data_18016
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18016
_Entry.PDB_ID 2LKY
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 18016
_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 4.560 -0.130 18016
2 1 1 . 1 1 2 2 PRO C C 2 177.600 177.600 176.028 1.572 18016
3 1 1 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.864 0.436 18016
4 1 1 . 1 1 2 2 PRO CB C 2 32.300 32.300 31.752 0.548 18016
5 1 1 . 1 1 3 3 GLY N N 3 110.000 110.000 112.191 -2.191 18016
6 1 1 . 1 1 3 3 GLY C C 3 174.200 174.200 174.072 0.128 18016
7 1 1 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.512 -0.112 18016
8 1 1 . 1 1 3 3 GLY H H 3 8.700 8.700 8.172 0.528 18016
9 1 1 . 1 1 4 4 SER N N 4 115.400 115.400 116.740 -1.340 18016
10 1 1 . 1 1 4 4 SER HA H 4 4.440 4.440 4.183 0.257 18016
11 1 1 . 1 1 4 4 SER C C 4 174.800 174.800 174.226 0.574 18016
12 1 1 . 1 1 4 4 SER CA C 4 58.400 58.400 58.915 -0.515 18016
13 1 1 . 1 1 4 4 SER CB C 4 63.800 63.800 63.545 0.255 18016
14 1 1 . 1 1 4 4 SER H H 4 8.210 8.210 8.560 -0.350 18016
15 1 1 . 1 1 5 5 MET N N 5 122.200 122.200 120.101 2.099 18016
16 1 1 . 1 1 5 5 MET HA H 5 4.510 4.510 4.335 0.175 18016
17 1 1 . 1 1 5 5 MET CA C 5 55.600 55.600 57.234 -1.634 18016
18 1 1 . 1 1 5 5 MET CB C 5 32.900 32.900 33.256 -0.356 18016
19 1 1 . 1 1 5 5 MET H H 5 8.570 8.570 8.068 0.502 18016
20 1 1 . 1 1 6 6 VAL N N 6 120.000 120.000 115.091 4.909 18016
21 1 1 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.292 -0.242 18016
22 1 1 . 1 1 6 6 VAL C C 6 175.700 175.700 175.817 -0.117 18016
23 1 1 . 1 1 6 6 VAL CA C 6 62.700 62.700 60.510 2.190 18016
24 1 1 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.285 0.215 18016
25 1 1 . 1 1 6 6 VAL H H 6 8.150 8.150 7.901 0.249 18016
26 1 1 . 1 1 7 7 ASN N N 7 122.000 122.000 118.673 3.327 18016
27 1 1 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.589 0.071 18016
28 1 1 . 1 1 7 7 ASN C C 7 175.200 175.200 176.773 -1.573 18016
29 1 1 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.900 -0.700 18016
30 1 1 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.704 -0.804 18016
31 1 1 . 1 1 7 7 ASN H H 7 8.010 8.010 8.391 -0.381 18016
32 1 1 . 1 1 8 8 ALA N N 8 126.500 126.500 125.173 1.327 18016
33 1 1 . 1 1 8 8 ALA C C 8 180.200 180.200 179.468 0.732 18016
34 1 1 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.505 -0.005 18016
35 1 1 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.832 -0.432 18016
36 1 1 . 1 1 8 8 ALA H H 8 9.020 9.020 8.735 0.285 18016
37 1 1 . 1 1 9 9 PHE N N 9 121.300 121.300 119.086 2.214 18016
38 1 1 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.090 0.200 18016
39 1 1 . 1 1 9 9 PHE C C 9 177.200 177.200 177.125 0.075 18016
40 1 1 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.569 -0.269 18016
41 1 1 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.740 0.460 18016
42 1 1 . 1 1 9 9 PHE H H 9 8.570 8.570 8.370 0.200 18016
43 1 1 . 1 1 10 10 LEU N N 10 117.200 117.200 118.976 -1.776 18016
44 1 1 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.984 -0.284 18016
45 1 1 . 1 1 10 10 LEU C C 10 179.700 179.700 179.261 0.439 18016
46 1 1 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.648 -0.048 18016
47 1 1 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.453 0.247 18016
48 1 1 . 1 1 10 10 LEU H H 10 8.150 8.150 7.998 0.152 18016
49 1 1 . 1 1 11 11 ALA N N 11 121.500 121.500 122.379 -0.879 18016
50 1 1 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.897 0.123 18016
51 1 1 . 1 1 11 11 ALA C C 11 180.900 180.900 179.710 1.190 18016
52 1 1 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.581 -0.581 18016
53 1 1 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.110 -0.110 18016
54 1 1 . 1 1 11 11 ALA H H 11 8.460 8.460 8.707 -0.247 18016
55 1 1 . 1 1 12 12 LYS N N 12 120.700 120.700 119.055 1.645 18016
56 1 1 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.016 0.034 18016
57 1 1 . 1 1 12 12 LYS C C 12 179.700 179.700 178.979 0.721 18016
58 1 1 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.972 0.228 18016
59 1 1 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.807 -0.207 18016
60 1 1 . 1 1 12 12 LYS H H 12 7.820 7.820 7.775 0.045 18016
61 1 1 . 1 1 13 13 ILE N N 13 120.100 120.100 119.671 0.429 18016
62 1 1 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.893 -0.203 18016
63 1 1 . 1 1 13 13 ILE C C 13 178.100 178.100 178.170 -0.070 18016
64 1 1 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.694 -0.694 18016
65 1 1 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.613 -1.213 18016
66 1 1 . 1 1 13 13 ILE H H 13 7.640 7.640 7.862 -0.222 18016
67 1 1 . 1 1 14 14 ALA N N 14 122.700 122.700 122.300 0.400 18016
68 1 1 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.938 -0.078 18016
69 1 1 . 1 1 14 14 ALA C C 14 179.000 179.000 179.574 -0.574 18016
70 1 1 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.460 0.540 18016
71 1 1 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.041 -0.041 18016
72 1 1 . 1 1 14 14 ALA H H 14 8.680 8.680 8.421 0.259 18016
73 1 1 . 1 1 15 15 ALA N N 15 118.700 118.700 121.869 -3.169 18016
74 1 1 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.036 0.054 18016
75 1 1 . 1 1 15 15 ALA C C 15 180.400 180.400 178.896 1.504 18016
76 1 1 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.834 0.166 18016
77 1 1 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.439 -0.739 18016
78 1 1 . 1 1 15 15 ALA H H 15 8.070 8.070 8.041 0.029 18016
79 1 1 . 1 1 16 16 TRP N N 16 122.900 122.900 121.286 1.614 18016
80 1 1 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.250 0.310 18016
81 1 1 . 1 1 16 16 TRP C C 16 178.400 178.400 178.006 0.394 18016
82 1 1 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.316 -1.716 18016
83 1 1 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.045 -0.745 18016
84 1 1 . 1 1 16 16 TRP H H 16 7.820 7.820 8.264 -0.444 18016
85 1 1 . 1 1 17 17 LEU N N 17 120.400 120.400 119.188 1.212 18016
86 1 1 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.199 0.411 18016
87 1 1 . 1 1 17 17 LEU C C 17 179.000 179.000 178.787 0.213 18016
88 1 1 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.823 0.077 18016
89 1 1 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.550 0.450 18016
90 1 1 . 1 1 17 17 LEU H H 17 8.630 8.630 8.496 0.134 18016
91 1 1 . 1 1 18 18 ASN N N 18 116.200 116.200 116.580 -0.380 18016
92 1 1 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.613 -0.303 18016
93 1 1 . 1 1 18 18 ASN C C 18 177.100 177.100 176.882 0.218 18016
94 1 1 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.482 0.118 18016
95 1 1 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.959 0.241 18016
96 1 1 . 1 1 18 18 ASN H H 18 8.350 8.350 8.327 0.023 18016
97 1 1 . 1 1 19 19 ALA N N 19 119.600 119.600 121.264 -1.664 18016
98 1 1 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.264 -0.174 18016
99 1 1 . 1 1 19 19 ALA C C 19 180.100 180.100 179.083 1.017 18016
100 1 1 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.129 0.071 18016
101 1 1 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.590 -0.990 18016
102 1 1 . 1 1 19 19 ALA H H 19 7.920 7.920 8.090 -0.170 18016
103 1 1 . 1 1 20 20 GLY N N 20 103.500 103.500 105.628 -2.128 18016
104 1 1 . 1 1 20 20 GLY C C 20 173.800 173.800 173.682 0.118 18016
105 1 1 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.580 0.220 18016
106 1 1 . 1 1 20 20 GLY H H 20 7.700 7.700 7.575 0.125 18016
107 1 1 . 1 1 21 21 TYR N N 21 119.900 119.900 117.913 1.987 18016
108 1 1 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.916 0.254 18016
109 1 1 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.011 1.389 18016
110 1 1 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.761 -0.961 18016
111 1 1 . 1 1 21 21 TYR H H 21 7.980 7.980 7.909 0.071 18016
112 1 1 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.509 -0.009 18016
113 1 1 . 1 1 22 22 PRO C C 22 178.700 178.700 176.949 1.751 18016
114 1 1 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.049 0.951 18016
115 1 1 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.148 -0.148 18016
116 1 1 . 1 1 23 23 GLU N N 23 116.300 116.300 116.865 -0.565 18016
117 1 1 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.392 0.178 18016
118 1 1 . 1 1 23 23 GLU C C 23 176.300 176.300 176.403 -0.103 18016
119 1 1 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.712 -1.112 18016
120 1 1 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.145 0.355 18016
121 1 1 . 1 1 23 23 GLU H H 23 8.680 8.680 8.058 0.622 18016
122 1 1 . 1 1 24 24 GLY N N 24 108.100 108.100 109.019 -0.919 18016
123 1 1 . 1 1 24 24 GLY C C 24 173.100 173.100 172.878 0.222 18016
124 1 1 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.599 -1.699 18016
125 1 1 . 1 1 24 24 GLY H H 24 7.230 7.230 7.380 -0.150 18016
126 1 1 . 1 1 25 25 VAL N N 25 121.500 121.500 120.690 0.810 18016
127 1 1 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.781 -0.191 18016
128 1 1 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.106 1.194 18016
129 1 1 . 1 1 25 25 VAL CB C 25 32.100 32.100 33.011 -0.911 18016
130 1 1 . 1 1 25 25 VAL H H 25 8.050 8.050 7.952 0.098 18016
131 1 1 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.441 -0.121 18016
132 1 1 . 1 1 26 26 PRO C C 26 177.600 177.600 178.155 -0.555 18016
133 1 1 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.622 0.278 18016
134 1 1 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.779 0.321 18016
135 1 1 . 1 1 27 27 GLY N N 27 109.000 109.000 109.687 -0.687 18016
136 1 1 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.781 1.319 18016
137 1 1 . 1 1 27 27 GLY H H 27 8.930 8.930 8.881 0.049 18016
138 1 1 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.209 0.181 18016
139 1 1 . 1 1 28 28 PRO C C 28 175.800 175.800 176.579 -0.779 18016
140 1 1 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.814 -0.414 18016
141 1 1 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.568 0.332 18016
142 1 1 . 1 1 29 29 ASP N N 29 115.000 115.000 114.894 0.106 18016
143 1 1 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.721 -0.231 18016
144 1 1 . 1 1 29 29 ASP C C 29 177.000 177.000 178.043 -1.043 18016
145 1 1 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.872 -1.972 18016
146 1 1 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.520 -0.820 18016
147 1 1 . 1 1 29 29 ASP H H 29 7.760 7.760 7.893 -0.133 18016
148 1 1 . 1 1 30 30 ARG N N 30 119.900 119.900 121.605 -1.705 18016
149 1 1 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.927 -0.357 18016
150 1 1 . 1 1 30 30 ARG C C 30 176.500 176.500 178.563 -2.063 18016
151 1 1 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.825 2.075 18016
152 1 1 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.189 0.311 18016
153 1 1 . 1 1 30 30 ARG H H 30 7.460 7.460 8.121 -0.661 18016
154 1 1 . 1 1 31 31 VAL N N 31 117.600 117.600 119.957 -2.357 18016
155 1 1 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.871 -0.051 18016
156 1 1 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.336 0.364 18016
157 1 1 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.198 -0.398 18016
158 1 1 . 1 1 31 31 VAL H H 31 9.080 9.080 8.271 0.809 18016
159 1 1 . 1 1 32 32 PRO C C 32 177.000 177.000 178.760 -1.760 18016
160 1 1 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.886 -0.686 18016
161 1 1 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.180 -0.380 18016
162 1 1 . 1 1 33 33 LEU N N 33 115.200 115.200 120.887 -5.687 18016
163 1 1 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.106 0.014 18016
164 1 1 . 1 1 33 33 LEU C C 33 178.600 178.600 178.482 0.118 18016
165 1 1 . 1 1 33 33 LEU CA C 33 58.400 58.400 57.986 0.414 18016
166 1 1 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.328 0.172 18016
167 1 1 . 1 1 33 33 LEU H H 33 8.010 8.010 8.143 -0.133 18016
168 1 1 . 1 1 34 34 LEU N N 34 120.400 120.400 119.282 1.118 18016
169 1 1 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.033 -0.103 18016
170 1 1 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.632 0.468 18016
171 1 1 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.290 0.610 18016
172 1 1 . 1 1 34 34 LEU H H 34 8.220 8.220 8.435 -0.215 18016
173 1 1 . 1 1 35 35 ALA N N 35 123.100 123.100 122.648 0.452 18016
174 1 1 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.084 -0.044 18016
175 1 1 . 1 1 35 35 ALA C C 35 179.500 179.500 179.308 0.192 18016
176 1 1 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.999 0.501 18016
177 1 1 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.462 -0.562 18016
178 1 1 . 1 1 35 35 ALA H H 35 8.560 8.560 8.033 0.527 18016
179 1 1 . 1 1 36 36 LEU N N 36 117.600 117.600 118.732 -1.132 18016
180 1 1 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.289 -0.169 18016
181 1 1 . 1 1 36 36 LEU C C 36 180.100 180.100 179.159 0.941 18016
182 1 1 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.343 0.857 18016
183 1 1 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.804 0.996 18016
184 1 1 . 1 1 36 36 LEU H H 36 7.850 7.850 7.965 -0.115 18016
185 1 1 . 1 1 37 37 LEU N N 37 116.700 116.700 120.246 -3.546 18016
186 1 1 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.091 0.009 18016
187 1 1 . 1 1 37 37 LEU C C 37 180.100 180.100 178.548 1.552 18016
188 1 1 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.127 0.173 18016
189 1 1 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.249 -0.049 18016
190 1 1 . 1 1 37 37 LEU H H 37 8.730 8.730 8.408 0.322 18016
191 1 1 . 1 1 38 38 THR N N 38 110.600 110.600 108.998 1.602 18016
192 1 1 . 1 1 38 38 THR HA H 38 4.440 4.440 4.129 0.311 18016
193 1 1 . 1 1 38 38 THR C C 38 175.100 175.100 175.763 -0.663 18016
194 1 1 . 1 1 38 38 THR CA C 38 64.200 64.200 64.045 0.155 18016
195 1 1 . 1 1 38 38 THR CB C 38 70.000 70.000 68.555 1.444 18016
196 1 1 . 1 1 38 38 THR H H 38 8.660 8.660 8.330 0.330 18016
197 1 1 . 1 1 39 39 ARG N N 39 118.000 118.000 120.635 -2.635 18016
198 1 1 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.118 0.162 18016
199 1 1 . 1 1 39 39 ARG C C 39 177.300 177.300 177.863 -0.563 18016
200 1 1 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.316 -0.016 18016
201 1 1 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.823 0.377 18016
202 1 1 . 1 1 39 39 ARG H H 39 7.180 7.180 7.526 -0.346 18016
203 1 1 . 1 1 40 40 ARG N N 40 114.400 114.400 114.949 -0.549 18016
204 1 1 . 1 1 40 40 ARG C C 40 174.800 174.800 175.586 -0.786 18016
205 1 1 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.759 -0.459 18016
206 1 1 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.421 3.179 18016
207 1 1 . 1 1 40 40 ARG H H 40 7.520 7.520 7.657 -0.137 18016
208 1 1 . 1 1 41 41 LEU N N 41 119.400 119.400 120.810 -1.410 18016
209 1 1 . 1 1 41 41 LEU C C 41 177.100 177.100 177.107 -0.007 18016
210 1 1 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.265 -0.565 18016
211 1 1 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.477 0.923 18016
212 1 1 . 1 1 41 41 LEU H H 41 8.380 8.380 7.434 0.946 18016
213 1 1 . 1 1 42 42 THR N N 42 112.000 112.000 115.382 -3.382 18016
214 1 1 . 1 1 42 42 THR HA H 42 4.440 4.440 4.380 0.060 18016
215 1 1 . 1 1 42 42 THR C C 42 175.800 175.800 175.829 -0.029 18016
216 1 1 . 1 1 42 42 THR CA C 42 60.500 60.500 60.884 -0.384 18016
217 1 1 . 1 1 42 42 THR CB C 42 70.800 70.800 70.080 0.720 18016
218 1 1 . 1 1 42 42 THR H H 42 9.330 9.330 8.969 0.361 18016
219 1 1 . 1 1 43 43 ASN N N 43 119.900 119.900 119.567 0.333 18016
220 1 1 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.372 -0.122 18016
221 1 1 . 1 1 43 43 ASN C C 43 177.900 177.900 177.441 0.459 18016
222 1 1 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.860 -1.160 18016
223 1 1 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.100 -0.900 18016
224 1 1 . 1 1 43 43 ASN H H 43 9.140 9.140 8.770 0.370 18016
225 1 1 . 1 1 44 44 ASP N N 44 118.000 118.000 118.937 -0.937 18016
226 1 1 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.412 -0.012 18016
227 1 1 . 1 1 44 44 ASP C C 44 179.600 179.600 178.349 1.251 18016
228 1 1 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.734 -0.434 18016
229 1 1 . 1 1 44 44 ASP H H 44 8.360 8.360 8.720 -0.360 18016
230 1 1 . 1 1 45 45 GLU N N 45 122.600 122.600 120.396 2.204 18016
231 1 1 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.090 -0.120 18016
232 1 1 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.125 0.275 18016
233 1 1 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.872 0.428 18016
234 1 1 . 1 1 45 45 GLU H H 45 7.850 7.850 7.677 0.173 18016
235 1 1 . 1 1 46 46 ILE N N 46 118.900 118.900 120.758 -1.858 18016
236 1 1 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.751 -0.321 18016
237 1 1 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.259 1.741 18016
238 1 1 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.777 -0.077 18016
239 1 1 . 1 1 46 46 ILE H H 46 8.290 8.290 8.384 -0.094 18016
240 1 1 . 1 1 47 47 LYS N N 47 118.900 118.900 119.334 -0.434 18016
241 1 1 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.952 -0.082 18016
242 1 1 . 1 1 47 47 LYS C C 47 178.400 178.400 178.832 -0.432 18016
243 1 1 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.721 0.579 18016
244 1 1 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.185 0.415 18016
245 1 1 . 1 1 47 47 LYS H H 47 8.290 8.290 8.198 0.092 18016
246 1 1 . 1 1 48 48 ALA N N 48 121.100 121.100 122.942 -1.842 18016
247 1 1 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.995 0.175 18016
248 1 1 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.177 -0.077 18016
249 1 1 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.092 -0.092 18016
250 1 1 . 1 1 48 48 ALA H H 48 7.710 7.710 8.088 -0.378 18016
251 1 1 . 1 1 49 49 ILE N N 49 119.900 119.900 117.934 1.966 18016
252 1 1 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.719 -0.069 18016
253 1 1 . 1 1 49 49 ILE C C 49 177.300 177.300 178.073 -0.773 18016
254 1 1 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.492 1.508 18016
255 1 1 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.323 1.777 18016
256 1 1 . 1 1 49 49 ILE H H 49 8.130 8.130 8.281 -0.151 18016
257 1 1 . 1 1 50 50 ALA N N 50 122.000 122.000 122.326 -0.326 18016
258 1 1 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.961 -0.101 18016
259 1 1 . 1 1 50 50 ALA C C 50 179.800 179.800 179.839 -0.039 18016
260 1 1 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.310 0.390 18016
261 1 1 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.077 -0.177 18016
262 1 1 . 1 1 50 50 ALA H H 50 8.730 8.730 7.899 0.831 18016
263 1 1 . 1 1 51 51 GLU N N 51 116.900 116.900 118.039 -1.139 18016
264 1 1 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.972 0.048 18016
265 1 1 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.307 0.093 18016
266 1 1 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.301 0.199 18016
267 1 1 . 1 1 51 51 GLU H H 51 8.220 8.220 8.515 -0.295 18016
268 1 1 . 1 1 52 52 ASP N N 52 120.300 120.300 120.237 0.063 18016
269 1 1 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.468 -0.078 18016
270 1 1 . 1 1 52 52 ASP C C 52 178.900 178.900 178.794 0.106 18016
271 1 1 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.061 0.439 18016
272 1 1 . 1 1 52 52 ASP CB C 52 42.500 42.500 40.934 1.566 18016
273 1 1 . 1 1 52 52 ASP H H 52 7.700 7.700 8.045 -0.345 18016
274 1 1 . 1 1 53 53 LEU N N 53 118.300 118.300 120.174 -1.874 18016
275 1 1 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.966 -0.236 18016
276 1 1 . 1 1 53 53 LEU C C 53 179.000 179.000 178.886 0.114 18016
277 1 1 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.757 -0.257 18016
278 1 1 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.996 -0.896 18016
279 1 1 . 1 1 53 53 LEU H H 53 8.290 8.290 7.863 0.427 18016
280 1 1 . 1 1 54 54 GLU N N 54 118.700 118.700 118.291 0.409 18016
281 1 1 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.103 0.117 18016
282 1 1 . 1 1 54 54 GLU C C 54 178.200 178.200 178.093 0.107 18016
283 1 1 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.262 0.438 18016
284 1 1 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.004 0.896 18016
285 1 1 . 1 1 54 54 GLU H H 54 8.070 8.070 8.513 -0.443 18016
286 1 1 . 1 1 55 55 LYS N N 55 117.700 117.700 118.353 -0.653 18016
287 1 1 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.076 0.074 18016
288 1 1 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.380 -0.080 18016
289 1 1 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.280 0.420 18016
290 1 1 . 1 1 55 55 LYS H H 55 7.750 7.750 7.551 0.199 18016
291 1 1 . 1 1 56 56 ARG N N 56 117.100 117.100 117.529 -0.429 18016
292 1 1 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.220 0.050 18016
293 1 1 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.814 -1.014 18016
294 1 1 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.465 -0.465 18016
295 1 1 . 1 1 56 56 ARG H H 56 8.270 8.270 7.704 0.566 18016
296 1 1 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.669 -0.309 18016
297 1 1 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.334 -0.234 18016
298 1 1 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.436 -1.236 18016
299 1 1 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.783 -0.273 18016
300 1 1 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.173 1.027 18016
301 1 1 . 1 1 58 58 HIS CB C 58 27.300 27.300 30.535 -3.235 18016
302 1 1 . 1 1 59 59 PHE N N 59 120.400 120.400 119.569 0.831 18016
303 1 1 . 1 1 59 59 PHE C C 59 175.500 175.500 175.717 -0.217 18016
304 1 1 . 1 1 59 59 PHE CA C 59 57.200 57.200 59.292 -2.092 18016
305 1 1 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.009 0.291 18016
306 1 1 . 1 1 59 59 PHE H H 59 7.710 7.710 8.488 -0.778 18016
307 1 1 . 1 1 60 60 ASP N N 60 120.800 120.800 118.530 2.270 18016
308 1 1 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.661 -0.171 18016
309 1 1 . 1 1 60 60 ASP CA C 60 54.300 54.300 54.636 -0.336 18016
310 1 1 . 1 1 60 60 ASP CB C 60 41.100 41.100 41.484 -0.385 18016
311 1 1 . 1 1 60 60 ASP H H 60 8.180 8.180 8.033 0.147 18016
312 1 1 . 1 1 61 61 HIS N N 61 118.300 118.300 118.283 0.017 18016
313 1 1 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.617 -0.227 18016
314 1 1 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.096 1.605 18016
315 1 1 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.207 -0.407 18016
316 1 1 . 1 1 61 61 HIS H H 61 8.550 8.550 8.076 0.474 18016
317 1 1 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.049 -0.039 18016
318 1 1 . 1 1 62 62 ILE C C 62 173.800 173.800 176.102 -2.302 18016
319 1 1 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.575 5.925 18016
320 1 1 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.112 2.988 18016
321 1 1 . 1 1 63 63 ASP N N 63 125.100 125.100 120.924 4.176 18016
322 1 1 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.302 0.298 18016
323 1 1 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.250 -2.450 18016
324 1 1 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.606 -1.106 18016
325 1 1 . 1 1 63 63 ASP H H 63 8.360 8.360 7.829 0.531 18016
326 1 1 . 1 1 64 64 ILE HA H 64 3.670 3.670 4.108 -0.438 18016
327 1 1 . 1 1 64 64 ILE C C 64 177.000 177.000 176.506 0.494 18016
328 1 1 . 1 1 64 64 ILE CA C 64 62.100 62.100 62.379 -0.279 18016
329 1 1 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.566 -1.966 18016
330 1 1 . 1 1 65 65 GLY N N 65 107.600 107.600 108.070 -0.470 18016
331 1 1 . 1 1 65 65 GLY C C 65 177.000 177.000 176.006 0.994 18016
332 1 1 . 1 1 65 65 GLY CA C 65 47.300 47.300 47.044 0.256 18016
333 1 1 . 1 1 65 65 GLY H H 65 8.440 8.440 8.184 0.256 18016
334 1 1 . 1 1 66 66 VAL N N 66 121.800 121.800 122.465 -0.665 18016
335 1 1 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.808 -0.048 18016
336 1 1 . 1 1 66 66 VAL C C 66 178.500 178.500 177.279 1.221 18016
337 1 1 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.111 0.489 18016
338 1 1 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.790 0.210 18016
339 1 1 . 1 1 66 66 VAL H H 66 7.550 7.550 8.126 -0.576 18016
340 1 1 . 1 1 67 67 LEU N N 67 120.900 120.900 119.211 1.689 18016
341 1 1 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.034 0.036 18016
342 1 1 . 1 1 67 67 LEU C C 67 179.000 179.000 179.569 -0.569 18016
343 1 1 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.871 -0.271 18016
344 1 1 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.499 1.801 18016
345 1 1 . 1 1 67 67 LEU H H 67 7.650 7.650 7.451 0.199 18016
346 1 1 . 1 1 68 68 ILE N N 68 118.900 118.900 117.938 0.962 18016
347 1 1 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.790 -0.080 18016
348 1 1 . 1 1 68 68 ILE C C 68 179.500 179.500 178.326 1.174 18016
349 1 1 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.799 0.401 18016
350 1 1 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.375 0.125 18016
351 1 1 . 1 1 68 68 ILE H H 68 8.580 8.580 7.641 0.939 18016
352 1 1 . 1 1 69 69 THR N N 69 118.100 118.100 114.360 3.740 18016
353 1 1 . 1 1 69 69 THR HA H 69 3.940 3.940 4.079 -0.139 18016
354 1 1 . 1 1 69 69 THR C C 69 176.200 176.200 175.958 0.242 18016
355 1 1 . 1 1 69 69 THR CA C 69 66.600 66.600 65.995 0.605 18016
356 1 1 . 1 1 69 69 THR CB C 69 68.500 68.500 68.300 0.200 18016
357 1 1 . 1 1 69 69 THR H H 69 7.840 7.840 7.592 0.248 18016
358 1 1 . 1 1 70 70 GLN N N 70 121.600 121.600 119.780 1.820 18016
359 1 1 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.213 -0.103 18016
360 1 1 . 1 1 70 70 GLN C C 70 178.100 178.100 177.992 0.108 18016
361 1 1 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.477 0.623 18016
362 1 1 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.854 -0.554 18016
363 1 1 . 1 1 70 70 GLN H H 70 8.100 8.100 7.405 0.695 18016
364 1 1 . 1 1 71 71 MET N N 71 118.700 118.700 118.246 0.454 18016
365 1 1 . 1 1 71 71 MET HA H 71 4.010 4.010 4.438 -0.428 18016
366 1 1 . 1 1 71 71 MET C C 71 176.300 176.300 178.223 -1.923 18016
367 1 1 . 1 1 71 71 MET CA C 71 58.100 58.100 58.831 -0.731 18016
368 1 1 . 1 1 71 71 MET CB C 71 33.600 33.600 32.916 0.684 18016
369 1 1 . 1 1 71 71 MET H H 71 8.350 8.350 8.490 -0.140 18016
370 1 1 . 1 1 72 72 THR N N 72 111.600 111.600 111.741 -0.141 18016
371 1 1 . 1 1 72 72 THR HA H 72 3.940 3.940 4.144 -0.204 18016
372 1 1 . 1 1 72 72 THR C C 72 175.800 175.800 175.194 0.606 18016
373 1 1 . 1 1 72 72 THR CA C 72 65.300 65.300 64.662 0.639 18016
374 1 1 . 1 1 72 72 THR CB C 72 69.100 69.100 69.222 -0.122 18016
375 1 1 . 1 1 72 72 THR H H 72 7.840 7.840 7.805 0.035 18016
376 1 1 . 1 1 73 73 ASP N N 73 121.100 121.100 119.699 1.401 18016
377 1 1 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.719 -0.189 18016
378 1 1 . 1 1 73 73 ASP C C 73 176.600 176.600 175.695 0.905 18016
379 1 1 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.201 0.999 18016
380 1 1 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.667 -1.267 18016
381 1 1 . 1 1 73 73 ASP H H 73 7.840 7.840 7.604 0.236 18016
382 1 1 . 1 1 74 74 GLU N N 74 121.100 121.100 119.106 1.994 18016
383 1 1 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.620 -0.280 18016
384 1 1 . 1 1 74 74 GLU C C 74 173.800 173.800 175.117 -1.317 18016
385 1 1 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.560 -0.060 18016
386 1 1 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.893 -1.293 18016
387 1 1 . 1 1 74 74 GLU H H 74 7.980 7.980 8.412 -0.432 18016
388 1 1 . 1 1 75 75 MET N N 75 125.800 125.800 125.780 0.020 18016
389 1 1 . 1 1 75 75 MET HA H 75 4.710 4.710 4.855 -0.145 18016
390 1 1 . 1 1 75 75 MET CA C 75 53.800 53.800 54.446 -0.646 18016
391 1 1 . 1 1 75 75 MET CB C 75 31.700 31.700 31.825 -0.124 18016
392 1 1 . 1 1 75 75 MET H H 75 8.380 8.380 8.606 -0.226 18016
393 1 1 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.451 0.059 18016
394 1 1 . 1 1 76 76 PRO C C 76 175.700 175.700 176.441 -0.741 18016
395 1 1 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.574 -1.574 18016
396 1 1 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.289 -0.490 18016
397 1 1 . 1 1 77 77 ARG N N 77 119.700 119.700 116.982 2.718 18016
398 1 1 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.519 -0.249 18016
399 1 1 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.230 0.570 18016
400 1 1 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.428 -1.728 18016
401 1 1 . 1 1 77 77 ARG H H 77 8.940 8.940 7.773 1.167 18016
402 1 1 . 1 1 78 78 GLU N N 78 124.700 124.700 124.620 0.080 18016
403 1 1 . 1 1 78 78 GLU HA H 78 3.960 3.960 4.023 -0.063 18016
404 1 1 . 1 1 78 78 GLU C C 78 179.000 179.000 178.160 0.840 18016
405 1 1 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.552 0.248 18016
406 1 1 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.738 -0.737 18016
407 1 1 . 1 1 78 78 GLU H H 78 9.170 9.170 8.961 0.209 18016
408 1 1 . 1 1 79 79 GLU N N 79 116.800 116.800 120.195 -3.395 18016
409 1 1 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.142 -0.022 18016
410 1 1 . 1 1 79 79 GLU C C 79 179.100 179.100 178.579 0.521 18016
411 1 1 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.763 -0.063 18016
412 1 1 . 1 1 79 79 GLU CB C 79 29.000 29.000 28.734 0.266 18016
413 1 1 . 1 1 79 79 GLU H H 79 9.660 9.660 8.768 0.892 18016
414 1 1 . 1 1 80 80 ASP N N 80 120.000 120.000 118.616 1.384 18016
415 1 1 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.474 0.216 18016
416 1 1 . 1 1 80 80 ASP C C 80 177.300 177.300 178.629 -1.329 18016
417 1 1 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.466 -0.066 18016
418 1 1 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.240 1.360 18016
419 1 1 . 1 1 80 80 ASP H H 80 7.310 7.310 8.340 -1.030 18016
420 1 1 . 1 1 81 81 ILE N N 81 120.100 120.100 120.300 -0.200 18016
421 1 1 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.695 -0.205 18016
422 1 1 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.834 0.466 18016
423 1 1 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.851 0.449 18016
424 1 1 . 1 1 81 81 ILE H H 81 7.610 7.610 8.284 -0.674 18016
425 1 1 . 1 1 82 82 GLU N N 82 118.100 118.100 120.427 -2.327 18016
426 1 1 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.081 0.199 18016
427 1 1 . 1 1 82 82 GLU C C 82 177.800 177.800 178.469 -0.669 18016
428 1 1 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.698 -1.698 18016
429 1 1 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.295 -0.495 18016
430 1 1 . 1 1 82 82 GLU H H 82 8.550 8.550 8.419 0.131 18016
431 1 1 . 1 1 83 83 ARG N N 83 119.900 119.900 118.948 0.952 18016
432 1 1 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.100 -0.070 18016
433 1 1 . 1 1 83 83 ARG C C 83 179.400 179.400 178.994 0.406 18016
434 1 1 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.117 0.783 18016
435 1 1 . 1 1 83 83 ARG CB C 83 29.600 29.600 29.954 -0.354 18016
436 1 1 . 1 1 83 83 ARG H H 83 7.590 7.590 8.216 -0.626 18016
437 1 1 . 1 1 84 84 VAL N N 84 120.400 120.400 120.992 -0.592 18016
438 1 1 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.878 -0.128 18016
439 1 1 . 1 1 84 84 VAL C C 84 177.400 177.400 177.290 0.110 18016
440 1 1 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.777 1.123 18016
441 1 1 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.269 -0.369 18016
442 1 1 . 1 1 84 84 VAL H H 84 7.550 7.550 8.477 -0.927 18016
443 1 1 . 1 1 85 85 ARG N N 85 121.600 121.600 120.258 1.342 18016
444 1 1 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.245 -0.235 18016
445 1 1 . 1 1 85 85 ARG C C 85 178.100 178.100 179.034 -0.934 18016
446 1 1 . 1 1 85 85 ARG CA C 85 60.900 60.900 60.028 0.872 18016
447 1 1 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.977 0.223 18016
448 1 1 . 1 1 85 85 ARG H H 85 9.090 9.090 8.416 0.674 18016
449 1 1 . 1 1 86 86 ARG N N 86 115.600 115.600 118.157 -2.557 18016
450 1 1 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.146 -0.266 18016
451 1 1 . 1 1 86 86 ARG C C 86 179.000 179.000 178.750 0.250 18016
452 1 1 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.969 0.431 18016
453 1 1 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.600 0.800 18016
454 1 1 . 1 1 86 86 ARG H H 86 8.660 8.660 8.497 0.163 18016
455 1 1 . 1 1 87 87 HIS N N 87 118.000 118.000 120.671 -2.671 18016
456 1 1 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.355 0.005 18016
457 1 1 . 1 1 87 87 HIS C C 87 178.400 178.400 177.467 0.933 18016
458 1 1 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.550 0.050 18016
459 1 1 . 1 1 87 87 HIS CB C 87 30.700 30.700 29.995 0.705 18016
460 1 1 . 1 1 87 87 HIS H H 87 7.640 7.640 7.893 -0.253 18016
461 1 1 . 1 1 88 88 LEU N N 88 119.600 119.600 118.689 0.911 18016
462 1 1 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.146 -0.566 18016
463 1 1 . 1 1 88 88 LEU C C 88 180.000 180.000 178.928 1.072 18016
464 1 1 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.092 0.108 18016
465 1 1 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.287 1.313 18016
466 1 1 . 1 1 88 88 LEU H H 88 8.650 8.650 8.694 -0.044 18016
467 1 1 . 1 1 89 89 ALA N N 89 118.500 118.500 122.617 -4.117 18016
468 1 1 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.724 0.636 18016
469 1 1 . 1 1 89 89 ALA C C 89 180.400 180.400 179.942 0.458 18016
470 1 1 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.773 -1.173 18016
471 1 1 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.424 -0.324 18016
472 1 1 . 1 1 89 89 ALA H H 89 8.870 8.870 8.204 0.666 18016
473 1 1 . 1 1 90 90 LEU N N 90 119.400 119.400 117.574 1.826 18016
474 1 1 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.981 0.229 18016
475 1 1 . 1 1 90 90 LEU C C 90 179.100 179.100 179.109 -0.009 18016
476 1 1 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.053 0.447 18016
477 1 1 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.620 0.080 18016
478 1 1 . 1 1 90 90 LEU H H 90 7.390 7.390 7.794 -0.404 18016
479 1 1 . 1 1 91 91 GLN N N 91 114.500 114.500 115.936 -1.436 18016
480 1 1 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.401 0.299 18016
481 1 1 . 1 1 91 91 GLN C C 91 175.800 175.800 176.692 -0.892 18016
482 1 1 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.030 -1.530 18016
483 1 1 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.111 -2.011 18016
484 1 1 . 1 1 91 91 GLN H H 91 7.810 7.810 7.899 -0.089 18016
485 1 1 . 1 1 92 92 GLY N N 92 107.900 107.900 105.990 1.910 18016
486 1 1 . 1 1 92 92 GLY C C 92 172.100 172.100 171.622 0.478 18016
487 1 1 . 1 1 92 92 GLY CA C 92 44.000 44.000 44.961 -0.961 18016
488 1 1 . 1 1 92 92 GLY H H 92 7.710 7.710 8.240 -0.530 18016
489 1 1 . 1 1 93 93 TRP N N 93 114.200 114.200 121.575 -7.375 18016
490 1 1 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.738 1.262 18016
491 1 1 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.723 -1.522 18016
492 1 1 . 1 1 93 93 TRP H H 93 8.450 8.450 8.214 0.236 18016
493 1 1 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.104 0.356 18016
494 1 1 . 1 1 94 94 PRO CA C 94 62.800 62.800 64.240 -1.440 18016
495 1 1 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.128 0.472 18016
496 1 1 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.124 -0.624 18016
497 1 1 . 1 1 95 95 LEU C C 95 175.000 175.000 178.386 -3.386 18016
498 1 1 . 1 1 95 95 LEU CA C 95 56.100 56.100 57.214 -1.114 18016
499 1 1 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.793 1.307 18016
500 1 1 . 1 1 96 96 ASP N N 96 114.000 114.000 119.582 -5.582 18016
501 1 1 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.649 0.301 18016
502 1 1 . 1 1 96 96 ASP C C 96 175.800 175.800 176.491 -0.691 18016
503 1 1 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.398 -2.398 18016
504 1 1 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.858 0.043 18016
505 1 1 . 1 1 96 96 ASP H H 96 7.230 7.230 7.707 -0.477 18016
506 1 1 . 1 1 97 97 ASP N N 97 123.200 123.200 120.272 2.928 18016
507 1 1 . 1 1 97 97 ASP HA H 97 4.610 4.610 5.028 -0.418 18016
508 1 1 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.889 1.611 18016
509 1 1 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.450 -3.749 18016
510 1 1 . 1 1 97 97 ASP H H 97 7.420 7.420 7.885 -0.465 18016
511 1 1 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.716 0.574 18016
512 1 1 . 1 1 98 98 PRO C C 98 177.500 177.500 176.619 0.881 18016
513 1 1 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.065 0.635 18016
514 1 1 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.599 -0.699 18016
515 1 1 . 1 1 99 99 ARG N N 99 121.300 121.300 121.501 -0.201 18016
516 1 1 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.182 -0.472 18016
517 1 1 . 1 1 99 99 ARG C C 99 176.500 176.500 175.845 0.655 18016
518 1 1 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.589 -1.489 18016
519 1 1 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.410 0.090 18016
520 1 1 . 1 1 99 99 ARG H H 99 8.390 8.390 8.209 0.181 18016
521 1 1 . 1 1 100 100 ASP N N 100 119.600 119.600 119.193 0.407 18016
522 1 1 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.663 -0.163 18016
523 1 1 . 1 1 100 100 ASP C C 100 177.000 177.000 175.053 1.947 18016
524 1 1 . 1 1 100 100 ASP CA C 100 54.700 54.700 54.027 0.673 18016
525 1 1 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.274 -1.374 18016
526 1 1 . 1 1 100 100 ASP H H 100 8.260 8.260 7.801 0.459 18016
527 1 1 . 1 1 101 101 GLY N N 101 109.300 109.300 111.078 -1.778 18016
528 1 1 . 1 1 101 101 GLY CA C 101 45.400 45.400 45.059 0.341 18016
529 1 1 . 1 1 101 101 GLY H H 101 8.450 8.450 8.360 0.090 18016
530 1 1 . 1 1 102 102 GLU N N 102 119.800 119.800 121.930 -2.130 18016
531 1 1 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.217 0.093 18016
532 1 1 . 1 1 102 102 GLU CA C 102 56.000 56.000 55.732 0.268 18016
533 1 1 . 1 1 102 102 GLU CB C 102 30.500 30.500 29.015 1.485 18016
534 1 1 . 1 1 102 102 GLU H H 102 8.140 8.140 8.328 -0.188 18016
535 1 1 . 1 1 103 103 GLU N N 103 123.000 123.000 125.811 -2.811 18016
536 1 1 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.405 0.155 18016
537 1 1 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.529 -0.229 18016
538 1 1 . 1 1 103 103 GLU CB C 103 29.600 29.600 30.265 -0.665 18016
539 1 1 . 1 1 103 103 GLU H H 103 8.580 8.580 8.177 0.403 18016
540 1 1 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.495 -0.015 18016
541 1 1 . 1 1 104 104 PRO C C 104 176.800 176.800 175.464 1.336 18016
542 1 1 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.081 0.320 18016
543 1 1 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.445 -0.345 18016
544 1 1 . 1 1 105 105 ASP N N 105 120.400 120.400 119.550 0.850 18016
545 1 1 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.829 -0.249 18016
546 1 1 . 1 1 105 105 ASP C C 105 177.100 177.100 175.040 2.060 18016
547 1 1 . 1 1 105 105 ASP CA C 105 54.300 54.300 53.637 0.663 18016
548 1 1 . 1 1 105 105 ASP CB C 105 41.400 41.400 42.221 -0.821 18016
549 1 1 . 1 1 105 105 ASP H H 105 8.500 8.500 8.752 -0.252 18016
550 1 1 . 1 1 106 106 GLY N N 106 109.300 109.300 112.815 -3.515 18016
551 1 1 . 1 1 106 106 GLY C C 106 174.600 174.600 173.761 0.839 18016
552 1 1 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.291 0.109 18016
553 1 1 . 1 1 106 106 GLY H H 106 8.360 8.360 8.349 0.011 18016
554 1 1 . 1 1 107 107 GLU N N 107 120.400 120.400 122.422 -2.022 18016
555 1 1 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.358 -0.018 18016
556 1 1 . 1 1 107 107 GLU C C 107 177.100 177.100 176.098 1.002 18016
557 1 1 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.941 -0.441 18016
558 1 1 . 1 1 107 107 GLU CB C 107 30.200 30.200 30.285 -0.085 18016
559 1 1 . 1 1 107 107 GLU H H 107 8.410 8.410 8.434 -0.024 18016
560 1 1 . 1 1 108 108 SER N N 108 116.600 116.600 120.097 -3.497 18016
561 1 1 . 1 1 108 108 SER HA H 108 4.450 4.450 4.756 -0.306 18016
562 1 1 . 1 1 108 108 SER C C 108 175.300 175.300 175.024 0.276 18016
563 1 1 . 1 1 108 108 SER CA C 108 58.700 58.700 57.904 0.796 18016
564 1 1 . 1 1 108 108 SER CB C 108 63.800 63.800 63.932 -0.132 18016
565 1 1 . 1 1 108 108 SER H H 108 8.460 8.460 8.567 -0.107 18016
566 1 1 . 1 1 109 109 GLY N N 109 110.800 110.800 113.280 -2.480 18016
567 1 1 . 1 1 109 109 GLY C C 109 174.500 174.500 174.734 -0.234 18016
568 1 1 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.455 0.845 18016
569 1 1 . 1 1 109 109 GLY H H 109 8.500 8.500 8.621 -0.121 18016
570 1 1 . 1 1 110 110 GLY N N 110 108.800 108.800 108.944 -0.144 18016
571 1 1 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.054 -0.654 18016
572 1 1 . 1 1 110 110 GLY H H 110 8.140 8.140 8.805 -0.665 18016
573 1 1 . 1 1 111 111 PRO HA H 111 4.610 4.610 5.303 -0.693 18016
574 1 1 . 1 1 111 111 PRO C C 111 176.000 176.000 177.277 -1.277 18016
575 1 1 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.739 -0.139 18016
576 1 1 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.495 2.105 18016
577 1 2 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.568 -0.138 18016
578 1 2 . 1 1 2 2 PRO C C 2 177.600 177.600 177.662 -0.062 18016
579 1 2 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.707 0.593 18016
580 1 2 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.492 -0.193 18016
581 1 2 . 1 1 3 3 GLY N N 3 110.000 110.000 110.111 -0.111 18016
582 1 2 . 1 1 3 3 GLY C C 3 174.200 174.200 173.405 0.795 18016
583 1 2 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.243 0.157 18016
584 1 2 . 1 1 3 3 GLY H H 3 8.700 8.700 8.427 0.273 18016
585 1 2 . 1 1 4 4 SER N N 4 115.400 115.400 120.587 -5.187 18016
586 1 2 . 1 1 4 4 SER HA H 4 4.440 4.440 5.090 -0.650 18016
587 1 2 . 1 1 4 4 SER C C 4 174.800 174.800 174.199 0.601 18016
588 1 2 . 1 1 4 4 SER CA C 4 58.400 58.400 56.828 1.572 18016
589 1 2 . 1 1 4 4 SER CB C 4 63.800 63.800 64.779 -0.979 18016
590 1 2 . 1 1 4 4 SER H H 4 8.210 8.210 8.052 0.158 18016
591 1 2 . 1 1 5 5 MET N N 5 122.200 122.200 122.544 -0.344 18016
592 1 2 . 1 1 5 5 MET HA H 5 4.510 4.510 4.729 -0.219 18016
593 1 2 . 1 1 5 5 MET CA C 5 55.600 55.600 56.007 -0.407 18016
594 1 2 . 1 1 5 5 MET CB C 5 32.900 32.900 33.501 -0.601 18016
595 1 2 . 1 1 5 5 MET H H 5 8.570 8.570 9.225 -0.655 18016
596 1 2 . 1 1 6 6 VAL N N 6 120.000 120.000 118.677 1.323 18016
597 1 2 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.117 -0.067 18016
598 1 2 . 1 1 6 6 VAL C C 6 175.700 175.700 175.654 0.046 18016
599 1 2 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.144 1.556 18016
600 1 2 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.344 0.156 18016
601 1 2 . 1 1 6 6 VAL H H 6 8.150 8.150 7.856 0.294 18016
602 1 2 . 1 1 7 7 ASN N N 7 122.000 122.000 118.348 3.652 18016
603 1 2 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.589 0.071 18016
604 1 2 . 1 1 7 7 ASN C C 7 175.200 175.200 176.787 -1.587 18016
605 1 2 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.011 -0.811 18016
606 1 2 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.604 -0.704 18016
607 1 2 . 1 1 7 7 ASN H H 7 8.010 8.010 8.344 -0.334 18016
608 1 2 . 1 1 8 8 ALA N N 8 126.500 126.500 123.974 2.526 18016
609 1 2 . 1 1 8 8 ALA C C 8 180.200 180.200 179.265 0.935 18016
610 1 2 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.439 0.061 18016
611 1 2 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.711 -0.311 18016
612 1 2 . 1 1 8 8 ALA H H 8 9.020 9.020 8.555 0.465 18016
613 1 2 . 1 1 9 9 PHE N N 9 121.300 121.300 117.688 3.612 18016
614 1 2 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.093 0.197 18016
615 1 2 . 1 1 9 9 PHE C C 9 177.200 177.200 177.145 0.055 18016
616 1 2 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.606 -0.306 18016
617 1 2 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.802 0.398 18016
618 1 2 . 1 1 9 9 PHE H H 9 8.570 8.570 8.391 0.179 18016
619 1 2 . 1 1 10 10 LEU N N 10 117.200 117.200 118.824 -1.624 18016
620 1 2 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.923 -0.223 18016
621 1 2 . 1 1 10 10 LEU C C 10 179.700 179.700 178.952 0.748 18016
622 1 2 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.632 -0.032 18016
623 1 2 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.377 0.323 18016
624 1 2 . 1 1 10 10 LEU H H 10 8.150 8.150 8.001 0.149 18016
625 1 2 . 1 1 11 11 ALA N N 11 121.500 121.500 122.018 -0.518 18016
626 1 2 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.926 0.094 18016
627 1 2 . 1 1 11 11 ALA C C 11 180.900 180.900 179.354 1.546 18016
628 1 2 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.254 -0.254 18016
629 1 2 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.051 -0.051 18016
630 1 2 . 1 1 11 11 ALA H H 11 8.460 8.460 8.685 -0.225 18016
631 1 2 . 1 1 12 12 LYS N N 12 120.700 120.700 119.435 1.265 18016
632 1 2 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.011 0.039 18016
633 1 2 . 1 1 12 12 LYS C C 12 179.700 179.700 178.829 0.871 18016
634 1 2 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.432 -0.232 18016
635 1 2 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.414 -0.814 18016
636 1 2 . 1 1 12 12 LYS H H 12 7.820 7.820 7.895 -0.075 18016
637 1 2 . 1 1 13 13 ILE N N 13 120.100 120.100 119.625 0.475 18016
638 1 2 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.840 -0.150 18016
639 1 2 . 1 1 13 13 ILE C C 13 178.100 178.100 178.051 0.049 18016
640 1 2 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.508 -0.507 18016
641 1 2 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.639 -1.239 18016
642 1 2 . 1 1 13 13 ILE H H 13 7.640 7.640 7.869 -0.229 18016
643 1 2 . 1 1 14 14 ALA N N 14 122.700 122.700 122.204 0.496 18016
644 1 2 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.921 -0.061 18016
645 1 2 . 1 1 14 14 ALA C C 14 179.000 179.000 179.585 -0.585 18016
646 1 2 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.436 0.564 18016
647 1 2 . 1 1 14 14 ALA CB C 14 18.000 18.000 17.979 0.021 18016
648 1 2 . 1 1 14 14 ALA H H 14 8.680 8.680 8.401 0.279 18016
649 1 2 . 1 1 15 15 ALA N N 15 118.700 118.700 121.676 -2.976 18016
650 1 2 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.091 -0.001 18016
651 1 2 . 1 1 15 15 ALA C C 15 180.400 180.400 178.854 1.546 18016
652 1 2 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.690 0.310 18016
653 1 2 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.445 -0.745 18016
654 1 2 . 1 1 15 15 ALA H H 15 8.070 8.070 8.072 -0.002 18016
655 1 2 . 1 1 16 16 TRP N N 16 122.900 122.900 121.598 1.302 18016
656 1 2 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.263 0.297 18016
657 1 2 . 1 1 16 16 TRP C C 16 178.400 178.400 177.868 0.532 18016
658 1 2 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.348 -1.748 18016
659 1 2 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.086 -0.786 18016
660 1 2 . 1 1 16 16 TRP H H 16 7.820 7.820 8.215 -0.395 18016
661 1 2 . 1 1 17 17 LEU N N 17 120.400 120.400 119.077 1.323 18016
662 1 2 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.151 0.459 18016
663 1 2 . 1 1 17 17 LEU C C 17 179.000 179.000 178.773 0.227 18016
664 1 2 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.923 -0.023 18016
665 1 2 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.517 0.483 18016
666 1 2 . 1 1 17 17 LEU H H 17 8.630 8.630 8.601 0.029 18016
667 1 2 . 1 1 18 18 ASN N N 18 116.200 116.200 116.939 -0.739 18016
668 1 2 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.600 -0.290 18016
669 1 2 . 1 1 18 18 ASN C C 18 177.100 177.100 176.907 0.193 18016
670 1 2 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.680 -0.080 18016
671 1 2 . 1 1 18 18 ASN CB C 18 39.200 39.200 39.045 0.155 18016
672 1 2 . 1 1 18 18 ASN H H 18 8.350 8.350 8.212 0.138 18016
673 1 2 . 1 1 19 19 ALA N N 19 119.600 119.600 120.825 -1.225 18016
674 1 2 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.178 -0.088 18016
675 1 2 . 1 1 19 19 ALA C C 19 180.100 180.100 179.144 0.956 18016
676 1 2 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.234 -0.034 18016
677 1 2 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.628 -1.028 18016
678 1 2 . 1 1 19 19 ALA H H 19 7.920 7.920 8.116 -0.196 18016
679 1 2 . 1 1 20 20 GLY N N 20 103.500 103.500 106.435 -2.935 18016
680 1 2 . 1 1 20 20 GLY C C 20 173.800 173.800 174.372 -0.572 18016
681 1 2 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.552 0.248 18016
682 1 2 . 1 1 20 20 GLY H H 20 7.700 7.700 7.418 0.282 18016
683 1 2 . 1 1 21 21 TYR N N 21 119.900 119.900 118.263 1.637 18016
684 1 2 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.974 0.196 18016
685 1 2 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.833 1.567 18016
686 1 2 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.370 -0.570 18016
687 1 2 . 1 1 21 21 TYR H H 21 7.980 7.980 7.981 -0.001 18016
688 1 2 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.561 -0.061 18016
689 1 2 . 1 1 22 22 PRO C C 22 178.700 178.700 176.917 1.783 18016
690 1 2 . 1 1 22 22 PRO CA C 22 65.000 65.000 63.990 1.010 18016
691 1 2 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.180 -0.180 18016
692 1 2 . 1 1 23 23 GLU N N 23 116.300 116.300 118.096 -1.796 18016
693 1 2 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.458 0.112 18016
694 1 2 . 1 1 23 23 GLU C C 23 176.300 176.300 176.384 -0.084 18016
695 1 2 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.621 -1.021 18016
696 1 2 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.463 0.037 18016
697 1 2 . 1 1 23 23 GLU H H 23 8.680 8.680 8.470 0.210 18016
698 1 2 . 1 1 24 24 GLY N N 24 108.100 108.100 107.743 0.357 18016
699 1 2 . 1 1 24 24 GLY C C 24 173.100 173.100 172.671 0.429 18016
700 1 2 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.548 -1.648 18016
701 1 2 . 1 1 24 24 GLY H H 24 7.230 7.230 7.517 -0.287 18016
702 1 2 . 1 1 25 25 VAL N N 25 121.500 121.500 119.379 2.121 18016
703 1 2 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.940 -0.350 18016
704 1 2 . 1 1 25 25 VAL CA C 25 59.300 59.300 57.923 1.377 18016
705 1 2 . 1 1 25 25 VAL CB C 25 32.100 32.100 33.638 -1.538 18016
706 1 2 . 1 1 25 25 VAL H H 25 8.050 8.050 8.074 -0.024 18016
707 1 2 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.464 -0.144 18016
708 1 2 . 1 1 26 26 PRO C C 26 177.600 177.600 178.054 -0.454 18016
709 1 2 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.369 0.531 18016
710 1 2 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.250 -0.150 18016
711 1 2 . 1 1 27 27 GLY N N 27 109.000 109.000 108.947 0.053 18016
712 1 2 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.531 1.569 18016
713 1 2 . 1 1 27 27 GLY H H 27 8.930 8.930 8.814 0.116 18016
714 1 2 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.321 0.069 18016
715 1 2 . 1 1 28 28 PRO C C 28 175.800 175.800 176.220 -0.420 18016
716 1 2 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.041 0.359 18016
717 1 2 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.410 0.490 18016
718 1 2 . 1 1 29 29 ASP N N 29 115.000 115.000 117.902 -2.902 18016
719 1 2 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.752 -0.262 18016
720 1 2 . 1 1 29 29 ASP C C 29 177.000 177.000 177.951 -0.951 18016
721 1 2 . 1 1 29 29 ASP CA C 29 53.900 53.900 56.100 -2.200 18016
722 1 2 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.660 -0.960 18016
723 1 2 . 1 1 29 29 ASP H H 29 7.760 7.760 7.623 0.137 18016
724 1 2 . 1 1 30 30 ARG N N 30 119.900 119.900 121.685 -1.785 18016
725 1 2 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.949 -0.379 18016
726 1 2 . 1 1 30 30 ARG C C 30 176.500 176.500 178.677 -2.177 18016
727 1 2 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.757 2.143 18016
728 1 2 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.303 0.197 18016
729 1 2 . 1 1 30 30 ARG H H 30 7.460 7.460 8.220 -0.760 18016
730 1 2 . 1 1 31 31 VAL N N 31 117.600 117.600 119.465 -1.865 18016
731 1 2 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.939 -0.119 18016
732 1 2 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.024 0.676 18016
733 1 2 . 1 1 31 31 VAL CB C 31 28.800 28.800 28.622 0.178 18016
734 1 2 . 1 1 31 31 VAL H H 31 9.080 9.080 8.296 0.784 18016
735 1 2 . 1 1 32 32 PRO C C 32 177.000 177.000 179.038 -2.038 18016
736 1 2 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.778 -0.577 18016
737 1 2 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.242 -0.442 18016
738 1 2 . 1 1 33 33 LEU N N 33 115.200 115.200 120.997 -5.797 18016
739 1 2 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.111 0.009 18016
740 1 2 . 1 1 33 33 LEU C C 33 178.600 178.600 178.532 0.068 18016
741 1 2 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.041 0.359 18016
742 1 2 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.342 0.158 18016
743 1 2 . 1 1 33 33 LEU H H 33 8.010 8.010 8.146 -0.136 18016
744 1 2 . 1 1 34 34 LEU N N 34 120.400 120.400 119.083 1.317 18016
745 1 2 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.055 -0.125 18016
746 1 2 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.506 0.594 18016
747 1 2 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.340 0.560 18016
748 1 2 . 1 1 34 34 LEU H H 34 8.220 8.220 8.339 -0.119 18016
749 1 2 . 1 1 35 35 ALA N N 35 123.100 123.100 122.904 0.196 18016
750 1 2 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.069 -0.029 18016
751 1 2 . 1 1 35 35 ALA C C 35 179.500 179.500 179.487 0.013 18016
752 1 2 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.036 0.464 18016
753 1 2 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.475 -0.575 18016
754 1 2 . 1 1 35 35 ALA H H 35 8.560 8.560 8.079 0.481 18016
755 1 2 . 1 1 36 36 LEU N N 36 117.600 117.600 118.627 -1.027 18016
756 1 2 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.269 -0.149 18016
757 1 2 . 1 1 36 36 LEU C C 36 180.100 180.100 179.234 0.866 18016
758 1 2 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.296 0.904 18016
759 1 2 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.741 1.059 18016
760 1 2 . 1 1 36 36 LEU H H 36 7.850 7.850 8.059 -0.209 18016
761 1 2 . 1 1 37 37 LEU N N 37 116.700 116.700 120.613 -3.913 18016
762 1 2 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.080 0.020 18016
763 1 2 . 1 1 37 37 LEU C C 37 180.100 180.100 178.451 1.649 18016
764 1 2 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.085 0.215 18016
765 1 2 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.201 -0.001 18016
766 1 2 . 1 1 37 37 LEU H H 37 8.730 8.730 8.329 0.401 18016
767 1 2 . 1 1 38 38 THR N N 38 110.600 110.600 109.672 0.928 18016
768 1 2 . 1 1 38 38 THR HA H 38 4.440 4.440 4.079 0.361 18016
769 1 2 . 1 1 38 38 THR C C 38 175.100 175.100 175.691 -0.591 18016
770 1 2 . 1 1 38 38 THR CA C 38 64.200 64.200 64.550 -0.350 18016
771 1 2 . 1 1 38 38 THR CB C 38 70.000 70.000 68.379 1.621 18016
772 1 2 . 1 1 38 38 THR H H 38 8.660 8.660 8.454 0.206 18016
773 1 2 . 1 1 39 39 ARG N N 39 118.000 118.000 121.336 -3.336 18016
774 1 2 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.161 0.119 18016
775 1 2 . 1 1 39 39 ARG C C 39 177.300 177.300 177.840 -0.540 18016
776 1 2 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.162 0.138 18016
777 1 2 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.954 0.246 18016
778 1 2 . 1 1 39 39 ARG H H 39 7.180 7.180 7.517 -0.337 18016
779 1 2 . 1 1 40 40 ARG N N 40 114.400 114.400 115.594 -1.194 18016
780 1 2 . 1 1 40 40 ARG C C 40 174.800 174.800 175.986 -1.186 18016
781 1 2 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.043 -0.743 18016
782 1 2 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.734 2.866 18016
783 1 2 . 1 1 40 40 ARG H H 40 7.520 7.520 7.610 -0.090 18016
784 1 2 . 1 1 41 41 LEU N N 41 119.400 119.400 120.642 -1.242 18016
785 1 2 . 1 1 41 41 LEU C C 41 177.100 177.100 177.013 0.087 18016
786 1 2 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.373 -0.673 18016
787 1 2 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.521 0.879 18016
788 1 2 . 1 1 41 41 LEU H H 41 8.380 8.380 7.408 0.972 18016
789 1 2 . 1 1 42 42 THR N N 42 112.000 112.000 114.443 -2.443 18016
790 1 2 . 1 1 42 42 THR HA H 42 4.440 4.440 4.372 0.068 18016
791 1 2 . 1 1 42 42 THR C C 42 175.800 175.800 175.832 -0.032 18016
792 1 2 . 1 1 42 42 THR CA C 42 60.500 60.500 60.914 -0.414 18016
793 1 2 . 1 1 42 42 THR CB C 42 70.800 70.800 70.075 0.725 18016
794 1 2 . 1 1 42 42 THR H H 42 9.330 9.330 9.032 0.298 18016
795 1 2 . 1 1 43 43 ASN N N 43 119.900 119.900 119.639 0.261 18016
796 1 2 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.336 -0.086 18016
797 1 2 . 1 1 43 43 ASN C C 43 177.900 177.900 177.110 0.790 18016
798 1 2 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.965 -1.264 18016
799 1 2 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.033 -0.833 18016
800 1 2 . 1 1 43 43 ASN H H 43 9.140 9.140 8.781 0.359 18016
801 1 2 . 1 1 44 44 ASP N N 44 118.000 118.000 118.825 -0.825 18016
802 1 2 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.407 -0.007 18016
803 1 2 . 1 1 44 44 ASP C C 44 179.600 179.600 178.705 0.895 18016
804 1 2 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.247 0.053 18016
805 1 2 . 1 1 44 44 ASP H H 44 8.360 8.360 8.768 -0.408 18016
806 1 2 . 1 1 45 45 GLU N N 45 122.600 122.600 120.659 1.941 18016
807 1 2 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.071 -0.101 18016
808 1 2 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.133 0.267 18016
809 1 2 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.810 0.490 18016
810 1 2 . 1 1 45 45 GLU H H 45 7.850 7.850 7.686 0.164 18016
811 1 2 . 1 1 46 46 ILE N N 46 118.900 118.900 120.475 -1.575 18016
812 1 2 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.727 -0.297 18016
813 1 2 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.181 1.819 18016
814 1 2 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.742 -0.042 18016
815 1 2 . 1 1 46 46 ILE H H 46 8.290 8.290 8.174 0.116 18016
816 1 2 . 1 1 47 47 LYS N N 47 118.900 118.900 119.583 -0.683 18016
817 1 2 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.904 -0.034 18016
818 1 2 . 1 1 47 47 LYS C C 47 178.400 178.400 178.849 -0.449 18016
819 1 2 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.734 0.566 18016
820 1 2 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.091 0.509 18016
821 1 2 . 1 1 47 47 LYS H H 47 8.290 8.290 8.165 0.125 18016
822 1 2 . 1 1 48 48 ALA N N 48 121.100 121.100 122.930 -1.830 18016
823 1 2 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.947 0.223 18016
824 1 2 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.200 -0.100 18016
825 1 2 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.170 -0.170 18016
826 1 2 . 1 1 48 48 ALA H H 48 7.710 7.710 8.133 -0.423 18016
827 1 2 . 1 1 49 49 ILE N N 49 119.900 119.900 117.870 2.030 18016
828 1 2 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.705 -0.055 18016
829 1 2 . 1 1 49 49 ILE C C 49 177.300 177.300 178.031 -0.731 18016
830 1 2 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.199 1.801 18016
831 1 2 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.268 1.832 18016
832 1 2 . 1 1 49 49 ILE H H 49 8.130 8.130 8.244 -0.114 18016
833 1 2 . 1 1 50 50 ALA N N 50 122.000 122.000 122.245 -0.245 18016
834 1 2 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.919 -0.059 18016
835 1 2 . 1 1 50 50 ALA C C 50 179.800 179.800 179.729 0.071 18016
836 1 2 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.175 0.525 18016
837 1 2 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.216 -0.316 18016
838 1 2 . 1 1 50 50 ALA H H 50 8.730 8.730 7.891 0.839 18016
839 1 2 . 1 1 51 51 GLU N N 51 116.900 116.900 118.528 -1.628 18016
840 1 2 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.867 0.153 18016
841 1 2 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.364 0.036 18016
842 1 2 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.186 0.313 18016
843 1 2 . 1 1 51 51 GLU H H 51 8.220 8.220 8.369 -0.149 18016
844 1 2 . 1 1 52 52 ASP N N 52 120.300 120.300 120.087 0.213 18016
845 1 2 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.365 0.025 18016
846 1 2 . 1 1 52 52 ASP C C 52 178.900 178.900 178.700 0.200 18016
847 1 2 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.202 0.298 18016
848 1 2 . 1 1 52 52 ASP CB C 52 42.500 42.500 40.830 1.670 18016
849 1 2 . 1 1 52 52 ASP H H 52 7.700 7.700 8.186 -0.486 18016
850 1 2 . 1 1 53 53 LEU N N 53 118.300 118.300 119.214 -0.914 18016
851 1 2 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.587 0.143 18016
852 1 2 . 1 1 53 53 LEU C C 53 179.000 179.000 178.981 0.019 18016
853 1 2 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.423 0.077 18016
854 1 2 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.137 -0.037 18016
855 1 2 . 1 1 53 53 LEU H H 53 8.290 8.290 7.325 0.965 18016
856 1 2 . 1 1 54 54 GLU N N 54 118.700 118.700 118.741 -0.041 18016
857 1 2 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.052 0.168 18016
858 1 2 . 1 1 54 54 GLU C C 54 178.200 178.200 178.666 -0.466 18016
859 1 2 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.858 -0.157 18016
860 1 2 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.339 0.561 18016
861 1 2 . 1 1 54 54 GLU H H 54 8.070 8.070 8.216 -0.146 18016
862 1 2 . 1 1 55 55 LYS N N 55 117.700 117.700 116.636 1.064 18016
863 1 2 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.198 -0.048 18016
864 1 2 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.900 0.400 18016
865 1 2 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.549 0.151 18016
866 1 2 . 1 1 55 55 LYS H H 55 7.750 7.750 7.904 -0.154 18016
867 1 2 . 1 1 56 56 ARG N N 56 117.100 117.100 117.797 -0.697 18016
868 1 2 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.191 0.079 18016
869 1 2 . 1 1 56 56 ARG CA C 56 56.800 56.800 58.571 -1.771 18016
870 1 2 . 1 1 56 56 ARG CB C 56 31.000 31.000 30.954 0.046 18016
871 1 2 . 1 1 56 56 ARG H H 56 8.270 8.270 7.640 0.630 18016
872 1 2 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.458 -0.098 18016
873 1 2 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.838 -0.738 18016
874 1 2 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.150 -0.950 18016
875 1 2 . 1 1 58 58 HIS HA H 58 4.510 4.510 5.023 -0.513 18016
876 1 2 . 1 1 58 58 HIS CA C 58 56.200 56.200 56.179 0.021 18016
877 1 2 . 1 1 58 58 HIS CB C 58 27.300 27.300 30.184 -2.885 18016
878 1 2 . 1 1 59 59 PHE N N 59 120.400 120.400 124.568 -4.168 18016
879 1 2 . 1 1 59 59 PHE C C 59 175.500 175.500 176.272 -0.772 18016
880 1 2 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.449 -0.249 18016
881 1 2 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.585 -0.285 18016
882 1 2 . 1 1 59 59 PHE H H 59 7.710 7.710 8.780 -1.070 18016
883 1 2 . 1 1 60 60 ASP N N 60 120.800 120.800 119.082 1.718 18016
884 1 2 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.628 -0.138 18016
885 1 2 . 1 1 60 60 ASP CA C 60 54.300 54.300 54.254 0.046 18016
886 1 2 . 1 1 60 60 ASP CB C 60 41.100 41.100 42.271 -1.171 18016
887 1 2 . 1 1 60 60 ASP H H 60 8.180 8.180 8.360 -0.180 18016
888 1 2 . 1 1 61 61 HIS N N 61 118.300 118.300 117.015 1.285 18016
889 1 2 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.498 -0.108 18016
890 1 2 . 1 1 61 61 HIS CA C 61 56.700 56.700 56.020 0.680 18016
891 1 2 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.316 -0.516 18016
892 1 2 . 1 1 61 61 HIS H H 61 8.550 8.550 8.680 -0.130 18016
893 1 2 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.067 -0.057 18016
894 1 2 . 1 1 62 62 ILE C C 62 173.800 173.800 175.965 -2.165 18016
895 1 2 . 1 1 62 62 ILE CA C 62 66.500 66.500 61.197 5.303 18016
896 1 2 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.102 2.998 18016
897 1 2 . 1 1 63 63 ASP N N 63 125.100 125.100 122.372 2.728 18016
898 1 2 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.321 0.279 18016
899 1 2 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.361 -2.561 18016
900 1 2 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.444 -0.944 18016
901 1 2 . 1 1 63 63 ASP H H 63 8.360 8.360 7.641 0.719 18016
902 1 2 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.783 -0.113 18016
903 1 2 . 1 1 64 64 ILE C C 64 177.000 177.000 176.846 0.154 18016
904 1 2 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.702 -1.602 18016
905 1 2 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.318 -1.718 18016
906 1 2 . 1 1 65 65 GLY N N 65 107.600 107.600 107.071 0.529 18016
907 1 2 . 1 1 65 65 GLY C C 65 177.000 177.000 176.080 0.920 18016
908 1 2 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.987 0.313 18016
909 1 2 . 1 1 65 65 GLY H H 65 8.440 8.440 7.994 0.446 18016
910 1 2 . 1 1 66 66 VAL N N 66 121.800 121.800 121.971 -0.171 18016
911 1 2 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.768 -0.008 18016
912 1 2 . 1 1 66 66 VAL C C 66 178.500 178.500 177.726 0.774 18016
913 1 2 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.399 0.201 18016
914 1 2 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.204 0.796 18016
915 1 2 . 1 1 66 66 VAL H H 66 7.550 7.550 7.771 -0.221 18016
916 1 2 . 1 1 67 67 LEU N N 67 120.900 120.900 119.006 1.894 18016
917 1 2 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.059 0.011 18016
918 1 2 . 1 1 67 67 LEU C C 67 179.000 179.000 179.464 -0.464 18016
919 1 2 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.734 -0.134 18016
920 1 2 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.385 1.915 18016
921 1 2 . 1 1 67 67 LEU H H 67 7.650 7.650 7.511 0.139 18016
922 1 2 . 1 1 68 68 ILE N N 68 118.900 118.900 118.952 -0.052 18016
923 1 2 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.789 -0.079 18016
924 1 2 . 1 1 68 68 ILE C C 68 179.500 179.500 178.235 1.265 18016
925 1 2 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.980 0.220 18016
926 1 2 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.332 0.168 18016
927 1 2 . 1 1 68 68 ILE H H 68 8.580 8.580 7.378 1.202 18016
928 1 2 . 1 1 69 69 THR N N 69 118.100 118.100 113.825 4.275 18016
929 1 2 . 1 1 69 69 THR HA H 69 3.940 3.940 4.047 -0.107 18016
930 1 2 . 1 1 69 69 THR C C 69 176.200 176.200 176.246 -0.046 18016
931 1 2 . 1 1 69 69 THR CA C 69 66.600 66.600 66.259 0.341 18016
932 1 2 . 1 1 69 69 THR CB C 69 68.500 68.500 68.091 0.409 18016
933 1 2 . 1 1 69 69 THR H H 69 7.840 7.840 7.592 0.248 18016
934 1 2 . 1 1 70 70 GLN N N 70 121.600 121.600 120.058 1.542 18016
935 1 2 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.200 -0.090 18016
936 1 2 . 1 1 70 70 GLN C C 70 178.100 178.100 177.952 0.148 18016
937 1 2 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.642 0.459 18016
938 1 2 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.660 -0.360 18016
939 1 2 . 1 1 70 70 GLN H H 70 8.100 8.100 7.283 0.817 18016
940 1 2 . 1 1 71 71 MET N N 71 118.700 118.700 118.190 0.510 18016
941 1 2 . 1 1 71 71 MET HA H 71 4.010 4.010 4.377 -0.367 18016
942 1 2 . 1 1 71 71 MET C C 71 176.300 176.300 178.115 -1.815 18016
943 1 2 . 1 1 71 71 MET CA C 71 58.100 58.100 58.911 -0.811 18016
944 1 2 . 1 1 71 71 MET CB C 71 33.600 33.600 32.771 0.829 18016
945 1 2 . 1 1 71 71 MET H H 71 8.350 8.350 8.453 -0.103 18016
946 1 2 . 1 1 72 72 THR N N 72 111.600 111.600 110.849 0.751 18016
947 1 2 . 1 1 72 72 THR HA H 72 3.940 3.940 4.099 -0.159 18016
948 1 2 . 1 1 72 72 THR C C 72 175.800 175.800 175.521 0.279 18016
949 1 2 . 1 1 72 72 THR CA C 72 65.300 65.300 65.216 0.084 18016
950 1 2 . 1 1 72 72 THR CB C 72 69.100 69.100 69.147 -0.047 18016
951 1 2 . 1 1 72 72 THR H H 72 7.840 7.840 7.859 -0.019 18016
952 1 2 . 1 1 73 73 ASP N N 73 121.100 121.100 119.045 2.055 18016
953 1 2 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.679 -0.149 18016
954 1 2 . 1 1 73 73 ASP C C 73 176.600 176.600 176.182 0.418 18016
955 1 2 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.576 0.624 18016
956 1 2 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.433 -1.033 18016
957 1 2 . 1 1 73 73 ASP H H 73 7.840 7.840 7.621 0.219 18016
958 1 2 . 1 1 74 74 GLU N N 74 121.100 121.100 119.366 1.734 18016
959 1 2 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.591 -0.251 18016
960 1 2 . 1 1 74 74 GLU C C 74 173.800 173.800 175.231 -1.431 18016
961 1 2 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.506 -0.006 18016
962 1 2 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.155 -0.555 18016
963 1 2 . 1 1 74 74 GLU H H 74 7.980 7.980 8.408 -0.428 18016
964 1 2 . 1 1 75 75 MET N N 75 125.800 125.800 126.025 -0.225 18016
965 1 2 . 1 1 75 75 MET HA H 75 4.710 4.710 4.815 -0.105 18016
966 1 2 . 1 1 75 75 MET CA C 75 53.800 53.800 54.595 -0.795 18016
967 1 2 . 1 1 75 75 MET CB C 75 31.700 31.700 31.747 -0.047 18016
968 1 2 . 1 1 75 75 MET H H 75 8.380 8.380 8.537 -0.157 18016
969 1 2 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.447 0.063 18016
970 1 2 . 1 1 76 76 PRO C C 76 175.700 175.700 176.340 -0.640 18016
971 1 2 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.900 -1.900 18016
972 1 2 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.337 -0.536 18016
973 1 2 . 1 1 77 77 ARG N N 77 119.700 119.700 117.061 2.639 18016
974 1 2 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.538 -0.268 18016
975 1 2 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.258 0.542 18016
976 1 2 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.379 -1.679 18016
977 1 2 . 1 1 77 77 ARG H H 77 8.940 8.940 7.780 1.160 18016
978 1 2 . 1 1 78 78 GLU N N 78 124.700 124.700 123.728 0.972 18016
979 1 2 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.980 -0.020 18016
980 1 2 . 1 1 78 78 GLU C C 78 179.000 179.000 178.054 0.946 18016
981 1 2 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.589 0.211 18016
982 1 2 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.688 -0.688 18016
983 1 2 . 1 1 78 78 GLU H H 78 9.170 9.170 8.840 0.330 18016
984 1 2 . 1 1 79 79 GLU N N 79 116.800 116.800 120.495 -3.695 18016
985 1 2 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.104 0.016 18016
986 1 2 . 1 1 79 79 GLU C C 79 179.100 179.100 178.261 0.839 18016
987 1 2 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.758 -0.058 18016
988 1 2 . 1 1 79 79 GLU CB C 79 29.000 29.000 28.875 0.124 18016
989 1 2 . 1 1 79 79 GLU H H 79 9.660 9.660 8.677 0.983 18016
990 1 2 . 1 1 80 80 ASP N N 80 120.000 120.000 118.380 1.620 18016
991 1 2 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.403 0.287 18016
992 1 2 . 1 1 80 80 ASP C C 80 177.300 177.300 178.916 -1.616 18016
993 1 2 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.228 0.172 18016
994 1 2 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.138 1.462 18016
995 1 2 . 1 1 80 80 ASP H H 80 7.310 7.310 8.341 -1.031 18016
996 1 2 . 1 1 81 81 ILE N N 81 120.100 120.100 120.072 0.028 18016
997 1 2 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.679 -0.189 18016
998 1 2 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.821 0.479 18016
999 1 2 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.874 0.426 18016
1000 1 2 . 1 1 81 81 ILE H H 81 7.610 7.610 8.278 -0.668 18016
1001 1 2 . 1 1 82 82 GLU N N 82 118.100 118.100 120.232 -2.132 18016
1002 1 2 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.056 0.224 18016
1003 1 2 . 1 1 82 82 GLU C C 82 177.800 177.800 178.833 -1.033 18016
1004 1 2 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.657 -1.657 18016
1005 1 2 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.266 -0.466 18016
1006 1 2 . 1 1 82 82 GLU H H 82 8.550 8.550 8.404 0.146 18016
1007 1 2 . 1 1 83 83 ARG N N 83 119.900 119.900 119.493 0.407 18016
1008 1 2 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.013 0.017 18016
1009 1 2 . 1 1 83 83 ARG C C 83 179.400 179.400 179.024 0.376 18016
