497
4960 1 15 . 1 1 10 10 VAL N N 10 119.557 119.557 118.827 0.730 18497
4961 1 15 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.124 0.053 18497
4962 1 15 . 1 1 10 10 VAL C C 10 174.930 174.930 176.222 -1.292 18497
4963 1 15 . 1 1 10 10 VAL CA C 10 61.880 61.880 62.708 -0.828 18497
4964 1 15 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.248 0.412 18497
4965 1 15 . 1 1 10 10 VAL H H 10 7.859 7.859 7.908 -0.049 18497
4966 1 15 . 1 1 11 11 ILE N N 11 126.561 126.561 122.911 3.650 18497
4967 1 15 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.260 -0.220 18497
4968 1 15 . 1 1 11 11 ILE C C 11 175.935 175.935 175.938 -0.003 18497
4969 1 15 . 1 1 11 11 ILE CA C 11 59.500 59.500 60.863 -1.363 18497
4970 1 15 . 1 1 11 11 ILE CB C 11 37.700 37.700 39.494 -1.794 18497
4971 1 15 . 1 1 11 11 ILE H H 11 8.283 8.283 8.182 0.101 18497
4972 1 15 . 1 1 12 12 ASP N N 12 128.161 128.161 127.175 0.986 18497
4973 1 15 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.808 -0.078 18497
4974 1 15 . 1 1 12 12 ASP C C 12 174.891 174.891 175.912 -1.021 18497
4975 1 15 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.359 0.068 18497
4976 1 15 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.072 0.148 18497
4977 1 15 . 1 1 12 12 ASP H H 12 8.477 8.477 8.531 -0.054 18497
4978 1 15 . 1 1 13 13 ASP N N 13 127.435 127.435 127.380 0.055 18497
4979 1 15 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.341 -0.025 18497
4980 1 15 . 1 1 13 13 ASP C C 13 175.369 175.369 177.799 -2.430 18497
4981 1 15 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.191 0.409 18497
4982 1 15 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.401 -0.241 18497
4983 1 15 . 1 1 13 13 ASP H H 13 8.698 8.698 8.936 -0.238 18497
4984 1 15 . 1 1 14 14 GLU N N 14 119.796 119.796 118.945 0.851 18497
4985 1 15 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.091 -0.056 18497
4986 1 15 . 1 1 14 14 GLU C C 14 178.588 178.588 178.630 -0.042 18497
4987 1 15 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.129 0.371 18497
4988 1 15 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.601 -0.701 18497
4989 1 15 . 1 1 14 14 GLU H H 14 8.205 8.205 8.627 -0.422 18497
4990 1 15 . 1 1 15 15 ALA N N 15 124.156 124.156 123.415 0.741 18497
4991 1 15 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.103 0.073 18497
4992 1 15 . 1 1 15 15 ALA C C 15 179.502 179.502 179.648 -0.146 18497
4993 1 15 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.075 -0.075 18497
4994 1 15 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.068 0.832 18497
4995 1 15 . 1 1 15 15 ALA H H 15 8.473 8.473 7.607 0.866 18497
4996 1 15 . 1 1 16 16 VAL N N 16 117.585 117.585 119.226 -1.641 18497
4997 1 15 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.653 -0.119 18497
4998 1 15 . 1 1 16 16 VAL C C 16 179.545 179.545 178.089 1.456 18497
4999 1 15 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.256 0.744 18497
5000 1 15 . 1 1 16 16 VAL CB C 16 31.600 31.600 30.871 0.729 18497
5001 1 15 . 1 1 16 16 VAL H H 16 8.181 8.181 8.614 -0.433 18497
5002 1 15 . 1 1 17 17 LYS N N 17 119.377 119.377 120.032 -0.655 18497
5003 1 15 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.959 -0.003 18497
5004 1 15 . 1 1 17 17 LYS C C 17 178.197 178.197 178.959 -0.762 18497
5005 1 15 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.823 0.197 18497
5006 1 15 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.342 -0.212 18497
5007 1 15 . 1 1 17 17 LYS H H 17 8.001 8.001 8.143 -0.142 18497
5008 1 15 . 1 1 18 18 GLU N N 18 120.395 120.395 119.633 0.762 18497
5009 1 15 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.120 0.020 18497
5010 1 15 . 1 1 18 18 GLU C C 18 178.849 178.849 178.851 -0.002 18497
5011 1 15 . 1 1 18 18 GLU CA C 18 59.800 59.800 58.953 0.847 18497
5012 1 15 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.400 0.093 18497
5013 1 15 . 1 1 18 18 GLU H H 18 7.943 7.943 8.000 -0.057 18497
5014 1 15 . 1 1 19 19 VAL N N 19 121.088 121.088 120.334 0.754 18497
5015 1 15 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.674 -0.024 18497
5016 1 15 . 1 1 19 19 VAL C C 19 179.415 179.415 178.331 1.084 18497
5017 1 15 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.562 1.418 18497
5018 1 15 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.627 -0.027 18497
5019 1 15 . 1 1 19 19 VAL H H 19 8.335 8.335 8.742 -0.407 18497
5020 1 15 . 1 1 20 20 CYS N N 20 117.290 117.290 118.130 -0.840 18497
5021 1 15 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.308 0.372 18497
5022 1 15 . 1 1 20 20 CYS C C 20 178.110 178.110 176.122 1.988 18497
5023 1 15 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.543 0.657 18497
5024 1 15 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.019 -0.219 18497
5025 1 15 . 1 1 20 20 CYS H H 20 8.434 8.434 8.098 0.336 18497
5026 1 15 . 1 1 21 21 GLU N N 21 118.195 118.195 119.308 -1.113 18497
5027 1 15 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.200 -0.061 18497
5028 1 15 . 1 1 21 21 GLU C C 21 178.153 178.153 178.404 -0.251 18497
5029 1 15 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.671 1.079 18497
5030 1 15 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.624 -0.124 18497
5031 1 15 . 1 1 21 21 GLU H H 21 7.972 7.972 7.647 0.325 18497
5032 1 15 . 1 1 22 22 LYS N N 22 119.095 119.095 118.727 0.368 18497
5033 1 15 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.215 -0.210 18497
5034 1 15 . 1 1 22 22 LYS C C 22 179.371 179.371 178.439 0.932 18497
5035 1 15 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.384 0.316 18497
5036 1 15 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.513 0.407 18497
5037 1 15 . 1 1 22 22 LYS H H 22 8.071 8.071 8.438 -0.367 18497
5038 1 15 . 1 1 23 23 PHE N N 23 114.252 114.252 118.072 -3.820 18497
5039 1 15 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.598 -0.168 18497
5040 1 15 . 1 1 23 23 PHE C C 23 178.197 178.197 174.892 3.305 18497
5041 1 15 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.039 0.391 18497
5042 1 15 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.270 -1.500 18497
5043 1 15 . 1 1 23 23 PHE H H 23 8.491 8.491 8.011 0.480 18497
5044 1 15 . 1 1 24 24 GLU N N 24 119.819 119.819 113.464 6.355 18497
5045 1 15 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.025 0.045 18497
5046 1 15 . 1 1 24 24 GLU C C 24 177.457 177.457 175.760 1.697 18497
5047 1 15 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.213 -0.383 18497
5048 1 15 . 1 1 24 24 GLU CB C 24 26.800 26.800 26.764 0.036 18497
5049 1 15 . 1 1 24 24 GLU H H 24 7.867 7.867 8.569 -0.702 18497
5050 1 15 . 1 1 25 25 CYS N N 25 114.633 114.633 116.650 -2.017 18497
5051 1 15 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.979 0.408 18497
5052 1 15 . 1 1 25 25 CYS C C 25 174.760 174.760 174.884 -0.124 18497
5053 1 15 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.776 -2.015 18497
5054 1 15 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.371 1.229 18497
5055 1 15 . 1 1 25 25 CYS H H 25 8.156 8.156 7.876 0.280 18497
5056 1 15 . 1 1 26 26 THR N N 26 109.312 109.312 111.573 -2.261 18497
5057 1 15 . 1 1 26 26 THR HA H 26 4.770 4.770 4.424 0.346 18497
5058 1 15 . 1 1 26 26 THR C C 26 173.499 173.499 175.723 -2.224 18497
5059 1 15 . 1 1 26 26 THR CA C 26 60.723 60.723 62.097 -1.374 18497
5060 1 15 . 1 1 26 26 THR CB C 26 72.000 72.000 70.486 1.514 18497
5061 1 15 . 1 1 26 26 THR H H 26 8.460 8.460 8.206 0.254 18497
5062 1 15 . 1 1 27 27 GLU N N 27 122.233 122.233 123.584 -1.351 18497
5063 1 15 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.951 -0.441 18497
5064 1 15 . 1 1 27 27 GLU C C 27 176.544 176.544 178.195 -1.651 18497
5065 1 15 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.317 0.233 18497
5066 1 15 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.412 -0.462 18497
5067 1 15 . 1 1 27 27 GLU H H 27 9.327 9.327 8.981 0.346 18497
5068 1 15 . 1 1 28 28 SER N N 28 112.925 112.925 114.975 -2.050 18497
5069 1 15 . 1 1 28 28 SER HA H 28 4.062 4.062 4.176 -0.114 18497
5070 1 15 . 1 1 28 28 SER C C 28 178.545 178.545 176.074 2.471 18497
5071 1 15 . 1 1 28 28 SER CA C 28 61.350 61.350 61.028 0.322 18497
5072 1 15 . 1 1 28 28 SER CB C 28 62.400 62.400 62.738 -0.338 18497
5073 1 15 . 1 1 28 28 SER H H 28 8.320 8.320 8.490 -0.170 18497
5074 1 15 . 1 1 29 29 GLU N N 29 121.736 121.736 120.250 1.486 18497
5075 1 15 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.171 -0.181 18497
5076 1 15 . 1 1 29 29 GLU C C 29 176.674 176.674 178.287 -1.613 18497
5077 1 15 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.438 1.312 18497
5078 1 15 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.229 0.241 18497
5079 1 15 . 1 1 29 29 GLU H H 29 7.512 7.512 7.893 -0.381 18497
5080 1 15 . 1 1 30 30 VAL N N 30 119.480 119.480 120.135 -0.655 18497
5081 1 15 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.642 -0.265 18497
5082 1 15 . 1 1 30 30 VAL C C 30 179.241 179.241 177.961 1.280 18497
5083 1 15 . 1 1 30 30 VAL CA C 30 66.660 66.660 65.888 0.772 18497
5084 1 15 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.279 -0.209 18497
5085 1 15 . 1 1 30 30 VAL H H 30 7.492 7.492 7.759 -0.267 18497
5086 1 15 . 1 1 31 31 MET N N 31 117.220 117.220 117.432 -0.212 18497
5087 1 15 . 1 1 31 31 MET HA H 31 3.870 3.870 3.888 -0.018 18497
5088 1 15 . 1 1 31 31 MET C C 31 177.936 177.936 178.300 -0.364 18497
5089 1 15 . 1 1 31 31 MET CA C 31 57.630 57.630 59.210 -1.580 18497
5090 1 15 . 1 1 31 31 MET CB C 31 30.270 30.270 32.068 -1.798 18497
5091 1 15 . 1 1 31 31 MET H H 31 8.302 8.302 8.025 0.277 18497
5092 1 15 . 1 1 32 32 ASN N N 32 116.672 116.672 118.771 -2.099 18497
5093 1 15 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.405 -0.015 18497
5094 1 15 . 1 1 32 32 ASN C C 32 176.065 176.065 177.643 -1.578 18497
5095 1 15 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.870 -0.840 18497
5096 1 15 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.710 -1.000 18497
5097 1 15 . 1 1 32 32 ASN H H 32 8.313 8.313 8.467 -0.154 18497
5098 1 15 . 1 1 33 33 SER N N 33 117.471 117.471 114.741 2.730 18497
5099 1 15 . 1 1 33 33 SER HA H 33 4.150 4.150 4.283 -0.133 18497
5100 1 15 . 1 1 33 33 SER C C 33 178.806 178.806 175.735 3.071 18497
5101 1 15 . 1 1 33 33 SER CA C 33 62.950 62.950 60.758 2.192 18497
5102 1 15 . 1 1 33 33 SER CB C 33 62.600 62.600 63.310 -0.710 18497
5103 1 15 . 1 1 33 33 SER H H 33 7.851 7.851 7.681 0.170 18497
5104 1 15 . 1 1 34 34 LEU N N 34 122.839 122.839 119.241 3.598 18497
5105 1 15 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.283 -0.404 18497
5106 1 15 . 1 1 34 34 LEU C C 34 177.892 177.892 177.467 0.425 18497
5107 1 15 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.155 1.475 18497
5108 1 15 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.574 -1.774 18497
5109 1 15 . 1 1 34 34 LEU H H 34 8.128 8.128 7.376 0.752 18497
5110 1 15 . 1 1 35 35 TYR N N 35 116.666 116.666 117.996 -1.330 18497
5111 1 15 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.454 0.156 18497
5112 1 15 . 1 1 35 35 TYR C C 35 179.067 179.067 176.141 2.926 18497
5113 1 15 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.025 -2.135 18497
5114 1 15 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.715 -4.005 18497
5115 1 15 . 1 1 35 35 TYR H H 35 7.924 7.924 7.957 -0.033 18497
5116 1 15 . 1 1 36 36 SER N N 36 114.801 114.801 110.648 4.153 18497
5117 1 15 . 1 1 36 36 SER HA H 36 4.080 4.080 4.612 -0.532 18497
5118 1 15 . 1 1 36 36 SER C C 36 177.283 177.283 175.455 1.828 18497
5119 1 15 . 1 1 36 36 SER CA C 36 60.519 60.519 58.206 2.313 18497
5120 1 15 . 1 1 36 36 SER CB C 36 64.240 64.240 65.982 -1.742 18497
5121 1 15 . 1 1 36 36 SER H H 36 7.715 7.715 8.658 -0.943 18497
5122 1 15 . 1 1 37 37 GLY N N 37 109.803 109.803 112.175 -2.372 18497
5123 1 15 . 1 1 37 37 GLY C C 37 175.978 175.978 173.011 2.967 18497
5124 1 15 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.772 0.906 18497
5125 1 15 . 1 1 37 37 GLY H H 37 8.017 8.017 7.939 0.078 18497
5126 1 15 . 1 1 38 38 ASP N N 38 120.613 120.613 119.271 1.342 18497
5127 1 15 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.939 0.086 18497
5128 1 15 . 1 1 38 38 ASP C C 38 173.368 173.368 174.896 -1.528 18497
5129 1 15 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.941 -1.221 18497
5130 1 15 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.024 -1.604 18497
5131 1 15 . 1 1 38 38 ASP H H 38 8.006 8.006 7.922 0.084 18497
5132 1 15 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.338 0.002 18497
5133 1 15 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.477 -0.727 18497
5134 1 15 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.138 -0.008 18497
5135 1 15 . 1 1 40 40 GLN N N 40 115.056 115.056 113.955 1.101 18497
5136 1 15 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.243 0.037 18497
5137 1 15 . 1 1 40 40 GLN C C 40 177.066 177.066 176.074 0.992 18497
5138 1 15 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.199 -0.489 18497
5139 1 15 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.704 -0.024 18497
5140 1 15 . 1 1 40 40 GLN H H 40 8.237 8.237 8.345 -0.108 18497
5141 1 15 . 1 1 41 41 ASP N N 41 122.839 122.839 121.547 1.292 18497
5142 1 15 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.595 -0.282 18497
5143 1 15 . 1 1 41 41 ASP C C 41 175.804 175.804 177.428 -1.624 18497
5144 1 15 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.588 0.652 18497
5145 1 15 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.968 -0.748 18497
5146 1 15 . 1 1 41 41 ASP H H 41 7.211 7.211 7.817 -0.606 18497
5147 1 15 . 1 1 42 42 GLN N N 42 124.547 124.547 124.263 0.284 18497
5148 1 15 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.030 -0.170 18497
5149 1 15 . 1 1 42 42 GLN C C 42 177.196 177.196 177.341 -0.145 18497
5150 1 15 . 1 1 42 42 GLN CA C 42 59.220 59.220 58.861 0.359 18497
5151 1 15 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.662 -0.262 18497
5152 1 15 . 1 1 42 42 GLN H H 42 8.719 8.719 8.689 0.030 18497
5153 1 15 . 1 1 43 43 LEU N N 43 118.960 118.960 120.186 -1.226 18497
5154 1 15 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.922 -0.237 18497
5155 1 15 . 1 1 43 43 LEU C C 43 178.066 178.066 178.822 -0.756 18497
5156 1 15 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.280 0.080 18497
5157 1 15 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.678 -1.288 18497
5158 1 15 . 1 1 43 43 LEU H H 43 8.206 8.206 8.214 -0.008 18497
5159 1 15 . 1 1 44 44 ALA N N 44 121.666 121.666 122.270 -0.604 18497
5160 1 15 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.133 -0.254 18497
5161 1 15 . 1 1 44 44 ALA C C 44 178.327 178.327 180.104 -1.777 18497
5162 1 15 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.790 -0.080 18497
5163 1 15 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.315 0.265 18497
5164 1 15 . 1 1 44 44 ALA H H 44 7.402 7.402 7.633 -0.231 18497
5165 1 15 . 1 1 45 45 VAL N N 45 118.589 118.589 120.766 -2.177 18497
5166 1 15 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.663 -0.003 18497
5167 1 15 . 1 1 45 45 VAL C C 45 179.893 179.893 177.682 2.211 18497
5168 1 15 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.615 -0.215 18497
5169 1 15 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.683 0.448 18497
5170 1 15 . 1 1 45 45 VAL H H 45 8.449 8.449 8.595 -0.146 18497
5171 1 15 . 1 1 46 46 ALA N N 46 121.006 121.006 122.570 -1.564 18497
5172 1 15 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.753 0.377 18497
5173 1 15 . 1 1 46 46 ALA C C 46 179.110 179.110 178.944 0.166 18497
5174 1 15 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.118 -0.148 18497
5175 1 15 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.168 1.942 18497
5176 1 15 . 1 1 46 46 ALA H H 46 7.654 7.654 7.947 -0.293 18497
5177 1 15 . 1 1 47 47 TYR N N 47 119.140 119.140 119.861 -0.721 18497
5178 1 15 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.944 -0.194 18497
5179 1 15 . 1 1 47 47 TYR C C 47 179.328 179.328 177.654 1.674 18497
5180 1 15 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.048 -0.168 18497
5181 1 15 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.279 0.221 18497
5182 1 15 . 1 1 47 47 TYR H H 47 8.077 8.077 7.744 0.333 18497
5183 1 15 . 1 1 48 48 HIS N N 48 116.422 116.422 118.310 -1.888 18497
5184 1 15 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.116 -0.016 18497
5185 1 15 . 1 1 48 48 HIS C C 48 178.023 178.023 177.709 0.314 18497
5186 1 15 . 1 1 48 48 HIS CA C 48 60.020 60.020 61.117 -1.097 18497
5187 1 15 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.695 -0.755 18497
5188 1 15 . 1 1 48 48 HIS H H 48 8.326 8.326 8.413 -0.087 18497
5189 1 15 . 1 1 49 49 LEU N N 49 120.974 120.974 120.657 0.317 18497
5190 1 15 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.012 0.143 18497
5191 1 15 . 1 1 49 49 LEU C C 49 177.417 177.417 179.189 -1.772 18497
5192 1 15 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.139 -0.249 18497
5193 1 15 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.773 0.188 18497
5194 1 15 . 1 1 49 49 LEU H H 49 8.237 8.237 8.410 -0.173 18497
5195 1 15 . 1 1 50 50 ILE N N 50 119.715 119.715 119.593 0.122 18497
5196 1 15 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.563 0.057 18497
5197 1 15 . 1 1 50 50 ILE C C 50 179.502 179.502 177.848 1.654 18497
5198 1 15 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.594 -0.534 18497
5199 1 15 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.980 -0.010 18497
5200 1 15 . 1 1 50 50 ILE H H 50 7.543 7.543 8.421 -0.878 18497
5201 1 15 . 1 1 51 51 ILE N N 51 117.995 117.995 121.728 -3.733 18497
5202 1 15 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.367 0.173 18497
5203 1 15 . 1 1 51 51 ILE C C 51 179.197 179.197 177.615 1.582 18497
5204 1 15 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.841 -2.101 18497
5205 1 15 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.246 -0.596 18497
5206 1 15 . 1 1 51 51 ILE H H 51 7.475 7.475 8.210 -0.735 18497
5207 1 15 . 1 1 52 52 ASP N N 52 121.642 121.642 120.014 1.628 18497
5208 1 15 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.272 0.168 18497
5209 1 15 . 1 1 52 52 ASP C C 52 179.197 179.197 178.583 0.614 18497
5210 1 15 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.783 -0.683 18497
5211 1 15 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.102 0.198 18497
5212 1 15 . 1 1 52 52 ASP H H 52 8.559 8.559 8.334 0.225 18497
5213 1 15 . 1 1 53 53 ASN N N 53 117.131 117.131 119.632 -2.501 18497
5214 1 15 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.339 0.271 18497
5215 1 15 . 1 1 53 53 ASN C C 53 178.545 178.545 177.631 0.914 18497
5216 1 15 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.337 -1.637 18497
5217 1 15 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.923 -0.223 18497
5218 1 15 . 1 1 53 53 ASN H H 53 8.106 8.106 8.237 -0.131 18497
5219 1 15 . 1 1 54 54 ARG N N 54 119.929 119.929 119.943 -0.014 18497
5220 1 15 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.007 0.113 18497
5221 1 15 . 1 1 54 54 ARG C C 54 176.892 176.892 178.305 -1.413 18497
5222 1 15 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.827 -0.667 18497
5223 1 15 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.239 0.031 18497
5224 1 15 . 1 1 54 54 ARG H H 54 7.797 7.797 8.223 -0.426 18497
5225 1 15 . 1 1 55 55 ARG N N 55 119.227 119.227 118.151 1.076 18497
5226 1 15 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.166 0.008 18497
5227 1 15 . 1 1 55 55 ARG C C 55 175.108 175.108 177.894 -2.786 18497
5228 1 15 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.499 3.381 18497
5229 1 15 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.831 1.829 18497
5230 1 15 . 1 1 55 55 ARG H H 55 7.857 7.857 7.993 -0.136 18497
5231 1 15 . 1 1 56 56 ILE N N 56 116.676 116.676 118.332 -1.656 18497
5232 1 15 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.039 -0.029 18497
5233 1 15 . 1 1 56 56 ILE C C 56 176.065 176.065 176.571 -0.506 18497
5234 1 15 . 1 1 56 56 ILE CA C 56 62.140 62.140 63.322 -1.182 18497
5235 1 15 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.629 -1.389 18497
5236 1 15 . 1 1 56 56 ILE H H 56 8.317 8.317 8.205 0.112 18497
5237 1 15 . 1 1 57 57 MET N N 57 122.058 122.058 116.780 5.278 18497
5238 1 15 . 1 1 57 57 MET HA H 57 4.420 4.420 4.571 -0.150 18497
5239 1 15 . 1 1 57 57 MET C C 57 177.283 177.283 174.296 2.987 18497
5240 1 15 . 1 1 57 57 MET CA C 57 56.030 56.030 55.192 0.838 18497
5241 1 15 . 1 1 57 57 MET CB C 57 32.515 32.515 35.044 -2.529 18497
5242 1 15 . 1 1 57 57 MET H H 57 8.177 8.177 7.659 0.518 18497
5243 1 15 . 1 1 58 58 ASN N N 58 118.892 118.892 125.629 -6.737 18497
5244 1 15 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.885 -0.195 18497
5245 1 15 . 1 1 58 58 ASN C C 58 176.500 176.500 174.735 1.765 18497
5246 1 15 . 1 1 58 58 ASN CA C 58 53.653 53.653 53.290 0.363 18497
5247 1 15 . 1 1 58 58 ASN CB C 58 38.770 38.770 37.313 1.457 18497
5248 1 15 . 1 1 58 58 ASN H H 58 8.238 8.238 8.570 -0.332 18497
5249 1 15 . 1 1 59 59 GLN N N 59 120.456 120.456 121.460 -1.004 18497
5250 1 15 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.205 0.105 18497
5251 1 15 . 1 1 59 59 GLN C C 59 175.326 175.326 174.643 0.683 18497
5252 1 15 . 1 1 59 59 GLN CA C 59 56.030 56.030 56.724 -0.694 18497
5253 1 15 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.595 -0.795 18497
5254 1 15 . 1 1 59 59 GLN H H 59 8.196 8.196 7.764 0.432 18497
5255 1 15 . 1 1 60 60 ALA N N 60 125.116 125.116 126.399 -1.283 18497
5256 1 15 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.595 -0.213 18497
5257 1 15 . 1 1 60 60 ALA CA C 60 52.300 52.300 51.314 0.986 18497
5258 1 15 . 1 1 60 60 ALA CB C 60 19.110 19.110 20.504 -1.394 18497
5259 1 15 . 1 1 60 60 ALA H H 60 8.293 8.293 8.083 0.210 18497
5260 1 15 . 1 1 61 61 SER N N 61 115.686 115.686 115.769 -0.083 18497
5261 1 15 . 1 1 61 61 SER HA H 61 4.470 4.470 5.091 -0.621 18497
5262 1 15 . 1 1 61 61 SER C C 61 175.674 175.674 174.589 1.085 18497
5263 1 15 . 1 1 61 61 SER CA C 61 58.160 58.160 58.178 -0.018 18497
5264 1 15 . 1 1 61 61 SER CB C 61 63.740 63.740 64.199 -0.459 18497
5265 1 15 . 1 1 61 61 SER H H 61 8.290 8.290 8.930 -0.640 18497