1010 1 2 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.738 0.162 18016
1011 1 2 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.304 -0.704 18016
1012 1 2 . 1 1 83 83 ARG H H 83 7.590 7.590 8.078 -0.488 18016
1013 1 2 . 1 1 84 84 VAL N N 84 120.400 120.400 119.982 0.418 18016
1014 1 2 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.805 -0.055 18016
1015 1 2 . 1 1 84 84 VAL C C 84 177.400 177.400 177.468 -0.068 18016
1016 1 2 . 1 1 84 84 VAL CA C 84 66.900 66.900 66.027 0.873 18016
1017 1 2 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.050 -0.150 18016
1018 1 2 . 1 1 84 84 VAL H H 84 7.550 7.550 8.511 -0.961 18016
1019 1 2 . 1 1 85 85 ARG N N 85 121.600 121.600 119.276 2.324 18016
1020 1 2 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.334 -0.324 18016
1021 1 2 . 1 1 85 85 ARG C C 85 178.100 178.100 178.674 -0.574 18016
1022 1 2 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.804 1.096 18016
1023 1 2 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.922 0.278 18016
1024 1 2 . 1 1 85 85 ARG H H 85 9.090 9.090 8.451 0.639 18016
1025 1 2 . 1 1 86 86 ARG N N 86 115.600 115.600 118.440 -2.840 18016
1026 1 2 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.100 -0.220 18016
1027 1 2 . 1 1 86 86 ARG C C 86 179.000 179.000 178.847 0.153 18016
1028 1 2 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.937 0.463 18016
1029 1 2 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.626 0.774 18016
1030 1 2 . 1 1 86 86 ARG H H 86 8.660 8.660 8.506 0.154 18016
1031 1 2 . 1 1 87 87 HIS N N 87 118.000 118.000 119.541 -1.541 18016
1032 1 2 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.403 -0.043 18016
1033 1 2 . 1 1 87 87 HIS C C 87 178.400 178.400 177.351 1.049 18016
1034 1 2 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.355 0.245 18016
1035 1 2 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.227 0.473 18016
1036 1 2 . 1 1 87 87 HIS H H 87 7.640 7.640 7.935 -0.295 18016
1037 1 2 . 1 1 88 88 LEU N N 88 119.600 119.600 119.537 0.063 18016
1038 1 2 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.153 -0.573 18016
1039 1 2 . 1 1 88 88 LEU C C 88 180.000 180.000 178.829 1.171 18016
1040 1 2 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.075 0.125 18016
1041 1 2 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.262 1.338 18016
1042 1 2 . 1 1 88 88 LEU H H 88 8.650 8.650 8.601 0.049 18016
1043 1 2 . 1 1 89 89 ALA N N 89 118.500 118.500 122.343 -3.843 18016
1044 1 2 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.662 0.698 18016
1045 1 2 . 1 1 89 89 ALA C C 89 180.400 180.400 179.536 0.864 18016
1046 1 2 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.944 -1.344 18016
1047 1 2 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.481 -0.381 18016
1048 1 2 . 1 1 89 89 ALA H H 89 8.870 8.870 8.245 0.625 18016
1049 1 2 . 1 1 90 90 LEU N N 90 119.400 119.400 117.137 2.263 18016
1050 1 2 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.999 0.211 18016
1051 1 2 . 1 1 90 90 LEU C C 90 179.100 179.100 178.733 0.367 18016
1052 1 2 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.079 0.421 18016
1053 1 2 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.436 0.264 18016
1054 1 2 . 1 1 90 90 LEU H H 90 7.390 7.390 7.534 -0.144 18016
1055 1 2 . 1 1 91 91 GLN N N 91 114.500 114.500 116.387 -1.887 18016
1056 1 2 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.331 0.369 18016
1057 1 2 . 1 1 91 91 GLN C C 91 175.800 175.800 176.904 -1.104 18016
1058 1 2 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.261 -1.761 18016
1059 1 2 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.884 -1.784 18016
1060 1 2 . 1 1 91 91 GLN H H 91 7.810 7.810 7.852 -0.042 18016
1061 1 2 . 1 1 92 92 GLY N N 92 107.900 107.900 105.830 2.070 18016
1062 1 2 . 1 1 92 92 GLY C C 92 172.100 172.100 171.958 0.142 18016
1063 1 2 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.019 -1.019 18016
1064 1 2 . 1 1 92 92 GLY H H 92 7.710 7.710 8.285 -0.575 18016
1065 1 2 . 1 1 93 93 TRP N N 93 114.200 114.200 121.745 -7.545 18016
1066 1 2 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.914 1.086 18016
1067 1 2 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.486 -1.286 18016
1068 1 2 . 1 1 93 93 TRP H H 93 8.450 8.450 8.323 0.127 18016
1069 1 2 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.259 0.201 18016
1070 1 2 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.872 -1.072 18016
1071 1 2 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.241 0.359 18016
1072 1 2 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.014 -0.514 18016
1073 1 2 . 1 1 95 95 LEU C C 95 175.000 175.000 177.904 -2.904 18016
1074 1 2 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.072 0.028 18016
1075 1 2 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.389 1.711 18016
1076 1 2 . 1 1 96 96 ASP N N 96 114.000 114.000 120.101 -6.101 18016
1077 1 2 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.600 0.350 18016
1078 1 2 . 1 1 96 96 ASP C C 96 175.800 175.800 175.770 0.030 18016
1079 1 2 . 1 1 96 96 ASP CA C 96 54.000 54.000 57.322 -3.322 18016
1080 1 2 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.955 -0.055 18016
1081 1 2 . 1 1 96 96 ASP H H 96 7.230 7.230 7.612 -0.382 18016
1082 1 2 . 1 1 97 97 ASP N N 97 123.200 123.200 115.057 8.143 18016
1083 1 2 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.877 -0.267 18016
1084 1 2 . 1 1 97 97 ASP CA C 97 53.500 53.500 52.196 1.304 18016
1085 1 2 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.328 -4.628 18016
1086 1 2 . 1 1 97 97 ASP H H 97 7.420 7.420 7.673 -0.253 18016
1087 1 2 . 1 1 98 98 PRO HA H 98 4.290 4.290 2.665 1.625 18016
1088 1 2 . 1 1 98 98 PRO C C 98 177.500 177.500 176.535 0.965 18016
1089 1 2 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.250 0.450 18016
1090 1 2 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.020 -0.120 18016
1091 1 2 . 1 1 99 99 ARG N N 99 121.300 121.300 117.810 3.490 18016
1092 1 2 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.213 -0.502 18016
1093 1 2 . 1 1 99 99 ARG C C 99 176.500 176.500 175.945 0.555 18016
1094 1 2 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.247 -1.147 18016
1095 1 2 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.587 -0.087 18016
1096 1 2 . 1 1 99 99 ARG H H 99 8.390 8.390 8.114 0.276 18016
1097 1 2 . 1 1 100 100 ASP N N 100 119.600 119.600 119.684 -0.084 18016
1098 1 2 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.641 -0.141 18016
1099 1 2 . 1 1 100 100 ASP C C 100 177.000 177.000 175.937 1.063 18016
1100 1 2 . 1 1 100 100 ASP CA C 100 54.700 54.700 52.503 2.197 18016
1101 1 2 . 1 1 100 100 ASP CB C 100 40.900 40.900 39.552 1.348 18016
1102 1 2 . 1 1 100 100 ASP H H 100 8.260 8.260 7.870 0.390 18016
1103 1 2 . 1 1 101 101 GLY N N 101 109.300 109.300 109.357 -0.057 18016
1104 1 2 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.700 0.700 18016
1105 1 2 . 1 1 101 101 GLY H H 101 8.450 8.450 8.554 -0.104 18016
1106 1 2 . 1 1 102 102 GLU N N 102 119.800 119.800 123.104 -3.304 18016
1107 1 2 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.362 -0.052 18016
1108 1 2 . 1 1 102 102 GLU CA C 102 56.000 56.000 55.779 0.221 18016
1109 1 2 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.735 -0.235 18016
1110 1 2 . 1 1 102 102 GLU H H 102 8.140 8.140 7.878 0.262 18016
1111 1 2 . 1 1 103 103 GLU N N 103 123.000 123.000 126.418 -3.418 18016
1112 1 2 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.571 -0.011 18016
1113 1 2 . 1 1 103 103 GLU CA C 103 54.300 54.300 53.777 0.523 18016
1114 1 2 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.733 -0.133 18016
1115 1 2 . 1 1 103 103 GLU H H 103 8.580 8.580 8.495 0.085 18016
1116 1 2 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.586 -0.106 18016
1117 1 2 . 1 1 104 104 PRO C C 104 176.800 176.800 176.182 0.618 18016
1118 1 2 . 1 1 104 104 PRO CA C 104 63.400 63.400 62.308 1.092 18016
1119 1 2 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.396 -0.296 18016
1120 1 2 . 1 1 105 105 ASP N N 105 120.400 120.400 120.185 0.215 18016
1121 1 2 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.577 0.003 18016
1122 1 2 . 1 1 105 105 ASP C C 105 177.100 177.100 177.164 -0.064 18016
1123 1 2 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.621 -0.321 18016
1124 1 2 . 1 1 105 105 ASP CB C 105 41.400 41.400 40.852 0.548 18016
1125 1 2 . 1 1 105 105 ASP H H 105 8.500 8.500 8.542 -0.042 18016
1126 1 2 . 1 1 106 106 GLY N N 106 109.300 109.300 113.899 -4.599 18016
1127 1 2 . 1 1 106 106 GLY C C 106 174.600 174.600 174.666 -0.066 18016
1128 1 2 . 1 1 106 106 GLY CA C 106 45.400 45.400 44.934 0.466 18016
1129 1 2 . 1 1 106 106 GLY H H 106 8.360 8.360 8.846 -0.486 18016
1130 1 2 . 1 1 107 107 GLU N N 107 120.400 120.400 122.403 -2.003 18016
1131 1 2 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.173 0.167 18016
1132 1 2 . 1 1 107 107 GLU C C 107 177.100 177.100 177.262 -0.162 18016
1133 1 2 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.276 0.224 18016
1134 1 2 . 1 1 107 107 GLU CB C 107 30.200 30.200 29.658 0.542 18016
1135 1 2 . 1 1 107 107 GLU H H 107 8.410 8.410 7.929 0.481 18016
1136 1 2 . 1 1 108 108 SER N N 108 116.600 116.600 114.026 2.574 18016
1137 1 2 . 1 1 108 108 SER HA H 108 4.450 4.450 4.305 0.145 18016
1138 1 2 . 1 1 108 108 SER C C 108 175.300 175.300 175.919 -0.619 18016
1139 1 2 . 1 1 108 108 SER CA C 108 58.700 58.700 59.210 -0.510 18016
1140 1 2 . 1 1 108 108 SER CB C 108 63.800 63.800 63.005 0.795 18016
1141 1 2 . 1 1 108 108 SER H H 108 8.460 8.460 8.183 0.277 18016
1142 1 2 . 1 1 109 109 GLY N N 109 110.800 110.800 111.166 -0.366 18016
1143 1 2 . 1 1 109 109 GLY C C 109 174.500 174.500 174.208 0.292 18016
1144 1 2 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.954 -0.654 18016
1145 1 2 . 1 1 109 109 GLY H H 109 8.500 8.500 8.101 0.399 18016
1146 1 2 . 1 1 110 110 GLY N N 110 108.800 108.800 107.773 1.027 18016
1147 1 2 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.940 -0.540 18016
1148 1 2 . 1 1 110 110 GLY H H 110 8.140 8.140 7.605 0.535 18016
1149 1 2 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.434 0.176 18016
1150 1 2 . 1 1 111 111 PRO C C 111 176.000 176.000 176.501 -0.501 18016
1151 1 2 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.680 -1.080 18016
1152 1 2 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.232 2.368 18016
1153 1 3 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.469 -0.039 18016
1154 1 3 . 1 1 2 2 PRO C C 2 177.600 177.600 176.079 1.521 18016
1155 1 3 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.775 0.525 18016
1156 1 3 . 1 1 2 2 PRO CB C 2 32.300 32.300 31.853 0.447 18016
1157 1 3 . 1 1 3 3 GLY N N 3 110.000 110.000 109.683 0.317 18016
1158 1 3 . 1 1 3 3 GLY C C 3 174.200 174.200 172.735 1.465 18016
1159 1 3 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.411 -0.011 18016
1160 1 3 . 1 1 3 3 GLY H H 3 8.700 8.700 7.908 0.792 18016
1161 1 3 . 1 1 4 4 SER N N 4 115.400 115.400 116.616 -1.216 18016
1162 1 3 . 1 1 4 4 SER HA H 4 4.440 4.440 4.527 -0.087 18016
1163 1 3 . 1 1 4 4 SER C C 4 174.800 174.800 174.101 0.699 18016
1164 1 3 . 1 1 4 4 SER CA C 4 58.400 58.400 58.486 -0.086 18016
1165 1 3 . 1 1 4 4 SER CB C 4 63.800 63.800 64.546 -0.746 18016
1166 1 3 . 1 1 4 4 SER H H 4 8.210 8.210 8.820 -0.610 18016
1167 1 3 . 1 1 5 5 MET N N 5 122.200 122.200 119.738 2.462 18016
1168 1 3 . 1 1 5 5 MET HA H 5 4.510 4.510 4.608 -0.098 18016
1169 1 3 . 1 1 5 5 MET CA C 5 55.600 55.600 55.980 -0.380 18016
1170 1 3 . 1 1 5 5 MET CB C 5 32.900 32.900 34.768 -1.868 18016
1171 1 3 . 1 1 5 5 MET H H 5 8.570 8.570 8.528 0.042 18016
1172 1 3 . 1 1 6 6 VAL N N 6 120.000 120.000 118.283 1.717 18016
1173 1 3 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.555 -0.505 18016
1174 1 3 . 1 1 6 6 VAL C C 6 175.700 175.700 173.465 2.235 18016
1175 1 3 . 1 1 6 6 VAL CA C 6 62.700 62.700 60.722 1.978 18016
1176 1 3 . 1 1 6 6 VAL CB C 6 32.500 32.500 34.074 -1.574 18016
1177 1 3 . 1 1 6 6 VAL H H 6 8.150 8.150 8.158 -0.008 18016
1178 1 3 . 1 1 7 7 ASN N N 7 122.000 122.000 118.969 3.031 18016
1179 1 3 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.633 0.027 18016
1180 1 3 . 1 1 7 7 ASN C C 7 175.200 175.200 177.135 -1.935 18016
1181 1 3 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.714 -0.514 18016
1182 1 3 . 1 1 7 7 ASN CB C 7 38.900 38.900 40.104 -1.204 18016
1183 1 3 . 1 1 7 7 ASN H H 7 8.010 8.010 8.330 -0.320 18016
1184 1 3 . 1 1 8 8 ALA N N 8 126.500 126.500 126.086 0.414 18016
1185 1 3 . 1 1 8 8 ALA C C 8 180.200 180.200 179.496 0.704 18016
1186 1 3 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.290 0.210 18016
1187 1 3 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.758 -0.358 18016
1188 1 3 . 1 1 8 8 ALA H H 8 9.020 9.020 8.818 0.202 18016
1189 1 3 . 1 1 9 9 PHE N N 9 121.300 121.300 118.823 2.477 18016
1190 1 3 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.097 0.193 18016
1191 1 3 . 1 1 9 9 PHE C C 9 177.200 177.200 177.025 0.175 18016
1192 1 3 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.538 -0.238 18016
1193 1 3 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.172 0.028 18016
1194 1 3 . 1 1 9 9 PHE H H 9 8.570 8.570 8.337 0.233 18016
1195 1 3 . 1 1 10 10 LEU N N 10 117.200 117.200 119.617 -2.417 18016
1196 1 3 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.055 -0.355 18016
1197 1 3 . 1 1 10 10 LEU C C 10 179.700 179.700 179.199 0.501 18016
1198 1 3 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.099 0.501 18016
1199 1 3 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.369 0.331 18016
1200 1 3 . 1 1 10 10 LEU H H 10 8.150 8.150 7.981 0.169 18016
1201 1 3 . 1 1 11 11 ALA N N 11 121.500 121.500 122.159 -0.659 18016
1202 1 3 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.966 0.054 18016
1203 1 3 . 1 1 11 11 ALA C C 11 180.900 180.900 179.567 1.333 18016
1204 1 3 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.554 -0.554 18016
1205 1 3 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.096 -0.096 18016
1206 1 3 . 1 1 11 11 ALA H H 11 8.460 8.460 8.802 -0.342 18016
1207 1 3 . 1 1 12 12 LYS N N 12 120.700 120.700 119.530 1.170 18016
1208 1 3 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.065 -0.015 18016
1209 1 3 . 1 1 12 12 LYS C C 12 179.700 179.700 178.831 0.869 18016
1210 1 3 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.621 0.579 18016
1211 1 3 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.931 -0.331 18016
1212 1 3 . 1 1 12 12 LYS H H 12 7.820 7.820 7.622 0.198 18016
1213 1 3 . 1 1 13 13 ILE N N 13 120.100 120.100 119.479 0.621 18016
1214 1 3 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.903 -0.213 18016
1215 1 3 . 1 1 13 13 ILE C C 13 178.100 178.100 178.242 -0.142 18016
1216 1 3 . 1 1 13 13 ILE CA C 13 63.000 63.000 64.062 -1.062 18016
1217 1 3 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.726 -1.326 18016
1218 1 3 . 1 1 13 13 ILE H H 13 7.640 7.640 8.034 -0.394 18016
1219 1 3 . 1 1 14 14 ALA N N 14 122.700 122.700 122.212 0.488 18016
1220 1 3 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.973 -0.113 18016
1221 1 3 . 1 1 14 14 ALA C C 14 179.000 179.000 179.599 -0.599 18016
1222 1 3 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.517 0.483 18016
1223 1 3 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.058 -0.058 18016
1224 1 3 . 1 1 14 14 ALA H H 14 8.680 8.680 8.481 0.199 18016
1225 1 3 . 1 1 15 15 ALA N N 15 118.700 118.700 122.042 -3.342 18016
1226 1 3 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.029 0.061 18016
1227 1 3 . 1 1 15 15 ALA C C 15 180.400 180.400 179.006 1.394 18016
1228 1 3 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.169 -0.169 18016
1229 1 3 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.645 -0.945 18016
1230 1 3 . 1 1 15 15 ALA H H 15 8.070 8.070 8.197 -0.127 18016
1231 1 3 . 1 1 16 16 TRP N N 16 122.900 122.900 120.841 2.059 18016
1232 1 3 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.266 0.294 18016
1233 1 3 . 1 1 16 16 TRP C C 16 178.400 178.400 178.192 0.208 18016
1234 1 3 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.014 -1.414 18016
1235 1 3 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.322 -1.022 18016
1236 1 3 . 1 1 16 16 TRP H H 16 7.820 7.820 8.366 -0.546 18016
1237 1 3 . 1 1 17 17 LEU N N 17 120.400 120.400 119.929 0.471 18016
1238 1 3 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.217 0.393 18016
1239 1 3 . 1 1 17 17 LEU C C 17 179.000 179.000 178.586 0.414 18016
1240 1 3 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.776 0.124 18016
1241 1 3 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.537 0.463 18016
1242 1 3 . 1 1 17 17 LEU H H 17 8.630 8.630 8.566 0.064 18016
1243 1 3 . 1 1 18 18 ASN N N 18 116.200 116.200 116.576 -0.376 18016
1244 1 3 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.398 -0.088 18016
1245 1 3 . 1 1 18 18 ASN C C 18 177.100 177.100 176.790 0.310 18016
1246 1 3 . 1 1 18 18 ASN CA C 18 55.600 55.600 56.066 -0.466 18016
1247 1 3 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.752 0.448 18016
1248 1 3 . 1 1 18 18 ASN H H 18 8.350 8.350 8.435 -0.085 18016
1249 1 3 . 1 1 19 19 ALA N N 19 119.600 119.600 120.069 -0.469 18016
1250 1 3 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.365 -0.275 18016
1251 1 3 . 1 1 19 19 ALA C C 19 180.100 180.100 178.950 1.150 18016
1252 1 3 . 1 1 19 19 ALA CA C 19 54.200 54.200 53.994 0.206 18016
1253 1 3 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.549 -0.949 18016
1254 1 3 . 1 1 19 19 ALA H H 19 7.920 7.920 7.840 0.080 18016
1255 1 3 . 1 1 20 20 GLY N N 20 103.500 103.500 105.236 -1.736 18016
1256 1 3 . 1 1 20 20 GLY C C 20 173.800 173.800 173.947 -0.147 18016
1257 1 3 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.726 0.074 18016
1258 1 3 . 1 1 20 20 GLY H H 20 7.700 7.700 7.593 0.107 18016
1259 1 3 . 1 1 21 21 TYR N N 21 119.900 119.900 117.314 2.586 18016
1260 1 3 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.931 0.239 18016
1261 1 3 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.122 1.278 18016
1262 1 3 . 1 1 21 21 TYR CB C 21 37.800 37.800 39.040 -1.240 18016
1263 1 3 . 1 1 21 21 TYR H H 21 7.980 7.980 8.115 -0.135 18016
1264 1 3 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.535 -0.035 18016
1265 1 3 . 1 1 22 22 PRO C C 22 178.700 178.700 176.925 1.775 18016
1266 1 3 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.159 0.841 18016
1267 1 3 . 1 1 22 22 PRO CB C 22 32.000 32.000 31.978 0.022 18016
1268 1 3 . 1 1 23 23 GLU N N 23 116.300 116.300 115.986 0.314 18016
1269 1 3 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.421 0.149 18016
1270 1 3 . 1 1 23 23 GLU C C 23 176.300 176.300 176.514 -0.214 18016
1271 1 3 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.688 -1.088 18016
1272 1 3 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.705 -0.205 18016
1273 1 3 . 1 1 23 23 GLU H H 23 8.680 8.680 8.022 0.658 18016
1274 1 3 . 1 1 24 24 GLY N N 24 108.100 108.100 109.301 -1.201 18016
1275 1 3 . 1 1 24 24 GLY C C 24 173.100 173.100 172.933 0.167 18016
1276 1 3 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.595 -1.695 18016
1277 1 3 . 1 1 24 24 GLY H H 24 7.230 7.230 7.561 -0.331 18016
1278 1 3 . 1 1 25 25 VAL N N 25 121.500 121.500 121.136 0.364 18016
1279 1 3 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.889 -0.299 18016
1280 1 3 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.355 0.945 18016
1281 1 3 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.243 -0.143 18016
1282 1 3 . 1 1 25 25 VAL H H 25 8.050 8.050 7.934 0.116 18016
1283 1 3 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.407 -0.087 18016
1284 1 3 . 1 1 26 26 PRO C C 26 177.600 177.600 177.781 -0.181 18016
1285 1 3 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.408 0.492 18016
1286 1 3 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.996 0.104 18016
1287 1 3 . 1 1 27 27 GLY N N 27 109.000 109.000 109.140 -0.140 18016
1288 1 3 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.582 1.518 18016
1289 1 3 . 1 1 27 27 GLY H H 27 8.930 8.930 8.776 0.154 18016
1290 1 3 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.344 0.046 18016
1291 1 3 . 1 1 28 28 PRO C C 28 175.800 175.800 177.071 -1.271 18016
1292 1 3 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.882 -0.482 18016
1293 1 3 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.361 0.539 18016
1294 1 3 . 1 1 29 29 ASP N N 29 115.000 115.000 117.619 -2.619 18016
1295 1 3 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.782 -0.292 18016
1296 1 3 . 1 1 29 29 ASP C C 29 177.000 177.000 177.929 -0.929 18016
1297 1 3 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.760 -1.860 18016
1298 1 3 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.545 -0.845 18016
1299 1 3 . 1 1 29 29 ASP H H 29 7.760 7.760 7.701 0.059 18016
1300 1 3 . 1 1 30 30 ARG N N 30 119.900 119.900 121.914 -2.014 18016
1301 1 3 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.948 -0.378 18016
1302 1 3 . 1 1 30 30 ARG C C 30 176.500 176.500 178.530 -2.030 18016
1303 1 3 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.745 2.155 18016
1304 1 3 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.214 0.286 18016
1305 1 3 . 1 1 30 30 ARG H H 30 7.460 7.460 8.202 -0.742 18016
1306 1 3 . 1 1 31 31 VAL N N 31 117.600 117.600 119.529 -1.929 18016
1307 1 3 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.901 -0.081 18016
1308 1 3 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.073 0.627 18016
1309 1 3 . 1 1 31 31 VAL CB C 31 28.800 28.800 28.532 0.268 18016
1310 1 3 . 1 1 31 31 VAL H H 31 9.080 9.080 8.281 0.799 18016
1311 1 3 . 1 1 32 32 PRO C C 32 177.000 177.000 179.021 -2.021 18016
1312 1 3 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.789 -0.589 18016
1313 1 3 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.222 -0.422 18016
1314 1 3 . 1 1 33 33 LEU N N 33 115.200 115.200 120.939 -5.739 18016
1315 1 3 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.090 0.030 18016
1316 1 3 . 1 1 33 33 LEU C C 33 178.600 178.600 178.441 0.159 18016
1317 1 3 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.093 0.307 18016
1318 1 3 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.287 0.213 18016
1319 1 3 . 1 1 33 33 LEU H H 33 8.010 8.010 8.077 -0.067 18016
1320 1 3 . 1 1 34 34 LEU N N 34 120.400 120.400 119.250 1.150 18016
1321 1 3 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.058 -0.128 18016
1322 1 3 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.632 0.468 18016
1323 1 3 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.344 0.556 18016
1324 1 3 . 1 1 34 34 LEU H H 34 8.220 8.220 8.302 -0.082 18016
1325 1 3 . 1 1 35 35 ALA N N 35 123.100 123.100 121.970 1.130 18016
1326 1 3 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.051 -0.011 18016
1327 1 3 . 1 1 35 35 ALA C C 35 179.500 179.500 179.218 0.282 18016
1328 1 3 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.952 0.548 18016
1329 1 3 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.414 -0.514 18016
1330 1 3 . 1 1 35 35 ALA H H 35 8.560 8.560 8.028 0.532 18016
1331 1 3 . 1 1 36 36 LEU N N 36 117.600 117.600 118.737 -1.137 18016
1332 1 3 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.277 -0.157 18016
1333 1 3 . 1 1 36 36 LEU C C 36 180.100 180.100 179.335 0.765 18016
1334 1 3 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.655 0.545 18016
1335 1 3 . 1 1 36 36 LEU CB C 36 42.800 42.800 42.003 0.797 18016
1336 1 3 . 1 1 36 36 LEU H H 36 7.850 7.850 7.990 -0.140 18016
1337 1 3 . 1 1 37 37 LEU N N 37 116.700 116.700 120.026 -3.326 18016
1338 1 3 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.110 -0.010 18016
1339 1 3 . 1 1 37 37 LEU C C 37 180.100 180.100 178.983 1.117 18016
1340 1 3 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.260 0.041 18016
1341 1 3 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.078 1.122 18016
1342 1 3 . 1 1 37 37 LEU H H 37 8.730 8.730 8.502 0.228 18016
1343 1 3 . 1 1 38 38 THR N N 38 110.600 110.600 108.880 1.720 18016
1344 1 3 . 1 1 38 38 THR HA H 38 4.440 4.440 4.134 0.306 18016
1345 1 3 . 1 1 38 38 THR C C 38 175.100 175.100 175.930 -0.830 18016
1346 1 3 . 1 1 38 38 THR CA C 38 64.200 64.200 64.217 -0.017 18016
1347 1 3 . 1 1 38 38 THR CB C 38 70.000 70.000 68.536 1.464 18016
1348 1 3 . 1 1 38 38 THR H H 38 8.660 8.660 8.521 0.139 18016
1349 1 3 . 1 1 39 39 ARG N N 39 118.000 118.000 120.582 -2.582 18016
1350 1 3 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.150 0.130 18016
1351 1 3 . 1 1 39 39 ARG C C 39 177.300 177.300 177.896 -0.596 18016
1352 1 3 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.250 0.050 18016
1353 1 3 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.930 0.270 18016
1354 1 3 . 1 1 39 39 ARG H H 39 7.180 7.180 7.535 -0.355 18016
1355 1 3 . 1 1 40 40 ARG N N 40 114.400 114.400 115.253 -0.853 18016
1356 1 3 . 1 1 40 40 ARG C C 40 174.800 174.800 176.626 -1.826 18016
1357 1 3 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.144 -0.844 18016
1358 1 3 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.353 3.247 18016
1359 1 3 . 1 1 40 40 ARG H H 40 7.520 7.520 7.729 -0.209 18016
1360 1 3 . 1 1 41 41 LEU N N 41 119.400 119.400 120.787 -1.387 18016
1361 1 3 . 1 1 41 41 LEU C C 41 177.100 177.100 177.365 -0.265 18016
1362 1 3 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.813 -1.113 18016
1363 1 3 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.286 1.114 18016
1364 1 3 . 1 1 41 41 LEU H H 41 8.380 8.380 7.738 0.642 18016
1365 1 3 . 1 1 42 42 THR N N 42 112.000 112.000 112.856 -0.856 18016
1366 1 3 . 1 1 42 42 THR HA H 42 4.440 4.440 4.465 -0.025 18016
1367 1 3 . 1 1 42 42 THR C C 42 175.800 175.800 175.325 0.475 18016
1368 1 3 . 1 1 42 42 THR CA C 42 60.500 60.500 60.522 -0.022 18016
1369 1 3 . 1 1 42 42 THR CB C 42 70.800 70.800 70.611 0.189 18016
1370 1 3 . 1 1 42 42 THR H H 42 9.330 9.330 8.433 0.897 18016
1371 1 3 . 1 1 43 43 ASN N N 43 119.900 119.900 120.830 -0.930 18016
1372 1 3 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.427 -0.177 18016
1373 1 3 . 1 1 43 43 ASN C C 43 177.900 177.900 177.188 0.712 18016
1374 1 3 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.611 0.089 18016
1375 1 3 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.367 -1.167 18016
1376 1 3 . 1 1 43 43 ASN H H 43 9.140 9.140 8.941 0.199 18016
1377 1 3 . 1 1 44 44 ASP N N 44 118.000 118.000 119.298 -1.298 18016
1378 1 3 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.346 0.054 18016
1379 1 3 . 1 1 44 44 ASP C C 44 179.600 179.600 178.602 0.998 18016
1380 1 3 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.484 -0.184 18016
1381 1 3 . 1 1 44 44 ASP H H 44 8.360 8.360 8.713 -0.353 18016
1382 1 3 . 1 1 45 45 GLU N N 45 122.600 122.600 119.917 2.683 18016
1383 1 3 . 1 1 45 45 GLU HA H 45 3.970 3.970 3.996 -0.026 18016
1384 1 3 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.365 0.035 18016
1385 1 3 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.804 0.496 18016
1386 1 3 . 1 1 45 45 GLU H H 45 7.850 7.850 7.597 0.253 18016
1387 1 3 . 1 1 46 46 ILE N N 46 118.900 118.900 120.741 -1.841 18016
1388 1 3 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.772 -0.342 18016
1389 1 3 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.302 1.698 18016
1390 1 3 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.760 -0.060 18016
1391 1 3 . 1 1 46 46 ILE H H 46 8.290 8.290 8.259 0.031 18016
1392 1 3 . 1 1 47 47 LYS N N 47 118.900 118.900 119.293 -0.393 18016
1393 1 3 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.982 -0.112 18016
1394 1 3 . 1 1 47 47 LYS C C 47 178.400 178.400 178.763 -0.363 18016
1395 1 3 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.834 0.466 18016
1396 1 3 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.258 0.342 18016
1397 1 3 . 1 1 47 47 LYS H H 47 8.290 8.290 8.192 0.098 18016
1398 1 3 . 1 1 48 48 ALA N N 48 121.100 121.100 123.563 -2.463 18016
1399 1 3 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.265 -0.095 18016
1400 1 3 . 1 1 48 48 ALA CA C 48 55.100 55.100 54.999 0.101 18016
1401 1 3 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.325 -0.325 18016
1402 1 3 . 1 1 48 48 ALA H H 48 7.710 7.710 8.093 -0.383 18016
1403 1 3 . 1 1 49 49 ILE N N 49 119.900 119.900 118.692 1.208 18016
1404 1 3 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.736 -0.086 18016
1405 1 3 . 1 1 49 49 ILE C C 49 177.300 177.300 178.128 -0.828 18016
1406 1 3 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.539 1.461 18016
1407 1 3 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.614 1.486 18016
1408 1 3 . 1 1 49 49 ILE H H 49 8.130 8.130 8.311 -0.181 18016
1409 1 3 . 1 1 50 50 ALA N N 50 122.000 122.000 122.266 -0.266 18016
1410 1 3 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.014 -0.154 18016
1411 1 3 . 1 1 50 50 ALA C C 50 179.800 179.800 179.936 -0.136 18016
1412 1 3 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.366 0.334 18016
1413 1 3 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.031 -0.131 18016
1414 1 3 . 1 1 50 50 ALA H H 50 8.730 8.730 7.538 1.192 18016
1415 1 3 . 1 1 51 51 GLU N N 51 116.900 116.900 118.283 -1.383 18016
1416 1 3 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.863 0.157 18016
1417 1 3 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.779 -0.379 18016
1418 1 3 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.324 0.176 18016
1419 1 3 . 1 1 51 51 GLU H H 51 8.220 8.220 8.414 -0.194 18016
1420 1 3 . 1 1 52 52 ASP N N 52 120.300 120.300 120.319 -0.019 18016
1421 1 3 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.434 -0.044 18016
1422 1 3 . 1 1 52 52 ASP C C 52 178.900 178.900 178.598 0.302 18016
1423 1 3 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.167 0.333 18016
1424 1 3 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.048 1.452 18016
1425 1 3 . 1 1 52 52 ASP H H 52 7.700 7.700 7.782 -0.082 18016
1426 1 3 . 1 1 53 53 LEU N N 53 118.300 118.300 119.496 -1.196 18016
1427 1 3 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.947 -0.217 18016
1428 1 3 . 1 1 53 53 LEU C C 53 179.000 179.000 178.969 0.031 18016
1429 1 3 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.625 -0.125 18016
1430 1 3 . 1 1 53 53 LEU CB C 53 41.100 41.100 42.051 -0.951 18016
1431 1 3 . 1 1 53 53 LEU H H 53 8.290 8.290 7.785 0.505 18016
1432 1 3 . 1 1 54 54 GLU N N 54 118.700 118.700 117.228 1.472 18016
1433 1 3 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.174 0.046 18016
1434 1 3 . 1 1 54 54 GLU C C 54 178.200 178.200 177.170 1.030 18016
1435 1 3 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.134 0.566 18016
1436 1 3 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.686 1.214 18016
1437 1 3 . 1 1 54 54 GLU H H 54 8.070 8.070 8.514 -0.444 18016
1438 1 3 . 1 1 55 55 LYS N N 55 117.700 117.700 117.277 0.423 18016
1439 1 3 . 1 1 55 55 LYS HA H 55 4.150 4.150 3.976 0.174 18016
1440 1 3 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.094 0.206 18016
1441 1 3 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.456 0.244 18016
1442 1 3 . 1 1 55 55 LYS H H 55 7.750 7.750 7.553 0.197 18016
1443 1 3 . 1 1 56 56 ARG N N 56 117.100 117.100 117.574 -0.474 18016
1444 1 3 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.173 0.097 18016
1445 1 3 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.930 -1.130 18016
1446 1 3 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.145 -0.145 18016
1447 1 3 . 1 1 56 56 ARG H H 56 8.270 8.270 7.521 0.749 18016
1448 1 3 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.660 -0.300 18016
1449 1 3 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.801 0.299 18016
1450 1 3 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.997 -1.797 18016
1451 1 3 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.489 0.021 18016
1452 1 3 . 1 1 58 58 HIS CA C 58 56.200 56.200 56.543 -0.343 18016
1453 1 3 . 1 1 58 58 HIS CB C 58 27.300 27.300 28.036 -0.736 18016
1454 1 3 . 1 1 59 59 PHE N N 59 120.400 120.400 122.241 -1.841 18016
1455 1 3 . 1 1 59 59 PHE C C 59 175.500 175.500 176.225 -0.725 18016
1456 1 3 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.432 -0.232 18016
1457 1 3 . 1 1 59 59 PHE CB C 59 39.300 39.300 42.077 -2.777 18016
1458 1 3 . 1 1 59 59 PHE H H 59 7.710 7.710 7.850 -0.140 18016
1459 1 3 . 1 1 60 60 ASP N N 60 120.800 120.800 123.950 -3.150 18016
1460 1 3 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.614 -0.124 18016
1461 1 3 . 1 1 60 60 ASP CA C 60 54.300 54.300 54.800 -0.500 18016
1462 1 3 . 1 1 60 60 ASP CB C 60 41.100 41.100 40.721 0.378 18016
1463 1 3 . 1 1 60 60 ASP H H 60 8.180 8.180 8.953 -0.773 18016
1464 1 3 . 1 1 61 61 HIS N N 61 118.300 118.300 121.362 -3.062 18016
1465 1 3 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.305 0.085 18016
1466 1 3 . 1 1 61 61 HIS CA C 61 56.700 56.700 58.922 -2.222 18016
1467 1 3 . 1 1 61 61 HIS CB C 61 28.800 28.800 30.101 -1.301 18016
1468 1 3 . 1 1 61 61 HIS H H 61 8.550 8.550 8.530 0.020 18016
1469 1 3 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.184 -0.174 18016
1470 1 3 . 1 1 62 62 ILE C C 62 173.800 173.800 174.610 -0.810 18016
1471 1 3 . 1 1 62 62 ILE CA C 62 66.500 66.500 59.453 7.047 18016
1472 1 3 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.765 2.335 18016
1473 1 3 . 1 1 63 63 ASP N N 63 125.100 125.100 123.285 1.815 18016
1474 1 3 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.324 0.276 18016
1475 1 3 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.455 -2.655 18016
1476 1 3 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.536 -1.036 18016
1477 1 3 . 1 1 63 63 ASP H H 63 8.360 8.360 7.659 0.701 18016
1478 1 3 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.871 -0.201 18016
1479 1 3 . 1 1 64 64 ILE C C 64 177.000 177.000 176.989 0.011 18016
1480 1 3 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.470 -1.370 18016
1481 1 3 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.272 -1.672 18016
1482 1 3 . 1 1 65 65 GLY N N 65 107.600 107.600 107.224 0.376 18016
1483 1 3 . 1 1 65 65 GLY C C 65 177.000 177.000 176.165 0.835 18016
1484 1 3 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.638 0.662 18016
1485 1 3 . 1 1 65 65 GLY H H 65 8.440 8.440 7.836 0.604 18016
1486 1 3 . 1 1 66 66 VAL N N 66 121.800 121.800 123.235 -1.435 18016
1487 1 3 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.695 0.065 18016
1488 1 3 . 1 1 66 66 VAL C C 66 178.500 178.500 177.007 1.493 18016
1489 1 3 . 1 1 66 66 VAL CA C 66 65.600 65.600 64.802 0.798 18016
1490 1 3 . 1 1 66 66 VAL CB C 66 32.000 32.000 32.008 -0.008 18016
1491 1 3 . 1 1 66 66 VAL H H 66 7.550 7.550 8.296 -0.746 18016
1492 1 3 . 1 1 67 67 LEU N N 67 120.900 120.900 119.551 1.349 18016
1493 1 3 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.019 0.051 18016
1494 1 3 . 1 1 67 67 LEU C C 67 179.000 179.000 179.212 -0.212 18016
1495 1 3 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.659 -0.059 18016
1496 1 3 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.358 1.942 18016
1497 1 3 . 1 1 67 67 LEU H H 67 7.650 7.650 7.572 0.078 18016
1498 1 3 . 1 1 68 68 ILE N N 68 118.900 118.900 118.762 0.138 18016
1499 1 3 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.794 -0.084 18016
1500 1 3 . 1 1 68 68 ILE C C 68 179.500 179.500 178.379 1.121 18016
1501 1 3 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.961 0.239 18016
1502 1 3 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.530 -0.030 18016
1503 1 3 . 1 1 68 68 ILE H H 68 8.580 8.580 7.666 0.914 18016
1504 1 3 . 1 1 69 69 THR N N 69 118.100 118.100 116.260 1.840 18016
1505 1 3 . 1 1 69 69 THR HA H 69 3.940 3.940 4.028 -0.088 18016
1506 1 3 . 1 1 69 69 THR C C 69 176.200 176.200 176.957 -0.757 18016
1507 1 3 . 1 1 69 69 THR CA C 69 66.600 66.600 66.372 0.228 18016
1508 1 3 . 1 1 69 69 THR CB C 69 68.500 68.500 68.369 0.131 18016
1509 1 3 . 1 1 69 69 THR H H 69 7.840 7.840 7.717 0.123 18016
1510 1 3 . 1 1 70 70 GLN N N 70 121.600 121.600 120.992 0.608 18016
1511 1 3 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.019 0.091 18016
1512 1 3 . 1 1 70 70 GLN C C 70 178.100 178.100 178.360 -0.260 18016
1513 1 3 . 1 1 70 70 GLN CA C 70 59.100 59.100 59.128 -0.028 18016
1514 1 3 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.390 -0.090 18016
1515 1 3 . 1 1 70 70 GLN H H 70 8.100 8.100 7.861 0.239 18016
1516 1 3 . 1 1 71 71 MET N N 71 118.700 118.700 117.446 1.254 18016
1517 1 3 . 1 1 71 71 MET HA H 71 4.010 4.010 4.356 -0.346 18016
1518 1 3 . 1 1 71 71 MET C C 71 176.300 176.300 178.247 -1.947 18016
1519 1 3 . 1 1 71 71 MET CA C 71 58.100 58.100 58.835 -0.735 18016
1520 1 3 . 1 1 71 71 MET CB C 71 33.600 33.600 32.752 0.848 18016
1521 1 3 . 1 1 71 71 MET H H 71 8.350 8.350 8.460 -0.110 18016
1522 1 3 . 1 1 72 72 THR N N 72 111.600 111.600 111.852 -0.252 18016
1523 1 3 . 1 1 72 72 THR HA H 72 3.940 3.940 4.111 -0.171 18016
1524 1 3 . 1 1 72 72 THR C C 72 175.800 175.800 175.591 0.209 18016
1525 1 3 . 1 1 72 72 THR CA C 72 65.300 65.300 65.122 0.178 18016
1526 1 3 . 1 1 72 72 THR CB C 72 69.100 69.100 69.158 -0.058 18016
1527 1 3 . 1 1 72 72 THR H H 72 7.840 7.840 7.703 0.137 18016
1528 1 3 . 1 1 73 73 ASP N N 73 121.100 121.100 119.563 1.537 18016
1529 1 3 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.649 -0.119 18016
1530 1 3 . 1 1 73 73 ASP C C 73 176.600 176.600 175.900 0.700 18016
1531 1 3 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.465 0.735 18016
1532 1 3 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.122 -0.722 18016
1533 1 3 . 1 1 73 73 ASP H H 73 7.840 7.840 7.615 0.225 18016
1534 1 3 . 1 1 74 74 GLU N N 74 121.100 121.100 119.163 1.937 18016
1535 1 3 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.579 -0.239 18016
1536 1 3 . 1 1 74 74 GLU C C 74 173.800 173.800 175.225 -1.425 18016
1537 1 3 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.444 0.056 18016
1538 1 3 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.408 -0.808 18016
1539 1 3 . 1 1 74 74 GLU H H 74 7.980 7.980 8.430 -0.450 18016
1540 1 3 . 1 1 75 75 MET N N 75 125.800 125.800 125.884 -0.084 18016
1541 1 3 . 1 1 75 75 MET HA H 75 4.710 4.710 4.792 -0.082 18016
1542 1 3 . 1 1 75 75 MET CA C 75 53.800 53.800 54.709 -0.909 18016
1543 1 3 . 1 1 75 75 MET CB C 75 31.700 31.700 31.703 -0.003 18016
1544 1 3 . 1 1 75 75 MET H H 75 8.380 8.380 8.554 -0.174 18016
1545 1 3 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.434 0.076 18016
1546 1 3 . 1 1 76 76 PRO C C 76 175.700 175.700 176.597 -0.897 18016
1547 1 3 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.379 -1.379 18016
1548 1 3 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.267 -0.467 18016
1549 1 3 . 1 1 77 77 ARG N N 77 119.700 119.700 119.001 0.699 18016
1550 1 3 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.666 -0.396 18016
1551 1 3 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.934 0.865 18016
1552 1 3 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.663 -1.963 18016
1553 1 3 . 1 1 77 77 ARG H H 77 8.940 8.940 8.075 0.865 18016
1554 1 3 . 1 1 78 78 GLU N N 78 124.700 124.700 125.575 -0.875 18016
1555 1 3 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.995 -0.035 18016
1556 1 3 . 1 1 78 78 GLU C C 78 179.000 179.000 178.173 0.827 18016
1557 1 3 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.722 0.078 18016
1558 1 3 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.738 -0.739 18016
1559 1 3 . 1 1 78 78 GLU H H 78 9.170 9.170 9.007 0.163 18016
1560 1 3 . 1 1 79 79 GLU N N 79 116.800 116.800 120.626 -3.826 18016
1561 1 3 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.033 0.087 18016
1562 1 3 . 1 1 79 79 GLU C C 79 179.100 179.100 178.337 0.763 18016
1563 1 3 . 1 1 79 79 GLU CA C 79 59.700 59.700 60.010 -0.310 18016
1564 1 3 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.206 -0.206 18016
1565 1 3 . 1 1 79 79 GLU H H 79 9.660 9.660 8.746 0.914 18016
1566 1 3 . 1 1 80 80 ASP N N 80 120.000 120.000 118.347 1.653 18016
1567 1 3 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.434 0.256 18016
1568 1 3 . 1 1 80 80 ASP C C 80 177.300 177.300 178.738 -1.438 18016
1569 1 3 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.705 -0.305 18016
1570 1 3 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.595 1.005 18016
1571 1 3 . 1 1 80 80 ASP H H 80 7.310 7.310 8.349 -1.039 18016
1572 1 3 . 1 1 81 81 ILE N N 81 120.100 120.100 120.023 0.077 18016
1573 1 3 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.707 -0.217 18016
1574 1 3 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.588 0.712 18016
1575 1 3 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.944 0.356 18016
1576 1 3 . 1 1 81 81 ILE H H 81 7.610 7.610 8.227 -0.617 18016
1577 1 3 . 1 1 82 82 GLU N N 82 118.100 118.100 119.701 -1.601 18016
1578 1 3 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.042 0.238 18016
1579 1 3 . 1 1 82 82 GLU C C 82 177.800 177.800 178.992 -1.192 18016
1580 1 3 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.492 -1.492 18016
1581 1 3 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.002 -0.202 18016
1582 1 3 . 1 1 82 82 GLU H H 82 8.550 8.550 8.346 0.204 18016
1583 1 3 . 1 1 83 83 ARG N N 83 119.900 119.900 120.362 -0.462 18016
1584 1 3 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.028 0.002 18016
1585 1 3 . 1 1 83 83 ARG C C 83 179.400 179.400 179.036 0.364 18016
1586 1 3 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.283 0.617 18016
1587 1 3 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.176 -0.576 18016
1588 1 3 . 1 1 83 83 ARG H H 83 7.590 7.590 8.221 -0.631 18016
1589 1 3 . 1 1 84 84 VAL N N 84 120.400 120.400 119.849 0.551 18016
1590 1 3 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.851 -0.101 18016
1591 1 3 . 1 1 84 84 VAL C C 84 177.400 177.400 177.405 -0.005 18016
1592 1 3 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.911 0.989 18016
1593 1 3 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.081 -0.181 18016
1594 1 3 . 1 1 84 84 VAL H H 84 7.550 7.550 8.576 -1.026 18016
1595 1 3 . 1 1 85 85 ARG N N 85 121.600 121.600 119.704 1.896 18016
1596 1 3 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.296 -0.286 18016
1597 1 3 . 1 1 85 85 ARG C C 85 178.100 178.100 178.893 -0.793 18016
1598 1 3 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.880 1.020 18016
1599 1 3 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.893 0.307 18016
1600 1 3 . 1 1 85 85 ARG H H 85 9.090 9.090 8.434 0.656 18016
1601 1 3 . 1 1 86 86 ARG N N 86 115.600 115.600 118.896 -3.296 18016
1602 1 3 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.064 -0.184 18016
1603 1 3 . 1 1 86 86 ARG C C 86 179.000 179.000 178.638 0.362 18016
1604 1 3 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.947 0.453 18016
1605 1 3 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.560 0.840 18016
1606 1 3 . 1 1 86 86 ARG H H 86 8.660 8.660 8.452 0.208 18016
1607 1 3 . 1 1 87 87 HIS N N 87 118.000 118.000 119.985 -1.985 18016
1608 1 3 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.298 0.062 18016
1609 1 3 . 1 1 87 87 HIS C C 87 178.400 178.400 177.530 0.870 18016
1610 1 3 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.531 0.069 18016
1611 1 3 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.055 0.645 18016
1612 1 3 . 1 1 87 87 HIS H H 87 7.640 7.640 8.301 -0.661 18016
1613 1 3 . 1 1 88 88 LEU N N 88 119.600 119.600 118.716 0.884 18016
1614 1 3 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.162 -0.582 18016
1615 1 3 . 1 1 88 88 LEU C C 88 180.000 180.000 178.927 1.073 18016
1616 1 3 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.046 0.154 18016
1617 1 3 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.250 1.350 18016
1618 1 3 . 1 1 88 88 LEU H H 88 8.650 8.650 8.622 0.028 18016
1619 1 3 . 1 1 89 89 ALA N N 89 118.500 118.500 122.611 -4.111 18016
1620 1 3 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.604 0.756 18016
1621 1 3 . 1 1 89 89 ALA C C 89 180.400 180.400 179.974 0.426 18016
1622 1 3 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.626 -1.026 18016
1623 1 3 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.320 -0.220 18016
1624 1 3 . 1 1 89 89 ALA H H 89 8.870 8.870 8.200 0.670 18016
1625 1 3 . 1 1 90 90 LEU N N 90 119.400 119.400 117.652 1.748 18016
1626 1 3 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.931 0.279 18016
1627 1 3 . 1 1 90 90 LEU C C 90 179.100 179.100 179.152 -0.052 18016
1628 1 3 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.139 0.361 18016
1629 1 3 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.667 0.033 18016
1630 1 3 . 1 1 90 90 LEU H H 90 7.390 7.390 7.478 -0.088 18016
1631 1 3 . 1 1 91 91 GLN N N 91 114.500 114.500 116.128 -1.628 18016
1632 1 3 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.337 0.363 18016
1633 1 3 . 1 1 91 91 GLN C C 91 175.800 175.800 176.527 -0.727 18016
1634 1 3 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.955 -2.455 18016
1635 1 3 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.096 -1.996 18016
1636 1 3 . 1 1 91 91 GLN H H 91 7.810 7.810 7.768 0.042 18016
1637 1 3 . 1 1 92 92 GLY N N 92 107.900 107.900 105.553 2.347 18016
1638 1 3 . 1 1 92 92 GLY C C 92 172.100 172.100 172.064 0.036 18016
1639 1 3 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.469 -1.469 18016
1640 1 3 . 1 1 92 92 GLY H H 92 7.710 7.710 8.388 -0.678 18016
1641 1 3 . 1 1 93 93 TRP N N 93 114.200 114.200 122.270 -8.070 18016
1642 1 3 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.999 1.001 18016
1643 1 3 . 1 1 93 93 TRP CB C 93 29.200 29.200 31.316 -2.116 18016
1644 1 3 . 1 1 93 93 TRP H H 93 8.450 8.450 8.298 0.152 18016
1645 1 3 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.253 0.207 18016
1646 1 3 . 1 1 94 94 PRO CA C 94 62.800 62.800 62.933 -0.133 18016
1647 1 3 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.098 0.502 18016
1648 1 3 . 1 1 95 95 LEU HA H 95 3.500 3.500 3.869 -0.369 18016
1649 1 3 . 1 1 95 95 LEU C C 95 175.000 175.000 177.807 -2.807 18016
1650 1 3 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.669 -0.569 18016
1651 1 3 . 1 1 95 95 LEU CB C 95 42.100 42.100 41.126 0.974 18016
1652 1 3 . 1 1 96 96 ASP N N 96 114.000 114.000 119.066 -5.066 18016
1653 1 3 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.317 0.633 18016
1654 1 3 . 1 1 96 96 ASP C C 96 175.800 175.800 175.402 0.398 18016
1655 1 3 . 1 1 96 96 ASP CA C 96 54.000 54.000 57.328 -3.328 18016
1656 1 3 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.538 0.362 18016
1657 1 3 . 1 1 96 96 ASP H H 96 7.230 7.230 7.689 -0.459 18016
1658 1 3 . 1 1 97 97 ASP N N 97 123.200 123.200 114.081 9.119 18016
1659 1 3 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.934 -0.324 18016
1660 1 3 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.838 1.662 18016
1661 1 3 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.509 -4.809 18016
1662 1 3 . 1 1 97 97 ASP H H 97 7.420 7.420 7.627 -0.207 18016
1663 1 3 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.862 0.428 18016
1664 1 3 . 1 1 98 98 PRO C C 98 177.500 177.500 177.027 0.473 18016
1665 1 3 . 1 1 98 98 PRO CA C 98 62.700 62.700 63.102 -0.402 18016
1666 1 3 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.270 -0.370 18016
1667 1 3 . 1 1 99 99 ARG N N 99 121.300 121.300 118.584 2.716 18016
1668 1 3 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.350 -0.640 18016
1669 1 3 . 1 1 99 99 ARG C C 99 176.500 176.500 176.079 0.421 18016
1670 1 3 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.034 -0.934 18016
1671 1 3 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.614 -0.115 18016
1672 1 3 . 1 1 99 99 ARG H H 99 8.390 8.390 8.398 -0.008 18016
1673 1 3 . 1 1 100 100 ASP N N 100 119.600 119.600 120.250 -0.650 18016
1674 1 3 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.549 -0.049 18016
1675 1 3 . 1 1 100 100 ASP C C 100 177.000 177.000 176.603 0.397 18016
1676 1 3 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.695 1.005 18016
1677 1 3 . 1 1 100 100 ASP CB C 100 40.900 40.900 40.958 -0.058 18016
1678 1 3 . 1 1 100 100 ASP H H 100 8.260 8.260 7.868 0.392 18016
1679 1 3 . 1 1 101 101 GLY N N 101 109.300 109.300 108.664 0.636 18016
1680 1 3 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.634 0.766 18016
1681 1 3 . 1 1 101 101 GLY H H 101 8.450 8.450 8.552 -0.102 18016
1682 1 3 . 1 1 102 102 GLU N N 102 119.800 119.800 122.094 -2.294 18016
1683 1 3 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.078 0.232 18016
1684 1 3 . 1 1 102 102 GLU CA C 102 56.000 56.000 57.283 -1.283 18016
1685 1 3 . 1 1 102 102 GLU CB C 102 30.500 30.500 29.995 0.504 18016
1686 1 3 . 1 1 102 102 GLU H H 102 8.140 8.140 7.864 0.276 18016
1687 1 3 . 1 1 103 103 GLU N N 103 123.000 123.000 127.062 -4.062 18016
1688 1 3 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.600 -0.040 18016
1689 1 3 . 1 1 103 103 GLU CA C 103 54.300 54.300 53.751 0.549 18016
1690 1 3 . 1 1 103 103 GLU CB C 103 29.600 29.600 30.202 -0.602 18016
1691 1 3 . 1 1 103 103 GLU H H 103 8.580 8.580 8.595 -0.015 18016
1692 1 3 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.510 -0.030 18016
1693 1 3 . 1 1 104 104 PRO C C 104 176.800 176.800 175.950 0.850 18016
1694 1 3 . 1 1 104 104 PRO CA C 104 63.400 63.400 62.807 0.593 18016
1695 1 3 . 1 1 104 104 PRO CB C 104 32.100 32.100 30.408 1.692 18016
1696 1 3 . 1 1 105 105 ASP N N 105 120.400 120.400 123.926 -3.526 18016
1697 1 3 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.628 -0.048 18016
1698 1 3 . 1 1 105 105 ASP C C 105 177.100 177.100 176.770 0.330 18016
1699 1 3 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.589 -0.289 18016
1700 1 3 . 1 1 105 105 ASP CB C 105 41.400 41.400 39.002 2.398 18016
1701 1 3 . 1 1 105 105 ASP H H 105 8.500 8.500 8.340 0.160 18016
1702 1 3 . 1 1 106 106 GLY N N 106 109.300 109.300 107.663 1.637 18016
1703 1 3 . 1 1 106 106 GLY C C 106 174.600 174.600 174.603 -0.003 18016
1704 1 3 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.217 0.183 18016
1705 1 3 . 1 1 106 106 GLY H H 106 8.360 8.360 7.786 0.574 18016
1706 1 3 . 1 1 107 107 GLU N N 107 120.400 120.400 116.743 3.657 18016
1707 1 3 . 1 1 107 107 GLU HA H 107 4.340 4.340 3.872 0.468 18016
1708 1 3 . 1 1 107 107 GLU C C 107 177.100 177.100 175.413 1.687 18016
1709 1 3 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.704 -0.204 18016
1710 1 3 . 1 1 107 107 GLU CB C 107 30.200 30.200 28.076 2.124 18016
1711 1 3 . 1 1 107 107 GLU H H 107 8.410 8.410 8.520 -0.110 18016
1712 1 3 . 1 1 108 108 SER N N 108 116.600 116.600 114.644 1.956 18016
1713 1 3 . 1 1 108 108 SER HA H 108 4.450 4.450 4.446 0.004 18016
1714 1 3 . 1 1 108 108 SER C C 108 175.300 175.300 174.566 0.734 18016
1715 1 3 . 1 1 108 108 SER CA C 108 58.700 58.700 58.651 0.049 18016
1716 1 3 . 1 1 108 108 SER CB C 108 63.800 63.800 64.552 -0.751 18016
1717 1 3 . 1 1 108 108 SER H H 108 8.460 8.460 7.950 0.510 18016
1718 1 3 . 1 1 109 109 GLY N N 109 110.800 110.800 108.879 1.921 18016
1719 1 3 . 1 1 109 109 GLY C C 109 174.500 174.500 173.579 0.921 18016
1720 1 3 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.320 -0.020 18016
1721 1 3 . 1 1 109 109 GLY H H 109 8.500 8.500 8.277 0.223 18016
1722 1 3 . 1 1 110 110 GLY N N 110 108.800 108.800 111.260 -2.460 18016
1723 1 3 . 1 1 110 110 GLY CA C 110 44.400 44.400 43.886 0.514 18016
1724 1 3 . 1 1 110 110 GLY H H 110 8.140 8.140 8.435 -0.295 18016
1725 1 3 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.705 -0.095 18016
1726 1 3 . 1 1 111 111 PRO C C 111 176.000 176.000 175.979 0.021 18016
1727 1 3 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.185 0.415 18016
1728 1 3 . 1 1 111 111 PRO CB C 111 34.600 34.600 33.053 1.547 18016
1729 1 4 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.531 -0.101 18016
1730 1 4 . 1 1 2 2 PRO C C 2 177.600 177.600 176.943 0.657 18016
1731 1 4 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.478 0.822 18016
1732 1 4 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.447 -0.147 18016
1733 1 4 . 1 1 3 3 GLY N N 3 110.000 110.000 106.657 3.343 18016
1734 1 4 . 1 1 3 3 GLY C C 3 174.200 174.200 174.823 -0.623 18016
1735 1 4 . 1 1 3 3 GLY CA C 3 45.400 45.400 44.540 0.860 18016
1736 1 4 . 1 1 3 3 GLY H H 3 8.700 8.700 8.329 0.371 18016
1737 1 4 . 1 1 4 4 SER N N 4 115.400 115.400 118.070 -2.670 18016
1738 1 4 . 1 1 4 4 SER HA H 4 4.440 4.440 4.712 -0.272 18016
1739 1 4 . 1 1 4 4 SER C C 4 174.800 174.800 174.137 0.663 18016
1740 1 4 . 1 1 4 4 SER CA C 4 58.400 58.400 58.204 0.196 18016
1741 1 4 . 1 1 4 4 SER CB C 4 63.800 63.800 64.225 -0.425 18016
1742 1 4 . 1 1 4 4 SER H H 4 8.210 8.210 8.197 0.013 18016
1743 1 4 . 1 1 5 5 MET N N 5 122.200 122.200 125.858 -3.658 18016
1744 1 4 . 1 1 5 5 MET HA H 5 4.510 4.510 4.742 -0.232 18016
1745 1 4 . 1 1 5 5 MET CA C 5 55.600 55.600 54.215 1.385 18016
1746 1 4 . 1 1 5 5 MET CB C 5 32.900 32.900 30.839 2.061 18016
1747 1 4 . 1 1 5 5 MET H H 5 8.570 8.570 9.017 -0.447 18016
1748 1 4 . 1 1 6 6 VAL N N 6 120.000 120.000 121.117 -1.117 18016
1749 1 4 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.348 -0.298 18016
1750 1 4 . 1 1 6 6 VAL C C 6 175.700 175.700 174.378 1.322 18016
1751 1 4 . 1 1 6 6 VAL CA C 6 62.700 62.700 60.459 2.241 18016
1752 1 4 . 1 1 6 6 VAL CB C 6 32.500 32.500 33.237 -0.737 18016
1753 1 4 . 1 1 6 6 VAL H H 6 8.150 8.150 7.780 0.370 18016
1754 1 4 . 1 1 7 7 ASN N N 7 122.000 122.000 118.782 3.218 18016
1755 1 4 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.603 0.057 18016
1756 1 4 . 1 1 7 7 ASN C C 7 175.200 175.200 177.198 -1.998 18016
1757 1 4 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.212 -0.013 18016
1758 1 4 . 1 1 7 7 ASN CB C 7 38.900 38.900 38.968 -0.068 18016
1759 1 4 . 1 1 7 7 ASN H H 7 8.010 8.010 8.445 -0.435 18016
1760 1 4 . 1 1 8 8 ALA N N 8 126.500 126.500 128.816 -2.316 18016
1761 1 4 . 1 1 8 8 ALA C C 8 180.200 180.200 179.476 0.724 18016
1762 1 4 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.315 0.185 18016
1763 1 4 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.961 -0.561 18016
1764 1 4 . 1 1 8 8 ALA H H 8 9.020 9.020 9.013 0.007 18016
1765 1 4 . 1 1 9 9 PHE N N 9 121.300 121.300 118.916 2.384 18016
1766 1 4 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.112 0.178 18016
1767 1 4 . 1 1 9 9 PHE C C 9 177.200 177.200 177.129 0.071 18016
1768 1 4 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.387 -0.087 18016
1769 1 4 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.061 0.139 18016
1770 1 4 . 1 1 9 9 PHE H H 9 8.570 8.570 8.398 0.172 18016
1771 1 4 . 1 1 10 10 LEU N N 10 117.200 117.200 119.229 -2.029 18016
1772 1 4 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.893 -0.193 18016
1773 1 4 . 1 1 10 10 LEU C C 10 179.700 179.700 179.105 0.595 18016
1774 1 4 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.061 0.539 18016
1775 1 4 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.324 0.376 18016
1776 1 4 . 1 1 10 10 LEU H H 10 8.150 8.150 7.879 0.271 18016
1777 1 4 . 1 1 11 11 ALA N N 11 121.500 121.500 122.531 -1.031 18016
1778 1 4 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.941 0.079 18016
1779 1 4 . 1 1 11 11 ALA C C 11 180.900 180.900 179.522 1.378 18016
1780 1 4 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.545 -0.545 18016
1781 1 4 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.083 -0.083 18016
1782 1 4 . 1 1 11 11 ALA H H 11 8.460 8.460 8.417 0.043 18016
1783 1 4 . 1 1 12 12 LYS N N 12 120.700 120.700 119.358 1.342 18016
1784 1 4 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.073 -0.023 18016
1785 1 4 . 1 1 12 12 LYS C C 12 179.700 179.700 178.802 0.898 18016
1786 1 4 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.474 0.726 18016
1787 1 4 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.949 -0.349 18016
1788 1 4 . 1 1 12 12 LYS H H 12 7.820 7.820 7.720 0.100 18016
1789 1 4 . 1 1 13 13 ILE N N 13 120.100 120.100 119.751 0.349 18016
1790 1 4 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.747 -0.057 18016
1791 1 4 . 1 1 13 13 ILE C C 13 178.100 178.100 178.032 0.068 18016
1792 1 4 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.625 -0.625 18016
1793 1 4 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.511 -1.111 18016
1794 1 4 . 1 1 13 13 ILE H H 13 7.640 7.640 7.878 -0.238 18016
1795 1 4 . 1 1 14 14 ALA N N 14 122.700 122.700 122.237 0.463 18016
1796 1 4 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.911 -0.051 18016
1797 1 4 . 1 1 14 14 ALA C C 14 179.000 179.000 179.531 -0.531 18016
1798 1 4 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.481 0.519 18016
1799 1 4 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.004 -0.004 18016
1800 1 4 . 1 1 14 14 ALA H H 14 8.680 8.680 8.410 0.270 18016
1801 1 4 . 1 1 15 15 ALA N N 15 118.700 118.700 121.611 -2.911 18016
1802 1 4 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.038 0.052 18016
1803 1 4 . 1 1 15 15 ALA C C 15 180.400 180.400 178.923 1.477 18016
1804 1 4 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.794 0.206 18016
1805 1 4 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.404 -0.703 18016
1806 1 4 . 1 1 15 15 ALA H H 15 8.070 8.070 8.034 0.036 18016
1807 1 4 . 1 1 16 16 TRP N N 16 122.900 122.900 121.269 1.631 18016
1808 1 4 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.241 0.319 18016
1809 1 4 . 1 1 16 16 TRP C C 16 178.400 178.400 177.943 0.457 18016
1810 1 4 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.354 -1.754 18016
1811 1 4 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.079 -0.779 18016
1812 1 4 . 1 1 16 16 TRP H H 16 7.820 7.820 8.213 -0.393 18016
1813 1 4 . 1 1 17 17 LEU N N 17 120.400 120.400 118.952 1.448 18016
1814 1 4 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.138 0.472 18016
1815 1 4 . 1 1 17 17 LEU C C 17 179.000 179.000 178.710 0.290 18016
1816 1 4 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.618 0.282 18016
1817 1 4 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.623 0.377 18016
1818 1 4 . 1 1 17 17 LEU H H 17 8.630 8.630 8.371 0.259 18016
1819 1 4 . 1 1 18 18 ASN N N 18 116.200 116.200 117.288 -1.088 18016
1820 1 4 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.548 -0.238 18016
1821 1 4 . 1 1 18 18 ASN C C 18 177.100 177.100 177.295 -0.195 18016
1822 1 4 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.778 -0.178 18016
1823 1 4 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.943 0.257 18016
1824 1 4 . 1 1 18 18 ASN H H 18 8.350 8.350 8.420 -0.070 18016
1825 1 4 . 1 1 19 19 ALA N N 19 119.600 119.600 120.100 -0.500 18016
1826 1 4 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.173 -0.083 18016
1827 1 4 . 1 1 19 19 ALA C C 19 180.100 180.100 178.624 1.476 18016
1828 1 4 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.048 0.152 18016
1829 1 4 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.495 -0.895 18016
1830 1 4 . 1 1 19 19 ALA H H 19 7.920 7.920 7.986 -0.066 18016
1831 1 4 . 1 1 20 20 GLY N N 20 103.500 103.500 105.444 -1.944 18016
1832 1 4 . 1 1 20 20 GLY C C 20 173.800 173.800 174.079 -0.279 18016
1833 1 4 . 1 1 20 20 GLY CA C 20 45.800 45.800 44.808 0.992 18016
1834 1 4 . 1 1 20 20 GLY H H 20 7.700 7.700 7.348 0.352 18016
1835 1 4 . 1 1 21 21 TYR N N 21 119.900 119.900 118.236 1.664 18016
1836 1 4 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.929 0.241 18016
1837 1 4 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.408 1.992 18016
1838 1 4 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.793 -0.993 18016
1839 1 4 . 1 1 21 21 TYR H H 21 7.980 7.980 7.837 0.143 18016
1840 1 4 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.481 0.019 18016
1841 1 4 . 1 1 22 22 PRO C C 22 178.700 178.700 176.905 1.795 18016
1842 1 4 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.289 0.711 18016
1843 1 4 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.205 -0.204 18016
1844 1 4 . 1 1 23 23 GLU N N 23 116.300 116.300 117.425 -1.125 18016
1845 1 4 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.486 0.084 18016
1846 1 4 . 1 1 23 23 GLU C C 23 176.300 176.300 176.345 -0.045 18016
1847 1 4 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.346 -0.746 18016
1848 1 4 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.300 0.200 18016
1849 1 4 . 1 1 23 23 GLU H H 23 8.680 8.680 8.250 0.430 18016
1850 1 4 . 1 1 24 24 GLY N N 24 108.100 108.100 107.968 0.132 18016
1851 1 4 . 1 1 24 24 GLY C C 24 173.100 173.100 172.413 0.687 18016
1852 1 4 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.363 -1.463 18016
1853 1 4 . 1 1 24 24 GLY H H 24 7.230 7.230 7.493 -0.263 18016
1854 1 4 . 1 1 25 25 VAL N N 25 121.500 121.500 119.220 2.280 18016
1855 1 4 . 1 1 25 25 VAL HA H 25 3.590 3.590 4.097 -0.507 18016
1856 1 4 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.217 1.083 18016
1857 1 4 . 1 1 25 25 VAL CB C 25 32.100 32.100 33.112 -1.012 18016
1858 1 4 . 1 1 25 25 VAL H H 25 8.050 8.050 8.062 -0.012 18016
1859 1 4 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.446 -0.126 18016
1860 1 4 . 1 1 26 26 PRO C C 26 177.600 177.600 177.749 -0.149 18016
1861 1 4 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.381 0.519 18016
1862 1 4 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.029 0.071 18016
1863 1 4 . 1 1 27 27 GLY N N 27 109.000 109.000 109.478 -0.478 18016
1864 1 4 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.920 1.180 18016
1865 1 4 . 1 1 27 27 GLY H H 27 8.930 8.930 8.823 0.107 18016
1866 1 4 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.272 0.118 18016
1867 1 4 . 1 1 28 28 PRO C C 28 175.800 175.800 177.334 -1.534 18016
1868 1 4 . 1 1 28 28 PRO CA C 28 64.400 64.400 65.111 -0.710 18016
1869 1 4 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.485 0.415 18016
1870 1 4 . 1 1 29 29 ASP N N 29 115.000 115.000 116.230 -1.230 18016
1871 1 4 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.780 -0.290 18016
1872 1 4 . 1 1 29 29 ASP C C 29 177.000 177.000 177.934 -0.934 18016
1873 1 4 . 1 1 29 29 ASP CA C 29 53.900 53.900 56.240 -2.340 18016
1874 1 4 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.553 -0.853 18016
1875 1 4 . 1 1 29 29 ASP H H 29 7.760 7.760 7.867 -0.107 18016
1876 1 4 . 1 1 30 30 ARG N N 30 119.900 119.900 121.781 -1.881 18016
1877 1 4 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.870 -0.300 18016
1878 1 4 . 1 1 30 30 ARG C C 30 176.500 176.500 178.505 -2.005 18016
1879 1 4 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.946 1.954 18016
1880 1 4 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.247 0.253 18016
1881 1 4 . 1 1 30 30 ARG H H 30 7.460 7.460 8.128 -0.668 18016
1882 1 4 . 1 1 31 31 VAL N N 31 117.600 117.600 119.706 -2.106 18016
1883 1 4 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.836 -0.016 18016
1884 1 4 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.499 0.201 18016
1885 1 4 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.329 -0.530 18016
1886 1 4 . 1 1 31 31 VAL H H 31 9.080 9.080 8.215 0.865 18016
1887 1 4 . 1 1 32 32 PRO C C 32 177.000 177.000 178.739 -1.739 18016
1888 1 4 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.870 -0.670 18016
1889 1 4 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.188 -0.388 18016
1890 1 4 . 1 1 33 33 LEU N N 33 115.200 115.200 120.944 -5.744 18016
1891 1 4 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.065 0.055 18016
1892 1 4 . 1 1 33 33 LEU C C 33 178.600 178.600 178.538 0.062 18016
1893 1 4 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.093 0.308 18016
1894 1 4 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.300 0.200 18016
1895 1 4 . 1 1 33 33 LEU H H 33 8.010 8.010 8.115 -0.105 18016
1896 1 4 . 1 1 34 34 LEU N N 34 120.400 120.400 119.137 1.263 18016
1897 1 4 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.061 -0.131 18016
1898 1 4 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.476 0.624 18016
1899 1 4 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.342 0.558 18016
1900 1 4 . 1 1 34 34 LEU H H 34 8.220 8.220 8.310 -0.090 18016
1901 1 4 . 1 1 35 35 ALA N N 35 123.100 123.100 122.465 0.635 18016
1902 1 4 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.090 -0.050 18016
1903 1 4 . 1 1 35 35 ALA C C 35 179.500 179.500 178.924 0.576 18016
1904 1 4 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.938 0.562 18016
1905 1 4 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.468 -0.568 18016
1906 1 4 . 1 1 35 35 ALA H H 35 8.560 8.560 7.967 0.593 18016
1907 1 4 . 1 1 36 36 LEU N N 36 117.600 117.600 118.700 -1.100 18016
1908 1 4 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.243 -0.123 18016
1909 1 4 . 1 1 36 36 LEU C C 36 180.100 180.100 179.132 0.968 18016
1910 1 4 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.337 0.863 18016
1911 1 4 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.851 0.949 18016
1912 1 4 . 1 1 36 36 LEU H H 36 7.850 7.850 7.934 -0.084 18016
1913 1 4 . 1 1 37 37 LEU N N 37 116.700 116.700 119.810 -3.110 18016
1914 1 4 . 1 1 37 37 LEU HA H 37 4.100 4.100 3.936 0.164 18016
1915 1 4 . 1 1 37 37 LEU C C 37 180.100 180.100 178.933 1.167 18016
1916 1 4 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.307 -0.007 18016
1917 1 4 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.895 0.305 18016
1918 1 4 . 1 1 37 37 LEU H H 37 8.730 8.730 8.397 0.333 18016
1919 1 4 . 1 1 38 38 THR N N 38 110.600 110.600 108.559 2.041 18016
1920 1 4 . 1 1 38 38 THR HA H 38 4.440 4.440 4.113 0.327 18016
1921 1 4 . 1 1 38 38 THR C C 38 175.100 175.100 176.887 -1.787 18016
1922 1 4 . 1 1 38 38 THR CA C 38 64.200 64.200 64.288 -0.088 18016
1923 1 4 . 1 1 38 38 THR CB C 38 70.000 70.000 68.612 1.388 18016
1924 1 4 . 1 1 38 38 THR H H 38 8.660 8.660 8.469 0.191 18016
1925 1 4 . 1 1 39 39 ARG N N 39 118.000 118.000 121.855 -3.855 18016
1926 1 4 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.202 0.078 18016
1927 1 4 . 1 1 39 39 ARG C C 39 177.300 177.300 177.050 0.250 18016
1928 1 4 . 1 1 39 39 ARG CA C 39 58.300 58.300 57.864 0.437 18016
1929 1 4 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.328 -0.128 18016
1930 1 4 . 1 1 39 39 ARG H H 39 7.180 7.180 7.631 -0.451 18016
1931 1 4 . 1 1 40 40 ARG N N 40 114.400 114.400 118.176 -3.776 18016
1932 1 4 . 1 1 40 40 ARG C C 40 174.800 174.800 173.842 0.958 18016
1933 1 4 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.395 -0.095 18016
1934 1 4 . 1 1 40 40 ARG CB C 40 34.600 34.600 30.182 4.418 18016
1935 1 4 . 1 1 40 40 ARG H H 40 7.520 7.520 7.829 -0.309 18016
1936 1 4 . 1 1 41 41 LEU N N 41 119.400 119.400 121.028 -1.628 18016
1937 1 4 . 1 1 41 41 LEU C C 41 177.100 177.100 175.398 1.702 18016
1938 1 4 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.827 -1.127 18016
1939 1 4 . 1 1 41 41 LEU CB C 41 44.400 44.400 46.528 -2.128 18016
1940 1 4 . 1 1 41 41 LEU H H 41 8.380 8.380 8.122 0.258 18016
1941 1 4 . 1 1 42 42 THR N N 42 112.000 112.000 115.074 -3.074 18016
1942 1 4 . 1 1 42 42 THR HA H 42 4.440 4.440 4.626 -0.186 18016
1943 1 4 . 1 1 42 42 THR C C 42 175.800 175.800 174.908 0.892 18016
1944 1 4 . 1 1 42 42 THR CA C 42 60.500 60.500 60.182 0.318 18016
1945 1 4 . 1 1 42 42 THR CB C 42 70.800 70.800 70.955 -0.155 18016
1946 1 4 . 1 1 42 42 THR H H 42 9.330 9.330 9.056 0.274 18016
1947 1 4 . 1 1 43 43 ASN N N 43 119.900 119.900 120.615 -0.715 18016
1948 1 4 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.465 -0.215 18016
1949 1 4 . 1 1 43 43 ASN C C 43 177.900 177.900 177.392 0.508 18016
1950 1 4 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.258 0.442 18016
1951 1 4 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.217 -1.016 18016
1952 1 4 . 1 1 43 43 ASN H H 43 9.140 9.140 8.871 0.269 18016
1953 1 4 . 1 1 44 44 ASP N N 44 118.000 118.000 119.260 -1.260 18016
1954 1 4 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.366 0.034 18016
1955 1 4 . 1 1 44 44 ASP C C 44 179.600 179.600 178.359 1.241 18016
1956 1 4 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.729 -0.429 18016
1957 1 4 . 1 1 44 44 ASP H H 44 8.360 8.360 8.747 -0.387 18016
1958 1 4 . 1 1 45 45 GLU N N 45 122.600 122.600 120.449 2.151 18016
1959 1 4 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.103 -0.133 18016
1960 1 4 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.048 0.352 18016
1961 1 4 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.881 0.419 18016
1962 1 4 . 1 1 45 45 GLU H H 45 7.850 7.850 7.662 0.188 18016
1963 1 4 . 1 1 46 46 ILE N N 46 118.900 118.900 120.538 -1.638 18016
1964 1 4 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.745 -0.315 18016
1965 1 4 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.187 1.813 18016
1966 1 4 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.760 -0.060 18016
1967 1 4 . 1 1 46 46 ILE H H 46 8.290 8.290 8.227 0.063 18016
1968 1 4 . 1 1 47 47 LYS N N 47 118.900 118.900 119.405 -0.505 18016
1969 1 4 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.926 -0.056 18016
1970 1 4 . 1 1 47 47 LYS C C 47 178.400 178.400 178.725 -0.325 18016
1971 1 4 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.730 0.570 18016
1972 1 4 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.191 0.409 18016
1973 1 4 . 1 1 47 47 LYS H H 47 8.290 8.290 8.186 0.104 18016
1974 1 4 . 1 1 48 48 ALA N N 48 121.100 121.100 123.375 -2.275 18016
1975 1 4 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.041 0.129 18016
1976 1 4 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.197 -0.097 18016
1977 1 4 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.072 -0.072 18016
1978 1 4 . 1 1 48 48 ALA H H 48 7.710 7.710 7.967 -0.257 18016
1979 1 4 . 1 1 49 49 ILE N N 49 119.900 119.900 117.716 2.184 18016
1980 1 4 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.709 -0.059 18016
1981 1 4 . 1 1 49 49 ILE C C 49 177.300 177.300 178.042 -0.742 18016
1982 1 4 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.607 1.393 18016
1983 1 4 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.500 1.600 18016
1984 1 4 . 1 1 49 49 ILE H H 49 8.130 8.130 8.257 -0.127 18016
1985 1 4 . 1 1 50 50 ALA N N 50 122.000 122.000 122.427 -0.427 18016
1986 1 4 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.986 -0.126 18016
1987 1 4 . 1 1 50 50 ALA C C 50 179.800 179.800 179.912 -0.112 18016
1988 1 4 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.311 0.389 18016
1989 1 4 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.059 -0.160 18016
1990 1 4 . 1 1 50 50 ALA H H 50 8.730 8.730 7.483 1.247 18016
1991 1 4 . 1 1 51 51 GLU N N 51 116.900 116.900 118.055 -1.155 18016
1992 1 4 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.003 0.017 18016
1993 1 4 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.523 -0.122 18016
1994 1 4 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.215 0.285 18016
1995 1 4 . 1 1 51 51 GLU H H 51 8.220 8.220 8.398 -0.178 18016
1996 1 4 . 1 1 52 52 ASP N N 52 120.300 120.300 121.169 -0.869 18016
1997 1 4 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.466 -0.076 18016
1998 1 4 . 1 1 52 52 ASP C C 52 178.900 178.900 178.521 0.379 18016
1999 1 4 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.330 0.170 18016
2000 1 4 . 1 1 52 52 ASP CB C 52 42.500 42.500 40.906 1.595 18016
2001 1 4 . 1 1 52 52 ASP H H 52 7.700 7.700 7.991 -0.291 18016
2002 1 4 . 1 1 53 53 LEU N N 53 118.300 118.300 119.491 -1.191 18016
2003 1 4 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.911 -0.181 18016
2004 1 4 . 1 1 53 53 LEU C C 53 179.000 179.000 178.854 0.146 18016
2005 1 4 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.966 -0.466 18016
2006 1 4 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.826 -0.726 18016
2007 1 4 . 1 1 53 53 LEU H H 53 8.290 8.290 7.787 0.503 18016