5266 1 16 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.667 -0.237 18497
5267 1 16 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.298 0.648 18497
5268 1 16 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.657 -0.527 18497
5269 1 16 . 1 1 3 3 HIS N N 3 119.985 119.985 116.121 3.864 18497
5270 1 16 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.522 0.084 18497
5271 1 16 . 1 1 3 3 HIS C C 3 176.587 176.587 174.372 2.215 18497
5272 1 16 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.432 -0.247 18497
5273 1 16 . 1 1 3 3 HIS CB C 3 30.471 30.471 29.990 0.481 18497
5274 1 16 . 1 1 3 3 HIS H H 3 8.526 8.526 8.016 0.510 18497
5275 1 16 . 1 1 4 4 MET N N 4 122.338 122.338 119.387 2.951 18497
5276 1 16 . 1 1 4 4 MET HA H 4 4.448 4.448 4.732 -0.284 18497
5277 1 16 . 1 1 4 4 MET C C 4 175.108 175.108 175.313 -0.205 18497
5278 1 16 . 1 1 4 4 MET CA C 4 55.562 55.562 54.407 1.155 18497
5279 1 16 . 1 1 4 4 MET CB C 4 33.141 33.141 35.182 -2.041 18497
5280 1 16 . 1 1 4 4 MET H H 4 8.337 8.337 7.951 0.386 18497
5281 1 16 . 1 1 5 5 SER N N 5 116.990 116.990 119.494 -2.504 18497
5282 1 16 . 1 1 5 5 SER HA H 5 4.400 4.400 4.430 -0.030 18497
5283 1 16 . 1 1 5 5 SER C C 5 177.979 177.979 173.780 4.199 18497
5284 1 16 . 1 1 5 5 SER CA C 5 58.039 58.039 58.285 -0.246 18497
5285 1 16 . 1 1 5 5 SER CB C 5 63.797 63.797 63.563 0.234 18497
5286 1 16 . 1 1 5 5 SER H H 5 8.330 8.330 8.619 -0.289 18497
5287 1 16 . 1 1 6 6 TYR N N 6 122.027 122.027 123.331 -1.304 18497
5288 1 16 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.419 0.091 18497
5289 1 16 . 1 1 6 6 TYR C C 6 174.060 174.060 174.804 -0.744 18497
5290 1 16 . 1 1 6 6 TYR CA C 6 57.800 57.800 59.827 -2.027 18497
5291 1 16 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.135 -0.450 18497
5292 1 16 . 1 1 6 6 TYR H H 6 8.201 8.201 7.588 0.613 18497
5293 1 16 . 1 1 7 7 ASP N N 7 122.439 122.439 125.095 -2.656 18497
5294 1 16 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.306 0.243 18497
5295 1 16 . 1 1 7 7 ASP C C 7 175.150 175.150 175.492 -0.342 18497
5296 1 16 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.187 0.453 18497
5297 1 16 . 1 1 7 7 ASP CB C 7 41.300 41.300 43.651 -2.350 18497
5298 1 16 . 1 1 7 7 ASP H H 7 8.119 8.119 7.935 0.184 18497
5299 1 16 . 1 1 8 8 ALA N N 8 124.655 124.655 125.887 -1.232 18497
5300 1 16 . 1 1 8 8 ALA HA H 8 4.230 4.230 3.881 0.349 18497
5301 1 16 . 1 1 8 8 ALA C C 8 175.935 175.935 177.952 -2.017 18497
5302 1 16 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.710 -1.817 18497
5303 1 16 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.826 0.024 18497
5304 1 16 . 1 1 8 8 ALA H H 8 8.235 8.235 8.599 -0.364 18497
5305 1 16 . 1 1 9 9 ASN N N 9 116.133 116.133 115.345 0.788 18497
5306 1 16 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.663 0.027 18497
5307 1 16 . 1 1 9 9 ASN C C 9 177.718 177.718 175.948 1.770 18497
5308 1 16 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.415 -0.615 18497
5309 1 16 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.272 -0.502 18497
5310 1 16 . 1 1 9 9 ASN H H 9 8.417 8.417 8.136 0.281 18497
5311 1 16 . 1 1 10 10 VAL N N 10 119.557 119.557 121.668 -2.111 18497
5312 1 16 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.132 0.045 18497
5313 1 16 . 1 1 10 10 VAL C C 10 174.930 174.930 174.991 -0.061 18497
5314 1 16 . 1 1 10 10 VAL CA C 10 61.880 61.880 61.837 0.043 18497
5315 1 16 . 1 1 10 10 VAL CB C 10 32.660 32.660 30.531 2.129 18497
5316 1 16 . 1 1 10 10 VAL H H 10 7.859 7.859 7.948 -0.089 18497
5317 1 16 . 1 1 11 11 ILE N N 11 126.561 126.561 126.836 -0.275 18497
5318 1 16 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.144 -0.104 18497
5319 1 16 . 1 1 11 11 ILE C C 11 175.935 175.935 175.564 0.371 18497
5320 1 16 . 1 1 11 11 ILE CA C 11 59.500 59.500 62.103 -2.603 18497
5321 1 16 . 1 1 11 11 ILE CB C 11 37.700 37.700 39.199 -1.499 18497
5322 1 16 . 1 1 11 11 ILE H H 11 8.283 8.283 7.791 0.492 18497
5323 1 16 . 1 1 12 12 ASP N N 12 128.161 128.161 124.939 3.222 18497
5324 1 16 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.948 -0.218 18497
5325 1 16 . 1 1 12 12 ASP C C 12 174.891 174.891 175.645 -0.754 18497
5326 1 16 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.562 -0.135 18497
5327 1 16 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.658 -0.438 18497
5328 1 16 . 1 1 12 12 ASP H H 12 8.477 8.477 8.511 -0.034 18497
5329 1 16 . 1 1 13 13 ASP N N 13 127.435 127.435 126.610 0.825 18497
5330 1 16 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.357 -0.041 18497
5331 1 16 . 1 1 13 13 ASP C C 13 175.369 175.369 177.588 -2.219 18497
5332 1 16 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.057 0.543 18497
5333 1 16 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.279 -0.118 18497
5334 1 16 . 1 1 13 13 ASP H H 13 8.698 8.698 8.956 -0.258 18497
5335 1 16 . 1 1 14 14 GLU N N 14 119.796 119.796 118.618 1.178 18497
5336 1 16 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.086 -0.051 18497
5337 1 16 . 1 1 14 14 GLU C C 14 178.588 178.588 178.729 -0.141 18497
5338 1 16 . 1 1 14 14 GLU CA C 14 59.500 59.500 58.935 0.565 18497
5339 1 16 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.678 -0.778 18497
5340 1 16 . 1 1 14 14 GLU H H 14 8.205 8.205 8.745 -0.540 18497
5341 1 16 . 1 1 15 15 ALA N N 15 124.156 124.156 122.903 1.253 18497
5342 1 16 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.051 0.125 18497
5343 1 16 . 1 1 15 15 ALA C C 15 179.502 179.502 179.426 0.076 18497
5344 1 16 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.174 -0.174 18497
5345 1 16 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.411 0.489 18497
5346 1 16 . 1 1 15 15 ALA H H 15 8.473 8.473 7.666 0.807 18497
5347 1 16 . 1 1 16 16 VAL N N 16 117.585 117.585 118.860 -1.275 18497
5348 1 16 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.637 -0.103 18497
5349 1 16 . 1 1 16 16 VAL C C 16 179.545 179.545 178.088 1.457 18497
5350 1 16 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.163 0.837 18497
5351 1 16 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.072 0.528 18497
5352 1 16 . 1 1 16 16 VAL H H 16 8.181 8.181 8.620 -0.439 18497
5353 1 16 . 1 1 17 17 LYS N N 17 119.377 119.377 118.233 1.144 18497
5354 1 16 . 1 1 17 17 LYS HA H 17 3.956 3.956 4.091 -0.135 18497
5355 1 16 . 1 1 17 17 LYS C C 17 178.197 178.197 178.141 0.056 18497
5356 1 16 . 1 1 17 17 LYS CA C 17 60.020 60.020 58.895 1.125 18497
5357 1 16 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.364 -0.234 18497
5358 1 16 . 1 1 17 17 LYS H H 17 8.001 8.001 7.717 0.284 18497
5359 1 16 . 1 1 18 18 GLU N N 18 120.395 120.395 119.171 1.224 18497
5360 1 16 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.230 -0.090 18497
5361 1 16 . 1 1 18 18 GLU C C 18 178.849 178.849 178.431 0.418 18497
5362 1 16 . 1 1 18 18 GLU CA C 18 59.800 59.800 58.649 1.151 18497
5363 1 16 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.893 -0.400 18497
5364 1 16 . 1 1 18 18 GLU H H 18 7.943 7.943 7.463 0.480 18497
5365 1 16 . 1 1 19 19 VAL N N 19 121.088 121.088 120.577 0.511 18497
5366 1 16 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.643 0.007 18497
5367 1 16 . 1 1 19 19 VAL C C 19 179.415 179.415 178.191 1.224 18497
5368 1 16 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.709 1.271 18497
5369 1 16 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.546 0.054 18497
5370 1 16 . 1 1 19 19 VAL H H 19 8.335 8.335 8.611 -0.276 18497
5371 1 16 . 1 1 20 20 CYS N N 20 117.290 117.290 116.717 0.573 18497
5372 1 16 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.046 0.634 18497
5373 1 16 . 1 1 20 20 CYS C C 20 178.110 178.110 176.337 1.773 18497
5374 1 16 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.781 -0.581 18497
5375 1 16 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.173 -0.373 18497
5376 1 16 . 1 1 20 20 CYS H H 20 8.434 8.434 7.838 0.596 18497
5377 1 16 . 1 1 21 21 GLU N N 21 118.195 118.195 119.515 -1.320 18497
5378 1 16 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.199 -0.060 18497
5379 1 16 . 1 1 21 21 GLU C C 21 178.153 178.153 178.979 -0.826 18497
5380 1 16 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.430 1.320 18497
5381 1 16 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.766 -0.266 18497
5382 1 16 . 1 1 21 21 GLU H H 21 7.972 7.972 7.893 0.079 18497
5383 1 16 . 1 1 22 22 LYS N N 22 119.095 119.095 119.603 -0.508 18497
5384 1 16 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.166 -0.161 18497
5385 1 16 . 1 1 22 22 LYS C C 22 179.371 179.371 178.163 1.208 18497
5386 1 16 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.935 -0.235 18497
5387 1 16 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.863 0.057 18497
5388 1 16 . 1 1 22 22 LYS H H 22 8.071 8.071 8.306 -0.235 18497
5389 1 16 . 1 1 23 23 PHE N N 23 114.252 114.252 116.507 -2.255 18497
5390 1 16 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.564 -0.134 18497
5391 1 16 . 1 1 23 23 PHE C C 23 178.197 178.197 174.141 4.056 18497
5392 1 16 . 1 1 23 23 PHE CA C 23 58.430 58.430 57.511 0.919 18497
5393 1 16 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.045 -1.275 18497
5394 1 16 . 1 1 23 23 PHE H H 23 8.491 8.491 7.995 0.496 18497
5395 1 16 . 1 1 24 24 GLU N N 24 119.819 119.819 117.031 2.788 18497
5396 1 16 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.094 -0.024 18497
5397 1 16 . 1 1 24 24 GLU C C 24 177.457 177.457 175.856 1.601 18497
5398 1 16 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.330 -0.500 18497
5399 1 16 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.225 -0.425 18497
5400 1 16 . 1 1 24 24 GLU H H 24 7.867 7.867 8.144 -0.277 18497
5401 1 16 . 1 1 25 25 CYS N N 25 114.633 114.633 118.033 -3.400 18497
5402 1 16 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.737 0.650 18497
5403 1 16 . 1 1 25 25 CYS C C 25 174.760 174.760 173.735 1.025 18497
5404 1 16 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.359 -2.598 18497
5405 1 16 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.025 1.575 18497
5406 1 16 . 1 1 25 25 CYS H H 25 8.156 8.156 7.916 0.240 18497
5407 1 16 . 1 1 26 26 THR N N 26 109.312 109.312 113.711 -4.399 18497
5408 1 16 . 1 1 26 26 THR HA H 26 4.770 4.770 4.604 0.166 18497
5409 1 16 . 1 1 26 26 THR C C 26 173.499 173.499 174.992 -1.493 18497
5410 1 16 . 1 1 26 26 THR CA C 26 60.723 60.723 60.994 -0.271 18497
5411 1 16 . 1 1 26 26 THR CB C 26 72.000 72.000 71.723 0.277 18497
5412 1 16 . 1 1 26 26 THR H H 26 8.460 8.460 7.995 0.465 18497
5413 1 16 . 1 1 27 27 GLU N N 27 122.233 122.233 125.475 -3.242 18497
5414 1 16 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.915 -0.405 18497
5415 1 16 . 1 1 27 27 GLU C C 27 176.544 176.544 178.205 -1.661 18497
5416 1 16 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.366 0.184 18497
5417 1 16 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.568 -0.618 18497
5418 1 16 . 1 1 27 27 GLU H H 27 9.327 9.327 9.006 0.321 18497
5419 1 16 . 1 1 28 28 SER N N 28 112.925 112.925 113.978 -1.053 18497
5420 1 16 . 1 1 28 28 SER HA H 28 4.062 4.062 4.144 -0.082 18497
5421 1 16 . 1 1 28 28 SER C C 28 178.545 178.545 176.604 1.941 18497
5422 1 16 . 1 1 28 28 SER CA C 28 61.350 61.350 61.225 0.124 18497
5423 1 16 . 1 1 28 28 SER CB C 28 62.400 62.400 62.785 -0.385 18497
5424 1 16 . 1 1 28 28 SER H H 28 8.320 8.320 8.454 -0.134 18497
5425 1 16 . 1 1 29 29 GLU N N 29 121.736 121.736 121.618 0.118 18497
5426 1 16 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.224 -0.234 18497
5427 1 16 . 1 1 29 29 GLU C C 29 176.674 176.674 178.663 -1.989 18497
5428 1 16 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.629 1.121 18497
5429 1 16 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.640 -0.170 18497
5430 1 16 . 1 1 29 29 GLU H H 29 7.512 7.512 7.565 -0.053 18497
5431 1 16 . 1 1 30 30 VAL N N 30 119.480 119.480 120.656 -1.176 18497
5432 1 16 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.658 -0.281 18497
5433 1 16 . 1 1 30 30 VAL C C 30 179.241 179.241 178.191 1.050 18497
5434 1 16 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.537 0.123 18497
5435 1 16 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.661 -0.591 18497
5436 1 16 . 1 1 30 30 VAL H H 30 7.492 7.492 8.371 -0.879 18497
5437 1 16 . 1 1 31 31 MET N N 31 117.220 117.220 117.922 -0.702 18497
5438 1 16 . 1 1 31 31 MET HA H 31 3.870 3.870 3.841 0.029 18497
5439 1 16 . 1 1 31 31 MET C C 31 177.936 177.936 177.685 0.251 18497
5440 1 16 . 1 1 31 31 MET CA C 31 57.630 57.630 59.592 -1.962 18497
5441 1 16 . 1 1 31 31 MET CB C 31 30.270 30.270 32.196 -1.926 18497
5442 1 16 . 1 1 31 31 MET H H 31 8.302 8.302 8.593 -0.291 18497
5443 1 16 . 1 1 32 32 ASN N N 32 116.672 116.672 118.579 -1.907 18497
5444 1 16 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.337 0.053 18497
5445 1 16 . 1 1 32 32 ASN C C 32 176.065 176.065 177.468 -1.403 18497
5446 1 16 . 1 1 32 32 ASN CA C 32 56.030 56.030 57.079 -1.049 18497
5447 1 16 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.617 -0.908 18497
5448 1 16 . 1 1 32 32 ASN H H 32 8.313 8.313 7.933 0.380 18497
5449 1 16 . 1 1 33 33 SER N N 33 117.471 117.471 116.048 1.423 18497
5450 1 16 . 1 1 33 33 SER HA H 33 4.150 4.150 4.206 -0.056 18497
5451 1 16 . 1 1 33 33 SER C C 33 178.806 178.806 176.320 2.486 18497
5452 1 16 . 1 1 33 33 SER CA C 33 62.950 62.950 61.407 1.544 18497
5453 1 16 . 1 1 33 33 SER CB C 33 62.600 62.600 63.054 -0.454 18497
5454 1 16 . 1 1 33 33 SER H H 33 7.851 7.851 7.738 0.113 18497
5455 1 16 . 1 1 34 34 LEU N N 34 122.839 122.839 121.442 1.397 18497
5456 1 16 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.032 -0.153 18497
5457 1 16 . 1 1 34 34 LEU C C 34 177.892 177.892 177.952 -0.060 18497
5458 1 16 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.876 0.754 18497
5459 1 16 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.732 -0.932 18497
5460 1 16 . 1 1 34 34 LEU H H 34 8.128 8.128 7.366 0.762 18497
5461 1 16 . 1 1 35 35 TYR N N 35 116.666 116.666 120.813 -4.147 18497
5462 1 16 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.325 0.285 18497
5463 1 16 . 1 1 35 35 TYR C C 35 179.067 179.067 177.403 1.664 18497
5464 1 16 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.537 -2.647 18497
5465 1 16 . 1 1 35 35 TYR CB C 35 37.710 37.710 38.959 -1.249 18497
5466 1 16 . 1 1 35 35 TYR H H 35 7.924 7.924 8.489 -0.565 18497
5467 1 16 . 1 1 36 36 SER N N 36 114.801 114.801 114.939 -0.138 18497
5468 1 16 . 1 1 36 36 SER HA H 36 4.080 4.080 4.284 -0.204 18497
5469 1 16 . 1 1 36 36 SER C C 36 177.283 177.283 174.822 2.461 18497
5470 1 16 . 1 1 36 36 SER CA C 36 60.519 60.519 60.323 0.196 18497
5471 1 16 . 1 1 36 36 SER CB C 36 64.240 64.240 63.833 0.407 18497
5472 1 16 . 1 1 36 36 SER H H 36 7.715 7.715 8.447 -0.732 18497
5473 1 16 . 1 1 37 37 GLY N N 37 109.803 109.803 108.964 0.839 18497
5474 1 16 . 1 1 37 37 GLY C C 37 175.978 175.978 173.740 2.238 18497
5475 1 16 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.819 0.859 18497
5476 1 16 . 1 1 37 37 GLY H H 37 8.017 8.017 7.702 0.315 18497
5477 1 16 . 1 1 38 38 ASP N N 38 120.613 120.613 121.999 -1.386 18497
5478 1 16 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.005 0.020 18497
5479 1 16 . 1 1 38 38 ASP C C 38 173.368 173.368 176.229 -2.861 18497
5480 1 16 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.689 0.031 18497
5481 1 16 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.402 -0.982 18497
5482 1 16 . 1 1 38 38 ASP H H 38 8.006 8.006 7.891 0.115 18497
5483 1 16 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.461 -0.121 18497
5484 1 16 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.889 -0.140 18497
5485 1 16 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.398 -0.268 18497
5486 1 16 . 1 1 40 40 GLN N N 40 115.056 115.056 116.610 -1.554 18497
5487 1 16 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.241 0.039 18497
5488 1 16 . 1 1 40 40 GLN C C 40 177.066 177.066 176.126 0.940 18497
5489 1 16 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.935 -1.225 18497
5490 1 16 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.951 -0.271 18497
5491 1 16 . 1 1 40 40 GLN H H 40 8.237 8.237 8.138 0.099 18497
5492 1 16 . 1 1 41 41 ASP N N 41 122.839 122.839 121.234 1.605 18497
5493 1 16 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.493 -0.180 18497
5494 1 16 . 1 1 41 41 ASP C C 41 175.804 175.804 177.666 -1.862 18497
5495 1 16 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.156 1.084 18497
5496 1 16 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.500 -0.280 18497
5497 1 16 . 1 1 41 41 ASP H H 41 7.211 7.211 7.437 -0.226 18497
5498 1 16 . 1 1 42 42 GLN N N 42 124.547 124.547 123.382 1.165 18497
5499 1 16 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.028 -0.168 18497
5500 1 16 . 1 1 42 42 GLN C C 42 177.196 177.196 177.662 -0.466 18497
5501 1 16 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.319 -0.099 18497
5502 1 16 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.093 -0.693 18497
5503 1 16 . 1 1 42 42 GLN H H 42 8.719 8.719 8.827 -0.108 18497
5504 1 16 . 1 1 43 43 LEU N N 43 118.960 118.960 118.710 0.250 18497
5505 1 16 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.817 -0.132 18497
5506 1 16 . 1 1 43 43 LEU C C 43 178.066 178.066 178.268 -0.202 18497
5507 1 16 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.890 0.470 18497
5508 1 16 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.451 -1.061 18497
5509 1 16 . 1 1 43 43 LEU H H 43 8.206 8.206 8.021 0.185 18497
5510 1 16 . 1 1 44 44 ALA N N 44 121.666 121.666 122.913 -1.247 18497
5511 1 16 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.068 -0.189 18497
5512 1 16 . 1 1 44 44 ALA C C 44 178.327 178.327 179.560 -1.233 18497
5513 1 16 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.908 -0.199 18497
5514 1 16 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.214 0.366 18497
5515 1 16 . 1 1 44 44 ALA H H 44 7.402 7.402 7.566 -0.164 18497
5516 1 16 . 1 1 45 45 VAL N N 45 118.589 118.589 120.360 -1.771 18497
5517 1 16 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.648 0.012 18497
5518 1 16 . 1 1 45 45 VAL C C 45 179.893 179.893 177.912 1.981 18497
5519 1 16 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.894 -0.494 18497
5520 1 16 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.194 0.937 18497
5521 1 16 . 1 1 45 45 VAL H H 45 8.449 8.449 8.547 -0.098 18497
5522 1 16 . 1 1 46 46 ALA N N 46 121.006 121.006 122.537 -1.531 18497
5523 1 16 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.866 0.264 18497
5524 1 16 . 1 1 46 46 ALA C C 46 179.110 179.110 179.152 -0.042 18497
5525 1 16 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.112 -0.142 18497
5526 1 16 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.435 1.675 18497
5527 1 16 . 1 1 46 46 ALA H H 46 7.654 7.654 7.891 -0.237 18497
5528 1 16 . 1 1 47 47 TYR N N 47 119.140 119.140 119.962 -0.822 18497
5529 1 16 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.993 -0.243 18497
5530 1 16 . 1 1 47 47 TYR C C 47 179.328 179.328 177.357 1.971 18497
5531 1 16 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.526 0.353 18497
5532 1 16 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.211 0.289 18497
5533 1 16 . 1 1 47 47 TYR H H 47 8.077 8.077 8.058 0.019 18497
5534 1 16 . 1 1 48 48 HIS N N 48 116.422 116.422 120.480 -4.058 18497
5535 1 16 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.185 -0.085 18497
5536 1 16 . 1 1 48 48 HIS C C 48 178.023 178.023 177.795 0.228 18497
5537 1 16 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.431 0.589 18497
5538 1 16 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.237 -1.297 18497
5539 1 16 . 1 1 48 48 HIS H H 48 8.326 8.326 8.676 -0.350 18497
5540 1 16 . 1 1 49 49 LEU N N 49 120.974 120.974 120.288 0.686 18497
5541 1 16 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.236 -0.081 18497
5542 1 16 . 1 1 49 49 LEU C C 49 177.417 177.417 179.677 -2.260 18497
5543 1 16 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.098 -0.208 18497
5544 1 16 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.968 -0.008 18497
5545 1 16 . 1 1 49 49 LEU H H 49 8.237 8.237 8.507 -0.270 18497
5546 1 16 . 1 1 50 50 ILE N N 50 119.715 119.715 120.112 -0.397 18497
5547 1 16 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.647 -0.027 18497
5548 1 16 . 1 1 50 50 ILE C C 50 179.502 179.502 178.243 1.259 18497
5549 1 16 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.815 -0.755 18497
5550 1 16 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.968 0.003 18497
5551 1 16 . 1 1 50 50 ILE H H 50 7.543 7.543 8.448 -0.905 18497
5552 1 16 . 1 1 51 51 ILE N N 51 117.995 117.995 121.260 -3.265 18497
5553 1 16 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.387 0.153 18497
5554 1 16 . 1 1 51 51 ILE C C 51 179.197 179.197 177.666 1.531 18497
5555 1 16 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.791 -2.051 18497
5556 1 16 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.208 -0.558 18497
5557 1 16 . 1 1 51 51 ILE H H 51 7.475 7.475 8.078 -0.603 18497
5558 1 16 . 1 1 52 52 ASP N N 52 121.642 121.642 120.447 1.195 18497
5559 1 16 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.243 0.197 18497
5560 1 16 . 1 1 52 52 ASP C C 52 179.197 179.197 178.929 0.268 18497
5561 1 16 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.872 -0.772 18497
5562 1 16 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.049 0.251 18497
5563 1 16 . 1 1 52 52 ASP H H 52 8.559 8.559 8.536 0.023 18497
5564 1 16 . 1 1 53 53 ASN N N 53 117.131 117.131 118.446 -1.315 18497
5565 1 16 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.447 0.164 18497
5566 1 16 . 1 1 53 53 ASN C C 53 178.545 178.545 177.961 0.584 18497
5567 1 16 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.138 -1.438 18497
5568 1 16 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.768 -0.068 18497
5569 1 16 . 1 1 53 53 ASN H H 53 8.106 8.106 8.269 -0.163 18497
5570 1 16 . 1 1 54 54 ARG N N 54 119.929 119.929 120.235 -0.306 18497
5571 1 16 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.063 0.057 18497
5572 1 16 . 1 1 54 54 ARG C C 54 176.892 176.892 178.088 -1.196 18497
5573 1 16 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.757 -0.597 18497
5574 1 16 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.286 -0.016 18497
5575 1 16 . 1 1 54 54 ARG H H 54 7.797 7.797 8.345 -0.548 18497
5576 1 16 . 1 1 55 55 ARG N N 55 119.227 119.227 118.830 0.397 18497
5577 1 16 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.179 -0.006 18497
5578 1 16 . 1 1 55 55 ARG C C 55 175.108 175.108 178.510 -3.402 18497
5579 1 16 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.409 3.471 18497
5580 1 16 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.529 2.131 18497
5581 1 16 . 1 1 55 55 ARG H H 55 7.857 7.857 8.126 -0.269 18497
5582 1 16 . 1 1 56 56 ILE N N 56 116.676 116.676 117.704 -1.028 18497
5583 1 16 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.144 -0.134 18497
5584 1 16 . 1 1 56 56 ILE C C 56 176.065 176.065 177.079 -1.014 18497
5585 1 16 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.036 0.103 18497
5586 1 16 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.667 -0.427 18497
5587 1 16 . 1 1 56 56 ILE H H 56 8.317 8.317 8.273 0.044 18497
5588 1 16 . 1 1 57 57 MET N N 57 122.058 122.058 117.000 5.058 18497
5589 1 16 . 1 1 57 57 MET HA H 57 4.420 4.420 4.526 -0.106 18497
5590 1 16 . 1 1 57 57 MET C C 57 177.283 177.283 175.780 1.503 18497
5591 1 16 . 1 1 57 57 MET CA C 57 56.030 56.030 54.699 1.331 18497
5592 1 16 . 1 1 57 57 MET CB C 57 32.515 32.515 32.232 0.283 18497
5593 1 16 . 1 1 57 57 MET H H 57 8.177 8.177 7.569 0.608 18497
5594 1 16 . 1 1 58 58 ASN N N 58 118.892 118.892 118.166 0.726 18497
5595 1 16 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.490 0.200 18497
5596 1 16 . 1 1 58 58 ASN C C 58 176.500 176.500 174.859 1.641 18497
5597 1 16 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.452 -0.798 18497
5598 1 16 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.068 -0.298 18497
5599 1 16 . 1 1 58 58 ASN H H 58 8.238 8.238 8.331 -0.093 18497
5600 1 16 . 1 1 59 59 GLN N N 59 120.456 120.456 115.133 5.323 18497
5601 1 16 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.450 -0.140 18497
5602 1 16 . 1 1 59 59 GLN C C 59 175.326 175.326 175.481 -0.155 18497
5603 1 16 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.296 0.734 18497
5604 1 16 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.556 -1.756 18497
5605 1 16 . 1 1 59 59 GLN H H 59 8.196 8.196 7.525 0.671 18497
5606 1 16 . 1 1 60 60 ALA N N 60 125.116 125.116 127.423 -2.307 18497
5607 1 16 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.110 0.272 18497
5608 1 16 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.890 -1.590 18497
5609 1 16 . 1 1 60 60 ALA CB C 60 19.110 19.110 18.249 0.861 18497
5610 1 16 . 1 1 60 60 ALA H H 60 8.293 8.293 8.889 -0.596 18497
5611 1 16 . 1 1 61 61 SER N N 61 115.686 115.686 111.989 3.697 18497
5612 1 16 . 1 1 61 61 SER HA H 61 4.470 4.470 4.262 0.208 18497
5613 1 16 . 1 1 61 61 SER C C 61 175.674 175.674 174.432 1.242 18497
5614 1 16 . 1 1 61 61 SER CA C 61 58.160 58.160 60.236 -2.076 18497
5615 1 16 . 1 1 61 61 SER CB C 61 63.740 63.740 62.457 1.283 18497
5616 1 16 . 1 1 61 61 SER H H 61 8.290 8.290 8.724 -0.434 18497
5617 1 17 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.667 -0.237 18497
5618 1 17 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.304 0.643 18497
5619 1 17 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.619 -0.489 18497
5620 1 17 . 1 1 3 3 HIS N N 3 119.985 119.985 118.621 1.364 18497
5621 1 17 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.479 0.127 18497
5622 1 17 . 1 1 3 3 HIS C C 3 176.587 176.587 176.010 0.577 18497
5623 1 17 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.674 -0.489 18497
5624 1 17 . 1 1 3 3 HIS CB C 3 30.471 30.471 29.815 0.656 18497
5625 1 17 . 1 1 3 3 HIS H H 3 8.526 8.526 8.125 0.401 18497
5626 1 17 . 1 1 4 4 MET N N 4 122.338 122.338 116.763 5.575 18497
5627 1 17 . 1 1 4 4 MET HA H 4 4.448 4.448 4.037 0.411 18497
5628 1 17 . 1 1 4 4 MET C C 4 175.108 175.108 176.173 -1.065 18497
5629 1 17 . 1 1 4 4 MET CA C 4 55.562 55.562 57.477 -1.915 18497
5630 1 17 . 1 1 4 4 MET CB C 4 33.141 33.141 30.152 2.989 18497
5631 1 17 . 1 1 4 4 MET H H 4 8.337 8.337 8.233 0.104 18497
5632 1 17 . 1 1 5 5 SER N N 5 116.990 116.990 115.664 1.326 18497
5633 1 17 . 1 1 5 5 SER HA H 5 4.400 4.400 4.385 0.015 18497
5634 1 17 . 1 1 5 5 SER C C 5 177.979 177.979 174.548 3.431 18497
5635 1 17 . 1 1 5 5 SER CA C 5 58.039 58.039 58.015 0.024 18497
5636 1 17 . 1 1 5 5 SER CB C 5 63.797 63.797 63.535 0.263 18497
5637 1 17 . 1 1 5 5 SER H H 5 8.330 8.330 8.017 0.313 18497
5638 1 17 . 1 1 6 6 TYR N N 6 122.027 122.027 121.093 0.934 18497
5639 1 17 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.442 0.068 18497
5640 1 17 . 1 1 6 6 TYR C C 6 174.060 174.060 175.296 -1.236 18497
5641 1 17 . 1 1 6 6 TYR CA C 6 57.800 57.800 59.187 -1.387 18497
5642 1 17 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.103 -0.418 18497
5643 1 17 . 1 1 6 6 TYR H H 6 8.201 8.201 7.698 0.503 18497
5644 1 17 . 1 1 7 7 ASP N N 7 122.439 122.439 123.552 -1.113 18497
5645 1 17 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.632 -0.083 18497
5646 1 17 . 1 1 7 7 ASP C C 7 175.150 175.150 174.175 0.975 18497
5647 1 17 . 1 1 7 7 ASP CA C 7 53.640 53.640 53.046 0.594 18497
5648 1 17 . 1 1 7 7 ASP CB C 7 41.300 41.300 42.840 -1.540 18497
5649 1 17 . 1 1 7 7 ASP H H 7 8.119 8.119 7.686 0.433 18497
5650 1 17 . 1 1 8 8 ALA N N 8 124.655 124.655 125.874 -1.219 18497
5651 1 17 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.128 0.102 18497
5652 1 17 . 1 1 8 8 ALA C C 8 175.935 175.935 177.398 -1.463 18497
5653 1 17 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.598 -0.705 18497
5654 1 17 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.626 -0.776 18497
5655 1 17 . 1 1 8 8 ALA H H 8 8.235 8.235 8.287 -0.052 18497
5656 1 17 . 1 1 9 9 ASN N N 9 116.133 116.133 114.825 1.308 18497
5657 1 17 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.769 -0.079 18497
5658 1 17 . 1 1 9 9 ASN C C 9 177.718 177.718 174.700 3.018 18497
5659 1 17 . 1 1 9 9 ASN CA C 9 53.800 53.800 53.328 0.472 18497
5660 1 17 . 1 1 9 9 ASN CB C 9 38.770 38.770 40.952 -2.182 18497
5661 1 17 . 1 1 9 9 ASN H H 9 8.417 8.417 8.255 0.162 18497
5662 1 17 . 1 1 10 10 VAL N N 10 119.557 119.557 118.892 0.665 18497
5663 1 17 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.711 0.466 18497
5664 1 17 . 1 1 10 10 VAL C C 10 174.930 174.930 174.266 0.664 18497
5665 1 17 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.949 -2.069 18497
5666 1 17 . 1 1 10 10 VAL CB C 10 32.660 32.660 30.936 1.724 18497
5667 1 17 . 1 1 10 10 VAL H H 10 7.859 7.859 8.773 -0.914 18497
5668 1 17 . 1 1 11 11 ILE N N 11 126.561 126.561 125.916 0.645 18497
5669 1 17 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.728 -0.688 18497
5670 1 17 . 1 1 11 11 ILE C C 11 175.935 175.935 174.304 1.631 18497
5671 1 17 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.798 -0.298 18497
5672 1 17 . 1 1 11 11 ILE CB C 11 37.700 37.700 42.125 -4.425 18497
5673 1 17 . 1 1 11 11 ILE H H 11 8.283 8.283 8.141 0.142 18497
5674 1 17 . 1 1 12 12 ASP N N 12 128.161 128.161 124.975 3.186 18497
5675 1 17 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.987 -0.257 18497
5676 1 17 . 1 1 12 12 ASP C C 12 174.891 174.891 176.219 -1.328 18497
5677 1 17 . 1 1 12 12 ASP CA C 12 53.427 53.427 52.892 0.535 18497
5678 1 17 . 1 1 12 12 ASP CB C 12 42.220 42.220 42.394 -0.174 18497
5679 1 17 . 1 1 12 12 ASP H H 12 8.477 8.477 8.508 -0.031 18497
5680 1 17 . 1 1 13 13 ASP N N 13 127.435 127.435 126.271 1.164 18497
5681 1 17 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.368 -0.052 18497
5682 1 17 . 1 1 13 13 ASP C C 13 175.369 175.369 177.617 -2.248 18497
5683 1 17 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.037 0.563 18497
5684 1 17 . 1 1 13 13 ASP CB C 13 41.160 41.160 40.785 0.375 18497
5685 1 17 . 1 1 13 13 ASP H H 13 8.698 8.698 8.972 -0.274 18497
5686 1 17 . 1 1 14 14 GLU N N 14 119.796 119.796 120.068 -0.272 18497
5687 1 17 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.162 -0.127 18497
5688 1 17 . 1 1 14 14 GLU C C 14 178.588 178.588 178.566 0.022 18497
5689 1 17 . 1 1 14 14 GLU CA C 14 59.500 59.500 58.958 0.542 18497
5690 1 17 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.475 -0.575 18497
5691 1 17 . 1 1 14 14 GLU H H 14 8.205 8.205 8.828 -0.623 18497
5692 1 17 . 1 1 15 15 ALA N N 15 124.156 124.156 123.599 0.557 18497
5693 1 17 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.049 0.127 18497
5694 1 17 . 1 1 15 15 ALA C C 15 179.502 179.502 179.483 0.019 18497
5695 1 17 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.117 -0.117 18497
5696 1 17 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.183 0.717 18497
5697 1 17 . 1 1 15 15 ALA H H 15 8.473 8.473 7.655 0.818 18497
5698 1 17 . 1 1 16 16 VAL N N 16 117.585 117.585 118.986 -1.401 18497
5699 1 17 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.721 -0.187 18497
5700 1 17 . 1 1 16 16 VAL C C 16 179.545 179.545 178.149 1.396 18497
5701 1 17 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.017 0.983 18497
5702 1 17 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.107 0.493 18497
5703 1 17 . 1 1 16 16 VAL H H 16 8.181 8.181 8.687 -0.506 18497
5704 1 17 . 1 1 17 17 LYS N N 17 119.377 119.377 120.016 -0.639 18497
5705 1 17 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.983 -0.027 18497
5706 1 17 . 1 1 17 17 LYS C C 17 178.197 178.197 178.715 -0.518 18497
5707 1 17 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.180 0.840 18497
5708 1 17 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.092 0.038 18497
5709 1 17 . 1 1 17 17 LYS H H 17 8.001 8.001 7.935 0.066 18497
5710 1 17 . 1 1 18 18 GLU N N 18 120.395 120.395 119.579 0.816 18497
5711 1 17 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.022 0.118 18497
5712 1 17 . 1 1 18 18 GLU C C 18 178.849 178.849 179.011 -0.162 18497
5713 1 17 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.638 0.162 18497
5714 1 17 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.810 -0.317 18497
5715 1 17 . 1 1 18 18 GLU H H 18 7.943 7.943 8.192 -0.249 18497
5716 1 17 . 1 1 19 19 VAL N N 19 121.088 121.088 120.407 0.681 18497
5717 1 17 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.801 -0.151 18497
5718 1 17 . 1 1 19 19 VAL C C 19 179.415 179.415 177.737 1.678 18497
5719 1 17 . 1 1 19 19 VAL CA C 19 67.980 67.980 65.814 2.167 18497
5720 1 17 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.806 -0.206 18497
5721 1 17 . 1 1 19 19 VAL H H 19 8.335 8.335 8.504 -0.169 18497
5722 1 17 . 1 1 20 20 CYS N N 20 117.290 117.290 118.360 -1.070 18497
5723 1 17 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.008 0.672 18497
5724 1 17 . 1 1 20 20 CYS C C 20 178.110 178.110 176.259 1.851 18497
5725 1 17 . 1 1 20 20 CYS CA C 20 63.200 63.200 63.667 -0.467 18497
5726 1 17 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.158 -0.358 18497
5727 1 17 . 1 1 20 20 CYS H H 20 8.434 8.434 7.936 0.498 18497
5728 1 17 . 1 1 21 21 GLU N N 21 118.195 118.195 118.663 -0.468 18497
5729 1 17 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.262 -0.123 18497
5730 1 17 . 1 1 21 21 GLU C C 21 178.153 178.153 178.283 -0.130 18497
5731 1 17 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.284 1.466 18497
5732 1 17 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.760 -0.260 18497
5733 1 17 . 1 1 21 21 GLU H H 21 7.972 7.972 7.808 0.164 18497
5734 1 17 . 1 1 22 22 LYS N N 22 119.095 119.095 118.770 0.325 18497
5735 1 17 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.171 -0.166 18497
5736 1 17 . 1 1 22 22 LYS C C 22 179.371 179.371 177.914 1.457 18497
5737 1 17 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.665 0.035 18497
5738 1 17 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.866 0.054 18497
5739 1 17 . 1 1 22 22 LYS H H 22 8.071 8.071 8.265 -0.194 18497
5740 1 17 . 1 1 23 23 PHE N N 23 114.252 114.252 117.965 -3.713 18497
5741 1 17 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.469 -0.039 18497
5742 1 17 . 1 1 23 23 PHE C C 23 178.197 178.197 174.606 3.591 18497
5743 1 17 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.018 0.412 18497
5744 1 17 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.230 -1.460 18497
5745 1 17 . 1 1 23 23 PHE H H 23 8.491 8.491 7.708 0.783 18497
5746 1 17 . 1 1 24 24 GLU N N 24 119.819 119.819 117.107 2.712 18497
5747 1 17 . 1 1 24 24 GLU HA H 24 4.070 4.070 3.998 0.072 18497
5748 1 17 . 1 1 24 24 GLU C C 24 177.457 177.457 175.135 2.322 18497
5749 1 17 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.314 -0.484 18497
5750 1 17 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.308 -0.508 18497
5751 1 17 . 1 1 24 24 GLU H H 24 7.867 7.867 8.284 -0.417 18497
5752 1 17 . 1 1 25 25 CYS N N 25 114.633 114.633 121.345 -6.712 18497
5753 1 17 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.855 0.532 18497
5754 1 17 . 1 1 25 25 CYS C C 25 174.760 174.760 173.008 1.752 18497
5755 1 17 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.002 -2.241 18497
5756 1 17 . 1 1 25 25 CYS CB C 25 31.600 31.600 29.290 2.310 18497
5757 1 17 . 1 1 25 25 CYS H H 25 8.156 8.156 8.803 -0.647 18497
5758 1 17 . 1 1 26 26 THR N N 26 109.312 109.312 113.757 -4.445 18497
5759 1 17 . 1 1 26 26 THR HA H 26 4.770 4.770 4.703 0.067 18497
5760 1 17 . 1 1 26 26 THR C C 26 173.499 173.499 174.673 -1.174 18497
5761 1 17 . 1 1 26 26 THR CA C 26 60.723 60.723 61.233 -0.511 18497
5762 1 17 . 1 1 26 26 THR CB C 26 72.000 72.000 71.547 0.452 18497
5763 1 17 . 1 1 26 26 THR H H 26 8.460 8.460 7.960 0.500 18497
5764 1 17 . 1 1 27 27 GLU N N 27 122.233 122.233 124.106 -1.873 18497
5765 1 17 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.955 -0.445 18497
5766 1 17 . 1 1 27 27 GLU C C 27 176.544 176.544 178.237 -1.693 18497
5767 1 17 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.646 -0.096 18497
5768 1 17 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.412 -0.462 18497
5769 1 17 . 1 1 27 27 GLU H H 27 9.327 9.327 9.042 0.285 18497
5770 1 17 . 1 1 28 28 SER N N 28 112.925 112.925 114.997 -2.072 18497
5771 1 17 . 1 1 28 28 SER HA H 28 4.062 4.062 4.168 -0.106 18497
5772 1 17 . 1 1 28 28 SER C C 28 178.545 178.545 176.369 2.176 18497
5773 1 17 . 1 1 28 28 SER CA C 28 61.350 61.350 61.401 -0.051 18497
5774 1 17 . 1 1 28 28 SER CB C 28 62.400 62.400 62.736 -0.336 18497
5775 1 17 . 1 1 28 28 SER H H 28 8.320 8.320 8.515 -0.195 18497
5776 1 17 . 1 1 29 29 GLU N N 29 121.736 121.736 121.634 0.102 18497
5777 1 17 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.199 -0.209 18497
5778 1 17 . 1 1 29 29 GLU C C 29 176.674 176.674 178.810 -2.136 18497
5779 1 17 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.714 1.036 18497
5780 1 17 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.496 -0.026 18497
5781 1 17 . 1 1 29 29 GLU H H 29 7.512 7.512 7.512 0.000 18497
5782 1 17 . 1 1 30 30 VAL N N 30 119.480 119.480 120.893 -1.413 18497
5783 1 17 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.620 -0.243 18497
5784 1 17 . 1 1 30 30 VAL C C 30 179.241 179.241 178.240 1.001 18497
5785 1 17 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.656 0.004 18497
5786 1 17 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.358 -0.288 18497
5787 1 17 . 1 1 30 30 VAL H H 30 7.492 7.492 8.410 -0.918 18497
5788 1 17 . 1 1 31 31 MET N N 31 117.220 117.220 117.123 0.097 18497
5789 1 17 . 1 1 31 31 MET HA H 31 3.870 3.870 3.939 -0.069 18497
5790 1 17 . 1 1 31 31 MET C C 31 177.936 177.936 178.273 -0.337 18497
5791 1 17 . 1 1 31 31 MET CA C 31 57.630 57.630 59.051 -1.421 18497
5792 1 17 . 1 1 31 31 MET CB C 31 30.270 30.270 32.156 -1.886 18497
5793 1 17 . 1 1 31 31 MET H H 31 8.302 8.302 8.611 -0.309 18497
5794 1 17 . 1 1 32 32 ASN N N 32 116.672 116.672 118.835 -2.163 18497
5795 1 17 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.464 -0.074 18497
5796 1 17 . 1 1 32 32 ASN C C 32 176.065 176.065 177.711 -1.646 18497
5797 1 17 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.277 -0.247 18497
5798 1 17 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.602 -0.893 18497
5799 1 17 . 1 1 32 32 ASN H H 32 8.313 8.313 8.093 0.220 18497
5800 1 17 . 1 1 33 33 SER N N 33 117.471 117.471 114.877 2.594 18497
5801 1 17 . 1 1 33 33 SER HA H 33 4.150 4.150 4.244 -0.094 18497
5802 1 17 . 1 1 33 33 SER C C 33 178.806 178.806 175.608 3.198 18497
5803 1 17 . 1 1 33 33 SER CA C 33 62.950 62.950 60.984 1.966 18497
5804 1 17 . 1 1 33 33 SER CB C 33 62.600 62.600 63.238 -0.638 18497
5805 1 17 . 1 1 33 33 SER H H 33 7.851 7.851 8.202 -0.351 18497
5806 1 17 . 1 1 34 34 LEU N N 34 122.839 122.839 119.382 3.457 18497
5807 1 17 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.196 -0.317 18497
5808 1 17 . 1 1 34 34 LEU C C 34 177.892 177.892 177.148 0.744 18497
5809 1 17 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.166 1.464 18497
5810 1 17 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.552 -1.752 18497
5811 1 17 . 1 1 34 34 LEU H H 34 8.128 8.128 7.332 0.796 18497
5812 1 17 . 1 1 35 35 TYR N N 35 116.666 116.666 118.772 -2.106 18497
5813 1 17 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.483 0.127 18497
5814 1 17 . 1 1 35 35 TYR C C 35 179.067 179.067 176.295 2.772 18497
5815 1 17 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.155 -2.265 18497
5816 1 17 . 1 1 35 35 TYR CB C 35 37.710 37.710 41.139 -3.429 18497
5817 1 17 . 1 1 35 35 TYR H H 35 7.924 7.924 7.964 -0.040 18497
5818 1 17 . 1 1 36 36 SER N N 36 114.801 114.801 114.677 0.124 18497
5819 1 17 . 1 1 36 36 SER HA H 36 4.080 4.080 4.367 -0.287 18497
5820 1 17 . 1 1 36 36 SER C C 36 177.283 177.283 175.153 2.130 18497
5821 1 17 . 1 1 36 36 SER CA C 36 60.519 60.519 59.422 1.097 18497
5822 1 17 . 1 1 36 36 SER CB C 36 64.240 64.240 64.247 -0.007 18497
5823 1 17 . 1 1 36 36 SER H H 36 7.715 7.715 8.460 -0.745 18497
5824 1 17 . 1 1 37 37 GLY N N 37 109.803 109.803 109.372 0.431 18497
5825 1 17 . 1 1 37 37 GLY C C 37 175.978 175.978 172.231 3.747 18497
5826 1 17 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.578 1.100 18497
5827 1 17 . 1 1 37 37 GLY H H 37 8.017 8.017 7.718 0.299 18497
5828 1 17 . 1 1 38 38 ASP N N 38 120.613 120.613 116.622 3.991 18497
5829 1 17 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.831 0.194 18497
5830 1 17 . 1 1 38 38 ASP C C 38 173.368 173.368 174.673 -1.305 18497
5831 1 17 . 1 1 38 38 ASP CA C 38 50.720 50.720 52.187 -1.467 18497
5832 1 17 . 1 1 38 38 ASP CB C 38 41.420 41.420 41.230 0.190 18497
5833 1 17 . 1 1 38 38 ASP H H 38 8.006 8.006 7.861 0.145 18497
5834 1 17 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.314 0.026 18497
5835 1 17 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.198 -0.448 18497
5836 1 17 . 1 1 39 39 PRO CB C 39 32.130 32.130 30.951 1.179 18497
5837 1 17 . 1 1 40 40 GLN N N 40 115.056 115.056 115.421 -0.365 18497
5838 1 17 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.293 -0.013 18497
5839 1 17 . 1 1 40 40 GLN C C 40 177.066 177.066 175.878 1.188 18497
5840 1 17 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.475 -0.765 18497
5841 1 17 . 1 1 40 40 GLN CB C 40 28.680 28.680 29.817 -1.137 18497
5842 1 17 . 1 1 40 40 GLN H H 40 8.237 8.237 7.940 0.297 18497
5843 1 17 . 1 1 41 41 ASP N N 41 122.839 122.839 122.199 0.640 18497
5844 1 17 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.569 -0.256 18497
5845 1 17 . 1 1 41 41 ASP C C 41 175.804 175.804 177.323 -1.519 18497
5846 1 17 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.829 0.411 18497
5847 1 17 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.908 -0.688 18497
5848 1 17 . 1 1 41 41 ASP H H 41 7.211 7.211 7.815 -0.604 18497
5849 1 17 . 1 1 42 42 GLN N N 42 124.547 124.547 125.707 -1.160 18497
5850 1 17 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.053 -0.193 18497
5851 1 17 . 1 1 42 42 GLN C C 42 177.196 177.196 177.343 -0.147 18497
5852 1 17 . 1 1 42 42 GLN CA C 42 59.220 59.220 58.969 0.251 18497
5853 1 17 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.158 0.242 18497
5854 1 17 . 1 1 42 42 GLN H H 42 8.719 8.719 8.848 -0.129 18497
5855 1 17 . 1 1 43 43 LEU N N 43 118.960 118.960 120.340 -1.380 18497
5856 1 17 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.931 -0.246 18497
5857 1 17 . 1 1 43 43 LEU C C 43 178.066 178.066 178.761 -0.695 18497
5858 1 17 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.827 0.534 18497
5859 1 17 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.177 -0.787 18497
5860 1 17 . 1 1 43 43 LEU H H 43 8.206 8.206 8.640 -0.434 18497
5861 1 17 . 1 1 44 44 ALA N N 44 121.666 121.666 122.454 -0.788 18497
5862 1 17 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.052 -0.173 18497
5863 1 17 . 1 1 44 44 ALA C C 44 178.327 178.327 179.618 -1.291 18497
5864 1 17 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.828 -0.118 18497
5865 1 17 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.211 0.369 18497
5866 1 17 . 1 1 44 44 ALA H H 44 7.402 7.402 7.670 -0.268 18497
5867 1 17 . 1 1 45 45 VAL N N 45 118.589 118.589 120.090 -1.501 18497
5868 1 17 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.560 0.100 18497
5869 1 17 . 1 1 45 45 VAL C C 45 179.893 179.893 177.692 2.201 18497
5870 1 17 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.827 -0.427 18497
5871 1 17 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.617 0.513 18497
5872 1 17 . 1 1 45 45 VAL H H 45 8.449 8.449 8.577 -0.128 18497
5873 1 17 . 1 1 46 46 ALA N N 46 121.006 121.006 122.106 -1.100 18497
5874 1 17 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.749 0.381 18497
5875 1 17 . 1 1 46 46 ALA C C 46 179.110 179.110 179.069 0.041 18497
5876 1 17 . 1 1 46 46 ALA CA C 46 54.970 54.970 54.994 -0.024 18497
5877 1 17 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.123 1.987 18497
5878 1 17 . 1 1 46 46 ALA H H 46 7.654 7.654 7.895 -0.241 18497
5879 1 17 . 1 1 47 47 TYR N N 47 119.140 119.140 120.111 -0.971 18497
5880 1 17 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.983 -0.233 18497
5881 1 17 . 1 1 47 47 TYR C C 47 179.328 179.328 177.494 1.834 18497
5882 1 17 . 1 1 47 47 TYR CA C 47 61.880 61.880 62.019 -0.139 18497