2008 1 4 . 1 1 54 54 GLU N N 54 118.700 118.700 117.152 1.548 18016
2009 1 4 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.840 0.380 18016
2010 1 4 . 1 1 54 54 GLU C C 54 178.200 178.200 177.620 0.580 18016
2011 1 4 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.631 0.069 18016
2012 1 4 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.820 1.080 18016
2013 1 4 . 1 1 54 54 GLU H H 54 8.070 8.070 8.436 -0.366 18016
2014 1 4 . 1 1 55 55 LYS N N 55 117.700 117.700 117.045 0.655 18016
2015 1 4 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.144 0.006 18016
2016 1 4 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.741 0.559 18016
2017 1 4 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.648 0.052 18016
2018 1 4 . 1 1 55 55 LYS H H 55 7.750 7.750 7.562 0.188 18016
2019 1 4 . 1 1 56 56 ARG N N 56 117.100 117.100 118.188 -1.088 18016
2020 1 4 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.245 0.025 18016
2021 1 4 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.769 -0.969 18016
2022 1 4 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.271 -0.271 18016
2023 1 4 . 1 1 56 56 ARG H H 56 8.270 8.270 7.345 0.925 18016
2024 1 4 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.643 -0.283 18016
2025 1 4 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.514 -0.414 18016
2026 1 4 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.165 -0.965 18016
2027 1 4 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.788 -0.278 18016
2028 1 4 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.173 1.027 18016
2029 1 4 . 1 1 58 58 HIS CB C 58 27.300 27.300 30.408 -3.108 18016
2030 1 4 . 1 1 59 59 PHE N N 59 120.400 120.400 115.870 4.530 18016
2031 1 4 . 1 1 59 59 PHE C C 59 175.500 175.500 175.417 0.083 18016
2032 1 4 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.252 -0.052 18016
2033 1 4 . 1 1 59 59 PHE CB C 59 39.300 39.300 38.608 0.692 18016
2034 1 4 . 1 1 59 59 PHE H H 59 7.710 7.710 8.268 -0.558 18016
2035 1 4 . 1 1 60 60 ASP N N 60 120.800 120.800 120.224 0.576 18016
2036 1 4 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.174 0.316 18016
2037 1 4 . 1 1 60 60 ASP CA C 60 54.300 54.300 53.810 0.490 18016
2038 1 4 . 1 1 60 60 ASP CB C 60 41.100 41.100 41.346 -0.246 18016
2039 1 4 . 1 1 60 60 ASP H H 60 8.180 8.180 7.483 0.697 18016
2040 1 4 . 1 1 61 61 HIS N N 61 118.300 118.300 115.402 2.898 18016
2041 1 4 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.608 -0.218 18016
2042 1 4 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.937 0.763 18016
2043 1 4 . 1 1 61 61 HIS CB C 61 28.800 28.800 31.000 -2.200 18016
2044 1 4 . 1 1 61 61 HIS H H 61 8.550 8.550 7.924 0.626 18016
2045 1 4 . 1 1 62 62 ILE HA H 62 4.010 4.010 3.598 0.412 18016
2046 1 4 . 1 1 62 62 ILE C C 62 173.800 173.800 175.915 -2.115 18016
2047 1 4 . 1 1 62 62 ILE CA C 62 66.500 66.500 63.023 3.477 18016
2048 1 4 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.026 2.074 18016
2049 1 4 . 1 1 63 63 ASP N N 63 125.100 125.100 117.327 7.773 18016
2050 1 4 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.248 0.352 18016
2051 1 4 . 1 1 63 63 ASP CA C 63 52.800 52.800 54.852 -2.052 18016
2052 1 4 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.482 -0.982 18016
2053 1 4 . 1 1 63 63 ASP H H 63 8.360 8.360 7.889 0.471 18016
2054 1 4 . 1 1 64 64 ILE HA H 64 3.670 3.670 4.159 -0.489 18016
2055 1 4 . 1 1 64 64 ILE C C 64 177.000 177.000 176.650 0.350 18016
2056 1 4 . 1 1 64 64 ILE CA C 64 62.100 62.100 62.820 -0.720 18016
2057 1 4 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.106 -1.506 18016
2058 1 4 . 1 1 65 65 GLY N N 65 107.600 107.600 108.132 -0.532 18016
2059 1 4 . 1 1 65 65 GLY C C 65 177.000 177.000 176.116 0.884 18016
2060 1 4 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.827 0.473 18016
2061 1 4 . 1 1 65 65 GLY H H 65 8.440 8.440 8.116 0.324 18016
2062 1 4 . 1 1 66 66 VAL N N 66 121.800 121.800 121.909 -0.109 18016
2063 1 4 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.667 0.093 18016
2064 1 4 . 1 1 66 66 VAL C C 66 178.500 178.500 177.020 1.480 18016
2065 1 4 . 1 1 66 66 VAL CA C 66 65.600 65.600 64.855 0.745 18016
2066 1 4 . 1 1 66 66 VAL CB C 66 32.000 32.000 32.078 -0.078 18016
2067 1 4 . 1 1 66 66 VAL H H 66 7.550 7.550 8.578 -1.028 18016
2068 1 4 . 1 1 67 67 LEU N N 67 120.900 120.900 119.387 1.513 18016
2069 1 4 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.001 0.069 18016
2070 1 4 . 1 1 67 67 LEU C C 67 179.000 179.000 179.135 -0.135 18016
2071 1 4 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.659 -0.059 18016
2072 1 4 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.566 1.734 18016
2073 1 4 . 1 1 67 67 LEU H H 67 7.650 7.650 7.393 0.257 18016
2074 1 4 . 1 1 68 68 ILE N N 68 118.900 118.900 118.118 0.782 18016
2075 1 4 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.761 -0.051 18016
2076 1 4 . 1 1 68 68 ILE C C 68 179.500 179.500 178.385 1.115 18016
2077 1 4 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.932 0.268 18016
2078 1 4 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.436 0.064 18016
2079 1 4 . 1 1 68 68 ILE H H 68 8.580 8.580 7.619 0.961 18016
2080 1 4 . 1 1 69 69 THR N N 69 118.100 118.100 113.757 4.343 18016
2081 1 4 . 1 1 69 69 THR HA H 69 3.940 3.940 4.064 -0.124 18016
2082 1 4 . 1 1 69 69 THR C C 69 176.200 176.200 175.983 0.217 18016
2083 1 4 . 1 1 69 69 THR CA C 69 66.600 66.600 65.873 0.727 18016
2084 1 4 . 1 1 69 69 THR CB C 69 68.500 68.500 68.305 0.195 18016
2085 1 4 . 1 1 69 69 THR H H 69 7.840 7.840 7.587 0.253 18016
2086 1 4 . 1 1 70 70 GLN N N 70 121.600 121.600 120.048 1.552 18016
2087 1 4 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.189 -0.079 18016
2088 1 4 . 1 1 70 70 GLN C C 70 178.100 178.100 178.045 0.055 18016
2089 1 4 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.392 0.709 18016
2090 1 4 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.781 -0.481 18016
2091 1 4 . 1 1 70 70 GLN H H 70 8.100 8.100 7.396 0.704 18016
2092 1 4 . 1 1 71 71 MET N N 71 118.700 118.700 119.699 -0.999 18016
2093 1 4 . 1 1 71 71 MET HA H 71 4.010 4.010 4.332 -0.322 18016
2094 1 4 . 1 1 71 71 MET C C 71 176.300 176.300 178.882 -2.582 18016
2095 1 4 . 1 1 71 71 MET CA C 71 58.100 58.100 59.160 -1.060 18016
2096 1 4 . 1 1 71 71 MET CB C 71 33.600 33.600 32.616 0.984 18016
2097 1 4 . 1 1 71 71 MET H H 71 8.350 8.350 8.627 -0.277 18016
2098 1 4 . 1 1 72 72 THR N N 72 111.600 111.600 111.605 -0.005 18016
2099 1 4 . 1 1 72 72 THR HA H 72 3.940 3.940 4.085 -0.145 18016
2100 1 4 . 1 1 72 72 THR C C 72 175.800 175.800 175.621 0.179 18016
2101 1 4 . 1 1 72 72 THR CA C 72 65.300 65.300 64.747 0.553 18016
2102 1 4 . 1 1 72 72 THR CB C 72 69.100 69.100 68.983 0.117 18016
2103 1 4 . 1 1 72 72 THR H H 72 7.840 7.840 7.748 0.092 18016
2104 1 4 . 1 1 73 73 ASP N N 73 121.100 121.100 120.026 1.074 18016
2105 1 4 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.641 -0.111 18016
2106 1 4 . 1 1 73 73 ASP C C 73 176.600 176.600 175.529 1.071 18016
2107 1 4 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.211 0.989 18016
2108 1 4 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.637 -1.237 18016
2109 1 4 . 1 1 73 73 ASP H H 73 7.840 7.840 7.668 0.172 18016
2110 1 4 . 1 1 74 74 GLU N N 74 121.100 121.100 118.858 2.242 18016
2111 1 4 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.541 -0.201 18016
2112 1 4 . 1 1 74 74 GLU C C 74 173.800 173.800 175.130 -1.330 18016
2113 1 4 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.517 -0.018 18016
2114 1 4 . 1 1 74 74 GLU CB C 74 30.600 30.600 32.246 -1.646 18016
2115 1 4 . 1 1 74 74 GLU H H 74 7.980 7.980 8.241 -0.261 18016
2116 1 4 . 1 1 75 75 MET N N 75 125.800 125.800 125.312 0.488 18016
2117 1 4 . 1 1 75 75 MET HA H 75 4.710 4.710 4.908 -0.198 18016
2118 1 4 . 1 1 75 75 MET CA C 75 53.800 53.800 53.181 0.619 18016
2119 1 4 . 1 1 75 75 MET CB C 75 31.700 31.700 31.814 -0.114 18016
2120 1 4 . 1 1 75 75 MET H H 75 8.380 8.380 8.460 -0.080 18016
2121 1 4 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.463 0.047 18016
2122 1 4 . 1 1 76 76 PRO C C 76 175.700 175.700 176.709 -1.009 18016
2123 1 4 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.394 -1.394 18016
2124 1 4 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.325 -0.525 18016
2125 1 4 . 1 1 77 77 ARG N N 77 119.700 119.700 117.347 2.353 18016
2126 1 4 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.616 -0.346 18016
2127 1 4 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.973 0.827 18016
2128 1 4 . 1 1 77 77 ARG CB C 77 30.700 30.700 33.081 -2.381 18016
2129 1 4 . 1 1 77 77 ARG H H 77 8.940 8.940 7.720 1.220 18016
2130 1 4 . 1 1 78 78 GLU N N 78 124.700 124.700 123.555 1.145 18016
2131 1 4 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.975 -0.015 18016
2132 1 4 . 1 1 78 78 GLU C C 78 179.000 179.000 177.630 1.370 18016
2133 1 4 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.489 -0.689 18016
2134 1 4 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.431 -0.431 18016
2135 1 4 . 1 1 78 78 GLU H H 78 9.170 9.170 8.991 0.179 18016
2136 1 4 . 1 1 79 79 GLU N N 79 116.800 116.800 120.452 -3.652 18016
2137 1 4 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.115 0.004 18016
2138 1 4 . 1 1 79 79 GLU C C 79 179.100 179.100 177.776 1.324 18016
2139 1 4 . 1 1 79 79 GLU CA C 79 59.700 59.700 60.030 -0.330 18016
2140 1 4 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.094 -0.094 18016
2141 1 4 . 1 1 79 79 GLU H H 79 9.660 9.660 8.715 0.945 18016
2142 1 4 . 1 1 80 80 ASP N N 80 120.000 120.000 119.223 0.777 18016
2143 1 4 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.432 0.258 18016
2144 1 4 . 1 1 80 80 ASP C C 80 177.300 177.300 178.613 -1.313 18016
2145 1 4 . 1 1 80 80 ASP CA C 80 57.400 57.400 58.172 -0.772 18016
2146 1 4 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.403 1.197 18016
2147 1 4 . 1 1 80 80 ASP H H 80 7.310 7.310 8.117 -0.807 18016
2148 1 4 . 1 1 81 81 ILE N N 81 120.100 120.100 120.521 -0.421 18016
2149 1 4 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.655 -0.165 18016
2150 1 4 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.854 0.446 18016
2151 1 4 . 1 1 81 81 ILE CB C 81 38.300 38.300 38.056 0.244 18016
2152 1 4 . 1 1 81 81 ILE H H 81 7.610 7.610 8.154 -0.544 18016
2153 1 4 . 1 1 82 82 GLU N N 82 118.100 118.100 118.971 -0.871 18016
2154 1 4 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.077 0.203 18016
2155 1 4 . 1 1 82 82 GLU C C 82 177.800 177.800 178.860 -1.060 18016
2156 1 4 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.371 -1.371 18016
2157 1 4 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.108 -0.308 18016
2158 1 4 . 1 1 82 82 GLU H H 82 8.550 8.550 8.584 -0.034 18016
2159 1 4 . 1 1 83 83 ARG N N 83 119.900 119.900 120.624 -0.724 18016
2160 1 4 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.135 -0.105 18016
2161 1 4 . 1 1 83 83 ARG C C 83 179.400 179.400 178.951 0.449 18016
2162 1 4 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.228 0.672 18016
2163 1 4 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.428 -0.828 18016
2164 1 4 . 1 1 83 83 ARG H H 83 7.590 7.590 8.121 -0.531 18016
2165 1 4 . 1 1 84 84 VAL N N 84 120.400 120.400 120.073 0.327 18016
2166 1 4 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.971 -0.221 18016
2167 1 4 . 1 1 84 84 VAL C C 84 177.400 177.400 177.358 0.042 18016
2168 1 4 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.663 1.237 18016
2169 1 4 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.144 -0.244 18016
2170 1 4 . 1 1 84 84 VAL H H 84 7.550 7.550 8.448 -0.898 18016
2171 1 4 . 1 1 85 85 ARG N N 85 121.600 121.600 120.123 1.477 18016
2172 1 4 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.193 -0.183 18016
2173 1 4 . 1 1 85 85 ARG C C 85 178.100 178.100 178.902 -0.802 18016
2174 1 4 . 1 1 85 85 ARG CA C 85 60.900 60.900 60.044 0.856 18016
2175 1 4 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.961 0.239 18016
2176 1 4 . 1 1 85 85 ARG H H 85 9.090 9.090 8.432 0.658 18016
2177 1 4 . 1 1 86 86 ARG N N 86 115.600 115.600 118.678 -3.078 18016
2178 1 4 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.130 -0.250 18016
2179 1 4 . 1 1 86 86 ARG C C 86 179.000 179.000 178.520 0.480 18016
2180 1 4 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.069 0.331 18016
2181 1 4 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.427 0.973 18016
2182 1 4 . 1 1 86 86 ARG H H 86 8.660 8.660 8.472 0.188 18016
2183 1 4 . 1 1 87 87 HIS N N 87 118.000 118.000 120.273 -2.273 18016
2184 1 4 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.330 0.030 18016
2185 1 4 . 1 1 87 87 HIS C C 87 178.400 178.400 177.437 0.963 18016
2186 1 4 . 1 1 87 87 HIS CA C 87 59.600 59.600 58.389 1.211 18016
2187 1 4 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.431 0.269 18016
2188 1 4 . 1 1 87 87 HIS H H 87 7.640 7.640 7.846 -0.206 18016
2189 1 4 . 1 1 88 88 LEU N N 88 119.600 119.600 118.894 0.706 18016
2190 1 4 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.026 -0.446 18016
2191 1 4 . 1 1 88 88 LEU C C 88 180.000 180.000 178.952 1.048 18016
2192 1 4 . 1 1 88 88 LEU CA C 88 57.200 57.200 56.766 0.434 18016
2193 1 4 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.024 1.576 18016
2194 1 4 . 1 1 88 88 LEU H H 88 8.650 8.650 8.478 0.172 18016
2195 1 4 . 1 1 89 89 ALA N N 89 118.500 118.500 122.054 -3.554 18016
2196 1 4 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.725 0.635 18016
2197 1 4 . 1 1 89 89 ALA C C 89 180.400 180.400 179.621 0.779 18016
2198 1 4 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.882 -1.282 18016
2199 1 4 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.478 -0.378 18016
2200 1 4 . 1 1 89 89 ALA H H 89 8.870 8.870 8.283 0.587 18016
2201 1 4 . 1 1 90 90 LEU N N 90 119.400 119.400 116.929 2.471 18016
2202 1 4 . 1 1 90 90 LEU HA H 90 4.210 4.210 4.058 0.152 18016
2203 1 4 . 1 1 90 90 LEU C C 90 179.100 179.100 179.028 0.072 18016
2204 1 4 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.084 0.416 18016
2205 1 4 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.864 -0.163 18016
2206 1 4 . 1 1 90 90 LEU H H 90 7.390 7.390 7.492 -0.102 18016
2207 1 4 . 1 1 91 91 GLN N N 91 114.500 114.500 116.130 -1.630 18016
2208 1 4 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.351 0.349 18016
2209 1 4 . 1 1 91 91 GLN C C 91 175.800 175.800 176.934 -1.134 18016
2210 1 4 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.623 -2.123 18016
2211 1 4 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.188 -2.088 18016
2212 1 4 . 1 1 91 91 GLN H H 91 7.810 7.810 7.817 -0.008 18016
2213 1 4 . 1 1 92 92 GLY N N 92 107.900 107.900 105.969 1.931 18016
2214 1 4 . 1 1 92 92 GLY C C 92 172.100 172.100 171.742 0.358 18016
2215 1 4 . 1 1 92 92 GLY CA C 92 44.000 44.000 44.861 -0.861 18016
2216 1 4 . 1 1 92 92 GLY H H 92 7.710 7.710 8.279 -0.569 18016
2217 1 4 . 1 1 93 93 TRP N N 93 114.200 114.200 121.619 -7.419 18016
2218 1 4 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.744 1.256 18016
2219 1 4 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.449 -1.249 18016
2220 1 4 . 1 1 93 93 TRP H H 93 8.450 8.450 8.267 0.183 18016
2221 1 4 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.295 0.165 18016
2222 1 4 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.626 -0.826 18016
2223 1 4 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.347 0.253 18016
2224 1 4 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.244 -0.744 18016
2225 1 4 . 1 1 95 95 LEU C C 95 175.000 175.000 177.824 -2.824 18016
2226 1 4 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.196 -0.096 18016
2227 1 4 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.985 1.115 18016
2228 1 4 . 1 1 96 96 ASP N N 96 114.000 114.000 119.555 -5.555 18016
2229 1 4 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.711 0.239 18016
2230 1 4 . 1 1 96 96 ASP C C 96 175.800 175.800 175.742 0.058 18016
2231 1 4 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.104 -2.104 18016
2232 1 4 . 1 1 96 96 ASP CB C 96 41.900 41.900 42.193 -0.293 18016
2233 1 4 . 1 1 96 96 ASP H H 96 7.230 7.230 7.908 -0.678 18016
2234 1 4 . 1 1 97 97 ASP N N 97 123.200 123.200 119.100 4.100 18016
2235 1 4 . 1 1 97 97 ASP HA H 97 4.610 4.610 5.012 -0.402 18016
2236 1 4 . 1 1 97 97 ASP CA C 97 53.500 53.500 50.764 2.736 18016
2237 1 4 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.359 -4.659 18016
2238 1 4 . 1 1 97 97 ASP H H 97 7.420 7.420 7.782 -0.362 18016
2239 1 4 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.838 0.452 18016
2240 1 4 . 1 1 98 98 PRO C C 98 177.500 177.500 176.108 1.392 18016
2241 1 4 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.347 0.353 18016
2242 1 4 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.509 -0.609 18016
2243 1 4 . 1 1 99 99 ARG N N 99 121.300 121.300 122.370 -1.070 18016
2244 1 4 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.309 -0.599 18016
2245 1 4 . 1 1 99 99 ARG C C 99 176.500 176.500 176.412 0.088 18016
2246 1 4 . 1 1 99 99 ARG CA C 99 56.100 56.100 56.921 -0.821 18016
2247 1 4 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.615 -0.115 18016
2248 1 4 . 1 1 99 99 ARG H H 99 8.390 8.390 8.631 -0.241 18016
2249 1 4 . 1 1 100 100 ASP N N 100 119.600 119.600 116.793 2.807 18016
2250 1 4 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.823 -0.323 18016
2251 1 4 . 1 1 100 100 ASP C C 100 177.000 177.000 176.064 0.936 18016
2252 1 4 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.187 1.513 18016
2253 1 4 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.804 -1.905 18016
2254 1 4 . 1 1 100 100 ASP H H 100 8.260 8.260 7.896 0.364 18016
2255 1 4 . 1 1 101 101 GLY N N 101 109.300 109.300 108.437 0.863 18016
2256 1 4 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.856 0.544 18016
2257 1 4 . 1 1 101 101 GLY H H 101 8.450 8.450 8.167 0.283 18016
2258 1 4 . 1 1 102 102 GLU N N 102 119.800 119.800 122.911 -3.111 18016
2259 1 4 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.128 0.182 18016
2260 1 4 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.376 -0.376 18016
2261 1 4 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.420 0.080 18016
2262 1 4 . 1 1 102 102 GLU H H 102 8.140 8.140 8.189 -0.049 18016
2263 1 4 . 1 1 103 103 GLU N N 103 123.000 123.000 123.260 -0.260 18016
2264 1 4 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.263 0.297 18016
2265 1 4 . 1 1 103 103 GLU CA C 103 54.300 54.300 55.185 -0.885 18016
2266 1 4 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.977 -0.377 18016
2267 1 4 . 1 1 103 103 GLU H H 103 8.580 8.580 8.530 0.050 18016
2268 1 4 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.505 -0.025 18016
2269 1 4 . 1 1 104 104 PRO C C 104 176.800 176.800 175.999 0.801 18016
2270 1 4 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.112 0.288 18016
2271 1 4 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.116 -0.016 18016
2272 1 4 . 1 1 105 105 ASP N N 105 120.400 120.400 121.807 -1.407 18016
2273 1 4 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.637 -0.057 18016
2274 1 4 . 1 1 105 105 ASP C C 105 177.100 177.100 175.897 1.203 18016
2275 1 4 . 1 1 105 105 ASP CA C 105 54.300 54.300 53.938 0.362 18016
2276 1 4 . 1 1 105 105 ASP CB C 105 41.400 41.400 42.534 -1.134 18016
2277 1 4 . 1 1 105 105 ASP H H 105 8.500 8.500 8.087 0.413 18016
2278 1 4 . 1 1 106 106 GLY N N 106 109.300 109.300 107.864 1.436 18016
2279 1 4 . 1 1 106 106 GLY C C 106 174.600 174.600 174.268 0.332 18016
2280 1 4 . 1 1 106 106 GLY CA C 106 45.400 45.400 44.988 0.412 18016
2281 1 4 . 1 1 106 106 GLY H H 106 8.360 8.360 8.457 -0.097 18016
2282 1 4 . 1 1 107 107 GLU N N 107 120.400 120.400 119.595 0.805 18016
2283 1 4 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.555 -0.215 18016
2284 1 4 . 1 1 107 107 GLU C C 107 177.100 177.100 175.927 1.173 18016
2285 1 4 . 1 1 107 107 GLU CA C 107 56.500 56.500 55.212 1.288 18016
2286 1 4 . 1 1 107 107 GLU CB C 107 30.200 30.200 30.191 0.009 18016
2287 1 4 . 1 1 107 107 GLU H H 107 8.410 8.410 7.961 0.449 18016
2288 1 4 . 1 1 108 108 SER N N 108 116.600 116.600 116.571 0.029 18016
2289 1 4 . 1 1 108 108 SER HA H 108 4.450 4.450 4.629 -0.179 18016
2290 1 4 . 1 1 108 108 SER C C 108 175.300 175.300 173.474 1.826 18016
2291 1 4 . 1 1 108 108 SER CA C 108 58.700 58.700 57.987 0.713 18016
2292 1 4 . 1 1 108 108 SER CB C 108 63.800 63.800 62.944 0.856 18016
2293 1 4 . 1 1 108 108 SER H H 108 8.460 8.460 8.607 -0.147 18016
2294 1 4 . 1 1 109 109 GLY N N 109 110.800 110.800 108.529 2.271 18016
2295 1 4 . 1 1 109 109 GLY C C 109 174.500 174.500 174.041 0.459 18016
2296 1 4 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.087 0.213 18016
2297 1 4 . 1 1 109 109 GLY H H 109 8.500 8.500 7.998 0.502 18016
2298 1 4 . 1 1 110 110 GLY N N 110 108.800 108.800 110.022 -1.222 18016
2299 1 4 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.469 -0.069 18016
2300 1 4 . 1 1 110 110 GLY H H 110 8.140 8.140 8.321 -0.181 18016
2301 1 4 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.679 -0.069 18016
2302 1 4 . 1 1 111 111 PRO C C 111 176.000 176.000 176.710 -0.710 18016
2303 1 4 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.288 0.312 18016
2304 1 4 . 1 1 111 111 PRO CB C 111 34.600 34.600 33.066 1.534 18016
2305 1 5 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.704 -0.274 18016
2306 1 5 . 1 1 2 2 PRO C C 2 177.600 177.600 176.507 1.093 18016
2307 1 5 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.346 0.954 18016
2308 1 5 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.084 0.216 18016
2309 1 5 . 1 1 3 3 GLY N N 3 110.000 110.000 112.153 -2.153 18016
2310 1 5 . 1 1 3 3 GLY C C 3 174.200 174.200 173.777 0.423 18016
2311 1 5 . 1 1 3 3 GLY CA C 3 45.400 45.400 44.641 0.759 18016
2312 1 5 . 1 1 3 3 GLY H H 3 8.700 8.700 8.392 0.308 18016
2313 1 5 . 1 1 4 4 SER N N 4 115.400 115.400 116.650 -1.250 18016
2314 1 5 . 1 1 4 4 SER HA H 4 4.440 4.440 4.489 -0.049 18016
2315 1 5 . 1 1 4 4 SER C C 4 174.800 174.800 174.077 0.723 18016
2316 1 5 . 1 1 4 4 SER CA C 4 58.400 58.400 58.748 -0.348 18016
2317 1 5 . 1 1 4 4 SER CB C 4 63.800 63.800 63.791 0.009 18016
2318 1 5 . 1 1 4 4 SER H H 4 8.210 8.210 8.122 0.088 18016
2319 1 5 . 1 1 5 5 MET N N 5 122.200 122.200 126.100 -3.900 18016
2320 1 5 . 1 1 5 5 MET HA H 5 4.510 4.510 4.597 -0.087 18016
2321 1 5 . 1 1 5 5 MET CA C 5 55.600 55.600 55.840 -0.240 18016
2322 1 5 . 1 1 5 5 MET CB C 5 32.900 32.900 34.959 -2.059 18016
2323 1 5 . 1 1 5 5 MET H H 5 8.570 8.570 9.047 -0.477 18016
2324 1 5 . 1 1 6 6 VAL N N 6 120.000 120.000 116.794 3.206 18016
2325 1 5 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.174 -0.124 18016
2326 1 5 . 1 1 6 6 VAL C C 6 175.700 175.700 175.648 0.052 18016
2327 1 5 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.632 1.068 18016
2328 1 5 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.167 0.333 18016
2329 1 5 . 1 1 6 6 VAL H H 6 8.150 8.150 7.689 0.461 18016
2330 1 5 . 1 1 7 7 ASN N N 7 122.000 122.000 118.389 3.611 18016
2331 1 5 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.544 0.116 18016
2332 1 5 . 1 1 7 7 ASN C C 7 175.200 175.200 176.842 -1.642 18016
2333 1 5 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.094 -0.894 18016
2334 1 5 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.629 -0.729 18016
2335 1 5 . 1 1 7 7 ASN H H 7 8.010 8.010 8.298 -0.288 18016
2336 1 5 . 1 1 8 8 ALA N N 8 126.500 126.500 125.244 1.256 18016
2337 1 5 . 1 1 8 8 ALA C C 8 180.200 180.200 179.612 0.588 18016
2338 1 5 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.056 0.444 18016
2339 1 5 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.826 -0.426 18016
2340 1 5 . 1 1 8 8 ALA H H 8 9.020 9.020 8.692 0.328 18016
2341 1 5 . 1 1 9 9 PHE N N 9 121.300 121.300 119.480 1.820 18016
2342 1 5 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.068 0.222 18016
2343 1 5 . 1 1 9 9 PHE C C 9 177.200 177.200 177.164 0.036 18016
2344 1 5 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.965 -0.665 18016
2345 1 5 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.947 0.253 18016
2346 1 5 . 1 1 9 9 PHE H H 9 8.570 8.570 8.027 0.543 18016
2347 1 5 . 1 1 10 10 LEU N N 10 117.200 117.200 119.363 -2.163 18016
2348 1 5 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.071 -0.371 18016
2349 1 5 . 1 1 10 10 LEU C C 10 179.700 179.700 179.284 0.416 18016
2350 1 5 . 1 1 10 10 LEU CA C 10 57.600 57.600 58.106 -0.506 18016
2351 1 5 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.596 0.104 18016
2352 1 5 . 1 1 10 10 LEU H H 10 8.150 8.150 8.059 0.091 18016
2353 1 5 . 1 1 11 11 ALA N N 11 121.500 121.500 121.292 0.208 18016
2354 1 5 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.897 0.123 18016
2355 1 5 . 1 1 11 11 ALA C C 11 180.900 180.900 179.497 1.403 18016
2356 1 5 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.458 -0.458 18016
2357 1 5 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.001 -0.001 18016
2358 1 5 . 1 1 11 11 ALA H H 11 8.460 8.460 8.562 -0.102 18016
2359 1 5 . 1 1 12 12 LYS N N 12 120.700 120.700 118.822 1.878 18016
2360 1 5 . 1 1 12 12 LYS HA H 12 4.050 4.050 3.997 0.053 18016
2361 1 5 . 1 1 12 12 LYS C C 12 179.700 179.700 178.682 1.018 18016
2362 1 5 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.472 -0.272 18016
2363 1 5 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.350 -0.750 18016
2364 1 5 . 1 1 12 12 LYS H H 12 7.820 7.820 7.525 0.295 18016
2365 1 5 . 1 1 13 13 ILE N N 13 120.100 120.100 119.829 0.271 18016
2366 1 5 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.836 -0.146 18016
2367 1 5 . 1 1 13 13 ILE C C 13 178.100 178.100 178.193 -0.093 18016
2368 1 5 . 1 1 13 13 ILE CA C 13 63.000 63.000 64.125 -1.125 18016
2369 1 5 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.723 -1.323 18016
2370 1 5 . 1 1 13 13 ILE H H 13 7.640 7.640 7.926 -0.286 18016
2371 1 5 . 1 1 14 14 ALA N N 14 122.700 122.700 122.119 0.581 18016
2372 1 5 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.955 -0.095 18016
2373 1 5 . 1 1 14 14 ALA C C 14 179.000 179.000 179.580 -0.580 18016
2374 1 5 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.458 0.542 18016
2375 1 5 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.058 -0.059 18016
2376 1 5 . 1 1 14 14 ALA H H 14 8.680 8.680 8.392 0.288 18016
2377 1 5 . 1 1 15 15 ALA N N 15 118.700 118.700 121.830 -3.130 18016
2378 1 5 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.057 0.033 18016
2379 1 5 . 1 1 15 15 ALA C C 15 180.400 180.400 178.896 1.504 18016
2380 1 5 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.756 0.244 18016
2381 1 5 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.436 -0.736 18016
2382 1 5 . 1 1 15 15 ALA H H 15 8.070 8.070 8.139 -0.069 18016
2383 1 5 . 1 1 16 16 TRP N N 16 122.900 122.900 121.255 1.645 18016
2384 1 5 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.253 0.307 18016
2385 1 5 . 1 1 16 16 TRP C C 16 178.400 178.400 177.993 0.407 18016
2386 1 5 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.284 -1.684 18016
2387 1 5 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.088 -0.788 18016
2388 1 5 . 1 1 16 16 TRP H H 16 7.820 7.820 8.308 -0.488 18016
2389 1 5 . 1 1 17 17 LEU N N 17 120.400 120.400 118.922 1.478 18016
2390 1 5 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.203 0.407 18016
2391 1 5 . 1 1 17 17 LEU C C 17 179.000 179.000 178.767 0.233 18016
2392 1 5 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.601 0.299 18016
2393 1 5 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.617 0.383 18016
2394 1 5 . 1 1 17 17 LEU H H 17 8.630 8.630 8.339 0.291 18016
2395 1 5 . 1 1 18 18 ASN N N 18 116.200 116.200 117.383 -1.183 18016
2396 1 5 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.552 -0.242 18016
2397 1 5 . 1 1 18 18 ASN C C 18 177.100 177.100 177.240 -0.140 18016
2398 1 5 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.836 -0.236 18016
2399 1 5 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.935 0.265 18016
2400 1 5 . 1 1 18 18 ASN H H 18 8.350 8.350 8.286 0.064 18016
2401 1 5 . 1 1 19 19 ALA N N 19 119.600 119.600 119.757 -0.157 18016
2402 1 5 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.214 -0.124 18016
2403 1 5 . 1 1 19 19 ALA C C 19 180.100 180.100 178.655 1.445 18016
2404 1 5 . 1 1 19 19 ALA CA C 19 54.200 54.200 53.836 0.364 18016
2405 1 5 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.590 -0.990 18016
2406 1 5 . 1 1 19 19 ALA H H 19 7.920 7.920 8.149 -0.229 18016
2407 1 5 . 1 1 20 20 GLY N N 20 103.500 103.500 105.992 -2.492 18016
2408 1 5 . 1 1 20 20 GLY C C 20 173.800 173.800 174.037 -0.237 18016
2409 1 5 . 1 1 20 20 GLY CA C 20 45.800 45.800 44.691 1.109 18016
2410 1 5 . 1 1 20 20 GLY H H 20 7.700 7.700 7.392 0.308 18016
2411 1 5 . 1 1 21 21 TYR N N 21 119.900 119.900 118.931 0.969 18016
2412 1 5 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.912 0.258 18016
2413 1 5 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.720 1.680 18016
2414 1 5 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.489 -0.689 18016
2415 1 5 . 1 1 21 21 TYR H H 21 7.980 7.980 7.764 0.216 18016
2416 1 5 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.281 0.219 18016
2417 1 5 . 1 1 22 22 PRO C C 22 178.700 178.700 177.340 1.360 18016
2418 1 5 . 1 1 22 22 PRO CA C 22 65.000 65.000 65.188 -0.188 18016
2419 1 5 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.201 -0.201 18016
2420 1 5 . 1 1 23 23 GLU N N 23 116.300 116.300 117.796 -1.496 18016
2421 1 5 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.288 0.282 18016
2422 1 5 . 1 1 23 23 GLU C C 23 176.300 176.300 176.285 0.015 18016
2423 1 5 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.967 -1.367 18016
2424 1 5 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.770 -0.271 18016
2425 1 5 . 1 1 23 23 GLU H H 23 8.680 8.680 8.460 0.220 18016
2426 1 5 . 1 1 24 24 GLY N N 24 108.100 108.100 106.998 1.102 18016
2427 1 5 . 1 1 24 24 GLY C C 24 173.100 173.100 171.841 1.259 18016
2428 1 5 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.375 -1.475 18016
2429 1 5 . 1 1 24 24 GLY H H 24 7.230 7.230 7.674 -0.444 18016
2430 1 5 . 1 1 25 25 VAL N N 25 121.500 121.500 120.811 0.689 18016
2431 1 5 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.723 -0.133 18016
2432 1 5 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.877 0.423 18016
2433 1 5 . 1 1 25 25 VAL CB C 25 32.100 32.100 31.600 0.500 18016
2434 1 5 . 1 1 25 25 VAL H H 25 8.050 8.050 8.025 0.025 18016
2435 1 5 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.490 -0.170 18016
2436 1 5 . 1 1 26 26 PRO C C 26 177.600 177.600 177.948 -0.348 18016
2437 1 5 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.580 0.320 18016
2438 1 5 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.996 0.104 18016
2439 1 5 . 1 1 27 27 GLY N N 27 109.000 109.000 109.940 -0.940 18016
2440 1 5 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.943 1.157 18016
2441 1 5 . 1 1 27 27 GLY H H 27 8.930 8.930 8.855 0.075 18016
2442 1 5 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.313 0.077 18016
2443 1 5 . 1 1 28 28 PRO C C 28 175.800 175.800 178.191 -2.391 18016
2444 1 5 . 1 1 28 28 PRO CA C 28 64.400 64.400 65.234 -0.834 18016
2445 1 5 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.418 0.482 18016
2446 1 5 . 1 1 29 29 ASP N N 29 115.000 115.000 118.243 -3.243 18016
2447 1 5 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.773 -0.283 18016
2448 1 5 . 1 1 29 29 ASP C C 29 177.000 177.000 177.997 -0.997 18016
2449 1 5 . 1 1 29 29 ASP CA C 29 53.900 53.900 56.536 -2.636 18016
2450 1 5 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.099 -0.399 18016
2451 1 5 . 1 1 29 29 ASP H H 29 7.760 7.760 8.359 -0.599 18016
2452 1 5 . 1 1 30 30 ARG N N 30 119.900 119.900 121.579 -1.679 18016
2453 1 5 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.832 -0.262 18016
2454 1 5 . 1 1 30 30 ARG C C 30 176.500 176.500 178.418 -1.918 18016
2455 1 5 . 1 1 30 30 ARG CA C 30 61.900 61.900 60.052 1.848 18016
2456 1 5 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.215 0.285 18016
2457 1 5 . 1 1 30 30 ARG H H 30 7.460 7.460 8.133 -0.673 18016
2458 1 5 . 1 1 31 31 VAL N N 31 117.600 117.600 119.755 -2.155 18016
2459 1 5 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.884 -0.064 18016
2460 1 5 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.222 0.478 18016
2461 1 5 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.215 -0.415 18016
2462 1 5 . 1 1 31 31 VAL H H 31 9.080 9.080 8.226 0.854 18016
2463 1 5 . 1 1 32 32 PRO C C 32 177.000 177.000 178.590 -1.590 18016
2464 1 5 . 1 1 32 32 PRO CA C 32 65.200 65.200 66.013 -0.813 18016
2465 1 5 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.346 -0.546 18016
2466 1 5 . 1 1 33 33 LEU N N 33 115.200 115.200 120.855 -5.655 18016
2467 1 5 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.126 -0.006 18016
2468 1 5 . 1 1 33 33 LEU C C 33 178.600 178.600 178.583 0.017 18016
2469 1 5 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.063 0.337 18016
2470 1 5 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.368 0.132 18016
2471 1 5 . 1 1 33 33 LEU H H 33 8.010 8.010 8.178 -0.168 18016
2472 1 5 . 1 1 34 34 LEU N N 34 120.400 120.400 118.877 1.523 18016
2473 1 5 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.112 -0.182 18016
2474 1 5 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.383 0.717 18016
2475 1 5 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.324 0.576 18016
2476 1 5 . 1 1 34 34 LEU H H 34 8.220 8.220 8.406 -0.186 18016
2477 1 5 . 1 1 35 35 ALA N N 35 123.100 123.100 123.872 -0.772 18016
2478 1 5 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.040 0.000 18016
2479 1 5 . 1 1 35 35 ALA C C 35 179.500 179.500 179.656 -0.156 18016
2480 1 5 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.255 0.245 18016
2481 1 5 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.435 -0.535 18016
2482 1 5 . 1 1 35 35 ALA H H 35 8.560 8.560 8.217 0.343 18016
2483 1 5 . 1 1 36 36 LEU N N 36 117.600 117.600 119.825 -2.225 18016
2484 1 5 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.285 -0.165 18016
2485 1 5 . 1 1 36 36 LEU C C 36 180.100 180.100 179.308 0.792 18016
2486 1 5 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.980 0.220 18016
2487 1 5 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.495 1.305 18016
2488 1 5 . 1 1 36 36 LEU H H 36 7.850 7.850 8.149 -0.299 18016
2489 1 5 . 1 1 37 37 LEU N N 37 116.700 116.700 120.074 -3.374 18016
2490 1 5 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.126 -0.026 18016
2491 1 5 . 1 1 37 37 LEU C C 37 180.100 180.100 178.828 1.272 18016
2492 1 5 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.045 0.255 18016
2493 1 5 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.484 0.716 18016
2494 1 5 . 1 1 37 37 LEU H H 37 8.730 8.730 8.391 0.339 18016
2495 1 5 . 1 1 38 38 THR N N 38 110.600 110.600 108.912 1.688 18016
2496 1 5 . 1 1 38 38 THR HA H 38 4.440 4.440 4.125 0.315 18016
2497 1 5 . 1 1 38 38 THR C C 38 175.100 175.100 176.684 -1.584 18016
2498 1 5 . 1 1 38 38 THR CA C 38 64.200 64.200 64.259 -0.059 18016
2499 1 5 . 1 1 38 38 THR CB C 38 70.000 70.000 68.815 1.185 18016
2500 1 5 . 1 1 38 38 THR H H 38 8.660 8.660 8.430 0.230 18016
2501 1 5 . 1 1 39 39 ARG N N 39 118.000 118.000 121.829 -3.829 18016
2502 1 5 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.127 0.153 18016
2503 1 5 . 1 1 39 39 ARG C C 39 177.300 177.300 177.460 -0.160 18016
2504 1 5 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.322 -0.022 18016
2505 1 5 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.084 0.116 18016
2506 1 5 . 1 1 39 39 ARG H H 39 7.180 7.180 7.733 -0.553 18016
2507 1 5 . 1 1 40 40 ARG N N 40 114.400 114.400 119.607 -5.207 18016
2508 1 5 . 1 1 40 40 ARG C C 40 174.800 174.800 174.369 0.431 18016
2509 1 5 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.350 -0.050 18016
2510 1 5 . 1 1 40 40 ARG CB C 40 34.600 34.600 30.483 4.117 18016
2511 1 5 . 1 1 40 40 ARG H H 40 7.520 7.520 7.837 -0.317 18016
2512 1 5 . 1 1 41 41 LEU N N 41 119.400 119.400 121.597 -2.197 18016
2513 1 5 . 1 1 41 41 LEU C C 41 177.100 177.100 175.876 1.224 18016
2514 1 5 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.469 -0.769 18016
2515 1 5 . 1 1 41 41 LEU CB C 41 44.400 44.400 46.297 -1.897 18016
2516 1 5 . 1 1 41 41 LEU H H 41 8.380 8.380 7.981 0.399 18016
2517 1 5 . 1 1 42 42 THR N N 42 112.000 112.000 114.947 -2.947 18016
2518 1 5 . 1 1 42 42 THR HA H 42 4.440 4.440 4.557 -0.117 18016
2519 1 5 . 1 1 42 42 THR C C 42 175.800 175.800 175.347 0.453 18016
2520 1 5 . 1 1 42 42 THR CA C 42 60.500 60.500 60.471 0.028 18016
2521 1 5 . 1 1 42 42 THR CB C 42 70.800 70.800 70.479 0.321 18016
2522 1 5 . 1 1 42 42 THR H H 42 9.330 9.330 8.925 0.405 18016
2523 1 5 . 1 1 43 43 ASN N N 43 119.900 119.900 119.715 0.185 18016
2524 1 5 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.353 -0.103 18016
2525 1 5 . 1 1 43 43 ASN C C 43 177.900 177.900 177.284 0.616 18016
2526 1 5 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.072 -0.372 18016
2527 1 5 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.204 -1.004 18016
2528 1 5 . 1 1 43 43 ASN H H 43 9.140 9.140 8.713 0.427 18016
2529 1 5 . 1 1 44 44 ASP N N 44 118.000 118.000 119.843 -1.843 18016
2530 1 5 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.360 0.040 18016
2531 1 5 . 1 1 44 44 ASP C C 44 179.600 179.600 178.139 1.461 18016
2532 1 5 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.692 -0.392 18016
2533 1 5 . 1 1 44 44 ASP H H 44 8.360 8.360 8.648 -0.288 18016
2534 1 5 . 1 1 45 45 GLU N N 45 122.600 122.600 120.065 2.535 18016
2535 1 5 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.049 -0.079 18016
2536 1 5 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.055 0.345 18016
2537 1 5 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.760 0.540 18016
2538 1 5 . 1 1 45 45 GLU H H 45 7.850 7.850 7.725 0.125 18016
2539 1 5 . 1 1 46 46 ILE N N 46 118.900 118.900 120.681 -1.781 18016
2540 1 5 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.758 -0.328 18016
2541 1 5 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.247 1.753 18016
2542 1 5 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.754 -0.054 18016
2543 1 5 . 1 1 46 46 ILE H H 46 8.290 8.290 8.217 0.073 18016
2544 1 5 . 1 1 47 47 LYS N N 47 118.900 118.900 119.459 -0.559 18016
2545 1 5 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.959 -0.089 18016
2546 1 5 . 1 1 47 47 LYS C C 47 178.400 178.400 178.905 -0.505 18016
2547 1 5 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.761 0.539 18016
2548 1 5 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.245 0.354 18016
2549 1 5 . 1 1 47 47 LYS H H 47 8.290 8.290 8.176 0.114 18016
2550 1 5 . 1 1 48 48 ALA N N 48 121.100 121.100 122.948 -1.848 18016
2551 1 5 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.009 0.161 18016
2552 1 5 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.187 -0.087 18016
2553 1 5 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.116 -0.117 18016
2554 1 5 . 1 1 48 48 ALA H H 48 7.710 7.710 8.201 -0.491 18016
2555 1 5 . 1 1 49 49 ILE N N 49 119.900 119.900 118.070 1.830 18016
2556 1 5 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.739 -0.089 18016
2557 1 5 . 1 1 49 49 ILE C C 49 177.300 177.300 178.009 -0.709 18016
2558 1 5 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.496 1.504 18016
2559 1 5 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.422 1.678 18016
2560 1 5 . 1 1 49 49 ILE H H 49 8.130 8.130 8.317 -0.187 18016
2561 1 5 . 1 1 50 50 ALA N N 50 122.000 122.000 123.285 -1.285 18016
2562 1 5 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.900 -0.040 18016
2563 1 5 . 1 1 50 50 ALA C C 50 179.800 179.800 179.595 0.205 18016
2564 1 5 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.343 0.358 18016
2565 1 5 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.212 -0.312 18016
2566 1 5 . 1 1 50 50 ALA H H 50 8.730 8.730 7.820 0.910 18016
2567 1 5 . 1 1 51 51 GLU N N 51 116.900 116.900 118.395 -1.495 18016
2568 1 5 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.985 0.035 18016
2569 1 5 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.499 -0.099 18016
2570 1 5 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.171 0.329 18016
2571 1 5 . 1 1 51 51 GLU H H 51 8.220 8.220 8.269 -0.049 18016
2572 1 5 . 1 1 52 52 ASP N N 52 120.300 120.300 119.240 1.060 18016
2573 1 5 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.487 -0.097 18016
2574 1 5 . 1 1 52 52 ASP C C 52 178.900 178.900 179.026 -0.126 18016
2575 1 5 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.717 0.783 18016
2576 1 5 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.048 1.452 18016
2577 1 5 . 1 1 52 52 ASP H H 52 7.700 7.700 7.931 -0.231 18016
2578 1 5 . 1 1 53 53 LEU N N 53 118.300 118.300 121.078 -2.778 18016
2579 1 5 . 1 1 53 53 LEU HA H 53 3.730 3.730 4.007 -0.277 18016
2580 1 5 . 1 1 53 53 LEU C C 53 179.000 179.000 178.666 0.334 18016
2581 1 5 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.417 0.083 18016
2582 1 5 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.880 -0.780 18016
2583 1 5 . 1 1 53 53 LEU H H 53 8.290 8.290 7.891 0.399 18016
2584 1 5 . 1 1 54 54 GLU N N 54 118.700 118.700 118.104 0.596 18016
2585 1 5 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.869 0.351 18016
2586 1 5 . 1 1 54 54 GLU C C 54 178.200 178.200 177.113 1.087 18016
2587 1 5 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.183 0.517 18016
2588 1 5 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.009 0.891 18016
2589 1 5 . 1 1 54 54 GLU H H 54 8.070 8.070 8.321 -0.251 18016
2590 1 5 . 1 1 55 55 LYS N N 55 117.700 117.700 115.807 1.893 18016
2591 1 5 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.024 0.126 18016
2592 1 5 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.313 -0.013 18016
2593 1 5 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.467 0.233 18016
2594 1 5 . 1 1 55 55 LYS H H 55 7.750 7.750 7.343 0.407 18016
2595 1 5 . 1 1 56 56 ARG N N 56 117.100 117.100 116.606 0.494 18016
2596 1 5 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.308 -0.038 18016
2597 1 5 . 1 1 56 56 ARG CA C 56 56.800 56.800 56.983 -0.183 18016
2598 1 5 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.765 -0.765 18016
2599 1 5 . 1 1 56 56 ARG H H 56 8.270 8.270 7.602 0.668 18016
2600 1 5 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.527 -0.167 18016
2601 1 5 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.125 -0.025 18016
2602 1 5 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.525 -1.325 18016
2603 1 5 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.621 -0.111 18016
2604 1 5 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.382 0.818 18016
2605 1 5 . 1 1 58 58 HIS CB C 58 27.300 27.300 28.433 -1.133 18016
2606 1 5 . 1 1 59 59 PHE N N 59 120.400 120.400 124.151 -3.751 18016
2607 1 5 . 1 1 59 59 PHE C C 59 175.500 175.500 175.790 -0.290 18016
2608 1 5 . 1 1 59 59 PHE CA C 59 57.200 57.200 56.388 0.812 18016
2609 1 5 . 1 1 59 59 PHE CB C 59 39.300 39.300 38.255 1.045 18016
2610 1 5 . 1 1 59 59 PHE H H 59 7.710 7.710 8.229 -0.519 18016
2611 1 5 . 1 1 60 60 ASP N N 60 120.800 120.800 124.622 -3.822 18016
2612 1 5 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.440 0.050 18016
2613 1 5 . 1 1 60 60 ASP CA C 60 54.300 54.300 56.344 -2.044 18016
2614 1 5 . 1 1 60 60 ASP CB C 60 41.100 41.100 40.297 0.803 18016
2615 1 5 . 1 1 60 60 ASP H H 60 8.180 8.180 8.158 0.022 18016
2616 1 5 . 1 1 61 61 HIS N N 61 118.300 118.300 118.432 -0.132 18016
2617 1 5 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.448 -0.058 18016
2618 1 5 . 1 1 61 61 HIS CA C 61 56.700 56.700 57.412 -0.712 18016
2619 1 5 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.817 -1.017 18016
2620 1 5 . 1 1 61 61 HIS H H 61 8.550 8.550 7.877 0.673 18016
2621 1 5 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.472 -0.462 18016
2622 1 5 . 1 1 62 62 ILE C C 62 173.800 173.800 174.337 -0.537 18016
2623 1 5 . 1 1 62 62 ILE CA C 62 66.500 66.500 59.625 6.875 18016
2624 1 5 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.065 2.035 18016
2625 1 5 . 1 1 63 63 ASP N N 63 125.100 125.100 122.090 3.010 18016
2626 1 5 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.377 0.223 18016
2627 1 5 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.377 -2.577 18016
2628 1 5 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.987 -1.488 18016
2629 1 5 . 1 1 63 63 ASP H H 63 8.360 8.360 7.649 0.711 18016
2630 1 5 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.881 -0.211 18016
2631 1 5 . 1 1 64 64 ILE C C 64 177.000 177.000 176.796 0.204 18016
2632 1 5 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.215 -1.115 18016
2633 1 5 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.223 -1.623 18016
2634 1 5 . 1 1 65 65 GLY N N 65 107.600 107.600 107.215 0.385 18016
2635 1 5 . 1 1 65 65 GLY C C 65 177.000 177.000 175.750 1.250 18016
2636 1 5 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.801 0.499 18016
2637 1 5 . 1 1 65 65 GLY H H 65 8.440 8.440 7.753 0.687 18016
2638 1 5 . 1 1 66 66 VAL N N 66 121.800 121.800 123.025 -1.225 18016
2639 1 5 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.771 -0.011 18016
2640 1 5 . 1 1 66 66 VAL C C 66 178.500 178.500 177.493 1.007 18016
2641 1 5 . 1 1 66 66 VAL CA C 66 65.600 65.600 64.611 0.989 18016
2642 1 5 . 1 1 66 66 VAL CB C 66 32.000 32.000 32.112 -0.112 18016
2643 1 5 . 1 1 66 66 VAL H H 66 7.550 7.550 8.140 -0.590 18016
2644 1 5 . 1 1 67 67 LEU N N 67 120.900 120.900 119.439 1.461 18016
2645 1 5 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.009 0.061 18016
2646 1 5 . 1 1 67 67 LEU C C 67 179.000 179.000 179.114 -0.114 18016
2647 1 5 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.725 -0.125 18016
2648 1 5 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.376 1.924 18016
2649 1 5 . 1 1 67 67 LEU H H 67 7.650 7.650 7.452 0.198 18016
2650 1 5 . 1 1 68 68 ILE N N 68 118.900 118.900 117.663 1.237 18016
2651 1 5 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.771 -0.061 18016
2652 1 5 . 1 1 68 68 ILE C C 68 179.500 179.500 178.537 0.963 18016
2653 1 5 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.922 0.278 18016
2654 1 5 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.526 -0.026 18016
2655 1 5 . 1 1 68 68 ILE H H 68 8.580 8.580 7.569 1.011 18016
2656 1 5 . 1 1 69 69 THR N N 69 118.100 118.100 114.309 3.791 18016
2657 1 5 . 1 1 69 69 THR HA H 69 3.940 3.940 4.041 -0.101 18016
2658 1 5 . 1 1 69 69 THR C C 69 176.200 176.200 175.944 0.256 18016
2659 1 5 . 1 1 69 69 THR CA C 69 66.600 66.600 65.485 1.115 18016
2660 1 5 . 1 1 69 69 THR CB C 69 68.500 68.500 68.518 -0.018 18016
2661 1 5 . 1 1 69 69 THR H H 69 7.840 7.840 7.702 0.138 18016
2662 1 5 . 1 1 70 70 GLN N N 70 121.600 121.600 120.140 1.460 18016
2663 1 5 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.153 -0.043 18016
2664 1 5 . 1 1 70 70 GLN C C 70 178.100 178.100 178.082 0.018 18016
2665 1 5 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.472 0.628 18016
2666 1 5 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.912 -0.612 18016
2667 1 5 . 1 1 70 70 GLN H H 70 8.100 8.100 7.565 0.535 18016
2668 1 5 . 1 1 71 71 MET N N 71 118.700 118.700 117.528 1.172 18016
2669 1 5 . 1 1 71 71 MET HA H 71 4.010 4.010 4.354 -0.344 18016
2670 1 5 . 1 1 71 71 MET C C 71 176.300 176.300 178.126 -1.826 18016
2671 1 5 . 1 1 71 71 MET CA C 71 58.100 58.100 58.935 -0.835 18016
2672 1 5 . 1 1 71 71 MET CB C 71 33.600 33.600 32.681 0.919 18016
2673 1 5 . 1 1 71 71 MET H H 71 8.350 8.350 8.451 -0.101 18016
2674 1 5 . 1 1 72 72 THR N N 72 111.600 111.600 111.132 0.468 18016
2675 1 5 . 1 1 72 72 THR HA H 72 3.940 3.940 4.174 -0.234 18016
2676 1 5 . 1 1 72 72 THR C C 72 175.800 175.800 175.362 0.438 18016
2677 1 5 . 1 1 72 72 THR CA C 72 65.300 65.300 64.557 0.743 18016
2678 1 5 . 1 1 72 72 THR CB C 72 69.100 69.100 69.440 -0.340 18016
2679 1 5 . 1 1 72 72 THR H H 72 7.840 7.840 7.581 0.259 18016
2680 1 5 . 1 1 73 73 ASP N N 73 121.100 121.100 120.210 0.890 18016
2681 1 5 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.704 -0.174 18016
2682 1 5 . 1 1 73 73 ASP C C 73 176.600 176.600 175.674 0.926 18016
2683 1 5 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.101 1.099 18016
2684 1 5 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.831 -1.431 18016
2685 1 5 . 1 1 73 73 ASP H H 73 7.840 7.840 7.781 0.059 18016
2686 1 5 . 1 1 74 74 GLU N N 74 121.100 121.100 119.539 1.561 18016
2687 1 5 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.607 -0.267 18016
2688 1 5 . 1 1 74 74 GLU C C 74 173.800 173.800 175.157 -1.357 18016
2689 1 5 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.598 -0.098 18016
2690 1 5 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.287 -0.687 18016
2691 1 5 . 1 1 74 74 GLU H H 74 7.980 7.980 8.427 -0.447 18016
2692 1 5 . 1 1 75 75 MET N N 75 125.800 125.800 125.945 -0.145 18016
2693 1 5 . 1 1 75 75 MET HA H 75 4.710 4.710 4.859 -0.149 18016
2694 1 5 . 1 1 75 75 MET CA C 75 53.800 53.800 54.388 -0.588 18016
2695 1 5 . 1 1 75 75 MET CB C 75 31.700 31.700 31.778 -0.078 18016
2696 1 5 . 1 1 75 75 MET H H 75 8.380 8.380 8.555 -0.175 18016
2697 1 5 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.452 0.058 18016
2698 1 5 . 1 1 76 76 PRO C C 76 175.700 175.700 176.507 -0.807 18016
2699 1 5 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.389 -1.389 18016
2700 1 5 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.311 -0.511 18016
2701 1 5 . 1 1 77 77 ARG N N 77 119.700 119.700 117.467 2.233 18016
2702 1 5 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.669 -0.399 18016
2703 1 5 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.975 0.825 18016
2704 1 5 . 1 1 77 77 ARG CB C 77 30.700 30.700 33.348 -2.648 18016
2705 1 5 . 1 1 77 77 ARG H H 77 8.940 8.940 7.729 1.211 18016
2706 1 5 . 1 1 78 78 GLU N N 78 124.700 124.700 123.645 1.055 18016
2707 1 5 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.940 0.020 18016
2708 1 5 . 1 1 78 78 GLU C C 78 179.000 179.000 178.326 0.674 18016
2709 1 5 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.473 0.327 18016
2710 1 5 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.790 -0.790 18016
2711 1 5 . 1 1 78 78 GLU H H 78 9.170 9.170 8.802 0.368 18016
2712 1 5 . 1 1 79 79 GLU N N 79 116.800 116.800 120.492 -3.692 18016
2713 1 5 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.108 0.012 18016
2714 1 5 . 1 1 79 79 GLU C C 79 179.100 179.100 178.453 0.647 18016
2715 1 5 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.572 0.129 18016
2716 1 5 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.073 -0.073 18016
2717 1 5 . 1 1 79 79 GLU H H 79 9.660 9.660 8.615 1.045 18016
2718 1 5 . 1 1 80 80 ASP N N 80 120.000 120.000 117.653 2.347 18016
2719 1 5 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.446 0.244 18016
2720 1 5 . 1 1 80 80 ASP C C 80 177.300 177.300 178.622 -1.322 18016
2721 1 5 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.861 -0.461 18016
2722 1 5 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.430 1.170 18016
2723 1 5 . 1 1 80 80 ASP H H 80 7.310 7.310 8.336 -1.026 18016
2724 1 5 . 1 1 81 81 ILE N N 81 120.100 120.100 120.379 -0.279 18016
2725 1 5 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.729 -0.239 18016
2726 1 5 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.594 0.706 18016
2727 1 5 . 1 1 81 81 ILE CB C 81 38.300 38.300 38.090 0.210 18016
2728 1 5 . 1 1 81 81 ILE H H 81 7.610 7.610 8.080 -0.470 18016
2729 1 5 . 1 1 82 82 GLU N N 82 118.100 118.100 120.054 -1.954 18016
2730 1 5 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.076 0.204 18016
2731 1 5 . 1 1 82 82 GLU C C 82 177.800 177.800 178.635 -0.835 18016
2732 1 5 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.416 -1.416 18016
2733 1 5 . 1 1 82 82 GLU CB C 82 28.800 28.800 28.925 -0.125 18016
2734 1 5 . 1 1 82 82 GLU H H 82 8.550 8.550 8.434 0.116 18016
2735 1 5 . 1 1 83 83 ARG N N 83 119.900 119.900 120.540 -0.640 18016
2736 1 5 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.086 -0.056 18016
2737 1 5 . 1 1 83 83 ARG C C 83 179.400 179.400 178.300 1.100 18016
2738 1 5 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.149 0.751 18016
2739 1 5 . 1 1 83 83 ARG CB C 83 29.600 29.600 29.906 -0.306 18016
2740 1 5 . 1 1 83 83 ARG H H 83 7.590 7.590 8.239 -0.649 18016
2741 1 5 . 1 1 84 84 VAL N N 84 120.400 120.400 119.915 0.485 18016
2742 1 5 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.898 -0.148 18016
2743 1 5 . 1 1 84 84 VAL C C 84 177.400 177.400 177.392 0.008 18016
2744 1 5 . 1 1 84 84 VAL CA C 84 66.900 66.900 66.040 0.861 18016
2745 1 5 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.062 -0.162 18016
2746 1 5 . 1 1 84 84 VAL H H 84 7.550 7.550 8.477 -0.927 18016
2747 1 5 . 1 1 85 85 ARG N N 85 121.600 121.600 119.881 1.719 18016
2748 1 5 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.274 -0.264 18016
2749 1 5 . 1 1 85 85 ARG C C 85 178.100 178.100 178.912 -0.812 18016
2750 1 5 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.925 0.976 18016
2751 1 5 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.879 0.321 18016
2752 1 5 . 1 1 85 85 ARG H H 85 9.090 9.090 8.429 0.661 18016
2753 1 5 . 1 1 86 86 ARG N N 86 115.600 115.600 118.463 -2.863 18016
2754 1 5 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.086 -0.206 18016
2755 1 5 . 1 1 86 86 ARG C C 86 179.000 179.000 178.685 0.315 18016
2756 1 5 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.989 0.411 18016
2757 1 5 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.621 0.779 18016
2758 1 5 . 1 1 86 86 ARG H H 86 8.660 8.660 8.452 0.208 18016
2759 1 5 . 1 1 87 87 HIS N N 87 118.000 118.000 120.530 -2.530 18016
2760 1 5 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.407 -0.047 18016
2761 1 5 . 1 1 87 87 HIS C C 87 178.400 178.400 177.769 0.631 18016
2762 1 5 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.477 0.123 18016
2763 1 5 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.092 0.608 18016
2764 1 5 . 1 1 87 87 HIS H H 87 7.640 7.640 7.801 -0.161 18016
2765 1 5 . 1 1 88 88 LEU N N 88 119.600 119.600 119.271 0.329 18016
2766 1 5 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.151 -0.571 18016
2767 1 5 . 1 1 88 88 LEU C C 88 180.000 180.000 178.921 1.079 18016
2768 1 5 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.115 0.085 18016
2769 1 5 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.165 1.435 18016
2770 1 5 . 1 1 88 88 LEU H H 88 8.650 8.650 8.777 -0.127 18016
2771 1 5 . 1 1 89 89 ALA N N 89 118.500 118.500 122.650 -4.150 18016
2772 1 5 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.628 0.732 18016
2773 1 5 . 1 1 89 89 ALA C C 89 180.400 180.400 179.917 0.483 18016
2774 1 5 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.736 -1.136 18016
2775 1 5 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.358 -0.258 18016
2776 1 5 . 1 1 89 89 ALA H H 89 8.870 8.870 8.230 0.640 18016
2777 1 5 . 1 1 90 90 LEU N N 90 119.400 119.400 117.547 1.853 18016
2778 1 5 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.941 0.269 18016
2779 1 5 . 1 1 90 90 LEU C C 90 179.100 179.100 179.197 -0.097 18016
2780 1 5 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.097 0.403 18016
2781 1 5 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.621 0.079 18016
2782 1 5 . 1 1 90 90 LEU H H 90 7.390 7.390 7.513 -0.123 18016
2783 1 5 . 1 1 91 91 GLN N N 91 114.500 114.500 116.357 -1.857 18016
2784 1 5 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.231 0.469 18016
2785 1 5 . 1 1 91 91 GLN C C 91 175.800 175.800 177.186 -1.386 18016
2786 1 5 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.961 -2.461 18016
2787 1 5 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.992 -1.892 18016
2788 1 5 . 1 1 91 91 GLN H H 91 7.810 7.810 7.750 0.060 18016
2789 1 5 . 1 1 92 92 GLY N N 92 107.900 107.900 104.631 3.269 18016
2790 1 5 . 1 1 92 92 GLY C C 92 172.100 172.100 171.765 0.335 18016
2791 1 5 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.041 -1.040 18016
2792 1 5 . 1 1 92 92 GLY H H 92 7.710 7.710 8.152 -0.442 18016
2793 1 5 . 1 1 93 93 TRP N N 93 114.200 114.200 122.906 -8.706 18016
2794 1 5 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.730 1.270 18016
2795 1 5 . 1 1 93 93 TRP CB C 93 29.200 29.200 31.262 -2.062 18016
2796 1 5 . 1 1 93 93 TRP H H 93 8.450 8.450 8.389 0.061 18016
2797 1 5 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.084 0.376 18016
2798 1 5 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.859 -1.059 18016
2799 1 5 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.141 0.459 18016
2800 1 5 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.233 -0.733 18016
2801 1 5 . 1 1 95 95 LEU C C 95 175.000 175.000 177.714 -2.714 18016
2802 1 5 . 1 1 95 95 LEU CA C 95 56.100 56.100 55.316 0.784 18016
2803 1 5 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.618 1.482 18016
2804 1 5 . 1 1 96 96 ASP N N 96 114.000 114.000 120.055 -6.055 18016
2805 1 5 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.629 0.321 18016
2806 1 5 . 1 1 96 96 ASP C C 96 175.800 175.800 176.271 -0.471 18016
2807 1 5 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.594 -2.594 18016
2808 1 5 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.816 0.084 18016
2809 1 5 . 1 1 96 96 ASP H H 96 7.230 7.230 7.522 -0.292 18016
2810 1 5 . 1 1 97 97 ASP N N 97 123.200 123.200 117.295 5.905 18016
2811 1 5 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.990 -0.380 18016
2812 1 5 . 1 1 97 97 ASP CA C 97 53.500 53.500 52.072 1.428 18016
2813 1 5 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.308 -4.608 18016
2814 1 5 . 1 1 97 97 ASP H H 97 7.420 7.420 7.704 -0.284 18016
2815 1 5 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.988 -0.698 18016
2816 1 5 . 1 1 98 98 PRO C C 98 177.500 177.500 176.788 0.712 18016
2817 1 5 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.313 0.387 18016
2818 1 5 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.875 -1.975 18016
2819 1 5 . 1 1 99 99 ARG N N 99 121.300 121.300 119.366 1.934 18016
2820 1 5 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.126 -0.416 18016
2821 1 5 . 1 1 99 99 ARG C C 99 176.500 176.500 176.210 0.290 18016
2822 1 5 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.678 -1.579 18016
2823 1 5 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.166 0.334 18016
2824 1 5 . 1 1 99 99 ARG H H 99 8.390 8.390 8.062 0.328 18016
2825 1 5 . 1 1 100 100 ASP N N 100 119.600 119.600 116.948 2.652 18016
2826 1 5 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.646 -0.146 18016
2827 1 5 . 1 1 100 100 ASP C C 100 177.000 177.000 175.692 1.308 18016
2828 1 5 . 1 1 100 100 ASP CA C 100 54.700 54.700 52.877 1.823 18016
2829 1 5 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.921 -2.021 18016
2830 1 5 . 1 1 100 100 ASP H H 100 8.260 8.260 7.674 0.586 18016
2831 1 5 . 1 1 101 101 GLY N N 101 109.300 109.300 109.520 -0.220 18016
2832 1 5 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.880 0.520 18016
2833 1 5 . 1 1 101 101 GLY H H 101 8.450 8.450 8.238 0.212 18016
2834 1 5 . 1 1 102 102 GLU N N 102 119.800 119.800 121.958 -2.158 18016
2835 1 5 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.132 0.178 18016
2836 1 5 . 1 1 102 102 GLU CA C 102 56.000 56.000 57.591 -1.591 18016
2837 1 5 . 1 1 102 102 GLU CB C 102 30.500 30.500 29.988 0.512 18016
2838 1 5 . 1 1 102 102 GLU H H 102 8.140 8.140 8.020 0.120 18016
2839 1 5 . 1 1 103 103 GLU N N 103 123.000 123.000 125.275 -2.275 18016
2840 1 5 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.527 0.033 18016
2841 1 5 . 1 1 103 103 GLU CA C 103 54.300 54.300 53.480 0.820 18016
2842 1 5 . 1 1 103 103 GLU CB C 103 29.600 29.600 31.646 -2.046 18016
2843 1 5 . 1 1 103 103 GLU H H 103 8.580 8.580 8.213 0.367 18016
2844 1 5 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.548 -0.068 18016
2845 1 5 . 1 1 104 104 PRO C C 104 176.800 176.800 175.753 1.047 18016
2846 1 5 . 1 1 104 104 PRO CA C 104 63.400 63.400 62.953 0.447 18016
2847 1 5 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.133 -0.033 18016
2848 1 5 . 1 1 105 105 ASP N N 105 120.400 120.400 121.447 -1.047 18016
2849 1 5 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.619 -0.039 18016
2850 1 5 . 1 1 105 105 ASP C C 105 177.100 177.100 177.027 0.073 18016
2851 1 5 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.805 -0.505 18016
2852 1 5 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.110 0.290 18016
2853 1 5 . 1 1 105 105 ASP H H 105 8.500 8.500 8.440 0.060 18016
2854 1 5 . 1 1 106 106 GLY N N 106 109.300 109.300 110.740 -1.440 18016
2855 1 5 . 1 1 106 106 GLY C C 106 174.600 174.600 174.293 0.307 18016
2856 1 5 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.138 0.262 18016
2857 1 5 . 1 1 106 106 GLY H H 106 8.360 8.360 8.729 -0.369 18016
2858 1 5 . 1 1 107 107 GLU N N 107 120.400 120.400 122.177 -1.777 18016
2859 1 5 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.302 0.038 18016
2860 1 5 . 1 1 107 107 GLU C C 107 177.100 177.100 176.016 1.084 18016
2861 1 5 . 1 1 107 107 GLU CA C 107 56.500 56.500 54.840 1.660 18016
2862 1 5 . 1 1 107 107 GLU CB C 107 30.200 30.200 29.273 0.927 18016
2863 1 5 . 1 1 107 107 GLU H H 107 8.410 8.410 8.011 0.399 18016
2864 1 5 . 1 1 108 108 SER N N 108 116.600 116.600 114.916 1.684 18016
2865 1 5 . 1 1 108 108 SER HA H 108 4.450 4.450 4.467 -0.017 18016
2866 1 5 . 1 1 108 108 SER C C 108 175.300 175.300 175.526 -0.226 18016
2867 1 5 . 1 1 108 108 SER CA C 108 58.700 58.700 57.829 0.871 18016
2868 1 5 . 1 1 108 108 SER CB C 108 63.800 63.800 62.671 1.129 18016
2869 1 5 . 1 1 108 108 SER H H 108 8.460 8.460 7.780 0.680 18016
2870 1 5 . 1 1 109 109 GLY N N 109 110.800 110.800 112.377 -1.577 18016
2871 1 5 . 1 1 109 109 GLY C C 109 174.500 174.500 174.122 0.378 18016
2872 1 5 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.484 0.816 18016
2873 1 5 . 1 1 109 109 GLY H H 109 8.500 8.500 8.142 0.358 18016
2874 1 5 . 1 1 110 110 GLY N N 110 108.800 108.800 108.636 0.164 18016
2875 1 5 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.068 -0.668 18016
2876 1 5 . 1 1 110 110 GLY H H 110 8.140 8.140 8.151 -0.011 18016
2877 1 5 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.542 0.068 18016
2878 1 5 . 1 1 111 111 PRO C C 111 176.000 176.000 176.625 -0.625 18016
2879 1 5 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.559 0.041 18016
2880 1 5 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.210 2.390 18016
2881 1 6 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.345 0.085 18016
2882 1 6 . 1 1 2 2 PRO C C 2 177.600 177.600 175.935 1.665 18016
2883 1 6 . 1 1 2 2 PRO CA C 2 63.300 63.300 63.433 -0.133 18016
2884 1 6 . 1 1 2 2 PRO CB C 2 32.300 32.300 30.103 2.197 18016
2885 1 6 . 1 1 3 3 GLY N N 3 110.000 110.000 111.726 -1.726 18016
2886 1 6 . 1 1 3 3 GLY C C 3 174.200 174.200 173.816 0.384 18016
2887 1 6 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.859 -0.459 18016
2888 1 6 . 1 1 3 3 GLY H H 3 8.700 8.700 8.410 0.290 18016
2889 1 6 . 1 1 4 4 SER N N 4 115.400 115.400 119.537 -4.137 18016
2890 1 6 . 1 1 4 4 SER HA H 4 4.440 4.440 4.743 -0.303 18016
2891 1 6 . 1 1 4 4 SER C C 4 174.800 174.800 175.141 -0.341 18016
2892 1 6 . 1 1 4 4 SER CA C 4 58.400 58.400 58.856 -0.456 18016
2893 1 6 . 1 1 4 4 SER CB C 4 63.800 63.800 61.894 1.906 18016
2894 1 6 . 1 1 4 4 SER H H 4 8.210 8.210 7.876 0.334 18016
2895 1 6 . 1 1 5 5 MET N N 5 122.200 122.200 121.373 0.827 18016
2896 1 6 . 1 1 5 5 MET HA H 5 4.510 4.510 4.705 -0.195 18016
2897 1 6 . 1 1 5 5 MET CA C 5 55.600 55.600 56.213 -0.613 18016
2898 1 6 . 1 1 5 5 MET CB C 5 32.900 32.900 33.875 -0.975 18016
2899 1 6 . 1 1 5 5 MET H H 5 8.570 8.570 8.662 -0.092 18016
2900 1 6 . 1 1 6 6 VAL N N 6 120.000 120.000 119.058 0.942 18016
2901 1 6 . 1 1 6 6 VAL HA H 6 4.050 4.050 3.975 0.075 18016
2902 1 6 . 1 1 6 6 VAL C C 6 175.700 175.700 175.701 -0.001 18016
2903 1 6 . 1 1 6 6 VAL CA C 6 62.700 62.700 62.259 0.441 18016
2904 1 6 . 1 1 6 6 VAL CB C 6 32.500 32.500 31.589 0.911 18016
2905 1 6 . 1 1 6 6 VAL H H 6 8.150 8.150 7.870 0.280 18016
2906 1 6 . 1 1 7 7 ASN N N 7 122.000 122.000 117.463 4.537 18016
2907 1 6 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.531 0.129 18016
2908 1 6 . 1 1 7 7 ASN C C 7 175.200 175.200 176.858 -1.658 18016
2909 1 6 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.757 -0.556 18016
2910 1 6 . 1 1 7 7 ASN CB C 7 38.900 38.900 38.942 -0.042 18016
2911 1 6 . 1 1 7 7 ASN H H 7 8.010 8.010 8.217 -0.207 18016
2912 1 6 . 1 1 8 8 ALA N N 8 126.500 126.500 126.152 0.348 18016
2913 1 6 . 1 1 8 8 ALA C C 8 180.200 180.200 179.398 0.802 18016
2914 1 6 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.820 -0.320 18016
2915 1 6 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.868 -0.468 18016
2916 1 6 . 1 1 8 8 ALA H H 8 9.020 9.020 8.871 0.149 18016
2917 1 6 . 1 1 9 9 PHE N N 9 121.300 121.300 118.945 2.355 18016
2918 1 6 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.104 0.186 18016
2919 1 6 . 1 1 9 9 PHE C C 9 177.200 177.200 176.920 0.280 18016
2920 1 6 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.430 -0.130 18016
2921 1 6 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.646 0.554 18016
2922 1 6 . 1 1 9 9 PHE H H 9 8.570 8.570 8.348 0.222 18016
2923 1 6 . 1 1 10 10 LEU N N 10 117.200 117.200 119.157 -1.957 18016
2924 1 6 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.877 -0.177 18016
2925 1 6 . 1 1 10 10 LEU C C 10 179.700 179.700 179.343 0.357 18016
2926 1 6 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.621 -0.021 18016
2927 1 6 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.422 0.278 18016
2928 1 6 . 1 1 10 10 LEU H H 10 8.150 8.150 7.944 0.206 18016
2929 1 6 . 1 1 11 11 ALA N N 11 121.500 121.500 122.099 -0.599 18016
2930 1 6 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.938 0.082 18016
2931 1 6 . 1 1 11 11 ALA C C 11 180.900 180.900 179.526 1.374 18016
2932 1 6 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.449 -0.449 18016
2933 1 6 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.088 -0.088 18016
2934 1 6 . 1 1 11 11 ALA H H 11 8.460 8.460 8.842 -0.382 18016
2935 1 6 . 1 1 12 12 LYS N N 12 120.700 120.700 119.590 1.110 18016
2936 1 6 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.051 -0.001 18016
2937 1 6 . 1 1 12 12 LYS C C 12 179.700 179.700 178.850 0.850 18016
2938 1 6 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.164 0.035 18016
2939 1 6 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.256 -0.656 18016
2940 1 6 . 1 1 12 12 LYS H H 12 7.820 7.820 7.899 -0.079 18016
2941 1 6 . 1 1 13 13 ILE N N 13 120.100 120.100 119.392 0.708 18016
2942 1 6 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.808 -0.118 18016
2943 1 6 . 1 1 13 13 ILE C C 13 178.100 178.100 178.100 0.000 18016
2944 1 6 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.510 -0.510 18016
2945 1 6 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.475 -1.075 18016
2946 1 6 . 1 1 13 13 ILE H H 13 7.640 7.640 8.008 -0.368 18016
2947 1 6 . 1 1 14 14 ALA N N 14 122.700 122.700 122.416 0.284 18016
2948 1 6 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.963 -0.103 18016
2949 1 6 . 1 1 14 14 ALA C C 14 179.000 179.000 179.619 -0.619 18016
2950 1 6 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.437 0.563 18016
2951 1 6 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.026 -0.025 18016
2952 1 6 . 1 1 14 14 ALA H H 14 8.680 8.680 8.321 0.359 18016
2953 1 6 . 1 1 15 15 ALA N N 15 118.700 118.700 121.682 -2.982 18016
2954 1 6 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.096 -0.006 18016
2955 1 6 . 1 1 15 15 ALA C C 15 180.400 180.400 178.879 1.521 18016
2956 1 6 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.638 0.362 18016
2957 1 6 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.442 -0.742 18016
2958 1 6 . 1 1 15 15 ALA H H 15 8.070 8.070 8.151 -0.081 18016
2959 1 6 . 1 1 16 16 TRP N N 16 122.900 122.900 121.194 1.706 18016
2960 1 6 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.225 0.335 18016
2961 1 6 . 1 1 16 16 TRP C C 16 178.400 178.400 178.220 0.180 18016
2962 1 6 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.278 -1.678 18016
2963 1 6 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.165 -0.865 18016
2964 1 6 . 1 1 16 16 TRP H H 16 7.820 7.820 8.223 -0.403 18016
2965 1 6 . 1 1 17 17 LEU N N 17 120.400 120.400 119.006 1.394 18016
2966 1 6 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.254 0.356 18016
2967 1 6 . 1 1 17 17 LEU C C 17 179.000 179.000 178.639 0.361 18016
2968 1 6 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.672 0.228 18016
2969 1 6 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.599 0.401 18016
2970 1 6 . 1 1 17 17 LEU H H 17 8.630 8.630 8.530 0.100 18016
2971 1 6 . 1 1 18 18 ASN N N 18 116.200 116.200 117.365 -1.165 18016
2972 1 6 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.335 -0.025 18016
2973 1 6 . 1 1 18 18 ASN C C 18 177.100 177.100 176.382 0.718 18016
2974 1 6 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.958 -0.358 18016
2975 1 6 . 1 1 18 18 ASN CB C 18 39.200 39.200 39.007 0.193 18016
2976 1 6 . 1 1 18 18 ASN H H 18 8.350 8.350 8.230 0.120 18016
2977 1 6 . 1 1 19 19 ALA N N 19 119.600 119.600 119.989 -0.389 18016
2978 1 6 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.240 -0.150 18016
2979 1 6 . 1 1 19 19 ALA C C 19 180.100 180.100 179.205 0.895 18016
2980 1 6 . 1 1 19 19 ALA CA C 19 54.200 54.200 53.855 0.345 18016
2981 1 6 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.876 -1.276 18016
2982 1 6 . 1 1 19 19 ALA H H 19 7.920 7.920 8.160 -0.240 18016
2983 1 6 . 1 1 20 20 GLY N N 20 103.500 103.500 105.433 -1.933 18016
2984 1 6 . 1 1 20 20 GLY C C 20 173.800 173.800 173.638 0.162 18016
2985 1 6 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.729 0.071 18016
2986 1 6 . 1 1 20 20 GLY H H 20 7.700 7.700 7.516 0.184 18016
2987 1 6 . 1 1 21 21 TYR N N 21 119.900 119.900 117.259 2.641 18016
2988 1 6 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.950 0.220 18016
2989 1 6 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.088 1.312 18016
2990 1 6 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.855 -1.055 18016
2991 1 6 . 1 1 21 21 TYR H H 21 7.980 7.980 8.014 -0.034 18016
2992 1 6 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.444 0.056 18016
2993 1 6 . 1 1 22 22 PRO C C 22 178.700 178.700 176.881 1.819 18016
2994 1 6 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.265 0.735 18016
2995 1 6 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.043 -0.043 18016
2996 1 6 . 1 1 23 23 GLU N N 23 116.300 116.300 117.269 -0.969 18016
2997 1 6 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.458 0.112 18016
2998 1 6 . 1 1 23 23 GLU C C 23 176.300 176.300 176.685 -0.385 18016
2999 1 6 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.953 -1.353 18016
3000 1 6 . 1 1 23 23 GLU CB C 23 29.500 29.500 28.913 0.587 18016
3001 1 6 . 1 1 23 23 GLU H H 23 8.680 8.680 8.097 0.583 18016
3002 1 6 . 1 1 24 24 GLY N N 24 108.100 108.100 109.290 -1.190 18016
3003 1 6 . 1 1 24 24 GLY C C 24 173.100 173.100 172.982 0.118 18016
3004 1 6 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.686 -1.786 18016
3005 1 6 . 1 1 24 24 GLY H H 24 7.230 7.230 7.419 -0.189 18016
3006 1 6 . 1 1 25 25 VAL N N 25 121.500 121.500 120.645 0.855 18016
3007 1 6 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.872 -0.282 18016
3008 1 6 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.726 0.574 18016
3009 1 6 . 1 1 25 25 VAL CB C 25 32.100 32.100 31.924 0.176 18016
3010 1 6 . 1 1 25 25 VAL H H 25 8.050 8.050 7.962 0.088 18016
3011 1 6 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.430 -0.110 18016
3012 1 6 . 1 1 26 26 PRO C C 26 177.600 177.600 177.811 -0.211 18016
3013 1 6 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.283 0.617 18016
3014 1 6 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.091 0.009 18016
3015 1 6 . 1 1 27 27 GLY N N 27 109.000 109.000 109.231 -0.231 18016
3016 1 6 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.770 1.329 18016
3017 1 6 . 1 1 27 27 GLY H H 27 8.930 8.930 8.801 0.129 18016
3018 1 6 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.283 0.107 18016
3019 1 6 . 1 1 28 28 PRO C C 28 175.800 175.800 176.166 -0.366 18016
3020 1 6 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.280 0.120 18016
3021 1 6 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.558 0.342 18016
3022 1 6 . 1 1 29 29 ASP N N 29 115.000 115.000 115.923 -0.923 18016
3023 1 6 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.698 -0.208 18016
3024 1 6 . 1 1 29 29 ASP C C 29 177.000 177.000 177.792 -0.792 18016
3025 1 6 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.984 -2.084 18016
3026 1 6 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.698 -0.998 18016
3027 1 6 . 1 1 29 29 ASP H H 29 7.760 7.760 7.824 -0.064 18016
3028 1 6 . 1 1 30 30 ARG N N 30 119.900 119.900 121.836 -1.936 18016
3029 1 6 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.904 -0.334 18016
3030 1 6 . 1 1 30 30 ARG C C 30 176.500 176.500 178.548 -2.048 18016
3031 1 6 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.973 1.927 18016
3032 1 6 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.309 0.191 18016
3033 1 6 . 1 1 30 30 ARG H H 30 7.460 7.460 8.131 -0.671 18016
3034 1 6 . 1 1 31 31 VAL N N 31 117.600 117.600 119.800 -2.200 18016
3035 1 6 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.838 -0.018 18016
3036 1 6 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.515 0.185 18016
3037 1 6 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.405 -0.605 18016
3038 1 6 . 1 1 31 31 VAL H H 31 9.080 9.080 8.209 0.871 18016
3039 1 6 . 1 1 32 32 PRO C C 32 177.000 177.000 178.600 -1.600 18016
3040 1 6 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.938 -0.738 18016
3041 1 6 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.229 -0.429 18016
3042 1 6 . 1 1 33 33 LEU N N 33 115.200 115.200 121.058 -5.858 18016
3043 1 6 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.112 0.008 18016
3044 1 6 . 1 1 33 33 LEU C C 33 178.600 178.600 178.525 0.075 18016
3045 1 6 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.066 0.334 18016
3046 1 6 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.334 0.166 18016
3047 1 6 . 1 1 33 33 LEU H H 33 8.010 8.010 8.124 -0.114 18016
3048 1 6 . 1 1 34 34 LEU N N 34 120.400 120.400 119.076 1.324 18016
3049 1 6 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.089 -0.159 18016
3050 1 6 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.394 0.706 18016
3051 1 6 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.378 0.522 18016
3052 1 6 . 1 1 34 34 LEU H H 34 8.220 8.220 8.306 -0.086 18016
3053 1 6 . 1 1 35 35 ALA N N 35 123.100 123.100 122.493 0.607 18016
3054 1 6 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.054 -0.014 18016
3055 1 6 . 1 1 35 35 ALA C C 35 179.500 179.500 179.521 -0.021 18016
3056 1 6 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.130 0.370 18016
3057 1 6 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.387 -0.487 18016
3058 1 6 . 1 1 35 35 ALA H H 35 8.560 8.560 8.030 0.530 18016
3059 1 6 . 1 1 36 36 LEU N N 36 117.600 117.600 118.888 -1.288 18016
3060 1 6 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.277 -0.158 18016
3061 1 6 . 1 1 36 36 LEU C C 36 180.100 180.100 179.127 0.973 18016
3062 1 6 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.424 0.776 18016
3063 1 6 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.725 1.075 18016
3064 1 6 . 1 1 36 36 LEU H H 36 7.850 7.850 7.986 -0.136 18016
3065 1 6 . 1 1 37 37 LEU N N 37 116.700 116.700 120.421 -3.721 18016
3066 1 6 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.077 0.023 18016
3067 1 6 . 1 1 37 37 LEU C C 37 180.100 180.100 178.306 1.794 18016
3068 1 6 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.273 0.027 18016
3069 1 6 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.192 0.008 18016
3070 1 6 . 1 1 37 37 LEU H H 37 8.730 8.730 8.347 0.383 18016
3071 1 6 . 1 1 38 38 THR N N 38 110.600 110.600 109.440 1.160 18016
3072 1 6 . 1 1 38 38 THR HA H 38 4.440 4.440 4.151 0.289 18016
3073 1 6 . 1 1 38 38 THR C C 38 175.100 175.100 175.651 -0.551 18016
3074 1 6 . 1 1 38 38 THR CA C 38 64.200 64.200 64.125 0.075 18016
3075 1 6 . 1 1 38 38 THR CB C 38 70.000 70.000 68.440 1.560 18016
3076 1 6 . 1 1 38 38 THR H H 38 8.660 8.660 8.375 0.285 18016
3077 1 6 . 1 1 39 39 ARG N N 39 118.000 118.000 120.568 -2.568 18016
3078 1 6 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.142 0.138 18016
3079 1 6 . 1 1 39 39 ARG C C 39 177.300 177.300 177.842 -0.542 18016
3080 1 6 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.080 0.220 18016
3081 1 6 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.675 0.524 18016
3082 1 6 . 1 1 39 39 ARG H H 39 7.180 7.180 7.620 -0.440 18016
3083 1 6 . 1 1 40 40 ARG N N 40 114.400 114.400 116.028 -1.628 18016
3084 1 6 . 1 1 40 40 ARG C C 40 174.800 174.800 176.819 -2.019 18016
3085 1 6 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.508 -1.208 18016
3086 1 6 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.596 3.004 18016
3087 1 6 . 1 1 40 40 ARG H H 40 7.520 7.520 7.611 -0.091 18016
3088 1 6 . 1 1 41 41 LEU N N 41 119.400 119.400 121.065 -1.665 18016
3089 1 6 . 1 1 41 41 LEU C C 41 177.100 177.100 176.759 0.341 18016
3090 1 6 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.675 -0.975 18016
3091 1 6 . 1 1 41 41 LEU CB C 41 44.400 44.400 42.468 1.932 18016
3092 1 6 . 1 1 41 41 LEU H H 41 8.380 8.380 7.512 0.868 18016
3093 1 6 . 1 1 42 42 THR N N 42 112.000 112.000 115.222 -3.222 18016
3094 1 6 . 1 1 42 42 THR HA H 42 4.440 4.440 4.272 0.168 18016
3095 1 6 . 1 1 42 42 THR C C 42 175.800 175.800 175.852 -0.052 18016
3096 1 6 . 1 1 42 42 THR CA C 42 60.500 60.500 61.388 -0.888 18016
3097 1 6 . 1 1 42 42 THR CB C 42 70.800 70.800 70.217 0.583 18016
3098 1 6 . 1 1 42 42 THR H H 42 9.330 9.330 9.072 0.258 18016
3099 1 6 . 1 1 43 43 ASN N N 43 119.900 119.900 119.930 -0.030 18016
3100 1 6 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.370 -0.120 18016
3101 1 6 . 1 1 43 43 ASN C C 43 177.900 177.900 177.040 0.860 18016
3102 1 6 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.822 -0.122 18016
3103 1 6 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.404 -1.204 18016
3104 1 6 . 1 1 43 43 ASN H H 43 9.140 9.140 8.686 0.454 18016
3105 1 6 . 1 1 44 44 ASP N N 44 118.000 118.000 120.381 -2.381 18016
3106 1 6 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.355 0.045 18016
3107 1 6 . 1 1 44 44 ASP C C 44 179.600 179.600 178.357 1.243 18016
3108 1 6 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.874 -0.574 18016
3109 1 6 . 1 1 44 44 ASP H H 44 8.360 8.360 8.420 -0.060 18016
3110 1 6 . 1 1 45 45 GLU N N 45 122.600 122.600 120.276 2.324 18016
3111 1 6 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.055 -0.085 18016
3112 1 6 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.207 0.193 18016
3113 1 6 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.833 0.467 18016
3114 1 6 . 1 1 45 45 GLU H H 45 7.850 7.850 7.674 0.176 18016
3115 1 6 . 1 1 46 46 ILE N N 46 118.900 118.900 120.689 -1.789 18016
3116 1 6 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.729 -0.299 18016
3117 1 6 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.253 1.747 18016
3118 1 6 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.756 -0.056 18016
3119 1 6 . 1 1 46 46 ILE H H 46 8.290 8.290 8.455 -0.165 18016
3120 1 6 . 1 1 47 47 LYS N N 47 118.900 118.900 119.514 -0.614 18016
3121 1 6 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.903 -0.033 18016
3122 1 6 . 1 1 47 47 LYS C C 47 178.400 178.400 178.871 -0.471 18016
3123 1 6 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.913 0.387 18016
3124 1 6 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.198 0.402 18016
3125 1 6 . 1 1 47 47 LYS H H 47 8.290 8.290 8.148 0.142 18016
3126 1 6 . 1 1 48 48 ALA N N 48 121.100 121.100 122.346 -1.246 18016
3127 1 6 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.977 0.193 18016
3128 1 6 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.267 -0.167 18016
3129 1 6 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.276 -0.276 18016
3130 1 6 . 1 1 48 48 ALA H H 48 7.710 7.710 8.172 -0.462 18016
3131 1 6 . 1 1 49 49 ILE N N 49 119.900 119.900 117.483 2.417 18016
3132 1 6 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.745 -0.095 18016
3133 1 6 . 1 1 49 49 ILE C C 49 177.300 177.300 177.971 -0.671 18016
3134 1 6 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.340 1.660 18016
3135 1 6 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.320 1.780 18016
3136 1 6 . 1 1 49 49 ILE H H 49 8.130 8.130 8.279 -0.149 18016
3137 1 6 . 1 1 50 50 ALA N N 50 122.000 122.000 122.733 -0.733 18016
3138 1 6 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.996 -0.136 18016
3139 1 6 . 1 1 50 50 ALA C C 50 179.800 179.800 179.877 -0.077 18016
3140 1 6 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.403 0.297 18016
3141 1 6 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.130 -0.230 18016
3142 1 6 . 1 1 50 50 ALA H H 50 8.730 8.730 7.825 0.905 18016
3143 1 6 . 1 1 51 51 GLU N N 51 116.900 116.900 118.068 -1.168 18016
3144 1 6 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.935 0.085 18016
3145 1 6 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.463 -0.063 18016
3146 1 6 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.105 0.395 18016
3147 1 6 . 1 1 51 51 GLU H H 51 8.220 8.220 8.395 -0.175 18016
3148 1 6 . 1 1 52 52 ASP N N 52 120.300 120.300 120.265 0.035 18016
3149 1 6 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.456 -0.066 18016
3150 1 6 . 1 1 52 52 ASP C C 52 178.900 178.900 178.656 0.244 18016
3151 1 6 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.103 0.397 18016
3152 1 6 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.204 1.296 18016
3153 1 6 . 1 1 52 52 ASP H H 52 7.700 7.700 7.897 -0.197 18016
3154 1 6 . 1 1 53 53 LEU N N 53 118.300 118.300 119.653 -1.353 18016
3155 1 6 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.943 -0.213 18016
3156 1 6 . 1 1 53 53 LEU C C 53 179.000 179.000 179.000 0.000 18016
3157 1 6 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.681 -0.181 18016
3158 1 6 . 1 1 53 53 LEU CB C 53 41.100 41.100 42.052 -0.952 18016
3159 1 6 . 1 1 53 53 LEU H H 53 8.290 8.290 7.979 0.311 18016
3160 1 6 . 1 1 54 54 GLU N N 54 118.700 118.700 118.442 0.258 18016
3161 1 6 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.145 0.075 18016
3162 1 6 . 1 1 54 54 GLU C C 54 178.200 178.200 177.974 0.226 18016
3163 1 6 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.513 0.187 18016
3164 1 6 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.105 0.795 18016
3165 1 6 . 1 1 54 54 GLU H H 54 8.070 8.070 8.575 -0.505 18016
3166 1 6 . 1 1 55 55 LYS N N 55 117.700 117.700 118.797 -1.097 18016
3167 1 6 . 1 1 55 55 LYS HA H 55 4.150 4.150 3.994 0.156 18016
3168 1 6 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.109 0.191 18016
3169 1 6 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.325 0.375 18016
3170 1 6 . 1 1 55 55 LYS H H 55 7.750 7.750 7.588 0.162 18016
3171 1 6 . 1 1 56 56 ARG N N 56 117.100 117.100 117.005 0.095 18016
3172 1 6 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.095 0.175 18016
3173 1 6 . 1 1 56 56 ARG CA C 56 56.800 56.800 58.526 -1.726 18016
3174 1 6 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.081 -0.081 18016
3175 1 6 . 1 1 56 56 ARG H H 56 8.270 8.270 7.487 0.783 18016
3176 1 6 . 1 1 57 57 ALA HA H 57 4.360 4.360 3.987 0.373 18016
3177 1 6 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.834 0.266 18016
3178 1 6 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.388 -1.188 18016
3179 1 6 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.450 0.060 18016
3180 1 6 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.600 0.600 18016
3181 1 6 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.474 -2.174 18016
3182 1 6 . 1 1 59 59 PHE N N 59 120.400 120.400 118.155 2.245 18016
3183 1 6 . 1 1 59 59 PHE C C 59 175.500 175.500 176.186 -0.686 18016
3184 1 6 . 1 1 59 59 PHE CA C 59 57.200 57.200 58.818 -1.618 18016
3185 1 6 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.028 0.272 18016
3186 1 6 . 1 1 59 59 PHE H H 59 7.710 7.710 7.725 -0.015 18016
3187 1 6 . 1 1 60 60 ASP N N 60 120.800 120.800 118.440 2.360 18016
3188 1 6 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.765 -0.275 18016
3189 1 6 . 1 1 60 60 ASP CA C 60 54.300 54.300 53.496 0.804 18016
3190 1 6 . 1 1 60 60 ASP CB C 60 41.100 41.100 42.980 -1.880 18016
3191 1 6 . 1 1 60 60 ASP H H 60 8.180 8.180 8.009 0.171 18016
3192 1 6 . 1 1 61 61 HIS N N 61 118.300 118.300 117.206 1.094 18016
3193 1 6 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.752 -0.362 18016
3194 1 6 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.412 1.288 18016
3195 1 6 . 1 1 61 61 HIS CB C 61 28.800 28.800 30.305 -1.506 18016
3196 1 6 . 1 1 61 61 HIS H H 61 8.550 8.550 8.689 -0.139 18016
3197 1 6 . 1 1 62 62 ILE HA H 62 4.010 4.010 3.990 0.020 18016
3198 1 6 . 1 1 62 62 ILE C C 62 173.800 173.800 175.710 -1.910 18016
3199 1 6 . 1 1 62 62 ILE CA C 62 66.500 66.500 61.426 5.074 18016
3200 1 6 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.374 2.726 18016
3201 1 6 . 1 1 63 63 ASP N N 63 125.100 125.100 121.316 3.784 18016
3202 1 6 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.296 0.304 18016
3203 1 6 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.409 -2.609 18016
3204 1 6 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.969 -1.469 18016
3205 1 6 . 1 1 63 63 ASP H H 63 8.360 8.360 7.764 0.596 18016
3206 1 6 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.948 -0.278 18016
3207 1 6 . 1 1 64 64 ILE C C 64 177.000 177.000 176.598 0.402 18016
3208 1 6 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.160 -1.060 18016
3209 1 6 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.368 -1.768 18016
3210 1 6 . 1 1 65 65 GLY N N 65 107.600 107.600 108.107 -0.507 18016
3211 1 6 . 1 1 65 65 GLY C C 65 177.000 177.000 175.884 1.116 18016
3212 1 6 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.960 0.340 18016
3213 1 6 . 1 1 65 65 GLY H H 65 8.440 8.440 7.949 0.491 18016
3214 1 6 . 1 1 66 66 VAL N N 66 121.800 121.800 122.106 -0.306 18016
3215 1 6 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.651 0.109 18016
3216 1 6 . 1 1 66 66 VAL C C 66 178.500 178.500 177.726 0.774 18016
3217 1 6 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.480 0.120 18016
3218 1 6 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.690 0.310 18016
3219 1 6 . 1 1 66 66 VAL H H 66 7.550 7.550 8.180 -0.630 18016
3220 1 6 . 1 1 67 67 LEU N N 67 120.900 120.900 118.362 2.538 18016
3221 1 6 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.239 -0.169 18016
3222 1 6 . 1 1 67 67 LEU C C 67 179.000 179.000 179.218 -0.218 18016
3223 1 6 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.420 0.180 18016
3224 1 6 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.556 1.744 18016
3225 1 6 . 1 1 67 67 LEU H H 67 7.650 7.650 7.585 0.065 18016
3226 1 6 . 1 1 68 68 ILE N N 68 118.900 118.900 117.912 0.988 18016
3227 1 6 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.772 -0.062 18016
3228 1 6 . 1 1 68 68 ILE C C 68 179.500 179.500 178.375 1.125 18016
3229 1 6 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.939 0.261 18016
3230 1 6 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.426 0.074 18016
3231 1 6 . 1 1 68 68 ILE H H 68 8.580 8.580 7.535 1.045 18016
3232 1 6 . 1 1 69 69 THR N N 69 118.100 118.100 114.794 3.306 18016
3233 1 6 . 1 1 69 69 THR HA H 69 3.940 3.940 4.028 -0.088 18016
3234 1 6 . 1 1 69 69 THR C C 69 176.200 176.200 176.153 0.047 18016
3235 1 6 . 1 1 69 69 THR CA C 69 66.600 66.600 65.948 0.652 18016
3236 1 6 . 1 1 69 69 THR CB C 69 68.500 68.500 68.477 0.023 18016
3237 1 6 . 1 1 69 69 THR H H 69 7.840 7.840 7.699 0.141 18016
3238 1 6 . 1 1 70 70 GLN N N 70 121.600 121.600 120.126 1.474 18016
3239 1 6 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.156 -0.046 18016
3240 1 6 . 1 1 70 70 GLN C C 70 178.100 178.100 178.031 0.069 18016
3241 1 6 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.505 0.595 18016
3242 1 6 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.762 -0.462 18016
3243 1 6 . 1 1 70 70 GLN H H 70 8.100 8.100 7.324 0.776 18016
3244 1 6 . 1 1 71 71 MET N N 71 118.700 118.700 118.328 0.372 18016
3245 1 6 . 1 1 71 71 MET HA H 71 4.010 4.010 4.390 -0.380 18016
3246 1 6 . 1 1 71 71 MET C C 71 176.300 176.300 178.155 -1.855 18016
3247 1 6 . 1 1 71 71 MET CA C 71 58.100 58.100 58.891 -0.791 18016
3248 1 6 . 1 1 71 71 MET CB C 71 33.600 33.600 32.877 0.723 18016
3249 1 6 . 1 1 71 71 MET H H 71 8.350 8.350 8.593 -0.243 18016
3250 1 6 . 1 1 72 72 THR N N 72 111.600 111.600 111.443 0.157 18016
3251 1 6 . 1 1 72 72 THR HA H 72 3.940 3.940 4.147 -0.207 18016
3252 1 6 . 1 1 72 72 THR C C 72 175.800 175.800 175.332 0.468 18016
3253 1 6 . 1 1 72 72 THR CA C 72 65.300 65.300 64.769 0.531 18016
3254 1 6 . 1 1 72 72 THR CB C 72 69.100 69.100 69.151 -0.051 18016
3255 1 6 . 1 1 72 72 THR H H 72 7.840 7.840 7.792 0.048 18016
3256 1 6 . 1 1 73 73 ASP N N 73 121.100 121.100 119.869 1.231 18016
3257 1 6 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.713 -0.182 18016
3258 1 6 . 1 1 73 73 ASP C C 73 176.600 176.600 175.708 0.892 18016
3259 1 6 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.319 0.881 18016
3260 1 6 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.582 -1.182 18016
3261 1 6 . 1 1 73 73 ASP H H 73 7.840 7.840 7.615 0.225 18016
3262 1 6 . 1 1 74 74 GLU N N 74 121.100 121.100 119.328 1.772 18016
3263 1 6 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.599 -0.259 18016
3264 1 6 . 1 1 74 74 GLU C C 74 173.800 173.800 175.278 -1.478 18016
3265 1 6 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.542 -0.042 18016
3266 1 6 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.360 -0.760 18016
3267 1 6 . 1 1 74 74 GLU H H 74 7.980 7.980 8.447 -0.467 18016
3268 1 6 . 1 1 75 75 MET N N 75 125.800 125.800 125.822 -0.022 18016
3269 1 6 . 1 1 75 75 MET HA H 75 4.710 4.710 4.821 -0.111 18016
3270 1 6 . 1 1 75 75 MET CA C 75 53.800 53.800 54.575 -0.776 18016
3271 1 6 . 1 1 75 75 MET CB C 75 31.700 31.700 31.683 0.017 18016
3272 1 6 . 1 1 75 75 MET H H 75 8.380 8.380 8.549 -0.169 18016
3273 1 6 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.401 0.109 18016
3274 1 6 . 1 1 76 76 PRO C C 76 175.700 175.700 176.216 -0.516 18016
3275 1 6 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.528 -1.528 18016
3276 1 6 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.188 -0.388 18016
3277 1 6 . 1 1 77 77 ARG N N 77 119.700 119.700 116.968 2.732 18016
3278 1 6 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.658 -0.388 18016
3279 1 6 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.911 0.889 18016
3280 1 6 . 1 1 77 77 ARG CB C 77 30.700 30.700 33.356 -2.656 18016
3281 1 6 . 1 1 77 77 ARG H H 77 8.940 8.940 7.733 1.207 18016
3282 1 6 . 1 1 78 78 GLU N N 78 124.700 124.700 123.345 1.355 18016
3283 1 6 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.965 -0.005 18016
3284 1 6 . 1 1 78 78 GLU C C 78 179.000 179.000 178.436 0.564 18016
3285 1 6 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.552 0.248 18016
3286 1 6 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.798 -0.798 18016
3287 1 6 . 1 1 78 78 GLU H H 78 9.170 9.170 8.811 0.359 18016
3288 1 6 . 1 1 79 79 GLU N N 79 116.800 116.800 120.159 -3.359 18016
3289 1 6 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.087 0.033 18016
3290 1 6 . 1 1 79 79 GLU C C 79 179.100 179.100 178.489 0.611 18016
3291 1 6 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.821 -0.120 18016
3292 1 6 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.330 -0.330 18016
3293 1 6 . 1 1 79 79 GLU H H 79 9.660 9.660 8.720 0.940 18016
3294 1 6 . 1 1 80 80 ASP N N 80 120.000 120.000 119.132 0.868 18016
3295 1 6 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.431 0.259 18016
3296 1 6 . 1 1 80 80 ASP C C 80 177.300 177.300 178.620 -1.320 18016
3297 1 6 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.218 0.182 18016
3298 1 6 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.170 1.430 18016
3299 1 6 . 1 1 80 80 ASP H H 80 7.310 7.310 8.358 -1.048 18016
3300 1 6 . 1 1 81 81 ILE N N 81 120.100 120.100 120.147 -0.047 18016
3301 1 6 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.725 -0.235 18016
3302 1 6 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.513 0.787 18016
3303 1 6 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.994 0.306 18016
3304 1 6 . 1 1 81 81 ILE H H 81 7.610 7.610 8.090 -0.480 18016
3305 1 6 . 1 1 82 82 GLU N N 82 118.100 118.100 120.620 -2.520 18016
3306 1 6 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.064 0.216 18016
3307 1 6 . 1 1 82 82 GLU C C 82 177.800 177.800 178.408 -0.608 18016
3308 1 6 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.664 -1.664 18016
3309 1 6 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.346 -0.546 18016
3310 1 6 . 1 1 82 82 GLU H H 82 8.550 8.550 8.516 0.034 18016
3311 1 6 . 1 1 83 83 ARG N N 83 119.900 119.900 119.804 0.096 18016
3312 1 6 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.108 -0.078 18016
3313 1 6 . 1 1 83 83 ARG C C 83 179.400 179.400 178.908 0.492 18016
3314 1 6 . 1 1 83 83 ARG CA C 83 59.900 59.900 58.888 1.012 18016
3315 1 6 . 1 1 83 83 ARG CB C 83 29.600 29.600 29.452 0.148 18016
3316 1 6 . 1 1 83 83 ARG H H 83 7.590 7.590 8.211 -0.621 18016
3317 1 6 . 1 1 84 84 VAL N N 84 120.400 120.400 119.835 0.565 18016
3318 1 6 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.901 -0.151 18016
3319 1 6 . 1 1 84 84 VAL C C 84 177.400 177.400 177.566 -0.166 18016
3320 1 6 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.666 1.234 18016
3321 1 6 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.964 -0.064 18016
3322 1 6 . 1 1 84 84 VAL H H 84 7.550 7.550 8.446 -0.896 18016
3323 1 6 . 1 1 85 85 ARG N N 85 121.600 121.600 119.630 1.970 18016
3324 1 6 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.304 -0.294 18016
3325 1 6 . 1 1 85 85 ARG C C 85 178.100 178.100 178.736 -0.636 18016
3326 1 6 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.764 1.136 18016
3327 1 6 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.927 0.273 18016
3328 1 6 . 1 1 85 85 ARG H H 85 9.090 9.090 8.467 0.623 18016
3329 1 6 . 1 1 86 86 ARG N N 86 115.600 115.600 118.337 -2.737 18016
3330 1 6 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.124 -0.244 18016
3331 1 6 . 1 1 86 86 ARG C C 86 179.000 179.000 178.615 0.385 18016
3332 1 6 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.006 0.394 18016
3333 1 6 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.494 0.906 18016
3334 1 6 . 1 1 86 86 ARG H H 86 8.660 8.660 8.520 0.140 18016
3335 1 6 . 1 1 87 87 HIS N N 87 118.000 118.000 120.019 -2.019 18016
3336 1 6 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.313 0.047 18016
3337 1 6 . 1 1 87 87 HIS C C 87 178.400 178.400 177.505 0.895 18016
3338 1 6 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.500 0.100 18016
3339 1 6 . 1 1 87 87 HIS CB C 87 30.700 30.700 29.938 0.762 18016
3340 1 6 . 1 1 87 87 HIS H H 87 7.640 7.640 7.672 -0.032 18016
3341 1 6 . 1 1 88 88 LEU N N 88 119.600 119.600 118.927 0.673 18016
3342 1 6 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.114 -0.534 18016
3343 1 6 . 1 1 88 88 LEU C C 88 180.000 180.000 178.928 1.072 18016
3344 1 6 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.084 0.116 18016
3345 1 6 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.134 1.466 18016
3346 1 6 . 1 1 88 88 LEU H H 88 8.650 8.650 8.532 0.118 18016
3347 1 6 . 1 1 89 89 ALA N N 89 118.500 118.500 122.351 -3.851 18016
3348 1 6 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.747 0.613 18016
3349 1 6 . 1 1 89 89 ALA C C 89 180.400 180.400 180.034 0.366 18016
3350 1 6 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.589 -0.989 18016
3351 1 6 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.371 -0.271 18016
3352 1 6 . 1 1 89 89 ALA H H 89 8.870 8.870 8.270 0.600 18016
3353 1 6 . 1 1 90 90 LEU N N 90 119.400 119.400 117.734 1.666 18016
3354 1 6 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.985 0.225 18016
3355 1 6 . 1 1 90 90 LEU C C 90 179.100 179.100 179.033 0.067 18016
3356 1 6 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.049 0.451 18016
3357 1 6 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.697 0.003 18016
3358 1 6 . 1 1 90 90 LEU H H 90 7.390 7.390 7.502 -0.112 18016
3359 1 6 . 1 1 91 91 GLN N N 91 114.500 114.500 116.336 -1.836 18016
3360 1 6 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.291 0.409 18016
3361 1 6 . 1 1 91 91 GLN C C 91 175.800 175.800 176.573 -0.773 18016
3362 1 6 . 1 1 91 91 GLN CA C 91 54.500 54.500 57.062 -2.562 18016
3363 1 6 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.888 -1.788 18016
3364 1 6 . 1 1 91 91 GLN H H 91 7.810 7.810 7.717 0.093 18016
3365 1 6 . 1 1 92 92 GLY N N 92 107.900 107.900 105.042 2.858 18016
3366 1 6 . 1 1 92 92 GLY C C 92 172.100 172.100 171.837 0.263 18016
3367 1 6 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.363 -1.363 18016
3368 1 6 . 1 1 92 92 GLY H H 92 7.710 7.710 8.399 -0.689 18016
3369 1 6 . 1 1 93 93 TRP N N 93 114.200 114.200 121.584 -7.384 18016
3370 1 6 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.767 1.233 18016
3371 1 6 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.342 -1.142 18016
3372 1 6 . 1 1 93 93 TRP H H 93 8.450 8.450 8.250 0.200 18016
3373 1 6 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.306 0.154 18016
3374 1 6 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.796 -0.996 18016
3375 1 6 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.431 0.169 18016
3376 1 6 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.023 -0.523 18016
3377 1 6 . 1 1 95 95 LEU C C 95 175.000 175.000 177.977 -2.977 18016
3378 1 6 . 1 1 95 95 LEU CA C 95 56.100 56.100 57.355 -1.255 18016
3379 1 6 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.832 1.268 18016
3380 1 6 . 1 1 96 96 ASP N N 96 114.000 114.000 117.822 -3.822 18016
3381 1 6 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.555 0.395 18016
3382 1 6 . 1 1 96 96 ASP C C 96 175.800 175.800 175.903 -0.103 18016
3383 1 6 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.818 -2.818 18016
3384 1 6 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.922 -0.022 18016
3385 1 6 . 1 1 96 96 ASP H H 96 7.230 7.230 7.770 -0.540 18016
3386 1 6 . 1 1 97 97 ASP N N 97 123.200 123.200 115.199 8.001 18016
3387 1 6 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.833 -0.223 18016
3388 1 6 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.678 1.822 18016
3389 1 6 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.257 -3.557 18016
3390 1 6 . 1 1 97 97 ASP H H 97 7.420 7.420 7.869 -0.449 18016
3391 1 6 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.405 0.885 18016
3392 1 6 . 1 1 98 98 PRO C C 98 177.500 177.500 176.598 0.902 18016
3393 1 6 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.633 0.067 18016
3394 1 6 . 1 1 98 98 PRO CB C 98 31.900 31.900 31.653 0.247 18016
3395 1 6 . 1 1 99 99 ARG N N 99 121.300 121.300 120.987 0.313 18016
3396 1 6 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.196 -0.486 18016
3397 1 6 . 1 1 99 99 ARG C C 99 176.500 176.500 175.788 0.712 18016
3398 1 6 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.679 -1.579 18016
3399 1 6 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.574 -0.074 18016
3400 1 6 . 1 1 99 99 ARG H H 99 8.390 8.390 8.450 -0.060 18016
3401 1 6 . 1 1 100 100 ASP N N 100 119.600 119.600 117.841 1.759 18016
3402 1 6 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.723 -0.223 18016
3403 1 6 . 1 1 100 100 ASP C C 100 177.000 177.000 176.355 0.645 18016
3404 1 6 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.809 0.891 18016
3405 1 6 . 1 1 100 100 ASP CB C 100 40.900 40.900 41.663 -0.763 18016
3406 1 6 . 1 1 100 100 ASP H H 100 8.260 8.260 7.821 0.439 18016
3407 1 6 . 1 1 101 101 GLY N N 101 109.300 109.300 113.596 -4.296 18016
3408 1 6 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.989 0.411 18016
3409 1 6 . 1 1 101 101 GLY H H 101 8.450 8.450 8.619 -0.169 18016
3410 1 6 . 1 1 102 102 GLU N N 102 119.800 119.800 121.579 -1.779 18016
3411 1 6 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.573 -0.263 18016
3412 1 6 . 1 1 102 102 GLU CA C 102 56.000 56.000 54.966 1.034 18016
3413 1 6 . 1 1 102 102 GLU CB C 102 30.500 30.500 32.850 -2.350 18016
3414 1 6 . 1 1 102 102 GLU H H 102 8.140 8.140 7.699 0.441 18016
3415 1 6 . 1 1 103 103 GLU N N 103 123.000 123.000 124.843 -1.843 18016
3416 1 6 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.526 0.034 18016
3417 1 6 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.230 0.070 18016
3418 1 6 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.371 0.229 18016
3419 1 6 . 1 1 103 103 GLU H H 103 8.580 8.580 8.590 -0.010 18016
3420 1 6 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.370 0.110 18016
3421 1 6 . 1 1 104 104 PRO C C 104 176.800 176.800 176.219 0.581 18016
3422 1 6 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.688 -0.288 18016
3423 1 6 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.273 -0.173 18016
3424 1 6 . 1 1 105 105 ASP N N 105 120.400 120.400 117.768 2.632 18016
3425 1 6 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.807 -0.227 18016
3426 1 6 . 1 1 105 105 ASP C C 105 177.100 177.100 176.792 0.308 18016
3427 1 6 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.110 0.190 18016
3428 1 6 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.435 -0.035 18016
3429 1 6 . 1 1 105 105 ASP H H 105 8.500 8.500 7.679 0.821 18016
3430 1 6 . 1 1 106 106 GLY N N 106 109.300 109.300 110.116 -0.816 18016
3431 1 6 . 1 1 106 106 GLY C C 106 174.600 174.600 175.428 -0.828 18016
3432 1 6 . 1 1 106 106 GLY CA C 106 45.400 45.400 46.065 -0.665 18016
3433 1 6 . 1 1 106 106 GLY H H 106 8.360 8.360 8.596 -0.236 18016
3434 1 6 . 1 1 107 107 GLU N N 107 120.400 120.400 118.863 1.537 18016
3435 1 6 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.469 -0.129 18016
3436 1 6 . 1 1 107 107 GLU C C 107 177.100 177.100 176.743 0.357 18016
3437 1 6 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.210 0.290 18016
3438 1 6 . 1 1 107 107 GLU CB C 107 30.200 30.200 30.490 -0.290 18016
3439 1 6 . 1 1 107 107 GLU H H 107 8.410 8.410 8.570 -0.160 18016
3440 1 6 . 1 1 108 108 SER N N 108 116.600 116.600 113.956 2.644 18016
3441 1 6 . 1 1 108 108 SER HA H 108 4.450 4.450 4.525 -0.075 18016
3442 1 6 . 1 1 108 108 SER C C 108 175.300 175.300 175.357 -0.057 18016
3443 1 6 . 1 1 108 108 SER CA C 108 58.700 58.700 58.473 0.227 18016
3444 1 6 . 1 1 108 108 SER CB C 108 63.800 63.800 63.908 -0.109 18016
3445 1 6 . 1 1 108 108 SER H H 108 8.460 8.460 7.724 0.736 18016
3446 1 6 . 1 1 109 109 GLY N N 109 110.800 110.800 107.625 3.175 18016
3447 1 6 . 1 1 109 109 GLY C C 109 174.500 174.500 174.018 0.482 18016
3448 1 6 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.483 -0.183 18016
3449 1 6 . 1 1 109 109 GLY H H 109 8.500 8.500 8.615 -0.115 18016
3450 1 6 . 1 1 110 110 GLY N N 110 108.800 108.800 107.297 1.503 18016
3451 1 6 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.229 0.171 18016
3452 1 6 . 1 1 110 110 GLY H H 110 8.140 8.140 7.914 0.226 18016
3453 1 6 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.671 -0.061 18016
3454 1 6 . 1 1 111 111 PRO C C 111 176.000 176.000 175.923 0.077 18016
3455 1 6 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.728 -0.129 18016
3456 1 6 . 1 1 111 111 PRO CB C 111 34.600 34.600 30.567 4.033 18016
3457 1 7 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.587 -0.157 18016
3458 1 7 . 1 1 2 2 PRO C C 2 177.600 177.600 176.574 1.026 18016
3459 1 7 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.531 0.769 18016
3460 1 7 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.517 -0.217 18016
3461 1 7 . 1 1 3 3 GLY N N 3 110.000 110.000 108.173 1.827 18016
3462 1 7 . 1 1 3 3 GLY C C 3 174.200 174.200 173.633 0.567 18016
3463 1 7 . 1 1 3 3 GLY CA C 3 45.400 45.400 44.981 0.419 18016
3464 1 7 . 1 1 3 3 GLY H H 3 8.700 8.700 8.582 0.118 18016
3465 1 7 . 1 1 4 4 SER N N 4 115.400 115.400 115.256 0.144 18016
3466 1 7 . 1 1 4 4 SER HA H 4 4.440 4.440 4.888 -0.448 18016
3467 1 7 . 1 1 4 4 SER C C 4 174.800 174.800 173.904 0.896 18016
3468 1 7 . 1 1 4 4 SER CA C 4 58.400 58.400 56.889 1.511 18016
3469 1 7 . 1 1 4 4 SER CB C 4 63.800 63.800 65.775 -1.975 18016
3470 1 7 . 1 1 4 4 SER H H 4 8.210 8.210 7.784 0.426 18016
3471 1 7 . 1 1 5 5 MET N N 5 122.200 122.200 120.263 1.937 18016
3472 1 7 . 1 1 5 5 MET HA H 5 4.510 4.510 4.786 -0.276 18016
3473 1 7 . 1 1 5 5 MET CA C 5 55.600 55.600 55.280 0.320 18016
3474 1 7 . 1 1 5 5 MET CB C 5 32.900 32.900 34.320 -1.420 18016
3475 1 7 . 1 1 5 5 MET H H 5 8.570 8.570 9.224 -0.654 18016
3476 1 7 . 1 1 6 6 VAL N N 6 120.000 120.000 117.988 2.012 18016
3477 1 7 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.210 -0.160 18016
3478 1 7 . 1 1 6 6 VAL C C 6 175.700 175.700 176.013 -0.313 18016
3479 1 7 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.614 1.086 18016
3480 1 7 . 1 1 6 6 VAL CB C 6 32.500 32.500 31.467 1.033 18016
3481 1 7 . 1 1 6 6 VAL H H 6 8.150 8.150 7.767 0.383 18016
3482 1 7 . 1 1 7 7 ASN N N 7 122.000 122.000 117.718 4.282 18016
3483 1 7 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.540 0.120 18016
3484 1 7 . 1 1 7 7 ASN C C 7 175.200 175.200 176.919 -1.719 18016
3485 1 7 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.087 -0.888 18016
3486 1 7 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.835 -0.935 18016
3487 1 7 . 1 1 7 7 ASN H H 7 8.010 8.010 8.362 -0.352 18016
3488 1 7 . 1 1 8 8 ALA N N 8 126.500 126.500 124.345 2.155 18016
3489 1 7 . 1 1 8 8 ALA C C 8 180.200 180.200 179.452 0.748 18016
3490 1 7 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.100 0.400 18016
3491 1 7 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.823 -0.423 18016
3492 1 7 . 1 1 8 8 ALA H H 8 9.020 9.020 8.667 0.353 18016
3493 1 7 . 1 1 9 9 PHE N N 9 121.300 121.300 119.488 1.812 18016
3494 1 7 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.108 0.182 18016
3495 1 7 . 1 1 9 9 PHE C C 9 177.200 177.200 177.126 0.074 18016
3496 1 7 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.533 -0.233 18016
3497 1 7 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.899 0.301 18016
3498 1 7 . 1 1 9 9 PHE H H 9 8.570 8.570 7.975 0.595 18016
3499 1 7 . 1 1 10 10 LEU N N 10 117.200 117.200 119.524 -2.324 18016
3500 1 7 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.114 -0.414 18016
3501 1 7 . 1 1 10 10 LEU C C 10 179.700 179.700 179.308 0.392 18016
3502 1 7 . 1 1 10 10 LEU CA C 10 57.600 57.600 58.090 -0.490 18016
3503 1 7 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.537 0.163 18016
3504 1 7 . 1 1 10 10 LEU H H 10 8.150 8.150 8.101 0.049 18016
3505 1 7 . 1 1 11 11 ALA N N 11 121.500 121.500 121.678 -0.178 18016
3506 1 7 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.937 0.083 18016
3507 1 7 . 1 1 11 11 ALA C C 11 180.900 180.900 179.339 1.561 18016
3508 1 7 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.258 -0.258 18016
3509 1 7 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.069 -0.069 18016
3510 1 7 . 1 1 11 11 ALA H H 11 8.460 8.460 8.461 -0.001 18016
3511 1 7 . 1 1 12 12 LYS N N 12 120.700 120.700 119.404 1.296 18016
3512 1 7 . 1 1 12 12 LYS HA H 12 4.050 4.050 3.996 0.054 18016
3513 1 7 . 1 1 12 12 LYS C C 12 179.700 179.700 178.884 0.816 18016
3514 1 7 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.472 -0.272 18016
3515 1 7 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.335 -0.735 18016
3516 1 7 . 1 1 12 12 LYS H H 12 7.820 7.820 7.775 0.045 18016
3517 1 7 . 1 1 13 13 ILE N N 13 120.100 120.100 119.430 0.670 18016
3518 1 7 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.847 -0.157 18016
3519 1 7 . 1 1 13 13 ILE C C 13 178.100 178.100 178.211 -0.111 18016
3520 1 7 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.875 -0.875 18016
3521 1 7 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.701 -1.301 18016
3522 1 7 . 1 1 13 13 ILE H H 13 7.640 7.640 7.897 -0.257 18016
3523 1 7 . 1 1 14 14 ALA N N 14 122.700 122.700 122.394 0.306 18016
3524 1 7 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.982 -0.122 18016
3525 1 7 . 1 1 14 14 ALA C C 14 179.000 179.000 179.555 -0.555 18016
3526 1 7 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.514 0.486 18016
3527 1 7 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.070 -0.070 18016
3528 1 7 . 1 1 14 14 ALA H H 14 8.680 8.680 8.437 0.243 18016
3529 1 7 . 1 1 15 15 ALA N N 15 118.700 118.700 121.262 -2.562 18016
3530 1 7 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.129 -0.039 18016
3531 1 7 . 1 1 15 15 ALA C C 15 180.400 180.400 179.205 1.195 18016
3532 1 7 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.758 0.242 18016
3533 1 7 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.326 -0.625 18016
3534 1 7 . 1 1 15 15 ALA H H 15 8.070 8.070 8.253 -0.183 18016
3535 1 7 . 1 1 16 16 TRP N N 16 122.900 122.900 121.464 1.436 18016
3536 1 7 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.264 0.296 18016
3537 1 7 . 1 1 16 16 TRP C C 16 178.400 178.400 177.871 0.529 18016
3538 1 7 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.363 -1.763 18016
3539 1 7 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.056 -0.756 18016
3540 1 7 . 1 1 16 16 TRP H H 16 7.820 7.820 8.211 -0.391 18016
3541 1 7 . 1 1 17 17 LEU N N 17 120.400 120.400 118.827 1.573 18016
3542 1 7 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.293 0.317 18016
3543 1 7 . 1 1 17 17 LEU C C 17 179.000 179.000 178.755 0.245 18016
3544 1 7 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.649 0.251 18016
3545 1 7 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.630 0.370 18016
3546 1 7 . 1 1 17 17 LEU H H 17 8.630 8.630 8.325 0.305 18016
3547 1 7 . 1 1 18 18 ASN N N 18 116.200 116.200 116.832 -0.632 18016
3548 1 7 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.512 -0.202 18016
3549 1 7 . 1 1 18 18 ASN C C 18 177.100 177.100 176.893 0.207 18016
3550 1 7 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.852 -0.252 18016
3551 1 7 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.959 0.241 18016
3552 1 7 . 1 1 18 18 ASN H H 18 8.350 8.350 8.452 -0.102 18016
3553 1 7 . 1 1 19 19 ALA N N 19 119.600 119.600 120.002 -0.402 18016
3554 1 7 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.175 -0.085 18016
3555 1 7 . 1 1 19 19 ALA C C 19 180.100 180.100 178.970 1.130 18016
3556 1 7 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.238 -0.038 18016
3557 1 7 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.598 -0.998 18016
3558 1 7 . 1 1 19 19 ALA H H 19 7.920 7.920 8.200 -0.280 18016
3559 1 7 . 1 1 20 20 GLY N N 20 103.500 103.500 104.858 -1.358 18016
3560 1 7 . 1 1 20 20 GLY C C 20 173.800 173.800 173.767 0.033 18016
3561 1 7 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.220 0.580 18016
3562 1 7 . 1 1 20 20 GLY H H 20 7.700 7.700 7.551 0.149 18016
3563 1 7 . 1 1 21 21 TYR N N 21 119.900 119.900 118.152 1.748 18016
3564 1 7 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.942 0.228 18016
3565 1 7 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.929 1.471 18016
3566 1 7 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.327 -0.527 18016
3567 1 7 . 1 1 21 21 TYR H H 21 7.980 7.980 7.855 0.125 18016
3568 1 7 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.413 0.087 18016
3569 1 7 . 1 1 22 22 PRO C C 22 178.700 178.700 177.250 1.450 18016
3570 1 7 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.560 0.440 18016
3571 1 7 . 1 1 22 22 PRO CB C 22 32.000 32.000 31.975 0.025 18016
3572 1 7 . 1 1 23 23 GLU N N 23 116.300 116.300 118.706 -2.406 18016
3573 1 7 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.313 0.257 18016
3574 1 7 . 1 1 23 23 GLU C C 23 176.300 176.300 176.491 -0.191 18016
3575 1 7 . 1 1 23 23 GLU CA C 23 54.600 54.600 56.345 -1.745 18016
3576 1 7 . 1 1 23 23 GLU CB C 23 29.500 29.500 30.194 -0.694 18016
3577 1 7 . 1 1 23 23 GLU H H 23 8.680 8.680 8.476 0.204 18016
3578 1 7 . 1 1 24 24 GLY N N 24 108.100 108.100 107.217 0.883 18016
3579 1 7 . 1 1 24 24 GLY C C 24 173.100 173.100 172.564 0.536 18016
3580 1 7 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.504 -1.604 18016
3581 1 7 . 1 1 24 24 GLY H H 24 7.230 7.230 7.918 -0.688 18016
3582 1 7 . 1 1 25 25 VAL N N 25 121.500 121.500 119.693 1.807 18016
3583 1 7 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.938 -0.348 18016
3584 1 7 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.374 0.926 18016
3585 1 7 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.611 -0.512 18016
3586 1 7 . 1 1 25 25 VAL H H 25 8.050 8.050 7.862 0.188 18016
3587 1 7 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.484 -0.164 18016
3588 1 7 . 1 1 26 26 PRO C C 26 177.600 177.600 178.137 -0.537 18016
3589 1 7 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.547 0.353 18016
3590 1 7 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.092 0.008 18016
3591 1 7 . 1 1 27 27 GLY N N 27 109.000 109.000 109.260 -0.260 18016
3592 1 7 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.800 1.300 18016
3593 1 7 . 1 1 27 27 GLY H H 27 8.930 8.930 8.819 0.111 18016
3594 1 7 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.281 0.109 18016
3595 1 7 . 1 1 28 28 PRO C C 28 175.800 175.800 176.272 -0.472 18016
3596 1 7 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.368 0.032 18016
3597 1 7 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.506 0.394 18016
3598 1 7 . 1 1 29 29 ASP N N 29 115.000 115.000 115.876 -0.876 18016
3599 1 7 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.778 -0.288 18016
3600 1 7 . 1 1 29 29 ASP C C 29 177.000 177.000 177.768 -0.768 18016
3601 1 7 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.733 -1.833 18016
3602 1 7 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.604 -0.904 18016
3603 1 7 . 1 1 29 29 ASP H H 29 7.760 7.760 7.822 -0.062 18016
3604 1 7 . 1 1 30 30 ARG N N 30 119.900 119.900 121.668 -1.768 18016
3605 1 7 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.843 -0.273 18016
3606 1 7 . 1 1 30 30 ARG C C 30 176.500 176.500 178.379 -1.879 18016
3607 1 7 . 1 1 30 30 ARG CA C 30 61.900 61.900 60.114 1.786 18016
3608 1 7 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.343 0.157 18016
3609 1 7 . 1 1 30 30 ARG H H 30 7.460 7.460 8.115 -0.655 18016
3610 1 7 . 1 1 31 31 VAL N N 31 117.600 117.600 119.824 -2.224 18016
3611 1 7 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.866 -0.046 18016
3612 1 7 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.485 0.215 18016
3613 1 7 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.441 -0.641 18016
3614 1 7 . 1 1 31 31 VAL H H 31 9.080 9.080 8.210 0.870 18016
3615 1 7 . 1 1 32 32 PRO C C 32 177.000 177.000 178.707 -1.707 18016
3616 1 7 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.921 -0.721 18016
3617 1 7 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.160 -0.360 18016
3618 1 7 . 1 1 33 33 LEU N N 33 115.200 115.200 120.922 -5.722 18016
3619 1 7 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.113 0.007 18016
3620 1 7 . 1 1 33 33 LEU C C 33 178.600 178.600 178.596 0.004 18016
3621 1 7 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.083 0.317 18016
3622 1 7 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.353 0.147 18016
3623 1 7 . 1 1 33 33 LEU H H 33 8.010 8.010 8.129 -0.119 18016
3624 1 7 . 1 1 34 34 LEU N N 34 120.400 120.400 119.006 1.394 18016
3625 1 7 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.084 -0.154 18016
3626 1 7 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.468 0.632 18016
3627 1 7 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.268 0.632 18016
3628 1 7 . 1 1 34 34 LEU H H 34 8.220 8.220 8.332 -0.112 18016
3629 1 7 . 1 1 35 35 ALA N N 35 123.100 123.100 122.605 0.495 18016
3630 1 7 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.024 0.016 18016
3631 1 7 . 1 1 35 35 ALA C C 35 179.500 179.500 179.612 -0.112 18016
3632 1 7 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.236 0.264 18016
3633 1 7 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.346 -0.446 18016
3634 1 7 . 1 1 35 35 ALA H H 35 8.560 8.560 8.001 0.559 18016
3635 1 7 . 1 1 36 36 LEU N N 36 117.600 117.600 118.820 -1.220 18016
3636 1 7 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.259 -0.139 18016
3637 1 7 . 1 1 36 36 LEU C C 36 180.100 180.100 179.167 0.933 18016
3638 1 7 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.394 0.806 18016
3639 1 7 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.690 1.110 18016
3640 1 7 . 1 1 36 36 LEU H H 36 7.850 7.850 8.043 -0.193 18016
3641 1 7 . 1 1 37 37 LEU N N 37 116.700 116.700 120.475 -3.775 18016
3642 1 7 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.033 0.067 18016
3643 1 7 . 1 1 37 37 LEU C C 37 180.100 180.100 178.290 1.810 18016
3644 1 7 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.240 0.059 18016
3645 1 7 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.348 -0.148 18016
3646 1 7 . 1 1 37 37 LEU H H 37 8.730 8.730 8.347 0.383 18016
3647 1 7 . 1 1 38 38 THR N N 38 110.600 110.600 108.111 2.489 18016
3648 1 7 . 1 1 38 38 THR HA H 38 4.440 4.440 4.074 0.366 18016
3649 1 7 . 1 1 38 38 THR C C 38 175.100 175.100 175.783 -0.683 18016
3650 1 7 . 1 1 38 38 THR CA C 38 64.200 64.200 64.058 0.142 18016
3651 1 7 . 1 1 38 38 THR CB C 38 70.000 70.000 68.775 1.225 18016
3652 1 7 . 1 1 38 38 THR H H 38 8.660 8.660 8.273 0.387 18016
3653 1 7 . 1 1 39 39 ARG N N 39 118.000 118.000 120.620 -2.620 18016
3654 1 7 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.096 0.184 18016
3655 1 7 . 1 1 39 39 ARG C C 39 177.300 177.300 177.703 -0.403 18016
3656 1 7 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.586 -0.286 18016
3657 1 7 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.219 -0.019 18016
3658 1 7 . 1 1 39 39 ARG H H 39 7.180 7.180 7.540 -0.360 18016
3659 1 7 . 1 1 40 40 ARG N N 40 114.400 114.400 116.252 -1.852 18016
3660 1 7 . 1 1 40 40 ARG C C 40 174.800 174.800 176.876 -2.076 18016
3661 1 7 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.377 -1.077 18016
3662 1 7 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.564 3.036 18016
3663 1 7 . 1 1 40 40 ARG H H 40 7.520 7.520 7.576 -0.056 18016
3664 1 7 . 1 1 41 41 LEU N N 41 119.400 119.400 121.357 -1.957 18016
3665 1 7 . 1 1 41 41 LEU C C 41 177.100 177.100 177.804 -0.704 18016
3666 1 7 . 1 1 41 41 LEU CA C 41 53.700 53.700 55.794 -2.094 18016
3667 1 7 . 1 1 41 41 LEU CB C 41 44.400 44.400 42.164 2.236 18016
3668 1 7 . 1 1 41 41 LEU H H 41 8.380 8.380 7.535 0.845 18016
3669 1 7 . 1 1 42 42 THR N N 42 112.000 112.000 116.045 -4.045 18016
3670 1 7 . 1 1 42 42 THR HA H 42 4.440 4.440 4.320 0.120 18016
3671 1 7 . 1 1 42 42 THR C C 42 175.800 175.800 175.558 0.242 18016
3672 1 7 . 1 1 42 42 THR CA C 42 60.500 60.500 61.243 -0.743 18016
3673 1 7 . 1 1 42 42 THR CB C 42 70.800 70.800 70.195 0.605 18016
3674 1 7 . 1 1 42 42 THR H H 42 9.330 9.330 8.930 0.400 18016
3675 1 7 . 1 1 43 43 ASN N N 43 119.900 119.900 120.404 -0.504 18016
3676 1 7 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.339 -0.089 18016
3677 1 7 . 1 1 43 43 ASN C C 43 177.900 177.900 177.335 0.565 18016
3678 1 7 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.997 -0.297 18016
3679 1 7 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.260 -1.060 18016
3680 1 7 . 1 1 43 43 ASN H H 43 9.140 9.140 8.792 0.348 18016
3681 1 7 . 1 1 44 44 ASP N N 44 118.000 118.000 119.602 -1.602 18016
3682 1 7 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.389 0.011 18016
3683 1 7 . 1 1 44 44 ASP C C 44 179.600 179.600 178.179 1.421 18016
3684 1 7 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.723 -0.423 18016
3685 1 7 . 1 1 44 44 ASP H H 44 8.360 8.360 8.662 -0.302 18016
3686 1 7 . 1 1 45 45 GLU N N 45 122.600 122.600 120.258 2.342 18016
3687 1 7 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.067 -0.097 18016
3688 1 7 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.106 0.294 18016
3689 1 7 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.823 0.477 18016
3690 1 7 . 1 1 45 45 GLU H H 45 7.850 7.850 7.637 0.213 18016
3691 1 7 . 1 1 46 46 ILE N N 46 118.900 118.900 120.773 -1.873 18016
3692 1 7 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.764 -0.334 18016
3693 1 7 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.242 1.758 18016
3694 1 7 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.755 -0.055 18016
3695 1 7 . 1 1 46 46 ILE H H 46 8.290 8.290 8.300 -0.010 18016
3696 1 7 . 1 1 47 47 LYS N N 47 118.900 118.900 119.299 -0.399 18016
3697 1 7 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.927 -0.057 18016
3698 1 7 . 1 1 47 47 LYS C C 47 178.400 178.400 178.805 -0.405 18016
3699 1 7 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.827 0.473 18016
3700 1 7 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.177 0.423 18016
3701 1 7 . 1 1 47 47 LYS H H 47 8.290 8.290 8.178 0.112 18016
3702 1 7 . 1 1 48 48 ALA N N 48 121.100 121.100 122.634 -1.534 18016
3703 1 7 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.008 0.162 18016
3704 1 7 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.167 -0.067 18016
3705 1 7 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.132 -0.132 18016
3706 1 7 . 1 1 48 48 ALA H H 48 7.710 7.710 8.032 -0.322 18016
3707 1 7 . 1 1 49 49 ILE N N 49 119.900 119.900 117.755 2.145 18016
3708 1 7 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.764 -0.114 18016
3709 1 7 . 1 1 49 49 ILE C C 49 177.300 177.300 177.979 -0.679 18016
3710 1 7 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.370 1.630 18016
3711 1 7 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.368 1.732 18016
3712 1 7 . 1 1 49 49 ILE H H 49 8.130 8.130 8.240 -0.110 18016
3713 1 7 . 1 1 50 50 ALA N N 50 122.000 122.000 122.880 -0.880 18016
3714 1 7 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.019 -0.159 18016
3715 1 7 . 1 1 50 50 ALA C C 50 179.800 179.800 179.864 -0.064 18016
3716 1 7 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.461 0.239 18016
3717 1 7 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.086 -0.186 18016
3718 1 7 . 1 1 50 50 ALA H H 50 8.730 8.730 7.713 1.017 18016
3719 1 7 . 1 1 51 51 GLU N N 51 116.900 116.900 118.059 -1.159 18016
3720 1 7 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.936 0.084 18016
3721 1 7 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.390 0.010 18016
3722 1 7 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.245 0.255 18016
3723 1 7 . 1 1 51 51 GLU H H 51 8.220 8.220 8.540 -0.320 18016
3724 1 7 . 1 1 52 52 ASP N N 52 120.300 120.300 120.494 -0.194 18016
3725 1 7 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.487 -0.097 18016
3726 1 7 . 1 1 52 52 ASP C C 52 178.900 178.900 179.172 -0.272 18016
3727 1 7 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.115 0.384 18016
3728 1 7 . 1 1 52 52 ASP CB C 52 42.500 42.500 40.881 1.619 18016
3729 1 7 . 1 1 52 52 ASP H H 52 7.700 7.700 8.008 -0.308 18016
3730 1 7 . 1 1 53 53 LEU N N 53 118.300 118.300 120.415 -2.115 18016
3731 1 7 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.976 -0.246 18016
3732 1 7 . 1 1 53 53 LEU C C 53 179.000 179.000 178.765 0.235 18016
3733 1 7 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.814 -0.314 18016
3734 1 7 . 1 1 53 53 LEU CB C 53 41.100 41.100 42.013 -0.913 18016
3735 1 7 . 1 1 53 53 LEU H H 53 8.290 8.290 8.268 0.022 18016
3736 1 7 . 1 1 54 54 GLU N N 54 118.700 118.700 117.415 1.285 18016
3737 1 7 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.068 0.152 18016
3738 1 7 . 1 1 54 54 GLU C C 54 178.200 178.200 178.132 0.068 18016
3739 1 7 . 1 1 54 54 GLU CA C 54 58.700 58.700 59.114 -0.414 18016
3740 1 7 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.875 1.025 18016
3741 1 7 . 1 1 54 54 GLU H H 54 8.070 8.070 8.711 -0.641 18016
3742 1 7 . 1 1 55 55 LYS N N 55 117.700 117.700 117.612 0.088 18016
3743 1 7 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.179 -0.029 18016
3744 1 7 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.187 0.113 18016
3745 1 7 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.498 0.202 18016
3746 1 7 . 1 1 55 55 LYS H H 55 7.750 7.750 7.475 0.275 18016
3747 1 7 . 1 1 56 56 ARG N N 56 117.100 117.100 117.069 0.031 18016
3748 1 7 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.230 0.040 18016
3749 1 7 . 1 1 56 56 ARG CA C 56 56.800 56.800 56.677 0.123 18016
3750 1 7 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.169 -0.169 18016
3751 1 7 . 1 1 56 56 ARG H H 56 8.270 8.270 7.738 0.532 18016
3752 1 7 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.136 0.224 18016
3753 1 7 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.045 0.054 18016
3754 1 7 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.292 -1.092 18016
3755 1 7 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.360 0.150 18016
3756 1 7 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.793 0.407 18016
3757 1 7 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.482 -2.182 18016
3758 1 7 . 1 1 59 59 PHE N N 59 120.400 120.400 116.794 3.606 18016
3759 1 7 . 1 1 59 59 PHE C C 59 175.500 175.500 174.480 1.020 18016
3760 1 7 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.795 -0.595 18016
3761 1 7 . 1 1 59 59 PHE CB C 59 39.300 39.300 36.276 3.024 18016
3762 1 7 . 1 1 59 59 PHE H H 59 7.710 7.710 8.400 -0.690 18016
3763 1 7 . 1 1 60 60 ASP N N 60 120.800 120.800 118.067 2.733 18016
3764 1 7 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.510 -0.020 18016
3765 1 7 . 1 1 60 60 ASP CA C 60 54.300 54.300 54.626 -0.326 18016
3766 1 7 . 1 1 60 60 ASP CB C 60 41.100 41.100 41.363 -0.263 18016
3767 1 7 . 1 1 60 60 ASP H H 60 8.180 8.180 8.039 0.141 18016
3768 1 7 . 1 1 61 61 HIS N N 61 118.300 118.300 119.012 -0.712 18016
3769 1 7 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.596 -0.206 18016
3770 1 7 . 1 1 61 61 HIS CA C 61 56.700 56.700 56.597 0.103 18016
3771 1 7 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.421 -0.621 18016
3772 1 7 . 1 1 61 61 HIS H H 61 8.550 8.550 8.519 0.031 18016
3773 1 7 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.279 -0.269 18016
3774 1 7 . 1 1 62 62 ILE C C 62 173.800 173.800 175.505 -1.705 18016
3775 1 7 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.179 6.321 18016
3776 1 7 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.830 2.270 18016
3777 1 7 . 1 1 63 63 ASP N N 63 125.100 125.100 121.321 3.779 18016
3778 1 7 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.335 0.265 18016
3779 1 7 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.274 -2.474 18016
3780 1 7 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.047 -1.548 18016
3781 1 7 . 1 1 63 63 ASP H H 63 8.360 8.360 7.683 0.677 18016
3782 1 7 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.945 -0.275 18016
3783 1 7 . 1 1 64 64 ILE C C 64 177.000 177.000 176.918 0.082 18016
3784 1 7 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.123 -1.023 18016
3785 1 7 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.374 -1.774 18016
3786 1 7 . 1 1 65 65 GLY N N 65 107.600 107.600 107.734 -0.134 18016
3787 1 7 . 1 1 65 65 GLY C C 65 177.000 177.000 175.763 1.237 18016
3788 1 7 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.847 0.453 18016
3789 1 7 . 1 1 65 65 GLY H H 65 8.440 8.440 7.793 0.647 18016
3790 1 7 . 1 1 66 66 VAL N N 66 121.800 121.800 122.035 -0.235 18016
3791 1 7 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.716 0.044 18016
3792 1 7 . 1 1 66 66 VAL C C 66 178.500 178.500 177.206 1.294 18016
3793 1 7 . 1 1 66 66 VAL CA C 66 65.600 65.600 64.776 0.824 18016
3794 1 7 . 1 1 66 66 VAL CB C 66 32.000 32.000 32.076 -0.076 18016
3795 1 7 . 1 1 66 66 VAL H H 66 7.550 7.550 8.291 -0.741 18016
3796 1 7 . 1 1 67 67 LEU N N 67 120.900 120.900 119.278 1.622 18016
3797 1 7 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.014 0.056 18016
3798 1 7 . 1 1 67 67 LEU C C 67 179.000 179.000 179.224 -0.224 18016
3799 1 7 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.798 -0.199 18016
3800 1 7 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.562 1.738 18016
3801 1 7 . 1 1 67 67 LEU H H 67 7.650 7.650 7.484 0.166 18016
3802 1 7 . 1 1 68 68 ILE N N 68 118.900 118.900 117.734 1.166 18016
3803 1 7 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.769 -0.059 18016
3804 1 7 . 1 1 68 68 ILE C C 68 179.500 179.500 178.429 1.071 18016
3805 1 7 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.974 0.226 18016
3806 1 7 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.438 0.062 18016
3807 1 7 . 1 1 68 68 ILE H H 68 8.580 8.580 7.682 0.898 18016
3808 1 7 . 1 1 69 69 THR N N 69 118.100 118.100 114.703 3.397 18016
3809 1 7 . 1 1 69 69 THR HA H 69 3.940 3.940 4.025 -0.085 18016
3810 1 7 . 1 1 69 69 THR C C 69 176.200 176.200 176.185 0.015 18016
3811 1 7 . 1 1 69 69 THR CA C 69 66.600 66.600 65.901 0.699 18016
3812 1 7 . 1 1 69 69 THR CB C 69 68.500 68.500 68.465 0.035 18016
3813 1 7 . 1 1 69 69 THR H H 69 7.840 7.840 7.698 0.142 18016
3814 1 7 . 1 1 70 70 GLN N N 70 121.600 121.600 120.148 1.452 18016
3815 1 7 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.158 -0.048 18016
3816 1 7 . 1 1 70 70 GLN C C 70 178.100 178.100 178.045 0.055 18016
3817 1 7 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.546 0.554 18016
3818 1 7 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.826 -0.527 18016
3819 1 7 . 1 1 70 70 GLN H H 70 8.100 8.100 7.368 0.732 18016
3820 1 7 . 1 1 71 71 MET N N 71 118.700 118.700 118.437 0.263 18016
3821 1 7 . 1 1 71 71 MET HA H 71 4.010 4.010 4.313 -0.303 18016
3822 1 7 . 1 1 71 71 MET C C 71 176.300 176.300 178.190 -1.890 18016
3823 1 7 . 1 1 71 71 MET CA C 71 58.100 58.100 59.190 -1.090 18016
3824 1 7 . 1 1 71 71 MET CB C 71 33.600 33.600 32.812 0.788 18016
3825 1 7 . 1 1 71 71 MET H H 71 8.350 8.350 8.653 -0.303 18016
3826 1 7 . 1 1 72 72 THR N N 72 111.600 111.600 110.924 0.676 18016
3827 1 7 . 1 1 72 72 THR HA H 72 3.940 3.940 4.142 -0.202 18016
3828 1 7 . 1 1 72 72 THR C C 72 175.800 175.800 175.492 0.308 18016
3829 1 7 . 1 1 72 72 THR CA C 72 65.300 65.300 64.846 0.454 18016
3830 1 7 . 1 1 72 72 THR CB C 72 69.100 69.100 69.289 -0.189 18016
3831 1 7 . 1 1 72 72 THR H H 72 7.840 7.840 7.836 0.004 18016
3832 1 7 . 1 1 73 73 ASP N N 73 121.100 121.100 120.197 0.903 18016
3833 1 7 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.682 -0.152 18016
3834 1 7 . 1 1 73 73 ASP C C 73 176.600 176.600 175.706 0.894 18016
3835 1 7 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.291 0.909 18016
3836 1 7 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.700 -1.300 18016
3837 1 7 . 1 1 73 73 ASP H H 73 7.840 7.840 7.607 0.233 18016
3838 1 7 . 1 1 74 74 GLU N N 74 121.100 121.100 119.277 1.823 18016
3839 1 7 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.597 -0.257 18016
3840 1 7 . 1 1 74 74 GLU C C 74 173.800 173.800 175.397 -1.597 18016
3841 1 7 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.606 -0.106 18016
3842 1 7 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.167 -0.567 18016
3843 1 7 . 1 1 74 74 GLU H H 74 7.980 7.980 8.450 -0.470 18016
3844 1 7 . 1 1 75 75 MET N N 75 125.800 125.800 125.861 -0.061 18016
3845 1 7 . 1 1 75 75 MET HA H 75 4.710 4.710 4.788 -0.078 18016
3846 1 7 . 1 1 75 75 MET CA C 75 53.800 53.800 54.715 -0.916 18016
3847 1 7 . 1 1 75 75 MET CB C 75 31.700 31.700 31.618 0.082 18016
3848 1 7 . 1 1 75 75 MET H H 75 8.380 8.380 8.521 -0.141 18016
3849 1 7 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.442 0.068 18016
3850 1 7 . 1 1 76 76 PRO C C 76 175.700 175.700 176.218 -0.518 18016
3851 1 7 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.226 -1.226 18016
3852 1 7 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.308 -0.508 18016
3853 1 7 . 1 1 77 77 ARG N N 77 119.700 119.700 118.940 0.760 18016
3854 1 7 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.644 -0.374 18016
3855 1 7 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.161 0.639 18016
3856 1 7 . 1 1 77 77 ARG CB C 77 30.700 30.700 33.627 -2.927 18016
3857 1 7 . 1 1 77 77 ARG H H 77 8.940 8.940 8.231 0.709 18016
3858 1 7 . 1 1 78 78 GLU N N 78 124.700 124.700 124.419 0.281 18016
3859 1 7 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.980 -0.020 18016
3860 1 7 . 1 1 78 78 GLU C C 78 179.000 179.000 178.050 0.950 18016
3861 1 7 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.093 -0.293 18016
3862 1 7 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.564 -0.564 18016
3863 1 7 . 1 1 78 78 GLU H H 78 9.170 9.170 9.155 0.015 18016
3864 1 7 . 1 1 79 79 GLU N N 79 116.800 116.800 119.085 -2.285 18016
3865 1 7 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.092 0.028 18016
3866 1 7 . 1 1 79 79 GLU C C 79 179.100 179.100 178.552 0.548 18016
3867 1 7 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.468 0.232 18016
3868 1 7 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.021 -0.021 18016
3869 1 7 . 1 1 79 79 GLU H H 79 9.660 9.660 8.816 0.844 18016
3870 1 7 . 1 1 80 80 ASP N N 80 120.000 120.000 119.757 0.243 18016
3871 1 7 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.518 0.172 18016
3872 1 7 . 1 1 80 80 ASP C C 80 177.300 177.300 178.456 -1.156 18016
3873 1 7 . 1 1 80 80 ASP CA C 80 57.400 57.400 56.532 0.868 18016
3874 1 7 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.175 1.425 18016
3875 1 7 . 1 1 80 80 ASP H H 80 7.310 7.310 8.284 -0.974 18016
3876 1 7 . 1 1 81 81 ILE N N 81 120.100 120.100 120.322 -0.222 18016
3877 1 7 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.710 -0.220 18016
3878 1 7 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.787 0.513 18016
3879 1 7 . 1 1 81 81 ILE CB C 81 38.300 38.300 38.011 0.289 18016
3880 1 7 . 1 1 81 81 ILE H H 81 7.610 7.610 8.125 -0.515 18016
3881 1 7 . 1 1 82 82 GLU N N 82 118.100 118.100 119.673 -1.573 18016
3882 1 7 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.075 0.205 18016
3883 1 7 . 1 1 82 82 GLU C C 82 177.800 177.800 178.947 -1.147 18016
3884 1 7 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.638 -1.638 18016
3885 1 7 . 1 1 82 82 GLU CB C 82 28.800 28.800 28.764 0.036 18016
3886 1 7 . 1 1 82 82 GLU H H 82 8.550 8.550 8.711 -0.161 18016
3887 1 7 . 1 1 83 83 ARG N N 83 119.900 119.900 119.992 -0.092 18016
3888 1 7 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.089 -0.059 18016
3889 1 7 . 1 1 83 83 ARG C C 83 179.400 179.400 179.267 0.133 18016
3890 1 7 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.128 0.772 18016
3891 1 7 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.217 -0.617 18016
3892 1 7 . 1 1 83 83 ARG H H 83 7.590 7.590 7.720 -0.130 18016
3893 1 7 . 1 1 84 84 VAL N N 84 120.400 120.400 119.959 0.441 18016
3894 1 7 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.891 -0.141 18016
3895 1 7 . 1 1 84 84 VAL C C 84 177.400 177.400 177.307 0.093 18016
3896 1 7 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.668 1.232 18016
3897 1 7 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.163 -0.263 18016
3898 1 7 . 1 1 84 84 VAL H H 84 7.550 7.550 8.348 -0.798 18016
3899 1 7 . 1 1 85 85 ARG N N 85 121.600 121.600 119.785 1.815 18016
3900 1 7 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.265 -0.255 18016
3901 1 7 . 1 1 85 85 ARG C C 85 178.100 178.100 178.702 -0.602 18016
3902 1 7 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.858 1.042 18016
3903 1 7 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.929 0.271 18016
3904 1 7 . 1 1 85 85 ARG H H 85 9.090 9.090 8.462 0.628 18016
3905 1 7 . 1 1 86 86 ARG N N 86 115.600 115.600 118.845 -3.245 18016
3906 1 7 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.082 -0.202 18016
3907 1 7 . 1 1 86 86 ARG C C 86 179.000 179.000 178.701 0.299 18016
3908 1 7 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.160 0.240 18016
3909 1 7 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.551 0.849 18016
3910 1 7 . 1 1 86 86 ARG H H 86 8.660 8.660 8.571 0.089 18016
3911 1 7 . 1 1 87 87 HIS N N 87 118.000 118.000 119.523 -1.523 18016
3912 1 7 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.382 -0.022 18016
3913 1 7 . 1 1 87 87 HIS C C 87 178.400 178.400 177.467 0.933 18016
3914 1 7 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.307 0.293 18016
3915 1 7 . 1 1 87 87 HIS CB C 87 30.700 30.700 29.933 0.767 18016
3916 1 7 . 1 1 87 87 HIS H H 87 7.640 7.640 7.699 -0.059 18016
3917 1 7 . 1 1 88 88 LEU N N 88 119.600 119.600 119.338 0.262 18016
3918 1 7 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.110 -0.530 18016
3919 1 7 . 1 1 88 88 LEU C C 88 180.000 180.000 178.941 1.059 18016
3920 1 7 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.027 0.173 18016
3921 1 7 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.085 1.515 18016
3922 1 7 . 1 1 88 88 LEU H H 88 8.650 8.650 8.384 0.266 18016
3923 1 7 . 1 1 89 89 ALA N N 89 118.500 118.500 122.617 -4.117 18016
3924 1 7 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.652 0.708 18016
3925 1 7 . 1 1 89 89 ALA C C 89 180.400 180.400 179.920 0.480 18016
3926 1 7 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.808 -1.208 18016
3927 1 7 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.441 -0.341 18016
3928 1 7 . 1 1 89 89 ALA H H 89 8.870 8.870 8.321 0.549 18016
3929 1 7 . 1 1 90 90 LEU N N 90 119.400 119.400 117.522 1.878 18016
3930 1 7 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.982 0.228 18016
3931 1 7 . 1 1 90 90 LEU C C 90 179.100 179.100 179.094 0.006 18016
3932 1 7 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.051 0.449 18016
3933 1 7 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.530 0.170 18016
3934 1 7 . 1 1 90 90 LEU H H 90 7.390 7.390 7.678 -0.288 18016
3935 1 7 . 1 1 91 91 GLN N N 91 114.500 114.500 116.171 -1.671 18016
3936 1 7 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.357 0.343 18016
3937 1 7 . 1 1 91 91 GLN C C 91 175.800 175.800 176.762 -0.962 18016
3938 1 7 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.074 -1.574 18016
3939 1 7 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.959 -1.859 18016
3940 1 7 . 1 1 91 91 GLN H H 91 7.810 7.810 7.822 -0.012 18016
3941 1 7 . 1 1 92 92 GLY N N 92 107.900 107.900 105.606 2.294 18016
3942 1 7 . 1 1 92 92 GLY C C 92 172.100 172.100 171.523 0.577 18016
3943 1 7 . 1 1 92 92 GLY CA C 92 44.000 44.000 44.919 -0.919 18016
3944 1 7 . 1 1 92 92 GLY H H 92 7.710 7.710 8.208 -0.498 18016
3945 1 7 . 1 1 93 93 TRP N N 93 114.200 114.200 122.003 -7.803 18016
3946 1 7 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.490 1.510 18016
3947 1 7 . 1 1 93 93 TRP CB C 93 29.200 29.200 31.281 -2.081 18016
3948 1 7 . 1 1 93 93 TRP H H 93 8.450 8.450 8.298 0.152 18016
3949 1 7 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.238 0.222 18016
3950 1 7 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.568 -0.768 18016
3951 1 7 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.183 0.417 18016
3952 1 7 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.023 -0.523 18016
3953 1 7 . 1 1 95 95 LEU C C 95 175.000 175.000 178.236 -3.236 18016
3954 1 7 . 1 1 95 95 LEU CA C 95 56.100 56.100 57.248 -1.148 18016
3955 1 7 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.963 1.137 18016
3956 1 7 . 1 1 96 96 ASP N N 96 114.000 114.000 117.690 -3.690 18016
3957 1 7 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.777 0.173 18016
3958 1 7 . 1 1 96 96 ASP C C 96 175.800 175.800 175.960 -0.160 18016
3959 1 7 . 1 1 96 96 ASP CA C 96 54.000 54.000 54.268 -0.268 18016
3960 1 7 . 1 1 96 96 ASP CB C 96 41.900 41.900 42.294 -0.394 18016
3961 1 7 . 1 1 96 96 ASP H H 96 7.230 7.230 7.627 -0.397 18016
3962 1 7 . 1 1 97 97 ASP N N 97 123.200 123.200 121.614 1.586 18016
3963 1 7 . 1 1 97 97 ASP HA H 97 4.610 4.610 5.065 -0.455 18016
3964 1 7 . 1 1 97 97 ASP CA C 97 53.500 53.500 52.304 1.196 18016
3965 1 7 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.669 -3.969 18016
3966 1 7 . 1 1 97 97 ASP H H 97 7.420 7.420 7.668 -0.248 18016
3967 1 7 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.859 -0.569 18016
3968 1 7 . 1 1 98 98 PRO C C 98 177.500 177.500 177.281 0.219 18016
3969 1 7 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.390 0.310 18016
3970 1 7 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.793 -0.893 18016
3971 1 7 . 1 1 99 99 ARG N N 99 121.300 121.300 120.807 0.493 18016
3972 1 7 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.119 -0.409 18016
3973 1 7 . 1 1 99 99 ARG C C 99 176.500 176.500 176.060 0.440 18016
3974 1 7 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.870 -1.770 18016
3975 1 7 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.126 0.374 18016
3976 1 7 . 1 1 99 99 ARG H H 99 8.390 8.390 8.216 0.174 18016
3977 1 7 . 1 1 100 100 ASP N N 100 119.600 119.600 119.468 0.132 18016
3978 1 7 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.676 -0.176 18016
3979 1 7 . 1 1 100 100 ASP C C 100 177.000 177.000 175.280 1.720 18016
3980 1 7 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.420 1.280 18016
3981 1 7 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.201 -1.301 18016
3982 1 7 . 1 1 100 100 ASP H H 100 8.260 8.260 7.742 0.518 18016
3983 1 7 . 1 1 101 101 GLY N N 101 109.300 109.300 109.174 0.126 18016
3984 1 7 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.934 0.466 18016
3985 1 7 . 1 1 101 101 GLY H H 101 8.450 8.450 8.208 0.242 18016
3986 1 7 . 1 1 102 102 GLU N N 102 119.800 119.800 123.853 -4.053 18016
3987 1 7 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.141 0.169 18016
3988 1 7 . 1 1 102 102 GLU CA C 102 56.000 56.000 57.348 -1.348 18016
3989 1 7 . 1 1 102 102 GLU CB C 102 30.500 30.500 28.785 1.715 18016
3990 1 7 . 1 1 102 102 GLU H H 102 8.140 8.140 8.600 -0.460 18016
3991 1 7 . 1 1 103 103 GLU N N 103 123.000 123.000 124.369 -1.369 18016
3992 1 7 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.458 0.102 18016
3993 1 7 . 1 1 103 103 GLU CA C 103 54.300 54.300 56.929 -2.629 18016
3994 1 7 . 1 1 103 103 GLU CB C 103 29.600 29.600 28.994 0.606 18016
3995 1 7 . 1 1 103 103 GLU H H 103 8.580 8.580 8.467 0.113 18016
3996 1 7 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.498 -0.018 18016
3997 1 7 . 1 1 104 104 PRO C C 104 176.800 176.800 176.348 0.452 18016
3998 1 7 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.155 0.245 18016
3999 1 7 . 1 1 104 104 PRO CB C 104 32.100 32.100 31.723 0.377 18016
4000 1 7 . 1 1 105 105 ASP N N 105 120.400 120.400 121.877 -1.477 18016
4001 1 7 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.615 -0.035 18016
4002 1 7 . 1 1 105 105 ASP C C 105 177.100 177.100 176.262 0.838 18016
4003 1 7 . 1 1 105 105 ASP CA C 105 54.300 54.300 55.003 -0.703 18016
4004 1 7 . 1 1 105 105 ASP CB C 105 41.400 41.400 38.889 2.511 18016