5883 1 17 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.342 0.158 18497
5884 1 17 . 1 1 47 47 TYR H H 47 8.077 8.077 8.204 -0.127 18497
5885 1 17 . 1 1 48 48 HIS N N 48 116.422 116.422 119.154 -2.732 18497
5886 1 17 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.113 -0.013 18497
5887 1 17 . 1 1 48 48 HIS C C 48 178.023 178.023 177.476 0.547 18497
5888 1 17 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.262 -0.242 18497
5889 1 17 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.879 -0.939 18497
5890 1 17 . 1 1 48 48 HIS H H 48 8.326 8.326 8.473 -0.147 18497
5891 1 17 . 1 1 49 49 LEU N N 49 120.974 120.974 120.324 0.650 18497
5892 1 17 . 1 1 49 49 LEU HA H 49 4.155 4.155 3.944 0.211 18497
5893 1 17 . 1 1 49 49 LEU C C 49 177.417 177.417 179.115 -1.698 18497
5894 1 17 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.263 -0.373 18497
5895 1 17 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.491 0.469 18497
5896 1 17 . 1 1 49 49 LEU H H 49 8.237 8.237 8.505 -0.268 18497
5897 1 17 . 1 1 50 50 ILE N N 50 119.715 119.715 119.509 0.206 18497
5898 1 17 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.536 0.084 18497
5899 1 17 . 1 1 50 50 ILE C C 50 179.502 179.502 177.825 1.677 18497
5900 1 17 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.605 -0.545 18497
5901 1 17 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.808 0.162 18497
5902 1 17 . 1 1 50 50 ILE H H 50 7.543 7.543 8.385 -0.842 18497
5903 1 17 . 1 1 51 51 ILE N N 51 117.995 117.995 121.740 -3.745 18497
5904 1 17 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.377 0.163 18497
5905 1 17 . 1 1 51 51 ILE C C 51 179.197 179.197 177.482 1.715 18497
5906 1 17 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.817 -2.078 18497
5907 1 17 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.401 -0.751 18497
5908 1 17 . 1 1 51 51 ILE H H 51 7.475 7.475 8.146 -0.671 18497
5909 1 17 . 1 1 52 52 ASP N N 52 121.642 121.642 119.770 1.872 18497
5910 1 17 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.150 0.290 18497
5911 1 17 . 1 1 52 52 ASP C C 52 179.197 179.197 178.485 0.712 18497
5912 1 17 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.919 -0.819 18497
5913 1 17 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.685 -0.385 18497
5914 1 17 . 1 1 52 52 ASP H H 52 8.559 8.559 8.170 0.389 18497
5915 1 17 . 1 1 53 53 ASN N N 53 117.131 117.131 118.316 -1.185 18497
5916 1 17 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.328 0.282 18497
5917 1 17 . 1 1 53 53 ASN C C 53 178.545 178.545 177.444 1.101 18497
5918 1 17 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.550 -1.850 18497
5919 1 17 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.594 0.106 18497
5920 1 17 . 1 1 53 53 ASN H H 53 8.106 8.106 8.037 0.069 18497
5921 1 17 . 1 1 54 54 ARG N N 54 119.929 119.929 120.094 -0.165 18497
5922 1 17 . 1 1 54 54 ARG HA H 54 4.120 4.120 3.988 0.132 18497
5923 1 17 . 1 1 54 54 ARG C C 54 176.892 176.892 178.276 -1.384 18497
5924 1 17 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.153 -0.993 18497
5925 1 17 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.199 0.071 18497
5926 1 17 . 1 1 54 54 ARG H H 54 7.797 7.797 8.318 -0.521 18497
5927 1 17 . 1 1 55 55 ARG N N 55 119.227 119.227 118.376 0.851 18497
5928 1 17 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.216 -0.042 18497
5929 1 17 . 1 1 55 55 ARG C C 55 175.108 175.108 177.890 -2.782 18497
5930 1 17 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.177 3.703 18497
5931 1 17 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.699 1.961 18497
5932 1 17 . 1 1 55 55 ARG H H 55 7.857 7.857 8.077 -0.220 18497
5933 1 17 . 1 1 56 56 ILE N N 56 116.676 116.676 118.286 -1.610 18497
5934 1 17 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.082 -0.072 18497
5935 1 17 . 1 1 56 56 ILE C C 56 176.065 176.065 177.807 -1.742 18497
5936 1 17 . 1 1 56 56 ILE CA C 56 62.140 62.140 63.975 -1.835 18497
5937 1 17 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.630 -0.390 18497
5938 1 17 . 1 1 56 56 ILE H H 56 8.317 8.317 8.259 0.058 18497
5939 1 17 . 1 1 57 57 MET N N 57 122.058 122.058 119.286 2.772 18497
5940 1 17 . 1 1 57 57 MET HA H 57 4.420 4.420 4.142 0.278 18497
5941 1 17 . 1 1 57 57 MET C C 57 177.283 177.283 178.804 -1.521 18497
5942 1 17 . 1 1 57 57 MET CA C 57 56.030 56.030 56.813 -0.783 18497
5943 1 17 . 1 1 57 57 MET CB C 57 32.515 32.515 31.011 1.504 18497
5944 1 17 . 1 1 57 57 MET H H 57 8.177 8.177 7.779 0.398 18497
5945 1 17 . 1 1 58 58 ASN N N 58 118.892 118.892 117.690 1.202 18497
5946 1 17 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.385 0.305 18497
5947 1 17 . 1 1 58 58 ASN C C 58 176.500 176.500 176.717 -0.217 18497
5948 1 17 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.931 -2.278 18497
5949 1 17 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.525 0.245 18497
5950 1 17 . 1 1 58 58 ASN H H 58 8.238 8.238 8.413 -0.175 18497
5951 1 17 . 1 1 59 59 GLN N N 59 120.456 120.456 117.276 3.180 18497
5952 1 17 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.352 -0.042 18497
5953 1 17 . 1 1 59 59 GLN C C 59 175.326 175.326 177.202 -1.876 18497
5954 1 17 . 1 1 59 59 GLN CA C 59 56.030 56.030 57.378 -1.348 18497
5955 1 17 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.586 -0.786 18497
5956 1 17 . 1 1 59 59 GLN H H 59 8.196 8.196 7.659 0.537 18497
5957 1 17 . 1 1 60 60 ALA N N 60 125.116 125.116 122.547 2.569 18497
5958 1 17 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.251 0.131 18497
5959 1 17 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.284 -0.984 18497
5960 1 17 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.294 -0.184 18497
5961 1 17 . 1 1 60 60 ALA H H 60 8.293 8.293 8.196 0.097 18497
5962 1 17 . 1 1 61 61 SER N N 61 115.686 115.686 114.827 0.859 18497
5963 1 17 . 1 1 61 61 SER HA H 61 4.470 4.470 4.464 0.006 18497
5964 1 17 . 1 1 61 61 SER C C 61 175.674 175.674 173.248 2.426 18497
5965 1 17 . 1 1 61 61 SER CA C 61 58.160 58.160 58.255 -0.095 18497
5966 1 17 . 1 1 61 61 SER CB C 61 63.740 63.740 63.715 0.025 18497
5967 1 17 . 1 1 61 61 SER H H 61 8.290 8.290 8.085 0.205 18497
5968 1 18 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.635 -0.205 18497
5969 1 18 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.434 -0.487 18497
5970 1 18 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.336 -0.206 18497
5971 1 18 . 1 1 3 3 HIS N N 3 119.985 119.985 119.374 0.611 18497
5972 1 18 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.602 0.004 18497
5973 1 18 . 1 1 3 3 HIS C C 3 176.587 176.587 174.974 1.613 18497
5974 1 18 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.607 -0.422 18497
5975 1 18 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.027 0.444 18497
5976 1 18 . 1 1 3 3 HIS H H 3 8.526 8.526 8.462 0.064 18497
5977 1 18 . 1 1 4 4 MET N N 4 122.338 122.338 118.647 3.691 18497
5978 1 18 . 1 1 4 4 MET HA H 4 4.448 4.448 5.019 -0.571 18497
5979 1 18 . 1 1 4 4 MET C C 4 175.108 175.108 174.391 0.717 18497
5980 1 18 . 1 1 4 4 MET CA C 4 55.562 55.562 54.975 0.587 18497
5981 1 18 . 1 1 4 4 MET CB C 4 33.141 33.141 35.266 -2.125 18497
5982 1 18 . 1 1 4 4 MET H H 4 8.337 8.337 8.005 0.332 18497
5983 1 18 . 1 1 5 5 SER N N 5 116.990 116.990 118.448 -1.458 18497
5984 1 18 . 1 1 5 5 SER HA H 5 4.400 4.400 5.149 -0.749 18497
5985 1 18 . 1 1 5 5 SER C C 5 177.979 177.979 172.435 5.544 18497
5986 1 18 . 1 1 5 5 SER CA C 5 58.039 58.039 58.270 -0.231 18497
5987 1 18 . 1 1 5 5 SER CB C 5 63.797 63.797 64.502 -0.705 18497
5988 1 18 . 1 1 5 5 SER H H 5 8.330 8.330 8.802 -0.472 18497
5989 1 18 . 1 1 6 6 TYR N N 6 122.027 122.027 119.312 2.715 18497
5990 1 18 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.924 -0.414 18497
5991 1 18 . 1 1 6 6 TYR C C 6 174.060 174.060 173.532 0.528 18497
5992 1 18 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.556 0.244 18497
5993 1 18 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.797 -1.112 18497
5994 1 18 . 1 1 6 6 TYR H H 6 8.201 8.201 7.940 0.261 18497
5995 1 18 . 1 1 7 7 ASP N N 7 122.439 122.439 121.574 0.865 18497
5996 1 18 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.817 -0.268 18497
5997 1 18 . 1 1 7 7 ASP C C 7 175.150 175.150 176.704 -1.554 18497
5998 1 18 . 1 1 7 7 ASP CA C 7 53.640 53.640 52.632 1.008 18497
5999 1 18 . 1 1 7 7 ASP CB C 7 41.300 41.300 42.157 -0.857 18497
6000 1 18 . 1 1 7 7 ASP H H 7 8.119 8.119 8.528 -0.409 18497
6001 1 18 . 1 1 8 8 ALA N N 8 124.655 124.655 127.638 -2.983 18497
6002 1 18 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.144 0.086 18497
6003 1 18 . 1 1 8 8 ALA C C 8 175.935 175.935 178.415 -2.480 18497
6004 1 18 . 1 1 8 8 ALA CA C 8 52.893 52.893 54.358 -1.465 18497
6005 1 18 . 1 1 8 8 ALA CB C 8 18.850 18.850 18.920 -0.070 18497
6006 1 18 . 1 1 8 8 ALA H H 8 8.235 8.235 8.786 -0.551 18497
6007 1 18 . 1 1 9 9 ASN N N 9 116.133 116.133 115.008 1.125 18497
6008 1 18 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.525 0.165 18497
6009 1 18 . 1 1 9 9 ASN C C 9 177.718 177.718 175.482 2.236 18497
6010 1 18 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.697 -0.897 18497
6011 1 18 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.263 -0.493 18497
6012 1 18 . 1 1 9 9 ASN H H 9 8.417 8.417 8.432 -0.015 18497
6013 1 18 . 1 1 10 10 VAL N N 10 119.557 119.557 121.036 -1.479 18497
6014 1 18 . 1 1 10 10 VAL HA H 10 4.177 4.177 4.076 0.101 18497
6015 1 18 . 1 1 10 10 VAL C C 10 174.930 174.930 174.571 0.359 18497
6016 1 18 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.722 -1.842 18497
6017 1 18 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.049 0.611 18497
6018 1 18 . 1 1 10 10 VAL H H 10 7.859 7.859 8.163 -0.304 18497
6019 1 18 . 1 1 11 11 ILE N N 11 126.561 126.561 127.131 -0.570 18497
6020 1 18 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.510 -0.470 18497
6021 1 18 . 1 1 11 11 ILE C C 11 175.935 175.935 174.172 1.763 18497
6022 1 18 . 1 1 11 11 ILE CA C 11 59.500 59.500 60.326 -0.826 18497
6023 1 18 . 1 1 11 11 ILE CB C 11 37.700 37.700 42.331 -4.631 18497
6024 1 18 . 1 1 11 11 ILE H H 11 8.283 8.283 8.433 -0.150 18497
6025 1 18 . 1 1 12 12 ASP N N 12 128.161 128.161 125.080 3.081 18497
6026 1 18 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.942 -0.212 18497
6027 1 18 . 1 1 12 12 ASP C C 12 174.891 174.891 176.167 -1.276 18497
6028 1 18 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.264 0.163 18497
6029 1 18 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.806 0.415 18497
6030 1 18 . 1 1 12 12 ASP H H 12 8.477 8.477 8.495 -0.018 18497
6031 1 18 . 1 1 13 13 ASP N N 13 127.435 127.435 126.373 1.062 18497
6032 1 18 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.348 -0.032 18497
6033 1 18 . 1 1 13 13 ASP C C 13 175.369 175.369 178.017 -2.648 18497
6034 1 18 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.534 0.066 18497
6035 1 18 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.205 -0.045 18497
6036 1 18 . 1 1 13 13 ASP H H 13 8.698 8.698 8.944 -0.246 18497
6037 1 18 . 1 1 14 14 GLU N N 14 119.796 119.796 119.220 0.576 18497
6038 1 18 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.116 -0.081 18497
6039 1 18 . 1 1 14 14 GLU C C 14 178.588 178.588 178.573 0.015 18497
6040 1 18 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.163 0.337 18497
6041 1 18 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.567 -0.667 18497
6042 1 18 . 1 1 14 14 GLU H H 14 8.205 8.205 8.706 -0.501 18497
6043 1 18 . 1 1 15 15 ALA N N 15 124.156 124.156 122.860 1.296 18497
6044 1 18 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.056 0.120 18497
6045 1 18 . 1 1 15 15 ALA C C 15 179.502 179.502 179.404 0.098 18497
6046 1 18 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.096 -0.096 18497
6047 1 18 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.375 0.525 18497
6048 1 18 . 1 1 15 15 ALA H H 15 8.473 8.473 7.762 0.711 18497
6049 1 18 . 1 1 16 16 VAL N N 16 117.585 117.585 118.746 -1.161 18497
6050 1 18 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.497 0.037 18497
6051 1 18 . 1 1 16 16 VAL C C 16 179.545 179.545 177.908 1.637 18497
6052 1 18 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.075 0.925 18497
6053 1 18 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.486 0.114 18497
6054 1 18 . 1 1 16 16 VAL H H 16 8.181 8.181 8.689 -0.508 18497
6055 1 18 . 1 1 17 17 LYS N N 17 119.377 119.377 120.271 -0.894 18497
6056 1 18 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.865 0.091 18497
6057 1 18 . 1 1 17 17 LYS C C 17 178.197 178.197 178.592 -0.395 18497
6058 1 18 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.255 -0.235 18497
6059 1 18 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.295 -0.165 18497
6060 1 18 . 1 1 17 17 LYS H H 17 8.001 8.001 8.095 -0.094 18497
6061 1 18 . 1 1 18 18 GLU N N 18 120.395 120.395 119.630 0.765 18497
6062 1 18 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.117 0.023 18497
6063 1 18 . 1 1 18 18 GLU C C 18 178.849 178.849 178.967 -0.118 18497
6064 1 18 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.217 0.583 18497
6065 1 18 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.259 0.234 18497
6066 1 18 . 1 1 18 18 GLU H H 18 7.943 7.943 8.197 -0.254 18497
6067 1 18 . 1 1 19 19 VAL N N 19 121.088 121.088 120.357 0.731 18497
6068 1 18 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.754 -0.104 18497
6069 1 18 . 1 1 19 19 VAL C C 19 179.415 179.415 178.219 1.196 18497
6070 1 18 . 1 1 19 19 VAL CA C 19 67.980 67.980 67.138 0.842 18497
6071 1 18 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.419 0.181 18497
6072 1 18 . 1 1 19 19 VAL H H 19 8.335 8.335 8.685 -0.350 18497
6073 1 18 . 1 1 20 20 CYS N N 20 117.290 117.290 119.847 -2.557 18497
6074 1 18 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.418 0.262 18497
6075 1 18 . 1 1 20 20 CYS C C 20 178.110 178.110 176.469 1.641 18497
6076 1 18 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.692 0.508 18497
6077 1 18 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.289 -0.489 18497
6078 1 18 . 1 1 20 20 CYS H H 20 8.434 8.434 8.425 0.009 18497
6079 1 18 . 1 1 21 21 GLU N N 21 118.195 118.195 119.448 -1.253 18497
6080 1 18 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.120 0.019 18497
6081 1 18 . 1 1 21 21 GLU C C 21 178.153 178.153 178.639 -0.486 18497
6082 1 18 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.857 0.893 18497
6083 1 18 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.564 -0.064 18497
6084 1 18 . 1 1 21 21 GLU H H 21 7.972 7.972 7.917 0.055 18497
6085 1 18 . 1 1 22 22 LYS N N 22 119.095 119.095 117.986 1.109 18497
6086 1 18 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.179 -0.174 18497
6087 1 18 . 1 1 22 22 LYS C C 22 179.371 179.371 178.532 0.839 18497
6088 1 18 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.647 0.053 18497
6089 1 18 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.837 0.083 18497
6090 1 18 . 1 1 22 22 LYS H H 22 8.071 8.071 8.276 -0.205 18497
6091 1 18 . 1 1 23 23 PHE N N 23 114.252 114.252 117.642 -3.390 18497
6092 1 18 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.559 -0.129 18497
6093 1 18 . 1 1 23 23 PHE C C 23 178.197 178.197 174.840 3.357 18497
6094 1 18 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.207 0.223 18497
6095 1 18 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.533 -1.763 18497
6096 1 18 . 1 1 23 23 PHE H H 23 8.491 8.491 8.242 0.249 18497
6097 1 18 . 1 1 24 24 GLU N N 24 119.819 119.819 115.497 4.322 18497
6098 1 18 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.081 -0.011 18497
6099 1 18 . 1 1 24 24 GLU C C 24 177.457 177.457 175.654 1.803 18497
6100 1 18 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.413 -0.583 18497
6101 1 18 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.147 -0.347 18497
6102 1 18 . 1 1 24 24 GLU H H 24 7.867 7.867 8.172 -0.305 18497
6103 1 18 . 1 1 25 25 CYS N N 25 114.633 114.633 117.941 -3.308 18497
6104 1 18 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.884 0.503 18497
6105 1 18 . 1 1 25 25 CYS C C 25 174.760 174.760 175.027 -0.267 18497
6106 1 18 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.240 -2.479 18497
6107 1 18 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.658 0.942 18497
6108 1 18 . 1 1 25 25 CYS H H 25 8.156 8.156 7.855 0.301 18497
6109 1 18 . 1 1 26 26 THR N N 26 109.312 109.312 114.570 -5.258 18497
6110 1 18 . 1 1 26 26 THR HA H 26 4.770 4.770 4.355 0.415 18497
6111 1 18 . 1 1 26 26 THR C C 26 173.499 173.499 176.024 -2.525 18497
6112 1 18 . 1 1 26 26 THR CA C 26 60.723 60.723 62.758 -2.035 18497
6113 1 18 . 1 1 26 26 THR CB C 26 72.000 72.000 69.737 2.263 18497
6114 1 18 . 1 1 26 26 THR H H 26 8.460 8.460 8.364 0.096 18497
6115 1 18 . 1 1 27 27 GLU N N 27 122.233 122.233 124.219 -1.986 18497
6116 1 18 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.892 -0.382 18497
6117 1 18 . 1 1 27 27 GLU C C 27 176.544 176.544 178.449 -1.905 18497
6118 1 18 . 1 1 27 27 GLU CA C 27 60.550 60.550 61.189 -0.639 18497
6119 1 18 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.083 -0.133 18497
6120 1 18 . 1 1 27 27 GLU H H 27 9.327 9.327 9.112 0.215 18497
6121 1 18 . 1 1 28 28 SER N N 28 112.925 112.925 113.493 -0.568 18497
6122 1 18 . 1 1 28 28 SER HA H 28 4.062 4.062 4.176 -0.114 18497
6123 1 18 . 1 1 28 28 SER C C 28 178.545 178.545 176.301 2.244 18497
6124 1 18 . 1 1 28 28 SER CA C 28 61.350 61.350 60.926 0.424 18497
6125 1 18 . 1 1 28 28 SER CB C 28 62.400 62.400 62.533 -0.133 18497
6126 1 18 . 1 1 28 28 SER H H 28 8.320 8.320 8.440 -0.120 18497
6127 1 18 . 1 1 29 29 GLU N N 29 121.736 121.736 122.515 -0.779 18497
6128 1 18 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.228 -0.238 18497
6129 1 18 . 1 1 29 29 GLU C C 29 176.674 176.674 178.713 -2.039 18497
6130 1 18 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.574 1.176 18497
6131 1 18 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.688 -0.218 18497
6132 1 18 . 1 1 29 29 GLU H H 29 7.512 7.512 7.575 -0.063 18497
6133 1 18 . 1 1 30 30 VAL N N 30 119.480 119.480 120.594 -1.114 18497
6134 1 18 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.527 -0.150 18497
6135 1 18 . 1 1 30 30 VAL C C 30 179.241 179.241 178.245 0.996 18497
6136 1 18 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.569 0.091 18497
6137 1 18 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.808 -0.738 18497
6138 1 18 . 1 1 30 30 VAL H H 30 7.492 7.492 8.403 -0.911 18497
6139 1 18 . 1 1 31 31 MET N N 31 117.220 117.220 117.013 0.207 18497
6140 1 18 . 1 1 31 31 MET HA H 31 3.870 3.870 3.938 -0.068 18497
6141 1 18 . 1 1 31 31 MET C C 31 177.936 177.936 177.649 0.287 18497
6142 1 18 . 1 1 31 31 MET CA C 31 57.630 57.630 59.300 -1.669 18497
6143 1 18 . 1 1 31 31 MET CB C 31 30.270 30.270 32.351 -2.081 18497
6144 1 18 . 1 1 31 31 MET H H 31 8.302 8.302 8.529 -0.227 18497
6145 1 18 . 1 1 32 32 ASN N N 32 116.672 116.672 118.867 -2.195 18497
6146 1 18 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.405 -0.015 18497
6147 1 18 . 1 1 32 32 ASN C C 32 176.065 176.065 177.568 -1.503 18497
6148 1 18 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.900 -0.870 18497
6149 1 18 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.542 -0.832 18497
6150 1 18 . 1 1 32 32 ASN H H 32 8.313 8.313 7.848 0.465 18497
6151 1 18 . 1 1 33 33 SER N N 33 117.471 117.471 116.098 1.373 18497
6152 1 18 . 1 1 33 33 SER HA H 33 4.150 4.150 4.200 -0.050 18497
6153 1 18 . 1 1 33 33 SER C C 33 178.806 178.806 176.318 2.488 18497
6154 1 18 . 1 1 33 33 SER CA C 33 62.950 62.950 61.403 1.547 18497
6155 1 18 . 1 1 33 33 SER CB C 33 62.600 62.600 63.026 -0.426 18497
6156 1 18 . 1 1 33 33 SER H H 33 7.851 7.851 7.709 0.142 18497
6157 1 18 . 1 1 34 34 LEU N N 34 122.839 122.839 121.261 1.578 18497
6158 1 18 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.048 -0.169 18497
6159 1 18 . 1 1 34 34 LEU C C 34 177.892 177.892 178.722 -0.830 18497
6160 1 18 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.791 0.839 18497
6161 1 18 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.854 -1.054 18497
6162 1 18 . 1 1 34 34 LEU H H 34 8.128 8.128 7.352 0.776 18497
6163 1 18 . 1 1 35 35 TYR N N 35 116.666 116.666 121.127 -4.461 18497
6164 1 18 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.505 0.105 18497
6165 1 18 . 1 1 35 35 TYR C C 35 179.067 179.067 177.688 1.379 18497
6166 1 18 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.815 -1.925 18497
6167 1 18 . 1 1 35 35 TYR CB C 35 37.710 37.710 38.997 -1.287 18497
6168 1 18 . 1 1 35 35 TYR H H 35 7.924 7.924 8.266 -0.342 18497
6169 1 18 . 1 1 36 36 SER N N 36 114.801 114.801 113.777 1.024 18497
6170 1 18 . 1 1 36 36 SER HA H 36 4.080 4.080 4.129 -0.049 18497
6171 1 18 . 1 1 36 36 SER C C 36 177.283 177.283 175.587 1.696 18497
6172 1 18 . 1 1 36 36 SER CA C 36 60.519 60.519 59.839 0.680 18497
6173 1 18 . 1 1 36 36 SER CB C 36 64.240 64.240 63.960 0.280 18497
6174 1 18 . 1 1 36 36 SER H H 36 7.715 7.715 8.408 -0.693 18497
6175 1 18 . 1 1 37 37 GLY N N 37 109.803 109.803 109.280 0.523 18497
6176 1 18 . 1 1 37 37 GLY C C 37 175.978 175.978 173.793 2.185 18497
6177 1 18 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.694 0.984 18497
6178 1 18 . 1 1 37 37 GLY H H 37 8.017 8.017 7.734 0.283 18497
6179 1 18 . 1 1 38 38 ASP N N 38 120.613 120.613 121.917 -1.304 18497
6180 1 18 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.009 0.016 18497
6181 1 18 . 1 1 38 38 ASP C C 38 173.368 173.368 176.205 -2.837 18497
6182 1 18 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.712 0.008 18497
6183 1 18 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.412 -0.992 18497
6184 1 18 . 1 1 38 38 ASP H H 38 8.006 8.006 7.843 0.163 18497
6185 1 18 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.406 -0.066 18497
6186 1 18 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.787 -0.037 18497
6187 1 18 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.254 -0.124 18497
6188 1 18 . 1 1 40 40 GLN N N 40 115.056 115.056 116.621 -1.565 18497
6189 1 18 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.236 0.044 18497
6190 1 18 . 1 1 40 40 GLN C C 40 177.066 177.066 176.066 1.000 18497
6191 1 18 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.856 -1.146 18497
6192 1 18 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.988 -0.308 18497
6193 1 18 . 1 1 40 40 GLN H H 40 8.237 8.237 8.111 0.126 18497
6194 1 18 . 1 1 41 41 ASP N N 41 122.839 122.839 120.814 2.025 18497
6195 1 18 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.500 -0.187 18497
6196 1 18 . 1 1 41 41 ASP C C 41 175.804 175.804 177.826 -2.022 18497
6197 1 18 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.194 1.046 18497
6198 1 18 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.590 -0.370 18497
6199 1 18 . 1 1 41 41 ASP H H 41 7.211 7.211 7.399 -0.188 18497
6200 1 18 . 1 1 42 42 GLN N N 42 124.547 124.547 124.783 -0.236 18497
6201 1 18 . 1 1 42 42 GLN HA H 42 3.860 3.860 3.998 -0.138 18497
6202 1 18 . 1 1 42 42 GLN C C 42 177.196 177.196 177.075 0.121 18497
6203 1 18 . 1 1 42 42 GLN CA C 42 59.220 59.220 58.786 0.434 18497
6204 1 18 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.625 -0.225 18497
6205 1 18 . 1 1 42 42 GLN H H 42 8.719 8.719 8.717 0.002 18497
6206 1 18 . 1 1 43 43 LEU N N 43 118.960 118.960 119.150 -0.190 18497
6207 1 18 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.854 -0.169 18497
6208 1 18 . 1 1 43 43 LEU C C 43 178.066 178.066 178.614 -0.548 18497
6209 1 18 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.258 1.101 18497
6210 1 18 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.373 -0.983 18497
6211 1 18 . 1 1 43 43 LEU H H 43 8.206 8.206 8.388 -0.182 18497
6212 1 18 . 1 1 44 44 ALA N N 44 121.666 121.666 123.253 -1.587 18497
6213 1 18 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.028 -0.149 18497
6214 1 18 . 1 1 44 44 ALA C C 44 178.327 178.327 179.564 -1.237 18497
6215 1 18 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.978 -0.268 18497
6216 1 18 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.119 0.461 18497
6217 1 18 . 1 1 44 44 ALA H H 44 7.402 7.402 7.702 -0.300 18497
6218 1 18 . 1 1 45 45 VAL N N 45 118.589 118.589 120.009 -1.420 18497
6219 1 18 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.694 -0.034 18497
6220 1 18 . 1 1 45 45 VAL C C 45 179.893 179.893 178.069 1.824 18497
6221 1 18 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.611 -0.211 18497
6222 1 18 . 1 1 45 45 VAL CB C 45 32.131 32.131 30.921 1.210 18497
6223 1 18 . 1 1 45 45 VAL H H 45 8.449 8.449 8.530 -0.081 18497
6224 1 18 . 1 1 46 46 ALA N N 46 121.006 121.006 122.751 -1.745 18497
6225 1 18 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.930 0.200 18497
6226 1 18 . 1 1 46 46 ALA C C 46 179.110 179.110 179.181 -0.071 18497
6227 1 18 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.215 -0.245 18497
6228 1 18 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.587 1.523 18497
6229 1 18 . 1 1 46 46 ALA H H 46 7.654 7.654 8.001 -0.347 18497
6230 1 18 . 1 1 47 47 TYR N N 47 119.140 119.140 119.772 -0.632 18497
6231 1 18 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.974 -0.224 18497
6232 1 18 . 1 1 47 47 TYR C C 47 179.328 179.328 177.306 2.022 18497
6233 1 18 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.606 0.274 18497
6234 1 18 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.154 0.346 18497
6235 1 18 . 1 1 47 47 TYR H H 47 8.077 8.077 8.049 0.028 18497
6236 1 18 . 1 1 48 48 HIS N N 48 116.422 116.422 119.718 -3.296 18497
6237 1 18 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.047 0.053 18497
6238 1 18 . 1 1 48 48 HIS C C 48 178.023 178.023 177.390 0.633 18497
6239 1 18 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.910 0.110 18497
6240 1 18 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.538 -1.598 18497
6241 1 18 . 1 1 48 48 HIS H H 48 8.326 8.326 8.629 -0.303 18497
6242 1 18 . 1 1 49 49 LEU N N 49 120.974 120.974 119.776 1.198 18497
6243 1 18 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.014 0.141 18497
6244 1 18 . 1 1 49 49 LEU C C 49 177.417 177.417 179.332 -1.915 18497
6245 1 18 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.059 -0.169 18497
6246 1 18 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.710 0.250 18497
6247 1 18 . 1 1 49 49 LEU H H 49 8.237 8.237 8.395 -0.158 18497
6248 1 18 . 1 1 50 50 ILE N N 50 119.715 119.715 119.882 -0.167 18497
6249 1 18 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.698 -0.078 18497
6250 1 18 . 1 1 50 50 ILE C C 50 179.502 179.502 177.872 1.630 18497
6251 1 18 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.566 -0.506 18497
6252 1 18 . 1 1 50 50 ILE CB C 50 37.970 37.970 38.084 -0.113 18497
6253 1 18 . 1 1 50 50 ILE H H 50 7.543 7.543 8.466 -0.923 18497
6254 1 18 . 1 1 51 51 ILE N N 51 117.995 117.995 121.723 -3.728 18497
6255 1 18 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.421 0.119 18497
6256 1 18 . 1 1 51 51 ILE C C 51 179.197 179.197 177.325 1.872 18497
6257 1 18 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.834 -2.094 18497
6258 1 18 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.389 -0.739 18497
6259 1 18 . 1 1 51 51 ILE H H 51 7.475 7.475 8.212 -0.737 18497
6260 1 18 . 1 1 52 52 ASP N N 52 121.642 121.642 119.781 1.861 18497
6261 1 18 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.132 0.308 18497
6262 1 18 . 1 1 52 52 ASP C C 52 179.197 179.197 178.361 0.836 18497
6263 1 18 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.735 -0.635 18497
6264 1 18 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.631 -0.331 18497
6265 1 18 . 1 1 52 52 ASP H H 52 8.559 8.559 8.147 0.412 18497
6266 1 18 . 1 1 53 53 ASN N N 53 117.131 117.131 118.011 -0.880 18497
6267 1 18 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.351 0.259 18497
6268 1 18 . 1 1 53 53 ASN C C 53 178.545 178.545 177.832 0.713 18497
6269 1 18 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.023 -1.323 18497
6270 1 18 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.880 -0.180 18497
6271 1 18 . 1 1 53 53 ASN H H 53 8.106 8.106 7.999 0.107 18497
6272 1 18 . 1 1 54 54 ARG N N 54 119.929 119.929 119.973 -0.044 18497
6273 1 18 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.066 0.054 18497
6274 1 18 . 1 1 54 54 ARG C C 54 176.892 176.892 178.263 -1.371 18497
6275 1 18 . 1 1 54 54 ARG CA C 54 58.160 58.160 59.002 -0.842 18497
6276 1 18 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.394 -0.124 18497
6277 1 18 . 1 1 54 54 ARG H H 54 7.797 7.797 8.109 -0.312 18497
6278 1 18 . 1 1 55 55 ARG N N 55 119.227 119.227 117.362 1.865 18497
6279 1 18 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.341 -0.167 18497
6280 1 18 . 1 1 55 55 ARG C C 55 175.108 175.108 177.673 -2.565 18497
6281 1 18 . 1 1 55 55 ARG CA C 55 61.880 61.880 57.762 4.118 18497
6282 1 18 . 1 1 55 55 ARG CB C 55 32.660 32.660 31.667 0.993 18497
6283 1 18 . 1 1 55 55 ARG H H 55 7.857 7.857 8.189 -0.332 18497
6284 1 18 . 1 1 56 56 ILE N N 56 116.676 116.676 117.241 -0.565 18497
6285 1 18 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.187 -0.177 18497
6286 1 18 . 1 1 56 56 ILE C C 56 176.065 176.065 175.133 0.932 18497
6287 1 18 . 1 1 56 56 ILE CA C 56 62.140 62.140 61.648 0.492 18497
6288 1 18 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.475 -1.235 18497
6289 1 18 . 1 1 56 56 ILE H H 56 8.317 8.317 7.857 0.460 18497
6290 1 18 . 1 1 57 57 MET N N 57 122.058 122.058 113.694 8.364 18497
6291 1 18 . 1 1 57 57 MET HA H 57 4.420 4.420 4.125 0.295 18497
6292 1 18 . 1 1 57 57 MET C C 57 177.283 177.283 176.443 0.840 18497
6293 1 18 . 1 1 57 57 MET CA C 57 56.030 56.030 56.242 -0.212 18497
6294 1 18 . 1 1 57 57 MET CB C 57 32.515 32.515 29.618 2.897 18497
6295 1 18 . 1 1 57 57 MET H H 57 8.177 8.177 7.899 0.278 18497
6296 1 18 . 1 1 58 58 ASN N N 58 118.892 118.892 115.486 3.406 18497
6297 1 18 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.621 0.069 18497
6298 1 18 . 1 1 58 58 ASN C C 58 176.500 176.500 174.397 2.103 18497
6299 1 18 . 1 1 58 58 ASN CA C 58 53.653 53.653 55.560 -1.907 18497
6300 1 18 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.274 0.496 18497
6301 1 18 . 1 1 58 58 ASN H H 58 8.238 8.238 8.367 -0.129 18497
6302 1 18 . 1 1 59 59 GLN N N 59 120.456 120.456 117.482 2.974 18497
6303 1 18 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.515 -0.205 18497
6304 1 18 . 1 1 59 59 GLN C C 59 175.326 175.326 174.528 0.798 18497
6305 1 18 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.622 0.408 18497
6306 1 18 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.585 -1.785 18497
6307 1 18 . 1 1 59 59 GLN H H 59 8.196 8.196 7.599 0.597 18497
6308 1 18 . 1 1 60 60 ALA N N 60 125.116 125.116 124.920 0.196 18497
6309 1 18 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.295 0.087 18497
6310 1 18 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.448 -1.148 18497
6311 1 18 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.398 -0.288 18497
6312 1 18 . 1 1 60 60 ALA H H 60 8.293 8.293 8.565 -0.272 18497
6313 1 18 . 1 1 61 61 SER N N 61 115.686 115.686 112.239 3.447 18497
6314 1 18 . 1 1 61 61 SER HA H 61 4.470 4.470 4.623 -0.153 18497
6315 1 18 . 1 1 61 61 SER C C 61 175.674 175.674 173.152 2.522 18497
6316 1 18 . 1 1 61 61 SER CA C 61 58.160 58.160 57.522 0.638 18497
6317 1 18 . 1 1 61 61 SER CB C 61 63.740 63.740 63.666 0.074 18497
6318 1 18 . 1 1 61 61 SER H H 61 8.290 8.290 8.110 0.180 18497
6319 1 19 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.332 0.098 18497
6320 1 19 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.845 0.102 18497
6321 1 19 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.285 -0.155 18497
6322 1 19 . 1 1 3 3 HIS N N 3 119.985 119.985 119.751 0.234 18497
6323 1 19 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.583 0.023 18497
6324 1 19 . 1 1 3 3 HIS C C 3 176.587 176.587 175.731 0.856 18497
6325 1 19 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.804 0.381 18497
6326 1 19 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.294 0.177 18497
6327 1 19 . 1 1 3 3 HIS H H 3 8.526 8.526 8.223 0.303 18497
6328 1 19 . 1 1 4 4 MET N N 4 122.338 122.338 121.062 1.276 18497
6329 1 19 . 1 1 4 4 MET HA H 4 4.448 4.448 4.605 -0.157 18497
6330 1 19 . 1 1 4 4 MET C C 4 175.108 175.108 177.801 -2.693 18497
6331 1 19 . 1 1 4 4 MET CA C 4 55.562 55.562 54.882 0.680 18497
6332 1 19 . 1 1 4 4 MET CB C 4 33.141 33.141 33.179 -0.038 18497
6333 1 19 . 1 1 4 4 MET H H 4 8.337 8.337 8.547 -0.210 18497
6334 1 19 . 1 1 5 5 SER N N 5 116.990 116.990 118.289 -1.299 18497
6335 1 19 . 1 1 5 5 SER HA H 5 4.400 4.400 4.593 -0.193 18497
6336 1 19 . 1 1 5 5 SER C C 5 177.979 177.979 175.258 2.721 18497
6337 1 19 . 1 1 5 5 SER CA C 5 58.039 58.039 57.760 0.279 18497
6338 1 19 . 1 1 5 5 SER CB C 5 63.797 63.797 62.415 1.382 18497
6339 1 19 . 1 1 5 5 SER H H 5 8.330 8.330 8.668 -0.338 18497
6340 1 19 . 1 1 6 6 TYR N N 6 122.027 122.027 124.187 -2.160 18497
6341 1 19 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.063 0.447 18497
6342 1 19 . 1 1 6 6 TYR C C 6 174.060 174.060 176.137 -2.077 18497
6343 1 19 . 1 1 6 6 TYR CA C 6 57.800 57.800 61.470 -3.670 18497
6344 1 19 . 1 1 6 6 TYR CB C 6 38.685 38.685 38.588 0.097 18497
6345 1 19 . 1 1 6 6 TYR H H 6 8.201 8.201 7.768 0.433 18497
6346 1 19 . 1 1 7 7 ASP N N 7 122.439 122.439 117.624 4.815 18497
6347 1 19 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.177 0.372 18497
6348 1 19 . 1 1 7 7 ASP C C 7 175.150 175.150 176.729 -1.579 18497
6349 1 19 . 1 1 7 7 ASP CA C 7 53.640 53.640 56.431 -2.791 18497
6350 1 19 . 1 1 7 7 ASP CB C 7 41.300 41.300 40.075 1.225 18497
6351 1 19 . 1 1 7 7 ASP H H 7 8.119 8.119 8.598 -0.479 18497
6352 1 19 . 1 1 8 8 ALA N N 8 124.655 124.655 121.122 3.533 18497
6353 1 19 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.207 0.023 18497
6354 1 19 . 1 1 8 8 ALA C C 8 175.935 175.935 178.386 -2.451 18497
6355 1 19 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.508 -0.615 18497
6356 1 19 . 1 1 8 8 ALA CB C 8 18.850 18.850 20.095 -1.245 18497
6357 1 19 . 1 1 8 8 ALA H H 8 8.235 8.235 7.512 0.723 18497
6358 1 19 . 1 1 9 9 ASN N N 9 116.133 116.133 115.775 0.358 18497
6359 1 19 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.608 0.082 18497
6360 1 19 . 1 1 9 9 ASN C C 9 177.718 177.718 175.946 1.772 18497
6361 1 19 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.701 -0.901 18497
6362 1 19 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.613 -0.843 18497
6363 1 19 . 1 1 9 9 ASN H H 9 8.417 8.417 7.631 0.786 18497
6364 1 19 . 1 1 10 10 VAL N N 10 119.557 119.557 121.337 -1.780 18497
6365 1 19 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.686 0.491 18497
6366 1 19 . 1 1 10 10 VAL C C 10 174.930 174.930 174.812 0.118 18497
6367 1 19 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.178 -1.298 18497
6368 1 19 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.186 0.474 18497
6369 1 19 . 1 1 10 10 VAL H H 10 7.859 7.859 7.591 0.268 18497
6370 1 19 . 1 1 11 11 ILE N N 11 126.561 126.561 127.057 -0.496 18497
6371 1 19 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.471 -0.431 18497
6372 1 19 . 1 1 11 11 ILE C C 11 175.935 175.935 174.522 1.413 18497
6373 1 19 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.566 -0.065 18497
6374 1 19 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.607 -3.907 18497
6375 1 19 . 1 1 11 11 ILE H H 11 8.283 8.283 7.869 0.414 18497
6376 1 19 . 1 1 12 12 ASP N N 12 128.161 128.161 127.886 0.275 18497
6377 1 19 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.950 -0.220 18497
6378 1 19 . 1 1 12 12 ASP C C 12 174.891 174.891 176.781 -1.890 18497
6379 1 19 . 1 1 12 12 ASP CA C 12 53.427 53.427 54.485 -1.058 18497
6380 1 19 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.270 0.950 18497
6381 1 19 . 1 1 12 12 ASP H H 12 8.477 8.477 8.515 -0.038 18497
6382 1 19 . 1 1 13 13 ASP N N 13 127.435 127.435 123.865 3.570 18497
6383 1 19 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.300 0.016 18497
6384 1 19 . 1 1 13 13 ASP C C 13 175.369 175.369 177.522 -2.153 18497
6385 1 19 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.566 0.033 18497
6386 1 19 . 1 1 13 13 ASP CB C 13 41.160 41.160 40.811 0.349 18497
6387 1 19 . 1 1 13 13 ASP H H 13 8.698 8.698 8.800 -0.102 18497
6388 1 19 . 1 1 14 14 GLU N N 14 119.796 119.796 120.550 -0.754 18497
6389 1 19 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.082 -0.047 18497
6390 1 19 . 1 1 14 14 GLU C C 14 178.588 178.588 178.010 0.578 18497
6391 1 19 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.262 0.238 18497
6392 1 19 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.130 -0.230 18497
6393 1 19 . 1 1 14 14 GLU H H 14 8.205 8.205 8.767 -0.562 18497
6394 1 19 . 1 1 15 15 ALA N N 15 124.156 124.156 122.932 1.224 18497
6395 1 19 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.045 0.131 18497
6396 1 19 . 1 1 15 15 ALA C C 15 179.502 179.502 179.350 0.152 18497
6397 1 19 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.787 0.213 18497
6398 1 19 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.164 0.736 18497
6399 1 19 . 1 1 15 15 ALA H H 15 8.473 8.473 7.834 0.639 18497
6400 1 19 . 1 1 16 16 VAL N N 16 117.585 117.585 119.188 -1.603 18497
6401 1 19 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.613 -0.079 18497
6402 1 19 . 1 1 16 16 VAL C C 16 179.545 179.545 178.163 1.382 18497
6403 1 19 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.246 0.754 18497
6404 1 19 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.023 0.577 18497
6405 1 19 . 1 1 16 16 VAL H H 16 8.181 8.181 8.612 -0.431 18497
6406 1 19 . 1 1 17 17 LYS N N 17 119.377 119.377 119.362 0.015 18497
6407 1 19 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.950 0.006 18497
6408 1 19 . 1 1 17 17 LYS C C 17 178.197 178.197 178.773 -0.576 18497
6409 1 19 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.587 0.433 18497
6410 1 19 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.348 -0.218 18497
6411 1 19 . 1 1 17 17 LYS H H 17 8.001 8.001 8.102 -0.101 18497
6412 1 19 . 1 1 18 18 GLU N N 18 120.395 120.395 119.452 0.943 18497
6413 1 19 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.108 0.032 18497
6414 1 19 . 1 1 18 18 GLU C C 18 178.849 178.849 178.889 -0.040 18497
6415 1 19 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.263 0.537 18497
6416 1 19 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.785 -0.292 18497
6417 1 19 . 1 1 18 18 GLU H H 18 7.943 7.943 7.923 0.020 18497
6418 1 19 . 1 1 19 19 VAL N N 19 121.088 121.088 118.940 2.148 18497
6419 1 19 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.755 -0.105 18497
6420 1 19 . 1 1 19 19 VAL C C 19 179.415 179.415 178.102 1.313 18497
6421 1 19 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.389 1.591 18497
6422 1 19 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.522 0.078 18497
6423 1 19 . 1 1 19 19 VAL H H 19 8.335 8.335 8.845 -0.510 18497
6424 1 19 . 1 1 20 20 CYS N N 20 117.290 117.290 118.194 -0.904 18497
6425 1 19 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.593 0.087 18497
6426 1 19 . 1 1 20 20 CYS C C 20 178.110 178.110 176.637 1.473 18497
6427 1 19 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.198 1.002 18497
6428 1 19 . 1 1 20 20 CYS CB C 20 26.800 26.800 26.095 0.705 18497
6429 1 19 . 1 1 20 20 CYS H H 20 8.434 8.434 7.806 0.628 18497
6430 1 19 . 1 1 21 21 GLU N N 21 118.195 118.195 120.103 -1.908 18497
6431 1 19 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.247 -0.108 18497
6432 1 19 . 1 1 21 21 GLU C C 21 178.153 178.153 178.114 0.039 18497
6433 1 19 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.577 1.173 18497
6434 1 19 . 1 1 21 21 GLU CB C 21 29.500 29.500 30.073 -0.573 18497
6435 1 19 . 1 1 21 21 GLU H H 21 7.972 7.972 7.722 0.250 18497
6436 1 19 . 1 1 22 22 LYS N N 22 119.095 119.095 118.881 0.214 18497
6437 1 19 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.183 -0.178 18497
6438 1 19 . 1 1 22 22 LYS C C 22 179.371 179.371 177.948 1.423 18497
6439 1 19 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.492 0.208 18497
6440 1 19 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.765 0.155 18497
6441 1 19 . 1 1 22 22 LYS H H 22 8.071 8.071 8.297 -0.226 18497
6442 1 19 . 1 1 23 23 PHE N N 23 114.252 114.252 117.737 -3.485 18497
6443 1 19 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.625 -0.195 18497
6444 1 19 . 1 1 23 23 PHE C C 23 178.197 178.197 175.123 3.074 18497
6445 1 19 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.469 -0.039 18497
6446 1 19 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.550 -1.780 18497
6447 1 19 . 1 1 23 23 PHE H H 23 8.491 8.491 7.824 0.666 18497
6448 1 19 . 1 1 24 24 GLU N N 24 119.819 119.819 114.889 4.930 18497
6449 1 19 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.130 -0.060 18497
6450 1 19 . 1 1 24 24 GLU C C 24 177.457 177.457 175.767 1.690 18497
6451 1 19 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.498 -0.668 18497
6452 1 19 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.379 -0.579 18497
6453 1 19 . 1 1 24 24 GLU H H 24 7.867 7.867 8.343 -0.476 18497
6454 1 19 . 1 1 25 25 CYS N N 25 114.633 114.633 118.086 -3.453 18497
6455 1 19 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.790 0.597 18497
6456 1 19 . 1 1 25 25 CYS C C 25 174.760 174.760 174.796 -0.036 18497
6457 1 19 . 1 1 25 25 CYS CA C 25 54.761 54.761 57.951 -3.190 18497
6458 1 19 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.776 0.824 18497
6459 1 19 . 1 1 25 25 CYS H H 25 8.156 8.156 7.762 0.394 18497
6460 1 19 . 1 1 26 26 THR N N 26 109.312 109.312 116.439 -7.127 18497
6461 1 19 . 1 1 26 26 THR HA H 26 4.770 4.770 4.379 0.391 18497
6462 1 19 . 1 1 26 26 THR C C 26 173.499 173.499 176.028 -2.529 18497
6463 1 19 . 1 1 26 26 THR CA C 26 60.723 60.723 62.088 -1.365 18497
6464 1 19 . 1 1 26 26 THR CB C 26 72.000 72.000 69.971 2.029 18497
6465 1 19 . 1 1 26 26 THR H H 26 8.460 8.460 9.098 -0.638 18497
6466 1 19 . 1 1 27 27 GLU N N 27 122.233 122.233 125.188 -2.955 18497
6467 1 19 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.950 -0.440 18497
6468 1 19 . 1 1 27 27 GLU C C 27 176.544 176.544 177.975 -1.431 18497
6469 1 19 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.234 0.316 18497
6470 1 19 . 1 1 27 27 GLU CB C 27 28.950 28.950 28.485 0.465 18497
6471 1 19 . 1 1 27 27 GLU H H 27 9.327 9.327 8.708 0.619 18497
6472 1 19 . 1 1 28 28 SER N N 28 112.925 112.925 117.126 -4.201 18497
6473 1 19 . 1 1 28 28 SER HA H 28 4.062 4.062 4.171 -0.109 18497
6474 1 19 . 1 1 28 28 SER C C 28 178.545 178.545 176.767 1.778 18497
6475 1 19 . 1 1 28 28 SER CA C 28 61.350 61.350 62.201 -0.851 18497
6476 1 19 . 1 1 28 28 SER CB C 28 62.400 62.400 62.658 -0.258 18497
6477 1 19 . 1 1 28 28 SER H H 28 8.320 8.320 8.471 -0.151 18497
6478 1 19 . 1 1 29 29 GLU N N 29 121.736 121.736 122.400 -0.664 18497
6479 1 19 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.092 -0.102 18497
6480 1 19 . 1 1 29 29 GLU C C 29 176.674 176.674 178.759 -2.085 18497
6481 1 19 . 1 1 29 29 GLU CA C 29 59.750 59.750 59.171 0.579 18497
6482 1 19 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.771 -0.301 18497
6483 1 19 . 1 1 29 29 GLU H H 29 7.512 7.512 7.494 0.018 18497
6484 1 19 . 1 1 30 30 VAL N N 30 119.480 119.480 120.324 -0.844 18497
6485 1 19 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.526 -0.149 18497
6486 1 19 . 1 1 30 30 VAL C C 30 179.241 179.241 177.979 1.262 18497
6487 1 19 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.608 0.053 18497
6488 1 19 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.864 -0.794 18497
6489 1 19 . 1 1 30 30 VAL H H 30 7.492 7.492 8.245 -0.753 18497
6490 1 19 . 1 1 31 31 MET N N 31 117.220 117.220 117.356 -0.136 18497
6491 1 19 . 1 1 31 31 MET HA H 31 3.870 3.870 3.906 -0.036 18497
6492 1 19 . 1 1 31 31 MET C C 31 177.936 177.936 178.088 -0.152 18497
6493 1 19 . 1 1 31 31 MET CA C 31 57.630 57.630 58.972 -1.342 18497
6494 1 19 . 1 1 31 31 MET CB C 31 30.270 30.270 32.175 -1.905 18497
6495 1 19 . 1 1 31 31 MET H H 31 8.302 8.302 8.492 -0.190 18497
6496 1 19 . 1 1 32 32 ASN N N 32 116.672 116.672 118.761 -2.089 18497
6497 1 19 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.393 -0.003 18497
6498 1 19 . 1 1 32 32 ASN C C 32 176.065 176.065 177.544 -1.479 18497