4005 1 7 . 1 1 105 105 ASP H H 105 8.500 8.500 8.202 0.298 18016
4006 1 7 . 1 1 106 106 GLY N N 106 109.300 109.300 108.776 0.524 18016
4007 1 7 . 1 1 106 106 GLY C C 106 174.600 174.600 173.860 0.740 18016
4008 1 7 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.488 -0.088 18016
4009 1 7 . 1 1 106 106 GLY H H 106 8.360 8.360 7.983 0.377 18016
4010 1 7 . 1 1 107 107 GLU N N 107 120.400 120.400 121.317 -0.917 18016
4011 1 7 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.224 0.116 18016
4012 1 7 . 1 1 107 107 GLU C C 107 177.100 177.100 176.160 0.940 18016
4013 1 7 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.425 0.075 18016
4014 1 7 . 1 1 107 107 GLU CB C 107 30.200 30.200 29.814 0.386 18016
4015 1 7 . 1 1 107 107 GLU H H 107 8.410 8.410 8.281 0.129 18016
4016 1 7 . 1 1 108 108 SER N N 108 116.600 116.600 120.689 -4.089 18016
4017 1 7 . 1 1 108 108 SER HA H 108 4.450 4.450 4.643 -0.193 18016
4018 1 7 . 1 1 108 108 SER C C 108 175.300 175.300 174.098 1.202 18016
4019 1 7 . 1 1 108 108 SER CA C 108 58.700 58.700 57.976 0.724 18016
4020 1 7 . 1 1 108 108 SER CB C 108 63.800 63.800 63.274 0.526 18016
4021 1 7 . 1 1 108 108 SER H H 108 8.460 8.460 8.523 -0.063 18016
4022 1 7 . 1 1 109 109 GLY N N 109 110.800 110.800 112.960 -2.160 18016
4023 1 7 . 1 1 109 109 GLY C C 109 174.500 174.500 172.923 1.577 18016
4024 1 7 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.573 0.727 18016
4025 1 7 . 1 1 109 109 GLY H H 109 8.500 8.500 8.364 0.136 18016
4026 1 7 . 1 1 110 110 GLY N N 110 108.800 108.800 107.235 1.565 18016
4027 1 7 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.074 -0.674 18016
4028 1 7 . 1 1 110 110 GLY H H 110 8.140 8.140 8.238 -0.098 18016
4029 1 7 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.670 -0.060 18016
4030 1 7 . 1 1 111 111 PRO C C 111 176.000 176.000 176.603 -0.603 18016
4031 1 7 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.713 -0.113 18016
4032 1 7 . 1 1 111 111 PRO CB C 111 34.600 34.600 31.220 3.380 18016
4033 1 8 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.459 -0.029 18016
4034 1 8 . 1 1 2 2 PRO C C 2 177.600 177.600 176.138 1.462 18016
4035 1 8 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.539 0.761 18016
4036 1 8 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.537 -0.237 18016
4037 1 8 . 1 1 3 3 GLY N N 3 110.000 110.000 107.776 2.224 18016
4038 1 8 . 1 1 3 3 GLY C C 3 174.200 174.200 174.461 -0.261 18016
4039 1 8 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.602 -0.202 18016
4040 1 8 . 1 1 3 3 GLY H H 3 8.700 8.700 8.514 0.186 18016
4041 1 8 . 1 1 4 4 SER N N 4 115.400 115.400 119.165 -3.765 18016
4042 1 8 . 1 1 4 4 SER HA H 4 4.440 4.440 4.768 -0.328 18016
4043 1 8 . 1 1 4 4 SER C C 4 174.800 174.800 174.090 0.710 18016
4044 1 8 . 1 1 4 4 SER CA C 4 58.400 58.400 57.803 0.597 18016
4045 1 8 . 1 1 4 4 SER CB C 4 63.800 63.800 61.848 1.952 18016
4046 1 8 . 1 1 4 4 SER H H 4 8.210 8.210 8.362 -0.152 18016
4047 1 8 . 1 1 5 5 MET N N 5 122.200 122.200 120.969 1.231 18016
4048 1 8 . 1 1 5 5 MET HA H 5 4.510 4.510 5.272 -0.762 18016
4049 1 8 . 1 1 5 5 MET CA C 5 55.600 55.600 54.248 1.353 18016
4050 1 8 . 1 1 5 5 MET CB C 5 32.900 32.900 34.716 -1.816 18016
4051 1 8 . 1 1 5 5 MET H H 5 8.570 8.570 7.888 0.682 18016
4052 1 8 . 1 1 6 6 VAL N N 6 120.000 120.000 116.268 3.732 18016
4053 1 8 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.426 -0.376 18016
4054 1 8 . 1 1 6 6 VAL C C 6 175.700 175.700 174.905 0.795 18016
4055 1 8 . 1 1 6 6 VAL CA C 6 62.700 62.700 59.808 2.892 18016
4056 1 8 . 1 1 6 6 VAL CB C 6 32.500 32.500 33.203 -0.703 18016
4057 1 8 . 1 1 6 6 VAL H H 6 8.150 8.150 8.066 0.084 18016
4058 1 8 . 1 1 7 7 ASN N N 7 122.000 122.000 118.837 3.163 18016
4059 1 8 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.559 0.101 18016
4060 1 8 . 1 1 7 7 ASN C C 7 175.200 175.200 177.056 -1.856 18016
4061 1 8 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.551 -0.351 18016
4062 1 8 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.709 -0.809 18016
4063 1 8 . 1 1 7 7 ASN H H 7 8.010 8.010 8.240 -0.230 18016
4064 1 8 . 1 1 8 8 ALA N N 8 126.500 126.500 128.041 -1.541 18016
4065 1 8 . 1 1 8 8 ALA C C 8 180.200 180.200 179.581 0.619 18016
4066 1 8 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.172 0.328 18016
4067 1 8 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.743 -0.343 18016
4068 1 8 . 1 1 8 8 ALA H H 8 9.020 9.020 8.689 0.331 18016
4069 1 8 . 1 1 9 9 PHE N N 9 121.300 121.300 120.440 0.860 18016
4070 1 8 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.022 0.268 18016
4071 1 8 . 1 1 9 9 PHE C C 9 177.200 177.200 177.124 0.076 18016
4072 1 8 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.984 -0.684 18016
4073 1 8 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.064 0.136 18016
4074 1 8 . 1 1 9 9 PHE H H 9 8.570 8.570 8.122 0.448 18016
4075 1 8 . 1 1 10 10 LEU N N 10 117.200 117.200 119.277 -2.077 18016
4076 1 8 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.856 -0.156 18016
4077 1 8 . 1 1 10 10 LEU C C 10 179.700 179.700 178.937 0.763 18016
4078 1 8 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.700 -0.100 18016
4079 1 8 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.542 0.158 18016
4080 1 8 . 1 1 10 10 LEU H H 10 8.150 8.150 7.841 0.309 18016
4081 1 8 . 1 1 11 11 ALA N N 11 121.500 121.500 122.237 -0.737 18016
4082 1 8 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.892 0.128 18016
4083 1 8 . 1 1 11 11 ALA C C 11 180.900 180.900 179.552 1.348 18016
4084 1 8 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.393 -0.393 18016
4085 1 8 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.072 -0.072 18016
4086 1 8 . 1 1 11 11 ALA H H 11 8.460 8.460 8.838 -0.378 18016
4087 1 8 . 1 1 12 12 LYS N N 12 120.700 120.700 118.891 1.809 18016
4088 1 8 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.030 0.020 18016
4089 1 8 . 1 1 12 12 LYS C C 12 179.700 179.700 178.967 0.733 18016
4090 1 8 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.912 0.288 18016
4091 1 8 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.820 -0.220 18016
4092 1 8 . 1 1 12 12 LYS H H 12 7.820 7.820 7.801 0.019 18016
4093 1 8 . 1 1 13 13 ILE N N 13 120.100 120.100 119.784 0.316 18016
4094 1 8 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.839 -0.149 18016
4095 1 8 . 1 1 13 13 ILE C C 13 178.100 178.100 178.088 0.012 18016
4096 1 8 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.576 -0.576 18016
4097 1 8 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.494 -1.094 18016
4098 1 8 . 1 1 13 13 ILE H H 13 7.640 7.640 7.866 -0.226 18016
4099 1 8 . 1 1 14 14 ALA N N 14 122.700 122.700 122.564 0.136 18016
4100 1 8 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.940 -0.080 18016
4101 1 8 . 1 1 14 14 ALA C C 14 179.000 179.000 179.594 -0.594 18016
4102 1 8 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.460 0.540 18016
4103 1 8 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.008 -0.008 18016
4104 1 8 . 1 1 14 14 ALA H H 14 8.680 8.680 8.370 0.310 18016
4105 1 8 . 1 1 15 15 ALA N N 15 118.700 118.700 121.684 -2.984 18016
4106 1 8 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.028 0.062 18016
4107 1 8 . 1 1 15 15 ALA C C 15 180.400 180.400 178.926 1.474 18016
4108 1 8 . 1 1 15 15 ALA CA C 15 55.000 55.000 55.195 -0.195 18016
4109 1 8 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.523 -0.823 18016
4110 1 8 . 1 1 15 15 ALA H H 15 8.070 8.070 8.134 -0.064 18016
4111 1 8 . 1 1 16 16 TRP N N 16 122.900 122.900 121.054 1.846 18016
4112 1 8 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.223 0.337 18016
4113 1 8 . 1 1 16 16 TRP C C 16 178.400 178.400 178.195 0.205 18016
4114 1 8 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.233 -1.633 18016
4115 1 8 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.170 -0.870 18016
4116 1 8 . 1 1 16 16 TRP H H 16 7.820 7.820 8.361 -0.541 18016
4117 1 8 . 1 1 17 17 LEU N N 17 120.400 120.400 119.250 1.150 18016
4118 1 8 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.237 0.373 18016
4119 1 8 . 1 1 17 17 LEU C C 17 179.000 179.000 178.704 0.296 18016
4120 1 8 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.683 0.217 18016
4121 1 8 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.576 0.424 18016
4122 1 8 . 1 1 17 17 LEU H H 17 8.630 8.630 8.429 0.201 18016
4123 1 8 . 1 1 18 18 ASN N N 18 116.200 116.200 117.359 -1.159 18016
4124 1 8 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.351 -0.041 18016
4125 1 8 . 1 1 18 18 ASN C C 18 177.100 177.100 176.887 0.213 18016
4126 1 8 . 1 1 18 18 ASN CA C 18 55.600 55.600 56.061 -0.461 18016
4127 1 8 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.961 0.239 18016
4128 1 8 . 1 1 18 18 ASN H H 18 8.350 8.350 8.303 0.047 18016
4129 1 8 . 1 1 19 19 ALA N N 19 119.600 119.600 120.360 -0.760 18016
4130 1 8 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.250 -0.160 18016
4131 1 8 . 1 1 19 19 ALA C C 19 180.100 180.100 178.936 1.164 18016
4132 1 8 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.050 0.150 18016
4133 1 8 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.508 -0.908 18016
4134 1 8 . 1 1 19 19 ALA H H 19 7.920 7.920 8.129 -0.209 18016
4135 1 8 . 1 1 20 20 GLY N N 20 103.500 103.500 105.209 -1.709 18016
4136 1 8 . 1 1 20 20 GLY C C 20 173.800 173.800 173.872 -0.072 18016
4137 1 8 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.529 0.271 18016
4138 1 8 . 1 1 20 20 GLY H H 20 7.700 7.700 7.478 0.222 18016
4139 1 8 . 1 1 21 21 TYR N N 21 119.900 119.900 117.334 2.566 18016
4140 1 8 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.851 0.319 18016
4141 1 8 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.954 1.446 18016
4142 1 8 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.730 -0.930 18016
4143 1 8 . 1 1 21 21 TYR H H 21 7.980 7.980 7.854 0.126 18016
4144 1 8 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.481 0.019 18016
4145 1 8 . 1 1 22 22 PRO C C 22 178.700 178.700 176.855 1.845 18016
4146 1 8 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.135 0.865 18016
4147 1 8 . 1 1 22 22 PRO CB C 22 32.000 32.000 31.977 0.024 18016
4148 1 8 . 1 1 23 23 GLU N N 23 116.300 116.300 117.422 -1.122 18016
4149 1 8 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.424 0.146 18016
4150 1 8 . 1 1 23 23 GLU C C 23 176.300 176.300 176.558 -0.258 18016
4151 1 8 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.507 -0.907 18016
4152 1 8 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.169 0.331 18016
4153 1 8 . 1 1 23 23 GLU H H 23 8.680 8.680 8.084 0.596 18016
4154 1 8 . 1 1 24 24 GLY N N 24 108.100 108.100 109.624 -1.524 18016
4155 1 8 . 1 1 24 24 GLY C C 24 173.100 173.100 173.432 -0.332 18016
4156 1 8 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.662 -1.762 18016
4157 1 8 . 1 1 24 24 GLY H H 24 7.230 7.230 7.646 -0.416 18016
4158 1 8 . 1 1 25 25 VAL N N 25 121.500 121.500 120.206 1.294 18016
4159 1 8 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.664 -0.074 18016
4160 1 8 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.996 0.304 18016
4161 1 8 . 1 1 25 25 VAL CB C 25 32.100 32.100 31.209 0.891 18016
4162 1 8 . 1 1 25 25 VAL H H 25 8.050 8.050 8.142 -0.092 18016
4163 1 8 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.490 -0.170 18016
4164 1 8 . 1 1 26 26 PRO C C 26 177.600 177.600 177.857 -0.257 18016
4165 1 8 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.597 0.303 18016
4166 1 8 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.974 0.126 18016
4167 1 8 . 1 1 27 27 GLY N N 27 109.000 109.000 109.768 -0.768 18016
4168 1 8 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.834 1.266 18016
4169 1 8 . 1 1 27 27 GLY H H 27 8.930 8.930 8.838 0.092 18016
4170 1 8 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.243 0.147 18016
4171 1 8 . 1 1 28 28 PRO C C 28 175.800 175.800 176.659 -0.859 18016
4172 1 8 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.941 -0.541 18016
4173 1 8 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.413 0.487 18016
4174 1 8 . 1 1 29 29 ASP N N 29 115.000 115.000 116.363 -1.363 18016
4175 1 8 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.741 -0.251 18016
4176 1 8 . 1 1 29 29 ASP C C 29 177.000 177.000 177.770 -0.770 18016
4177 1 8 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.906 -2.006 18016
4178 1 8 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.900 -1.200 18016
4179 1 8 . 1 1 29 29 ASP H H 29 7.760 7.760 8.124 -0.364 18016
4180 1 8 . 1 1 30 30 ARG N N 30 119.900 119.900 121.573 -1.673 18016
4181 1 8 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.946 -0.376 18016
4182 1 8 . 1 1 30 30 ARG C C 30 176.500 176.500 178.653 -2.153 18016
4183 1 8 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.749 2.151 18016
4184 1 8 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.257 0.243 18016
4185 1 8 . 1 1 30 30 ARG H H 30 7.460 7.460 8.036 -0.576 18016
4186 1 8 . 1 1 31 31 VAL N N 31 117.600 117.600 119.723 -2.123 18016
4187 1 8 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.853 -0.033 18016
4188 1 8 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.397 0.303 18016
4189 1 8 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.162 -0.362 18016
4190 1 8 . 1 1 31 31 VAL H H 31 9.080 9.080 8.222 0.858 18016
4191 1 8 . 1 1 32 32 PRO C C 32 177.000 177.000 178.711 -1.711 18016
4192 1 8 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.854 -0.654 18016
4193 1 8 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.206 -0.406 18016
4194 1 8 . 1 1 33 33 LEU N N 33 115.200 115.200 121.148 -5.948 18016
4195 1 8 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.098 0.022 18016
4196 1 8 . 1 1 33 33 LEU C C 33 178.600 178.600 178.478 0.122 18016
4197 1 8 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.053 0.347 18016
4198 1 8 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.310 0.190 18016
4199 1 8 . 1 1 33 33 LEU H H 33 8.010 8.010 8.120 -0.110 18016
4200 1 8 . 1 1 34 34 LEU N N 34 120.400 120.400 119.197 1.203 18016
4201 1 8 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.048 -0.118 18016
4202 1 8 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.530 0.570 18016
4203 1 8 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.275 0.625 18016
4204 1 8 . 1 1 34 34 LEU H H 34 8.220 8.220 8.312 -0.092 18016
4205 1 8 . 1 1 35 35 ALA N N 35 123.100 123.100 122.657 0.443 18016
4206 1 8 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.087 -0.047 18016
4207 1 8 . 1 1 35 35 ALA C C 35 179.500 179.500 179.642 -0.142 18016
4208 1 8 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.984 0.515 18016
4209 1 8 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.450 -0.550 18016
4210 1 8 . 1 1 35 35 ALA H H 35 8.560 8.560 8.011 0.549 18016
4211 1 8 . 1 1 36 36 LEU N N 36 117.600 117.600 118.693 -1.093 18016
4212 1 8 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.245 -0.125 18016
4213 1 8 . 1 1 36 36 LEU C C 36 180.100 180.100 179.367 0.733 18016
4214 1 8 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.634 0.566 18016
4215 1 8 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.730 1.070 18016
4216 1 8 . 1 1 36 36 LEU H H 36 7.850 7.850 8.022 -0.172 18016
4217 1 8 . 1 1 37 37 LEU N N 37 116.700 116.700 120.585 -3.885 18016
4218 1 8 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.026 0.074 18016
4219 1 8 . 1 1 37 37 LEU C C 37 180.100 180.100 178.818 1.282 18016
4220 1 8 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.572 -0.272 18016
4221 1 8 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.574 0.626 18016
4222 1 8 . 1 1 37 37 LEU H H 37 8.730 8.730 8.448 0.282 18016
4223 1 8 . 1 1 38 38 THR N N 38 110.600 110.600 109.074 1.526 18016
4224 1 8 . 1 1 38 38 THR HA H 38 4.440 4.440 4.253 0.187 18016
4225 1 8 . 1 1 38 38 THR C C 38 175.100 175.100 175.956 -0.856 18016
4226 1 8 . 1 1 38 38 THR CA C 38 64.200 64.200 64.303 -0.103 18016
4227 1 8 . 1 1 38 38 THR CB C 38 70.000 70.000 68.524 1.476 18016
4228 1 8 . 1 1 38 38 THR H H 38 8.660 8.660 8.391 0.269 18016
4229 1 8 . 1 1 39 39 ARG N N 39 118.000 118.000 120.071 -2.071 18016
4230 1 8 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.203 0.077 18016
4231 1 8 . 1 1 39 39 ARG C C 39 177.300 177.300 177.857 -0.557 18016
4232 1 8 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.014 0.286 18016
4233 1 8 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.138 0.062 18016
4234 1 8 . 1 1 39 39 ARG H H 39 7.180 7.180 7.491 -0.311 18016
4235 1 8 . 1 1 40 40 ARG N N 40 114.400 114.400 115.371 -0.971 18016
4236 1 8 . 1 1 40 40 ARG C C 40 174.800 174.800 176.227 -1.427 18016
4237 1 8 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.389 -1.089 18016
4238 1 8 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.971 2.629 18016
4239 1 8 . 1 1 40 40 ARG H H 40 7.520 7.520 7.917 -0.397 18016
4240 1 8 . 1 1 41 41 LEU N N 41 119.400 119.400 120.710 -1.310 18016
4241 1 8 . 1 1 41 41 LEU C C 41 177.100 177.100 176.341 0.759 18016
4242 1 8 . 1 1 41 41 LEU CA C 41 53.700 53.700 53.837 -0.137 18016
4243 1 8 . 1 1 41 41 LEU CB C 41 44.400 44.400 44.508 -0.108 18016
4244 1 8 . 1 1 41 41 LEU H H 41 8.380 8.380 7.959 0.421 18016
4245 1 8 . 1 1 42 42 THR N N 42 112.000 112.000 114.657 -2.657 18016
4246 1 8 . 1 1 42 42 THR HA H 42 4.440 4.440 4.420 0.020 18016
4247 1 8 . 1 1 42 42 THR C C 42 175.800 175.800 175.976 -0.176 18016
4248 1 8 . 1 1 42 42 THR CA C 42 60.500 60.500 61.099 -0.599 18016
4249 1 8 . 1 1 42 42 THR CB C 42 70.800 70.800 69.927 0.873 18016
4250 1 8 . 1 1 42 42 THR H H 42 9.330 9.330 9.097 0.233 18016
4251 1 8 . 1 1 43 43 ASN N N 43 119.900 119.900 119.423 0.477 18016
4252 1 8 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.367 -0.117 18016
4253 1 8 . 1 1 43 43 ASN C C 43 177.900 177.900 177.189 0.711 18016
4254 1 8 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.909 -0.209 18016
4255 1 8 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.085 -0.885 18016
4256 1 8 . 1 1 43 43 ASN H H 43 9.140 9.140 8.760 0.380 18016
4257 1 8 . 1 1 44 44 ASP N N 44 118.000 118.000 120.178 -2.178 18016
4258 1 8 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.383 0.017 18016
4259 1 8 . 1 1 44 44 ASP C C 44 179.600 179.600 178.483 1.117 18016
4260 1 8 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.306 -0.007 18016
4261 1 8 . 1 1 44 44 ASP H H 44 8.360 8.360 8.778 -0.418 18016
4262 1 8 . 1 1 45 45 GLU N N 45 122.600 122.600 120.072 2.528 18016
4263 1 8 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.004 -0.034 18016
4264 1 8 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.373 0.028 18016
4265 1 8 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.854 0.446 18016
4266 1 8 . 1 1 45 45 GLU H H 45 7.850 7.850 7.644 0.206 18016
4267 1 8 . 1 1 46 46 ILE N N 46 118.900 118.900 120.960 -2.060 18016
4268 1 8 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.734 -0.304 18016
4269 1 8 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.243 1.757 18016
4270 1 8 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.732 -0.032 18016
4271 1 8 . 1 1 46 46 ILE H H 46 8.290 8.290 8.275 0.015 18016
4272 1 8 . 1 1 47 47 LYS N N 47 118.900 118.900 119.374 -0.474 18016
4273 1 8 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.912 -0.042 18016
4274 1 8 . 1 1 47 47 LYS C C 47 178.400 178.400 178.712 -0.312 18016
4275 1 8 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.996 0.304 18016
4276 1 8 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.162 0.438 18016
4277 1 8 . 1 1 47 47 LYS H H 47 8.290 8.290 8.198 0.092 18016
4278 1 8 . 1 1 48 48 ALA N N 48 121.100 121.100 123.202 -2.102 18016
4279 1 8 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.277 -0.107 18016
4280 1 8 . 1 1 48 48 ALA CA C 48 55.100 55.100 54.950 0.150 18016
4281 1 8 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.328 -0.328 18016
4282 1 8 . 1 1 48 48 ALA H H 48 7.710 7.710 7.993 -0.283 18016
4283 1 8 . 1 1 49 49 ILE N N 49 119.900 119.900 119.001 0.899 18016
4284 1 8 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.666 -0.016 18016
4285 1 8 . 1 1 49 49 ILE C C 49 177.300 177.300 178.023 -0.723 18016
4286 1 8 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.101 1.899 18016
4287 1 8 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.538 1.562 18016
4288 1 8 . 1 1 49 49 ILE H H 49 8.130 8.130 8.005 0.125 18016
4289 1 8 . 1 1 50 50 ALA N N 50 122.000 122.000 122.071 -0.071 18016
4290 1 8 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.865 -0.005 18016
4291 1 8 . 1 1 50 50 ALA C C 50 179.800 179.800 179.694 0.106 18016
4292 1 8 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.463 0.237 18016
4293 1 8 . 1 1 50 50 ALA CB C 50 17.900 17.900 17.967 -0.067 18016
4294 1 8 . 1 1 50 50 ALA H H 50 8.730 8.730 7.858 0.872 18016
4295 1 8 . 1 1 51 51 GLU N N 51 116.900 116.900 117.103 -0.203 18016
4296 1 8 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.175 -0.155 18016
4297 1 8 . 1 1 51 51 GLU CA C 51 59.400 59.400 58.936 0.464 18016
4298 1 8 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.343 0.157 18016
4299 1 8 . 1 1 51 51 GLU H H 51 8.220 8.220 8.508 -0.288 18016
4300 1 8 . 1 1 52 52 ASP N N 52 120.300 120.300 120.412 -0.112 18016
4301 1 8 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.416 -0.026 18016
4302 1 8 . 1 1 52 52 ASP C C 52 178.900 178.900 178.554 0.346 18016
4303 1 8 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.758 0.742 18016
4304 1 8 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.177 1.323 18016
4305 1 8 . 1 1 52 52 ASP H H 52 7.700 7.700 7.685 0.015 18016
4306 1 8 . 1 1 53 53 LEU N N 53 118.300 118.300 120.214 -1.914 18016
4307 1 8 . 1 1 53 53 LEU HA H 53 3.730 3.730 4.061 -0.331 18016
4308 1 8 . 1 1 53 53 LEU C C 53 179.000 179.000 178.964 0.036 18016
4309 1 8 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.414 0.086 18016
4310 1 8 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.273 -0.173 18016
4311 1 8 . 1 1 53 53 LEU H H 53 8.290 8.290 7.940 0.350 18016
4312 1 8 . 1 1 54 54 GLU N N 54 118.700 118.700 116.723 1.977 18016
4313 1 8 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.077 0.142 18016
4314 1 8 . 1 1 54 54 GLU C C 54 178.200 178.200 177.338 0.862 18016
4315 1 8 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.359 0.341 18016
4316 1 8 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.885 1.015 18016
4317 1 8 . 1 1 54 54 GLU H H 54 8.070 8.070 8.311 -0.241 18016
4318 1 8 . 1 1 55 55 LYS N N 55 117.700 117.700 116.624 1.076 18016
4319 1 8 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.025 0.125 18016
4320 1 8 . 1 1 55 55 LYS CA C 55 58.300 58.300 56.687 1.613 18016
4321 1 8 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.236 0.464 18016
4322 1 8 . 1 1 55 55 LYS H H 55 7.750 7.750 7.402 0.348 18016
4323 1 8 . 1 1 56 56 ARG N N 56 117.100 117.100 116.224 0.876 18016
4324 1 8 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.358 -0.088 18016
4325 1 8 . 1 1 56 56 ARG CA C 56 56.800 56.800 55.729 1.071 18016
4326 1 8 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.512 -0.512 18016
4327 1 8 . 1 1 56 56 ARG H H 56 8.270 8.270 7.550 0.720 18016
4328 1 8 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.617 -0.257 18016
4329 1 8 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.049 0.051 18016
4330 1 8 . 1 1 57 57 ALA CB C 57 19.200 19.200 19.936 -0.736 18016
4331 1 8 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.336 0.174 18016
4332 1 8 . 1 1 58 58 HIS CA C 58 56.200 56.200 57.792 -1.592 18016
4333 1 8 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.962 -2.662 18016
4334 1 8 . 1 1 59 59 PHE N N 59 120.400 120.400 115.293 5.107 18016
4335 1 8 . 1 1 59 59 PHE C C 59 175.500 175.500 175.770 -0.270 18016
4336 1 8 . 1 1 59 59 PHE CA C 59 57.200 57.200 58.280 -1.080 18016
4337 1 8 . 1 1 59 59 PHE CB C 59 39.300 39.300 38.724 0.576 18016
4338 1 8 . 1 1 59 59 PHE H H 59 7.710 7.710 7.953 -0.243 18016
4339 1 8 . 1 1 60 60 ASP N N 60 120.800 120.800 120.455 0.345 18016
4340 1 8 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.503 -0.013 18016
4341 1 8 . 1 1 60 60 ASP CA C 60 54.300 54.300 55.037 -0.737 18016
4342 1 8 . 1 1 60 60 ASP CB C 60 41.100 41.100 41.401 -0.302 18016
4343 1 8 . 1 1 60 60 ASP H H 60 8.180 8.180 7.570 0.610 18016
4344 1 8 . 1 1 61 61 HIS N N 61 118.300 118.300 122.793 -4.493 18016
4345 1 8 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.823 -0.433 18016
4346 1 8 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.410 1.290 18016
4347 1 8 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.576 -0.776 18016
4348 1 8 . 1 1 61 61 HIS H H 61 8.550 8.550 8.664 -0.114 18016
4349 1 8 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.055 -0.045 18016
4350 1 8 . 1 1 62 62 ILE C C 62 173.800 173.800 175.705 -1.905 18016
4351 1 8 . 1 1 62 62 ILE CA C 62 66.500 66.500 62.430 4.070 18016
4352 1 8 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.317 1.783 18016
4353 1 8 . 1 1 63 63 ASP N N 63 125.100 125.100 118.639 6.461 18016
4354 1 8 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.207 0.393 18016
4355 1 8 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.221 -2.421 18016
4356 1 8 . 1 1 63 63 ASP CB C 63 40.500 40.500 38.557 1.943 18016
4357 1 8 . 1 1 63 63 ASP H H 63 8.360 8.360 7.834 0.526 18016
4358 1 8 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.605 0.065 18016
4359 1 8 . 1 1 64 64 ILE C C 64 177.000 177.000 177.143 -0.143 18016
4360 1 8 . 1 1 64 64 ILE CA C 64 62.100 62.100 64.737 -2.637 18016
4361 1 8 . 1 1 64 64 ILE CB C 64 36.600 36.600 37.909 -1.309 18016
4362 1 8 . 1 1 65 65 GLY N N 65 107.600 107.600 105.540 2.060 18016
4363 1 8 . 1 1 65 65 GLY C C 65 177.000 177.000 175.744 1.256 18016
4364 1 8 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.508 0.792 18016
4365 1 8 . 1 1 65 65 GLY H H 65 8.440 8.440 8.234 0.206 18016
4366 1 8 . 1 1 66 66 VAL N N 66 121.800 121.800 122.566 -0.766 18016
4367 1 8 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.724 0.036 18016
4368 1 8 . 1 1 66 66 VAL C C 66 178.500 178.500 178.069 0.431 18016
4369 1 8 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.107 0.493 18016
4370 1 8 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.888 0.112 18016
4371 1 8 . 1 1 66 66 VAL H H 66 7.550 7.550 7.844 -0.294 18016
4372 1 8 . 1 1 67 67 LEU N N 67 120.900 120.900 120.556 0.344 18016
4373 1 8 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.036 0.034 18016
4374 1 8 . 1 1 67 67 LEU C C 67 179.000 179.000 178.885 0.115 18016
4375 1 8 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.919 -0.319 18016
4376 1 8 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.136 2.164 18016
4377 1 8 . 1 1 67 67 LEU H H 67 7.650 7.650 7.687 -0.037 18016
4378 1 8 . 1 1 68 68 ILE N N 68 118.900 118.900 118.154 0.746 18016
4379 1 8 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.755 -0.045 18016
4380 1 8 . 1 1 68 68 ILE C C 68 179.500 179.500 178.568 0.932 18016
4381 1 8 . 1 1 68 68 ILE CA C 68 65.200 65.200 65.256 -0.056 18016
4382 1 8 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.627 -0.127 18016
4383 1 8 . 1 1 68 68 ILE H H 68 8.580 8.580 7.448 1.132 18016
4384 1 8 . 1 1 69 69 THR N N 69 118.100 118.100 114.374 3.726 18016
4385 1 8 . 1 1 69 69 THR HA H 69 3.940 3.940 4.090 -0.150 18016
4386 1 8 . 1 1 69 69 THR C C 69 176.200 176.200 176.287 -0.087 18016
4387 1 8 . 1 1 69 69 THR CA C 69 66.600 66.600 66.474 0.126 18016
4388 1 8 . 1 1 69 69 THR CB C 69 68.500 68.500 68.488 0.012 18016
4389 1 8 . 1 1 69 69 THR H H 69 7.840 7.840 7.814 0.026 18016
4390 1 8 . 1 1 70 70 GLN N N 70 121.600 121.600 120.805 0.795 18016
4391 1 8 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.133 -0.023 18016
4392 1 8 . 1 1 70 70 GLN C C 70 178.100 178.100 178.118 -0.018 18016
4393 1 8 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.873 0.227 18016
4394 1 8 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.309 -0.009 18016
4395 1 8 . 1 1 70 70 GLN H H 70 8.100 8.100 7.310 0.790 18016
4396 1 8 . 1 1 71 71 MET N N 71 118.700 118.700 118.691 0.009 18016
4397 1 8 . 1 1 71 71 MET HA H 71 4.010 4.010 4.445 -0.435 18016
4398 1 8 . 1 1 71 71 MET C C 71 176.300 176.300 179.024 -2.724 18016
4399 1 8 . 1 1 71 71 MET CA C 71 58.100 58.100 58.886 -0.786 18016
4400 1 8 . 1 1 71 71 MET CB C 71 33.600 33.600 32.467 1.133 18016
4401 1 8 . 1 1 71 71 MET H H 71 8.350 8.350 8.485 -0.135 18016
4402 1 8 . 1 1 72 72 THR N N 72 111.600 111.600 111.932 -0.332 18016
4403 1 8 . 1 1 72 72 THR HA H 72 3.940 3.940 4.202 -0.262 18016
4404 1 8 . 1 1 72 72 THR C C 72 175.800 175.800 175.275 0.525 18016
4405 1 8 . 1 1 72 72 THR CA C 72 65.300 65.300 65.133 0.167 18016
4406 1 8 . 1 1 72 72 THR CB C 72 69.100 69.100 68.995 0.105 18016
4407 1 8 . 1 1 72 72 THR H H 72 7.840 7.840 7.716 0.124 18016
4408 1 8 . 1 1 73 73 ASP N N 73 121.100 121.100 120.152 0.948 18016
4409 1 8 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.686 -0.157 18016
4410 1 8 . 1 1 73 73 ASP C C 73 176.600 176.600 175.625 0.975 18016
4411 1 8 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.180 1.020 18016
4412 1 8 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.712 -1.312 18016
4413 1 8 . 1 1 73 73 ASP H H 73 7.840 7.840 7.652 0.188 18016
4414 1 8 . 1 1 74 74 GLU N N 74 121.100 121.100 119.202 1.898 18016
4415 1 8 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.572 -0.232 18016
4416 1 8 . 1 1 74 74 GLU C C 74 173.800 173.800 175.000 -1.200 18016
4417 1 8 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.616 -0.116 18016
4418 1 8 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.778 -1.178 18016
4419 1 8 . 1 1 74 74 GLU H H 74 7.980 7.980 8.424 -0.444 18016
4420 1 8 . 1 1 75 75 MET N N 75 125.800 125.800 127.136 -1.336 18016
4421 1 8 . 1 1 75 75 MET HA H 75 4.710 4.710 4.687 0.023 18016
4422 1 8 . 1 1 75 75 MET CA C 75 53.800 53.800 54.323 -0.523 18016
4423 1 8 . 1 1 75 75 MET CB C 75 31.700 31.700 32.008 -0.308 18016
4424 1 8 . 1 1 75 75 MET H H 75 8.380 8.380 8.665 -0.285 18016
4425 1 8 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.371 0.139 18016
4426 1 8 . 1 1 76 76 PRO C C 76 175.700 175.700 176.479 -0.779 18016
4427 1 8 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.679 -1.679 18016
4428 1 8 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.220 -0.420 18016
4429 1 8 . 1 1 77 77 ARG N N 77 119.700 119.700 117.963 1.737 18016
4430 1 8 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.668 -0.398 18016
4431 1 8 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.919 0.881 18016
4432 1 8 . 1 1 77 77 ARG CB C 77 30.700 30.700 31.987 -1.287 18016
4433 1 8 . 1 1 77 77 ARG H H 77 8.940 8.940 8.034 0.906 18016
4434 1 8 . 1 1 78 78 GLU N N 78 124.700 124.700 126.011 -1.311 18016
4435 1 8 . 1 1 78 78 GLU HA H 78 3.960 3.960 4.033 -0.073 18016
4436 1 8 . 1 1 78 78 GLU C C 78 179.000 179.000 178.009 0.991 18016
4437 1 8 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.049 -0.249 18016
4438 1 8 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.585 -0.585 18016
4439 1 8 . 1 1 78 78 GLU H H 78 9.170 9.170 9.059 0.111 18016
4440 1 8 . 1 1 79 79 GLU N N 79 116.800 116.800 119.885 -3.085 18016
4441 1 8 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.212 -0.092 18016
4442 1 8 . 1 1 79 79 GLU C C 79 179.100 179.100 178.654 0.446 18016
4443 1 8 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.952 -0.252 18016
4444 1 8 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.194 -0.194 18016
4445 1 8 . 1 1 79 79 GLU H H 79 9.660 9.660 8.756 0.904 18016
4446 1 8 . 1 1 80 80 ASP N N 80 120.000 120.000 118.710 1.290 18016
4447 1 8 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.468 0.222 18016
4448 1 8 . 1 1 80 80 ASP C C 80 177.300 177.300 178.637 -1.337 18016
4449 1 8 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.551 -0.151 18016
4450 1 8 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.340 1.260 18016
4451 1 8 . 1 1 80 80 ASP H H 80 7.310 7.310 8.308 -0.998 18016
4452 1 8 . 1 1 81 81 ILE N N 81 120.100 120.100 120.075 0.025 18016
4453 1 8 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.686 -0.196 18016
4454 1 8 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.665 0.635 18016
4455 1 8 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.899 0.401 18016
4456 1 8 . 1 1 81 81 ILE H H 81 7.610 7.610 8.223 -0.613 18016
4457 1 8 . 1 1 82 82 GLU N N 82 118.100 118.100 119.177 -1.077 18016
4458 1 8 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.092 0.188 18016
4459 1 8 . 1 1 82 82 GLU C C 82 177.800 177.800 178.979 -1.179 18016
4460 1 8 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.237 -1.237 18016
4461 1 8 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.129 -0.329 18016
4462 1 8 . 1 1 82 82 GLU H H 82 8.550 8.550 8.464 0.086 18016
4463 1 8 . 1 1 83 83 ARG N N 83 119.900 119.900 121.206 -1.306 18016
4464 1 8 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.156 -0.126 18016
4465 1 8 . 1 1 83 83 ARG C C 83 179.400 179.400 178.708 0.692 18016
4466 1 8 . 1 1 83 83 ARG CA C 83 59.900 59.900 58.846 1.054 18016
4467 1 8 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.125 -0.525 18016
4468 1 8 . 1 1 83 83 ARG H H 83 7.590 7.590 8.231 -0.641 18016
4469 1 8 . 1 1 84 84 VAL N N 84 120.400 120.400 120.269 0.131 18016
4470 1 8 . 1 1 84 84 VAL HA H 84 3.750 3.750 4.071 -0.321 18016
4471 1 8 . 1 1 84 84 VAL C C 84 177.400 177.400 177.845 -0.445 18016
4472 1 8 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.528 1.371 18016
4473 1 8 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.759 0.141 18016
4474 1 8 . 1 1 84 84 VAL H H 84 7.550 7.550 8.545 -0.995 18016
4475 1 8 . 1 1 85 85 ARG N N 85 121.600 121.600 119.785 1.815 18016
4476 1 8 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.299 -0.289 18016
4477 1 8 . 1 1 85 85 ARG C C 85 178.100 178.100 178.610 -0.510 18016
4478 1 8 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.991 0.909 18016
4479 1 8 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.930 0.270 18016
4480 1 8 . 1 1 85 85 ARG H H 85 9.090 9.090 8.491 0.599 18016
4481 1 8 . 1 1 86 86 ARG N N 86 115.600 115.600 118.689 -3.089 18016
4482 1 8 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.117 -0.237 18016
4483 1 8 . 1 1 86 86 ARG C C 86 179.000 179.000 178.427 0.573 18016
4484 1 8 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.084 0.316 18016
4485 1 8 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.341 1.059 18016
4486 1 8 . 1 1 86 86 ARG H H 86 8.660 8.660 8.448 0.212 18016
4487 1 8 . 1 1 87 87 HIS N N 87 118.000 118.000 120.475 -2.475 18016
4488 1 8 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.263 0.097 18016
4489 1 8 . 1 1 87 87 HIS C C 87 178.400 178.400 177.390 1.010 18016
4490 1 8 . 1 1 87 87 HIS CA C 87 59.600 59.600 58.541 1.059 18016
4491 1 8 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.195 0.505 18016
4492 1 8 . 1 1 87 87 HIS H H 87 7.640 7.640 7.941 -0.301 18016
4493 1 8 . 1 1 88 88 LEU N N 88 119.600 119.600 118.448 1.152 18016
4494 1 8 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.054 -0.474 18016
4495 1 8 . 1 1 88 88 LEU C C 88 180.000 180.000 179.043 0.957 18016
4496 1 8 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.055 0.145 18016
4497 1 8 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.236 1.364 18016
4498 1 8 . 1 1 88 88 LEU H H 88 8.650 8.650 8.478 0.172 18016
4499 1 8 . 1 1 89 89 ALA N N 89 118.500 118.500 122.700 -4.200 18016
4500 1 8 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.656 0.704 18016
4501 1 8 . 1 1 89 89 ALA C C 89 180.400 180.400 180.173 0.227 18016
4502 1 8 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.665 -1.065 18016
4503 1 8 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.431 -0.331 18016
4504 1 8 . 1 1 89 89 ALA H H 89 8.870 8.870 8.324 0.546 18016
4505 1 8 . 1 1 90 90 LEU N N 90 119.400 119.400 117.819 1.581 18016
4506 1 8 . 1 1 90 90 LEU HA H 90 4.210 4.210 4.014 0.196 18016
4507 1 8 . 1 1 90 90 LEU C C 90 179.100 179.100 179.143 -0.043 18016
4508 1 8 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.252 0.248 18016
4509 1 8 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.843 -0.143 18016
4510 1 8 . 1 1 90 90 LEU H H 90 7.390 7.390 7.738 -0.348 18016
4511 1 8 . 1 1 91 91 GLN N N 91 114.500 114.500 116.060 -1.560 18016
4512 1 8 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.383 0.317 18016
4513 1 8 . 1 1 91 91 GLN C C 91 175.800 175.800 176.502 -0.702 18016
4514 1 8 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.836 -2.336 18016
4515 1 8 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.162 -2.062 18016
4516 1 8 . 1 1 91 91 GLN H H 91 7.810 7.810 7.848 -0.038 18016
4517 1 8 . 1 1 92 92 GLY N N 92 107.900 107.900 105.248 2.652 18016
4518 1 8 . 1 1 92 92 GLY C C 92 172.100 172.100 171.859 0.241 18016
4519 1 8 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.398 -1.398 18016
4520 1 8 . 1 1 92 92 GLY H H 92 7.710 7.710 8.412 -0.702 18016
4521 1 8 . 1 1 93 93 TRP N N 93 114.200 114.200 121.872 -7.672 18016
4522 1 8 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.798 1.202 18016
4523 1 8 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.891 -1.691 18016
4524 1 8 . 1 1 93 93 TRP H H 93 8.450 8.450 8.277 0.173 18016
4525 1 8 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.215 0.245 18016
4526 1 8 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.998 -1.198 18016
4527 1 8 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.249 0.351 18016
4528 1 8 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.084 -0.584 18016
4529 1 8 . 1 1 95 95 LEU C C 95 175.000 175.000 178.026 -3.026 18016
4530 1 8 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.462 -0.361 18016
4531 1 8 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.339 1.761 18016
4532 1 8 . 1 1 96 96 ASP N N 96 114.000 114.000 119.725 -5.725 18016
4533 1 8 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.592 0.358 18016
4534 1 8 . 1 1 96 96 ASP C C 96 175.800 175.800 176.059 -0.259 18016
4535 1 8 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.717 -2.717 18016
4536 1 8 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.845 0.055 18016
4537 1 8 . 1 1 96 96 ASP H H 96 7.230 7.230 7.524 -0.294 18016
4538 1 8 . 1 1 97 97 ASP N N 97 123.200 123.200 116.161 7.039 18016
4539 1 8 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.924 -0.314 18016
4540 1 8 . 1 1 97 97 ASP CA C 97 53.500 53.500 52.271 1.229 18016
4541 1 8 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.762 -4.062 18016
4542 1 8 . 1 1 97 97 ASP H H 97 7.420 7.420 7.916 -0.496 18016
4543 1 8 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.194 1.096 18016
4544 1 8 . 1 1 98 98 PRO C C 98 177.500 177.500 176.936 0.564 18016
4545 1 8 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.554 0.145 18016
4546 1 8 . 1 1 98 98 PRO CB C 98 31.900 31.900 31.714 0.186 18016
4547 1 8 . 1 1 99 99 ARG N N 99 121.300 121.300 121.556 -0.256 18016
4548 1 8 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.256 -0.546 18016
4549 1 8 . 1 1 99 99 ARG C C 99 176.500 176.500 175.674 0.826 18016
4550 1 8 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.411 -1.311 18016
4551 1 8 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.829 -0.329 18016
4552 1 8 . 1 1 99 99 ARG H H 99 8.390 8.390 8.580 -0.190 18016
4553 1 8 . 1 1 100 100 ASP N N 100 119.600 119.600 117.414 2.186 18016
4554 1 8 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.582 -0.082 18016
4555 1 8 . 1 1 100 100 ASP C C 100 177.000 177.000 174.853 2.147 18016
4556 1 8 . 1 1 100 100 ASP CA C 100 54.700 54.700 54.550 0.150 18016
4557 1 8 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.176 -1.276 18016
4558 1 8 . 1 1 100 100 ASP H H 100 8.260 8.260 7.833 0.427 18016
4559 1 8 . 1 1 101 101 GLY N N 101 109.300 109.300 110.701 -1.401 18016
4560 1 8 . 1 1 101 101 GLY CA C 101 45.400 45.400 45.151 0.249 18016
4561 1 8 . 1 1 101 101 GLY H H 101 8.450 8.450 8.105 0.345 18016
4562 1 8 . 1 1 102 102 GLU N N 102 119.800 119.800 120.732 -0.932 18016
4563 1 8 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.605 -0.295 18016
4564 1 8 . 1 1 102 102 GLU CA C 102 56.000 56.000 55.296 0.704 18016
4565 1 8 . 1 1 102 102 GLU CB C 102 30.500 30.500 31.305 -0.805 18016
4566 1 8 . 1 1 102 102 GLU H H 102 8.140 8.140 8.175 -0.035 18016
4567 1 8 . 1 1 103 103 GLU N N 103 123.000 123.000 121.598 1.402 18016
4568 1 8 . 1 1 103 103 GLU HA H 103 4.560 4.560 5.205 -0.645 18016
4569 1 8 . 1 1 103 103 GLU CA C 103 54.300 54.300 53.212 1.088 18016
4570 1 8 . 1 1 103 103 GLU CB C 103 29.600 29.600 32.046 -2.446 18016
4571 1 8 . 1 1 103 103 GLU H H 103 8.580 8.580 8.376 0.204 18016
4572 1 8 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.357 0.123 18016
4573 1 8 . 1 1 104 104 PRO C C 104 176.800 176.800 176.172 0.628 18016
4574 1 8 . 1 1 104 104 PRO CA C 104 63.400 63.400 64.742 -1.342 18016
4575 1 8 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.092 0.008 18016
4576 1 8 . 1 1 105 105 ASP N N 105 120.400 120.400 115.509 4.891 18016
4577 1 8 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.607 -0.027 18016
4578 1 8 . 1 1 105 105 ASP C C 105 177.100 177.100 175.261 1.839 18016
4579 1 8 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.054 0.246 18016
4580 1 8 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.813 -0.413 18016
4581 1 8 . 1 1 105 105 ASP H H 105 8.500 8.500 7.848 0.652 18016
4582 1 8 . 1 1 106 106 GLY N N 106 109.300 109.300 111.622 -2.322 18016
4583 1 8 . 1 1 106 106 GLY C C 106 174.600 174.600 173.464 1.136 18016
4584 1 8 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.257 0.143 18016
4585 1 8 . 1 1 106 106 GLY H H 106 8.360 8.360 8.442 -0.082 18016
4586 1 8 . 1 1 107 107 GLU N N 107 120.400 120.400 119.059 1.341 18016
4587 1 8 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.481 -0.141 18016
4588 1 8 . 1 1 107 107 GLU C C 107 177.100 177.100 175.829 1.271 18016
4589 1 8 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.404 0.096 18016
4590 1 8 . 1 1 107 107 GLU CB C 107 30.200 30.200 30.471 -0.271 18016
4591 1 8 . 1 1 107 107 GLU H H 107 8.410 8.410 8.596 -0.186 18016
4592 1 8 . 1 1 108 108 SER N N 108 116.600 116.600 114.956 1.644 18016
4593 1 8 . 1 1 108 108 SER HA H 108 4.450 4.450 4.692 -0.242 18016
4594 1 8 . 1 1 108 108 SER C C 108 175.300 175.300 174.737 0.563 18016
4595 1 8 . 1 1 108 108 SER CA C 108 58.700 58.700 58.123 0.577 18016
4596 1 8 . 1 1 108 108 SER CB C 108 63.800 63.800 63.658 0.142 18016
4597 1 8 . 1 1 108 108 SER H H 108 8.460 8.460 8.123 0.337 18016
4598 1 8 . 1 1 109 109 GLY N N 109 110.800 110.800 111.008 -0.208 18016
4599 1 8 . 1 1 109 109 GLY C C 109 174.500 174.500 173.658 0.842 18016
4600 1 8 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.203 0.097 18016
4601 1 8 . 1 1 109 109 GLY H H 109 8.500 8.500 8.519 -0.019 18016
4602 1 8 . 1 1 110 110 GLY N N 110 108.800 108.800 106.461 2.339 18016
4603 1 8 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.981 -0.581 18016
4604 1 8 . 1 1 110 110 GLY H H 110 8.140 8.140 7.924 0.216 18016
4605 1 8 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.266 0.344 18016
4606 1 8 . 1 1 111 111 PRO C C 111 176.000 176.000 176.701 -0.701 18016
4607 1 8 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.424 -0.824 18016
4608 1 8 . 1 1 111 111 PRO CB C 111 34.600 34.600 31.915 2.685 18016
4609 1 9 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.477 -0.047 18016
4610 1 9 . 1 1 2 2 PRO C C 2 177.600 177.600 176.739 0.861 18016
4611 1 9 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.367 0.933 18016
4612 1 9 . 1 1 2 2 PRO CB C 2 32.300 32.300 31.256 1.044 18016
4613 1 9 . 1 1 3 3 GLY N N 3 110.000 110.000 113.131 -3.131 18016
4614 1 9 . 1 1 3 3 GLY C C 3 174.200 174.200 173.388 0.812 18016
4615 1 9 . 1 1 3 3 GLY CA C 3 45.400 45.400 44.915 0.485 18016
4616 1 9 . 1 1 3 3 GLY H H 3 8.700 8.700 8.485 0.215 18016
4617 1 9 . 1 1 4 4 SER N N 4 115.400 115.400 116.454 -1.054 18016
4618 1 9 . 1 1 4 4 SER HA H 4 4.440 4.440 4.910 -0.470 18016
4619 1 9 . 1 1 4 4 SER C C 4 174.800 174.800 172.786 2.014 18016
4620 1 9 . 1 1 4 4 SER CA C 4 58.400 58.400 57.288 1.112 18016
4621 1 9 . 1 1 4 4 SER CB C 4 63.800 63.800 65.108 -1.308 18016
4622 1 9 . 1 1 4 4 SER H H 4 8.210 8.210 7.708 0.502 18016
4623 1 9 . 1 1 5 5 MET N N 5 122.200 122.200 118.553 3.647 18016
4624 1 9 . 1 1 5 5 MET HA H 5 4.510 4.510 4.725 -0.215 18016
4625 1 9 . 1 1 5 5 MET CA C 5 55.600 55.600 55.231 0.369 18016
4626 1 9 . 1 1 5 5 MET CB C 5 32.900 32.900 34.797 -1.897 18016
4627 1 9 . 1 1 5 5 MET H H 5 8.570 8.570 8.230 0.340 18016
4628 1 9 . 1 1 6 6 VAL N N 6 120.000 120.000 116.821 3.179 18016
4629 1 9 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.485 -0.435 18016
4630 1 9 . 1 1 6 6 VAL C C 6 175.700 175.700 174.860 0.840 18016
4631 1 9 . 1 1 6 6 VAL CA C 6 62.700 62.700 60.853 1.847 18016
4632 1 9 . 1 1 6 6 VAL CB C 6 32.500 32.500 33.622 -1.122 18016
4633 1 9 . 1 1 6 6 VAL H H 6 8.150 8.150 8.349 -0.199 18016
4634 1 9 . 1 1 7 7 ASN N N 7 122.000 122.000 119.316 2.684 18016
4635 1 9 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.611 0.049 18016
4636 1 9 . 1 1 7 7 ASN C C 7 175.200 175.200 177.061 -1.861 18016
4637 1 9 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.281 -0.081 18016
4638 1 9 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.231 -0.331 18016
4639 1 9 . 1 1 7 7 ASN H H 7 8.010 8.010 8.349 -0.339 18016
4640 1 9 . 1 1 8 8 ALA N N 8 126.500 126.500 126.092 0.408 18016
4641 1 9 . 1 1 8 8 ALA C C 8 180.200 180.200 179.563 0.637 18016
4642 1 9 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.339 0.161 18016
4643 1 9 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.892 -0.492 18016
4644 1 9 . 1 1 8 8 ALA H H 8 9.020 9.020 8.713 0.307 18016
4645 1 9 . 1 1 9 9 PHE N N 9 121.300 121.300 118.661 2.639 18016
4646 1 9 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.106 0.184 18016
4647 1 9 . 1 1 9 9 PHE C C 9 177.200 177.200 177.164 0.036 18016
4648 1 9 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.453 -0.153 18016
4649 1 9 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.112 0.088 18016
4650 1 9 . 1 1 9 9 PHE H H 9 8.570 8.570 8.479 0.091 18016
4651 1 9 . 1 1 10 10 LEU N N 10 117.200 117.200 119.524 -2.324 18016
4652 1 9 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.063 -0.363 18016
4653 1 9 . 1 1 10 10 LEU C C 10 179.700 179.700 179.117 0.583 18016
4654 1 9 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.128 0.472 18016
4655 1 9 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.611 0.089 18016
4656 1 9 . 1 1 10 10 LEU H H 10 8.150 8.150 7.773 0.377 18016
4657 1 9 . 1 1 11 11 ALA N N 11 121.500 121.500 122.224 -0.724 18016
4658 1 9 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.976 0.044 18016
4659 1 9 . 1 1 11 11 ALA C C 11 180.900 180.900 179.620 1.280 18016
4660 1 9 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.454 -0.454 18016
4661 1 9 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.094 -0.094 18016
4662 1 9 . 1 1 11 11 ALA H H 11 8.460 8.460 8.782 -0.322 18016
4663 1 9 . 1 1 12 12 LYS N N 12 120.700 120.700 119.746 0.954 18016
4664 1 9 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.049 0.001 18016
4665 1 9 . 1 1 12 12 LYS C C 12 179.700 179.700 178.842 0.858 18016
4666 1 9 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.761 0.438 18016
4667 1 9 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.000 -0.400 18016
4668 1 9 . 1 1 12 12 LYS H H 12 7.820 7.820 7.850 -0.030 18016
4669 1 9 . 1 1 13 13 ILE N N 13 120.100 120.100 119.400 0.700 18016
4670 1 9 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.816 -0.126 18016
4671 1 9 . 1 1 13 13 ILE C C 13 178.100 178.100 178.140 -0.040 18016
4672 1 9 . 1 1 13 13 ILE CA C 13 63.000 63.000 64.077 -1.077 18016
4673 1 9 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.768 -1.368 18016
4674 1 9 . 1 1 13 13 ILE H H 13 7.640 7.640 7.946 -0.306 18016
4675 1 9 . 1 1 14 14 ALA N N 14 122.700 122.700 122.244 0.456 18016
4676 1 9 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.961 -0.101 18016
4677 1 9 . 1 1 14 14 ALA C C 14 179.000 179.000 179.554 -0.554 18016
4678 1 9 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.529 0.471 18016
4679 1 9 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.040 -0.040 18016
4680 1 9 . 1 1 14 14 ALA H H 14 8.680 8.680 8.489 0.191 18016
4681 1 9 . 1 1 15 15 ALA N N 15 118.700 118.700 121.216 -2.516 18016
4682 1 9 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.116 -0.026 18016
4683 1 9 . 1 1 15 15 ALA C C 15 180.400 180.400 179.200 1.200 18016
4684 1 9 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.728 0.272 18016
4685 1 9 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.342 -0.642 18016
4686 1 9 . 1 1 15 15 ALA H H 15 8.070 8.070 8.039 0.031 18016
4687 1 9 . 1 1 16 16 TRP N N 16 122.900 122.900 121.283 1.617 18016
4688 1 9 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.243 0.317 18016
4689 1 9 . 1 1 16 16 TRP C C 16 178.400 178.400 178.018 0.382 18016
4690 1 9 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.279 -1.679 18016
4691 1 9 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.069 -0.769 18016
4692 1 9 . 1 1 16 16 TRP H H 16 7.820 7.820 8.182 -0.362 18016
4693 1 9 . 1 1 17 17 LEU N N 17 120.400 120.400 118.806 1.594 18016
4694 1 9 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.219 0.391 18016
4695 1 9 . 1 1 17 17 LEU C C 17 179.000 179.000 178.584 0.416 18016
4696 1 9 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.544 0.356 18016
4697 1 9 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.549 0.451 18016
4698 1 9 . 1 1 17 17 LEU H H 17 8.630 8.630 8.531 0.099 18016
4699 1 9 . 1 1 18 18 ASN N N 18 116.200 116.200 117.121 -0.921 18016
4700 1 9 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.603 -0.293 18016
4701 1 9 . 1 1 18 18 ASN C C 18 177.100 177.100 177.256 -0.156 18016
4702 1 9 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.924 -0.324 18016
4703 1 9 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.681 0.520 18016
4704 1 9 . 1 1 18 18 ASN H H 18 8.350 8.350 8.448 -0.098 18016
4705 1 9 . 1 1 19 19 ALA N N 19 119.600 119.600 119.611 -0.011 18016
4706 1 9 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.301 -0.211 18016
4707 1 9 . 1 1 19 19 ALA C C 19 180.100 180.100 178.649 1.451 18016
4708 1 9 . 1 1 19 19 ALA CA C 19 54.200 54.200 53.937 0.263 18016
4709 1 9 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.545 -0.945 18016
4710 1 9 . 1 1 19 19 ALA H H 19 7.920 7.920 7.860 0.060 18016
4711 1 9 . 1 1 20 20 GLY N N 20 103.500 103.500 105.356 -1.856 18016
4712 1 9 . 1 1 20 20 GLY C C 20 173.800 173.800 174.130 -0.330 18016
4713 1 9 . 1 1 20 20 GLY CA C 20 45.800 45.800 44.666 1.134 18016
4714 1 9 . 1 1 20 20 GLY H H 20 7.700 7.700 7.411 0.289 18016
4715 1 9 . 1 1 21 21 TYR N N 21 119.900 119.900 119.246 0.654 18016
4716 1 9 . 1 1 21 21 TYR HA H 21 5.170 5.170 5.023 0.147 18016
4717 1 9 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.530 1.870 18016
4718 1 9 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.796 -0.996 18016
4719 1 9 . 1 1 21 21 TYR H H 21 7.980 7.980 8.147 -0.167 18016
4720 1 9 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.616 -0.116 18016
4721 1 9 . 1 1 22 22 PRO C C 22 178.700 178.700 176.863 1.837 18016
4722 1 9 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.560 0.440 18016
4723 1 9 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.611 -0.611 18016
4724 1 9 . 1 1 23 23 GLU N N 23 116.300 116.300 116.920 -0.620 18016
4725 1 9 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.385 0.185 18016
4726 1 9 . 1 1 23 23 GLU C C 23 176.300 176.300 176.856 -0.556 18016
4727 1 9 . 1 1 23 23 GLU CA C 23 54.600 54.600 56.614 -2.014 18016
4728 1 9 . 1 1 23 23 GLU CB C 23 29.500 29.500 30.676 -1.176 18016
4729 1 9 . 1 1 23 23 GLU H H 23 8.680 8.680 8.158 0.522 18016
4730 1 9 . 1 1 24 24 GLY N N 24 108.100 108.100 108.137 -0.037 18016
4731 1 9 . 1 1 24 24 GLY C C 24 173.100 173.100 172.136 0.964 18016
4732 1 9 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.999 -2.099 18016
4733 1 9 . 1 1 24 24 GLY H H 24 7.230 7.230 7.813 -0.583 18016
4734 1 9 . 1 1 25 25 VAL N N 25 121.500 121.500 118.714 2.786 18016
4735 1 9 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.986 -0.396 18016
4736 1 9 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.062 1.238 18016
4737 1 9 . 1 1 25 25 VAL CB C 25 32.100 32.100 33.620 -1.520 18016
4738 1 9 . 1 1 25 25 VAL H H 25 8.050 8.050 8.025 0.025 18016
4739 1 9 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.441 -0.121 18016
4740 1 9 . 1 1 26 26 PRO C C 26 177.600 177.600 177.939 -0.339 18016
4741 1 9 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.297 0.603 18016
4742 1 9 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.062 0.038 18016
4743 1 9 . 1 1 27 27 GLY N N 27 109.000 109.000 109.182 -0.182 18016
4744 1 9 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.483 1.617 18016
4745 1 9 . 1 1 27 27 GLY H H 27 8.930 8.930 8.799 0.131 18016
4746 1 9 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.412 -0.022 18016
4747 1 9 . 1 1 28 28 PRO C C 28 175.800 175.800 176.461 -0.661 18016
4748 1 9 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.926 -0.526 18016
4749 1 9 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.300 0.600 18016
4750 1 9 . 1 1 29 29 ASP N N 29 115.000 115.000 117.681 -2.681 18016
4751 1 9 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.695 -0.205 18016
4752 1 9 . 1 1 29 29 ASP C C 29 177.000 177.000 177.803 -0.803 18016
4753 1 9 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.940 -2.039 18016
4754 1 9 . 1 1 29 29 ASP CB C 29 40.700 40.700 42.035 -1.335 18016
4755 1 9 . 1 1 29 29 ASP H H 29 7.760 7.760 7.751 0.009 18016
4756 1 9 . 1 1 30 30 ARG N N 30 119.900 119.900 121.630 -1.730 18016
4757 1 9 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.999 -0.429 18016
4758 1 9 . 1 1 30 30 ARG C C 30 176.500 176.500 178.681 -2.181 18016
4759 1 9 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.696 2.204 18016
4760 1 9 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.406 0.094 18016
4761 1 9 . 1 1 30 30 ARG H H 30 7.460 7.460 8.098 -0.638 18016
4762 1 9 . 1 1 31 31 VAL N N 31 117.600 117.600 120.298 -2.698 18016
4763 1 9 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.869 -0.049 18016
4764 1 9 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.490 0.209 18016
4765 1 9 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.477 -0.678 18016
4766 1 9 . 1 1 31 31 VAL H H 31 9.080 9.080 8.254 0.826 18016
4767 1 9 . 1 1 32 32 PRO C C 32 177.000 177.000 178.710 -1.710 18016
4768 1 9 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.881 -0.681 18016
4769 1 9 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.207 -0.407 18016
4770 1 9 . 1 1 33 33 LEU N N 33 115.200 115.200 120.887 -5.687 18016
4771 1 9 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.088 0.032 18016
4772 1 9 . 1 1 33 33 LEU C C 33 178.600 178.600 178.521 0.079 18016
4773 1 9 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.024 0.376 18016
4774 1 9 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.307 0.193 18016
4775 1 9 . 1 1 33 33 LEU H H 33 8.010 8.010 8.112 -0.102 18016
4776 1 9 . 1 1 34 34 LEU N N 34 120.400 120.400 119.277 1.123 18016
4777 1 9 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.046 -0.116 18016
4778 1 9 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.606 0.494 18016
4779 1 9 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.391 0.509 18016
4780 1 9 . 1 1 34 34 LEU H H 34 8.220 8.220 8.340 -0.120 18016
4781 1 9 . 1 1 35 35 ALA N N 35 123.100 123.100 122.476 0.624 18016
4782 1 9 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.144 -0.104 18016
4783 1 9 . 1 1 35 35 ALA C C 35 179.500 179.500 179.685 -0.185 18016
4784 1 9 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.888 0.612 18016
4785 1 9 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.442 -0.542 18016
4786 1 9 . 1 1 35 35 ALA H H 35 8.560 8.560 8.027 0.533 18016
4787 1 9 . 1 1 36 36 LEU N N 36 117.600 117.600 118.645 -1.045 18016
4788 1 9 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.241 -0.121 18016
4789 1 9 . 1 1 36 36 LEU C C 36 180.100 180.100 179.348 0.752 18016
4790 1 9 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.661 0.539 18016
4791 1 9 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.768 1.032 18016
4792 1 9 . 1 1 36 36 LEU H H 36 7.850 7.850 7.913 -0.063 18016
4793 1 9 . 1 1 37 37 LEU N N 37 116.700 116.700 120.198 -3.498 18016
4794 1 9 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.076 0.024 18016
4795 1 9 . 1 1 37 37 LEU C C 37 180.100 180.100 178.656 1.444 18016
4796 1 9 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.227 0.073 18016
4797 1 9 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.818 0.383 18016
4798 1 9 . 1 1 37 37 LEU H H 37 8.730 8.730 8.267 0.463 18016
4799 1 9 . 1 1 38 38 THR N N 38 110.600 110.600 108.415 2.185 18016
4800 1 9 . 1 1 38 38 THR HA H 38 4.440 4.440 4.078 0.362 18016
4801 1 9 . 1 1 38 38 THR C C 38 175.100 175.100 175.653 -0.553 18016
4802 1 9 . 1 1 38 38 THR CA C 38 64.200 64.200 64.086 0.114 18016
4803 1 9 . 1 1 38 38 THR CB C 38 70.000 70.000 68.736 1.264 18016
4804 1 9 . 1 1 38 38 THR H H 38 8.660 8.660 8.375 0.285 18016
4805 1 9 . 1 1 39 39 ARG N N 39 118.000 118.000 120.477 -2.477 18016
4806 1 9 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.167 0.113 18016
4807 1 9 . 1 1 39 39 ARG C C 39 177.300 177.300 177.775 -0.475 18016
4808 1 9 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.244 0.056 18016
4809 1 9 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.955 0.245 18016
4810 1 9 . 1 1 39 39 ARG H H 39 7.180 7.180 7.607 -0.427 18016
4811 1 9 . 1 1 40 40 ARG N N 40 114.400 114.400 115.117 -0.717 18016
4812 1 9 . 1 1 40 40 ARG C C 40 174.800 174.800 176.714 -1.914 18016
4813 1 9 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.132 -0.832 18016
4814 1 9 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.614 2.986 18016
4815 1 9 . 1 1 40 40 ARG H H 40 7.520 7.520 7.636 -0.116 18016
4816 1 9 . 1 1 41 41 LEU N N 41 119.400 119.400 121.827 -2.427 18016
4817 1 9 . 1 1 41 41 LEU C C 41 177.100 177.100 176.922 0.178 18016
4818 1 9 . 1 1 41 41 LEU CA C 41 53.700 53.700 55.256 -1.556 18016
4819 1 9 . 1 1 41 41 LEU CB C 41 44.400 44.400 42.046 2.354 18016
4820 1 9 . 1 1 41 41 LEU H H 41 8.380 8.380 7.869 0.511 18016
4821 1 9 . 1 1 42 42 THR N N 42 112.000 112.000 115.087 -3.087 18016
4822 1 9 . 1 1 42 42 THR HA H 42 4.440 4.440 4.332 0.108 18016
4823 1 9 . 1 1 42 42 THR C C 42 175.800 175.800 175.555 0.245 18016
4824 1 9 . 1 1 42 42 THR CA C 42 60.500 60.500 60.955 -0.455 18016
4825 1 9 . 1 1 42 42 THR CB C 42 70.800 70.800 70.382 0.419 18016
4826 1 9 . 1 1 42 42 THR H H 42 9.330 9.330 8.397 0.933 18016
4827 1 9 . 1 1 43 43 ASN N N 43 119.900 119.900 120.421 -0.521 18016
4828 1 9 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.381 -0.132 18016
4829 1 9 . 1 1 43 43 ASN C C 43 177.900 177.900 177.354 0.546 18016
4830 1 9 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.111 -0.411 18016
4831 1 9 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.138 -0.938 18016
4832 1 9 . 1 1 43 43 ASN H H 43 9.140 9.140 8.795 0.345 18016
4833 1 9 . 1 1 44 44 ASP N N 44 118.000 118.000 119.189 -1.189 18016
4834 1 9 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.366 0.034 18016
4835 1 9 . 1 1 44 44 ASP C C 44 179.600 179.600 178.318 1.282 18016
4836 1 9 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.823 -0.523 18016
4837 1 9 . 1 1 44 44 ASP H H 44 8.360 8.360 8.700 -0.340 18016
4838 1 9 . 1 1 45 45 GLU N N 45 122.600 122.600 119.995 2.605 18016
4839 1 9 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.088 -0.118 18016
4840 1 9 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.014 0.386 18016
4841 1 9 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.838 0.462 18016
4842 1 9 . 1 1 45 45 GLU H H 45 7.850 7.850 7.631 0.219 18016
4843 1 9 . 1 1 46 46 ILE N N 46 118.900 118.900 120.994 -2.094 18016
4844 1 9 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.750 -0.320 18016
4845 1 9 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.236 1.764 18016
4846 1 9 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.755 -0.055 18016
4847 1 9 . 1 1 46 46 ILE H H 46 8.290 8.290 8.469 -0.179 18016
4848 1 9 . 1 1 47 47 LYS N N 47 118.900 118.900 119.629 -0.729 18016
4849 1 9 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.907 -0.037 18016
4850 1 9 . 1 1 47 47 LYS C C 47 178.400 178.400 178.835 -0.435 18016
4851 1 9 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.891 0.409 18016
4852 1 9 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.181 0.419 18016
4853 1 9 . 1 1 47 47 LYS H H 47 8.290 8.290 8.159 0.131 18016
4854 1 9 . 1 1 48 48 ALA N N 48 121.100 121.100 122.580 -1.480 18016
4855 1 9 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.964 0.206 18016
4856 1 9 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.318 -0.218 18016
4857 1 9 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.233 -0.233 18016
4858 1 9 . 1 1 48 48 ALA H H 48 7.710 7.710 8.132 -0.422 18016
4859 1 9 . 1 1 49 49 ILE N N 49 119.900 119.900 117.515 2.385 18016
4860 1 9 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.785 -0.135 18016
4861 1 9 . 1 1 49 49 ILE C C 49 177.300 177.300 177.994 -0.694 18016
4862 1 9 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.321 1.679 18016
4863 1 9 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.427 1.673 18016
4864 1 9 . 1 1 49 49 ILE H H 49 8.130 8.130 8.299 -0.169 18016
4865 1 9 . 1 1 50 50 ALA N N 50 122.000 122.000 123.727 -1.727 18016
4866 1 9 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.949 -0.089 18016
4867 1 9 . 1 1 50 50 ALA C C 50 179.800 179.800 179.699 0.101 18016
4868 1 9 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.491 0.209 18016
4869 1 9 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.244 -0.344 18016
4870 1 9 . 1 1 50 50 ALA H H 50 8.730 8.730 7.656 1.074 18016
4871 1 9 . 1 1 51 51 GLU N N 51 116.900 116.900 117.408 -0.508 18016
4872 1 9 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.036 -0.016 18016
4873 1 9 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.264 0.136 18016
4874 1 9 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.419 0.081 18016
4875 1 9 . 1 1 51 51 GLU H H 51 8.220 8.220 8.363 -0.143 18016
4876 1 9 . 1 1 52 52 ASP N N 52 120.300 120.300 119.182 1.118 18016
4877 1 9 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.584 -0.194 18016
4878 1 9 . 1 1 52 52 ASP C C 52 178.900 178.900 178.915 -0.015 18016
4879 1 9 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.801 0.699 18016
4880 1 9 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.512 0.988 18016
4881 1 9 . 1 1 52 52 ASP H H 52 7.700 7.700 7.815 -0.115 18016
4882 1 9 . 1 1 53 53 LEU N N 53 118.300 118.300 120.285 -1.985 18016
4883 1 9 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.973 -0.243 18016
4884 1 9 . 1 1 53 53 LEU C C 53 179.000 179.000 178.742 0.258 18016
4885 1 9 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.435 0.065 18016
4886 1 9 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.598 -0.498 18016
4887 1 9 . 1 1 53 53 LEU H H 53 8.290 8.290 8.297 -0.007 18016
4888 1 9 . 1 1 54 54 GLU N N 54 118.700 118.700 118.995 -0.295 18016
4889 1 9 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.360 -0.140 18016
4890 1 9 . 1 1 54 54 GLU C C 54 178.200 178.200 178.045 0.155 18016
4891 1 9 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.650 0.050 18016
4892 1 9 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.394 0.506 18016
4893 1 9 . 1 1 54 54 GLU H H 54 8.070 8.070 8.147 -0.077 18016
4894 1 9 . 1 1 55 55 LYS N N 55 117.700 117.700 116.299 1.401 18016
4895 1 9 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.172 -0.022 18016
4896 1 9 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.023 1.277 18016
4897 1 9 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.166 0.534 18016
4898 1 9 . 1 1 55 55 LYS H H 55 7.750 7.750 7.821 -0.071 18016
4899 1 9 . 1 1 56 56 ARG N N 56 117.100 117.100 118.016 -0.916 18016
4900 1 9 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.328 -0.058 18016
4901 1 9 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.127 -0.327 18016
4902 1 9 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.437 -0.437 18016
4903 1 9 . 1 1 56 56 ARG H H 56 8.270 8.270 7.754 0.516 18016
4904 1 9 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.370 -0.010 18016
4905 1 9 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.076 0.024 18016
4906 1 9 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.722 -1.522 18016
4907 1 9 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.897 -0.387 18016
4908 1 9 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.740 0.460 18016
4909 1 9 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.686 -2.386 18016
4910 1 9 . 1 1 59 59 PHE N N 59 120.400 120.400 123.801 -3.401 18016
4911 1 9 . 1 1 59 59 PHE C C 59 175.500 175.500 176.408 -0.908 18016
4912 1 9 . 1 1 59 59 PHE CA C 59 57.200 57.200 58.273 -1.073 18016
4913 1 9 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.787 -0.487 18016
4914 1 9 . 1 1 59 59 PHE H H 59 7.710 7.710 8.646 -0.936 18016
4915 1 9 . 1 1 60 60 ASP N N 60 120.800 120.800 117.399 3.401 18016
4916 1 9 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.109 0.381 18016
4917 1 9 . 1 1 60 60 ASP CA C 60 54.300 54.300 57.283 -2.983 18016
4918 1 9 . 1 1 60 60 ASP CB C 60 41.100 41.100 39.515 1.585 18016
4919 1 9 . 1 1 60 60 ASP H H 60 8.180 8.180 8.640 -0.460 18016
4920 1 9 . 1 1 61 61 HIS N N 61 118.300 118.300 118.921 -0.621 18016
4921 1 9 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.561 -0.171 18016
4922 1 9 . 1 1 61 61 HIS CA C 61 56.700 56.700 57.746 -1.046 18016
4923 1 9 . 1 1 61 61 HIS CB C 61 28.800 28.800 30.325 -1.524 18016
4924 1 9 . 1 1 61 61 HIS H H 61 8.550 8.550 8.527 0.023 18016
4925 1 9 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.160 -0.150 18016
4926 1 9 . 1 1 62 62 ILE C C 62 173.800 173.800 175.509 -1.709 18016
4927 1 9 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.511 5.989 18016
4928 1 9 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.663 2.437 18016
4929 1 9 . 1 1 63 63 ASP N N 63 125.100 125.100 120.740 4.360 18016
4930 1 9 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.424 0.176 18016
4931 1 9 . 1 1 63 63 ASP CA C 63 52.800 52.800 54.402 -1.602 18016
4932 1 9 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.401 -1.901 18016
4933 1 9 . 1 1 63 63 ASP H H 63 8.360 8.360 7.480 0.880 18016
4934 1 9 . 1 1 64 64 ILE HA H 64 3.670 3.670 4.129 -0.459 18016
4935 1 9 . 1 1 64 64 ILE C C 64 177.000 177.000 176.254 0.746 18016
4936 1 9 . 1 1 64 64 ILE CA C 64 62.100 62.100 62.887 -0.787 18016
4937 1 9 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.725 -2.125 18016
4938 1 9 . 1 1 65 65 GLY N N 65 107.600 107.600 108.173 -0.573 18016
4939 1 9 . 1 1 65 65 GLY C C 65 177.000 177.000 175.781 1.219 18016
4940 1 9 . 1 1 65 65 GLY CA C 65 47.300 47.300 47.024 0.276 18016
4941 1 9 . 1 1 65 65 GLY H H 65 8.440 8.440 8.047 0.393 18016
4942 1 9 . 1 1 66 66 VAL N N 66 121.800 121.800 121.990 -0.190 18016
4943 1 9 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.612 0.148 18016
4944 1 9 . 1 1 66 66 VAL C C 66 178.500 178.500 177.718 0.782 18016
4945 1 9 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.335 0.265 18016
4946 1 9 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.656 0.344 18016
4947 1 9 . 1 1 66 66 VAL H H 66 7.550 7.550 7.675 -0.125 18016
4948 1 9 . 1 1 67 67 LEU N N 67 120.900 120.900 118.975 1.925 18016
4949 1 9 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.036 0.034 18016
4950 1 9 . 1 1 67 67 LEU C C 67 179.000 179.000 179.097 -0.097 18016
4951 1 9 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.538 0.062 18016
4952 1 9 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.618 1.682 18016
4953 1 9 . 1 1 67 67 LEU H H 67 7.650 7.650 7.402 0.248 18016
4954 1 9 . 1 1 68 68 ILE N N 68 118.900 118.900 117.658 1.242 18016
4955 1 9 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.788 -0.078 18016
4956 1 9 . 1 1 68 68 ILE C C 68 179.500 179.500 178.169 1.331 18016
4957 1 9 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.822 0.378 18016
4958 1 9 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.385 0.115 18016
4959 1 9 . 1 1 68 68 ILE H H 68 8.580 8.580 7.634 0.946 18016
4960 1 9 . 1 1 69 69 THR N N 69 118.100 118.100 114.828 3.272 18016
4961 1 9 . 1 1 69 69 THR HA H 69 3.940 3.940 4.041 -0.101 18016
4962 1 9 . 1 1 69 69 THR C C 69 176.200 176.200 175.632 0.568 18016
4963 1 9 . 1 1 69 69 THR CA C 69 66.600 66.600 66.073 0.527 18016
4964 1 9 . 1 1 69 69 THR CB C 69 68.500 68.500 68.321 0.179 18016
4965 1 9 . 1 1 69 69 THR H H 69 7.840 7.840 7.708 0.132 18016
4966 1 9 . 1 1 70 70 GLN N N 70 121.600 121.600 119.733 1.867 18016
4967 1 9 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.168 -0.058 18016
4968 1 9 . 1 1 70 70 GLN C C 70 178.100 178.100 177.969 0.131 18016
4969 1 9 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.383 0.717 18016
4970 1 9 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.912 -0.612 18016
4971 1 9 . 1 1 70 70 GLN H H 70 8.100 8.100 7.558 0.542 18016
4972 1 9 . 1 1 71 71 MET N N 71 118.700 118.700 119.275 -0.575 18016
4973 1 9 . 1 1 71 71 MET HA H 71 4.010 4.010 4.546 -0.536 18016
4974 1 9 . 1 1 71 71 MET C C 71 176.300 176.300 178.962 -2.662 18016
4975 1 9 . 1 1 71 71 MET CA C 71 58.100 58.100 58.775 -0.675 18016
4976 1 9 . 1 1 71 71 MET CB C 71 33.600 33.600 32.676 0.924 18016
4977 1 9 . 1 1 71 71 MET H H 71 8.350 8.350 8.571 -0.221 18016
4978 1 9 . 1 1 72 72 THR N N 72 111.600 111.600 112.660 -1.060 18016
4979 1 9 . 1 1 72 72 THR HA H 72 3.940 3.940 4.146 -0.206 18016
4980 1 9 . 1 1 72 72 THR C C 72 175.800 175.800 175.353 0.447 18016
4981 1 9 . 1 1 72 72 THR CA C 72 65.300 65.300 65.206 0.095 18016
4982 1 9 . 1 1 72 72 THR CB C 72 69.100 69.100 69.043 0.057 18016
4983 1 9 . 1 1 72 72 THR H H 72 7.840 7.840 7.920 -0.080 18016
4984 1 9 . 1 1 73 73 ASP N N 73 121.100 121.100 119.341 1.759 18016
4985 1 9 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.739 -0.209 18016
4986 1 9 . 1 1 73 73 ASP C C 73 176.600 176.600 175.540 1.060 18016
4987 1 9 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.035 1.165 18016
4988 1 9 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.764 -1.364 18016
4989 1 9 . 1 1 73 73 ASP H H 73 7.840 7.840 7.689 0.151 18016
4990 1 9 . 1 1 74 74 GLU N N 74 121.100 121.100 119.159 1.941 18016
4991 1 9 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.590 -0.250 18016
4992 1 9 . 1 1 74 74 GLU C C 74 173.800 173.800 174.994 -1.194 18016
4993 1 9 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.574 -0.074 18016
4994 1 9 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.933 -1.333 18016
4995 1 9 . 1 1 74 74 GLU H H 74 7.980 7.980 8.251 -0.271 18016
4996 1 9 . 1 1 75 75 MET N N 75 125.800 125.800 126.927 -1.127 18016
4997 1 9 . 1 1 75 75 MET HA H 75 4.710 4.710 4.615 0.095 18016
4998 1 9 . 1 1 75 75 MET CA C 75 53.800 53.800 54.114 -0.314 18016
4999 1 9 . 1 1 75 75 MET CB C 75 31.700 31.700 31.951 -0.251 18016
5000 1 9 . 1 1 75 75 MET H H 75 8.380 8.380 8.780 -0.400 18016
5001 1 9 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.356 0.154 18016
5002 1 9 . 1 1 76 76 PRO C C 76 175.700 175.700 176.436 -0.736 18016
5003 1 9 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.699 -1.699 18016
5004 1 9 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.332 -0.532 18016