6499 1 19 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.760 -0.730 18497
6500 1 19 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.356 -0.646 18497
6501 1 19 . 1 1 32 32 ASN H H 32 8.313 8.313 7.852 0.461 18497
6502 1 19 . 1 1 33 33 SER N N 33 117.471 117.471 115.953 1.518 18497
6503 1 19 . 1 1 33 33 SER HA H 33 4.150 4.150 4.161 -0.011 18497
6504 1 19 . 1 1 33 33 SER C C 33 178.806 178.806 176.262 2.544 18497
6505 1 19 . 1 1 33 33 SER CA C 33 62.950 62.950 61.590 1.360 18497
6506 1 19 . 1 1 33 33 SER CB C 33 62.600 62.600 63.130 -0.530 18497
6507 1 19 . 1 1 33 33 SER H H 33 7.851 7.851 7.696 0.155 18497
6508 1 19 . 1 1 34 34 LEU N N 34 122.839 122.839 121.085 1.754 18497
6509 1 19 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.100 -0.221 18497
6510 1 19 . 1 1 34 34 LEU C C 34 177.892 177.892 178.687 -0.795 18497
6511 1 19 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.788 0.843 18497
6512 1 19 . 1 1 34 34 LEU CB C 34 40.800 40.800 41.797 -0.997 18497
6513 1 19 . 1 1 34 34 LEU H H 34 8.128 8.128 7.249 0.879 18497
6514 1 19 . 1 1 35 35 TYR N N 35 116.666 116.666 120.363 -3.697 18497
6515 1 19 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.341 0.269 18497
6516 1 19 . 1 1 35 35 TYR C C 35 179.067 179.067 177.140 1.927 18497
6517 1 19 . 1 1 35 35 TYR CA C 35 57.890 57.890 60.434 -2.544 18497
6518 1 19 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.161 -1.451 18497
6519 1 19 . 1 1 35 35 TYR H H 35 7.924 7.924 8.375 -0.451 18497
6520 1 19 . 1 1 36 36 SER N N 36 114.801 114.801 115.159 -0.358 18497
6521 1 19 . 1 1 36 36 SER HA H 36 4.080 4.080 4.281 -0.201 18497
6522 1 19 . 1 1 36 36 SER C C 36 177.283 177.283 174.881 2.402 18497
6523 1 19 . 1 1 36 36 SER CA C 36 60.519 60.519 60.346 0.173 18497
6524 1 19 . 1 1 36 36 SER CB C 36 64.240 64.240 63.834 0.406 18497
6525 1 19 . 1 1 36 36 SER H H 36 7.715 7.715 8.495 -0.780 18497
6526 1 19 . 1 1 37 37 GLY N N 37 109.803 109.803 108.127 1.676 18497
6527 1 19 . 1 1 37 37 GLY C C 37 175.978 175.978 173.698 2.280 18497
6528 1 19 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.935 0.743 18497
6529 1 19 . 1 1 37 37 GLY H H 37 8.017 8.017 7.693 0.324 18497
6530 1 19 . 1 1 38 38 ASP N N 38 120.613 120.613 121.891 -1.278 18497
6531 1 19 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.054 -0.029 18497
6532 1 19 . 1 1 38 38 ASP C C 38 173.368 173.368 175.769 -2.401 18497
6533 1 19 . 1 1 38 38 ASP CA C 38 50.720 50.720 50.752 -0.032 18497
6534 1 19 . 1 1 38 38 ASP CB C 38 41.420 41.420 41.775 -0.355 18497
6535 1 19 . 1 1 38 38 ASP H H 38 8.006 8.006 7.940 0.066 18497
6536 1 19 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.481 -0.141 18497
6537 1 19 . 1 1 39 39 PRO CA C 39 63.750 63.750 63.802 -0.052 18497
6538 1 19 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.404 -0.274 18497
6539 1 19 . 1 1 40 40 GLN N N 40 115.056 115.056 116.656 -1.600 18497
6540 1 19 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.235 0.045 18497
6541 1 19 . 1 1 40 40 GLN C C 40 177.066 177.066 176.038 1.028 18497
6542 1 19 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.858 -1.148 18497
6543 1 19 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.927 -0.247 18497
6544 1 19 . 1 1 40 40 GLN H H 40 8.237 8.237 8.148 0.089 18497
6545 1 19 . 1 1 41 41 ASP N N 41 122.839 122.839 120.338 2.501 18497
6546 1 19 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.518 -0.205 18497
6547 1 19 . 1 1 41 41 ASP C C 41 175.804 175.804 177.239 -1.435 18497
6548 1 19 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.559 0.681 18497
6549 1 19 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.391 -0.171 18497
6550 1 19 . 1 1 41 41 ASP H H 41 7.211 7.211 7.443 -0.232 18497
6551 1 19 . 1 1 42 42 GLN N N 42 124.547 124.547 125.059 -0.512 18497
6552 1 19 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.014 -0.154 18497
6553 1 19 . 1 1 42 42 GLN C C 42 177.196 177.196 177.451 -0.255 18497
6554 1 19 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.182 0.038 18497
6555 1 19 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.812 -0.412 18497
6556 1 19 . 1 1 42 42 GLN H H 42 8.719 8.719 8.885 -0.166 18497
6557 1 19 . 1 1 43 43 LEU N N 43 118.960 118.960 118.336 0.624 18497
6558 1 19 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.955 -0.270 18497
6559 1 19 . 1 1 43 43 LEU C C 43 178.066 178.066 178.359 -0.293 18497
6560 1 19 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.508 0.852 18497
6561 1 19 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.597 -1.207 18497
6562 1 19 . 1 1 43 43 LEU H H 43 8.206 8.206 8.106 0.100 18497
6563 1 19 . 1 1 44 44 ALA N N 44 121.666 121.666 123.398 -1.732 18497
6564 1 19 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.071 -0.192 18497
6565 1 19 . 1 1 44 44 ALA C C 44 178.327 178.327 179.566 -1.239 18497
6566 1 19 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.981 -0.271 18497
6567 1 19 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.227 0.353 18497
6568 1 19 . 1 1 44 44 ALA H H 44 7.402 7.402 7.583 -0.181 18497
6569 1 19 . 1 1 45 45 VAL N N 45 118.589 118.589 120.289 -1.700 18497
6570 1 19 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.589 0.071 18497
6571 1 19 . 1 1 45 45 VAL C C 45 179.893 179.893 177.805 2.088 18497
6572 1 19 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.969 -0.569 18497
6573 1 19 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.250 0.881 18497
6574 1 19 . 1 1 45 45 VAL H H 45 8.449 8.449 8.486 -0.037 18497
6575 1 19 . 1 1 46 46 ALA N N 46 121.006 121.006 122.950 -1.944 18497
6576 1 19 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.668 0.462 18497
6577 1 19 . 1 1 46 46 ALA C C 46 179.110 179.110 178.845 0.265 18497
6578 1 19 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.224 -0.254 18497
6579 1 19 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.545 1.565 18497
6580 1 19 . 1 1 46 46 ALA H H 46 7.654 7.654 8.077 -0.423 18497
6581 1 19 . 1 1 47 47 TYR N N 47 119.140 119.140 119.857 -0.717 18497
6582 1 19 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.976 -0.226 18497
6583 1 19 . 1 1 47 47 TYR C C 47 179.328 179.328 177.417 1.911 18497
6584 1 19 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.764 0.116 18497
6585 1 19 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.361 0.139 18497
6586 1 19 . 1 1 47 47 TYR H H 47 8.077 8.077 8.127 -0.050 18497
6587 1 19 . 1 1 48 48 HIS N N 48 116.422 116.422 118.961 -2.539 18497
6588 1 19 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.066 0.034 18497
6589 1 19 . 1 1 48 48 HIS C C 48 178.023 178.023 177.655 0.368 18497
6590 1 19 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.903 0.117 18497
6591 1 19 . 1 1 48 48 HIS CB C 48 28.940 28.940 30.060 -1.120 18497
6592 1 19 . 1 1 48 48 HIS H H 48 8.326 8.326 8.430 -0.104 18497
6593 1 19 . 1 1 49 49 LEU N N 49 120.974 120.974 120.709 0.265 18497
6594 1 19 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.276 -0.121 18497
6595 1 19 . 1 1 49 49 LEU C C 49 177.417 177.417 179.665 -2.248 18497
6596 1 19 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.132 -0.242 18497
6597 1 19 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.552 0.408 18497
6598 1 19 . 1 1 49 49 LEU H H 49 8.237 8.237 8.552 -0.315 18497
6599 1 19 . 1 1 50 50 ILE N N 50 119.715 119.715 119.661 0.054 18497
6600 1 19 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.617 0.003 18497
6601 1 19 . 1 1 50 50 ILE C C 50 179.502 179.502 178.227 1.275 18497
6602 1 19 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.780 -0.720 18497
6603 1 19 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.824 0.146 18497
6604 1 19 . 1 1 50 50 ILE H H 50 7.543 7.543 8.378 -0.835 18497
6605 1 19 . 1 1 51 51 ILE N N 51 117.995 117.995 121.913 -3.918 18497
6606 1 19 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.375 0.165 18497
6607 1 19 . 1 1 51 51 ILE C C 51 179.197 179.197 177.397 1.800 18497
6608 1 19 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.837 -2.097 18497
6609 1 19 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.213 -0.563 18497
6610 1 19 . 1 1 51 51 ILE H H 51 7.475 7.475 8.028 -0.553 18497
6611 1 19 . 1 1 52 52 ASP N N 52 121.642 121.642 120.449 1.193 18497
6612 1 19 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.265 0.175 18497
6613 1 19 . 1 1 52 52 ASP C C 52 179.197 179.197 178.865 0.332 18497
6614 1 19 . 1 1 52 52 ASP CA C 52 57.100 57.100 58.099 -1.000 18497
6615 1 19 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.055 0.245 18497
6616 1 19 . 1 1 52 52 ASP H H 52 8.559 8.559 8.372 0.187 18497
6617 1 19 . 1 1 53 53 ASN N N 53 117.131 117.131 118.956 -1.825 18497
6618 1 19 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.553 0.057 18497
6619 1 19 . 1 1 53 53 ASN C C 53 178.545 178.545 177.707 0.838 18497
6620 1 19 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.129 -1.429 18497
6621 1 19 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.763 -0.063 18497
6622 1 19 . 1 1 53 53 ASN H H 53 8.106 8.106 8.476 -0.370 18497
6623 1 19 . 1 1 54 54 ARG N N 54 119.929 119.929 119.775 0.154 18497
6624 1 19 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.005 0.115 18497
6625 1 19 . 1 1 54 54 ARG C C 54 176.892 176.892 178.167 -1.275 18497
6626 1 19 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.724 -0.564 18497
6627 1 19 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.212 0.058 18497
6628 1 19 . 1 1 54 54 ARG H H 54 7.797 7.797 8.094 -0.297 18497
6629 1 19 . 1 1 55 55 ARG N N 55 119.227 119.227 118.154 1.073 18497
6630 1 19 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.195 -0.021 18497
6631 1 19 . 1 1 55 55 ARG C C 55 175.108 175.108 178.077 -2.969 18497
6632 1 19 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.436 3.444 18497
6633 1 19 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.452 2.208 18497
6634 1 19 . 1 1 55 55 ARG H H 55 7.857 7.857 8.124 -0.267 18497
6635 1 19 . 1 1 56 56 ILE N N 56 116.676 116.676 117.663 -0.987 18497
6636 1 19 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.001 0.009 18497
6637 1 19 . 1 1 56 56 ILE C C 56 176.065 176.065 176.581 -0.516 18497
6638 1 19 . 1 1 56 56 ILE CA C 56 62.140 62.140 63.597 -1.457 18497
6639 1 19 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.344 -1.104 18497
6640 1 19 . 1 1 56 56 ILE H H 56 8.317 8.317 8.412 -0.095 18497
6641 1 19 . 1 1 57 57 MET N N 57 122.058 122.058 115.216 6.842 18497
6642 1 19 . 1 1 57 57 MET HA H 57 4.420 4.420 4.505 -0.085 18497
6643 1 19 . 1 1 57 57 MET C C 57 177.283 177.283 174.693 2.590 18497
6644 1 19 . 1 1 57 57 MET CA C 57 56.030 56.030 55.000 1.030 18497
6645 1 19 . 1 1 57 57 MET CB C 57 32.515 32.515 35.118 -2.603 18497
6646 1 19 . 1 1 57 57 MET H H 57 8.177 8.177 7.653 0.524 18497
6647 1 19 . 1 1 58 58 ASN N N 58 118.892 118.892 120.231 -1.339 18497
6648 1 19 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.494 0.196 18497
6649 1 19 . 1 1 58 58 ASN C C 58 176.500 176.500 173.998 2.502 18497
6650 1 19 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.370 -0.717 18497
6651 1 19 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.016 -0.246 18497
6652 1 19 . 1 1 58 58 ASN H H 58 8.238 8.238 8.753 -0.515 18497
6653 1 19 . 1 1 59 59 GLN N N 59 120.456 120.456 112.935 7.521 18497
6654 1 19 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.492 -0.182 18497
6655 1 19 . 1 1 59 59 GLN C C 59 175.326 175.326 174.312 1.014 18497
6656 1 19 . 1 1 59 59 GLN CA C 59 56.030 56.030 55.105 0.925 18497
6657 1 19 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.646 -1.846 18497
6658 1 19 . 1 1 59 59 GLN H H 59 8.196 8.196 7.277 0.919 18497
6659 1 19 . 1 1 60 60 ALA N N 60 125.116 125.116 123.167 1.949 18497
6660 1 19 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.361 0.021 18497
6661 1 19 . 1 1 60 60 ALA CA C 60 52.300 52.300 53.137 -0.837 18497
6662 1 19 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.138 -0.028 18497
6663 1 19 . 1 1 60 60 ALA H H 60 8.293 8.293 8.508 -0.215 18497
6664 1 19 . 1 1 61 61 SER N N 61 115.686 115.686 111.501 4.185 18497
6665 1 19 . 1 1 61 61 SER HA H 61 4.470 4.470 4.479 -0.009 18497
6666 1 19 . 1 1 61 61 SER C C 61 175.674 175.674 173.306 2.368 18497
6667 1 19 . 1 1 61 61 SER CA C 61 58.160 58.160 57.544 0.616 18497
6668 1 19 . 1 1 61 61 SER CB C 61 63.740 63.740 63.680 0.060 18497
6669 1 19 . 1 1 61 61 SER H H 61 8.290 8.290 7.631 0.659 18497
6670 1 20 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.682 -0.252 18497
6671 1 20 . 1 1 2 2 PRO CA C 2 62.947 62.947 63.265 -0.318 18497
6672 1 20 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.714 -0.584 18497
6673 1 20 . 1 1 3 3 HIS N N 3 119.985 119.985 120.336 -0.351 18497
6674 1 20 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.581 0.025 18497
6675 1 20 . 1 1 3 3 HIS C C 3 176.587 176.587 176.307 0.280 18497
6676 1 20 . 1 1 3 3 HIS CA C 3 56.185 56.185 55.097 1.087 18497
6677 1 20 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.108 0.363 18497
6678 1 20 . 1 1 3 3 HIS H H 3 8.526 8.526 8.632 -0.106 18497
6679 1 20 . 1 1 4 4 MET N N 4 122.338 122.338 118.660 3.678 18497
6680 1 20 . 1 1 4 4 MET HA H 4 4.448 4.448 4.843 -0.395 18497
6681 1 20 . 1 1 4 4 MET C C 4 175.108 175.108 176.488 -1.380 18497
6682 1 20 . 1 1 4 4 MET CA C 4 55.562 55.562 56.463 -0.901 18497
6683 1 20 . 1 1 4 4 MET CB C 4 33.141 33.141 32.820 0.321 18497
6684 1 20 . 1 1 4 4 MET H H 4 8.337 8.337 7.949 0.388 18497
6685 1 20 . 1 1 5 5 SER N N 5 116.990 116.990 117.084 -0.094 18497
6686 1 20 . 1 1 5 5 SER HA H 5 4.400 4.400 4.643 -0.243 18497
6687 1 20 . 1 1 5 5 SER C C 5 177.979 177.979 173.793 4.186 18497
6688 1 20 . 1 1 5 5 SER CA C 5 58.039 58.039 58.342 -0.303 18497
6689 1 20 . 1 1 5 5 SER CB C 5 63.797 63.797 63.347 0.450 18497
6690 1 20 . 1 1 5 5 SER H H 5 8.330 8.330 8.459 -0.129 18497
6691 1 20 . 1 1 6 6 TYR N N 6 122.027 122.027 120.247 1.780 18497
6692 1 20 . 1 1 6 6 TYR HA H 6 4.510 4.510 5.035 -0.525 18497
6693 1 20 . 1 1 6 6 TYR C C 6 174.060 174.060 173.539 0.521 18497
6694 1 20 . 1 1 6 6 TYR CA C 6 57.800 57.800 57.193 0.607 18497
6695 1 20 . 1 1 6 6 TYR CB C 6 38.685 38.685 40.423 -1.738 18497
6696 1 20 . 1 1 6 6 TYR H H 6 8.201 8.201 8.002 0.199 18497
6697 1 20 . 1 1 7 7 ASP N N 7 122.439 122.439 123.107 -0.668 18497
6698 1 20 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.550 -0.001 18497
6699 1 20 . 1 1 7 7 ASP C C 7 175.150 175.150 174.053 1.097 18497
6700 1 20 . 1 1 7 7 ASP CA C 7 53.640 53.640 52.686 0.954 18497
6701 1 20 . 1 1 7 7 ASP CB C 7 41.300 41.300 42.685 -1.385 18497
6702 1 20 . 1 1 7 7 ASP H H 7 8.119 8.119 7.390 0.729 18497
6703 1 20 . 1 1 8 8 ALA N N 8 124.655 124.655 125.411 -0.756 18497
6704 1 20 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.230 0.000 18497
6705 1 20 . 1 1 8 8 ALA C C 8 175.935 175.935 177.483 -1.548 18497
6706 1 20 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.022 -0.128 18497
6707 1 20 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.670 -0.820 18497
6708 1 20 . 1 1 8 8 ALA H H 8 8.235 8.235 8.146 0.088 18497
6709 1 20 . 1 1 9 9 ASN N N 9 116.133 116.133 116.884 -0.751 18497
6710 1 20 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.426 0.264 18497
6711 1 20 . 1 1 9 9 ASN C C 9 177.718 177.718 175.725 1.993 18497
6712 1 20 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.180 -0.380 18497
6713 1 20 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.441 -0.671 18497
6714 1 20 . 1 1 9 9 ASN H H 9 8.417 8.417 7.863 0.554 18497
6715 1 20 . 1 1 10 10 VAL N N 10 119.557 119.557 116.412 3.145 18497
6716 1 20 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.917 0.260 18497
6717 1 20 . 1 1 10 10 VAL C C 10 174.930 174.930 174.420 0.510 18497
6718 1 20 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.989 -2.109 18497
6719 1 20 . 1 1 10 10 VAL CB C 10 32.660 32.660 32.268 0.392 18497
6720 1 20 . 1 1 10 10 VAL H H 10 7.859 7.859 8.227 -0.368 18497
6721 1 20 . 1 1 11 11 ILE N N 11 126.561 126.561 124.361 2.200 18497
6722 1 20 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.414 -0.374 18497
6723 1 20 . 1 1 11 11 ILE C C 11 175.935 175.935 174.356 1.579 18497
6724 1 20 . 1 1 11 11 ILE CA C 11 59.500 59.500 59.790 -0.290 18497
6725 1 20 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.632 -3.932 18497
6726 1 20 . 1 1 11 11 ILE H H 11 8.283 8.283 7.918 0.365 18497
6727 1 20 . 1 1 12 12 ASP N N 12 128.161 128.161 123.243 4.918 18497
6728 1 20 . 1 1 12 12 ASP HA H 12 4.730 4.730 5.003 -0.273 18497
6729 1 20 . 1 1 12 12 ASP C C 12 174.891 174.891 176.601 -1.710 18497
6730 1 20 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.224 0.203 18497
6731 1 20 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.245 0.975 18497
6732 1 20 . 1 1 12 12 ASP H H 12 8.477 8.477 8.615 -0.138 18497
6733 1 20 . 1 1 13 13 ASP N N 13 127.435 127.435 127.153 0.282 18497
6734 1 20 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.314 0.002 18497
6735 1 20 . 1 1 13 13 ASP C C 13 175.369 175.369 177.375 -2.006 18497
6736 1 20 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.246 0.354 18497
6737 1 20 . 1 1 13 13 ASP CB C 13 41.160 41.160 40.785 0.376 18497
6738 1 20 . 1 1 13 13 ASP H H 13 8.698 8.698 8.928 -0.230 18497
6739 1 20 . 1 1 14 14 GLU N N 14 119.796 119.796 120.054 -0.258 18497
6740 1 20 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.108 -0.073 18497
6741 1 20 . 1 1 14 14 GLU C C 14 178.588 178.588 178.143 0.445 18497
6742 1 20 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.123 0.377 18497
6743 1 20 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.666 -0.766 18497
6744 1 20 . 1 1 14 14 GLU H H 14 8.205 8.205 8.320 -0.115 18497
6745 1 20 . 1 1 15 15 ALA N N 15 124.156 124.156 123.158 0.998 18497
6746 1 20 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.124 0.052 18497
6747 1 20 . 1 1 15 15 ALA C C 15 179.502 179.502 179.730 -0.228 18497
6748 1 20 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.160 -0.160 18497
6749 1 20 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.198 0.702 18497
6750 1 20 . 1 1 15 15 ALA H H 15 8.473 8.473 7.718 0.754 18497
6751 1 20 . 1 1 16 16 VAL N N 16 117.585 117.585 118.619 -1.034 18497
6752 1 20 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.602 -0.068 18497
6753 1 20 . 1 1 16 16 VAL C C 16 179.545 179.545 178.338 1.207 18497
6754 1 20 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.014 0.986 18497
6755 1 20 . 1 1 16 16 VAL CB C 16 31.600 31.600 30.866 0.734 18497
6756 1 20 . 1 1 16 16 VAL H H 16 8.181 8.181 8.610 -0.429 18497
6757 1 20 . 1 1 17 17 LYS N N 17 119.377 119.377 119.475 -0.098 18497
6758 1 20 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.973 -0.017 18497
6759 1 20 . 1 1 17 17 LYS C C 17 178.197 178.197 178.933 -0.736 18497
6760 1 20 . 1 1 17 17 LYS CA C 17 60.020 60.020 60.028 -0.008 18497
6761 1 20 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.191 -0.061 18497
6762 1 20 . 1 1 17 17 LYS H H 17 8.001 8.001 8.321 -0.320 18497
6763 1 20 . 1 1 18 18 GLU N N 18 120.395 120.395 120.271 0.124 18497
6764 1 20 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.105 0.035 18497
6765 1 20 . 1 1 18 18 GLU C C 18 178.849 178.849 178.850 -0.001 18497
6766 1 20 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.421 0.379 18497
6767 1 20 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.733 -0.240 18497
6768 1 20 . 1 1 18 18 GLU H H 18 7.943 7.943 8.083 -0.140 18497
6769 1 20 . 1 1 19 19 VAL N N 19 121.088 121.088 120.461 0.627 18497
6770 1 20 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.713 -0.063 18497
6771 1 20 . 1 1 19 19 VAL C C 19 179.415 179.415 178.386 1.029 18497
6772 1 20 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.817 1.163 18497
6773 1 20 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.353 0.247 18497
6774 1 20 . 1 1 19 19 VAL H H 19 8.335 8.335 8.770 -0.435 18497
6775 1 20 . 1 1 20 20 CYS N N 20 117.290 117.290 118.045 -0.755 18497
6776 1 20 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.324 0.356 18497
6777 1 20 . 1 1 20 20 CYS C C 20 178.110 178.110 176.194 1.916 18497
6778 1 20 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.493 0.707 18497
6779 1 20 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.122 -0.322 18497
6780 1 20 . 1 1 20 20 CYS H H 20 8.434 8.434 8.133 0.301 18497
6781 1 20 . 1 1 21 21 GLU N N 21 118.195 118.195 119.309 -1.114 18497
6782 1 20 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.187 -0.048 18497
6783 1 20 . 1 1 21 21 GLU C C 21 178.153 178.153 178.105 0.048 18497
6784 1 20 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.566 1.184 18497
6785 1 20 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.779 -0.279 18497
6786 1 20 . 1 1 21 21 GLU H H 21 7.972 7.972 7.607 0.365 18497
6787 1 20 . 1 1 22 22 LYS N N 22 119.095 119.095 118.240 0.855 18497
6788 1 20 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.177 -0.172 18497
6789 1 20 . 1 1 22 22 LYS C C 22 179.371 179.371 178.242 1.129 18497
6790 1 20 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.548 0.152 18497
6791 1 20 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.607 0.313 18497
6792 1 20 . 1 1 22 22 LYS H H 22 8.071 8.071 8.314 -0.243 18497
6793 1 20 . 1 1 23 23 PHE N N 23 114.252 114.252 118.084 -3.832 18497
6794 1 20 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.556 -0.126 18497
6795 1 20 . 1 1 23 23 PHE C C 23 178.197 178.197 174.940 3.257 18497
6796 1 20 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.459 -0.029 18497
6797 1 20 . 1 1 23 23 PHE CB C 23 38.770 38.770 39.887 -1.117 18497
6798 1 20 . 1 1 23 23 PHE H H 23 8.491 8.491 8.054 0.437 18497
6799 1 20 . 1 1 24 24 GLU N N 24 119.819 119.819 114.453 5.366 18497
6800 1 20 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.067 0.003 18497
6801 1 20 . 1 1 24 24 GLU C C 24 177.457 177.457 175.920 1.537 18497
6802 1 20 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.231 -0.401 18497
6803 1 20 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.017 -0.218 18497
6804 1 20 . 1 1 24 24 GLU H H 24 7.867 7.867 8.701 -0.834 18497
6805 1 20 . 1 1 25 25 CYS N N 25 114.633 114.633 115.181 -0.548 18497
6806 1 20 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.842 0.545 18497