5005 1 9 . 1 1 77 77 ARG N N 77 119.700 119.700 117.863 1.837 18016
5006 1 9 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.672 -0.402 18016
5007 1 9 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.904 0.896 18016
5008 1 9 . 1 1 77 77 ARG CB C 77 30.700 30.700 31.979 -1.279 18016
5009 1 9 . 1 1 77 77 ARG H H 77 8.940 8.940 8.023 0.917 18016
5010 1 9 . 1 1 78 78 GLU N N 78 124.700 124.700 125.861 -1.161 18016
5011 1 9 . 1 1 78 78 GLU HA H 78 3.960 3.960 4.042 -0.082 18016
5012 1 9 . 1 1 78 78 GLU C C 78 179.000 179.000 178.235 0.765 18016
5013 1 9 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.106 -0.306 18016
5014 1 9 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.413 -0.413 18016
5015 1 9 . 1 1 78 78 GLU H H 78 9.170 9.170 8.958 0.212 18016
5016 1 9 . 1 1 79 79 GLU N N 79 116.800 116.800 119.377 -2.577 18016
5017 1 9 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.189 -0.069 18016
5018 1 9 . 1 1 79 79 GLU C C 79 179.100 179.100 178.282 0.818 18016
5019 1 9 . 1 1 79 79 GLU CA C 79 59.700 59.700 60.021 -0.321 18016
5020 1 9 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.196 -0.196 18016
5021 1 9 . 1 1 79 79 GLU H H 79 9.660 9.660 8.549 1.111 18016
5022 1 9 . 1 1 80 80 ASP N N 80 120.000 120.000 119.839 0.161 18016
5023 1 9 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.469 0.221 18016
5024 1 9 . 1 1 80 80 ASP C C 80 177.300 177.300 178.489 -1.189 18016
5025 1 9 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.955 -0.555 18016
5026 1 9 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.496 1.104 18016
5027 1 9 . 1 1 80 80 ASP H H 80 7.310 7.310 8.211 -0.901 18016
5028 1 9 . 1 1 81 81 ILE N N 81 120.100 120.100 120.781 -0.681 18016
5029 1 9 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.639 -0.149 18016
5030 1 9 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.893 0.407 18016
5031 1 9 . 1 1 81 81 ILE CB C 81 38.300 38.300 38.043 0.257 18016
5032 1 9 . 1 1 81 81 ILE H H 81 7.610 7.610 8.334 -0.724 18016
5033 1 9 . 1 1 82 82 GLU N N 82 118.100 118.100 118.564 -0.464 18016
5034 1 9 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.054 0.226 18016
5035 1 9 . 1 1 82 82 GLU C C 82 177.800 177.800 178.708 -0.908 18016
5036 1 9 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.281 -1.281 18016
5037 1 9 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.026 -0.226 18016
5038 1 9 . 1 1 82 82 GLU H H 82 8.550 8.550 8.616 -0.066 18016
5039 1 9 . 1 1 83 83 ARG N N 83 119.900 119.900 121.246 -1.346 18016
5040 1 9 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.063 -0.033 18016
5041 1 9 . 1 1 83 83 ARG C C 83 179.400 179.400 178.574 0.826 18016
5042 1 9 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.309 0.591 18016
5043 1 9 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.164 -0.564 18016
5044 1 9 . 1 1 83 83 ARG H H 83 7.590 7.590 7.830 -0.240 18016
5045 1 9 . 1 1 84 84 VAL N N 84 120.400 120.400 119.860 0.540 18016
5046 1 9 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.946 -0.196 18016
5047 1 9 . 1 1 84 84 VAL C C 84 177.400 177.400 177.774 -0.374 18016
5048 1 9 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.756 1.144 18016
5049 1 9 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.048 -0.148 18016
5050 1 9 . 1 1 84 84 VAL H H 84 7.550 7.550 8.490 -0.940 18016
5051 1 9 . 1 1 85 85 ARG N N 85 121.600 121.600 119.827 1.773 18016
5052 1 9 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.235 -0.225 18016
5053 1 9 . 1 1 85 85 ARG C C 85 178.100 178.100 178.850 -0.750 18016
5054 1 9 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.906 0.994 18016
5055 1 9 . 1 1 85 85 ARG CB C 85 30.200 30.200 30.039 0.161 18016
5056 1 9 . 1 1 85 85 ARG H H 85 9.090 9.090 8.461 0.629 18016
5057 1 9 . 1 1 86 86 ARG N N 86 115.600 115.600 118.537 -2.937 18016
5058 1 9 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.096 -0.216 18016
5059 1 9 . 1 1 86 86 ARG C C 86 179.000 179.000 178.558 0.442 18016
5060 1 9 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.071 0.329 18016
5061 1 9 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.362 1.038 18016
5062 1 9 . 1 1 86 86 ARG H H 86 8.660 8.660 8.442 0.218 18016
5063 1 9 . 1 1 87 87 HIS N N 87 118.000 118.000 120.141 -2.141 18016
5064 1 9 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.326 0.034 18016
5065 1 9 . 1 1 87 87 HIS C C 87 178.400 178.400 177.650 0.750 18016
5066 1 9 . 1 1 87 87 HIS CA C 87 59.600 59.600 58.380 1.220 18016
5067 1 9 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.287 0.413 18016
5068 1 9 . 1 1 87 87 HIS H H 87 7.640 7.640 7.704 -0.064 18016
5069 1 9 . 1 1 88 88 LEU N N 88 119.600 119.600 119.346 0.254 18016
5070 1 9 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.074 -0.494 18016
5071 1 9 . 1 1 88 88 LEU C C 88 180.000 180.000 178.710 1.290 18016
5072 1 9 . 1 1 88 88 LEU CA C 88 57.200 57.200 56.684 0.516 18016
5073 1 9 . 1 1 88 88 LEU CB C 88 42.600 42.600 40.953 1.647 18016
5074 1 9 . 1 1 88 88 LEU H H 88 8.650 8.650 8.460 0.190 18016
5075 1 9 . 1 1 89 89 ALA N N 89 118.500 118.500 122.291 -3.791 18016
5076 1 9 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.682 0.678 18016
5077 1 9 . 1 1 89 89 ALA C C 89 180.400 180.400 179.632 0.768 18016
5078 1 9 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.896 -1.296 18016
5079 1 9 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.418 -0.318 18016
5080 1 9 . 1 1 89 89 ALA H H 89 8.870 8.870 8.286 0.584 18016
5081 1 9 . 1 1 90 90 LEU N N 90 119.400 119.400 116.929 2.471 18016
5082 1 9 . 1 1 90 90 LEU HA H 90 4.210 4.210 4.034 0.176 18016
5083 1 9 . 1 1 90 90 LEU C C 90 179.100 179.100 179.143 -0.043 18016
5084 1 9 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.111 0.389 18016
5085 1 9 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.851 -0.151 18016
5086 1 9 . 1 1 90 90 LEU H H 90 7.390 7.390 7.630 -0.240 18016
5087 1 9 . 1 1 91 91 GLN N N 91 114.500 114.500 115.921 -1.421 18016
5088 1 9 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.366 0.334 18016
5089 1 9 . 1 1 91 91 GLN C C 91 175.800 175.800 176.895 -1.095 18016
5090 1 9 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.608 -2.108 18016
5091 1 9 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.186 -2.086 18016
5092 1 9 . 1 1 91 91 GLN H H 91 7.810 7.810 7.895 -0.085 18016
5093 1 9 . 1 1 92 92 GLY N N 92 107.900 107.900 105.256 2.644 18016
5094 1 9 . 1 1 92 92 GLY C C 92 172.100 172.100 171.619 0.481 18016
5095 1 9 . 1 1 92 92 GLY CA C 92 44.000 44.000 44.861 -0.861 18016
5096 1 9 . 1 1 92 92 GLY H H 92 7.710 7.710 8.202 -0.492 18016
5097 1 9 . 1 1 93 93 TRP N N 93 114.200 114.200 122.078 -7.878 18016
5098 1 9 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.253 1.747 18016
5099 1 9 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.664 -1.464 18016
5100 1 9 . 1 1 93 93 TRP H H 93 8.450 8.450 8.357 0.093 18016
5101 1 9 . 1 1 94 94 PRO HA H 94 4.460 4.460 3.979 0.481 18016
5102 1 9 . 1 1 94 94 PRO CA C 94 62.800 62.800 64.200 -1.400 18016
5103 1 9 . 1 1 94 94 PRO CB C 94 31.600 31.600 30.929 0.671 18016
5104 1 9 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.229 -0.729 18016
5105 1 9 . 1 1 95 95 LEU C C 95 175.000 175.000 177.799 -2.799 18016
5106 1 9 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.224 -0.124 18016
5107 1 9 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.529 1.571 18016
5108 1 9 . 1 1 96 96 ASP N N 96 114.000 114.000 119.207 -5.207 18016
5109 1 9 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.641 0.309 18016
5110 1 9 . 1 1 96 96 ASP C C 96 175.800 175.800 176.212 -0.412 18016
5111 1 9 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.283 -2.283 18016
5112 1 9 . 1 1 96 96 ASP CB C 96 41.900 41.900 42.327 -0.427 18016
5113 1 9 . 1 1 96 96 ASP H H 96 7.230 7.230 7.523 -0.293 18016
5114 1 9 . 1 1 97 97 ASP N N 97 123.200 123.200 118.952 4.248 18016
5115 1 9 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.994 -0.384 18016
5116 1 9 . 1 1 97 97 ASP CA C 97 53.500 53.500 50.877 2.623 18016
5117 1 9 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.754 -4.054 18016
5118 1 9 . 1 1 97 97 ASP H H 97 7.420 7.420 7.746 -0.326 18016
5119 1 9 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.432 -0.142 18016
5120 1 9 . 1 1 98 98 PRO C C 98 177.500 177.500 176.670 0.830 18016
5121 1 9 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.229 0.471 18016
5122 1 9 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.473 -1.573 18016
5123 1 9 . 1 1 99 99 ARG N N 99 121.300 121.300 121.119 0.181 18016
5124 1 9 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.081 -0.371 18016
5125 1 9 . 1 1 99 99 ARG C C 99 176.500 176.500 176.019 0.481 18016
5126 1 9 . 1 1 99 99 ARG CA C 99 56.100 56.100 56.947 -0.847 18016
5127 1 9 . 1 1 99 99 ARG CB C 99 30.500 30.500 29.724 0.777 18016
5128 1 9 . 1 1 99 99 ARG H H 99 8.390 8.390 8.006 0.384 18016
5129 1 9 . 1 1 100 100 ASP N N 100 119.600 119.600 119.511 0.089 18016
5130 1 9 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.351 0.149 18016
5131 1 9 . 1 1 100 100 ASP C C 100 177.000 177.000 177.332 -0.332 18016
5132 1 9 . 1 1 100 100 ASP CA C 100 54.700 54.700 54.973 -0.273 18016
5133 1 9 . 1 1 100 100 ASP CB C 100 40.900 40.900 40.704 0.196 18016
5134 1 9 . 1 1 100 100 ASP H H 100 8.260 8.260 7.753 0.507 18016
5135 1 9 . 1 1 101 101 GLY N N 101 109.300 109.300 113.597 -4.297 18016
5136 1 9 . 1 1 101 101 GLY CA C 101 45.400 45.400 45.157 0.243 18016
5137 1 9 . 1 1 101 101 GLY H H 101 8.450 8.450 8.571 -0.121 18016
5138 1 9 . 1 1 102 102 GLU N N 102 119.800 119.800 120.237 -0.437 18016
5139 1 9 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.517 -0.207 18016
5140 1 9 . 1 1 102 102 GLU CA C 102 56.000 56.000 54.752 1.248 18016
5141 1 9 . 1 1 102 102 GLU CB C 102 30.500 30.500 29.936 0.564 18016
5142 1 9 . 1 1 102 102 GLU H H 102 8.140 8.140 7.940 0.200 18016
5143 1 9 . 1 1 103 103 GLU N N 103 123.000 123.000 124.611 -1.611 18016
5144 1 9 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.373 0.187 18016
5145 1 9 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.920 -0.620 18016
5146 1 9 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.255 0.345 18016
5147 1 9 . 1 1 103 103 GLU H H 103 8.580 8.580 8.562 0.018 18016
5148 1 9 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.372 0.108 18016
5149 1 9 . 1 1 104 104 PRO C C 104 176.800 176.800 175.289 1.511 18016
5150 1 9 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.081 0.319 18016
5151 1 9 . 1 1 104 104 PRO CB C 104 32.100 32.100 30.491 1.609 18016
5152 1 9 . 1 1 105 105 ASP N N 105 120.400 120.400 119.388 1.012 18016
5153 1 9 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.639 -0.059 18016
5154 1 9 . 1 1 105 105 ASP C C 105 177.100 177.100 176.110 0.990 18016
5155 1 9 . 1 1 105 105 ASP CA C 105 54.300 54.300 53.513 0.787 18016
5156 1 9 . 1 1 105 105 ASP CB C 105 41.400 41.400 40.853 0.547 18016
5157 1 9 . 1 1 105 105 ASP H H 105 8.500 8.500 7.767 0.733 18016
5158 1 9 . 1 1 106 106 GLY N N 106 109.300 109.300 111.679 -2.379 18016
5159 1 9 . 1 1 106 106 GLY C C 106 174.600 174.600 174.591 0.009 18016
5160 1 9 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.053 0.347 18016
5161 1 9 . 1 1 106 106 GLY H H 106 8.360 8.360 8.748 -0.388 18016
5162 1 9 . 1 1 107 107 GLU N N 107 120.400 120.400 118.754 1.646 18016
5163 1 9 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.028 0.312 18016
5164 1 9 . 1 1 107 107 GLU C C 107 177.100 177.100 175.606 1.494 18016
5165 1 9 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.472 0.028 18016
5166 1 9 . 1 1 107 107 GLU CB C 107 30.200 30.200 28.119 2.080 18016
5167 1 9 . 1 1 107 107 GLU H H 107 8.410 8.410 8.534 -0.124 18016
5168 1 9 . 1 1 108 108 SER N N 108 116.600 116.600 114.298 2.302 18016
5169 1 9 . 1 1 108 108 SER HA H 108 4.450 4.450 4.377 0.073 18016
5170 1 9 . 1 1 108 108 SER C C 108 175.300 175.300 176.297 -0.997 18016
5171 1 9 . 1 1 108 108 SER CA C 108 58.700 58.700 58.928 -0.228 18016
5172 1 9 . 1 1 108 108 SER CB C 108 63.800 63.800 63.600 0.200 18016
5173 1 9 . 1 1 108 108 SER H H 108 8.460 8.460 8.017 0.443 18016
5174 1 9 . 1 1 109 109 GLY N N 109 110.800 110.800 112.295 -1.495 18016
5175 1 9 . 1 1 109 109 GLY C C 109 174.500 174.500 174.746 -0.246 18016
5176 1 9 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.763 -0.463 18016
5177 1 9 . 1 1 109 109 GLY H H 109 8.500 8.500 8.825 -0.325 18016
5178 1 9 . 1 1 110 110 GLY N N 110 108.800 108.800 108.306 0.494 18016
5179 1 9 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.265 -0.865 18016
5180 1 9 . 1 1 110 110 GLY H H 110 8.140 8.140 8.443 -0.303 18016
5181 1 9 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.840 -0.230 18016
5182 1 9 . 1 1 111 111 PRO C C 111 176.000 176.000 176.696 -0.696 18016
5183 1 9 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.550 0.050 18016
5184 1 9 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.529 2.071 18016
5185 1 10 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.403 0.027 18016
5186 1 10 . 1 1 2 2 PRO C C 2 177.600 177.600 176.216 1.384 18016
5187 1 10 . 1 1 2 2 PRO CA C 2 63.300 63.300 63.394 -0.094 18016
5188 1 10 . 1 1 2 2 PRO CB C 2 32.300 32.300 31.242 1.058 18016
5189 1 10 . 1 1 3 3 GLY N N 3 110.000 110.000 112.534 -2.534 18016
5190 1 10 . 1 1 3 3 GLY C C 3 174.200 174.200 174.149 0.051 18016
5191 1 10 . 1 1 3 3 GLY CA C 3 45.400 45.400 46.044 -0.644 18016
5192 1 10 . 1 1 3 3 GLY H H 3 8.700 8.700 8.195 0.505 18016
5193 1 10 . 1 1 4 4 SER N N 4 115.400 115.400 121.114 -5.714 18016
5194 1 10 . 1 1 4 4 SER HA H 4 4.440 4.440 4.796 -0.356 18016
5195 1 10 . 1 1 4 4 SER C C 4 174.800 174.800 174.839 -0.039 18016
5196 1 10 . 1 1 4 4 SER CA C 4 58.400 58.400 58.223 0.177 18016
5197 1 10 . 1 1 4 4 SER CB C 4 63.800 63.800 62.716 1.084 18016
5198 1 10 . 1 1 4 4 SER H H 4 8.210 8.210 8.298 -0.088 18016
5199 1 10 . 1 1 5 5 MET N N 5 122.200 122.200 129.618 -7.418 18016
5200 1 10 . 1 1 5 5 MET HA H 5 4.510 4.510 4.760 -0.250 18016
5201 1 10 . 1 1 5 5 MET CA C 5 55.600 55.600 54.602 0.998 18016
5202 1 10 . 1 1 5 5 MET CB C 5 32.900 32.900 32.143 0.757 18016
5203 1 10 . 1 1 5 5 MET H H 5 8.570 8.570 7.960 0.610 18016
5204 1 10 . 1 1 6 6 VAL N N 6 120.000 120.000 119.269 0.731 18016
5205 1 10 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.534 -0.484 18016
5206 1 10 . 1 1 6 6 VAL C C 6 175.700 175.700 174.980 0.720 18016
5207 1 10 . 1 1 6 6 VAL CA C 6 62.700 62.700 59.801 2.899 18016
5208 1 10 . 1 1 6 6 VAL CB C 6 32.500 32.500 34.358 -1.857 18016
5209 1 10 . 1 1 6 6 VAL H H 6 8.150 8.150 7.744 0.406 18016
5210 1 10 . 1 1 7 7 ASN N N 7 122.000 122.000 118.737 3.263 18016
5211 1 10 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.681 -0.021 18016
5212 1 10 . 1 1 7 7 ASN C C 7 175.200 175.200 176.825 -1.625 18016
5213 1 10 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.223 -0.023 18016
5214 1 10 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.423 -0.523 18016
5215 1 10 . 1 1 7 7 ASN H H 7 8.010 8.010 8.360 -0.350 18016
5216 1 10 . 1 1 8 8 ALA N N 8 126.500 126.500 127.550 -1.050 18016
5217 1 10 . 1 1 8 8 ALA C C 8 180.200 180.200 179.324 0.876 18016
5218 1 10 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.324 0.176 18016
5219 1 10 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.853 -0.453 18016
5220 1 10 . 1 1 8 8 ALA H H 8 9.020 9.020 8.618 0.402 18016
5221 1 10 . 1 1 9 9 PHE N N 9 121.300 121.300 117.923 3.377 18016
5222 1 10 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.115 0.175 18016
5223 1 10 . 1 1 9 9 PHE C C 9 177.200 177.200 177.150 0.050 18016
5224 1 10 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.420 -0.120 18016
5225 1 10 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.977 0.223 18016
5226 1 10 . 1 1 9 9 PHE H H 9 8.570 8.570 8.242 0.328 18016
5227 1 10 . 1 1 10 10 LEU N N 10 117.200 117.200 119.148 -1.948 18016
5228 1 10 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.781 -0.081 18016
5229 1 10 . 1 1 10 10 LEU C C 10 179.700 179.700 179.114 0.586 18016
5230 1 10 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.091 0.509 18016
5231 1 10 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.191 0.509 18016
5232 1 10 . 1 1 10 10 LEU H H 10 8.150 8.150 7.842 0.308 18016
5233 1 10 . 1 1 11 11 ALA N N 11 121.500 121.500 122.952 -1.452 18016
5234 1 10 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.918 0.102 18016
5235 1 10 . 1 1 11 11 ALA C C 11 180.900 180.900 179.770 1.130 18016
5236 1 10 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.372 -0.372 18016
5237 1 10 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.450 -0.450 18016
5238 1 10 . 1 1 11 11 ALA H H 11 8.460 8.460 8.384 0.076 18016
5239 1 10 . 1 1 12 12 LYS N N 12 120.700 120.700 118.265 2.435 18016
5240 1 10 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.044 0.006 18016
5241 1 10 . 1 1 12 12 LYS C C 12 179.700 179.700 179.143 0.557 18016
5242 1 10 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.504 0.696 18016
5243 1 10 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.765 -0.165 18016
5244 1 10 . 1 1 12 12 LYS H H 12 7.820 7.820 7.657 0.163 18016
5245 1 10 . 1 1 13 13 ILE N N 13 120.100 120.100 120.132 -0.032 18016
5246 1 10 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.824 -0.134 18016
5247 1 10 . 1 1 13 13 ILE C C 13 178.100 178.100 178.166 -0.066 18016
5248 1 10 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.516 -0.516 18016
5249 1 10 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.291 -0.891 18016
5250 1 10 . 1 1 13 13 ILE H H 13 7.640 7.640 7.945 -0.305 18016
5251 1 10 . 1 1 14 14 ALA N N 14 122.700 122.700 122.350 0.350 18016
5252 1 10 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.956 -0.096 18016
5253 1 10 . 1 1 14 14 ALA C C 14 179.000 179.000 179.577 -0.577 18016
5254 1 10 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.480 0.520 18016
5255 1 10 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.029 -0.029 18016
5256 1 10 . 1 1 14 14 ALA H H 14 8.680 8.680 8.458 0.222 18016
5257 1 10 . 1 1 15 15 ALA N N 15 118.700 118.700 121.610 -2.910 18016
5258 1 10 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.065 0.025 18016
5259 1 10 . 1 1 15 15 ALA C C 15 180.400 180.400 178.945 1.455 18016
5260 1 10 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.798 0.202 18016
5261 1 10 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.421 -0.721 18016
5262 1 10 . 1 1 15 15 ALA H H 15 8.070 8.070 8.119 -0.049 18016
5263 1 10 . 1 1 16 16 TRP N N 16 122.900 122.900 121.227 1.673 18016
5264 1 10 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.297 0.263 18016
5265 1 10 . 1 1 16 16 TRP C C 16 178.400 178.400 177.829 0.571 18016
5266 1 10 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.244 -1.644 18016
5267 1 10 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.175 -0.875 18016
5268 1 10 . 1 1 16 16 TRP H H 16 7.820 7.820 8.207 -0.387 18016
5269 1 10 . 1 1 17 17 LEU N N 17 120.400 120.400 119.673 0.727 18016
5270 1 10 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.260 0.350 18016
5271 1 10 . 1 1 17 17 LEU C C 17 179.000 179.000 178.735 0.265 18016
5272 1 10 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.718 0.182 18016
5273 1 10 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.692 0.308 18016
5274 1 10 . 1 1 17 17 LEU H H 17 8.630 8.630 8.458 0.172 18016
5275 1 10 . 1 1 18 18 ASN N N 18 116.200 116.200 117.272 -1.072 18016
5276 1 10 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.551 -0.240 18016
5277 1 10 . 1 1 18 18 ASN C C 18 177.100 177.100 177.290 -0.190 18016
5278 1 10 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.934 -0.334 18016
5279 1 10 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.965 0.235 18016
5280 1 10 . 1 1 18 18 ASN H H 18 8.350 8.350 8.350 -0.000 18016
5281 1 10 . 1 1 19 19 ALA N N 19 119.600 119.600 120.759 -1.159 18016
5282 1 10 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.195 -0.105 18016
5283 1 10 . 1 1 19 19 ALA C C 19 180.100 180.100 178.866 1.234 18016
5284 1 10 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.281 -0.081 18016
5285 1 10 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.480 -0.880 18016
5286 1 10 . 1 1 19 19 ALA H H 19 7.920 7.920 8.204 -0.284 18016
5287 1 10 . 1 1 20 20 GLY N N 20 103.500 103.500 104.621 -1.121 18016
5288 1 10 . 1 1 20 20 GLY C C 20 173.800 173.800 173.290 0.510 18016
5289 1 10 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.137 0.663 18016
5290 1 10 . 1 1 20 20 GLY H H 20 7.700 7.700 7.417 0.283 18016
5291 1 10 . 1 1 21 21 TYR N N 21 119.900 119.900 118.611 1.289 18016
5292 1 10 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.935 0.235 18016
5293 1 10 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.403 0.998 18016
5294 1 10 . 1 1 21 21 TYR CB C 21 37.800 37.800 39.170 -1.370 18016
5295 1 10 . 1 1 21 21 TYR H H 21 7.980 7.980 7.844 0.136 18016
5296 1 10 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.524 -0.024 18016
5297 1 10 . 1 1 22 22 PRO C C 22 178.700 178.700 177.992 0.708 18016
5298 1 10 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.368 0.632 18016
5299 1 10 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.574 -0.574 18016
5300 1 10 . 1 1 23 23 GLU N N 23 116.300 116.300 116.966 -0.666 18016
5301 1 10 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.270 0.300 18016
5302 1 10 . 1 1 23 23 GLU C C 23 176.300 176.300 176.711 -0.411 18016
5303 1 10 . 1 1 23 23 GLU CA C 23 54.600 54.600 56.019 -1.419 18016
5304 1 10 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.333 0.167 18016
5305 1 10 . 1 1 23 23 GLU H H 23 8.680 8.680 8.401 0.279 18016
5306 1 10 . 1 1 24 24 GLY N N 24 108.100 108.100 108.747 -0.647 18016
5307 1 10 . 1 1 24 24 GLY C C 24 173.100 173.100 172.983 0.117 18016
5308 1 10 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.354 -1.454 18016
5309 1 10 . 1 1 24 24 GLY H H 24 7.230 7.230 7.285 -0.055 18016
5310 1 10 . 1 1 25 25 VAL N N 25 121.500 121.500 120.425 1.075 18016
5311 1 10 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.776 -0.186 18016
5312 1 10 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.717 0.583 18016
5313 1 10 . 1 1 25 25 VAL CB C 25 32.100 32.100 31.765 0.335 18016
5314 1 10 . 1 1 25 25 VAL H H 25 8.050 8.050 7.862 0.188 18016
5315 1 10 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.453 -0.133 18016
5316 1 10 . 1 1 26 26 PRO C C 26 177.600 177.600 178.023 -0.423 18016
5317 1 10 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.741 0.159 18016
5318 1 10 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.124 -0.024 18016
5319 1 10 . 1 1 27 27 GLY N N 27 109.000 109.000 109.647 -0.647 18016
5320 1 10 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.713 1.387 18016
5321 1 10 . 1 1 27 27 GLY H H 27 8.930 8.930 8.837 0.093 18016
5322 1 10 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.285 0.105 18016
5323 1 10 . 1 1 28 28 PRO C C 28 175.800 175.800 176.538 -0.738 18016
5324 1 10 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.366 0.034 18016
5325 1 10 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.454 0.446 18016
5326 1 10 . 1 1 29 29 ASP N N 29 115.000 115.000 117.496 -2.496 18016
5327 1 10 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.743 -0.253 18016
5328 1 10 . 1 1 29 29 ASP C C 29 177.000 177.000 178.051 -1.051 18016
5329 1 10 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.789 -1.889 18016
5330 1 10 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.356 -0.656 18016
5331 1 10 . 1 1 29 29 ASP H H 29 7.760 7.760 7.749 0.011 18016
5332 1 10 . 1 1 30 30 ARG N N 30 119.900 119.900 121.821 -1.921 18016
5333 1 10 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.934 -0.364 18016
5334 1 10 . 1 1 30 30 ARG C C 30 176.500 176.500 178.553 -2.053 18016
5335 1 10 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.739 2.161 18016
5336 1 10 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.216 0.284 18016
5337 1 10 . 1 1 30 30 ARG H H 30 7.460 7.460 8.151 -0.691 18016
5338 1 10 . 1 1 31 31 VAL N N 31 117.600 117.600 119.472 -1.872 18016
5339 1 10 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.919 -0.099 18016
5340 1 10 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.040 0.660 18016
5341 1 10 . 1 1 31 31 VAL CB C 31 28.800 28.800 28.575 0.225 18016
5342 1 10 . 1 1 31 31 VAL H H 31 9.080 9.080 8.273 0.807 18016
5343 1 10 . 1 1 32 32 PRO C C 32 177.000 177.000 179.019 -2.019 18016
5344 1 10 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.799 -0.599 18016
5345 1 10 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.233 -0.433 18016
5346 1 10 . 1 1 33 33 LEU N N 33 115.200 115.200 120.960 -5.760 18016
5347 1 10 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.105 0.015 18016
5348 1 10 . 1 1 33 33 LEU C C 33 178.600 178.600 178.568 0.032 18016
5349 1 10 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.052 0.348 18016
5350 1 10 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.329 0.171 18016
5351 1 10 . 1 1 33 33 LEU H H 33 8.010 8.010 8.103 -0.093 18016
5352 1 10 . 1 1 34 34 LEU N N 34 120.400 120.400 119.117 1.283 18016
5353 1 10 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.080 -0.150 18016
5354 1 10 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.443 0.657 18016
5355 1 10 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.342 0.559 18016
5356 1 10 . 1 1 34 34 LEU H H 34 8.220 8.220 8.476 -0.256 18016
5357 1 10 . 1 1 35 35 ALA N N 35 123.100 123.100 122.608 0.492 18016
5358 1 10 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.067 -0.027 18016
5359 1 10 . 1 1 35 35 ALA C C 35 179.500 179.500 179.080 0.420 18016
5360 1 10 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.006 0.494 18016
5361 1 10 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.515 -0.615 18016
5362 1 10 . 1 1 35 35 ALA H H 35 8.560 8.560 7.997 0.563 18016
5363 1 10 . 1 1 36 36 LEU N N 36 117.600 117.600 118.434 -0.834 18016
5364 1 10 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.247 -0.127 18016
5365 1 10 . 1 1 36 36 LEU C C 36 180.100 180.100 179.224 0.876 18016
5366 1 10 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.379 0.821 18016
5367 1 10 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.748 1.052 18016
5368 1 10 . 1 1 36 36 LEU H H 36 7.850 7.850 7.908 -0.058 18016
5369 1 10 . 1 1 37 37 LEU N N 37 116.700 116.700 120.482 -3.782 18016
5370 1 10 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.054 0.046 18016
5371 1 10 . 1 1 37 37 LEU C C 37 180.100 180.100 178.271 1.829 18016
5372 1 10 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.126 0.174 18016
5373 1 10 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.256 -0.056 18016
5374 1 10 . 1 1 37 37 LEU H H 37 8.730 8.730 8.308 0.422 18016
5375 1 10 . 1 1 38 38 THR N N 38 110.600 110.600 108.667 1.933 18016
5376 1 10 . 1 1 38 38 THR HA H 38 4.440 4.440 4.124 0.316 18016
5377 1 10 . 1 1 38 38 THR C C 38 175.100 175.100 175.826 -0.726 18016
5378 1 10 . 1 1 38 38 THR CA C 38 64.200 64.200 63.990 0.210 18016
5379 1 10 . 1 1 38 38 THR CB C 38 70.000 70.000 68.837 1.163 18016
5380 1 10 . 1 1 38 38 THR H H 38 8.660 8.660 8.355 0.305 18016
5381 1 10 . 1 1 39 39 ARG N N 39 118.000 118.000 120.249 -2.249 18016
5382 1 10 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.175 0.105 18016
5383 1 10 . 1 1 39 39 ARG C C 39 177.300 177.300 177.697 -0.397 18016
5384 1 10 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.180 0.120 18016
5385 1 10 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.042 0.158 18016
5386 1 10 . 1 1 39 39 ARG H H 39 7.180 7.180 7.568 -0.388 18016
5387 1 10 . 1 1 40 40 ARG N N 40 114.400 114.400 116.251 -1.851 18016
5388 1 10 . 1 1 40 40 ARG C C 40 174.800 174.800 176.979 -2.179 18016
5389 1 10 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.590 -1.290 18016
5390 1 10 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.446 3.154 18016
5391 1 10 . 1 1 40 40 ARG H H 40 7.520 7.520 7.573 -0.053 18016
5392 1 10 . 1 1 41 41 LEU N N 41 119.400 119.400 120.199 -0.799 18016
5393 1 10 . 1 1 41 41 LEU C C 41 177.100 177.100 177.437 -0.337 18016
5394 1 10 . 1 1 41 41 LEU CA C 41 53.700 53.700 55.343 -1.643 18016
5395 1 10 . 1 1 41 41 LEU CB C 41 44.400 44.400 42.420 1.980 18016
5396 1 10 . 1 1 41 41 LEU H H 41 8.380 8.380 7.520 0.860 18016
5397 1 10 . 1 1 42 42 THR N N 42 112.000 112.000 113.312 -1.312 18016
5398 1 10 . 1 1 42 42 THR HA H 42 4.440 4.440 4.375 0.065 18016
5399 1 10 . 1 1 42 42 THR C C 42 175.800 175.800 175.420 0.380 18016
5400 1 10 . 1 1 42 42 THR CA C 42 60.500 60.500 60.951 -0.451 18016
5401 1 10 . 1 1 42 42 THR CB C 42 70.800 70.800 70.367 0.433 18016
5402 1 10 . 1 1 42 42 THR H H 42 9.330 9.330 8.873 0.457 18016
5403 1 10 . 1 1 43 43 ASN N N 43 119.900 119.900 120.185 -0.285 18016
5404 1 10 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.423 -0.173 18016
5405 1 10 . 1 1 43 43 ASN C C 43 177.900 177.900 177.370 0.530 18016
5406 1 10 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.998 -0.298 18016
5407 1 10 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.191 -0.991 18016
5408 1 10 . 1 1 43 43 ASN H H 43 9.140 9.140 8.818 0.322 18016
5409 1 10 . 1 1 44 44 ASP N N 44 118.000 118.000 119.528 -1.528 18016
5410 1 10 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.404 -0.004 18016
5411 1 10 . 1 1 44 44 ASP C C 44 179.600 179.600 178.282 1.318 18016
5412 1 10 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.858 -0.558 18016
5413 1 10 . 1 1 44 44 ASP H H 44 8.360 8.360 8.647 -0.287 18016
5414 1 10 . 1 1 45 45 GLU N N 45 122.600 122.600 120.102 2.498 18016
5415 1 10 . 1 1 45 45 GLU HA H 45 3.970 3.970 3.980 -0.010 18016
5416 1 10 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.459 -0.059 18016
5417 1 10 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.788 0.512 18016
5418 1 10 . 1 1 45 45 GLU H H 45 7.850 7.850 7.634 0.216 18016
5419 1 10 . 1 1 46 46 ILE N N 46 118.900 118.900 120.588 -1.688 18016
5420 1 10 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.761 -0.331 18016
5421 1 10 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.231 1.769 18016
5422 1 10 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.743 -0.043 18016
5423 1 10 . 1 1 46 46 ILE H H 46 8.290 8.290 8.349 -0.059 18016
5424 1 10 . 1 1 47 47 LYS N N 47 118.900 118.900 119.631 -0.731 18016
5425 1 10 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.913 -0.043 18016
5426 1 10 . 1 1 47 47 LYS C C 47 178.400 178.400 178.886 -0.486 18016
5427 1 10 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.892 0.408 18016
5428 1 10 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.201 0.399 18016
5429 1 10 . 1 1 47 47 LYS H H 47 8.290 8.290 8.139 0.151 18016
5430 1 10 . 1 1 48 48 ALA N N 48 121.100 121.100 122.475 -1.375 18016
5431 1 10 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.020 0.150 18016
5432 1 10 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.210 -0.110 18016
5433 1 10 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.165 -0.165 18016
5434 1 10 . 1 1 48 48 ALA H H 48 7.710 7.710 8.255 -0.545 18016
5435 1 10 . 1 1 49 49 ILE N N 49 119.900 119.900 118.482 1.418 18016
5436 1 10 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.759 -0.109 18016
5437 1 10 . 1 1 49 49 ILE C C 49 177.300 177.300 178.192 -0.892 18016
5438 1 10 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.254 1.746 18016
5439 1 10 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.605 1.495 18016
5440 1 10 . 1 1 49 49 ILE H H 49 8.130 8.130 8.233 -0.103 18016
5441 1 10 . 1 1 50 50 ALA N N 50 122.000 122.000 122.444 -0.444 18016
5442 1 10 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.025 -0.165 18016
5443 1 10 . 1 1 50 50 ALA C C 50 179.800 179.800 179.942 -0.142 18016
5444 1 10 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.356 0.344 18016
5445 1 10 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.151 -0.251 18016
5446 1 10 . 1 1 50 50 ALA H H 50 8.730 8.730 7.465 1.265 18016
5447 1 10 . 1 1 51 51 GLU N N 51 116.900 116.900 118.834 -1.934 18016
5448 1 10 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.131 -0.111 18016
5449 1 10 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.518 -0.118 18016
5450 1 10 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.326 0.174 18016
5451 1 10 . 1 1 51 51 GLU H H 51 8.220 8.220 8.385 -0.165 18016
5452 1 10 . 1 1 52 52 ASP N N 52 120.300 120.300 119.487 0.813 18016
5453 1 10 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.438 -0.048 18016
5454 1 10 . 1 1 52 52 ASP C C 52 178.900 178.900 178.644 0.256 18016
5455 1 10 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.796 0.704 18016
5456 1 10 . 1 1 52 52 ASP CB C 52 42.500 42.500 40.895 1.605 18016
5457 1 10 . 1 1 52 52 ASP H H 52 7.700 7.700 7.969 -0.269 18016
5458 1 10 . 1 1 53 53 LEU N N 53 118.300 118.300 119.142 -0.842 18016
5459 1 10 . 1 1 53 53 LEU HA H 53 3.730 3.730 4.161 -0.431 18016
5460 1 10 . 1 1 53 53 LEU C C 53 179.000 179.000 179.192 -0.192 18016
5461 1 10 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.189 0.311 18016
5462 1 10 . 1 1 53 53 LEU CB C 53 41.100 41.100 42.127 -1.027 18016
5463 1 10 . 1 1 53 53 LEU H H 53 8.290 8.290 7.478 0.812 18016
5464 1 10 . 1 1 54 54 GLU N N 54 118.700 118.700 118.383 0.317 18016
5465 1 10 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.805 0.415 18016
5466 1 10 . 1 1 54 54 GLU C C 54 178.200 178.200 177.142 1.058 18016
5467 1 10 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.029 0.671 18016
5468 1 10 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.286 0.614 18016
5469 1 10 . 1 1 54 54 GLU H H 54 8.070 8.070 8.294 -0.224 18016
5470 1 10 . 1 1 55 55 LYS N N 55 117.700 117.700 116.261 1.439 18016
5471 1 10 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.085 0.065 18016
5472 1 10 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.649 0.651 18016
5473 1 10 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.141 0.559 18016
5474 1 10 . 1 1 55 55 LYS H H 55 7.750 7.750 7.479 0.271 18016
5475 1 10 . 1 1 56 56 ARG N N 56 117.100 117.100 117.888 -0.788 18016
5476 1 10 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.194 0.076 18016
5477 1 10 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.790 -0.990 18016
5478 1 10 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.227 -0.227 18016
5479 1 10 . 1 1 56 56 ARG H H 56 8.270 8.270 7.537 0.733 18016
5480 1 10 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.349 0.011 18016
5481 1 10 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.017 0.083 18016
5482 1 10 . 1 1 57 57 ALA CB C 57 19.200 19.200 19.968 -0.768 18016
5483 1 10 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.763 -0.253 18016
5484 1 10 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.765 0.435 18016
5485 1 10 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.990 -2.690 18016
5486 1 10 . 1 1 59 59 PHE N N 59 120.400 120.400 118.145 2.255 18016
5487 1 10 . 1 1 59 59 PHE C C 59 175.500 175.500 175.248 0.252 18016
5488 1 10 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.389 -0.189 18016
5489 1 10 . 1 1 59 59 PHE CB C 59 39.300 39.300 40.296 -0.996 18016
5490 1 10 . 1 1 59 59 PHE H H 59 7.710 7.710 8.192 -0.482 18016
5491 1 10 . 1 1 60 60 ASP N N 60 120.800 120.800 120.476 0.324 18016
5492 1 10 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.757 -0.267 18016
5493 1 10 . 1 1 60 60 ASP CA C 60 54.300 54.300 53.472 0.828 18016
5494 1 10 . 1 1 60 60 ASP CB C 60 41.100 41.100 42.103 -1.003 18016
5495 1 10 . 1 1 60 60 ASP H H 60 8.180 8.180 7.967 0.213 18016
5496 1 10 . 1 1 61 61 HIS N N 61 118.300 118.300 116.435 1.865 18016
5497 1 10 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.803 -0.413 18016
5498 1 10 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.756 0.944 18016
5499 1 10 . 1 1 61 61 HIS CB C 61 28.800 28.800 30.745 -1.945 18016
5500 1 10 . 1 1 61 61 HIS H H 61 8.550 8.550 8.607 -0.057 18016
5501 1 10 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.326 -0.316 18016
5502 1 10 . 1 1 62 62 ILE C C 62 173.800 173.800 175.287 -1.487 18016
5503 1 10 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.801 5.699 18016
5504 1 10 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.992 1.108 18016
5505 1 10 . 1 1 63 63 ASP N N 63 125.100 125.100 122.214 2.886 18016
5506 1 10 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.392 0.208 18016
5507 1 10 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.297 -2.497 18016
5508 1 10 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.077 -1.577 18016
5509 1 10 . 1 1 63 63 ASP H H 63 8.360 8.360 7.931 0.429 18016
5510 1 10 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.833 -0.163 18016
5511 1 10 . 1 1 64 64 ILE C C 64 177.000 177.000 176.745 0.255 18016
5512 1 10 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.238 -1.138 18016
5513 1 10 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.289 -1.689 18016
5514 1 10 . 1 1 65 65 GLY N N 65 107.600 107.600 107.427 0.173 18016
5515 1 10 . 1 1 65 65 GLY C C 65 177.000 177.000 175.904 1.096 18016
5516 1 10 . 1 1 65 65 GLY CA C 65 47.300 47.300 47.107 0.193 18016
5517 1 10 . 1 1 65 65 GLY H H 65 8.440 8.440 7.886 0.554 18016
5518 1 10 . 1 1 66 66 VAL N N 66 121.800 121.800 122.000 -0.200 18016
5519 1 10 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.722 0.038 18016
5520 1 10 . 1 1 66 66 VAL C C 66 178.500 178.500 177.890 0.610 18016
5521 1 10 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.790 -0.190 18016
5522 1 10 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.586 0.414 18016
5523 1 10 . 1 1 66 66 VAL H H 66 7.550 7.550 7.808 -0.258 18016
5524 1 10 . 1 1 67 67 LEU N N 67 120.900 120.900 118.555 2.345 18016
5525 1 10 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.037 0.033 18016
5526 1 10 . 1 1 67 67 LEU C C 67 179.000 179.000 179.217 -0.217 18016
5527 1 10 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.680 -0.080 18016
5528 1 10 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.572 1.728 18016
5529 1 10 . 1 1 67 67 LEU H H 67 7.650 7.650 7.521 0.129 18016
5530 1 10 . 1 1 68 68 ILE N N 68 118.900 118.900 117.680 1.220 18016
5531 1 10 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.820 -0.110 18016
5532 1 10 . 1 1 68 68 ILE C C 68 179.500 179.500 178.173 1.327 18016
5533 1 10 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.759 0.441 18016
5534 1 10 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.413 0.087 18016
5535 1 10 . 1 1 68 68 ILE H H 68 8.580 8.580 7.490 1.090 18016
5536 1 10 . 1 1 69 69 THR N N 69 118.100 118.100 114.900 3.200 18016
5537 1 10 . 1 1 69 69 THR HA H 69 3.940 3.940 4.056 -0.116 18016
5538 1 10 . 1 1 69 69 THR C C 69 176.200 176.200 175.770 0.430 18016
5539 1 10 . 1 1 69 69 THR CA C 69 66.600 66.600 66.244 0.356 18016
5540 1 10 . 1 1 69 69 THR CB C 69 68.500 68.500 68.362 0.138 18016
5541 1 10 . 1 1 69 69 THR H H 69 7.840 7.840 7.722 0.118 18016
5542 1 10 . 1 1 70 70 GLN N N 70 121.600 121.600 120.102 1.498 18016
5543 1 10 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.156 -0.046 18016
5544 1 10 . 1 1 70 70 GLN C C 70 178.100 178.100 177.989 0.111 18016
5545 1 10 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.567 0.533 18016
5546 1 10 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.710 -0.410 18016
5547 1 10 . 1 1 70 70 GLN H H 70 8.100 8.100 7.348 0.752 18016
5548 1 10 . 1 1 71 71 MET N N 71 118.700 118.700 117.856 0.844 18016
5549 1 10 . 1 1 71 71 MET HA H 71 4.010 4.010 4.386 -0.376 18016
5550 1 10 . 1 1 71 71 MET C C 71 176.300 176.300 178.221 -1.921 18016
5551 1 10 . 1 1 71 71 MET CA C 71 58.100 58.100 58.830 -0.730 18016
5552 1 10 . 1 1 71 71 MET CB C 71 33.600 33.600 32.807 0.793 18016
5553 1 10 . 1 1 71 71 MET H H 71 8.350 8.350 8.538 -0.188 18016
5554 1 10 . 1 1 72 72 THR N N 72 111.600 111.600 111.464 0.136 18016
5555 1 10 . 1 1 72 72 THR HA H 72 3.940 3.940 4.162 -0.222 18016
5556 1 10 . 1 1 72 72 THR C C 72 175.800 175.800 175.344 0.456 18016
5557 1 10 . 1 1 72 72 THR CA C 72 65.300 65.300 64.686 0.615 18016
5558 1 10 . 1 1 72 72 THR CB C 72 69.100 69.100 69.223 -0.123 18016
5559 1 10 . 1 1 72 72 THR H H 72 7.840 7.840 7.658 0.182 18016
5560 1 10 . 1 1 73 73 ASP N N 73 121.100 121.100 119.876 1.224 18016
5561 1 10 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.739 -0.209 18016
5562 1 10 . 1 1 73 73 ASP C C 73 176.600 176.600 175.685 0.915 18016
5563 1 10 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.140 1.060 18016
5564 1 10 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.741 -1.341 18016
5565 1 10 . 1 1 73 73 ASP H H 73 7.840 7.840 7.731 0.109 18016
5566 1 10 . 1 1 74 74 GLU N N 74 121.100 121.100 119.387 1.713 18016
5567 1 10 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.610 -0.270 18016
5568 1 10 . 1 1 74 74 GLU C C 74 173.800 173.800 175.220 -1.420 18016
5569 1 10 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.544 -0.044 18016
5570 1 10 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.392 -0.792 18016
5571 1 10 . 1 1 74 74 GLU H H 74 7.980 7.980 8.417 -0.437 18016
5572 1 10 . 1 1 75 75 MET N N 75 125.800 125.800 126.010 -0.210 18016
5573 1 10 . 1 1 75 75 MET HA H 75 4.710 4.710 4.827 -0.117 18016
5574 1 10 . 1 1 75 75 MET CA C 75 53.800 53.800 54.582 -0.782 18016
5575 1 10 . 1 1 75 75 MET CB C 75 31.700 31.700 31.754 -0.054 18016
5576 1 10 . 1 1 75 75 MET H H 75 8.380 8.380 8.550 -0.170 18016
5577 1 10 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.434 0.076 18016
5578 1 10 . 1 1 76 76 PRO C C 76 175.700 175.700 176.380 -0.680 18016
5579 1 10 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.436 -1.436 18016
5580 1 10 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.224 -0.424 18016
5581 1 10 . 1 1 77 77 ARG N N 77 119.700 119.700 116.815 2.885 18016
5582 1 10 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.683 -0.413 18016
5583 1 10 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.514 1.286 18016
5584 1 10 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.613 -1.913 18016
5585 1 10 . 1 1 77 77 ARG H H 77 8.940 8.940 7.803 1.137 18016
5586 1 10 . 1 1 78 78 GLU N N 78 124.700 124.700 124.297 0.403 18016
5587 1 10 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.969 -0.009 18016
5588 1 10 . 1 1 78 78 GLU C C 78 179.000 179.000 178.138 0.862 18016
5589 1 10 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.547 0.253 18016
5590 1 10 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.793 -0.793 18016
5591 1 10 . 1 1 78 78 GLU H H 78 9.170 9.170 8.742 0.428 18016
5592 1 10 . 1 1 79 79 GLU N N 79 116.800 116.800 120.489 -3.689 18016
5593 1 10 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.102 0.018 18016
5594 1 10 . 1 1 79 79 GLU C C 79 179.100 179.100 178.441 0.659 18016
5595 1 10 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.704 -0.004 18016
5596 1 10 . 1 1 79 79 GLU CB C 79 29.000 29.000 28.690 0.310 18016
5597 1 10 . 1 1 79 79 GLU H H 79 9.660 9.660 8.780 0.880 18016
5598 1 10 . 1 1 80 80 ASP N N 80 120.000 120.000 118.302 1.698 18016
5599 1 10 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.483 0.207 18016
5600 1 10 . 1 1 80 80 ASP C C 80 177.300 177.300 178.749 -1.449 18016
5601 1 10 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.003 0.397 18016
5602 1 10 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.307 1.293 18016
5603 1 10 . 1 1 80 80 ASP H H 80 7.310 7.310 8.377 -1.067 18016
5604 1 10 . 1 1 81 81 ILE N N 81 120.100 120.100 120.461 -0.361 18016
5605 1 10 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.729 -0.239 18016
5606 1 10 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.565 0.735 18016
5607 1 10 . 1 1 81 81 ILE CB C 81 38.300 38.300 38.008 0.292 18016
5608 1 10 . 1 1 81 81 ILE H H 81 7.610 7.610 8.175 -0.565 18016
5609 1 10 . 1 1 82 82 GLU N N 82 118.100 118.100 119.142 -1.042 18016
5610 1 10 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.005 0.275 18016
5611 1 10 . 1 1 82 82 GLU C C 82 177.800 177.800 178.678 -0.878 18016
5612 1 10 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.449 -1.449 18016
5613 1 10 . 1 1 82 82 GLU CB C 82 28.800 28.800 28.960 -0.160 18016
5614 1 10 . 1 1 82 82 GLU H H 82 8.550 8.550 8.608 -0.058 18016
5615 1 10 . 1 1 83 83 ARG N N 83 119.900 119.900 120.697 -0.797 18016
5616 1 10 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.016 0.014 18016
5617 1 10 . 1 1 83 83 ARG C C 83 179.400 179.400 178.737 0.663 18016
5618 1 10 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.456 0.444 18016
5619 1 10 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.282 -0.682 18016
5620 1 10 . 1 1 83 83 ARG H H 83 7.590 7.590 7.771 -0.181 18016
5621 1 10 . 1 1 84 84 VAL N N 84 120.400 120.400 119.143 1.257 18016
5622 1 10 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.878 -0.128 18016
5623 1 10 . 1 1 84 84 VAL C C 84 177.400 177.400 177.442 -0.042 18016
5624 1 10 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.757 1.143 18016
5625 1 10 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.169 -0.268 18016
5626 1 10 . 1 1 84 84 VAL H H 84 7.550 7.550 8.460 -0.910 18016
5627 1 10 . 1 1 85 85 ARG N N 85 121.600 121.600 120.125 1.475 18016
5628 1 10 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.218 -0.208 18016
5629 1 10 . 1 1 85 85 ARG C C 85 178.100 178.100 178.883 -0.783 18016
5630 1 10 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.989 0.911 18016
5631 1 10 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.968 0.232 18016
5632 1 10 . 1 1 85 85 ARG H H 85 9.090 9.090 8.433 0.657 18016
5633 1 10 . 1 1 86 86 ARG N N 86 115.600 115.600 118.381 -2.781 18016
5634 1 10 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.102 -0.222 18016
5635 1 10 . 1 1 86 86 ARG C C 86 179.000 179.000 178.634 0.366 18016
5636 1 10 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.048 0.352 18016
5637 1 10 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.473 0.927 18016
5638 1 10 . 1 1 86 86 ARG H H 86 8.660 8.660 8.506 0.154 18016
5639 1 10 . 1 1 87 87 HIS N N 87 118.000 118.000 119.852 -1.852 18016
5640 1 10 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.333 0.027 18016
5641 1 10 . 1 1 87 87 HIS C C 87 178.400 178.400 177.309 1.091 18016
5642 1 10 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.355 0.245 18016
5643 1 10 . 1 1 87 87 HIS CB C 87 30.700 30.700 29.930 0.770 18016
5644 1 10 . 1 1 87 87 HIS H H 87 7.640 7.640 7.612 0.028 18016
5645 1 10 . 1 1 88 88 LEU N N 88 119.600 119.600 118.785 0.815 18016
5646 1 10 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.090 -0.510 18016
5647 1 10 . 1 1 88 88 LEU C C 88 180.000 180.000 179.008 0.992 18016
5648 1 10 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.009 0.191 18016
5649 1 10 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.204 1.396 18016
5650 1 10 . 1 1 88 88 LEU H H 88 8.650 8.650 8.407 0.243 18016
5651 1 10 . 1 1 89 89 ALA N N 89 118.500 118.500 122.788 -4.288 18016
5652 1 10 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.678 0.682 18016
5653 1 10 . 1 1 89 89 ALA C C 89 180.400 180.400 179.943 0.457 18016
5654 1 10 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.857 -1.257 18016
5655 1 10 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.434 -0.334 18016
5656 1 10 . 1 1 89 89 ALA H H 89 8.870 8.870 8.360 0.510 18016
5657 1 10 . 1 1 90 90 LEU N N 90 119.400 119.400 117.313 2.087 18016
5658 1 10 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.988 0.222 18016
5659 1 10 . 1 1 90 90 LEU C C 90 179.100 179.100 179.077 0.023 18016
5660 1 10 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.008 0.492 18016
5661 1 10 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.566 0.134 18016
5662 1 10 . 1 1 90 90 LEU H H 90 7.390 7.390 7.781 -0.391 18016
5663 1 10 . 1 1 91 91 GLN N N 91 114.500 114.500 115.894 -1.394 18016
5664 1 10 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.392 0.308 18016
5665 1 10 . 1 1 91 91 GLN C C 91 175.800 175.800 176.714 -0.914 18016
5666 1 10 . 1 1 91 91 GLN CA C 91 54.500 54.500 55.962 -1.462 18016
5667 1 10 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.052 -1.952 18016
5668 1 10 . 1 1 91 91 GLN H H 91 7.810 7.810 7.904 -0.094 18016
5669 1 10 . 1 1 92 92 GLY N N 92 107.900 107.900 105.449 2.451 18016
5670 1 10 . 1 1 92 92 GLY C C 92 172.100 172.100 171.595 0.505 18016
5671 1 10 . 1 1 92 92 GLY CA C 92 44.000 44.000 44.894 -0.894 18016
5672 1 10 . 1 1 92 92 GLY H H 92 7.710 7.710 8.129 -0.419 18016
5673 1 10 . 1 1 93 93 TRP N N 93 114.200 114.200 121.926 -7.726 18016
5674 1 10 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.505 1.495 18016
5675 1 10 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.416 -1.216 18016
5676 1 10 . 1 1 93 93 TRP H H 93 8.450 8.450 8.419 0.031 18016
5677 1 10 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.204 0.256 18016
5678 1 10 . 1 1 94 94 PRO CA C 94 62.800 62.800 64.089 -1.289 18016
5679 1 10 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.259 0.341 18016
5680 1 10 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.046 -0.546 18016
5681 1 10 . 1 1 95 95 LEU C C 95 175.000 175.000 177.901 -2.901 18016
5682 1 10 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.789 -0.689 18016
5683 1 10 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.465 1.635 18016
5684 1 10 . 1 1 96 96 ASP N N 96 114.000 114.000 119.132 -5.132 18016
5685 1 10 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.561 0.389 18016
5686 1 10 . 1 1 96 96 ASP C C 96 175.800 175.800 175.985 -0.185 18016
5687 1 10 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.898 -2.898 18016
5688 1 10 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.726 0.174 18016
5689 1 10 . 1 1 96 96 ASP H H 96 7.230 7.230 7.601 -0.371 18016
5690 1 10 . 1 1 97 97 ASP N N 97 123.200 123.200 114.411 8.789 18016
5691 1 10 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.749 -0.139 18016
5692 1 10 . 1 1 97 97 ASP CA C 97 53.500 53.500 52.276 1.224 18016
5693 1 10 . 1 1 97 97 ASP CB C 97 38.700 38.700 41.002 -2.302 18016
5694 1 10 . 1 1 97 97 ASP H H 97 7.420 7.420 7.842 -0.422 18016
5695 1 10 . 1 1 98 98 PRO HA H 98 4.290 4.290 2.659 1.631 18016
5696 1 10 . 1 1 98 98 PRO C C 98 177.500 177.500 176.332 1.168 18016
5697 1 10 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.342 0.358 18016
5698 1 10 . 1 1 98 98 PRO CB C 98 31.900 31.900 31.756 0.144 18016
5699 1 10 . 1 1 99 99 ARG N N 99 121.300 121.300 121.222 0.078 18016
5700 1 10 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.161 -0.451 18016
5701 1 10 . 1 1 99 99 ARG C C 99 176.500 176.500 176.223 0.277 18016
5702 1 10 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.303 -1.203 18016
5703 1 10 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.860 -0.360 18016
5704 1 10 . 1 1 99 99 ARG H H 99 8.390 8.390 8.329 0.061 18016
5705 1 10 . 1 1 100 100 ASP N N 100 119.600 119.600 117.818 1.782 18016
5706 1 10 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.701 -0.201 18016
5707 1 10 . 1 1 100 100 ASP C C 100 177.000 177.000 175.311 1.689 18016
5708 1 10 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.683 1.017 18016
5709 1 10 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.417 -1.517 18016
5710 1 10 . 1 1 100 100 ASP H H 100 8.260 8.260 7.934 0.326 18016
5711 1 10 . 1 1 101 101 GLY N N 101 109.300 109.300 110.801 -1.501 18016
5712 1 10 . 1 1 101 101 GLY CA C 101 45.400 45.400 45.254 0.146 18016
5713 1 10 . 1 1 101 101 GLY H H 101 8.450 8.450 8.298 0.152 18016
5714 1 10 . 1 1 102 102 GLU N N 102 119.800 119.800 121.420 -1.620 18016
5715 1 10 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.533 -0.223 18016
5716 1 10 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.098 -0.098 18016
5717 1 10 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.037 0.463 18016
5718 1 10 . 1 1 102 102 GLU H H 102 8.140 8.140 8.300 -0.160 18016
5719 1 10 . 1 1 103 103 GLU N N 103 123.000 123.000 124.841 -1.841 18016
5720 1 10 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.417 0.143 18016
5721 1 10 . 1 1 103 103 GLU CA C 103 54.300 54.300 56.882 -2.582 18016
5722 1 10 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.232 0.368 18016
5723 1 10 . 1 1 103 103 GLU H H 103 8.580 8.580 8.892 -0.312 18016
5724 1 10 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.481 -0.001 18016
5725 1 10 . 1 1 104 104 PRO C C 104 176.800 176.800 176.457 0.343 18016
5726 1 10 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.162 0.238 18016
5727 1 10 . 1 1 104 104 PRO CB C 104 32.100 32.100 31.986 0.113 18016
5728 1 10 . 1 1 105 105 ASP N N 105 120.400 120.400 118.313 2.087 18016
5729 1 10 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.464 0.116 18016
5730 1 10 . 1 1 105 105 ASP C C 105 177.100 177.100 175.970 1.130 18016
5731 1 10 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.374 -0.074 18016
5732 1 10 . 1 1 105 105 ASP CB C 105 41.400 41.400 40.306 1.094 18016
5733 1 10 . 1 1 105 105 ASP H H 105 8.500 8.500 8.491 0.009 18016
5734 1 10 . 1 1 106 106 GLY N N 106 109.300 109.300 108.851 0.449 18016
5735 1 10 . 1 1 106 106 GLY C C 106 174.600 174.600 173.693 0.907 18016
5736 1 10 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.041 0.359 18016
5737 1 10 . 1 1 106 106 GLY H H 106 8.360 8.360 8.137 0.223 18016
5738 1 10 . 1 1 107 107 GLU N N 107 120.400 120.400 121.356 -0.956 18016
5739 1 10 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.595 -0.255 18016
5740 1 10 . 1 1 107 107 GLU C C 107 177.100 177.100 176.012 1.088 18016
5741 1 10 . 1 1 107 107 GLU CA C 107 56.500 56.500 55.796 0.704 18016
5742 1 10 . 1 1 107 107 GLU CB C 107 30.200 30.200 28.600 1.600 18016
5743 1 10 . 1 1 107 107 GLU H H 107 8.410 8.410 8.206 0.204 18016
5744 1 10 . 1 1 108 108 SER N N 108 116.600 116.600 121.270 -4.670 18016
5745 1 10 . 1 1 108 108 SER HA H 108 4.450 4.450 4.519 -0.069 18016
5746 1 10 . 1 1 108 108 SER C C 108 175.300 175.300 175.361 -0.061 18016
5747 1 10 . 1 1 108 108 SER CA C 108 58.700 58.700 58.209 0.491 18016
5748 1 10 . 1 1 108 108 SER CB C 108 63.800 63.800 64.198 -0.398 18016
5749 1 10 . 1 1 108 108 SER H H 108 8.460 8.460 8.806 -0.346 18016
5750 1 10 . 1 1 109 109 GLY N N 109 110.800 110.800 109.153 1.647 18016
5751 1 10 . 1 1 109 109 GLY C C 109 174.500 174.500 173.880 0.620 18016
5752 1 10 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.871 0.429 18016
5753 1 10 . 1 1 109 109 GLY H H 109 8.500 8.500 8.325 0.175 18016
5754 1 10 . 1 1 110 110 GLY N N 110 108.800 108.800 109.369 -0.569 18016
5755 1 10 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.398 -0.998 18016
5756 1 10 . 1 1 110 110 GLY H H 110 8.140 8.140 8.344 -0.204 18016
5757 1 10 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.662 -0.052 18016
5758 1 10 . 1 1 111 111 PRO C C 111 176.000 176.000 176.828 -0.828 18016
5759 1 10 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.810 -0.210 18016
5760 1 10 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.077 2.523 18016
5761 1 11 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.463 -0.033 18016
5762 1 11 . 1 1 2 2 PRO C C 2 177.600 177.600 176.483 1.117 18016
5763 1 11 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.908 0.392 18016
5764 1 11 . 1 1 2 2 PRO CB C 2 32.300 32.300 31.821 0.479 18016
5765 1 11 . 1 1 3 3 GLY N N 3 110.000 110.000 111.619 -1.619 18016
5766 1 11 . 1 1 3 3 GLY C C 3 174.200 174.200 174.318 -0.118 18016
5767 1 11 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.211 0.189 18016
5768 1 11 . 1 1 3 3 GLY H H 3 8.700 8.700 8.539 0.161 18016
5769 1 11 . 1 1 4 4 SER N N 4 115.400 115.400 116.973 -1.573 18016
5770 1 11 . 1 1 4 4 SER HA H 4 4.440 4.440 4.923 -0.483 18016
5771 1 11 . 1 1 4 4 SER C C 4 174.800 174.800 174.402 0.398 18016
5772 1 11 . 1 1 4 4 SER CA C 4 58.400 58.400 57.877 0.523 18016
5773 1 11 . 1 1 4 4 SER CB C 4 63.800 63.800 64.327 -0.527 18016
5774 1 11 . 1 1 4 4 SER H H 4 8.210 8.210 7.678 0.532 18016
5775 1 11 . 1 1 5 5 MET N N 5 122.200 122.200 125.988 -3.788 18016
5776 1 11 . 1 1 5 5 MET HA H 5 4.510 4.510 4.561 -0.051 18016
5777 1 11 . 1 1 5 5 MET CA C 5 55.600 55.600 55.048 0.551 18016
5778 1 11 . 1 1 5 5 MET CB C 5 32.900 32.900 33.690 -0.790 18016
5779 1 11 . 1 1 5 5 MET H H 5 8.570 8.570 8.575 -0.005 18016
5780 1 11 . 1 1 6 6 VAL N N 6 120.000 120.000 117.345 2.655 18016
5781 1 11 . 1 1 6 6 VAL HA H 6 4.050 4.050 3.968 0.082 18016
5782 1 11 . 1 1 6 6 VAL C C 6 175.700 175.700 175.949 -0.249 18016
5783 1 11 . 1 1 6 6 VAL CA C 6 62.700 62.700 62.243 0.457 18016
5784 1 11 . 1 1 6 6 VAL CB C 6 32.500 32.500 31.863 0.637 18016
5785 1 11 . 1 1 6 6 VAL H H 6 8.150 8.150 7.564 0.586 18016
5786 1 11 . 1 1 7 7 ASN N N 7 122.000 122.000 119.265 2.735 18016
5787 1 11 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.525 0.135 18016
5788 1 11 . 1 1 7 7 ASN C C 7 175.200 175.200 176.841 -1.641 18016
5789 1 11 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.134 -0.934 18016
5790 1 11 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.249 -0.349 18016
5791 1 11 . 1 1 7 7 ASN H H 7 8.010 8.010 8.362 -0.352 18016
5792 1 11 . 1 1 8 8 ALA N N 8 126.500 126.500 125.739 0.761 18016
5793 1 11 . 1 1 8 8 ALA C C 8 180.200 180.200 179.502 0.698 18016
5794 1 11 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.498 0.002 18016
5795 1 11 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.793 -0.393 18016
5796 1 11 . 1 1 8 8 ALA H H 8 9.020 9.020 8.806 0.214 18016
5797 1 11 . 1 1 9 9 PHE N N 9 121.300 121.300 118.613 2.687 18016
5798 1 11 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.120 0.170 18016
5799 1 11 . 1 1 9 9 PHE C C 9 177.200 177.200 177.009 0.191 18016
5800 1 11 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.435 -0.135 18016
5801 1 11 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.123 0.077 18016
5802 1 11 . 1 1 9 9 PHE H H 9 8.570 8.570 8.396 0.174 18016
5803 1 11 . 1 1 10 10 LEU N N 10 117.200 117.200 119.679 -2.479 18016
5804 1 11 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.948 -0.248 18016
5805 1 11 . 1 1 10 10 LEU C C 10 179.700 179.700 179.070 0.630 18016
5806 1 11 . 1 1 10 10 LEU CA C 10 57.600 57.600 56.943 0.657 18016
5807 1 11 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.395 0.305 18016
5808 1 11 . 1 1 10 10 LEU H H 10 8.150 8.150 7.790 0.360 18016
5809 1 11 . 1 1 11 11 ALA N N 11 121.500 121.500 122.491 -0.991 18016
5810 1 11 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.883 0.137 18016
5811 1 11 . 1 1 11 11 ALA C C 11 180.900 180.900 179.446 1.454 18016
5812 1 11 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.428 -0.428 18016
5813 1 11 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.020 -0.020 18016
5814 1 11 . 1 1 11 11 ALA H H 11 8.460 8.460 8.842 -0.382 18016
5815 1 11 . 1 1 12 12 LYS N N 12 120.700 120.700 119.071 1.629 18016
5816 1 11 . 1 1 12 12 LYS HA H 12 4.050 4.050 3.963 0.087 18016
5817 1 11 . 1 1 12 12 LYS C C 12 179.700 179.700 179.015 0.685 18016
5818 1 11 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.496 -0.296 18016
5819 1 11 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.217 -0.616 18016
5820 1 11 . 1 1 12 12 LYS H H 12 7.820 7.820 7.708 0.112 18016
5821 1 11 . 1 1 13 13 ILE N N 13 120.100 120.100 119.583 0.517 18016
5822 1 11 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.833 -0.143 18016
5823 1 11 . 1 1 13 13 ILE C C 13 178.100 178.100 178.270 -0.170 18016
5824 1 11 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.737 -0.737 18016
5825 1 11 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.563 -1.163 18016
5826 1 11 . 1 1 13 13 ILE H H 13 7.640 7.640 7.864 -0.224 18016
5827 1 11 . 1 1 14 14 ALA N N 14 122.700 122.700 122.369 0.331 18016
5828 1 11 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.980 -0.120 18016
5829 1 11 . 1 1 14 14 ALA C C 14 179.000 179.000 179.547 -0.547 18016
5830 1 11 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.504 0.496 18016
5831 1 11 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.056 -0.056 18016
5832 1 11 . 1 1 14 14 ALA H H 14 8.680 8.680 8.662 0.018 18016
5833 1 11 . 1 1 15 15 ALA N N 15 118.700 118.700 121.610 -2.910 18016
5834 1 11 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.083 0.007 18016
5835 1 11 . 1 1 15 15 ALA C C 15 180.400 180.400 179.071 1.329 18016
5836 1 11 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.652 0.348 18016
5837 1 11 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.439 -0.739 18016
5838 1 11 . 1 1 15 15 ALA H H 15 8.070 8.070 8.079 -0.009 18016
5839 1 11 . 1 1 16 16 TRP N N 16 122.900 122.900 121.654 1.246 18016
5840 1 11 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.248 0.312 18016
5841 1 11 . 1 1 16 16 TRP C C 16 178.400 178.400 177.996 0.404 18016
5842 1 11 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.912 -2.312 18016
5843 1 11 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.088 -0.788 18016
5844 1 11 . 1 1 16 16 TRP H H 16 7.820 7.820 8.406 -0.586 18016
5845 1 11 . 1 1 17 17 LEU N N 17 120.400 120.400 119.233 1.167 18016
5846 1 11 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.333 0.277 18016
5847 1 11 . 1 1 17 17 LEU C C 17 179.000 179.000 178.759 0.241 18016
5848 1 11 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.798 0.102 18016
5849 1 11 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.744 0.256 18016
5850 1 11 . 1 1 17 17 LEU H H 17 8.630 8.630 8.425 0.205 18016
5851 1 11 . 1 1 18 18 ASN N N 18 116.200 116.200 116.923 -0.723 18016
5852 1 11 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.545 -0.235 18016
5853 1 11 . 1 1 18 18 ASN C C 18 177.100 177.100 177.039 0.061 18016
5854 1 11 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.782 -0.182 18016
5855 1 11 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.968 0.233 18016
5856 1 11 . 1 1 18 18 ASN H H 18 8.350 8.350 8.386 -0.036 18016
5857 1 11 . 1 1 19 19 ALA N N 19 119.600 119.600 121.550 -1.950 18016
5858 1 11 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.197 -0.107 18016
5859 1 11 . 1 1 19 19 ALA C C 19 180.100 180.100 179.207 0.893 18016
5860 1 11 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.609 -0.409 18016
5861 1 11 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.291 -0.691 18016
5862 1 11 . 1 1 19 19 ALA H H 19 7.920 7.920 8.111 -0.191 18016
5863 1 11 . 1 1 20 20 GLY N N 20 103.500 103.500 105.597 -2.097 18016
5864 1 11 . 1 1 20 20 GLY C C 20 173.800 173.800 174.138 -0.338 18016
5865 1 11 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.435 0.365 18016
5866 1 11 . 1 1 20 20 GLY H H 20 7.700 7.700 7.668 0.032 18016
5867 1 11 . 1 1 21 21 TYR N N 21 119.900 119.900 119.163 0.737 18016
5868 1 11 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.914 0.256 18016
5869 1 11 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.898 1.502 18016
5870 1 11 . 1 1 21 21 TYR CB C 21 37.800 37.800 37.968 -0.168 18016
5871 1 11 . 1 1 21 21 TYR H H 21 7.980 7.980 7.911 0.069 18016
5872 1 11 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.449 0.051 18016
5873 1 11 . 1 1 22 22 PRO C C 22 178.700 178.700 177.262 1.438 18016
5874 1 11 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.269 0.731 18016
5875 1 11 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.261 -0.261 18016
5876 1 11 . 1 1 23 23 GLU N N 23 116.300 116.300 118.778 -2.478 18016
5877 1 11 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.380 0.190 18016
5878 1 11 . 1 1 23 23 GLU C C 23 176.300 176.300 176.825 -0.525 18016
5879 1 11 . 1 1 23 23 GLU CA C 23 54.600 54.600 56.011 -1.411 18016
5880 1 11 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.750 -0.250 18016
5881 1 11 . 1 1 23 23 GLU H H 23 8.680 8.680 8.560 0.120 18016
5882 1 11 . 1 1 24 24 GLY N N 24 108.100 108.100 107.156 0.944 18016
5883 1 11 . 1 1 24 24 GLY C C 24 173.100 173.100 172.917 0.183 18016
5884 1 11 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.420 -1.520 18016
5885 1 11 . 1 1 24 24 GLY H H 24 7.230 7.230 7.888 -0.658 18016
5886 1 11 . 1 1 25 25 VAL N N 25 121.500 121.500 120.831 0.669 18016
5887 1 11 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.704 -0.114 18016
5888 1 11 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.624 0.676 18016
5889 1 11 . 1 1 25 25 VAL CB C 25 32.100 32.100 31.102 0.998 18016
5890 1 11 . 1 1 25 25 VAL H H 25 8.050 8.050 7.983 0.067 18016
5891 1 11 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.444 -0.124 18016
5892 1 11 . 1 1 26 26 PRO C C 26 177.600 177.600 177.883 -0.283 18016
5893 1 11 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.413 0.487 18016
5894 1 11 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.082 0.018 18016
5895 1 11 . 1 1 27 27 GLY N N 27 109.000 109.000 109.847 -0.847 18016
5896 1 11 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.911 1.189 18016
5897 1 11 . 1 1 27 27 GLY H H 27 8.930 8.930 8.825 0.105 18016
5898 1 11 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.231 0.159 18016
5899 1 11 . 1 1 28 28 PRO C C 28 175.800 175.800 177.169 -1.369 18016
5900 1 11 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.922 -0.522 18016
5901 1 11 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.529 0.371 18016
5902 1 11 . 1 1 29 29 ASP N N 29 115.000 115.000 115.212 -0.212 18016
5903 1 11 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.675 -0.185 18016
5904 1 11 . 1 1 29 29 ASP C C 29 177.000 177.000 178.001 -1.001 18016
5905 1 11 . 1 1 29 29 ASP CA C 29 53.900 53.900 56.046 -2.146 18016
5906 1 11 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.425 -0.725 18016
5907 1 11 . 1 1 29 29 ASP H H 29 7.760 7.760 7.869 -0.109 18016
5908 1 11 . 1 1 30 30 ARG N N 30 119.900 119.900 121.413 -1.513 18016
5909 1 11 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.774 -0.204 18016
5910 1 11 . 1 1 30 30 ARG C C 30 176.500 176.500 178.348 -1.848 18016
5911 1 11 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.970 1.930 18016
5912 1 11 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.213 0.287 18016
5913 1 11 . 1 1 30 30 ARG H H 30 7.460 7.460 8.062 -0.602 18016
5914 1 11 . 1 1 31 31 VAL N N 31 117.600 117.600 119.643 -2.043 18016
5915 1 11 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.848 -0.028 18016
5916 1 11 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.514 0.186 18016
5917 1 11 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.345 -0.545 18016
5918 1 11 . 1 1 31 31 VAL H H 31 9.080 9.080 8.204 0.876 18016
5919 1 11 . 1 1 32 32 PRO C C 32 177.000 177.000 178.727 -1.727 18016
5920 1 11 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.855 -0.655 18016
5921 1 11 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.159 -0.359 18016
5922 1 11 . 1 1 33 33 LEU N N 33 115.200 115.200 121.025 -5.825 18016
5923 1 11 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.087 0.033 18016
5924 1 11 . 1 1 33 33 LEU C C 33 178.600 178.600 178.527 0.073 18016
5925 1 11 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.022 0.378 18016
5926 1 11 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.305 0.195 18016
5927 1 11 . 1 1 33 33 LEU H H 33 8.010 8.010 8.128 -0.118 18016
5928 1 11 . 1 1 34 34 LEU N N 34 120.400 120.400 119.268 1.132 18016
5929 1 11 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.033 -0.103 18016
5930 1 11 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.618 0.481 18016
5931 1 11 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.271 0.629 18016
5932 1 11 . 1 1 34 34 LEU H H 34 8.220 8.220 8.345 -0.125 18016
5933 1 11 . 1 1 35 35 ALA N N 35 123.100 123.100 122.454 0.646 18016
5934 1 11 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.050 -0.010 18016
5935 1 11 . 1 1 35 35 ALA C C 35 179.500 179.500 178.894 0.606 18016
5936 1 11 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.987 0.513 18016
5937 1 11 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.480 -0.580 18016
5938 1 11 . 1 1 35 35 ALA H H 35 8.560 8.560 8.024 0.536 18016
5939 1 11 . 1 1 36 36 LEU N N 36 117.600 117.600 118.545 -0.945 18016
5940 1 11 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.283 -0.163 18016
5941 1 11 . 1 1 36 36 LEU C C 36 180.100 180.100 179.150 0.950 18016
5942 1 11 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.243 0.957 18016
5943 1 11 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.933 0.867 18016
5944 1 11 . 1 1 36 36 LEU H H 36 7.850 7.850 7.973 -0.123 18016
5945 1 11 . 1 1 37 37 LEU N N 37 116.700 116.700 120.395 -3.695 18016
5946 1 11 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.051 0.049 18016
5947 1 11 . 1 1 37 37 LEU C C 37 180.100 180.100 178.469 1.631 18016
5948 1 11 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.167 0.133 18016
5949 1 11 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.205 -0.005 18016
5950 1 11 . 1 1 37 37 LEU H H 37 8.730 8.730 8.503 0.227 18016
5951 1 11 . 1 1 38 38 THR N N 38 110.600 110.600 109.595 1.005 18016
5952 1 11 . 1 1 38 38 THR HA H 38 4.440 4.440 4.093 0.347 18016
5953 1 11 . 1 1 38 38 THR C C 38 175.100 175.100 175.929 -0.829 18016
5954 1 11 . 1 1 38 38 THR CA C 38 64.200 64.200 64.445 -0.245 18016
5955 1 11 . 1 1 38 38 THR CB C 38 70.000 70.000 68.471 1.529 18016
5956 1 11 . 1 1 38 38 THR H H 38 8.660 8.660 8.298 0.362 18016
5957 1 11 . 1 1 39 39 ARG N N 39 118.000 118.000 122.070 -4.070 18016
5958 1 11 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.104 0.176 18016
5959 1 11 . 1 1 39 39 ARG C C 39 177.300 177.300 177.851 -0.551 18016
5960 1 11 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.371 -0.071 18016
5961 1 11 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.635 0.565 18016
5962 1 11 . 1 1 39 39 ARG H H 39 7.180 7.180 7.570 -0.390 18016
5963 1 11 . 1 1 40 40 ARG N N 40 114.400 114.400 115.520 -1.120 18016
5964 1 11 . 1 1 40 40 ARG C C 40 174.800 174.800 176.766 -1.966 18016
5965 1 11 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.080 -0.780 18016
5966 1 11 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.433 3.167 18016
5967 1 11 . 1 1 40 40 ARG H H 40 7.520 7.520 7.661 -0.141 18016
5968 1 11 . 1 1 41 41 LEU N N 41 119.400 119.400 120.956 -1.556 18016
5969 1 11 . 1 1 41 41 LEU C C 41 177.100 177.100 177.594 -0.494 18016
5970 1 11 . 1 1 41 41 LEU CA C 41 53.700 53.700 55.257 -1.557 18016
5971 1 11 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.031 1.369 18016
5972 1 11 . 1 1 41 41 LEU H H 41 8.380 8.380 7.438 0.942 18016
5973 1 11 . 1 1 42 42 THR N N 42 112.000 112.000 113.431 -1.431 18016
5974 1 11 . 1 1 42 42 THR HA H 42 4.440 4.440 4.491 -0.051 18016
5975 1 11 . 1 1 42 42 THR C C 42 175.800 175.800 175.554 0.246 18016
5976 1 11 . 1 1 42 42 THR CA C 42 60.500 60.500 60.518 -0.018 18016
5977 1 11 . 1 1 42 42 THR CB C 42 70.800 70.800 70.392 0.408 18016
5978 1 11 . 1 1 42 42 THR H H 42 9.330 9.330 8.829 0.501 18016
5979 1 11 . 1 1 43 43 ASN N N 43 119.900 119.900 119.767 0.133 18016
5980 1 11 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.410 -0.160 18016
5981 1 11 . 1 1 43 43 ASN C C 43 177.900 177.900 177.450 0.450 18016
5982 1 11 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.601 -0.901 18016
5983 1 11 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.106 -0.906 18016
5984 1 11 . 1 1 43 43 ASN H H 43 9.140 9.140 8.761 0.379 18016
5985 1 11 . 1 1 44 44 ASP N N 44 118.000 118.000 119.301 -1.301 18016
5986 1 11 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.371 0.029 18016
5987 1 11 . 1 1 44 44 ASP C C 44 179.600 179.600 178.297 1.303 18016
5988 1 11 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.777 -0.477 18016
5989 1 11 . 1 1 44 44 ASP H H 44 8.360 8.360 8.698 -0.338 18016
5990 1 11 . 1 1 45 45 GLU N N 45 122.600 122.600 120.145 2.455 18016
5991 1 11 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.083 -0.113 18016
5992 1 11 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.103 0.297 18016