6807 1 20 . 1 1 25 25 CYS C C 25 174.760 174.760 175.000 -0.240 18497
6808 1 20 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.059 -1.298 18497
6809 1 20 . 1 1 25 25 CYS CB C 25 31.600 31.600 31.164 0.436 18497
6810 1 20 . 1 1 25 25 CYS H H 25 8.156 8.156 7.732 0.424 18497
6811 1 20 . 1 1 26 26 THR N N 26 109.312 109.312 111.979 -2.667 18497
6812 1 20 . 1 1 26 26 THR HA H 26 4.770 4.770 4.503 0.267 18497
6813 1 20 . 1 1 26 26 THR C C 26 173.499 173.499 175.692 -2.193 18497
6814 1 20 . 1 1 26 26 THR CA C 26 60.723 60.723 61.747 -1.024 18497
6815 1 20 . 1 1 26 26 THR CB C 26 72.000 72.000 70.547 1.452 18497
6816 1 20 . 1 1 26 26 THR H H 26 8.460 8.460 8.975 -0.515 18497
6817 1 20 . 1 1 27 27 GLU N N 27 122.233 122.233 122.132 0.101 18497
6818 1 20 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.933 -0.423 18497
6819 1 20 . 1 1 27 27 GLU C C 27 176.544 176.544 178.218 -1.674 18497
6820 1 20 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.203 0.347 18497
6821 1 20 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.364 -0.414 18497
6822 1 20 . 1 1 27 27 GLU H H 27 9.327 9.327 8.988 0.339 18497
6823 1 20 . 1 1 28 28 SER N N 28 112.925 112.925 114.334 -1.409 18497
6824 1 20 . 1 1 28 28 SER HA H 28 4.062 4.062 4.191 -0.129 18497
6825 1 20 . 1 1 28 28 SER C C 28 178.545 178.545 176.310 2.235 18497
6826 1 20 . 1 1 28 28 SER CA C 28 61.350 61.350 60.647 0.703 18497
6827 1 20 . 1 1 28 28 SER CB C 28 62.400 62.400 62.508 -0.108 18497
6828 1 20 . 1 1 28 28 SER H H 28 8.320 8.320 8.453 -0.133 18497
6829 1 20 . 1 1 29 29 GLU N N 29 121.736 121.736 122.299 -0.563 18497
6830 1 20 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.047 -0.057 18497
6831 1 20 . 1 1 29 29 GLU C C 29 176.674 176.674 178.553 -1.879 18497
6832 1 20 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.948 0.802 18497
6833 1 20 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.588 -0.118 18497
6834 1 20 . 1 1 29 29 GLU H H 29 7.512 7.512 7.626 -0.114 18497
6835 1 20 . 1 1 30 30 VAL N N 30 119.480 119.480 119.479 0.001 18497
6836 1 20 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.487 -0.110 18497
6837 1 20 . 1 1 30 30 VAL C C 30 179.241 179.241 177.590 1.651 18497
6838 1 20 . 1 1 30 30 VAL CA C 30 66.660 66.660 65.960 0.700 18497
6839 1 20 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.684 -0.614 18497
6840 1 20 . 1 1 30 30 VAL H H 30 7.492 7.492 7.561 -0.069 18497
6841 1 20 . 1 1 31 31 MET N N 31 117.220 117.220 117.831 -0.611 18497
6842 1 20 . 1 1 31 31 MET HA H 31 3.870 3.870 3.245 0.625 18497
6843 1 20 . 1 1 31 31 MET C C 31 177.936 177.936 177.693 0.243 18497
6844 1 20 . 1 1 31 31 MET CA C 31 57.630 57.630 58.960 -1.330 18497
6845 1 20 . 1 1 31 31 MET CB C 31 30.270 30.270 31.973 -1.703 18497
6846 1 20 . 1 1 31 31 MET H H 31 8.302 8.302 7.591 0.711 18497
6847 1 20 . 1 1 32 32 ASN N N 32 116.672 116.672 118.457 -1.785 18497
6848 1 20 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.314 0.076 18497
6849 1 20 . 1 1 32 32 ASN C C 32 176.065 176.065 177.637 -1.572 18497
6850 1 20 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.558 -0.528 18497
6851 1 20 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.604 -0.894 18497
6852 1 20 . 1 1 32 32 ASN H H 32 8.313 8.313 8.347 -0.034 18497
6853 1 20 . 1 1 33 33 SER N N 33 117.471 117.471 114.251 3.220 18497
6854 1 20 . 1 1 33 33 SER HA H 33 4.150 4.150 4.241 -0.091 18497
6855 1 20 . 1 1 33 33 SER C C 33 178.806 178.806 175.632 3.174 18497
6856 1 20 . 1 1 33 33 SER CA C 33 62.950 62.950 60.728 2.222 18497
6857 1 20 . 1 1 33 33 SER CB C 33 62.600 62.600 63.292 -0.692 18497
6858 1 20 . 1 1 33 33 SER H H 33 7.851 7.851 7.613 0.238 18497
6859 1 20 . 1 1 34 34 LEU N N 34 122.839 122.839 119.710 3.129 18497
6860 1 20 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.235 -0.356 18497
6861 1 20 . 1 1 34 34 LEU C C 34 177.892 177.892 177.216 0.676 18497
6862 1 20 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.575 1.056 18497
6863 1 20 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.454 -1.654 18497
6864 1 20 . 1 1 34 34 LEU H H 34 8.128 8.128 7.188 0.940 18497
6865 1 20 . 1 1 35 35 TYR N N 35 116.666 116.666 114.722 1.944 18497
6866 1 20 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.565 0.045 18497
6867 1 20 . 1 1 35 35 TYR C C 35 179.067 179.067 177.113 1.954 18497
6868 1 20 . 1 1 35 35 TYR CA C 35 57.890 57.890 58.031 -0.141 18497
6869 1 20 . 1 1 35 35 TYR CB C 35 37.710 37.710 39.881 -2.171 18497
6870 1 20 . 1 1 35 35 TYR H H 35 7.924 7.924 7.844 0.080 18497
6871 1 20 . 1 1 36 36 SER N N 36 114.801 114.801 111.424 3.377 18497
6872 1 20 . 1 1 36 36 SER HA H 36 4.080 4.080 4.710 -0.630 18497
6873 1 20 . 1 1 36 36 SER C C 36 177.283 177.283 175.720 1.563 18497
6874 1 20 . 1 1 36 36 SER CA C 36 60.519 60.519 58.332 2.187 18497
6875 1 20 . 1 1 36 36 SER CB C 36 64.240 64.240 65.386 -1.146 18497
6876 1 20 . 1 1 36 36 SER H H 36 7.715 7.715 8.592 -0.877 18497
6877 1 20 . 1 1 37 37 GLY N N 37 109.803 109.803 111.880 -2.077 18497
6878 1 20 . 1 1 37 37 GLY C C 37 175.978 175.978 172.750 3.228 18497
6879 1 20 . 1 1 37 37 GLY CA C 37 45.678 45.678 45.120 0.559 18497
6880 1 20 . 1 1 37 37 GLY H H 37 8.017 8.017 7.977 0.040 18497
6881 1 20 . 1 1 38 38 ASP N N 38 120.613 120.613 118.827 1.786 18497
6882 1 20 . 1 1 38 38 ASP HA H 38 5.025 5.025 5.038 -0.013 18497
6883 1 20 . 1 1 38 38 ASP C C 38 173.368 173.368 174.710 -1.342 18497
6884 1 20 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.846 -1.126 18497
6885 1 20 . 1 1 38 38 ASP CB C 38 41.420 41.420 43.068 -1.648 18497
6886 1 20 . 1 1 38 38 ASP H H 38 8.006 8.006 8.101 -0.095 18497
6887 1 20 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.333 0.007 18497
6888 1 20 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.428 -0.678 18497
6889 1 20 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.126 0.004 18497
6890 1 20 . 1 1 40 40 GLN N N 40 115.056 115.056 114.637 0.419 18497
6891 1 20 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.235 0.045 18497
6892 1 20 . 1 1 40 40 GLN C C 40 177.066 177.066 176.281 0.785 18497
6893 1 20 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.898 -1.188 18497
6894 1 20 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.930 -0.250 18497
6895 1 20 . 1 1 40 40 GLN H H 40 8.237 8.237 8.178 0.059 18497
6896 1 20 . 1 1 41 41 ASP N N 41 122.839 122.839 121.415 1.424 18497
6897 1 20 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.590 -0.277 18497
6898 1 20 . 1 1 41 41 ASP C C 41 175.804 175.804 177.289 -1.485 18497
6899 1 20 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.011 1.230 18497
6900 1 20 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.735 -0.515 18497
6901 1 20 . 1 1 41 41 ASP H H 41 7.211 7.211 7.839 -0.628 18497
6902 1 20 . 1 1 42 42 GLN N N 42 124.547 124.547 122.727 1.820 18497
6903 1 20 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.049 -0.189 18497
6904 1 20 . 1 1 42 42 GLN C C 42 177.196 177.196 177.937 -0.741 18497
6905 1 20 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.413 -0.193 18497
6906 1 20 . 1 1 42 42 GLN CB C 42 28.400 28.400 29.073 -0.673 18497
6907 1 20 . 1 1 42 42 GLN H H 42 8.719 8.719 8.821 -0.102 18497
6908 1 20 . 1 1 43 43 LEU N N 43 118.960 118.960 118.463 0.497 18497
6909 1 20 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.953 -0.268 18497
6910 1 20 . 1 1 43 43 LEU C C 43 178.066 178.066 178.685 -0.619 18497
6911 1 20 . 1 1 43 43 LEU CA C 43 57.360 57.360 57.576 -0.216 18497
6912 1 20 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.599 -1.209 18497
6913 1 20 . 1 1 43 43 LEU H H 43 8.206 8.206 8.371 -0.165 18497
6914 1 20 . 1 1 44 44 ALA N N 44 121.666 121.666 122.498 -0.832 18497
6915 1 20 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.142 -0.263 18497
6916 1 20 . 1 1 44 44 ALA C C 44 178.327 178.327 179.586 -1.259 18497
6917 1 20 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.804 -0.094 18497
6918 1 20 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.287 0.293 18497
6919 1 20 . 1 1 44 44 ALA H H 44 7.402 7.402 7.609 -0.207 18497
6920 1 20 . 1 1 45 45 VAL N N 45 118.589 118.589 119.995 -1.406 18497
6921 1 20 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.546 0.114 18497
6922 1 20 . 1 1 45 45 VAL C C 45 179.893 179.893 177.755 2.138 18497
6923 1 20 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.866 -0.466 18497
6924 1 20 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.585 0.546 18497
6925 1 20 . 1 1 45 45 VAL H H 45 8.449 8.449 8.654 -0.205 18497
6926 1 20 . 1 1 46 46 ALA N N 46 121.006 121.006 122.581 -1.575 18497
6927 1 20 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.689 0.441 18497
6928 1 20 . 1 1 46 46 ALA C C 46 179.110 179.110 178.903 0.207 18497
6929 1 20 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.038 -0.068 18497
6930 1 20 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.030 2.080 18497
6931 1 20 . 1 1 46 46 ALA H H 46 7.654 7.654 7.993 -0.339 18497
6932 1 20 . 1 1 47 47 TYR N N 47 119.140 119.140 119.939 -0.799 18497
6933 1 20 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.956 -0.206 18497
6934 1 20 . 1 1 47 47 TYR C C 47 179.328 179.328 177.386 1.942 18497
6935 1 20 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.781 0.099 18497
6936 1 20 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.290 0.210 18497
6937 1 20 . 1 1 47 47 TYR H H 47 8.077 8.077 7.693 0.384 18497
6938 1 20 . 1 1 48 48 HIS N N 48 116.422 116.422 118.797 -2.375 18497
6939 1 20 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.065 0.035 18497
6940 1 20 . 1 1 48 48 HIS C C 48 178.023 178.023 177.733 0.290 18497
6941 1 20 . 1 1 48 48 HIS CA C 48 60.020 60.020 59.705 0.315 18497
6942 1 20 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.916 -0.976 18497
6943 1 20 . 1 1 48 48 HIS H H 48 8.326 8.326 8.488 -0.162 18497
6944 1 20 . 1 1 49 49 LEU N N 49 120.974 120.974 119.841 1.133 18497
6945 1 20 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.075 0.080 18497
6946 1 20 . 1 1 49 49 LEU C C 49 177.417 177.417 179.685 -2.268 18497
6947 1 20 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.017 -0.127 18497
6948 1 20 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.918 0.042 18497
6949 1 20 . 1 1 49 49 LEU H H 49 8.237 8.237 8.411 -0.174 18497
6950 1 20 . 1 1 50 50 ILE N N 50 119.715 119.715 119.871 -0.156 18497
6951 1 20 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.704 -0.084 18497
6952 1 20 . 1 1 50 50 ILE C C 50 179.502 179.502 178.028 1.474 18497
6953 1 20 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.275 -0.214 18497
6954 1 20 . 1 1 50 50 ILE CB C 50 37.970 37.970 38.069 -0.099 18497
6955 1 20 . 1 1 50 50 ILE H H 50 7.543 7.543 8.317 -0.774 18497
6956 1 20 . 1 1 51 51 ILE N N 51 117.995 117.995 122.094 -4.099 18497
6957 1 20 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.453 0.087 18497
6958 1 20 . 1 1 51 51 ILE C C 51 179.197 179.197 177.744 1.453 18497
6959 1 20 . 1 1 51 51 ILE CA C 51 63.740 63.740 64.751 -1.011 18497
6960 1 20 . 1 1 51 51 ILE CB C 51 36.650 36.650 36.315 0.335 18497
6961 1 20 . 1 1 51 51 ILE H H 51 7.475 7.475 8.335 -0.860 18497
6962 1 20 . 1 1 52 52 ASP N N 52 121.642 121.642 119.757 1.885 18497
6963 1 20 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.305 0.135 18497
6964 1 20 . 1 1 52 52 ASP C C 52 179.197 179.197 179.018 0.179 18497
6965 1 20 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.617 -0.517 18497
6966 1 20 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.165 0.135 18497
6967 1 20 . 1 1 52 52 ASP H H 52 8.559 8.559 8.435 0.124 18497
6968 1 20 . 1 1 53 53 ASN N N 53 117.131 117.131 119.340 -2.209 18497
6969 1 20 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.424 0.186 18497
6970 1 20 . 1 1 53 53 ASN C C 53 178.545 178.545 177.408 1.137 18497
6971 1 20 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.186 -1.486 18497
6972 1 20 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.888 -0.188 18497
6973 1 20 . 1 1 53 53 ASN H H 53 8.106 8.106 8.180 -0.074 18497
6974 1 20 . 1 1 54 54 ARG N N 54 119.929 119.929 118.796 1.133 18497
6975 1 20 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.049 0.071 18497
6976 1 20 . 1 1 54 54 ARG C C 54 176.892 176.892 178.899 -2.007 18497
6977 1 20 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.925 -0.765 18497
6978 1 20 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.311 -0.041 18497
6979 1 20 . 1 1 54 54 ARG H H 54 7.797 7.797 8.129 -0.332 18497
6980 1 20 . 1 1 55 55 ARG N N 55 119.227 119.227 116.991 2.236 18497
6981 1 20 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.226 -0.052 18497
6982 1 20 . 1 1 55 55 ARG C C 55 175.108 175.108 177.710 -2.602 18497
6983 1 20 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.183 3.697 18497
6984 1 20 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.966 1.694 18497
6985 1 20 . 1 1 55 55 ARG H H 55 7.857 7.857 8.252 -0.395 18497
6986 1 20 . 1 1 56 56 ILE N N 56 116.676 116.676 117.120 -0.444 18497
6987 1 20 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.198 -0.188 18497
6988 1 20 . 1 1 56 56 ILE C C 56 176.065 176.065 176.849 -0.784 18497
6989 1 20 . 1 1 56 56 ILE CA C 56 62.140 62.140 61.537 0.603 18497
6990 1 20 . 1 1 56 56 ILE CB C 56 38.240 38.240 39.519 -1.279 18497
6991 1 20 . 1 1 56 56 ILE H H 56 8.317 8.317 7.898 0.419 18497
6992 1 20 . 1 1 57 57 MET N N 57 122.058 122.058 115.459 6.599 18497
6993 1 20 . 1 1 57 57 MET HA H 57 4.420 4.420 4.225 0.195 18497
6994 1 20 . 1 1 57 57 MET C C 57 177.283 177.283 174.496 2.787 18497
6995 1 20 . 1 1 57 57 MET CA C 57 56.030 56.030 57.019 -0.989 18497
6996 1 20 . 1 1 57 57 MET CB C 57 32.515 32.515 31.804 0.711 18497
6997 1 20 . 1 1 57 57 MET H H 57 8.177 8.177 8.100 0.077 18497
6998 1 20 . 1 1 58 58 ASN N N 58 118.892 118.892 115.096 3.796 18497
6999 1 20 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.832 -0.142 18497
7000 1 20 . 1 1 58 58 ASN C C 58 176.500 176.500 174.537 1.963 18497
7001 1 20 . 1 1 58 58 ASN CA C 58 53.653 53.653 53.038 0.616 18497
7002 1 20 . 1 1 58 58 ASN CB C 58 38.770 38.770 39.294 -0.524 18497
7003 1 20 . 1 1 58 58 ASN H H 58 8.238 8.238 7.834 0.404 18497
7004 1 20 . 1 1 59 59 GLN N N 59 120.456 120.456 120.217 0.239 18497
7005 1 20 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.172 0.138 18497
7006 1 20 . 1 1 59 59 GLN C C 59 175.326 175.326 175.278 0.048 18497
7007 1 20 . 1 1 59 59 GLN CA C 59 56.030 56.030 57.931 -1.901 18497
7008 1 20 . 1 1 59 59 GLN CB C 59 28.800 28.800 29.235 -0.435 18497
7009 1 20 . 1 1 59 59 GLN H H 59 8.196 8.196 8.525 -0.329 18497
7010 1 20 . 1 1 60 60 ALA N N 60 125.116 125.116 121.448 3.668 18497
7011 1 20 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.704 -0.322 18497
7012 1 20 . 1 1 60 60 ALA CA C 60 52.300 52.300 51.052 1.248 18497
7013 1 20 . 1 1 60 60 ALA CB C 60 19.110 19.110 20.919 -1.810 18497
7014 1 20 . 1 1 60 60 ALA H H 60 8.293 8.293 7.936 0.357 18497
7015 1 20 . 1 1 61 61 SER N N 61 115.686 115.686 115.480 0.206 18497
7016 1 20 . 1 1 61 61 SER HA H 61 4.470 4.470 4.723 -0.253 18497
7017 1 20 . 1 1 61 61 SER C C 61 175.674 175.674 173.860 1.814 18497
7018 1 20 . 1 1 61 61 SER CA C 61 58.160 58.160 58.082 0.078 18497
7019 1 20 . 1 1 61 61 SER CB C 61 63.740 63.740 64.332 -0.592 18497
7020 1 20 . 1 1 61 61 SER H H 61 8.290 8.290 8.613 -0.323 18497
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 58 2.245 -0.323 2.241 18497
2 1 1 "Average Difference" HA 61 0.208 0.006 0.210 18497
3 1 1 "Average Difference" C 57 1.824 -0.271 1.820 18497
4 1 1 "Average Difference" CA 60 1.093 0.175 1.088 18497
5 1 1 "Average Difference" CB 59 1.180 0.380 1.127 18497
6 1 1 "Average Difference" HN 58 0.422 0.055 0.422 18497
7 1 2 "Average Difference" N 58 2.205 0.112 2.222 18497
8 1 2 "Average Difference" HA 61 0.224 -0.010 0.226 18497
9 1 2 "Average Difference" C 57 1.739 -0.278 1.732 18497
10 1 2 "Average Difference" CA 60 1.115 0.139 1.115 18497
11 1 2 "Average Difference" CB 59 0.988 0.242 0.966 18497
12 1 2 "Average Difference" HN 58 0.387 0.047 0.388 18497
13 1 3 "Average Difference" N 58 2.578 0.090 2.599 18497
14 1 3 "Average Difference" HA 61 0.190 0.009 0.191 18497
15 1 3 "Average Difference" C 57 1.671 -0.287 1.661 18497
16 1 3 "Average Difference" CA 60 1.077 0.189 1.069 18497
17 1 3 "Average Difference" CB 59 1.014 0.225 0.997 18497
18 1 3 "Average Difference" HN 58 0.396 0.035 0.397 18497
19 1 4 "Average Difference" N 58 2.061 -0.507 2.015 18497
20 1 4 "Average Difference" HA 61 0.253 0.030 0.253 18497
21 1 4 "Average Difference" C 57 1.799 -0.388 1.772 18497
22 1 4 "Average Difference" CA 60 1.168 0.078 1.176 18497
23 1 4 "Average Difference" CB 59 1.134 0.320 1.098 18497
24 1 4 "Average Difference" HN 58 0.400 0.020 0.403 18497
25 1 5 "Average Difference" N 58 2.375 -0.133 2.392 18497
26 1 5 "Average Difference" HA 61 0.203 0.027 0.203 18497
27 1 5 "Average Difference" C 57 1.799 -0.179 1.806 18497
28 1 5 "Average Difference" CA 60 1.158 0.072 1.166 18497
29 1 5 "Average Difference" CB 59 0.876 0.072 0.881 18497
30 1 5 "Average Difference" HN 58 0.452 0.054 0.453 18497
31 1 6 "Average Difference" N 58 2.081 0.318 2.075 18497
32 1 6 "Average Difference" HA 61 0.191 0.006 0.193 18497
33 1 6 "Average Difference" C 57 1.601 -0.197 1.603 18497
34 1 6 "Average Difference" CA 60 1.025 0.045 1.033 18497
35 1 6 "Average Difference" CB 59 0.827 0.178 0.815 18497
36 1 6 "Average Difference" HN 58 0.418 0.038 0.420 18497
37 1 7 "Average Difference" N 58 2.017 -0.162 2.028 18497
38 1 7 "Average Difference" HA 61 0.212 0.001 0.214 18497
39 1 7 "Average Difference" C 57 1.714 -0.235 1.713 18497
40 1 7 "Average Difference" CA 60 1.144 0.178 1.140 18497
41 1 7 "Average Difference" CB 59 0.976 0.212 0.961 18497
42 1 7 "Average Difference" HN 58 0.458 -0.015 0.462 18497
43 1 8 "Average Difference" N 58 2.505 -0.387 2.497 18497
44 1 8 "Average Difference" HA 61 0.195 0.038 0.193 18497
45 1 8 "Average Difference" C 57 1.876 -0.471 1.833 18497
46 1 8 "Average Difference" CA 60 1.184 -0.109 1.189 18497
47 1 8 "Average Difference" CB 59 1.108 0.374 1.052 18497
48 1 8 "Average Difference" HN 58 0.449 -0.001 0.453 18497
49 1 9 "Average Difference" N 58 2.280 -0.171 2.294 18497
50 1 9 "Average Difference" HA 61 0.210 0.012 0.212 18497
51 1 9 "Average Difference" C 57 1.697 -0.250 1.693 18497
52 1 9 "Average Difference" CA 60 1.229 0.180 1.226 18497
53 1 9 "Average Difference" CB 59 1.087 0.216 1.075 18497
54 1 9 "Average Difference" HN 58 0.370 0.062 0.368 18497
55 1 10 "Average Difference" N 58 2.478 -0.131 2.496 18497
56 1 10 "Average Difference" HA 61 0.232 -0.007 0.234 18497
57 1 10 "Average Difference" C 57 1.742 -0.356 1.721 18497
58 1 10 "Average Difference" CA 60 1.212 0.126 1.216 18497
59 1 10 "Average Difference" CB 59 1.196 0.352 1.152 18497
60 1 10 "Average Difference" HN 58 0.389 0.036 0.390 18497
61 1 11 "Average Difference" N 58 1.981 0.076 1.997 18497
62 1 11 "Average Difference" HA 61 0.214 -0.019 0.215 18497
63 1 11 "Average Difference" C 57 1.672 -0.061 1.686 18497
64 1 11 "Average Difference" CA 60 1.136 0.220 1.124 18497
65 1 11 "Average Difference" CB 59 1.037 0.167 1.033 18497
66 1 11 "Average Difference" HN 58 0.364 0.049 0.363 18497
67 1 12 "Average Difference" N 58 2.166 -0.005 2.185 18497
68 1 12 "Average Difference" HA 61 0.214 0.017 0.216 18497
69 1 12 "Average Difference" C 57 1.680 -0.219 1.680 18497
70 1 12 "Average Difference" CA 60 1.202 0.162 1.201 18497
71 1 12 "Average Difference" CB 59 1.131 0.284 1.104 18497
72 1 12 "Average Difference" HN 58 0.365 0.010 0.368 18497
73 1 13 "Average Difference" N 58 2.067 0.040 2.084 18497
74 1 13 "Average Difference" HA 61 0.215 -0.020 0.216 18497
75 1 13 "Average Difference" C 57 1.721 -0.175 1.727 18497
76 1 13 "Average Difference" CA 60 1.267 0.280 1.246 18497
77 1 13 "Average Difference" CB 59 1.109 0.125 1.111 18497
78 1 13 "Average Difference" HN 58 0.398 0.070 0.395 18497
79 1 14 "Average Difference" N 58 2.176 -0.258 2.179 18497
80 1 14 "Average Difference" HA 61 0.217 0.036 0.215 18497
81 1 14 "Average Difference" C 57 1.685 -0.367 1.659 18497
82 1 14 "Average Difference" CA 60 1.095 0.057 1.103 18497
83 1 14 "Average Difference" CB 59 0.982 0.328 0.933 18497
84 1 14 "Average Difference" HN 58 0.396 0.067 0.394 18497
85 1 15 "Average Difference" N 58 2.368 0.086 2.387 18497
86 1 15 "Average Difference" HA 61 0.216 0.043 0.214 18497
87 1 15 "Average Difference" C 57 1.717 -0.360 1.694 18497
88 1 15 "Average Difference" CA 60 1.148 0.069 1.155 18497
89 1 15 "Average Difference" CB 59 1.171 0.355 1.125 18497
90 1 15 "Average Difference" HN 58 0.442 0.062 0.442 18497
91 1 16 "Average Difference" N 58 2.161 0.214 2.169 18497
92 1 16 "Average Difference" HA 61 0.210 -0.007 0.212 18497
93 1 16 "Average Difference" C 57 1.640 -0.317 1.623 18497
94 1 16 "Average Difference" CA 60 1.174 0.120 1.177 18497
95 1 16 "Average Difference" CB 59 0.930 0.213 0.913 18497
96 1 16 "Average Difference" HN 58 0.415 0.016 0.419 18497
97 1 17 "Average Difference" N 58 2.130 0.009 2.148 18497
98 1 17 "Average Difference" HA 61 0.237 0.001 0.239 18497
99 1 17 "Average Difference" C 57 1.748 -0.391 1.719 18497
100 1 17 "Average Difference" CA 60 1.176 0.189 1.171 18497
101 1 17 "Average Difference" CB 59 1.213 0.173 1.210 18497
102 1 17 "Average Difference" HN 58 0.425 0.047 0.426 18497
103 1 18 "Average Difference" N 58 2.350 0.014 2.371 18497
104 1 18 "Average Difference" HA 61 0.231 0.035 0.230 18497
105 1 18 "Average Difference" C 57 1.759 -0.384 1.732 18497
106 1 18 "Average Difference" CA 60 1.087 0.111 1.090 18497
107 1 18 "Average Difference" CB 59 1.109 0.266 1.086 18497
108 1 18 "Average Difference" HN 58 0.372 0.081 0.366 18497
109 1 19 "Average Difference" N 58 2.640 0.089 2.662 18497
110 1 19 "Average Difference" HA 61 0.218 -0.008 0.220 18497
111 1 19 "Average Difference" C 57 1.695 -0.245 1.692 18497
112 1 19 "Average Difference" CA 60 1.201 0.217 1.191 18497
113 1 19 "Average Difference" CB 59 1.046 0.174 1.040 18497
114 1 19 "Average Difference" HN 58 0.446 0.010 0.450 18497
115 1 20 "Average Difference" N 58 2.212 -0.506 2.172 18497
116 1 20 "Average Difference" HA 61 0.240 0.042 0.239 18497
117 1 20 "Average Difference" C 57 1.673 -0.411 1.637 18497
118 1 20 "Average Difference" CA 60 1.004 -0.070 1.010 18497