5993 1 11 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.854 0.446 18016
5994 1 11 . 1 1 45 45 GLU H H 45 7.850 7.850 7.747 0.103 18016
5995 1 11 . 1 1 46 46 ILE N N 46 118.900 118.900 120.606 -1.706 18016
5996 1 11 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.774 -0.344 18016
5997 1 11 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.195 1.805 18016
5998 1 11 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.767 -0.067 18016
5999 1 11 . 1 1 46 46 ILE H H 46 8.290 8.290 8.332 -0.042 18016
6000 1 11 . 1 1 47 47 LYS N N 47 118.900 118.900 119.070 -0.170 18016
6001 1 11 . 1 1 47 47 LYS HA H 47 3.870 3.870 4.021 -0.151 18016
6002 1 11 . 1 1 47 47 LYS C C 47 178.400 178.400 178.704 -0.304 18016
6003 1 11 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.696 0.604 18016
6004 1 11 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.325 0.275 18016
6005 1 11 . 1 1 47 47 LYS H H 47 8.290 8.290 8.208 0.082 18016
6006 1 11 . 1 1 48 48 ALA N N 48 121.100 121.100 123.470 -2.370 18016
6007 1 11 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.080 0.090 18016
6008 1 11 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.174 -0.074 18016
6009 1 11 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.096 -0.096 18016
6010 1 11 . 1 1 48 48 ALA H H 48 7.710 7.710 8.199 -0.489 18016
6011 1 11 . 1 1 49 49 ILE N N 49 119.900 119.900 117.840 2.060 18016
6012 1 11 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.742 -0.092 18016
6013 1 11 . 1 1 49 49 ILE C C 49 177.300 177.300 178.015 -0.715 18016
6014 1 11 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.255 1.745 18016
6015 1 11 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.320 1.780 18016
6016 1 11 . 1 1 49 49 ILE H H 49 8.130 8.130 8.319 -0.189 18016
6017 1 11 . 1 1 50 50 ALA N N 50 122.000 122.000 122.815 -0.815 18016
6018 1 11 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.988 -0.128 18016
6019 1 11 . 1 1 50 50 ALA C C 50 179.800 179.800 179.832 -0.032 18016
6020 1 11 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.445 0.255 18016
6021 1 11 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.089 -0.189 18016
6022 1 11 . 1 1 50 50 ALA H H 50 8.730 8.730 7.564 1.166 18016
6023 1 11 . 1 1 51 51 GLU N N 51 116.900 116.900 117.727 -0.827 18016
6024 1 11 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.969 0.051 18016
6025 1 11 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.200 0.200 18016
6026 1 11 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.283 0.217 18016
6027 1 11 . 1 1 51 51 GLU H H 51 8.220 8.220 8.413 -0.193 18016
6028 1 11 . 1 1 52 52 ASP N N 52 120.300 120.300 120.162 0.138 18016
6029 1 11 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.476 -0.086 18016
6030 1 11 . 1 1 52 52 ASP C C 52 178.900 178.900 178.790 0.110 18016
6031 1 11 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.035 0.465 18016
6032 1 11 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.027 1.473 18016
6033 1 11 . 1 1 52 52 ASP H H 52 7.700 7.700 7.911 -0.211 18016
6034 1 11 . 1 1 53 53 LEU N N 53 118.300 118.300 119.912 -1.612 18016
6035 1 11 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.954 -0.224 18016
6036 1 11 . 1 1 53 53 LEU C C 53 179.000 179.000 179.223 -0.223 18016
6037 1 11 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.893 -0.393 18016
6038 1 11 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.821 -0.721 18016
6039 1 11 . 1 1 53 53 LEU H H 53 8.290 8.290 8.015 0.275 18016
6040 1 11 . 1 1 54 54 GLU N N 54 118.700 118.700 117.158 1.542 18016
6041 1 11 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.132 0.088 18016
6042 1 11 . 1 1 54 54 GLU C C 54 178.200 178.200 176.723 1.477 18016
6043 1 11 . 1 1 54 54 GLU CA C 54 58.700 58.700 57.922 0.778 18016
6044 1 11 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.669 1.231 18016
6045 1 11 . 1 1 54 54 GLU H H 54 8.070 8.070 8.378 -0.308 18016
6046 1 11 . 1 1 55 55 LYS N N 55 117.700 117.700 117.078 0.622 18016
6047 1 11 . 1 1 55 55 LYS HA H 55 4.150 4.150 3.944 0.206 18016
6048 1 11 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.047 0.253 18016
6049 1 11 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.398 0.302 18016
6050 1 11 . 1 1 55 55 LYS H H 55 7.750 7.750 7.426 0.324 18016
6051 1 11 . 1 1 56 56 ARG N N 56 117.100 117.100 117.391 -0.291 18016
6052 1 11 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.259 0.011 18016
6053 1 11 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.251 -0.451 18016
6054 1 11 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.755 -0.755 18016
6055 1 11 . 1 1 56 56 ARG H H 56 8.270 8.270 7.708 0.562 18016
6056 1 11 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.658 -0.298 18016
6057 1 11 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.865 0.235 18016
6058 1 11 . 1 1 57 57 ALA CB C 57 19.200 19.200 19.893 -0.693 18016
6059 1 11 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.527 -0.017 18016
6060 1 11 . 1 1 58 58 HIS CA C 58 56.200 56.200 57.528 -1.328 18016
6061 1 11 . 1 1 58 58 HIS CB C 58 27.300 27.300 30.436 -3.136 18016
6062 1 11 . 1 1 59 59 PHE N N 59 120.400 120.400 113.782 6.618 18016
6063 1 11 . 1 1 59 59 PHE C C 59 175.500 175.500 174.869 0.631 18016
6064 1 11 . 1 1 59 59 PHE CA C 59 57.200 57.200 56.452 0.748 18016
6065 1 11 . 1 1 59 59 PHE CB C 59 39.300 39.300 38.543 0.757 18016
6066 1 11 . 1 1 59 59 PHE H H 59 7.710 7.710 7.961 -0.251 18016
6067 1 11 . 1 1 60 60 ASP N N 60 120.800 120.800 121.752 -0.952 18016
6068 1 11 . 1 1 60 60 ASP HA H 60 4.490 4.490 3.945 0.545 18016
6069 1 11 . 1 1 60 60 ASP CA C 60 54.300 54.300 53.891 0.409 18016
6070 1 11 . 1 1 60 60 ASP CB C 60 41.100 41.100 41.177 -0.077 18016
6071 1 11 . 1 1 60 60 ASP H H 60 8.180 8.180 7.369 0.811 18016
6072 1 11 . 1 1 61 61 HIS N N 61 118.300 118.300 120.143 -1.843 18016
6073 1 11 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.625 -0.235 18016
6074 1 11 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.981 0.719 18016
6075 1 11 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.791 -0.991 18016
6076 1 11 . 1 1 61 61 HIS H H 61 8.550 8.550 8.489 0.061 18016
6077 1 11 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.047 -0.037 18016
6078 1 11 . 1 1 62 62 ILE C C 62 173.800 173.800 174.891 -1.091 18016
6079 1 11 . 1 1 62 62 ILE CA C 62 66.500 66.500 61.074 5.426 18016
6080 1 11 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.444 2.656 18016
6081 1 11 . 1 1 63 63 ASP N N 63 125.100 125.100 121.600 3.500 18016
6082 1 11 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.359 0.241 18016
6083 1 11 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.176 -2.376 18016
6084 1 11 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.559 -1.059 18016
6085 1 11 . 1 1 63 63 ASP H H 63 8.360 8.360 7.847 0.513 18016
6086 1 11 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.778 -0.108 18016
6087 1 11 . 1 1 64 64 ILE C C 64 177.000 177.000 176.799 0.201 18016
6088 1 11 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.250 -1.150 18016
6089 1 11 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.350 -1.750 18016
6090 1 11 . 1 1 65 65 GLY N N 65 107.600 107.600 107.211 0.389 18016
6091 1 11 . 1 1 65 65 GLY C C 65 177.000 177.000 175.894 1.106 18016
6092 1 11 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.915 0.385 18016
6093 1 11 . 1 1 65 65 GLY H H 65 8.440 8.440 7.991 0.449 18016
6094 1 11 . 1 1 66 66 VAL N N 66 121.800 121.800 122.060 -0.260 18016
6095 1 11 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.669 0.091 18016
6096 1 11 . 1 1 66 66 VAL C C 66 178.500 178.500 177.615 0.885 18016
6097 1 11 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.307 0.293 18016
6098 1 11 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.760 0.240 18016
6099 1 11 . 1 1 66 66 VAL H H 66 7.550 7.550 7.917 -0.366 18016
6100 1 11 . 1 1 67 67 LEU N N 67 120.900 120.900 118.952 1.948 18016
6101 1 11 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.033 0.037 18016
6102 1 11 . 1 1 67 67 LEU C C 67 179.000 179.000 179.114 -0.114 18016
6103 1 11 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.577 0.023 18016
6104 1 11 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.478 1.822 18016
6105 1 11 . 1 1 67 67 LEU H H 67 7.650 7.650 7.454 0.196 18016
6106 1 11 . 1 1 68 68 ILE N N 68 118.900 118.900 117.763 1.137 18016
6107 1 11 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.805 -0.095 18016
6108 1 11 . 1 1 68 68 ILE C C 68 179.500 179.500 178.184 1.316 18016
6109 1 11 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.803 0.397 18016
6110 1 11 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.411 0.089 18016
6111 1 11 . 1 1 68 68 ILE H H 68 8.580 8.580 7.560 1.020 18016
6112 1 11 . 1 1 69 69 THR N N 69 118.100 118.100 114.794 3.306 18016
6113 1 11 . 1 1 69 69 THR HA H 69 3.940 3.940 4.071 -0.131 18016
6114 1 11 . 1 1 69 69 THR C C 69 176.200 176.200 176.024 0.176 18016
6115 1 11 . 1 1 69 69 THR CA C 69 66.600 66.600 66.351 0.249 18016
6116 1 11 . 1 1 69 69 THR CB C 69 68.500 68.500 68.366 0.134 18016
6117 1 11 . 1 1 69 69 THR H H 69 7.840 7.840 7.728 0.112 18016
6118 1 11 . 1 1 70 70 GLN N N 70 121.600 121.600 120.651 0.949 18016
6119 1 11 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.135 -0.025 18016
6120 1 11 . 1 1 70 70 GLN C C 70 178.100 178.100 178.002 0.098 18016
6121 1 11 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.694 0.406 18016
6122 1 11 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.650 -0.350 18016
6123 1 11 . 1 1 70 70 GLN H H 70 8.100 8.100 7.405 0.695 18016
6124 1 11 . 1 1 71 71 MET N N 71 118.700 118.700 118.459 0.241 18016
6125 1 11 . 1 1 71 71 MET HA H 71 4.010 4.010 4.395 -0.385 18016
6126 1 11 . 1 1 71 71 MET C C 71 176.300 176.300 178.138 -1.838 18016
6127 1 11 . 1 1 71 71 MET CA C 71 58.100 58.100 59.122 -1.022 18016
6128 1 11 . 1 1 71 71 MET CB C 71 33.600 33.600 32.806 0.794 18016
6129 1 11 . 1 1 71 71 MET H H 71 8.350 8.350 8.441 -0.091 18016
6130 1 11 . 1 1 72 72 THR N N 72 111.600 111.600 110.848 0.752 18016
6131 1 11 . 1 1 72 72 THR HA H 72 3.940 3.940 4.099 -0.159 18016
6132 1 11 . 1 1 72 72 THR C C 72 175.800 175.800 175.381 0.419 18016
6133 1 11 . 1 1 72 72 THR CA C 72 65.300 65.300 65.119 0.181 18016
6134 1 11 . 1 1 72 72 THR CB C 72 69.100 69.100 69.153 -0.053 18016
6135 1 11 . 1 1 72 72 THR H H 72 7.840 7.840 7.660 0.180 18016
6136 1 11 . 1 1 73 73 ASP N N 73 121.100 121.100 119.803 1.297 18016
6137 1 11 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.674 -0.144 18016
6138 1 11 . 1 1 73 73 ASP C C 73 176.600 176.600 176.026 0.574 18016
6139 1 11 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.391 0.809 18016
6140 1 11 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.588 -1.188 18016
6141 1 11 . 1 1 73 73 ASP H H 73 7.840 7.840 7.681 0.159 18016
6142 1 11 . 1 1 74 74 GLU N N 74 121.100 121.100 119.539 1.561 18016
6143 1 11 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.550 -0.210 18016
6144 1 11 . 1 1 74 74 GLU C C 74 173.800 173.800 175.227 -1.427 18016
6145 1 11 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.583 -0.083 18016
6146 1 11 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.677 -1.077 18016
6147 1 11 . 1 1 74 74 GLU H H 74 7.980 7.980 8.360 -0.380 18016
6148 1 11 . 1 1 75 75 MET N N 75 125.800 125.800 125.908 -0.108 18016
6149 1 11 . 1 1 75 75 MET HA H 75 4.710 4.710 4.831 -0.121 18016
6150 1 11 . 1 1 75 75 MET CA C 75 53.800 53.800 54.410 -0.610 18016
6151 1 11 . 1 1 75 75 MET CB C 75 31.700 31.700 31.730 -0.030 18016
6152 1 11 . 1 1 75 75 MET H H 75 8.380 8.380 8.532 -0.152 18016
6153 1 11 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.447 0.063 18016
6154 1 11 . 1 1 76 76 PRO C C 76 175.700 175.700 176.438 -0.738 18016
6155 1 11 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.219 -1.219 18016
6156 1 11 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.390 -0.590 18016
6157 1 11 . 1 1 77 77 ARG N N 77 119.700 119.700 118.671 1.029 18016
6158 1 11 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.618 -0.348 18016
6159 1 11 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.678 1.122 18016
6160 1 11 . 1 1 77 77 ARG CB C 77 30.700 30.700 33.113 -2.413 18016
6161 1 11 . 1 1 77 77 ARG H H 77 8.940 8.940 8.414 0.526 18016
6162 1 11 . 1 1 78 78 GLU N N 78 124.700 124.700 125.137 -0.437 18016
6163 1 11 . 1 1 78 78 GLU HA H 78 3.960 3.960 4.040 -0.080 18016
6164 1 11 . 1 1 78 78 GLU C C 78 179.000 179.000 178.069 0.931 18016
6165 1 11 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.352 -0.552 18016
6166 1 11 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.230 -0.230 18016
6167 1 11 . 1 1 78 78 GLU H H 78 9.170 9.170 9.117 0.053 18016
6168 1 11 . 1 1 79 79 GLU N N 79 116.800 116.800 118.894 -2.094 18016
6169 1 11 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.233 -0.113 18016
6170 1 11 . 1 1 79 79 GLU C C 79 179.100 179.100 178.771 0.329 18016
6171 1 11 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.894 -0.194 18016
6172 1 11 . 1 1 79 79 GLU CB C 79 29.000 29.000 28.874 0.126 18016
6173 1 11 . 1 1 79 79 GLU H H 79 9.660 9.660 8.764 0.896 18016
6174 1 11 . 1 1 80 80 ASP N N 80 120.000 120.000 120.052 -0.052 18016
6175 1 11 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.504 0.186 18016
6176 1 11 . 1 1 80 80 ASP C C 80 177.300 177.300 178.740 -1.440 18016
6177 1 11 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.261 0.139 18016
6178 1 11 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.688 0.912 18016
6179 1 11 . 1 1 80 80 ASP H H 80 7.310 7.310 7.446 -0.136 18016
6180 1 11 . 1 1 81 81 ILE N N 81 120.100 120.100 120.770 -0.670 18016
6181 1 11 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.684 -0.194 18016
6182 1 11 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.645 0.655 18016
6183 1 11 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.973 0.327 18016
6184 1 11 . 1 1 81 81 ILE H H 81 7.610 7.610 8.349 -0.739 18016
6185 1 11 . 1 1 82 82 GLU N N 82 118.100 118.100 119.121 -1.021 18016
6186 1 11 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.062 0.218 18016
6187 1 11 . 1 1 82 82 GLU C C 82 177.800 177.800 178.874 -1.074 18016
6188 1 11 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.376 -1.376 18016
6189 1 11 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.048 -0.248 18016
6190 1 11 . 1 1 82 82 GLU H H 82 8.550 8.550 8.700 -0.150 18016
6191 1 11 . 1 1 83 83 ARG N N 83 119.900 119.900 120.531 -0.631 18016
6192 1 11 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.105 -0.075 18016
6193 1 11 . 1 1 83 83 ARG C C 83 179.400 179.400 178.952 0.448 18016
6194 1 11 . 1 1 83 83 ARG CA C 83 59.900 59.900 58.845 1.055 18016
6195 1 11 . 1 1 83 83 ARG CB C 83 29.600 29.600 29.931 -0.331 18016
6196 1 11 . 1 1 83 83 ARG H H 83 7.590 7.590 7.741 -0.151 18016
6197 1 11 . 1 1 84 84 VAL N N 84 120.400 120.400 119.605 0.795 18016
6198 1 11 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.832 -0.082 18016
6199 1 11 . 1 1 84 84 VAL C C 84 177.400 177.400 177.170 0.230 18016
6200 1 11 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.986 0.914 18016
6201 1 11 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.046 -0.146 18016
6202 1 11 . 1 1 84 84 VAL H H 84 7.550 7.550 8.503 -0.953 18016
6203 1 11 . 1 1 85 85 ARG N N 85 121.600 121.600 120.248 1.352 18016
6204 1 11 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.236 -0.226 18016
6205 1 11 . 1 1 85 85 ARG C C 85 178.100 178.100 178.871 -0.771 18016
6206 1 11 . 1 1 85 85 ARG CA C 85 60.900 60.900 60.106 0.794 18016
6207 1 11 . 1 1 85 85 ARG CB C 85 30.200 30.200 30.030 0.170 18016
6208 1 11 . 1 1 85 85 ARG H H 85 9.090 9.090 8.438 0.652 18016
6209 1 11 . 1 1 86 86 ARG N N 86 115.600 115.600 118.117 -2.517 18016
6210 1 11 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.139 -0.259 18016
6211 1 11 . 1 1 86 86 ARG C C 86 179.000 179.000 178.637 0.363 18016
6212 1 11 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.959 0.441 18016
6213 1 11 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.567 0.833 18016
6214 1 11 . 1 1 86 86 ARG H H 86 8.660 8.660 8.500 0.160 18016
6215 1 11 . 1 1 87 87 HIS N N 87 118.000 118.000 119.993 -1.993 18016
6216 1 11 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.336 0.024 18016
6217 1 11 . 1 1 87 87 HIS C C 87 178.400 178.400 177.431 0.969 18016
6218 1 11 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.363 0.237 18016
6219 1 11 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.139 0.561 18016
6220 1 11 . 1 1 87 87 HIS H H 87 7.640 7.640 7.698 -0.058 18016
6221 1 11 . 1 1 88 88 LEU N N 88 119.600 119.600 119.070 0.530 18016
6222 1 11 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.150 -0.570 18016
6223 1 11 . 1 1 88 88 LEU C C 88 180.000 180.000 178.963 1.037 18016
6224 1 11 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.023 0.177 18016
6225 1 11 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.153 1.447 18016
6226 1 11 . 1 1 88 88 LEU H H 88 8.650 8.650 8.635 0.015 18016
6227 1 11 . 1 1 89 89 ALA N N 89 118.500 118.500 122.543 -4.043 18016
6228 1 11 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.697 0.663 18016
6229 1 11 . 1 1 89 89 ALA C C 89 180.400 180.400 179.635 0.765 18016
6230 1 11 . 1 1 89 89 ALA CA C 89 53.600 53.600 55.046 -1.446 18016
6231 1 11 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.435 -0.335 18016
6232 1 11 . 1 1 89 89 ALA H H 89 8.870 8.870 8.221 0.649 18016
6233 1 11 . 1 1 90 90 LEU N N 90 119.400 119.400 116.644 2.756 18016
6234 1 11 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.979 0.231 18016
6235 1 11 . 1 1 90 90 LEU C C 90 179.100 179.100 179.039 0.061 18016
6236 1 11 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.134 0.366 18016
6237 1 11 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.688 0.012 18016
6238 1 11 . 1 1 90 90 LEU H H 90 7.390 7.390 7.653 -0.263 18016
6239 1 11 . 1 1 91 91 GLN N N 91 114.500 114.500 116.209 -1.709 18016
6240 1 11 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.336 0.364 18016
6241 1 11 . 1 1 91 91 GLN C C 91 175.800 175.800 176.541 -0.741 18016
6242 1 11 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.988 -2.488 18016
6243 1 11 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.057 -1.957 18016
6244 1 11 . 1 1 91 91 GLN H H 91 7.810 7.810 7.798 0.012 18016
6245 1 11 . 1 1 92 92 GLY N N 92 107.900 107.900 104.476 3.424 18016
6246 1 11 . 1 1 92 92 GLY C C 92 172.100 172.100 171.592 0.508 18016
6247 1 11 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.047 -1.047 18016
6248 1 11 . 1 1 92 92 GLY H H 92 7.710 7.710 8.244 -0.534 18016
6249 1 11 . 1 1 93 93 TRP N N 93 114.200 114.200 122.138 -7.938 18016
6250 1 11 . 1 1 93 93 TRP CA C 93 56.000 56.000 55.089 0.911 18016
6251 1 11 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.982 -1.782 18016
6252 1 11 . 1 1 93 93 TRP H H 93 8.450 8.450 8.383 0.067 18016
6253 1 11 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.311 0.149 18016
6254 1 11 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.229 -0.429 18016
6255 1 11 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.125 0.475 18016
6256 1 11 . 1 1 95 95 LEU HA H 95 3.500 3.500 3.867 -0.367 18016
6257 1 11 . 1 1 95 95 LEU C C 95 175.000 175.000 177.589 -2.589 18016
6258 1 11 . 1 1 95 95 LEU CA C 95 56.100 56.100 57.338 -1.238 18016
6259 1 11 . 1 1 95 95 LEU CB C 95 42.100 42.100 41.452 0.648 18016
6260 1 11 . 1 1 96 96 ASP N N 96 114.000 114.000 116.842 -2.842 18016
6261 1 11 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.441 0.509 18016
6262 1 11 . 1 1 96 96 ASP C C 96 175.800 175.800 175.600 0.200 18016
6263 1 11 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.506 -2.506 18016
6264 1 11 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.705 0.195 18016
6265 1 11 . 1 1 96 96 ASP H H 96 7.230 7.230 7.686 -0.456 18016
6266 1 11 . 1 1 97 97 ASP N N 97 123.200 123.200 116.079 7.121 18016
6267 1 11 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.928 -0.318 18016
6268 1 11 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.545 1.955 18016
6269 1 11 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.827 -4.127 18016
6270 1 11 . 1 1 97 97 ASP H H 97 7.420 7.420 7.555 -0.135 18016
6271 1 11 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.396 0.894 18016
6272 1 11 . 1 1 98 98 PRO C C 98 177.500 177.500 177.129 0.371 18016
6273 1 11 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.536 0.164 18016
6274 1 11 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.242 -0.342 18016
6275 1 11 . 1 1 99 99 ARG N N 99 121.300 121.300 120.047 1.253 18016
6276 1 11 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.204 -0.494 18016
6277 1 11 . 1 1 99 99 ARG C C 99 176.500 176.500 175.949 0.551 18016
6278 1 11 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.869 -1.769 18016
6279 1 11 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.802 -0.301 18016
6280 1 11 . 1 1 99 99 ARG H H 99 8.390 8.390 8.357 0.033 18016
6281 1 11 . 1 1 100 100 ASP N N 100 119.600 119.600 116.512 3.088 18016
6282 1 11 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.581 -0.081 18016
6283 1 11 . 1 1 100 100 ASP C C 100 177.000 177.000 174.761 2.239 18016
6284 1 11 . 1 1 100 100 ASP CA C 100 54.700 54.700 54.047 0.653 18016
6285 1 11 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.478 -1.578 18016
6286 1 11 . 1 1 100 100 ASP H H 100 8.260 8.260 7.433 0.827 18016
6287 1 11 . 1 1 101 101 GLY N N 101 109.300 109.300 110.126 -0.826 18016
6288 1 11 . 1 1 101 101 GLY CA C 101 45.400 45.400 45.243 0.157 18016
6289 1 11 . 1 1 101 101 GLY H H 101 8.450 8.450 8.228 0.222 18016
6290 1 11 . 1 1 102 102 GLU N N 102 119.800 119.800 120.750 -0.950 18016
6291 1 11 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.189 0.121 18016
6292 1 11 . 1 1 102 102 GLU CA C 102 56.000 56.000 57.463 -1.463 18016
6293 1 11 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.095 0.406 18016
6294 1 11 . 1 1 102 102 GLU H H 102 8.140 8.140 8.254 -0.114 18016
6295 1 11 . 1 1 103 103 GLU N N 103 123.000 123.000 124.588 -1.588 18016
6296 1 11 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.719 -0.159 18016
6297 1 11 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.091 0.209 18016
6298 1 11 . 1 1 103 103 GLU CB C 103 29.600 29.600 31.009 -1.409 18016
6299 1 11 . 1 1 103 103 GLU H H 103 8.580 8.580 8.507 0.073 18016
6300 1 11 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.449 0.031 18016
6301 1 11 . 1 1 104 104 PRO C C 104 176.800 176.800 175.628 1.172 18016
6302 1 11 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.578 -0.178 18016
6303 1 11 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.304 -0.204 18016
6304 1 11 . 1 1 105 105 ASP N N 105 120.400 120.400 120.381 0.019 18016
6305 1 11 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.702 -0.122 18016
6306 1 11 . 1 1 105 105 ASP C C 105 177.100 177.100 176.004 1.096 18016
6307 1 11 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.148 0.152 18016
6308 1 11 . 1 1 105 105 ASP CB C 105 41.400 41.400 42.678 -1.278 18016
6309 1 11 . 1 1 105 105 ASP H H 105 8.500 8.500 8.150 0.350 18016
6310 1 11 . 1 1 106 106 GLY N N 106 109.300 109.300 112.266 -2.966 18016
6311 1 11 . 1 1 106 106 GLY C C 106 174.600 174.600 173.463 1.137 18016
6312 1 11 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.860 -0.460 18016
6313 1 11 . 1 1 106 106 GLY H H 106 8.360 8.360 8.623 -0.263 18016
6314 1 11 . 1 1 107 107 GLU N N 107 120.400 120.400 121.751 -1.351 18016
6315 1 11 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.607 -0.267 18016
6316 1 11 . 1 1 107 107 GLU C C 107 177.100 177.100 175.290 1.810 18016
6317 1 11 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.487 0.013 18016
6318 1 11 . 1 1 107 107 GLU CB C 107 30.200 30.200 31.107 -0.907 18016
6319 1 11 . 1 1 107 107 GLU H H 107 8.410 8.410 8.280 0.130 18016
6320 1 11 . 1 1 108 108 SER N N 108 116.600 116.600 120.378 -3.778 18016
6321 1 11 . 1 1 108 108 SER HA H 108 4.450 4.450 4.837 -0.387 18016
6322 1 11 . 1 1 108 108 SER C C 108 175.300 175.300 174.194 1.106 18016
6323 1 11 . 1 1 108 108 SER CA C 108 58.700 58.700 58.102 0.598 18016
6324 1 11 . 1 1 108 108 SER CB C 108 63.800 63.800 63.014 0.786 18016
6325 1 11 . 1 1 108 108 SER H H 108 8.460 8.460 8.678 -0.218 18016
6326 1 11 . 1 1 109 109 GLY N N 109 110.800 110.800 111.355 -0.555 18016
6327 1 11 . 1 1 109 109 GLY C C 109 174.500 174.500 172.551 1.949 18016
6328 1 11 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.782 0.518 18016
6329 1 11 . 1 1 109 109 GLY H H 109 8.500 8.500 8.194 0.306 18016
6330 1 11 . 1 1 110 110 GLY N N 110 108.800 108.800 108.444 0.356 18016
6331 1 11 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.501 -0.101 18016
6332 1 11 . 1 1 110 110 GLY H H 110 8.140 8.140 8.774 -0.634 18016
6333 1 11 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.557 0.053 18016
6334 1 11 . 1 1 111 111 PRO C C 111 176.000 176.000 177.215 -1.215 18016
6335 1 11 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.158 -0.558 18016
6336 1 11 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.661 1.939 18016
6337 1 12 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.596 -0.166 18016
6338 1 12 . 1 1 2 2 PRO C C 2 177.600 177.600 177.342 0.258 18016
6339 1 12 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.462 0.837 18016
6340 1 12 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.715 -0.415 18016
6341 1 12 . 1 1 3 3 GLY N N 3 110.000 110.000 111.401 -1.401 18016
6342 1 12 . 1 1 3 3 GLY C C 3 174.200 174.200 174.430 -0.230 18016
6343 1 12 . 1 1 3 3 GLY CA C 3 45.400 45.400 44.640 0.760 18016
6344 1 12 . 1 1 3 3 GLY H H 3 8.700 8.700 8.457 0.243 18016
6345 1 12 . 1 1 4 4 SER N N 4 115.400 115.400 121.004 -5.604 18016
6346 1 12 . 1 1 4 4 SER HA H 4 4.440 4.440 4.542 -0.102 18016
6347 1 12 . 1 1 4 4 SER C C 4 174.800 174.800 175.326 -0.526 18016
6348 1 12 . 1 1 4 4 SER CA C 4 58.400 58.400 57.746 0.654 18016
6349 1 12 . 1 1 4 4 SER CB C 4 63.800 63.800 64.726 -0.926 18016
6350 1 12 . 1 1 4 4 SER H H 4 8.210 8.210 7.801 0.409 18016
6351 1 12 . 1 1 5 5 MET N N 5 122.200 122.200 123.001 -0.801 18016
6352 1 12 . 1 1 5 5 MET HA H 5 4.510 4.510 4.384 0.126 18016
6353 1 12 . 1 1 5 5 MET CA C 5 55.600 55.600 56.830 -1.230 18016
6354 1 12 . 1 1 5 5 MET CB C 5 32.900 32.900 32.774 0.126 18016
6355 1 12 . 1 1 5 5 MET H H 5 8.570 8.570 9.002 -0.432 18016
6356 1 12 . 1 1 6 6 VAL N N 6 120.000 120.000 115.848 4.152 18016
6357 1 12 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.038 0.012 18016
6358 1 12 . 1 1 6 6 VAL C C 6 175.700 175.700 175.249 0.451 18016
6359 1 12 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.181 1.519 18016
6360 1 12 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.307 0.193 18016
6361 1 12 . 1 1 6 6 VAL H H 6 8.150 8.150 7.455 0.695 18016
6362 1 12 . 1 1 7 7 ASN N N 7 122.000 122.000 119.308 2.692 18016
6363 1 12 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.619 0.041 18016
6364 1 12 . 1 1 7 7 ASN C C 7 175.200 175.200 176.706 -1.506 18016
6365 1 12 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.034 -0.834 18016
6366 1 12 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.407 -0.506 18016
6367 1 12 . 1 1 7 7 ASN H H 7 8.010 8.010 8.629 -0.619 18016
6368 1 12 . 1 1 8 8 ALA N N 8 126.500 126.500 125.188 1.312 18016
6369 1 12 . 1 1 8 8 ALA C C 8 180.200 180.200 179.685 0.515 18016
6370 1 12 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.648 -0.148 18016
6371 1 12 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.842 -0.442 18016
6372 1 12 . 1 1 8 8 ALA H H 8 9.020 9.020 8.700 0.320 18016
6373 1 12 . 1 1 9 9 PHE N N 9 121.300 121.300 119.927 1.373 18016
6374 1 12 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.065 0.225 18016
6375 1 12 . 1 1 9 9 PHE C C 9 177.200 177.200 177.014 0.186 18016
6376 1 12 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.596 -0.296 18016
6377 1 12 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.944 0.256 18016
6378 1 12 . 1 1 9 9 PHE H H 9 8.570 8.570 8.206 0.364 18016
6379 1 12 . 1 1 10 10 LEU N N 10 117.200 117.200 119.265 -2.065 18016
6380 1 12 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.043 -0.343 18016
6381 1 12 . 1 1 10 10 LEU C C 10 179.700 179.700 178.922 0.778 18016
6382 1 12 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.985 -0.385 18016
6383 1 12 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.636 0.064 18016
6384 1 12 . 1 1 10 10 LEU H H 10 8.150 8.150 7.733 0.417 18016
6385 1 12 . 1 1 11 11 ALA N N 11 121.500 121.500 121.981 -0.481 18016
6386 1 12 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.924 0.096 18016
6387 1 12 . 1 1 11 11 ALA C C 11 180.900 180.900 179.310 1.590 18016
6388 1 12 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.409 -0.409 18016
6389 1 12 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.074 -0.074 18016
6390 1 12 . 1 1 11 11 ALA H H 11 8.460 8.460 8.761 -0.301 18016
6391 1 12 . 1 1 12 12 LYS N N 12 120.700 120.700 119.001 1.699 18016
6392 1 12 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.094 -0.044 18016
6393 1 12 . 1 1 12 12 LYS C C 12 179.700 179.700 178.946 0.754 18016
6394 1 12 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.160 0.040 18016
6395 1 12 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.488 -0.888 18016
6396 1 12 . 1 1 12 12 LYS H H 12 7.820 7.820 7.769 0.051 18016
6397 1 12 . 1 1 13 13 ILE N N 13 120.100 120.100 120.377 -0.277 18016
6398 1 12 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.736 -0.046 18016
6399 1 12 . 1 1 13 13 ILE C C 13 178.100 178.100 177.974 0.126 18016
6400 1 12 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.872 -0.872 18016
6401 1 12 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.715 -1.315 18016
6402 1 12 . 1 1 13 13 ILE H H 13 7.640 7.640 7.954 -0.314 18016
6403 1 12 . 1 1 14 14 ALA N N 14 122.700 122.700 122.048 0.652 18016
6404 1 12 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.978 -0.118 18016
6405 1 12 . 1 1 14 14 ALA C C 14 179.000 179.000 179.564 -0.564 18016
6406 1 12 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.478 0.522 18016
6407 1 12 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.055 -0.055 18016
6408 1 12 . 1 1 14 14 ALA H H 14 8.680 8.680 8.461 0.219 18016
6409 1 12 . 1 1 15 15 ALA N N 15 118.700 118.700 121.601 -2.901 18016
6410 1 12 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.066 0.024 18016
6411 1 12 . 1 1 15 15 ALA C C 15 180.400 180.400 178.962 1.438 18016
6412 1 12 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.781 0.220 18016
6413 1 12 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.433 -0.733 18016
6414 1 12 . 1 1 15 15 ALA H H 15 8.070 8.070 8.110 -0.040 18016
6415 1 12 . 1 1 16 16 TRP N N 16 122.900 122.900 121.035 1.865 18016
6416 1 12 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.215 0.345 18016
6417 1 12 . 1 1 16 16 TRP C C 16 178.400 178.400 178.132 0.268 18016
6418 1 12 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.127 -1.527 18016
6419 1 12 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.212 -0.912 18016
6420 1 12 . 1 1 16 16 TRP H H 16 7.820 7.820 8.060 -0.240 18016
6421 1 12 . 1 1 17 17 LEU N N 17 120.400 120.400 119.306 1.094 18016
6422 1 12 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.111 0.499 18016
6423 1 12 . 1 1 17 17 LEU C C 17 179.000 179.000 178.767 0.233 18016
6424 1 12 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.869 0.031 18016
6425 1 12 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.604 0.396 18016
6426 1 12 . 1 1 17 17 LEU H H 17 8.630 8.630 8.540 0.090 18016
6427 1 12 . 1 1 18 18 ASN N N 18 116.200 116.200 116.651 -0.451 18016
6428 1 12 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.589 -0.279 18016
6429 1 12 . 1 1 18 18 ASN C C 18 177.100 177.100 176.797 0.303 18016
6430 1 12 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.501 0.099 18016
6431 1 12 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.952 0.248 18016
6432 1 12 . 1 1 18 18 ASN H H 18 8.350 8.350 8.396 -0.046 18016
6433 1 12 . 1 1 19 19 ALA N N 19 119.600 119.600 120.957 -1.357 18016
6434 1 12 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.224 -0.134 18016
6435 1 12 . 1 1 19 19 ALA C C 19 180.100 180.100 178.912 1.188 18016
6436 1 12 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.163 0.037 18016
6437 1 12 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.515 -0.915 18016
6438 1 12 . 1 1 19 19 ALA H H 19 7.920 7.920 7.979 -0.059 18016
6439 1 12 . 1 1 20 20 GLY N N 20 103.500 103.500 105.526 -2.026 18016
6440 1 12 . 1 1 20 20 GLY C C 20 173.800 173.800 173.650 0.150 18016
6441 1 12 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.278 0.522 18016
6442 1 12 . 1 1 20 20 GLY H H 20 7.700 7.700 7.320 0.380 18016
6443 1 12 . 1 1 21 21 TYR N N 21 119.900 119.900 117.945 1.955 18016
6444 1 12 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.938 0.232 18016
6445 1 12 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.035 1.365 18016
6446 1 12 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.664 -0.864 18016
6447 1 12 . 1 1 21 21 TYR H H 21 7.980 7.980 8.011 -0.031 18016
6448 1 12 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.427 0.073 18016
6449 1 12 . 1 1 22 22 PRO C C 22 178.700 178.700 177.055 1.645 18016
6450 1 12 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.289 0.711 18016
6451 1 12 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.107 -0.107 18016
6452 1 12 . 1 1 23 23 GLU N N 23 116.300 116.300 118.216 -1.916 18016
6453 1 12 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.379 0.191 18016
6454 1 12 . 1 1 23 23 GLU C C 23 176.300 176.300 176.306 -0.006 18016
6455 1 12 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.859 -1.259 18016
6456 1 12 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.830 -0.330 18016
6457 1 12 . 1 1 23 23 GLU H H 23 8.680 8.680 8.288 0.392 18016
6458 1 12 . 1 1 24 24 GLY N N 24 108.100 108.100 107.845 0.255 18016
6459 1 12 . 1 1 24 24 GLY C C 24 173.100 173.100 172.592 0.508 18016
6460 1 12 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.564 -1.664 18016
6461 1 12 . 1 1 24 24 GLY H H 24 7.230 7.230 7.950 -0.720 18016
6462 1 12 . 1 1 25 25 VAL N N 25 121.500 121.500 120.321 1.179 18016
6463 1 12 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.902 -0.312 18016
6464 1 12 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.095 1.205 18016
6465 1 12 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.184 -0.084 18016
6466 1 12 . 1 1 25 25 VAL H H 25 8.050 8.050 7.954 0.096 18016
6467 1 12 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.480 -0.160 18016
6468 1 12 . 1 1 26 26 PRO C C 26 177.600 177.600 177.882 -0.282 18016
6469 1 12 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.386 0.514 18016
6470 1 12 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.014 0.086 18016
6471 1 12 . 1 1 27 27 GLY N N 27 109.000 109.000 109.179 -0.179 18016
6472 1 12 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.534 1.566 18016
6473 1 12 . 1 1 27 27 GLY H H 27 8.930 8.930 8.827 0.103 18016
6474 1 12 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.451 -0.061 18016
6475 1 12 . 1 1 28 28 PRO C C 28 175.800 175.800 177.097 -1.297 18016
6476 1 12 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.626 -0.226 18016
6477 1 12 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.265 0.635 18016
6478 1 12 . 1 1 29 29 ASP N N 29 115.000 115.000 119.556 -4.556 18016
6479 1 12 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.790 -0.300 18016
6480 1 12 . 1 1 29 29 ASP C C 29 177.000 177.000 177.880 -0.880 18016
6481 1 12 . 1 1 29 29 ASP CA C 29 53.900 53.900 56.344 -2.444 18016
6482 1 12 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.718 -1.018 18016
6483 1 12 . 1 1 29 29 ASP H H 29 7.760 7.760 7.926 -0.166 18016
6484 1 12 . 1 1 30 30 ARG N N 30 119.900 119.900 121.900 -2.000 18016
6485 1 12 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.814 -0.244 18016
6486 1 12 . 1 1 30 30 ARG C C 30 176.500 176.500 178.300 -1.800 18016
6487 1 12 . 1 1 30 30 ARG CA C 30 61.900 61.900 60.070 1.830 18016
6488 1 12 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.248 0.252 18016
6489 1 12 . 1 1 30 30 ARG H H 30 7.460 7.460 8.180 -0.720 18016
6490 1 12 . 1 1 31 31 VAL N N 31 117.600 117.600 119.325 -1.725 18016
6491 1 12 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.946 -0.126 18016
6492 1 12 . 1 1 31 31 VAL CA C 31 68.700 68.700 67.887 0.813 18016
6493 1 12 . 1 1 31 31 VAL CB C 31 28.800 28.800 28.704 0.096 18016
6494 1 12 . 1 1 31 31 VAL H H 31 9.080 9.080 8.247 0.833 18016
6495 1 12 . 1 1 32 32 PRO C C 32 177.000 177.000 179.020 -2.020 18016
6496 1 12 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.776 -0.576 18016
6497 1 12 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.270 -0.470 18016
6498 1 12 . 1 1 33 33 LEU N N 33 115.200 115.200 121.099 -5.899 18016
6499 1 12 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.137 -0.017 18016
6500 1 12 . 1 1 33 33 LEU C C 33 178.600 178.600 178.484 0.116 18016
6501 1 12 . 1 1 33 33 LEU CA C 33 58.400 58.400 57.988 0.412 18016
6502 1 12 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.325 0.175 18016
6503 1 12 . 1 1 33 33 LEU H H 33 8.010 8.010 8.121 -0.111 18016
6504 1 12 . 1 1 34 34 LEU N N 34 120.400 120.400 119.336 1.064 18016
6505 1 12 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.051 -0.121 18016
6506 1 12 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.707 0.393 18016
6507 1 12 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.331 0.569 18016
6508 1 12 . 1 1 34 34 LEU H H 34 8.220 8.220 8.321 -0.101 18016
6509 1 12 . 1 1 35 35 ALA N N 35 123.100 123.100 122.494 0.606 18016
6510 1 12 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.158 -0.118 18016
6511 1 12 . 1 1 35 35 ALA C C 35 179.500 179.500 179.807 -0.307 18016
6512 1 12 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.901 0.599 18016
6513 1 12 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.476 -0.576 18016
6514 1 12 . 1 1 35 35 ALA H H 35 8.560 8.560 8.049 0.511 18016
6515 1 12 . 1 1 36 36 LEU N N 36 117.600 117.600 119.214 -1.614 18016
6516 1 12 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.228 -0.108 18016
6517 1 12 . 1 1 36 36 LEU C C 36 180.100 180.100 178.705 1.395 18016
6518 1 12 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.593 0.607 18016
6519 1 12 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.736 1.064 18016
6520 1 12 . 1 1 36 36 LEU H H 36 7.850 7.850 7.906 -0.056 18016
6521 1 12 . 1 1 37 37 LEU N N 37 116.700 116.700 118.452 -1.752 18016
6522 1 12 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.000 0.100 18016
6523 1 12 . 1 1 37 37 LEU C C 37 180.100 180.100 179.173 0.927 18016
6524 1 12 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.094 0.205 18016
6525 1 12 . 1 1 37 37 LEU CB C 37 42.200 42.200 42.060 0.140 18016
6526 1 12 . 1 1 37 37 LEU H H 37 8.730 8.730 8.307 0.423 18016
6527 1 12 . 1 1 38 38 THR N N 38 110.600 110.600 108.483 2.117 18016
6528 1 12 . 1 1 38 38 THR HA H 38 4.440 4.440 4.119 0.321 18016
6529 1 12 . 1 1 38 38 THR C C 38 175.100 175.100 176.738 -1.638 18016
6530 1 12 . 1 1 38 38 THR CA C 38 64.200 64.200 64.450 -0.250 18016
6531 1 12 . 1 1 38 38 THR CB C 38 70.000 70.000 68.412 1.588 18016
6532 1 12 . 1 1 38 38 THR H H 38 8.660 8.660 8.553 0.107 18016
6533 1 12 . 1 1 39 39 ARG N N 39 118.000 118.000 121.946 -3.946 18016
6534 1 12 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.151 0.129 18016
6535 1 12 . 1 1 39 39 ARG C C 39 177.300 177.300 177.573 -0.273 18016
6536 1 12 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.055 0.245 18016
6537 1 12 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.040 0.160 18016
6538 1 12 . 1 1 39 39 ARG H H 39 7.180 7.180 7.595 -0.415 18016
6539 1 12 . 1 1 40 40 ARG N N 40 114.400 114.400 119.329 -4.929 18016
6540 1 12 . 1 1 40 40 ARG C C 40 174.800 174.800 174.071 0.729 18016
6541 1 12 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.476 -0.176 18016
6542 1 12 . 1 1 40 40 ARG CB C 40 34.600 34.600 30.151 4.449 18016
6543 1 12 . 1 1 40 40 ARG H H 40 7.520 7.520 7.941 -0.421 18016
6544 1 12 . 1 1 41 41 LEU N N 41 119.400 119.400 121.320 -1.920 18016
6545 1 12 . 1 1 41 41 LEU C C 41 177.100 177.100 175.470 1.630 18016
6546 1 12 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.939 -1.239 18016
6547 1 12 . 1 1 41 41 LEU CB C 41 44.400 44.400 46.301 -1.901 18016
6548 1 12 . 1 1 41 41 LEU H H 41 8.380 8.380 8.162 0.218 18016
6549 1 12 . 1 1 42 42 THR N N 42 112.000 112.000 116.139 -4.139 18016
6550 1 12 . 1 1 42 42 THR HA H 42 4.440 4.440 4.513 -0.073 18016
6551 1 12 . 1 1 42 42 THR C C 42 175.800 175.800 175.223 0.577 18016
6552 1 12 . 1 1 42 42 THR CA C 42 60.500 60.500 59.702 0.798 18016
6553 1 12 . 1 1 42 42 THR CB C 42 70.800 70.800 71.051 -0.251 18016
6554 1 12 . 1 1 42 42 THR H H 42 9.330 9.330 8.678 0.652 18016
6555 1 12 . 1 1 43 43 ASN N N 43 119.900 119.900 120.786 -0.886 18016
6556 1 12 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.334 -0.084 18016
6557 1 12 . 1 1 43 43 ASN C C 43 177.900 177.900 176.805 1.095 18016
6558 1 12 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.991 -0.291 18016
6559 1 12 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.463 -1.263 18016
6560 1 12 . 1 1 43 43 ASN H H 43 9.140 9.140 8.949 0.191 18016
6561 1 12 . 1 1 44 44 ASP N N 44 118.000 118.000 120.513 -2.513 18016
6562 1 12 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.366 0.034 18016
6563 1 12 . 1 1 44 44 ASP C C 44 179.600 179.600 178.510 1.090 18016
6564 1 12 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.908 -0.608 18016
6565 1 12 . 1 1 44 44 ASP H H 44 8.360 8.360 8.634 -0.274 18016
6566 1 12 . 1 1 45 45 GLU N N 45 122.600 122.600 120.001 2.599 18016
6567 1 12 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.020 -0.050 18016
6568 1 12 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.362 0.038 18016
6569 1 12 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.853 0.447 18016
6570 1 12 . 1 1 45 45 GLU H H 45 7.850 7.850 7.700 0.150 18016
6571 1 12 . 1 1 46 46 ILE N N 46 118.900 118.900 120.672 -1.772 18016
6572 1 12 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.764 -0.334 18016
6573 1 12 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.285 1.715 18016
6574 1 12 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.782 -0.082 18016
6575 1 12 . 1 1 46 46 ILE H H 46 8.290 8.290 8.261 0.029 18016
6576 1 12 . 1 1 47 47 LYS N N 47 118.900 118.900 119.431 -0.531 18016
6577 1 12 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.956 -0.086 18016
6578 1 12 . 1 1 47 47 LYS C C 47 178.400 178.400 178.907 -0.507 18016
6579 1 12 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.811 0.489 18016
6580 1 12 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.231 0.369 18016
6581 1 12 . 1 1 47 47 LYS H H 47 8.290 8.290 8.201 0.089 18016
6582 1 12 . 1 1 48 48 ALA N N 48 121.100 121.100 123.094 -1.994 18016
6583 1 12 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.986 0.184 18016
6584 1 12 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.273 -0.173 18016
6585 1 12 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.187 -0.187 18016
6586 1 12 . 1 1 48 48 ALA H H 48 7.710 7.710 8.214 -0.504 18016
6587 1 12 . 1 1 49 49 ILE N N 49 119.900 119.900 117.571 2.329 18016
6588 1 12 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.759 -0.109 18016
6589 1 12 . 1 1 49 49 ILE C C 49 177.300 177.300 177.991 -0.691 18016
6590 1 12 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.415 1.585 18016
6591 1 12 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.463 1.637 18016
6592 1 12 . 1 1 49 49 ILE H H 49 8.130 8.130 8.223 -0.094 18016
6593 1 12 . 1 1 50 50 ALA N N 50 122.000 122.000 122.618 -0.618 18016
6594 1 12 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.034 -0.174 18016
6595 1 12 . 1 1 50 50 ALA C C 50 179.800 179.800 179.774 0.026 18016
6596 1 12 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.387 0.313 18016
6597 1 12 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.222 -0.322 18016
6598 1 12 . 1 1 50 50 ALA H H 50 8.730 8.730 7.868 0.862 18016
6599 1 12 . 1 1 51 51 GLU N N 51 116.900 116.900 118.266 -1.366 18016
6600 1 12 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.963 0.057 18016
6601 1 12 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.346 0.054 18016
6602 1 12 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.258 0.242 18016
6603 1 12 . 1 1 51 51 GLU H H 51 8.220 8.220 8.563 -0.343 18016
6604 1 12 . 1 1 52 52 ASP N N 52 120.300 120.300 119.327 0.973 18016
6605 1 12 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.462 -0.072 18016
6606 1 12 . 1 1 52 52 ASP C C 52 178.900 178.900 178.228 0.672 18016
6607 1 12 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.854 0.646 18016
6608 1 12 . 1 1 52 52 ASP CB C 52 42.500 42.500 40.952 1.548 18016
6609 1 12 . 1 1 52 52 ASP H H 52 7.700 7.700 7.977 -0.277 18016
6610 1 12 . 1 1 53 53 LEU N N 53 118.300 118.300 118.855 -0.555 18016
6611 1 12 . 1 1 53 53 LEU HA H 53 3.730 3.730 4.126 -0.396 18016
6612 1 12 . 1 1 53 53 LEU C C 53 179.000 179.000 179.196 -0.196 18016
6613 1 12 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.403 0.097 18016
6614 1 12 . 1 1 53 53 LEU CB C 53 41.100 41.100 42.375 -1.275 18016
6615 1 12 . 1 1 53 53 LEU H H 53 8.290 8.290 7.517 0.773 18016
6616 1 12 . 1 1 54 54 GLU N N 54 118.700 118.700 118.015 0.685 18016
6617 1 12 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.973 0.247 18016
6618 1 12 . 1 1 54 54 GLU C C 54 178.200 178.200 177.106 1.094 18016
6619 1 12 . 1 1 54 54 GLU CA C 54 58.700 58.700 57.853 0.847 18016
6620 1 12 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.707 1.193 18016
6621 1 12 . 1 1 54 54 GLU H H 54 8.070 8.070 8.539 -0.469 18016
6622 1 12 . 1 1 55 55 LYS N N 55 117.700 117.700 118.634 -0.934 18016
6623 1 12 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.010 0.140 18016
6624 1 12 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.434 -0.134 18016
6625 1 12 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.486 0.214 18016
6626 1 12 . 1 1 55 55 LYS H H 55 7.750 7.750 7.734 0.016 18016
6627 1 12 . 1 1 56 56 ARG N N 56 117.100 117.100 117.338 -0.238 18016
6628 1 12 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.210 0.060 18016
6629 1 12 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.786 -0.986 18016
6630 1 12 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.252 -0.251 18016
6631 1 12 . 1 1 56 56 ARG H H 56 8.270 8.270 7.702 0.569 18016
6632 1 12 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.391 -0.031 18016
6633 1 12 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.809 0.291 18016
6634 1 12 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.932 -1.732 18016
6635 1 12 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.878 -0.368 18016
6636 1 12 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.873 0.327 18016
6637 1 12 . 1 1 58 58 HIS CB C 58 27.300 27.300 30.349 -3.049 18016
6638 1 12 . 1 1 59 59 PHE N N 59 120.400 120.400 122.268 -1.868 18016
6639 1 12 . 1 1 59 59 PHE C C 59 175.500 175.500 174.931 0.569 18016
6640 1 12 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.997 -0.797 18016
6641 1 12 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.919 -0.619 18016
6642 1 12 . 1 1 59 59 PHE H H 59 7.710 7.710 8.516 -0.806 18016
6643 1 12 . 1 1 60 60 ASP N N 60 120.800 120.800 118.218 2.582 18016
6644 1 12 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.809 -0.319 18016
6645 1 12 . 1 1 60 60 ASP CA C 60 54.300 54.300 53.139 1.161 18016
6646 1 12 . 1 1 60 60 ASP CB C 60 41.100 41.100 43.482 -2.382 18016
6647 1 12 . 1 1 60 60 ASP H H 60 8.180 8.180 8.307 -0.127 18016
6648 1 12 . 1 1 61 61 HIS N N 61 118.300 118.300 116.382 1.918 18016
6649 1 12 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.837 -0.447 18016
6650 1 12 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.616 1.084 18016
6651 1 12 . 1 1 61 61 HIS CB C 61 28.800 28.800 31.433 -2.632 18016
6652 1 12 . 1 1 61 61 HIS H H 61 8.550 8.550 8.382 0.168 18016
6653 1 12 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.340 -0.330 18016
6654 1 12 . 1 1 62 62 ILE C C 62 173.800 173.800 175.496 -1.696 18016
6655 1 12 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.903 5.597 18016
6656 1 12 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.357 1.743 18016
6657 1 12 . 1 1 63 63 ASP N N 63 125.100 125.100 123.127 1.973 18016
6658 1 12 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.418 0.182 18016
6659 1 12 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.459 -2.659 18016
6660 1 12 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.443 -1.943 18016
6661 1 12 . 1 1 63 63 ASP H H 63 8.360 8.360 7.973 0.387 18016
6662 1 12 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.899 -0.229 18016
6663 1 12 . 1 1 64 64 ILE C C 64 177.000 177.000 176.654 0.346 18016
6664 1 12 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.292 -1.192 18016
6665 1 12 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.408 -1.808 18016
6666 1 12 . 1 1 65 65 GLY N N 65 107.600 107.600 107.972 -0.372 18016
6667 1 12 . 1 1 65 65 GLY C C 65 177.000 177.000 176.051 0.949 18016
6668 1 12 . 1 1 65 65 GLY CA C 65 47.300 47.300 47.194 0.106 18016
6669 1 12 . 1 1 65 65 GLY H H 65 8.440 8.440 7.867 0.573 18016
6670 1 12 . 1 1 66 66 VAL N N 66 121.800 121.800 121.959 -0.159 18016
6671 1 12 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.743 0.017 18016
6672 1 12 . 1 1 66 66 VAL C C 66 178.500 178.500 177.749 0.751 18016
6673 1 12 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.762 -0.162 18016
6674 1 12 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.473 0.527 18016
6675 1 12 . 1 1 66 66 VAL H H 66 7.550 7.550 8.250 -0.700 18016
6676 1 12 . 1 1 67 67 LEU N N 67 120.900 120.900 119.128 1.772 18016
6677 1 12 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.022 0.048 18016
6678 1 12 . 1 1 67 67 LEU C C 67 179.000 179.000 179.113 -0.113 18016
6679 1 12 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.455 0.145 18016
6680 1 12 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.584 1.716 18016
6681 1 12 . 1 1 67 67 LEU H H 67 7.650 7.650 7.395 0.255 18016
6682 1 12 . 1 1 68 68 ILE N N 68 118.900 118.900 118.182 0.718 18016
6683 1 12 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.771 -0.061 18016
6684 1 12 . 1 1 68 68 ILE C C 68 179.500 179.500 178.234 1.266 18016
6685 1 12 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.877 0.323 18016
6686 1 12 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.417 0.083 18016
6687 1 12 . 1 1 68 68 ILE H H 68 8.580 8.580 7.597 0.983 18016
6688 1 12 . 1 1 69 69 THR N N 69 118.100 118.100 114.305 3.795 18016
6689 1 12 . 1 1 69 69 THR HA H 69 3.940 3.940 4.024 -0.084 18016
6690 1 12 . 1 1 69 69 THR C C 69 176.200 176.200 176.440 -0.240 18016
6691 1 12 . 1 1 69 69 THR CA C 69 66.600 66.600 66.231 0.369 18016
6692 1 12 . 1 1 69 69 THR CB C 69 68.500 68.500 68.241 0.259 18016
6693 1 12 . 1 1 69 69 THR H H 69 7.840 7.840 7.622 0.218 18016
6694 1 12 . 1 1 70 70 GLN N N 70 121.600 121.600 120.287 1.313 18016
6695 1 12 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.181 -0.071 18016
6696 1 12 . 1 1 70 70 GLN C C 70 178.100 178.100 178.151 -0.051 18016
6697 1 12 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.470 0.630 18016
6698 1 12 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.718 -0.418 18016
6699 1 12 . 1 1 70 70 GLN H H 70 8.100 8.100 7.567 0.533 18016
6700 1 12 . 1 1 71 71 MET N N 71 118.700 118.700 118.258 0.442 18016
6701 1 12 . 1 1 71 71 MET HA H 71 4.010 4.010 4.422 -0.412 18016
6702 1 12 . 1 1 71 71 MET C C 71 176.300 176.300 178.183 -1.883 18016
6703 1 12 . 1 1 71 71 MET CA C 71 58.100 58.100 58.991 -0.891 18016
6704 1 12 . 1 1 71 71 MET CB C 71 33.600 33.600 32.840 0.760 18016
6705 1 12 . 1 1 71 71 MET H H 71 8.350 8.350 8.249 0.101 18016
6706 1 12 . 1 1 72 72 THR N N 72 111.600 111.600 111.360 0.240 18016
6707 1 12 . 1 1 72 72 THR HA H 72 3.940 3.940 4.123 -0.183 18016
6708 1 12 . 1 1 72 72 THR C C 72 175.800 175.800 175.617 0.183 18016
6709 1 12 . 1 1 72 72 THR CA C 72 65.300 65.300 64.965 0.335 18016
6710 1 12 . 1 1 72 72 THR CB C 72 69.100 69.100 69.324 -0.224 18016
6711 1 12 . 1 1 72 72 THR H H 72 7.840 7.840 7.776 0.064 18016
6712 1 12 . 1 1 73 73 ASP N N 73 121.100 121.100 120.112 0.988 18016
6713 1 12 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.656 -0.126 18016
6714 1 12 . 1 1 73 73 ASP C C 73 176.600 176.600 175.736 0.864 18016
6715 1 12 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.264 0.936 18016
6716 1 12 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.491 -1.091 18016
6717 1 12 . 1 1 73 73 ASP H H 73 7.840 7.840 7.643 0.197 18016
6718 1 12 . 1 1 74 74 GLU N N 74 121.100 121.100 118.970 2.130 18016
6719 1 12 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.551 -0.211 18016
6720 1 12 . 1 1 74 74 GLU C C 74 173.800 173.800 175.192 -1.392 18016
6721 1 12 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.593 -0.092 18016
6722 1 12 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.583 -0.983 18016
6723 1 12 . 1 1 74 74 GLU H H 74 7.980 7.980 8.422 -0.442 18016
6724 1 12 . 1 1 75 75 MET N N 75 125.800 125.800 126.716 -0.916 18016
6725 1 12 . 1 1 75 75 MET HA H 75 4.710 4.710 4.657 0.053 18016
6726 1 12 . 1 1 75 75 MET CA C 75 53.800 53.800 54.719 -0.919 18016
6727 1 12 . 1 1 75 75 MET CB C 75 31.700 31.700 31.912 -0.212 18016
6728 1 12 . 1 1 75 75 MET H H 75 8.380 8.380 8.676 -0.296 18016
6729 1 12 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.418 0.092 18016
6730 1 12 . 1 1 76 76 PRO C C 76 175.700 175.700 176.493 -0.793 18016
6731 1 12 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.547 -1.547 18016
6732 1 12 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.184 -0.384 18016
6733 1 12 . 1 1 77 77 ARG N N 77 119.700 119.700 119.485 0.215 18016
6734 1 12 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.539 -0.269 18016
6735 1 12 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.382 0.418 18016
6736 1 12 . 1 1 77 77 ARG CB C 77 30.700 30.700 31.842 -1.142 18016
6737 1 12 . 1 1 77 77 ARG H H 77 8.940 8.940 7.960 0.980 18016
6738 1 12 . 1 1 78 78 GLU N N 78 124.700 124.700 125.664 -0.964 18016
6739 1 12 . 1 1 78 78 GLU HA H 78 3.960 3.960 4.012 -0.052 18016
6740 1 12 . 1 1 78 78 GLU C C 78 179.000 179.000 178.153 0.847 18016
6741 1 12 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.664 0.136 18016
6742 1 12 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.656 -0.656 18016
6743 1 12 . 1 1 78 78 GLU H H 78 9.170 9.170 8.968 0.202 18016
6744 1 12 . 1 1 79 79 GLU N N 79 116.800 116.800 120.316 -3.516 18016
6745 1 12 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.104 0.016 18016
6746 1 12 . 1 1 79 79 GLU C C 79 179.100 179.100 178.380 0.720 18016
6747 1 12 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.845 -0.145 18016
6748 1 12 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.350 -0.350 18016
6749 1 12 . 1 1 79 79 GLU H H 79 9.660 9.660 8.680 0.980 18016
6750 1 12 . 1 1 80 80 ASP N N 80 120.000 120.000 118.760 1.240 18016
6751 1 12 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.443 0.247 18016
6752 1 12 . 1 1 80 80 ASP C C 80 177.300 177.300 178.666 -1.366 18016
6753 1 12 . 1 1 80 80 ASP CA C 80 57.400 57.400 58.056 -0.656 18016
6754 1 12 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.398 1.202 18016
6755 1 12 . 1 1 80 80 ASP H H 80 7.310 7.310 8.442 -1.132 18016
6756 1 12 . 1 1 81 81 ILE N N 81 120.100 120.100 120.416 -0.316 18016
6757 1 12 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.700 -0.210 18016
6758 1 12 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.826 0.474 18016
6759 1 12 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.988 0.312 18016
6760 1 12 . 1 1 81 81 ILE H H 81 7.610 7.610 8.254 -0.644 18016
6761 1 12 . 1 1 82 82 GLU N N 82 118.100 118.100 120.437 -2.337 18016
6762 1 12 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.043 0.237 18016
6763 1 12 . 1 1 82 82 GLU C C 82 177.800 177.800 178.611 -0.811 18016
6764 1 12 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.740 -1.740 18016
6765 1 12 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.353 -0.553 18016
6766 1 12 . 1 1 82 82 GLU H H 82 8.550 8.550 8.259 0.291 18016
6767 1 12 . 1 1 83 83 ARG N N 83 119.900 119.900 119.438 0.462 18016
6768 1 12 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.102 -0.072 18016
6769 1 12 . 1 1 83 83 ARG C C 83 179.400 179.400 178.953 0.447 18016
6770 1 12 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.058 0.842 18016
6771 1 12 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.149 -0.549 18016
6772 1 12 . 1 1 83 83 ARG H H 83 7.590 7.590 8.274 -0.684 18016
6773 1 12 . 1 1 84 84 VAL N N 84 120.400 120.400 119.307 1.093 18016
6774 1 12 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.898 -0.148 18016
6775 1 12 . 1 1 84 84 VAL C C 84 177.400 177.400 177.849 -0.449 18016
6776 1 12 . 1 1 84 84 VAL CA C 84 66.900 66.900 66.058 0.842 18016
6777 1 12 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.995 -0.095 18016
6778 1 12 . 1 1 84 84 VAL H H 84 7.550 7.550 8.480 -0.930 18016
6779 1 12 . 1 1 85 85 ARG N N 85 121.600 121.600 119.533 2.067 18016
6780 1 12 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.279 -0.269 18016
6781 1 12 . 1 1 85 85 ARG C C 85 178.100 178.100 178.734 -0.634 18016
6782 1 12 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.821 1.079 18016
6783 1 12 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.901 0.299 18016
6784 1 12 . 1 1 85 85 ARG H H 85 9.090 9.090 8.463 0.627 18016
6785 1 12 . 1 1 86 86 ARG N N 86 115.600 115.600 118.268 -2.668 18016
6786 1 12 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.162 -0.282 18016
6787 1 12 . 1 1 86 86 ARG C C 86 179.000 179.000 178.749 0.251 18016
6788 1 12 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.993 0.407 18016
6789 1 12 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.595 0.805 18016
6790 1 12 . 1 1 86 86 ARG H H 86 8.660 8.660 8.525 0.135 18016
6791 1 12 . 1 1 87 87 HIS N N 87 118.000 118.000 119.959 -1.959 18016
6792 1 12 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.363 -0.003 18016
6793 1 12 . 1 1 87 87 HIS C C 87 178.400 178.400 177.441 0.959 18016
6794 1 12 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.404 0.196 18016
6795 1 12 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.013 0.687 18016
6796 1 12 . 1 1 87 87 HIS H H 87 7.640 7.640 7.712 -0.072 18016
6797 1 12 . 1 1 88 88 LEU N N 88 119.600 119.600 119.314 0.286 18016
6798 1 12 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.045 -0.465 18016
6799 1 12 . 1 1 88 88 LEU C C 88 180.000 180.000 178.925 1.075 18016
6800 1 12 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.005 0.195 18016
6801 1 12 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.051 1.549 18016
6802 1 12 . 1 1 88 88 LEU H H 88 8.650 8.650 8.591 0.059 18016
6803 1 12 . 1 1 89 89 ALA N N 89 118.500 118.500 122.650 -4.150 18016
6804 1 12 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.764 0.596 18016
6805 1 12 . 1 1 89 89 ALA C C 89 180.400 180.400 179.981 0.419 18016
6806 1 12 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.781 -1.181 18016
6807 1 12 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.453 -0.353 18016
6808 1 12 . 1 1 89 89 ALA H H 89 8.870 8.870 8.373 0.497 18016
6809 1 12 . 1 1 90 90 LEU N N 90 119.400 119.400 117.560 1.840 18016
6810 1 12 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.937 0.273 18016
6811 1 12 . 1 1 90 90 LEU C C 90 179.100 179.100 179.158 -0.058 18016
6812 1 12 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.148 0.352 18016
6813 1 12 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.627 0.074 18016
6814 1 12 . 1 1 90 90 LEU H H 90 7.390 7.390 7.499 -0.109 18016
6815 1 12 . 1 1 91 91 GLN N N 91 114.500 114.500 116.122 -1.622 18016
6816 1 12 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.280 0.420 18016
6817 1 12 . 1 1 91 91 GLN C C 91 175.800 175.800 176.544 -0.744 18016
6818 1 12 . 1 1 91 91 GLN CA C 91 54.500 54.500 57.031 -2.530 18016
6819 1 12 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.872 -1.772 18016
6820 1 12 . 1 1 91 91 GLN H H 91 7.810 7.810 7.697 0.113 18016
6821 1 12 . 1 1 92 92 GLY N N 92 107.900 107.900 104.437 3.463 18016
6822 1 12 . 1 1 92 92 GLY C C 92 172.100 172.100 171.649 0.451 18016
6823 1 12 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.022 -1.022 18016
6824 1 12 . 1 1 92 92 GLY H H 92 7.710 7.710 8.201 -0.491 18016
6825 1 12 . 1 1 93 93 TRP N N 93 114.200 114.200 122.374 -8.174 18016
6826 1 12 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.627 1.373 18016
6827 1 12 . 1 1 93 93 TRP CB C 93 29.200 29.200 31.335 -2.135 18016
6828 1 12 . 1 1 93 93 TRP H H 93 8.450 8.450 8.318 0.132 18016
6829 1 12 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.240 0.220 18016
6830 1 12 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.558 -0.758 18016
6831 1 12 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.305 0.295 18016
6832 1 12 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.243 -0.743 18016
6833 1 12 . 1 1 95 95 LEU C C 95 175.000 175.000 178.047 -3.047 18016
6834 1 12 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.011 0.089 18016
6835 1 12 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.565 1.535 18016
6836 1 12 . 1 1 96 96 ASP N N 96 114.000 114.000 119.834 -5.834 18016
6837 1 12 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.663 0.287 18016
6838 1 12 . 1 1 96 96 ASP C C 96 175.800 175.800 175.967 -0.167 18016
6839 1 12 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.618 -2.618 18016
6840 1 12 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.979 -0.079 18016
6841 1 12 . 1 1 96 96 ASP H H 96 7.230 7.230 7.697 -0.467 18016
6842 1 12 . 1 1 97 97 ASP N N 97 123.200 123.200 118.946 4.254 18016
6843 1 12 . 1 1 97 97 ASP HA H 97 4.610 4.610 5.016 -0.406 18016
6844 1 12 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.099 2.401 18016
6845 1 12 . 1 1 97 97 ASP CB C 97 38.700 38.700 41.543 -2.843 18016
6846 1 12 . 1 1 97 97 ASP H H 97 7.420 7.420 7.707 -0.287 18016
6847 1 12 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.674 -0.384 18016
6848 1 12 . 1 1 98 98 PRO C C 98 177.500 177.500 176.585 0.915 18016
6849 1 12 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.258 0.442 18016
6850 1 12 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.207 -1.307 18016
6851 1 12 . 1 1 99 99 ARG N N 99 121.300 121.300 121.669 -0.369 18016
6852 1 12 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.219 -0.509 18016
6853 1 12 . 1 1 99 99 ARG C C 99 176.500 176.500 176.215 0.285 18016
6854 1 12 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.731 -1.631 18016
6855 1 12 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.749 -0.249 18016
6856 1 12 . 1 1 99 99 ARG H H 99 8.390 8.390 8.386 0.004 18016
6857 1 12 . 1 1 100 100 ASP N N 100 119.600 119.600 114.626 4.974 18016
6858 1 12 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.672 -0.172 18016
6859 1 12 . 1 1 100 100 ASP C C 100 177.000 177.000 174.991 2.009 18016
6860 1 12 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.428 1.272 18016
6861 1 12 . 1 1 100 100 ASP CB C 100 40.900 40.900 43.518 -2.618 18016
6862 1 12 . 1 1 100 100 ASP H H 100 8.260 8.260 7.581 0.679 18016
6863 1 12 . 1 1 101 101 GLY N N 101 109.300 109.300 107.155 2.145 18016
6864 1 12 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.751 0.649 18016
6865 1 12 . 1 1 101 101 GLY H H 101 8.450 8.450 8.178 0.272 18016
6866 1 12 . 1 1 102 102 GLU N N 102 119.800 119.800 119.886 -0.086 18016
6867 1 12 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.048 0.262 18016
6868 1 12 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.924 -0.924 18016
6869 1 12 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.058 0.442 18016
6870 1 12 . 1 1 102 102 GLU H H 102 8.140 8.140 8.174 -0.034 18016
6871 1 12 . 1 1 103 103 GLU N N 103 123.000 123.000 125.503 -2.503 18016
6872 1 12 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.503 0.057 18016
6873 1 12 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.169 0.131 18016
6874 1 12 . 1 1 103 103 GLU CB C 103 29.600 29.600 30.156 -0.556 18016
6875 1 12 . 1 1 103 103 GLU H H 103 8.580 8.580 8.594 -0.014 18016
6876 1 12 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.509 -0.029 18016
6877 1 12 . 1 1 104 104 PRO C C 104 176.800 176.800 175.837 0.963 18016
6878 1 12 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.854 -0.454 18016
6879 1 12 . 1 1 104 104 PRO CB C 104 32.100 32.100 31.377 0.723 18016
6880 1 12 . 1 1 105 105 ASP N N 105 120.400 120.400 116.805 3.595 18016
6881 1 12 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.767 -0.187 18016
6882 1 12 . 1 1 105 105 ASP C C 105 177.100 177.100 175.346 1.754 18016
6883 1 12 . 1 1 105 105 ASP CA C 105 54.300 54.300 53.818 0.482 18016
6884 1 12 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.500 -0.100 18016
6885 1 12 . 1 1 105 105 ASP H H 105 8.500 8.500 7.736 0.764 18016
6886 1 12 . 1 1 106 106 GLY N N 106 109.300 109.300 108.061 1.239 18016
6887 1 12 . 1 1 106 106 GLY C C 106 174.600 174.600 172.772 1.828 18016
6888 1 12 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.560 -0.160 18016
6889 1 12 . 1 1 106 106 GLY H H 106 8.360 8.360 7.450 0.910 18016
6890 1 12 . 1 1 107 107 GLU N N 107 120.400 120.400 119.975 0.425 18016
6891 1 12 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.750 -0.410 18016
6892 1 12 . 1 1 107 107 GLU C C 107 177.100 177.100 174.903 2.197 18016
6893 1 12 . 1 1 107 107 GLU CA C 107 56.500 56.500 55.998 0.502 18016
6894 1 12 . 1 1 107 107 GLU CB C 107 30.200 30.200 29.633 0.567 18016
6895 1 12 . 1 1 107 107 GLU H H 107 8.410 8.410 8.483 -0.073 18016
6896 1 12 . 1 1 108 108 SER N N 108 116.600 116.600 118.475 -1.875 18016
6897 1 12 . 1 1 108 108 SER HA H 108 4.450 4.450 4.660 -0.210 18016
6898 1 12 . 1 1 108 108 SER C C 108 175.300 175.300 173.258 2.042 18016
6899 1 12 . 1 1 108 108 SER CA C 108 58.700 58.700 58.368 0.332 18016
6900 1 12 . 1 1 108 108 SER CB C 108 63.800 63.800 65.743 -1.943 18016
6901 1 12 . 1 1 108 108 SER H H 108 8.460 8.460 9.060 -0.600 18016
6902 1 12 . 1 1 109 109 GLY N N 109 110.800 110.800 109.315 1.485 18016
6903 1 12 . 1 1 109 109 GLY C C 109 174.500 174.500 173.722 0.778 18016
6904 1 12 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.034 0.266 18016
6905 1 12 . 1 1 109 109 GLY H H 109 8.500 8.500 8.202 0.298 18016
6906 1 12 . 1 1 110 110 GLY N N 110 108.800 108.800 112.115 -3.315 18016
6907 1 12 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.120 -0.720 18016
6908 1 12 . 1 1 110 110 GLY H H 110 8.140 8.140 7.721 0.419 18016
6909 1 12 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.456 0.154 18016
6910 1 12 . 1 1 111 111 PRO C C 111 176.000 176.000 176.671 -0.671 18016
6911 1 12 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.951 -0.351 18016
6912 1 12 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.066 2.534 18016
6913 1 13 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.614 -0.183 18016
6914 1 13 . 1 1 2 2 PRO C C 2 177.600 177.600 178.366 -0.766 18016
6915 1 13 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.199 1.101 18016
6916 1 13 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.673 -0.373 18016
6917 1 13 . 1 1 3 3 GLY N N 3 110.000 110.000 107.290 2.710 18016
6918 1 13 . 1 1 3 3 GLY C C 3 174.200 174.200 174.179 0.021 18016
6919 1 13 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.303 0.097 18016
6920 1 13 . 1 1 3 3 GLY H H 3 8.700 8.700 8.614 0.086 18016
6921 1 13 . 1 1 4 4 SER N N 4 115.400 115.400 117.458 -2.058 18016
6922 1 13 . 1 1 4 4 SER HA H 4 4.440 4.440 5.137 -0.697 18016
6923 1 13 . 1 1 4 4 SER C C 4 174.800 174.800 174.701 0.099 18016
6924 1 13 . 1 1 4 4 SER CA C 4 58.400 58.400 56.871 1.529 18016
6925 1 13 . 1 1 4 4 SER CB C 4 63.800 63.800 64.508 -0.708 18016
6926 1 13 . 1 1 4 4 SER H H 4 8.210 8.210 7.762 0.448 18016
6927 1 13 . 1 1 5 5 MET N N 5 122.200 122.200 122.671 -0.471 18016
6928 1 13 . 1 1 5 5 MET HA H 5 4.510 4.510 4.794 -0.284 18016
6929 1 13 . 1 1 5 5 MET CA C 5 55.600 55.600 55.498 0.102 18016
6930 1 13 . 1 1 5 5 MET CB C 5 32.900 32.900 34.603 -1.703 18016
6931 1 13 . 1 1 5 5 MET H H 5 8.570 8.570 9.031 -0.461 18016
6932 1 13 . 1 1 6 6 VAL N N 6 120.000 120.000 118.239 1.761 18016
6933 1 13 . 1 1 6 6 VAL HA H 6 4.050 4.050 3.943 0.107 18016
6934 1 13 . 1 1 6 6 VAL C C 6 175.700 175.700 175.646 0.054 18016
6935 1 13 . 1 1 6 6 VAL CA C 6 62.700 62.700 62.120 0.580 18016
6936 1 13 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.206 0.294 18016
6937 1 13 . 1 1 6 6 VAL H H 6 8.150 8.150 7.587 0.563 18016
6938 1 13 . 1 1 7 7 ASN N N 7 122.000 122.000 118.834 3.166 18016
6939 1 13 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.577 0.083 18016
6940 1 13 . 1 1 7 7 ASN C C 7 175.200 175.200 177.107 -1.907 18016
6941 1 13 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.635 -0.435 18016
6942 1 13 . 1 1 7 7 ASN CB C 7 38.900 38.900 38.934 -0.034 18016
6943 1 13 . 1 1 7 7 ASN H H 7 8.010 8.010 8.473 -0.463 18016
6944 1 13 . 1 1 8 8 ALA N N 8 126.500 126.500 128.628 -2.128 18016
6945 1 13 . 1 1 8 8 ALA C C 8 180.200 180.200 179.169 1.031 18016
6946 1 13 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.138 0.362 18016
6947 1 13 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.900 -0.500 18016
6948 1 13 . 1 1 8 8 ALA H H 8 9.020 9.020 8.731 0.289 18016
6949 1 13 . 1 1 9 9 PHE N N 9 121.300 121.300 119.576 1.724 18016
6950 1 13 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.078 0.212 18016
6951 1 13 . 1 1 9 9 PHE C C 9 177.200 177.200 177.246 -0.046 18016
6952 1 13 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.854 -0.554 18016
6953 1 13 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.075 0.125 18016
6954 1 13 . 1 1 9 9 PHE H H 9 8.570 8.570 8.009 0.561 18016
6955 1 13 . 1 1 10 10 LEU N N 10 117.200 117.200 119.384 -2.184 18016
6956 1 13 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.875 -0.175 18016
6957 1 13 . 1 1 10 10 LEU C C 10 179.700 179.700 179.039 0.661 18016
6958 1 13 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.649 -0.049 18016
6959 1 13 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.366 0.334 18016
6960 1 13 . 1 1 10 10 LEU H H 10 8.150 8.150 8.033 0.117 18016
6961 1 13 . 1 1 11 11 ALA N N 11 121.500 121.500 122.725 -1.225 18016
6962 1 13 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.968 0.052 18016
6963 1 13 . 1 1 11 11 ALA C C 11 180.900 180.900 179.969 0.931 18016
6964 1 13 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.274 -0.274 18016
6965 1 13 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.440 -0.440 18016
6966 1 13 . 1 1 11 11 ALA H H 11 8.460 8.460 8.761 -0.301 18016
6967 1 13 . 1 1 12 12 LYS N N 12 120.700 120.700 118.754 1.946 18016
6968 1 13 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.044 0.006 18016
6969 1 13 . 1 1 12 12 LYS C C 12 179.700 179.700 179.084 0.616 18016
6970 1 13 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.616 0.584 18016
6971 1 13 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.829 -0.229 18016
6972 1 13 . 1 1 12 12 LYS H H 12 7.820 7.820 7.758 0.062 18016
6973 1 13 . 1 1 13 13 ILE N N 13 120.100 120.100 119.787 0.313 18016
6974 1 13 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.797 -0.107 18016
6975 1 13 . 1 1 13 13 ILE C C 13 178.100 178.100 178.236 -0.136 18016
6976 1 13 . 1 1 13 13 ILE CA C 13 63.000 63.000 64.107 -1.107 18016