119 1 20 "Average Difference" CB 59 1.030 0.323 0.987 18497
120 1 20 "Average Difference" HN 58 0.407 0.028 0.410 18497
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 18497
_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 PRO HA H 2 4.430 4.430 4.609 -0.179 18497
2 1 . 1 1 2 2 PRO CA C 2 62.947 62.947 62.858 0.089 18497
3 1 . 1 1 2 2 PRO CB C 2 32.130 32.130 32.653 -0.523 18497
4 1 . 1 1 3 3 HIS N N 3 119.985 119.985 118.489 1.496 18497
5 1 . 1 1 3 3 HIS HA H 3 4.606 4.606 4.589 0.017 18497
6 1 . 1 1 3 3 HIS C C 3 176.587 176.587 175.294 1.293 18497
7 1 . 1 1 3 3 HIS CA C 3 56.185 56.185 56.295 -0.110 18497
8 1 . 1 1 3 3 HIS CB C 3 30.471 30.471 30.337 0.134 18497
9 1 . 1 1 3 3 HIS H H 3 8.526 8.526 8.347 0.179 18497
10 1 . 1 1 4 4 MET N N 4 122.338 122.338 119.571 2.767 18497
11 1 . 1 1 4 4 MET HA H 4 4.448 4.448 4.458 -0.010 18497
12 1 . 1 1 4 4 MET C C 4 175.108 175.108 176.386 -1.278 18497
13 1 . 1 1 4 4 MET CA C 4 55.562 55.562 55.845 -0.283 18497
14 1 . 1 1 4 4 MET CB C 4 33.141 33.141 33.175 -0.034 18497
15 1 . 1 1 4 4 MET H H 4 8.337 8.337 8.127 0.210 18497
16 1 . 1 1 5 5 SER N N 5 116.990 116.990 116.556 0.434 18497
17 1 . 1 1 5 5 SER HA H 5 4.400 4.400 4.432 -0.032 18497
18 1 . 1 1 5 5 SER C C 5 177.979 177.979 174.263 3.716 18497
19 1 . 1 1 5 5 SER CA C 5 58.039 58.039 58.989 -0.950 18497
20 1 . 1 1 5 5 SER CB C 5 63.797 63.797 63.514 0.283 18497
21 1 . 1 1 5 5 SER H H 5 8.330 8.330 8.368 -0.038 18497
22 1 . 1 1 6 6 TYR N N 6 122.027 122.027 121.209 0.818 18497
23 1 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.577 -0.067 18497
24 1 . 1 1 6 6 TYR C C 6 174.060 174.060 175.319 -1.259 18497
25 1 . 1 1 6 6 TYR CA C 6 57.800 57.800 58.621 -0.821 18497
26 1 . 1 1 6 6 TYR CB C 6 38.685 38.685 39.474 -0.789 18497
27 1 . 1 1 6 6 TYR H H 6 8.201 8.201 7.951 0.250 18497
28 1 . 1 1 7 7 ASP N N 7 122.439 122.439 120.511 1.928 18497
29 1 . 1 1 7 7 ASP HA H 7 4.549 4.549 4.524 0.025 18497
30 1 . 1 1 7 7 ASP C C 7 175.150 175.150 176.151 -1.001 18497
31 1 . 1 1 7 7 ASP CA C 7 53.640 53.640 54.722 -1.082 18497
32 1 . 1 1 7 7 ASP CB C 7 41.300 41.300 41.870 -0.570 18497
33 1 . 1 1 7 7 ASP H H 7 8.119 8.119 8.132 -0.013 18497
34 1 . 1 1 8 8 ALA N N 8 124.655 124.655 123.686 0.969 18497
35 1 . 1 1 8 8 ALA HA H 8 4.230 4.230 4.094 0.136 18497
36 1 . 1 1 8 8 ALA C C 8 175.935 175.935 178.356 -2.421 18497
37 1 . 1 1 8 8 ALA CA C 8 52.893 52.893 53.994 -1.101 18497
38 1 . 1 1 8 8 ALA CB C 8 18.850 18.850 19.099 -0.249 18497
39 1 . 1 1 8 8 ALA H H 8 8.235 8.235 8.219 0.016 18497
40 1 . 1 1 9 9 ASN N N 9 116.133 116.133 116.311 -0.178 18497
41 1 . 1 1 9 9 ASN HA H 9 4.690 4.690 4.629 0.061 18497
42 1 . 1 1 9 9 ASN C C 9 177.718 177.718 175.911 1.807 18497
43 1 . 1 1 9 9 ASN CA C 9 53.800 53.800 54.310 -0.510 18497
44 1 . 1 1 9 9 ASN CB C 9 38.770 38.770 39.569 -0.799 18497
45 1 . 1 1 9 9 ASN H H 9 8.417 8.417 8.026 0.391 18497
46 1 . 1 1 10 10 VAL N N 10 119.557 119.557 118.991 0.566 18497
47 1 . 1 1 10 10 VAL HA H 10 4.177 4.177 3.959 0.218 18497
48 1 . 1 1 10 10 VAL C C 10 174.930 174.930 174.951 -0.021 18497
49 1 . 1 1 10 10 VAL CA C 10 61.880 61.880 63.101 -1.221 18497
50 1 . 1 1 10 10 VAL CB C 10 32.660 32.660 31.730 0.930 18497
51 1 . 1 1 10 10 VAL H H 10 7.859 7.859 8.037 -0.178 18497
52 1 . 1 1 11 11 ILE N N 11 126.561 126.561 125.425 1.136 18497
53 1 . 1 1 11 11 ILE HA H 11 4.040 4.040 4.350 -0.310 18497
54 1 . 1 1 11 11 ILE C C 11 175.935 175.935 174.870 1.065 18497
55 1 . 1 1 11 11 ILE CA C 11 59.500 59.500 60.238 -0.738 18497
56 1 . 1 1 11 11 ILE CB C 11 37.700 37.700 41.065 -3.365 18497
57 1 . 1 1 11 11 ILE H H 11 8.283 8.283 8.012 0.271 18497
58 1 . 1 1 12 12 ASP N N 12 128.161 128.161 126.233 1.928 18497
59 1 . 1 1 12 12 ASP HA H 12 4.730 4.730 4.880 -0.150 18497
60 1 . 1 1 12 12 ASP C C 12 174.891 174.891 176.207 -1.316 18497
61 1 . 1 1 12 12 ASP CA C 12 53.427 53.427 53.855 -0.428 18497
62 1 . 1 1 12 12 ASP CB C 12 42.220 42.220 41.944 0.276 18497
63 1 . 1 1 12 12 ASP H H 12 8.477 8.477 8.536 -0.059 18497
64 1 . 1 1 13 13 ASP N N 13 127.435 127.435 126.514 0.921 18497
65 1 . 1 1 13 13 ASP HA H 13 4.316 4.316 4.314 0.002 18497
66 1 . 1 1 13 13 ASP C C 13 175.369 175.369 177.577 -2.208 18497
67 1 . 1 1 13 13 ASP CA C 13 57.600 57.600 57.315 0.285 18497
68 1 . 1 1 13 13 ASP CB C 13 41.160 41.160 41.169 -0.008 18497
69 1 . 1 1 13 13 ASP H H 13 8.698 8.698 8.867 -0.169 18497
70 1 . 1 1 14 14 GLU N N 14 119.796 119.796 119.692 0.104 18497
71 1 . 1 1 14 14 GLU HA H 14 4.035 4.035 4.054 -0.019 18497
72 1 . 1 1 14 14 GLU C C 14 178.588 178.588 178.265 0.323 18497
73 1 . 1 1 14 14 GLU CA C 14 59.500 59.500 59.274 0.226 18497
74 1 . 1 1 14 14 GLU CB C 14 28.900 28.900 29.452 -0.552 18497
75 1 . 1 1 14 14 GLU H H 14 8.205 8.205 8.660 -0.455 18497
76 1 . 1 1 15 15 ALA N N 15 124.156 124.156 122.983 1.173 18497
77 1 . 1 1 15 15 ALA HA H 15 4.176 4.176 4.078 0.098 18497
78 1 . 1 1 15 15 ALA C C 15 179.502 179.502 179.605 -0.103 18497
79 1 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.002 -0.002 18497
80 1 . 1 1 15 15 ALA CB C 15 18.900 18.900 18.197 0.703 18497
81 1 . 1 1 15 15 ALA H H 15 8.473 8.473 7.764 0.709 18497
82 1 . 1 1 16 16 VAL N N 16 117.585 117.585 118.928 -1.343 18497
83 1 . 1 1 16 16 VAL HA H 16 3.534 3.534 3.615 -0.081 18497
84 1 . 1 1 16 16 VAL C C 16 179.545 179.545 178.055 1.490 18497
85 1 . 1 1 16 16 VAL CA C 16 68.000 68.000 67.211 0.789 18497
86 1 . 1 1 16 16 VAL CB C 16 31.600 31.600 31.212 0.388 18497
87 1 . 1 1 16 16 VAL H H 16 8.181 8.181 8.585 -0.404 18497
88 1 . 1 1 17 17 LYS N N 17 119.377 119.377 119.738 -0.361 18497
89 1 . 1 1 17 17 LYS HA H 17 3.956 3.956 3.969 -0.013 18497
90 1 . 1 1 17 17 LYS C C 17 178.197 178.197 178.790 -0.593 18497
91 1 . 1 1 17 17 LYS CA C 17 60.020 60.020 59.655 0.365 18497
92 1 . 1 1 17 17 LYS CB C 17 32.130 32.130 32.222 -0.092 18497
93 1 . 1 1 17 17 LYS H H 17 8.001 8.001 8.117 -0.116 18497
94 1 . 1 1 18 18 GLU N N 18 120.395 120.395 119.652 0.743 18497
95 1 . 1 1 18 18 GLU HA H 18 4.140 4.140 4.096 0.045 18497
96 1 . 1 1 18 18 GLU C C 18 178.849 178.849 178.972 -0.123 18497
97 1 . 1 1 18 18 GLU CA C 18 59.800 59.800 59.284 0.516 18497
98 1 . 1 1 18 18 GLU CB C 18 29.493 29.493 29.694 -0.201 18497
99 1 . 1 1 18 18 GLU H H 18 7.943 7.943 8.062 -0.119 18497
100 1 . 1 1 19 19 VAL N N 19 121.088 121.088 120.095 0.993 18497
101 1 . 1 1 19 19 VAL HA H 19 3.650 3.650 3.751 -0.101 18497
102 1 . 1 1 19 19 VAL C C 19 179.415 179.415 178.196 1.219 18497
103 1 . 1 1 19 19 VAL CA C 19 67.980 67.980 66.600 1.380 18497
104 1 . 1 1 19 19 VAL CB C 19 31.600 31.600 31.356 0.244 18497
105 1 . 1 1 19 19 VAL H H 19 8.335 8.335 8.686 -0.351 18497
106 1 . 1 1 20 20 CYS N N 20 117.290 117.290 118.642 -1.352 18497
107 1 . 1 1 20 20 CYS HA H 20 4.680 4.680 4.270 0.410 18497
108 1 . 1 1 20 20 CYS C C 20 178.110 178.110 176.527 1.583 18497
109 1 . 1 1 20 20 CYS CA C 20 63.200 63.200 62.873 0.327 18497
110 1 . 1 1 20 20 CYS CB C 20 26.800 26.800 27.160 -0.360 18497
111 1 . 1 1 20 20 CYS H H 20 8.434 8.434 8.095 0.339 18497
112 1 . 1 1 21 21 GLU N N 21 118.195 118.195 119.113 -0.918 18497
113 1 . 1 1 21 21 GLU HA H 21 4.139 4.139 4.183 -0.044 18497
114 1 . 1 1 21 21 GLU C C 21 178.153 178.153 178.466 -0.313 18497
115 1 . 1 1 21 21 GLU CA C 21 59.750 59.750 58.620 1.130 18497
116 1 . 1 1 21 21 GLU CB C 21 29.500 29.500 29.573 -0.073 18497
117 1 . 1 1 21 21 GLU H H 21 7.972 7.972 7.842 0.130 18497
118 1 . 1 1 22 22 LYS N N 22 119.095 119.095 118.862 0.233 18497
119 1 . 1 1 22 22 LYS HA H 22 4.005 4.005 4.187 -0.182 18497
120 1 . 1 1 22 22 LYS C C 22 179.371 179.371 178.138 1.233 18497
121 1 . 1 1 22 22 LYS CA C 22 58.700 58.700 58.444 0.256 18497
122 1 . 1 1 22 22 LYS CB C 22 32.920 32.920 32.813 0.107 18497
123 1 . 1 1 22 22 LYS H H 22 8.071 8.071 8.284 -0.213 18497
124 1 . 1 1 23 23 PHE N N 23 114.252 114.252 117.713 -3.461 18497
125 1 . 1 1 23 23 PHE HA H 23 4.430 4.430 4.549 -0.119 18497
126 1 . 1 1 23 23 PHE C C 23 178.197 178.197 174.679 3.518 18497
127 1 . 1 1 23 23 PHE CA C 23 58.430 58.430 58.194 0.236 18497
128 1 . 1 1 23 23 PHE CB C 23 38.770 38.770 40.148 -1.378 18497
129 1 . 1 1 23 23 PHE H H 23 8.491 8.491 7.989 0.502 18497
130 1 . 1 1 24 24 GLU N N 24 119.819 119.819 116.219 3.600 18497
131 1 . 1 1 24 24 GLU HA H 24 4.070 4.070 4.054 0.016 18497
132 1 . 1 1 24 24 GLU C C 24 177.457 177.457 175.610 1.847 18497
133 1 . 1 1 24 24 GLU CA C 24 56.830 56.830 57.238 -0.408 18497
134 1 . 1 1 24 24 GLU CB C 24 26.800 26.800 27.134 -0.334 18497
135 1 . 1 1 24 24 GLU H H 24 7.867 7.867 8.284 -0.417 18497
136 1 . 1 1 25 25 CYS N N 25 114.633 114.633 117.457 -2.824 18497
137 1 . 1 1 25 25 CYS HA H 25 5.387 5.387 4.877 0.510 18497
138 1 . 1 1 25 25 CYS C C 25 174.760 174.760 174.259 0.501 18497
139 1 . 1 1 25 25 CYS CA C 25 54.761 54.761 56.971 -2.210 18497
140 1 . 1 1 25 25 CYS CB C 25 31.600 31.600 30.630 0.970 18497
141 1 . 1 1 25 25 CYS H H 25 8.156 8.156 8.026 0.130 18497
142 1 . 1 1 26 26 THR N N 26 109.312 109.312 113.192 -3.880 18497
143 1 . 1 1 26 26 THR HA H 26 4.770 4.770 4.578 0.192 18497
144 1 . 1 1 26 26 THR C C 26 173.499 173.499 175.404 -1.905 18497
145 1 . 1 1 26 26 THR CA C 26 60.723 60.723 61.421 -0.698 18497
146 1 . 1 1 26 26 THR CB C 26 72.000 72.000 70.880 1.120 18497
147 1 . 1 1 26 26 THR H H 26 8.460 8.460 8.478 -0.018 18497
148 1 . 1 1 27 27 GLU N N 27 122.233 122.233 124.149 -1.916 18497
149 1 . 1 1 27 27 GLU HA H 27 3.510 3.510 3.920 -0.410 18497
150 1 . 1 1 27 27 GLU C C 27 176.544 176.544 178.199 -1.655 18497
151 1 . 1 1 27 27 GLU CA C 27 60.550 60.550 60.499 0.051 18497
152 1 . 1 1 27 27 GLU CB C 27 28.950 28.950 29.261 -0.311 18497
153 1 . 1 1 27 27 GLU H H 27 9.327 9.327 9.008 0.319 18497
154 1 . 1 1 28 28 SER N N 28 112.925 112.925 114.830 -1.905 18497
155 1 . 1 1 28 28 SER HA H 28 4.062 4.062 4.178 -0.116 18497
156 1 . 1 1 28 28 SER C C 28 178.545 178.545 176.464 2.081 18497
157 1 . 1 1 28 28 SER CA C 28 61.350 61.350 61.248 0.101 18497
158 1 . 1 1 28 28 SER CB C 28 62.400 62.400 62.635 -0.235 18497
159 1 . 1 1 28 28 SER H H 28 8.320 8.320 8.473 -0.153 18497
160 1 . 1 1 29 29 GLU N N 29 121.736 121.736 121.852 -0.116 18497
161 1 . 1 1 29 29 GLU HA H 29 3.990 3.990 4.162 -0.172 18497
162 1 . 1 1 29 29 GLU C C 29 176.674 176.674 178.646 -1.972 18497
163 1 . 1 1 29 29 GLU CA C 29 59.750 59.750 58.758 0.992 18497
164 1 . 1 1 29 29 GLU CB C 29 29.470 29.470 29.560 -0.090 18497
165 1 . 1 1 29 29 GLU H H 29 7.512 7.512 7.621 -0.109 18497
166 1 . 1 1 30 30 VAL N N 30 119.480 119.480 120.494 -1.014 18497
167 1 . 1 1 30 30 VAL HA H 30 3.377 3.377 3.585 -0.208 18497
168 1 . 1 1 30 30 VAL C C 30 179.241 179.241 178.015 1.226 18497
169 1 . 1 1 30 30 VAL CA C 30 66.660 66.660 66.433 0.227 18497
170 1 . 1 1 30 30 VAL CB C 30 31.070 31.070 31.558 -0.488 18497
171 1 . 1 1 30 30 VAL H H 30 7.492 7.492 8.033 -0.541 18497
172 1 . 1 1 31 31 MET N N 31 117.220 117.220 117.605 -0.385 18497
173 1 . 1 1 31 31 MET HA H 31 3.870 3.870 3.820 0.050 18497
174 1 . 1 1 31 31 MET C C 31 177.936 177.936 178.141 -0.205 18497
175 1 . 1 1 31 31 MET CA C 31 57.630 57.630 58.843 -1.213 18497
176 1 . 1 1 31 31 MET CB C 31 30.270 30.270 31.957 -1.687 18497
177 1 . 1 1 31 31 MET H H 31 8.302 8.302 8.356 -0.054 18497
178 1 . 1 1 32 32 ASN N N 32 116.672 116.672 118.730 -2.058 18497
179 1 . 1 1 32 32 ASN HA H 32 4.390 4.390 4.414 -0.024 18497
180 1 . 1 1 32 32 ASN C C 32 176.065 176.065 177.650 -1.585 18497
181 1 . 1 1 32 32 ASN CA C 32 56.030 56.030 56.680 -0.650 18497
182 1 . 1 1 32 32 ASN CB C 32 37.710 37.710 38.472 -0.763 18497
183 1 . 1 1 32 32 ASN H H 32 8.313 8.313 8.181 0.132 18497
184 1 . 1 1 33 33 SER N N 33 117.471 117.471 115.020 2.451 18497
185 1 . 1 1 33 33 SER HA H 33 4.150 4.150 4.229 -0.079 18497
186 1 . 1 1 33 33 SER C C 33 178.806 178.806 175.788 3.018 18497
187 1 . 1 1 33 33 SER CA C 33 62.950 62.950 61.097 1.853 18497
188 1 . 1 1 33 33 SER CB C 33 62.600 62.600 63.221 -0.621 18497
189 1 . 1 1 33 33 SER H H 33 7.851 7.851 7.796 0.055 18497
190 1 . 1 1 34 34 LEU N N 34 122.839 122.839 119.978 2.861 18497
191 1 . 1 1 34 34 LEU HA H 34 3.879 3.879 4.164 -0.285 18497
192 1 . 1 1 34 34 LEU C C 34 177.892 177.892 177.734 0.158 18497
193 1 . 1 1 34 34 LEU CA C 34 57.630 57.630 56.391 1.239 18497
194 1 . 1 1 34 34 LEU CB C 34 40.800 40.800 42.211 -1.411 18497
195 1 . 1 1 34 34 LEU H H 34 8.128 8.128 7.316 0.812 18497
196 1 . 1 1 35 35 TYR N N 35 116.666 116.666 118.584 -1.918 18497
197 1 . 1 1 35 35 TYR HA H 35 4.610 4.610 4.425 0.185 18497
198 1 . 1 1 35 35 TYR C C 35 179.067 179.067 176.698 2.369 18497
199 1 . 1 1 35 35 TYR CA C 35 57.890 57.890 59.833 -1.943 18497
200 1 . 1 1 35 35 TYR CB C 35 37.710 37.710 40.244 -2.534 18497
201 1 . 1 1 35 35 TYR H H 35 7.924 7.924 8.012 -0.088 18497
202 1 . 1 1 36 36 SER N N 36 114.801 114.801 112.934 1.867 18497
203 1 . 1 1 36 36 SER HA H 36 4.080 4.080 4.407 -0.327 18497
204 1 . 1 1 36 36 SER C C 36 177.283 177.283 175.301 1.982 18497
205 1 . 1 1 36 36 SER CA C 36 60.519 60.519 58.966 1.553 18497
206 1 . 1 1 36 36 SER CB C 36 64.240 64.240 65.040 -0.800 18497
207 1 . 1 1 36 36 SER H H 36 7.715 7.715 8.502 -0.787 18497
208 1 . 1 1 37 37 GLY N N 37 109.803 109.803 110.694 -0.891 18497
209 1 . 1 1 37 37 GLY C C 37 175.978 175.978 173.092 2.886 18497
210 1 . 1 1 37 37 GLY CA C 37 45.678 45.678 44.978 0.700 18497
211 1 . 1 1 37 37 GLY H H 37 8.017 8.017 7.820 0.197 18497
212 1 . 1 1 38 38 ASP N N 38 120.613 120.613 119.799 0.814 18497
213 1 . 1 1 38 38 ASP HA H 38 5.025 5.025 4.985 0.040 18497
214 1 . 1 1 38 38 ASP C C 38 173.368 173.368 175.241 -1.873 18497
215 1 . 1 1 38 38 ASP CA C 38 50.720 50.720 51.527 -0.807 18497
216 1 . 1 1 38 38 ASP CB C 38 41.420 41.420 42.566 -1.146 18497
217 1 . 1 1 38 38 ASP H H 38 8.006 8.006 8.029 -0.023 18497
218 1 . 1 1 39 39 PRO HA H 39 4.340 4.340 4.373 -0.033 18497
219 1 . 1 1 39 39 PRO CA C 39 63.750 63.750 64.165 -0.414 18497
220 1 . 1 1 39 39 PRO CB C 39 32.130 32.130 32.090 0.041 18497
221 1 . 1 1 40 40 GLN N N 40 115.056 115.056 115.398 -0.341 18497
222 1 . 1 1 40 40 GLN HA H 40 4.280 4.280 4.271 0.009 18497
223 1 . 1 1 40 40 GLN C C 40 177.066 177.066 176.156 0.910 18497
224 1 . 1 1 40 40 GLN CA C 40 54.710 54.710 55.549 -0.839 18497
225 1 . 1 1 40 40 GLN CB C 40 28.680 28.680 28.913 -0.233 18497
226 1 . 1 1 40 40 GLN H H 40 8.237 8.237 8.125 0.112 18497
227 1 . 1 1 41 41 ASP N N 41 122.839 122.839 121.457 1.382 18497
228 1 . 1 1 41 41 ASP HA H 41 4.313 4.313 4.549 -0.236 18497
229 1 . 1 1 41 41 ASP C C 41 175.804 175.804 177.429 -1.625 18497
230 1 . 1 1 41 41 ASP CA C 41 55.240 55.240 54.458 0.782 18497
231 1 . 1 1 41 41 ASP CB C 41 42.220 42.220 42.626 -0.406 18497
232 1 . 1 1 41 41 ASP H H 41 7.211 7.211 7.687 -0.476 18497
233 1 . 1 1 42 42 GLN N N 42 124.547 124.547 123.663 0.884 18497
234 1 . 1 1 42 42 GLN HA H 42 3.860 3.860 4.037 -0.177 18497
235 1 . 1 1 42 42 GLN C C 42 177.196 177.196 177.580 -0.384 18497
236 1 . 1 1 42 42 GLN CA C 42 59.220 59.220 59.207 0.013 18497
237 1 . 1 1 42 42 GLN CB C 42 28.400 28.400 28.812 -0.412 18497
238 1 . 1 1 42 42 GLN H H 42 8.719 8.719 8.808 -0.089 18497
239 1 . 1 1 43 43 LEU N N 43 118.960 118.960 119.020 -0.060 18497
240 1 . 1 1 43 43 LEU HA H 43 3.685 3.685 3.885 -0.200 18497
241 1 . 1 1 43 43 LEU C C 43 178.066 178.066 178.551 -0.485 18497
242 1 . 1 1 43 43 LEU CA C 43 57.360 57.360 56.916 0.444 18497
243 1 . 1 1 43 43 LEU CB C 43 40.390 40.390 41.438 -1.048 18497
244 1 . 1 1 43 43 LEU H H 43 8.206 8.206 8.322 -0.116 18497
245 1 . 1 1 44 44 ALA N N 44 121.666 121.666 122.817 -1.151 18497
246 1 . 1 1 44 44 ALA HA H 44 3.879 3.879 4.083 -0.204 18497
247 1 . 1 1 44 44 ALA C C 44 178.327 178.327 179.656 -1.329 18497
248 1 . 1 1 44 44 ALA CA C 44 54.710 54.710 54.890 -0.180 18497
249 1 . 1 1 44 44 ALA CB C 44 18.580 18.580 18.224 0.356 18497
250 1 . 1 1 44 44 ALA H H 44 7.402 7.402 7.623 -0.221 18497
251 1 . 1 1 45 45 VAL N N 45 118.589 118.589 120.215 -1.626 18497
252 1 . 1 1 45 45 VAL HA H 45 3.660 3.660 3.613 0.047 18497
253 1 . 1 1 45 45 VAL C C 45 179.893 179.893 177.818 2.075 18497
254 1 . 1 1 45 45 VAL CA C 45 66.400 66.400 66.797 -0.397 18497
255 1 . 1 1 45 45 VAL CB C 45 32.131 32.131 31.379 0.752 18497
256 1 . 1 1 45 45 VAL H H 45 8.449 8.449 8.564 -0.115 18497
257 1 . 1 1 46 46 ALA N N 46 121.006 121.006 122.526 -1.520 18497
258 1 . 1 1 46 46 ALA HA H 46 4.130 4.130 3.770 0.360 18497
259 1 . 1 1 46 46 ALA C C 46 179.110 179.110 179.043 0.067 18497
260 1 . 1 1 46 46 ALA CA C 46 54.970 54.970 55.082 -0.112 18497
261 1 . 1 1 46 46 ALA CB C 46 19.110 19.110 17.254 1.856 18497
262 1 . 1 1 46 46 ALA H H 46 7.654 7.654 7.966 -0.312 18497
263 1 . 1 1 47 47 TYR N N 47 119.140 119.140 119.892 -0.752 18497
264 1 . 1 1 47 47 TYR HA H 47 3.750 3.750 3.960 -0.210 18497
265 1 . 1 1 47 47 TYR C C 47 179.328 179.328 177.487 1.841 18497
266 1 . 1 1 47 47 TYR CA C 47 61.880 61.880 61.853 0.027 18497
267 1 . 1 1 47 47 TYR CB C 47 38.500 38.500 38.283 0.217 18497
268 1 . 1 1 47 47 TYR H H 47 8.077 8.077 7.955 0.122 18497
269 1 . 1 1 48 48 HIS N N 48 116.422 116.422 118.711 -2.289 18497
270 1 . 1 1 48 48 HIS HA H 48 4.100 4.100 4.077 0.023 18497
271 1 . 1 1 48 48 HIS C C 48 178.023 178.023 177.653 0.370 18497
272 1 . 1 1 48 48 HIS CA C 48 60.020 60.020 60.181 -0.161 18497
273 1 . 1 1 48 48 HIS CB C 48 28.940 28.940 29.981 -1.041 18497
274 1 . 1 1 48 48 HIS H H 48 8.326 8.326 8.432 -0.106 18497
275 1 . 1 1 49 49 LEU N N 49 120.974 120.974 120.242 0.732 18497
276 1 . 1 1 49 49 LEU HA H 49 4.155 4.155 4.082 0.073 18497
277 1 . 1 1 49 49 LEU C C 49 177.417 177.417 179.388 -1.971 18497
278 1 . 1 1 49 49 LEU CA C 49 57.890 57.890 58.026 -0.136 18497
279 1 . 1 1 49 49 LEU CB C 49 41.960 41.960 41.670 0.290 18497
280 1 . 1 1 49 49 LEU H H 49 8.237 8.237 8.443 -0.206 18497
281 1 . 1 1 50 50 ILE N N 50 119.715 119.715 119.771 -0.056 18497
282 1 . 1 1 50 50 ILE HA H 50 3.620 3.620 3.637 -0.017 18497
283 1 . 1 1 50 50 ILE C C 50 179.502 179.502 177.943 1.559 18497
284 1 . 1 1 50 50 ILE CA C 50 65.060 65.060 65.488 -0.428 18497
285 1 . 1 1 50 50 ILE CB C 50 37.970 37.970 37.890 0.080 18497
286 1 . 1 1 50 50 ILE H H 50 7.543 7.543 8.414 -0.871 18497
287 1 . 1 1 51 51 ILE N N 51 117.995 117.995 121.603 -3.608 18497
288 1 . 1 1 51 51 ILE HA H 51 3.540 3.540 3.420 0.120 18497
289 1 . 1 1 51 51 ILE C C 51 179.197 179.197 177.668 1.529 18497
290 1 . 1 1 51 51 ILE CA C 51 63.740 63.740 65.457 -1.717 18497
291 1 . 1 1 51 51 ILE CB C 51 36.650 36.650 37.015 -0.365 18497
292 1 . 1 1 51 51 ILE H H 51 7.475 7.475 8.103 -0.628 18497
293 1 . 1 1 52 52 ASP N N 52 121.642 121.642 120.120 1.522 18497
294 1 . 1 1 52 52 ASP HA H 52 4.440 4.440 4.246 0.194 18497
295 1 . 1 1 52 52 ASP C C 52 179.197 179.197 178.624 0.573 18497
296 1 . 1 1 52 52 ASP CA C 52 57.100 57.100 57.818 -0.718 18497
297 1 . 1 1 52 52 ASP CB C 52 40.300 40.300 40.400 -0.100 18497
298 1 . 1 1 52 52 ASP H H 52 8.559 8.559 8.267 0.292 18497
299 1 . 1 1 53 53 ASN N N 53 117.131 117.131 118.709 -1.578 18497
300 1 . 1 1 53 53 ASN HA H 53 4.610 4.610 4.393 0.217 18497
301 1 . 1 1 53 53 ASN C C 53 178.545 178.545 177.651 0.893 18497
302 1 . 1 1 53 53 ASN CA C 53 54.700 54.700 56.222 -1.522 18497
303 1 . 1 1 53 53 ASN CB C 53 38.700 38.700 38.761 -0.061 18497
304 1 . 1 1 53 53 ASN H H 53 8.106 8.106 8.177 -0.071 18497
305 1 . 1 1 54 54 ARG N N 54 119.929 119.929 119.798 0.131 18497
306 1 . 1 1 54 54 ARG HA H 54 4.120 4.120 4.016 0.104 18497
307 1 . 1 1 54 54 ARG C C 54 176.892 176.892 178.317 -1.425 18497
308 1 . 1 1 54 54 ARG CA C 54 58.160 58.160 58.925 -0.765 18497
309 1 . 1 1 54 54 ARG CB C 54 30.270 30.270 30.222 0.048 18497
310 1 . 1 1 54 54 ARG H H 54 7.797 7.797 8.214 -0.417 18497
311 1 . 1 1 55 55 ARG N N 55 119.227 119.227 117.562 1.665 18497
312 1 . 1 1 55 55 ARG HA H 55 4.174 4.174 4.219 -0.046 18497
313 1 . 1 1 55 55 ARG C C 55 175.108 175.108 178.070 -2.962 18497
314 1 . 1 1 55 55 ARG CA C 55 61.880 61.880 58.368 3.512 18497
315 1 . 1 1 55 55 ARG CB C 55 32.660 32.660 30.977 1.683 18497
316 1 . 1 1 55 55 ARG H H 55 7.857 7.857 8.043 -0.186 18497
317 1 . 1 1 56 56 ILE N N 56 116.676 116.676 117.641 -0.965 18497
318 1 . 1 1 56 56 ILE HA H 56 4.010 4.010 4.114 -0.104 18497
319 1 . 1 1 56 56 ILE C C 56 176.065 176.065 176.922 -0.857 18497
320 1 . 1 1 56 56 ILE CA C 56 62.140 62.140 62.497 -0.357 18497
321 1 . 1 1 56 56 ILE CB C 56 38.240 38.240 38.996 -0.756 18497
322 1 . 1 1 56 56 ILE H H 56 8.317 8.317 8.226 0.091 18497
323 1 . 1 1 57 57 MET N N 57 122.058 122.058 117.228 4.830 18497
324 1 . 1 1 57 57 MET HA H 57 4.420 4.420 4.357 0.063 18497
325 1 . 1 1 57 57 MET C C 57 177.283 177.283 176.060 1.223 18497
326 1 . 1 1 57 57 MET CA C 57 56.030 56.030 56.031 -0.001 18497
327 1 . 1 1 57 57 MET CB C 57 32.515 32.515 32.343 0.171 18497
328 1 . 1 1 57 57 MET H H 57 8.177 8.177 7.741 0.436 18497
329 1 . 1 1 58 58 ASN N N 58 118.892 118.892 118.297 0.595 18497
330 1 . 1 1 58 58 ASN HA H 58 4.690 4.690 4.579 0.111 18497
331 1 . 1 1 58 58 ASN C C 58 176.500 176.500 175.145 1.355 18497
332 1 . 1 1 58 58 ASN CA C 58 53.653 53.653 54.481 -0.828 18497
333 1 . 1 1 58 58 ASN CB C 58 38.770 38.770 38.706 0.064 18497
334 1 . 1 1 58 58 ASN H H 58 8.238 8.238 8.184 0.054 18497
335 1 . 1 1 59 59 GLN N N 59 120.456 120.456 119.415 1.041 18497
336 1 . 1 1 59 59 GLN HA H 59 4.310 4.310 4.387 -0.077 18497
337 1 . 1 1 59 59 GLN C C 59 175.326 175.326 175.240 0.086 18497
338 1 . 1 1 59 59 GLN CA C 59 56.030 56.030 56.139 -0.109 18497
339 1 . 1 1 59 59 GLN CB C 59 28.800 28.800 30.045 -1.245 18497
340 1 . 1 1 59 59 GLN H H 59 8.196 8.196 7.955 0.241 18497
341 1 . 1 1 60 60 ALA N N 60 125.116 125.116 124.295 0.821 18497
342 1 . 1 1 60 60 ALA HA H 60 4.382 4.382 4.391 -0.009 18497
343 1 . 1 1 60 60 ALA CA C 60 52.300 52.300 52.566 -0.266 18497
344 1 . 1 1 60 60 ALA CB C 60 19.110 19.110 19.388 -0.278 18497
345 1 . 1 1 60 60 ALA H H 60 8.293 8.293 8.293 0.000 18497
346 1 . 1 1 61 61 SER N N 61 115.686 115.686 114.170 1.516 18497
347 1 . 1 1 61 61 SER HA H 61 4.470 4.470 4.538 -0.068 18497
348 1 . 1 1 61 61 SER C C 61 175.674 175.674 173.954 1.720 18497
349 1 . 1 1 61 61 SER CA C 61 58.160 58.160 58.413 -0.253 18497
350 1 . 1 1 61 61 SER CB C 61 63.740 63.740 63.783 -0.043 18497
351 1 . 1 1 61 61 SER H H 61 8.290 8.290 8.396 -0.106 18497
stop_
save_