6977 1 13 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.469 -1.069 18016
6978 1 13 . 1 1 13 13 ILE H H 13 7.640 7.640 7.928 -0.288 18016
6979 1 13 . 1 1 14 14 ALA N N 14 122.700 122.700 122.206 0.494 18016
6980 1 13 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.958 -0.098 18016
6981 1 13 . 1 1 14 14 ALA C C 14 179.000 179.000 179.515 -0.515 18016
6982 1 13 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.396 0.604 18016
6983 1 13 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.070 -0.070 18016
6984 1 13 . 1 1 14 14 ALA H H 14 8.680 8.680 8.426 0.254 18016
6985 1 13 . 1 1 15 15 ALA N N 15 118.700 118.700 121.457 -2.757 18016
6986 1 13 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.089 0.001 18016
6987 1 13 . 1 1 15 15 ALA C C 15 180.400 180.400 179.259 1.141 18016
6988 1 13 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.794 0.206 18016
6989 1 13 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.323 -0.623 18016
6990 1 13 . 1 1 15 15 ALA H H 15 8.070 8.070 8.154 -0.084 18016
6991 1 13 . 1 1 16 16 TRP N N 16 122.900 122.900 120.885 2.015 18016
6992 1 13 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.242 0.318 18016
6993 1 13 . 1 1 16 16 TRP C C 16 178.400 178.400 178.009 0.391 18016
6994 1 13 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.031 -1.431 18016
6995 1 13 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.141 -0.841 18016
6996 1 13 . 1 1 16 16 TRP H H 16 7.820 7.820 8.362 -0.542 18016
6997 1 13 . 1 1 17 17 LEU N N 17 120.400 120.400 119.369 1.031 18016
6998 1 13 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.134 0.476 18016
6999 1 13 . 1 1 17 17 LEU C C 17 179.000 179.000 178.759 0.241 18016
7000 1 13 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.578 0.322 18016
7001 1 13 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.404 0.596 18016
7002 1 13 . 1 1 17 17 LEU H H 17 8.630 8.630 8.165 0.465 18016
7003 1 13 . 1 1 18 18 ASN N N 18 116.200 116.200 116.703 -0.503 18016
7004 1 13 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.533 -0.223 18016
7005 1 13 . 1 1 18 18 ASN C C 18 177.100 177.100 177.072 0.028 18016
7006 1 13 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.995 -0.395 18016
7007 1 13 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.708 0.492 18016
7008 1 13 . 1 1 18 18 ASN H H 18 8.350 8.350 8.417 -0.067 18016
7009 1 13 . 1 1 19 19 ALA N N 19 119.600 119.600 120.495 -0.895 18016
7010 1 13 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.240 -0.150 18016
7011 1 13 . 1 1 19 19 ALA C C 19 180.100 180.100 178.735 1.365 18016
7012 1 13 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.343 -0.143 18016
7013 1 13 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.402 -0.802 18016
7014 1 13 . 1 1 19 19 ALA H H 19 7.920 7.920 7.815 0.105 18016
7015 1 13 . 1 1 20 20 GLY N N 20 103.500 103.500 104.829 -1.329 18016
7016 1 13 . 1 1 20 20 GLY C C 20 173.800 173.800 174.004 -0.204 18016
7017 1 13 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.215 0.585 18016
7018 1 13 . 1 1 20 20 GLY H H 20 7.700 7.700 7.261 0.439 18016
7019 1 13 . 1 1 21 21 TYR N N 21 119.900 119.900 117.812 2.088 18016
7020 1 13 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.901 0.269 18016
7021 1 13 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.983 1.417 18016
7022 1 13 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.765 -0.965 18016
7023 1 13 . 1 1 21 21 TYR H H 21 7.980 7.980 7.919 0.061 18016
7024 1 13 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.482 0.018 18016
7025 1 13 . 1 1 22 22 PRO C C 22 178.700 178.700 176.804 1.896 18016
7026 1 13 . 1 1 22 22 PRO CA C 22 65.000 65.000 63.873 1.127 18016
7027 1 13 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.289 -0.289 18016
7028 1 13 . 1 1 23 23 GLU N N 23 116.300 116.300 115.696 0.604 18016
7029 1 13 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.409 0.162 18016
7030 1 13 . 1 1 23 23 GLU C C 23 176.300 176.300 176.472 -0.172 18016
7031 1 13 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.328 -0.728 18016
7032 1 13 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.756 -0.256 18016
7033 1 13 . 1 1 23 23 GLU H H 23 8.680 8.680 8.170 0.510 18016
7034 1 13 . 1 1 24 24 GLY N N 24 108.100 108.100 108.920 -0.820 18016
7035 1 13 . 1 1 24 24 GLY C C 24 173.100 173.100 172.582 0.518 18016
7036 1 13 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.447 -1.547 18016
7037 1 13 . 1 1 24 24 GLY H H 24 7.230 7.230 7.484 -0.254 18016
7038 1 13 . 1 1 25 25 VAL N N 25 121.500 121.500 120.654 0.846 18016
7039 1 13 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.845 -0.255 18016
7040 1 13 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.152 1.148 18016
7041 1 13 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.683 -0.583 18016
7042 1 13 . 1 1 25 25 VAL H H 25 8.050 8.050 7.889 0.161 18016
7043 1 13 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.445 -0.125 18016
7044 1 13 . 1 1 26 26 PRO C C 26 177.600 177.600 178.034 -0.434 18016
7045 1 13 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.654 0.246 18016
7046 1 13 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.815 0.285 18016
7047 1 13 . 1 1 27 27 GLY N N 27 109.000 109.000 109.539 -0.539 18016
7048 1 13 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.686 1.414 18016
7049 1 13 . 1 1 27 27 GLY H H 27 8.930 8.930 8.858 0.072 18016
7050 1 13 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.267 0.123 18016
7051 1 13 . 1 1 28 28 PRO C C 28 175.800 175.800 177.165 -1.365 18016
7052 1 13 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.843 -0.443 18016
7053 1 13 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.498 0.402 18016
7054 1 13 . 1 1 29 29 ASP N N 29 115.000 115.000 115.695 -0.695 18016
7055 1 13 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.725 -0.235 18016
7056 1 13 . 1 1 29 29 ASP C C 29 177.000 177.000 177.894 -0.894 18016
7057 1 13 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.662 -1.762 18016
7058 1 13 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.290 -0.590 18016
7059 1 13 . 1 1 29 29 ASP H H 29 7.760 7.760 7.845 -0.085 18016
7060 1 13 . 1 1 30 30 ARG N N 30 119.900 119.900 121.673 -1.773 18016
7061 1 13 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.794 -0.224 18016
7062 1 13 . 1 1 30 30 ARG C C 30 176.500 176.500 178.355 -1.855 18016
7063 1 13 . 1 1 30 30 ARG CA C 30 61.900 61.900 60.047 1.853 18016
7064 1 13 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.239 0.261 18016
7065 1 13 . 1 1 30 30 ARG H H 30 7.460 7.460 8.030 -0.570 18016
7066 1 13 . 1 1 31 31 VAL N N 31 117.600 117.600 119.846 -2.246 18016
7067 1 13 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.824 -0.004 18016
7068 1 13 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.513 0.187 18016
7069 1 13 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.381 -0.581 18016
7070 1 13 . 1 1 31 31 VAL H H 31 9.080 9.080 8.200 0.880 18016
7071 1 13 . 1 1 32 32 PRO C C 32 177.000 177.000 178.690 -1.690 18016
7072 1 13 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.862 -0.662 18016
7073 1 13 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.159 -0.359 18016
7074 1 13 . 1 1 33 33 LEU N N 33 115.200 115.200 120.960 -5.760 18016
7075 1 13 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.049 0.071 18016
7076 1 13 . 1 1 33 33 LEU C C 33 178.600 178.600 178.419 0.181 18016
7077 1 13 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.051 0.349 18016
7078 1 13 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.273 0.227 18016
7079 1 13 . 1 1 33 33 LEU H H 33 8.010 8.010 8.081 -0.071 18016
7080 1 13 . 1 1 34 34 LEU N N 34 120.400 120.400 119.208 1.192 18016
7081 1 13 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.039 -0.109 18016
7082 1 13 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.546 0.554 18016
7083 1 13 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.324 0.576 18016
7084 1 13 . 1 1 34 34 LEU H H 34 8.220 8.220 8.282 -0.062 18016
7085 1 13 . 1 1 35 35 ALA N N 35 123.100 123.100 123.322 -0.222 18016
7086 1 13 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.081 -0.041 18016
7087 1 13 . 1 1 35 35 ALA C C 35 179.500 179.500 179.778 -0.278 18016
7088 1 13 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.135 0.365 18016
7089 1 13 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.390 -0.490 18016
7090 1 13 . 1 1 35 35 ALA H H 35 8.560 8.560 8.176 0.384 18016
7091 1 13 . 1 1 36 36 LEU N N 36 117.600 117.600 119.513 -1.913 18016
7092 1 13 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.215 -0.095 18016
7093 1 13 . 1 1 36 36 LEU C C 36 180.100 180.100 179.482 0.618 18016
7094 1 13 . 1 1 36 36 LEU CA C 36 58.200 58.200 58.091 0.109 18016
7095 1 13 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.374 1.426 18016
7096 1 13 . 1 1 36 36 LEU H H 36 7.850 7.850 8.086 -0.236 18016
7097 1 13 . 1 1 37 37 LEU N N 37 116.700 116.700 120.085 -3.385 18016
7098 1 13 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.041 0.059 18016
7099 1 13 . 1 1 37 37 LEU C C 37 180.100 180.100 179.244 0.856 18016
7100 1 13 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.425 -0.125 18016
7101 1 13 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.470 0.730 18016
7102 1 13 . 1 1 37 37 LEU H H 37 8.730 8.730 8.572 0.158 18016
7103 1 13 . 1 1 38 38 THR N N 38 110.600 110.600 109.881 0.719 18016
7104 1 13 . 1 1 38 38 THR HA H 38 4.440 4.440 4.062 0.378 18016
7105 1 13 . 1 1 38 38 THR C C 38 175.100 175.100 176.798 -1.698 18016
7106 1 13 . 1 1 38 38 THR CA C 38 64.200 64.200 64.995 -0.795 18016
7107 1 13 . 1 1 38 38 THR CB C 38 70.000 70.000 68.263 1.736 18016
7108 1 13 . 1 1 38 38 THR H H 38 8.660 8.660 8.482 0.178 18016
7109 1 13 . 1 1 39 39 ARG N N 39 118.000 118.000 121.852 -3.852 18016
7110 1 13 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.219 0.061 18016
7111 1 13 . 1 1 39 39 ARG C C 39 177.300 177.300 177.407 -0.107 18016
7112 1 13 . 1 1 39 39 ARG CA C 39 58.300 58.300 57.680 0.620 18016
7113 1 13 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.424 -0.224 18016
7114 1 13 . 1 1 39 39 ARG H H 39 7.180 7.180 7.698 -0.518 18016
7115 1 13 . 1 1 40 40 ARG N N 40 114.400 114.400 119.543 -5.143 18016
7116 1 13 . 1 1 40 40 ARG C C 40 174.800 174.800 174.124 0.676 18016
7117 1 13 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.383 -0.083 18016
7118 1 13 . 1 1 40 40 ARG CB C 40 34.600 34.600 30.764 3.836 18016
7119 1 13 . 1 1 40 40 ARG H H 40 7.520 7.520 8.017 -0.497 18016
7120 1 13 . 1 1 41 41 LEU N N 41 119.400 119.400 120.763 -1.363 18016
7121 1 13 . 1 1 41 41 LEU C C 41 177.100 177.100 175.254 1.846 18016
7122 1 13 . 1 1 41 41 LEU CA C 41 53.700 53.700 55.177 -1.477 18016
7123 1 13 . 1 1 41 41 LEU CB C 41 44.400 44.400 46.256 -1.856 18016
7124 1 13 . 1 1 41 41 LEU H H 41 8.380 8.380 8.193 0.187 18016
7125 1 13 . 1 1 42 42 THR N N 42 112.000 112.000 115.357 -3.357 18016
7126 1 13 . 1 1 42 42 THR HA H 42 4.440 4.440 4.692 -0.252 18016
7127 1 13 . 1 1 42 42 THR C C 42 175.800 175.800 175.332 0.468 18016
7128 1 13 . 1 1 42 42 THR CA C 42 60.500 60.500 60.065 0.435 18016
7129 1 13 . 1 1 42 42 THR CB C 42 70.800 70.800 70.538 0.262 18016
7130 1 13 . 1 1 42 42 THR H H 42 9.330 9.330 8.848 0.482 18016
7131 1 13 . 1 1 43 43 ASN N N 43 119.900 119.900 120.318 -0.418 18016
7132 1 13 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.433 -0.183 18016
7133 1 13 . 1 1 43 43 ASN C C 43 177.900 177.900 177.508 0.392 18016
7134 1 13 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.118 -0.418 18016
7135 1 13 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.293 -1.093 18016
7136 1 13 . 1 1 43 43 ASN H H 43 9.140 9.140 8.836 0.304 18016
7137 1 13 . 1 1 44 44 ASP N N 44 118.000 118.000 119.935 -1.935 18016
7138 1 13 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.394 0.006 18016
7139 1 13 . 1 1 44 44 ASP C C 44 179.600 179.600 178.586 1.014 18016
7140 1 13 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.490 -0.190 18016
7141 1 13 . 1 1 44 44 ASP H H 44 8.360 8.360 8.738 -0.378 18016
7142 1 13 . 1 1 45 45 GLU N N 45 122.600 122.600 120.219 2.381 18016
7143 1 13 . 1 1 45 45 GLU HA H 45 3.970 3.970 3.986 -0.016 18016
7144 1 13 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.482 -0.082 18016
7145 1 13 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.815 0.485 18016
7146 1 13 . 1 1 45 45 GLU H H 45 7.850 7.850 7.742 0.108 18016
7147 1 13 . 1 1 46 46 ILE N N 46 118.900 118.900 120.619 -1.719 18016
7148 1 13 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.750 -0.320 18016
7149 1 13 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.202 1.798 18016
7150 1 13 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.748 -0.048 18016
7151 1 13 . 1 1 46 46 ILE H H 46 8.290 8.290 8.217 0.073 18016
7152 1 13 . 1 1 47 47 LYS N N 47 118.900 118.900 119.536 -0.636 18016
7153 1 13 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.856 0.014 18016
7154 1 13 . 1 1 47 47 LYS C C 47 178.400 178.400 179.050 -0.650 18016
7155 1 13 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.935 0.365 18016
7156 1 13 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.166 0.434 18016
7157 1 13 . 1 1 47 47 LYS H H 47 8.290 8.290 8.177 0.113 18016
7158 1 13 . 1 1 48 48 ALA N N 48 121.100 121.100 123.657 -2.557 18016
7159 1 13 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.289 -0.119 18016
7160 1 13 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.017 0.083 18016
7161 1 13 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.354 -0.353 18016
7162 1 13 . 1 1 48 48 ALA H H 48 7.710 7.710 8.186 -0.476 18016
7163 1 13 . 1 1 49 49 ILE N N 49 119.900 119.900 118.578 1.322 18016
7164 1 13 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.684 -0.034 18016
7165 1 13 . 1 1 49 49 ILE C C 49 177.300 177.300 178.131 -0.831 18016
7166 1 13 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.263 1.737 18016
7167 1 13 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.378 1.722 18016
7168 1 13 . 1 1 49 49 ILE H H 49 8.130 8.130 8.157 -0.027 18016
7169 1 13 . 1 1 50 50 ALA N N 50 122.000 122.000 122.076 -0.076 18016
7170 1 13 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.935 -0.075 18016
7171 1 13 . 1 1 50 50 ALA C C 50 179.800 179.800 179.748 0.052 18016
7172 1 13 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.408 0.292 18016
7173 1 13 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.070 -0.170 18016
7174 1 13 . 1 1 50 50 ALA H H 50 8.730 8.730 7.637 1.093 18016
7175 1 13 . 1 1 51 51 GLU N N 51 116.900 116.900 117.860 -0.960 18016
7176 1 13 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.994 0.026 18016
7177 1 13 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.052 0.348 18016
7178 1 13 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.565 -0.065 18016
7179 1 13 . 1 1 51 51 GLU H H 51 8.220 8.220 8.294 -0.074 18016
7180 1 13 . 1 1 52 52 ASP N N 52 120.300 120.300 119.199 1.101 18016
7181 1 13 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.487 -0.097 18016
7182 1 13 . 1 1 52 52 ASP C C 52 178.900 178.900 178.537 0.363 18016
7183 1 13 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.879 0.621 18016
7184 1 13 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.218 1.282 18016
7185 1 13 . 1 1 52 52 ASP H H 52 7.700 7.700 7.807 -0.107 18016
7186 1 13 . 1 1 53 53 LEU N N 53 118.300 118.300 119.847 -1.547 18016
7187 1 13 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.989 -0.259 18016
7188 1 13 . 1 1 53 53 LEU C C 53 179.000 179.000 179.014 -0.014 18016
7189 1 13 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.528 -0.028 18016
7190 1 13 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.981 -0.881 18016
7191 1 13 . 1 1 53 53 LEU H H 53 8.290 8.290 8.054 0.236 18016
7192 1 13 . 1 1 54 54 GLU N N 54 118.700 118.700 118.567 0.133 18016
7193 1 13 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.949 0.271 18016
7194 1 13 . 1 1 54 54 GLU C C 54 178.200 178.200 178.020 0.180 18016
7195 1 13 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.603 0.097 18016
7196 1 13 . 1 1 54 54 GLU CB C 54 29.900 29.900 28.575 1.325 18016
7197 1 13 . 1 1 54 54 GLU H H 54 8.070 8.070 8.680 -0.610 18016
7198 1 13 . 1 1 55 55 LYS N N 55 117.700 117.700 118.796 -1.096 18016
7199 1 13 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.015 0.135 18016
7200 1 13 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.044 0.256 18016
7201 1 13 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.273 0.427 18016
7202 1 13 . 1 1 55 55 LYS H H 55 7.750 7.750 7.356 0.394 18016
7203 1 13 . 1 1 56 56 ARG N N 56 117.100 117.100 117.176 -0.076 18016
7204 1 13 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.140 0.130 18016
7205 1 13 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.120 -0.320 18016
7206 1 13 . 1 1 56 56 ARG CB C 56 31.000 31.000 30.627 0.373 18016
7207 1 13 . 1 1 56 56 ARG H H 56 8.270 8.270 7.834 0.436 18016
7208 1 13 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.159 0.201 18016
7209 1 13 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.163 0.937 18016
7210 1 13 . 1 1 57 57 ALA CB C 57 19.200 19.200 19.565 -0.365 18016
7211 1 13 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.688 -0.178 18016
7212 1 13 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.657 0.543 18016
7213 1 13 . 1 1 58 58 HIS CB C 58 27.300 27.300 30.187 -2.887 18016
7214 1 13 . 1 1 59 59 PHE N N 59 120.400 120.400 117.874 2.526 18016
7215 1 13 . 1 1 59 59 PHE C C 59 175.500 175.500 173.882 1.618 18016
7216 1 13 . 1 1 59 59 PHE CA C 59 57.200 57.200 56.627 0.573 18016
7217 1 13 . 1 1 59 59 PHE CB C 59 39.300 39.300 40.488 -1.188 18016
7218 1 13 . 1 1 59 59 PHE H H 59 7.710 7.710 7.203 0.507 18016
7219 1 13 . 1 1 60 60 ASP N N 60 120.800 120.800 122.411 -1.611 18016
7220 1 13 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.555 -0.065 18016
7221 1 13 . 1 1 60 60 ASP CA C 60 54.300 54.300 53.502 0.798 18016
7222 1 13 . 1 1 60 60 ASP CB C 60 41.100 41.100 42.609 -1.509 18016
7223 1 13 . 1 1 60 60 ASP H H 60 8.180 8.180 8.232 -0.052 18016
7224 1 13 . 1 1 61 61 HIS N N 61 118.300 118.300 117.287 1.013 18016
7225 1 13 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.842 -0.452 18016
7226 1 13 . 1 1 61 61 HIS CA C 61 56.700 56.700 55.748 0.952 18016
7227 1 13 . 1 1 61 61 HIS CB C 61 28.800 28.800 31.317 -2.517 18016
7228 1 13 . 1 1 61 61 HIS H H 61 8.550 8.550 8.476 0.074 18016
7229 1 13 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.407 -0.397 18016
7230 1 13 . 1 1 62 62 ILE C C 62 173.800 173.800 175.268 -1.468 18016
7231 1 13 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.353 6.147 18016
7232 1 13 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.460 1.640 18016
7233 1 13 . 1 1 63 63 ASP N N 63 125.100 125.100 122.925 2.175 18016
7234 1 13 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.338 0.262 18016
7235 1 13 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.418 -2.618 18016
7236 1 13 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.016 -1.516 18016
7237 1 13 . 1 1 63 63 ASP H H 63 8.360 8.360 7.925 0.435 18016
7238 1 13 . 1 1 64 64 ILE HA H 64 3.670 3.670 4.032 -0.362 18016
7239 1 13 . 1 1 64 64 ILE C C 64 177.000 177.000 176.646 0.354 18016
7240 1 13 . 1 1 64 64 ILE CA C 64 62.100 62.100 62.969 -0.869 18016
7241 1 13 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.434 -1.833 18016
7242 1 13 . 1 1 65 65 GLY N N 65 107.600 107.600 107.972 -0.372 18016
7243 1 13 . 1 1 65 65 GLY C C 65 177.000 177.000 175.814 1.186 18016
7244 1 13 . 1 1 65 65 GLY CA C 65 47.300 47.300 47.055 0.245 18016
7245 1 13 . 1 1 65 65 GLY H H 65 8.440 8.440 7.827 0.613 18016
7246 1 13 . 1 1 66 66 VAL N N 66 121.800 121.800 122.117 -0.317 18016
7247 1 13 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.756 0.004 18016
7248 1 13 . 1 1 66 66 VAL C C 66 178.500 178.500 177.447 1.053 18016
7249 1 13 . 1 1 66 66 VAL CA C 66 65.600 65.600 64.840 0.760 18016
7250 1 13 . 1 1 66 66 VAL CB C 66 32.000 32.000 32.148 -0.148 18016
7251 1 13 . 1 1 66 66 VAL H H 66 7.550 7.550 8.150 -0.600 18016
7252 1 13 . 1 1 67 67 LEU N N 67 120.900 120.900 118.961 1.939 18016
7253 1 13 . 1 1 67 67 LEU HA H 67 4.070 4.070 3.988 0.082 18016
7254 1 13 . 1 1 67 67 LEU C C 67 179.000 179.000 179.278 -0.278 18016
7255 1 13 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.903 -0.303 18016
7256 1 13 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.590 1.710 18016
7257 1 13 . 1 1 67 67 LEU H H 67 7.650 7.650 7.443 0.207 18016
7258 1 13 . 1 1 68 68 ILE N N 68 118.900 118.900 117.485 1.415 18016
7259 1 13 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.792 -0.082 18016
7260 1 13 . 1 1 68 68 ILE C C 68 179.500 179.500 178.326 1.174 18016
7261 1 13 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.668 0.532 18016
7262 1 13 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.472 0.028 18016
7263 1 13 . 1 1 68 68 ILE H H 68 8.580 8.580 7.591 0.989 18016
7264 1 13 . 1 1 69 69 THR N N 69 118.100 118.100 114.236 3.864 18016
7265 1 13 . 1 1 69 69 THR HA H 69 3.940 3.940 4.081 -0.141 18016
7266 1 13 . 1 1 69 69 THR C C 69 176.200 176.200 175.891 0.309 18016
7267 1 13 . 1 1 69 69 THR CA C 69 66.600 66.600 65.757 0.843 18016
7268 1 13 . 1 1 69 69 THR CB C 69 68.500 68.500 68.404 0.096 18016
7269 1 13 . 1 1 69 69 THR H H 69 7.840 7.840 7.715 0.125 18016
7270 1 13 . 1 1 70 70 GLN N N 70 121.600 121.600 119.893 1.707 18016
7271 1 13 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.207 -0.097 18016
7272 1 13 . 1 1 70 70 GLN C C 70 178.100 178.100 178.054 0.046 18016
7273 1 13 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.254 0.846 18016
7274 1 13 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.787 -0.487 18016
7275 1 13 . 1 1 70 70 GLN H H 70 8.100 8.100 7.357 0.743 18016
7276 1 13 . 1 1 71 71 MET N N 71 118.700 118.700 117.974 0.726 18016
7277 1 13 . 1 1 71 71 MET HA H 71 4.010 4.010 4.481 -0.471 18016
7278 1 13 . 1 1 71 71 MET C C 71 176.300 176.300 178.457 -2.157 18016
7279 1 13 . 1 1 71 71 MET CA C 71 58.100 58.100 59.152 -1.052 18016
7280 1 13 . 1 1 71 71 MET CB C 71 33.600 33.600 32.749 0.851 18016
7281 1 13 . 1 1 71 71 MET H H 71 8.350 8.350 8.580 -0.230 18016
7282 1 13 . 1 1 72 72 THR N N 72 111.600 111.600 111.412 0.188 18016
7283 1 13 . 1 1 72 72 THR HA H 72 3.940 3.940 4.172 -0.232 18016
7284 1 13 . 1 1 72 72 THR C C 72 175.800 175.800 175.331 0.469 18016
7285 1 13 . 1 1 72 72 THR CA C 72 65.300 65.300 64.772 0.528 18016
7286 1 13 . 1 1 72 72 THR CB C 72 69.100 69.100 69.148 -0.048 18016
7287 1 13 . 1 1 72 72 THR H H 72 7.840 7.840 7.594 0.246 18016
7288 1 13 . 1 1 73 73 ASP N N 73 121.100 121.100 119.344 1.756 18016
7289 1 13 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.752 -0.222 18016
7290 1 13 . 1 1 73 73 ASP C C 73 176.600 176.600 175.396 1.204 18016
7291 1 13 . 1 1 73 73 ASP CA C 73 56.200 56.200 54.798 1.402 18016
7292 1 13 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.808 -1.408 18016
7293 1 13 . 1 1 73 73 ASP H H 73 7.840 7.840 7.807 0.033 18016
7294 1 13 . 1 1 74 74 GLU N N 74 121.100 121.100 119.487 1.613 18016
7295 1 13 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.602 -0.262 18016
7296 1 13 . 1 1 74 74 GLU C C 74 173.800 173.800 174.993 -1.193 18016
7297 1 13 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.528 -0.028 18016
7298 1 13 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.668 -1.068 18016
7299 1 13 . 1 1 74 74 GLU H H 74 7.980 7.980 8.298 -0.318 18016
7300 1 13 . 1 1 75 75 MET N N 75 125.800 125.800 127.592 -1.792 18016
7301 1 13 . 1 1 75 75 MET HA H 75 4.710 4.710 4.680 0.030 18016
7302 1 13 . 1 1 75 75 MET CA C 75 53.800 53.800 54.282 -0.482 18016
7303 1 13 . 1 1 75 75 MET CB C 75 31.700 31.700 31.976 -0.276 18016
7304 1 13 . 1 1 75 75 MET H H 75 8.380 8.380 8.759 -0.379 18016
7305 1 13 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.286 0.224 18016
7306 1 13 . 1 1 76 76 PRO C C 76 175.700 175.700 176.296 -0.596 18016
7307 1 13 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.952 -1.952 18016
7308 1 13 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.022 -0.222 18016
7309 1 13 . 1 1 77 77 ARG N N 77 119.700 119.700 118.748 0.952 18016
7310 1 13 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.550 -0.280 18016
7311 1 13 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.270 0.529 18016
7312 1 13 . 1 1 77 77 ARG CB C 77 30.700 30.700 31.814 -1.113 18016
7313 1 13 . 1 1 77 77 ARG H H 77 8.940 8.940 7.891 1.049 18016
7314 1 13 . 1 1 78 78 GLU N N 78 124.700 124.700 126.243 -1.543 18016
7315 1 13 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.988 -0.028 18016
7316 1 13 . 1 1 78 78 GLU C C 78 179.000 179.000 178.177 0.823 18016
7317 1 13 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.845 -0.045 18016
7318 1 13 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.583 -0.583 18016
7319 1 13 . 1 1 78 78 GLU H H 78 9.170 9.170 9.021 0.149 18016
7320 1 13 . 1 1 79 79 GLU N N 79 116.800 116.800 120.144 -3.344 18016
7321 1 13 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.088 0.032 18016
7322 1 13 . 1 1 79 79 GLU C C 79 179.100 179.100 178.458 0.642 18016
7323 1 13 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.777 -0.077 18016
7324 1 13 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.345 -0.345 18016
7325 1 13 . 1 1 79 79 GLU H H 79 9.660 9.660 8.743 0.917 18016
7326 1 13 . 1 1 80 80 ASP N N 80 120.000 120.000 118.293 1.707 18016
7327 1 13 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.478 0.212 18016
7328 1 13 . 1 1 80 80 ASP C C 80 177.300 177.300 178.590 -1.290 18016
7329 1 13 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.698 -0.298 18016
7330 1 13 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.415 1.185 18016
7331 1 13 . 1 1 80 80 ASP H H 80 7.310 7.310 8.262 -0.952 18016
7332 1 13 . 1 1 81 81 ILE N N 81 120.100 120.100 120.805 -0.705 18016
7333 1 13 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.685 -0.195 18016
7334 1 13 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.633 0.667 18016
7335 1 13 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.985 0.315 18016
7336 1 13 . 1 1 81 81 ILE H H 81 7.610 7.610 8.170 -0.560 18016
7337 1 13 . 1 1 82 82 GLU N N 82 118.100 118.100 118.863 -0.763 18016
7338 1 13 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.040 0.240 18016
7339 1 13 . 1 1 82 82 GLU C C 82 177.800 177.800 178.827 -1.027 18016
7340 1 13 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.401 -1.401 18016
7341 1 13 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.032 -0.232 18016
7342 1 13 . 1 1 82 82 GLU H H 82 8.550 8.550 8.514 0.036 18016
7343 1 13 . 1 1 83 83 ARG N N 83 119.900 119.900 120.910 -1.010 18016
7344 1 13 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.128 -0.098 18016
7345 1 13 . 1 1 83 83 ARG C C 83 179.400 179.400 178.746 0.654 18016
7346 1 13 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.308 0.592 18016
7347 1 13 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.331 -0.731 18016
7348 1 13 . 1 1 83 83 ARG H H 83 7.590 7.590 8.035 -0.445 18016
7349 1 13 . 1 1 84 84 VAL N N 84 120.400 120.400 119.904 0.496 18016
7350 1 13 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.807 -0.057 18016
7351 1 13 . 1 1 84 84 VAL C C 84 177.400 177.400 177.358 0.042 18016
7352 1 13 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.922 0.978 18016
7353 1 13 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.975 -0.075 18016
7354 1 13 . 1 1 84 84 VAL H H 84 7.550 7.550 8.522 -0.972 18016
7355 1 13 . 1 1 85 85 ARG N N 85 121.600 121.600 119.598 2.002 18016
7356 1 13 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.328 -0.318 18016
7357 1 13 . 1 1 85 85 ARG C C 85 178.100 178.100 178.720 -0.620 18016
7358 1 13 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.860 1.040 18016
7359 1 13 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.960 0.240 18016
7360 1 13 . 1 1 85 85 ARG H H 85 9.090 9.090 8.506 0.584 18016
7361 1 13 . 1 1 86 86 ARG N N 86 115.600 115.600 119.041 -3.441 18016
7362 1 13 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.173 -0.293 18016
7363 1 13 . 1 1 86 86 ARG C C 86 179.000 179.000 178.529 0.471 18016
7364 1 13 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.099 0.302 18016
7365 1 13 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.504 0.896 18016
7366 1 13 . 1 1 86 86 ARG H H 86 8.660 8.660 8.518 0.142 18016
7367 1 13 . 1 1 87 87 HIS N N 87 118.000 118.000 120.187 -2.187 18016
7368 1 13 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.306 0.054 18016
7369 1 13 . 1 1 87 87 HIS C C 87 178.400 178.400 177.705 0.695 18016
7370 1 13 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.384 0.216 18016
7371 1 13 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.093 0.607 18016
7372 1 13 . 1 1 87 87 HIS H H 87 7.640 7.640 8.076 -0.436 18016
7373 1 13 . 1 1 88 88 LEU N N 88 119.600 119.600 118.843 0.757 18016
7374 1 13 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.227 -0.647 18016
7375 1 13 . 1 1 88 88 LEU C C 88 180.000 180.000 178.933 1.067 18016
7376 1 13 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.168 0.032 18016
7377 1 13 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.190 1.411 18016
7378 1 13 . 1 1 88 88 LEU H H 88 8.650 8.650 8.632 0.018 18016
7379 1 13 . 1 1 89 89 ALA N N 89 118.500 118.500 122.518 -4.018 18016
7380 1 13 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.795 0.565 18016
7381 1 13 . 1 1 89 89 ALA C C 89 180.400 180.400 180.159 0.241 18016
7382 1 13 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.671 -1.071 18016
7383 1 13 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.480 -0.380 18016
7384 1 13 . 1 1 89 89 ALA H H 89 8.870 8.870 8.226 0.644 18016
7385 1 13 . 1 1 90 90 LEU N N 90 119.400 119.400 117.869 1.531 18016
7386 1 13 . 1 1 90 90 LEU HA H 90 4.210 4.210 4.002 0.208 18016
7387 1 13 . 1 1 90 90 LEU C C 90 179.100 179.100 179.130 -0.030 18016
7388 1 13 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.137 0.363 18016
7389 1 13 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.750 -0.050 18016
7390 1 13 . 1 1 90 90 LEU H H 90 7.390 7.390 7.571 -0.181 18016
7391 1 13 . 1 1 91 91 GLN N N 91 114.500 114.500 116.303 -1.803 18016
7392 1 13 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.314 0.386 18016
7393 1 13 . 1 1 91 91 GLN C C 91 175.800 175.800 176.601 -0.801 18016
7394 1 13 . 1 1 91 91 GLN CA C 91 54.500 54.500 57.163 -2.663 18016
7395 1 13 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.922 -1.822 18016
7396 1 13 . 1 1 91 91 GLN H H 91 7.810 7.810 7.801 0.009 18016
7397 1 13 . 1 1 92 92 GLY N N 92 107.900 107.900 104.424 3.476 18016
7398 1 13 . 1 1 92 92 GLY C C 92 172.100 172.100 171.591 0.509 18016
7399 1 13 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.065 -1.065 18016
7400 1 13 . 1 1 92 92 GLY H H 92 7.710 7.710 8.280 -0.570 18016
7401 1 13 . 1 1 93 93 TRP N N 93 114.200 114.200 121.851 -7.651 18016
7402 1 13 . 1 1 93 93 TRP CA C 93 56.000 56.000 55.412 0.588 18016
7403 1 13 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.548 -1.348 18016
7404 1 13 . 1 1 93 93 TRP H H 93 8.450 8.450 8.216 0.234 18016
7405 1 13 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.336 0.124 18016
7406 1 13 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.648 -0.848 18016
7407 1 13 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.505 0.095 18016
7408 1 13 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.161 -0.661 18016
7409 1 13 . 1 1 95 95 LEU C C 95 175.000 175.000 177.814 -2.814 18016
7410 1 13 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.420 -0.321 18016
7411 1 13 . 1 1 95 95 LEU CB C 95 42.100 42.100 41.155 0.945 18016
7412 1 13 . 1 1 96 96 ASP N N 96 114.000 114.000 119.620 -5.620 18016
7413 1 13 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.656 0.294 18016
7414 1 13 . 1 1 96 96 ASP C C 96 175.800 175.800 175.724 0.076 18016
7415 1 13 . 1 1 96 96 ASP CA C 96 54.000 54.000 57.198 -3.198 18016
7416 1 13 . 1 1 96 96 ASP CB C 96 41.900 41.900 42.068 -0.168 18016
7417 1 13 . 1 1 96 96 ASP H H 96 7.230 7.230 7.982 -0.752 18016
7418 1 13 . 1 1 97 97 ASP N N 97 123.200 123.200 116.664 6.536 18016
7419 1 13 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.992 -0.382 18016
7420 1 13 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.448 2.052 18016
7421 1 13 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.699 -4.999 18016
7422 1 13 . 1 1 97 97 ASP H H 97 7.420 7.420 7.738 -0.318 18016
7423 1 13 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.535 0.755 18016
7424 1 13 . 1 1 98 98 PRO C C 98 177.500 177.500 176.464 1.036 18016
7425 1 13 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.818 -0.117 18016
7426 1 13 . 1 1 98 98 PRO CB C 98 31.900 31.900 31.924 -0.024 18016
7427 1 13 . 1 1 99 99 ARG N N 99 121.300 121.300 119.235 2.065 18016
7428 1 13 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.504 -0.794 18016
7429 1 13 . 1 1 99 99 ARG C C 99 176.500 176.500 175.534 0.966 18016
7430 1 13 . 1 1 99 99 ARG CA C 99 56.100 56.100 55.940 0.160 18016
7431 1 13 . 1 1 99 99 ARG CB C 99 30.500 30.500 31.122 -0.622 18016
7432 1 13 . 1 1 99 99 ARG H H 99 8.390 8.390 8.444 -0.054 18016
7433 1 13 . 1 1 100 100 ASP N N 100 119.600 119.600 118.246 1.354 18016
7434 1 13 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.707 -0.207 18016
7435 1 13 . 1 1 100 100 ASP C C 100 177.000 177.000 176.293 0.707 18016
7436 1 13 . 1 1 100 100 ASP CA C 100 54.700 54.700 52.914 1.786 18016
7437 1 13 . 1 1 100 100 ASP CB C 100 40.900 40.900 41.493 -0.593 18016
7438 1 13 . 1 1 100 100 ASP H H 100 8.260 8.260 7.810 0.450 18016
7439 1 13 . 1 1 101 101 GLY N N 101 109.300 109.300 107.573 1.727 18016
7440 1 13 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.894 0.506 18016
7441 1 13 . 1 1 101 101 GLY H H 101 8.450 8.450 8.370 0.080 18016
7442 1 13 . 1 1 102 102 GLU N N 102 119.800 119.800 123.768 -3.968 18016
7443 1 13 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.479 -0.169 18016
7444 1 13 . 1 1 102 102 GLU CA C 102 56.000 56.000 55.995 0.005 18016
7445 1 13 . 1 1 102 102 GLU CB C 102 30.500 30.500 32.055 -1.555 18016
7446 1 13 . 1 1 102 102 GLU H H 102 8.140 8.140 8.229 -0.089 18016
7447 1 13 . 1 1 103 103 GLU N N 103 123.000 123.000 126.155 -3.155 18016
7448 1 13 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.384 0.176 18016
7449 1 13 . 1 1 103 103 GLU CA C 103 54.300 54.300 55.713 -1.413 18016
7450 1 13 . 1 1 103 103 GLU CB C 103 29.600 29.600 28.886 0.714 18016
7451 1 13 . 1 1 103 103 GLU H H 103 8.580 8.580 8.603 -0.023 18016
7452 1 13 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.390 0.090 18016
7453 1 13 . 1 1 104 104 PRO C C 104 176.800 176.800 176.810 -0.010 18016
7454 1 13 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.746 -0.346 18016
7455 1 13 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.387 -0.287 18016
7456 1 13 . 1 1 105 105 ASP N N 105 120.400 120.400 118.219 2.181 18016
7457 1 13 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.724 -0.144 18016
7458 1 13 . 1 1 105 105 ASP C C 105 177.100 177.100 175.815 1.285 18016
7459 1 13 . 1 1 105 105 ASP CA C 105 54.300 54.300 53.645 0.655 18016
7460 1 13 . 1 1 105 105 ASP CB C 105 41.400 41.400 42.369 -0.969 18016
7461 1 13 . 1 1 105 105 ASP H H 105 8.500 8.500 8.099 0.401 18016
7462 1 13 . 1 1 106 106 GLY N N 106 109.300 109.300 109.550 -0.250 18016
7463 1 13 . 1 1 106 106 GLY C C 106 174.600 174.600 174.435 0.165 18016
7464 1 13 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.539 -0.139 18016
7465 1 13 . 1 1 106 106 GLY H H 106 8.360 8.360 8.502 -0.142 18016
7466 1 13 . 1 1 107 107 GLU N N 107 120.400 120.400 120.736 -0.336 18016
7467 1 13 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.457 -0.117 18016
7468 1 13 . 1 1 107 107 GLU C C 107 177.100 177.100 176.909 0.191 18016
7469 1 13 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.590 -0.090 18016
7470 1 13 . 1 1 107 107 GLU CB C 107 30.200 30.200 30.681 -0.481 18016
7471 1 13 . 1 1 107 107 GLU H H 107 8.410 8.410 8.535 -0.125 18016
7472 1 13 . 1 1 108 108 SER N N 108 116.600 116.600 116.117 0.483 18016
7473 1 13 . 1 1 108 108 SER HA H 108 4.450 4.450 4.537 -0.087 18016
7474 1 13 . 1 1 108 108 SER C C 108 175.300 175.300 175.274 0.026 18016
7475 1 13 . 1 1 108 108 SER CA C 108 58.700 58.700 58.259 0.441 18016
7476 1 13 . 1 1 108 108 SER CB C 108 63.800 63.800 64.196 -0.396 18016
7477 1 13 . 1 1 108 108 SER H H 108 8.460 8.460 8.085 0.375 18016
7478 1 13 . 1 1 109 109 GLY N N 109 110.800 110.800 109.135 1.665 18016
7479 1 13 . 1 1 109 109 GLY C C 109 174.500 174.500 174.589 -0.089 18016
7480 1 13 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.179 0.121 18016
7481 1 13 . 1 1 109 109 GLY H H 109 8.500 8.500 8.832 -0.332 18016
7482 1 13 . 1 1 110 110 GLY N N 110 108.800 108.800 108.489 0.311 18016
7483 1 13 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.166 -0.766 18016
7484 1 13 . 1 1 110 110 GLY H H 110 8.140 8.140 8.387 -0.247 18016
7485 1 13 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.522 0.088 18016
7486 1 13 . 1 1 111 111 PRO C C 111 176.000 176.000 176.674 -0.674 18016
7487 1 13 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.207 -0.607 18016
7488 1 13 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.027 2.573 18016
7489 1 14 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.763 -0.333 18016
7490 1 14 . 1 1 2 2 PRO C C 2 177.600 177.600 176.125 1.475 18016
7491 1 14 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.763 0.537 18016
7492 1 14 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.889 -0.589 18016
7493 1 14 . 1 1 3 3 GLY N N 3 110.000 110.000 107.813 2.187 18016
7494 1 14 . 1 1 3 3 GLY C C 3 174.200 174.200 173.417 0.783 18016
7495 1 14 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.008 0.392 18016
7496 1 14 . 1 1 3 3 GLY H H 3 8.700 8.700 8.214 0.486 18016
7497 1 14 . 1 1 4 4 SER N N 4 115.400 115.400 115.160 0.240 18016
7498 1 14 . 1 1 4 4 SER HA H 4 4.440 4.440 4.204 0.236 18016
7499 1 14 . 1 1 4 4 SER C C 4 174.800 174.800 174.263 0.537 18016
7500 1 14 . 1 1 4 4 SER CA C 4 58.400 58.400 59.018 -0.618 18016
7501 1 14 . 1 1 4 4 SER CB C 4 63.800 63.800 61.792 2.008 18016
7502 1 14 . 1 1 4 4 SER H H 4 8.210 8.210 8.626 -0.416 18016
7503 1 14 . 1 1 5 5 MET N N 5 122.200 122.200 120.703 1.497 18016
7504 1 14 . 1 1 5 5 MET HA H 5 4.510 4.510 4.354 0.156 18016
7505 1 14 . 1 1 5 5 MET CA C 5 55.600 55.600 57.210 -1.610 18016
7506 1 14 . 1 1 5 5 MET CB C 5 32.900 32.900 33.676 -0.776 18016
7507 1 14 . 1 1 5 5 MET H H 5 8.570 8.570 8.827 -0.257 18016
7508 1 14 . 1 1 6 6 VAL N N 6 120.000 120.000 117.052 2.948 18016
7509 1 14 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.241 -0.191 18016
7510 1 14 . 1 1 6 6 VAL C C 6 175.700 175.700 175.766 -0.066 18016
7511 1 14 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.035 1.665 18016
7512 1 14 . 1 1 6 6 VAL CB C 6 32.500 32.500 31.788 0.712 18016
7513 1 14 . 1 1 6 6 VAL H H 6 8.150 8.150 7.588 0.562 18016
7514 1 14 . 1 1 7 7 ASN N N 7 122.000 122.000 117.839 4.161 18016
7515 1 14 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.675 -0.015 18016
7516 1 14 . 1 1 7 7 ASN C C 7 175.200 175.200 176.897 -1.697 18016
7517 1 14 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.273 -0.073 18016
7518 1 14 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.461 -0.561 18016
7519 1 14 . 1 1 7 7 ASN H H 7 8.010 8.010 8.356 -0.346 18016
7520 1 14 . 1 1 8 8 ALA N N 8 126.500 126.500 125.806 0.694 18016
7521 1 14 . 1 1 8 8 ALA C C 8 180.200 180.200 179.510 0.690 18016
7522 1 14 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.376 0.124 18016
7523 1 14 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.699 -0.299 18016
7524 1 14 . 1 1 8 8 ALA H H 8 9.020 9.020 8.753 0.267 18016
7525 1 14 . 1 1 9 9 PHE N N 9 121.300 121.300 119.251 2.049 18016
7526 1 14 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.114 0.176 18016
7527 1 14 . 1 1 9 9 PHE C C 9 177.200 177.200 177.206 -0.006 18016
7528 1 14 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.534 -0.234 18016
7529 1 14 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.069 0.132 18016
7530 1 14 . 1 1 9 9 PHE H H 9 8.570 8.570 8.445 0.125 18016
7531 1 14 . 1 1 10 10 LEU N N 10 117.200 117.200 119.194 -1.994 18016
7532 1 14 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.991 -0.291 18016
7533 1 14 . 1 1 10 10 LEU C C 10 179.700 179.700 179.183 0.517 18016
7534 1 14 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.240 0.360 18016
7535 1 14 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.451 0.249 18016
7536 1 14 . 1 1 10 10 LEU H H 10 8.150 8.150 7.572 0.578 18016
7537 1 14 . 1 1 11 11 ALA N N 11 121.500 121.500 122.304 -0.804 18016
7538 1 14 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.932 0.088 18016
7539 1 14 . 1 1 11 11 ALA C C 11 180.900 180.900 179.321 1.579 18016
7540 1 14 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.326 -0.326 18016
7541 1 14 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.058 -0.058 18016
7542 1 14 . 1 1 11 11 ALA H H 11 8.460 8.460 8.807 -0.347 18016
7543 1 14 . 1 1 12 12 LYS N N 12 120.700 120.700 119.494 1.206 18016
7544 1 14 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.003 0.047 18016
7545 1 14 . 1 1 12 12 LYS C C 12 179.700 179.700 178.713 0.987 18016
7546 1 14 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.062 0.138 18016
7547 1 14 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.930 -0.330 18016
7548 1 14 . 1 1 12 12 LYS H H 12 7.820 7.820 7.945 -0.125 18016
7549 1 14 . 1 1 13 13 ILE N N 13 120.100 120.100 119.157 0.943 18016
7550 1 14 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.785 -0.095 18016
7551 1 14 . 1 1 13 13 ILE C C 13 178.100 178.100 178.234 -0.134 18016
7552 1 14 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.818 -0.818 18016
7553 1 14 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.557 -1.157 18016
7554 1 14 . 1 1 13 13 ILE H H 13 7.640 7.640 7.819 -0.179 18016
7555 1 14 . 1 1 14 14 ALA N N 14 122.700 122.700 122.245 0.455 18016
7556 1 14 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.963 -0.103 18016
7557 1 14 . 1 1 14 14 ALA C C 14 179.000 179.000 179.511 -0.511 18016
7558 1 14 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.457 0.543 18016
7559 1 14 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.020 -0.020 18016
7560 1 14 . 1 1 14 14 ALA H H 14 8.680 8.680 8.519 0.161 18016
7561 1 14 . 1 1 15 15 ALA N N 15 118.700 118.700 121.833 -3.133 18016
7562 1 14 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.036 0.054 18016
7563 1 14 . 1 1 15 15 ALA C C 15 180.400 180.400 178.975 1.425 18016
7564 1 14 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.876 0.124 18016
7565 1 14 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.416 -0.716 18016
7566 1 14 . 1 1 15 15 ALA H H 15 8.070 8.070 8.057 0.013 18016
7567 1 14 . 1 1 16 16 TRP N N 16 122.900 122.900 121.219 1.681 18016
7568 1 14 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.255 0.305 18016
7569 1 14 . 1 1 16 16 TRP C C 16 178.400 178.400 177.868 0.532 18016
7570 1 14 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.332 -1.732 18016
7571 1 14 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.076 -0.777 18016
7572 1 14 . 1 1 16 16 TRP H H 16 7.820 7.820 8.116 -0.296 18016
7573 1 14 . 1 1 17 17 LEU N N 17 120.400 120.400 119.221 1.179 18016
7574 1 14 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.132 0.478 18016
7575 1 14 . 1 1 17 17 LEU C C 17 179.000 179.000 178.765 0.235 18016
7576 1 14 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.874 0.026 18016
7577 1 14 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.540 0.460 18016
7578 1 14 . 1 1 17 17 LEU H H 17 8.630 8.630 8.406 0.224 18016
7579 1 14 . 1 1 18 18 ASN N N 18 116.200 116.200 116.969 -0.769 18016
7580 1 14 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.623 -0.313 18016
7581 1 14 . 1 1 18 18 ASN C C 18 177.100 177.100 177.212 -0.112 18016
7582 1 14 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.669 -0.070 18016
7583 1 14 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.897 0.303 18016
7584 1 14 . 1 1 18 18 ASN H H 18 8.350 8.350 8.417 -0.067 18016
7585 1 14 . 1 1 19 19 ALA N N 19 119.600 119.600 121.200 -1.600 18016
7586 1 14 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.181 -0.091 18016
7587 1 14 . 1 1 19 19 ALA C C 19 180.100 180.100 178.948 1.152 18016
7588 1 14 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.452 -0.252 18016
7589 1 14 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.349 -0.749 18016
7590 1 14 . 1 1 19 19 ALA H H 19 7.920 7.920 8.106 -0.186 18016
7591 1 14 . 1 1 20 20 GLY N N 20 103.500 103.500 106.496 -2.996 18016
7592 1 14 . 1 1 20 20 GLY C C 20 173.800 173.800 174.450 -0.650 18016
7593 1 14 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.163 0.637 18016
7594 1 14 . 1 1 20 20 GLY H H 20 7.700 7.700 7.460 0.240 18016
7595 1 14 . 1 1 21 21 TYR N N 21 119.900 119.900 119.402 0.498 18016
7596 1 14 . 1 1 21 21 TYR HA H 21 5.170 5.170 5.178 -0.008 18016
7597 1 14 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.429 1.971 18016
7598 1 14 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.422 -0.622 18016
7599 1 14 . 1 1 21 21 TYR H H 21 7.980 7.980 8.116 -0.136 18016
7600 1 14 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.494 0.006 18016
7601 1 14 . 1 1 22 22 PRO C C 22 178.700 178.700 177.105 1.595 18016
7602 1 14 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.452 0.548 18016
7603 1 14 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.403 -0.403 18016
7604 1 14 . 1 1 23 23 GLU N N 23 116.300 116.300 117.651 -1.351 18016
7605 1 14 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.364 0.206 18016
7606 1 14 . 1 1 23 23 GLU C C 23 176.300 176.300 176.194 0.106 18016
7607 1 14 . 1 1 23 23 GLU CA C 23 54.600 54.600 56.687 -2.087 18016
7608 1 14 . 1 1 23 23 GLU CB C 23 29.500 29.500 30.117 -0.617 18016
7609 1 14 . 1 1 23 23 GLU H H 23 8.680 8.680 8.491 0.189 18016
7610 1 14 . 1 1 24 24 GLY N N 24 108.100 108.100 107.263 0.837 18016
7611 1 14 . 1 1 24 24 GLY C C 24 173.100 173.100 172.559 0.541 18016
7612 1 14 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.716 -1.816 18016
7613 1 14 . 1 1 24 24 GLY H H 24 7.230 7.230 7.923 -0.693 18016
7614 1 14 . 1 1 25 25 VAL N N 25 121.500 121.500 119.790 1.710 18016
7615 1 14 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.853 -0.263 18016
7616 1 14 . 1 1 25 25 VAL CA C 25 59.300 59.300 59.078 0.222 18016
7617 1 14 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.042 0.058 18016
7618 1 14 . 1 1 25 25 VAL H H 25 8.050 8.050 8.196 -0.146 18016
7619 1 14 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.455 -0.135 18016
7620 1 14 . 1 1 26 26 PRO C C 26 177.600 177.600 178.072 -0.472 18016
7621 1 14 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.446 0.454 18016
7622 1 14 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.154 -0.054 18016
7623 1 14 . 1 1 27 27 GLY N N 27 109.000 109.000 109.400 -0.400 18016
7624 1 14 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.882 1.218 18016
7625 1 14 . 1 1 27 27 GLY H H 27 8.930 8.930 8.828 0.102 18016
7626 1 14 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.294 0.096 18016
7627 1 14 . 1 1 28 28 PRO C C 28 175.800 175.800 176.929 -1.129 18016
7628 1 14 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.752 -0.352 18016
7629 1 14 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.501 0.399 18016
7630 1 14 . 1 1 29 29 ASP N N 29 115.000 115.000 115.748 -0.748 18016
7631 1 14 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.683 -0.193 18016
7632 1 14 . 1 1 29 29 ASP C C 29 177.000 177.000 177.921 -0.921 18016
7633 1 14 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.950 -2.050 18016
7634 1 14 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.314 -0.614 18016
7635 1 14 . 1 1 29 29 ASP H H 29 7.760 7.760 7.860 -0.100 18016
7636 1 14 . 1 1 30 30 ARG N N 30 119.900 119.900 121.451 -1.551 18016
7637 1 14 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.964 -0.394 18016
7638 1 14 . 1 1 30 30 ARG C C 30 176.500 176.500 178.606 -2.106 18016
7639 1 14 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.774 2.126 18016
7640 1 14 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.221 0.279 18016
7641 1 14 . 1 1 30 30 ARG H H 30 7.460 7.460 8.123 -0.663 18016
7642 1 14 . 1 1 31 31 VAL N N 31 117.600 117.600 119.888 -2.288 18016
7643 1 14 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.856 -0.036 18016
7644 1 14 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.410 0.290 18016
7645 1 14 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.088 -0.288 18016
7646 1 14 . 1 1 31 31 VAL H H 31 9.080 9.080 8.281 0.799 18016
7647 1 14 . 1 1 32 32 PRO C C 32 177.000 177.000 178.592 -1.592 18016
7648 1 14 . 1 1 32 32 PRO CA C 32 65.200 65.200 66.021 -0.821 18016
7649 1 14 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.335 -0.535 18016
7650 1 14 . 1 1 33 33 LEU N N 33 115.200 115.200 120.809 -5.609 18016
7651 1 14 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.124 -0.004 18016
7652 1 14 . 1 1 33 33 LEU C C 33 178.600 178.600 178.609 -0.009 18016
7653 1 14 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.104 0.296 18016
7654 1 14 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.386 0.114 18016
7655 1 14 . 1 1 33 33 LEU H H 33 8.010 8.010 8.246 -0.236 18016
7656 1 14 . 1 1 34 34 LEU N N 34 120.400 120.400 119.015 1.385 18016
7657 1 14 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.082 -0.152 18016
7658 1 14 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.487 0.613 18016
7659 1 14 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.296 0.604 18016
7660 1 14 . 1 1 34 34 LEU H H 34 8.220 8.220 8.404 -0.184 18016
7661 1 14 . 1 1 35 35 ALA N N 35 123.100 123.100 122.650 0.450 18016
7662 1 14 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.005 0.035 18016
7663 1 14 . 1 1 35 35 ALA C C 35 179.500 179.500 179.163 0.337 18016
7664 1 14 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.195 0.305 18016
7665 1 14 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.403 -0.503 18016
7666 1 14 . 1 1 35 35 ALA H H 35 8.560 8.560 8.035 0.525 18016
7667 1 14 . 1 1 36 36 LEU N N 36 117.600 117.600 118.746 -1.146 18016
7668 1 14 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.328 -0.208 18016
7669 1 14 . 1 1 36 36 LEU C C 36 180.100 180.100 179.240 0.860 18016
7670 1 14 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.495 0.705 18016
7671 1 14 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.991 0.809 18016
7672 1 14 . 1 1 36 36 LEU H H 36 7.850 7.850 7.949 -0.099 18016
7673 1 14 . 1 1 37 37 LEU N N 37 116.700 116.700 120.396 -3.696 18016
7674 1 14 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.132 -0.032 18016
7675 1 14 . 1 1 37 37 LEU C C 37 180.100 180.100 178.646 1.454 18016
7676 1 14 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.053 0.247 18016
7677 1 14 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.627 0.573 18016
7678 1 14 . 1 1 37 37 LEU H H 37 8.730 8.730 8.334 0.396 18016
7679 1 14 . 1 1 38 38 THR N N 38 110.600 110.600 108.839 1.761 18016
7680 1 14 . 1 1 38 38 THR HA H 38 4.440 4.440 4.111 0.329 18016
7681 1 14 . 1 1 38 38 THR C C 38 175.100 175.100 175.896 -0.796 18016
7682 1 14 . 1 1 38 38 THR CA C 38 64.200 64.200 64.078 0.122 18016
7683 1 14 . 1 1 38 38 THR CB C 38 70.000 70.000 68.832 1.168 18016
7684 1 14 . 1 1 38 38 THR H H 38 8.660 8.660 8.451 0.209 18016
7685 1 14 . 1 1 39 39 ARG N N 39 118.000 118.000 120.503 -2.503 18016
7686 1 14 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.153 0.127 18016
7687 1 14 . 1 1 39 39 ARG C C 39 177.300 177.300 177.952 -0.652 18016
7688 1 14 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.194 0.105 18016
7689 1 14 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.910 0.290 18016
7690 1 14 . 1 1 39 39 ARG H H 39 7.180 7.180 7.598 -0.418 18016
7691 1 14 . 1 1 40 40 ARG N N 40 114.400 114.400 114.936 -0.536 18016
7692 1 14 . 1 1 40 40 ARG C C 40 174.800 174.800 176.111 -1.311 18016
7693 1 14 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.280 -0.980 18016
7694 1 14 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.314 3.287 18016
7695 1 14 . 1 1 40 40 ARG H H 40 7.520 7.520 7.746 -0.226 18016
7696 1 14 . 1 1 41 41 LEU N N 41 119.400 119.400 120.772 -1.372 18016
7697 1 14 . 1 1 41 41 LEU C C 41 177.100 177.100 177.351 -0.251 18016
7698 1 14 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.480 -0.780 18016
7699 1 14 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.310 1.090 18016
7700 1 14 . 1 1 41 41 LEU H H 41 8.380 8.380 7.468 0.912 18016
7701 1 14 . 1 1 42 42 THR N N 42 112.000 112.000 115.186 -3.186 18016
7702 1 14 . 1 1 42 42 THR HA H 42 4.440 4.440 4.423 0.017 18016
7703 1 14 . 1 1 42 42 THR C C 42 175.800 175.800 175.572 0.228 18016
7704 1 14 . 1 1 42 42 THR CA C 42 60.500 60.500 60.572 -0.071 18016
7705 1 14 . 1 1 42 42 THR CB C 42 70.800 70.800 70.231 0.569 18016
7706 1 14 . 1 1 42 42 THR H H 42 9.330 9.330 8.938 0.392 18016
7707 1 14 . 1 1 43 43 ASN N N 43 119.900 119.900 119.446 0.454 18016
7708 1 14 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.361 -0.111 18016
7709 1 14 . 1 1 43 43 ASN C C 43 177.900 177.900 177.377 0.523 18016
7710 1 14 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.188 -0.488 18016
7711 1 14 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.228 -1.028 18016
7712 1 14 . 1 1 43 43 ASN H H 43 9.140 9.140 8.756 0.384 18016
7713 1 14 . 1 1 44 44 ASP N N 44 118.000 118.000 119.598 -1.598 18016
7714 1 14 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.397 0.003 18016
7715 1 14 . 1 1 44 44 ASP C C 44 179.600 179.600 178.186 1.414 18016
7716 1 14 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.728 -0.428 18016
7717 1 14 . 1 1 44 44 ASP H H 44 8.360 8.360 8.652 -0.292 18016
7718 1 14 . 1 1 45 45 GLU N N 45 122.600 122.600 120.254 2.346 18016
7719 1 14 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.074 -0.104 18016
7720 1 14 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.114 0.286 18016
7721 1 14 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.837 0.463 18016
7722 1 14 . 1 1 45 45 GLU H H 45 7.850 7.850 7.665 0.185 18016
7723 1 14 . 1 1 46 46 ILE N N 46 118.900 118.900 120.643 -1.743 18016
7724 1 14 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.773 -0.343 18016
7725 1 14 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.201 1.799 18016
7726 1 14 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.776 -0.076 18016
7727 1 14 . 1 1 46 46 ILE H H 46 8.290 8.290 8.375 -0.085 18016
7728 1 14 . 1 1 47 47 LYS N N 47 118.900 118.900 119.309 -0.409 18016
7729 1 14 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.958 -0.088 18016
7730 1 14 . 1 1 47 47 LYS C C 47 178.400 178.400 178.878 -0.478 18016
7731 1 14 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.698 0.602 18016
7732 1 14 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.268 0.332 18016
7733 1 14 . 1 1 47 47 LYS H H 47 8.290 8.290 8.177 0.113 18016
7734 1 14 . 1 1 48 48 ALA N N 48 121.100 121.100 123.099 -1.999 18016
7735 1 14 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.000 0.170 18016
7736 1 14 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.205 -0.105 18016
7737 1 14 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.090 -0.090 18016
7738 1 14 . 1 1 48 48 ALA H H 48 7.710 7.710 8.117 -0.407 18016
7739 1 14 . 1 1 49 49 ILE N N 49 119.900 119.900 117.853 2.047 18016
7740 1 14 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.723 -0.073 18016
7741 1 14 . 1 1 49 49 ILE C C 49 177.300 177.300 178.080 -0.780 18016
7742 1 14 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.581 1.419 18016
7743 1 14 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.365 1.735 18016
7744 1 14 . 1 1 49 49 ILE H H 49 8.130 8.130 8.268 -0.138 18016
7745 1 14 . 1 1 50 50 ALA N N 50 122.000 122.000 123.203 -1.203 18016
7746 1 14 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.911 -0.051 18016
7747 1 14 . 1 1 50 50 ALA C C 50 179.800 179.800 179.570 0.230 18016
7748 1 14 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.265 0.435 18016
7749 1 14 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.370 -0.470 18016
7750 1 14 . 1 1 50 50 ALA H H 50 8.730 8.730 7.886 0.844 18016
7751 1 14 . 1 1 51 51 GLU N N 51 116.900 116.900 118.149 -1.249 18016
7752 1 14 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.254 -0.234 18016
7753 1 14 . 1 1 51 51 GLU CA C 51 59.400 59.400 58.964 0.436 18016
7754 1 14 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.361 0.139 18016
7755 1 14 . 1 1 51 51 GLU H H 51 8.220 8.220 8.334 -0.114 18016
7756 1 14 . 1 1 52 52 ASP N N 52 120.300 120.300 118.886 1.414 18016
7757 1 14 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.521 -0.131 18016
7758 1 14 . 1 1 52 52 ASP C C 52 178.900 178.900 178.964 -0.064 18016
7759 1 14 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.847 0.653 18016
7760 1 14 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.202 1.298 18016
7761 1 14 . 1 1 52 52 ASP H H 52 7.700 7.700 7.896 -0.196 18016
7762 1 14 . 1 1 53 53 LEU N N 53 118.300 118.300 120.572 -2.272 18016
7763 1 14 . 1 1 53 53 LEU HA H 53 3.730 3.730 4.028 -0.298 18016
7764 1 14 . 1 1 53 53 LEU C C 53 179.000 179.000 178.660 0.340 18016
7765 1 14 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.314 0.186 18016
7766 1 14 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.818 -0.718 18016
7767 1 14 . 1 1 53 53 LEU H H 53 8.290 8.290 7.700 0.590 18016
7768 1 14 . 1 1 54 54 GLU N N 54 118.700 118.700 118.955 -0.255 18016
7769 1 14 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.244 -0.024 18016
7770 1 14 . 1 1 54 54 GLU C C 54 178.200 178.200 178.003 0.197 18016
7771 1 14 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.630 0.070 18016
7772 1 14 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.298 0.602 18016
7773 1 14 . 1 1 54 54 GLU H H 54 8.070 8.070 8.183 -0.113 18016
7774 1 14 . 1 1 55 55 LYS N N 55 117.700 117.700 117.295 0.405 18016
7775 1 14 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.130 0.020 18016
7776 1 14 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.861 0.439 18016
7777 1 14 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.218 0.482 18016
7778 1 14 . 1 1 55 55 LYS H H 55 7.750 7.750 7.474 0.276 18016
7779 1 14 . 1 1 56 56 ARG N N 56 117.100 117.100 117.476 -0.376 18016
7780 1 14 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.285 -0.015 18016
7781 1 14 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.106 -0.306 18016
7782 1 14 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.593 -0.593 18016
7783 1 14 . 1 1 56 56 ARG H H 56 8.270 8.270 7.931 0.339 18016
7784 1 14 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.351 0.009 18016
7785 1 14 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.559 0.541 18016
7786 1 14 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.580 -1.380 18016
7787 1 14 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.696 -0.186 18016
7788 1 14 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.129 1.071 18016
7789 1 14 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.891 -2.591 18016
7790 1 14 . 1 1 59 59 PHE N N 59 120.400 120.400 125.873 -5.473 18016
7791 1 14 . 1 1 59 59 PHE C C 59 175.500 175.500 176.296 -0.796 18016
7792 1 14 . 1 1 59 59 PHE CA C 59 57.200 57.200 54.869 2.331 18016
7793 1 14 . 1 1 59 59 PHE CB C 59 39.300 39.300 38.266 1.034 18016
7794 1 14 . 1 1 59 59 PHE H H 59 7.710 7.710 8.327 -0.617 18016
7795 1 14 . 1 1 60 60 ASP N N 60 120.800 120.800 125.440 -4.640 18016
7796 1 14 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.203 0.287 18016
7797 1 14 . 1 1 60 60 ASP CA C 60 54.300 54.300 57.577 -3.277 18016
7798 1 14 . 1 1 60 60 ASP CB C 60 41.100 41.100 40.840 0.259 18016
7799 1 14 . 1 1 60 60 ASP H H 60 8.180 8.180 8.690 -0.510 18016
7800 1 14 . 1 1 61 61 HIS N N 61 118.300 118.300 116.115 2.185 18016
7801 1 14 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.580 -0.190 18016
7802 1 14 . 1 1 61 61 HIS CA C 61 56.700 56.700 56.803 -0.103 18016
7803 1 14 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.637 -0.837 18016
7804 1 14 . 1 1 61 61 HIS H H 61 8.550 8.550 8.226 0.324 18016
7805 1 14 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.253 -0.243 18016
7806 1 14 . 1 1 62 62 ILE C C 62 173.800 173.800 175.154 -1.354 18016
7807 1 14 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.341 6.159 18016
7808 1 14 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.258 1.842 18016
7809 1 14 . 1 1 63 63 ASP N N 63 125.100 125.100 121.653 3.447 18016
7810 1 14 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.365 0.235 18016
7811 1 14 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.338 -2.538 18016
7812 1 14 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.626 -2.126 18016
7813 1 14 . 1 1 63 63 ASP H H 63 8.360 8.360 7.538 0.822 18016
7814 1 14 . 1 1 64 64 ILE HA H 64 3.670 3.670 4.124 -0.454 18016
7815 1 14 . 1 1 64 64 ILE C C 64 177.000 177.000 176.566 0.434 18016
7816 1 14 . 1 1 64 64 ILE CA C 64 62.100 62.100 62.773 -0.673 18016
7817 1 14 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.696 -2.096 18016
7818 1 14 . 1 1 65 65 GLY N N 65 107.600 107.600 108.485 -0.885 18016
7819 1 14 . 1 1 65 65 GLY C C 65 177.000 177.000 175.851 1.149 18016
7820 1 14 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.948 0.352 18016
7821 1 14 . 1 1 65 65 GLY H H 65 8.440 8.440 7.968 0.472 18016
7822 1 14 . 1 1 66 66 VAL N N 66 121.800 121.800 122.132 -0.332 18016
7823 1 14 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.650 0.110 18016
7824 1 14 . 1 1 66 66 VAL C C 66 178.500 178.500 177.515 0.985 18016
7825 1 14 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.478 0.122 18016
7826 1 14 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.720 0.280 18016
7827 1 14 . 1 1 66 66 VAL H H 66 7.550 7.550 8.232 -0.682 18016
7828 1 14 . 1 1 67 67 LEU N N 67 120.900 120.900 119.140 1.760 18016
7829 1 14 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.059 0.011 18016
7830 1 14 . 1 1 67 67 LEU C C 67 179.000 179.000 179.014 -0.014 18016
7831 1 14 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.535 0.065 18016
7832 1 14 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.553 1.747 18016
7833 1 14 . 1 1 67 67 LEU H H 67 7.650 7.650 7.435 0.215 18016
7834 1 14 . 1 1 68 68 ILE N N 68 118.900 118.900 117.786 1.114 18016
7835 1 14 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.795 -0.085 18016
7836 1 14 . 1 1 68 68 ILE C C 68 179.500 179.500 178.370 1.130 18016
7837 1 14 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.792 0.408 18016
7838 1 14 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.419 0.081 18016
7839 1 14 . 1 1 68 68 ILE H H 68 8.580 8.580 7.527 1.053 18016
7840 1 14 . 1 1 69 69 THR N N 69 118.100 118.100 114.776 3.324 18016
7841 1 14 . 1 1 69 69 THR HA H 69 3.940 3.940 4.084 -0.144 18016
7842 1 14 . 1 1 69 69 THR C C 69 176.200 176.200 176.643 -0.443 18016
7843 1 14 . 1 1 69 69 THR CA C 69 66.600 66.600 66.292 0.308 18016
7844 1 14 . 1 1 69 69 THR CB C 69 68.500 68.500 68.458 0.042 18016
7845 1 14 . 1 1 69 69 THR H H 69 7.840 7.840 7.720 0.120 18016
7846 1 14 . 1 1 70 70 GLN N N 70 121.600 121.600 121.114 0.486 18016
7847 1 14 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.150 -0.040 18016
7848 1 14 . 1 1 70 70 GLN C C 70 178.100 178.100 178.179 -0.079 18016
7849 1 14 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.676 0.424 18016
7850 1 14 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.549 -0.249 18016
7851 1 14 . 1 1 70 70 GLN H H 70 8.100 8.100 7.361 0.739 18016
7852 1 14 . 1 1 71 71 MET N N 71 118.700 118.700 118.352 0.348 18016
7853 1 14 . 1 1 71 71 MET HA H 71 4.010 4.010 4.337 -0.327 18016
7854 1 14 . 1 1 71 71 MET C C 71 176.300 176.300 178.209 -1.909 18016
7855 1 14 . 1 1 71 71 MET CA C 71 58.100 58.100 59.221 -1.121 18016
7856 1 14 . 1 1 71 71 MET CB C 71 33.600 33.600 32.826 0.774 18016
7857 1 14 . 1 1 71 71 MET H H 71 8.350 8.350 8.659 -0.309 18016
7858 1 14 . 1 1 72 72 THR N N 72 111.600 111.600 111.221 0.379 18016
7859 1 14 . 1 1 72 72 THR HA H 72 3.940 3.940 4.125 -0.185 18016
7860 1 14 . 1 1 72 72 THR C C 72 175.800 175.800 175.786 0.014 18016
7861 1 14 . 1 1 72 72 THR CA C 72 65.300 65.300 64.890 0.410 18016
7862 1 14 . 1 1 72 72 THR CB C 72 69.100 69.100 69.203 -0.103 18016
7863 1 14 . 1 1 72 72 THR H H 72 7.840 7.840 7.731 0.109 18016
7864 1 14 . 1 1 73 73 ASP N N 73 121.100 121.100 120.166 0.934 18016
7865 1 14 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.634 -0.104 18016
7866 1 14 . 1 1 73 73 ASP C C 73 176.600 176.600 175.809 0.791 18016
7867 1 14 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.560 0.640 18016
7868 1 14 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.395 -0.995 18016
7869 1 14 . 1 1 73 73 ASP H H 73 7.840 7.840 7.658 0.182 18016
7870 1 14 . 1 1 74 74 GLU N N 74 121.100 121.100 119.087 2.013 18016
7871 1 14 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.553 -0.213 18016
7872 1 14 . 1 1 74 74 GLU C C 74 173.800 173.800 175.202 -1.402 18016
7873 1 14 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.530 -0.030 18016
7874 1 14 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.393 -0.793 18016
7875 1 14 . 1 1 74 74 GLU H H 74 7.980 7.980 8.539 -0.559 18016
7876 1 14 . 1 1 75 75 MET N N 75 125.800 125.800 126.156 -0.356 18016
7877 1 14 . 1 1 75 75 MET HA H 75 4.710 4.710 4.750 -0.040 18016
7878 1 14 . 1 1 75 75 MET CA C 75 53.800 53.800 52.697 1.103 18016
7879 1 14 . 1 1 75 75 MET CB C 75 31.700 31.700 30.776 0.923 18016
7880 1 14 . 1 1 75 75 MET H H 75 8.380 8.380 8.623 -0.243 18016
7881 1 14 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.361 0.149 18016
7882 1 14 . 1 1 76 76 PRO C C 76 175.700 175.700 176.883 -1.183 18016
7883 1 14 . 1 1 76 76 PRO CA C 76 62.000 62.000 64.005 -2.006 18016
7884 1 14 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.314 -0.514 18016
7885 1 14 . 1 1 77 77 ARG N N 77 119.700 119.700 118.487 1.213 18016
7886 1 14 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.533 -0.263 18016
7887 1 14 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.456 0.344 18016
7888 1 14 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.065 -1.365 18016
7889 1 14 . 1 1 77 77 ARG H H 77 8.940 8.940 7.985 0.955 18016
7890 1 14 . 1 1 78 78 GLU N N 78 124.700 124.700 125.866 -1.166 18016
7891 1 14 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.956 0.004 18016
7892 1 14 . 1 1 78 78 GLU C C 78 179.000 179.000 177.753 1.247 18016
7893 1 14 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.448 -0.648 18016
7894 1 14 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.548 -0.548 18016
7895 1 14 . 1 1 78 78 GLU H H 78 9.170 9.170 9.037 0.133 18016
7896 1 14 . 1 1 79 79 GLU N N 79 116.800 116.800 119.613 -2.813 18016
7897 1 14 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.097 0.023 18016
7898 1 14 . 1 1 79 79 GLU C C 79 179.100 179.100 178.484 0.616 18016
7899 1 14 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.546 0.154 18016
7900 1 14 . 1 1 79 79 GLU CB C 79 29.000 29.000 28.743 0.257 18016
7901 1 14 . 1 1 79 79 GLU H H 79 9.660 9.660 8.750 0.910 18016
7902 1 14 . 1 1 80 80 ASP N N 80 120.000 120.000 119.185 0.815 18016
7903 1 14 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.482 0.208 18016
7904 1 14 . 1 1 80 80 ASP C C 80 177.300 177.300 178.639 -1.339 18016
7905 1 14 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.140 0.260 18016
7906 1 14 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.491 1.109 18016
7907 1 14 . 1 1 80 80 ASP H H 80 7.310 7.310 8.262 -0.952 18016
7908 1 14 . 1 1 81 81 ILE N N 81 120.100 120.100 120.657 -0.557 18016
7909 1 14 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.710 -0.220 18016
7910 1 14 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.615 0.685 18016
7911 1 14 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.996 0.304 18016
7912 1 14 . 1 1 81 81 ILE H H 81 7.610 7.610 8.255 -0.645 18016
7913 1 14 . 1 1 82 82 GLU N N 82 118.100 118.100 118.713 -0.613 18016
7914 1 14 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.033 0.247 18016
7915 1 14 . 1 1 82 82 GLU C C 82 177.800 177.800 178.789 -0.989 18016
7916 1 14 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.344 -1.345 18016
7917 1 14 . 1 1 82 82 GLU CB C 82 28.800 28.800 28.995 -0.195 18016
7918 1 14 . 1 1 82 82 GLU H H 82 8.550 8.550 8.459 0.091 18016
7919 1 14 . 1 1 83 83 ARG N N 83 119.900 119.900 120.993 -1.093 18016
7920 1 14 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.073 -0.043 18016
7921 1 14 . 1 1 83 83 ARG C C 83 179.400 179.400 178.829 0.571 18016
7922 1 14 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.309 0.591 18016
7923 1 14 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.375 -0.775 18016
7924 1 14 . 1 1 83 83 ARG H H 83 7.590 7.590 8.040 -0.450 18016
7925 1 14 . 1 1 84 84 VAL N N 84 120.400 120.400 119.814 0.586 18016
7926 1 14 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.947 -0.197 18016
7927 1 14 . 1 1 84 84 VAL C C 84 177.400 177.400 177.505 -0.105 18016
7928 1 14 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.613 1.287 18016
7929 1 14 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.900 -0.000 18016
7930 1 14 . 1 1 84 84 VAL H H 84 7.550 7.550 8.409 -0.859 18016
7931 1 14 . 1 1 85 85 ARG N N 85 121.600 121.600 119.783 1.817 18016
7932 1 14 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.287 -0.277 18016
7933 1 14 . 1 1 85 85 ARG C C 85 178.100 178.100 179.009 -0.909 18016
7934 1 14 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.954 0.946 18016
7935 1 14 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.939 0.261 18016
7936 1 14 . 1 1 85 85 ARG H H 85 9.090 9.090 8.511 0.579 18016
7937 1 14 . 1 1 86 86 ARG N N 86 115.600 115.600 117.879 -2.279 18016
7938 1 14 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.098 -0.218 18016
7939 1 14 . 1 1 86 86 ARG C C 86 179.000 179.000 178.382 0.618 18016
7940 1 14 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.115 0.285 18016
7941 1 14 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.825 0.575 18016
7942 1 14 . 1 1 86 86 ARG H H 86 8.660 8.660 8.397 0.263 18016
7943 1 14 . 1 1 87 87 HIS N N 87 118.000 118.000 119.977 -1.977 18016
7944 1 14 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.359 0.001 18016
7945 1 14 . 1 1 87 87 HIS C C 87 178.400 178.400 177.409 0.991 18016
7946 1 14 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.300 0.300 18016
7947 1 14 . 1 1 87 87 HIS CB C 87 30.700 30.700 29.980 0.720 18016
7948 1 14 . 1 1 87 87 HIS H H 87 7.640 7.640 7.835 -0.195 18016
7949 1 14 . 1 1 88 88 LEU N N 88 119.600 119.600 118.513 1.087 18016
7950 1 14 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.144 -0.564 18016
7951 1 14 . 1 1 88 88 LEU C C 88 180.000 180.000 178.840 1.160 18016
7952 1 14 . 1 1 88 88 LEU CA C 88 57.200 57.200 56.779 0.421 18016
7953 1 14 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.202 1.398 18016
7954 1 14 . 1 1 88 88 LEU H H 88 8.650 8.650 8.616 0.034 18016
7955 1 14 . 1 1 89 89 ALA N N 89 118.500 118.500 122.253 -3.753 18016
7956 1 14 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.627 0.733 18016
7957 1 14 . 1 1 89 89 ALA C C 89 180.400 180.400 179.592 0.808 18016
7958 1 14 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.752 -1.152 18016
7959 1 14 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.308 -0.208 18016
7960 1 14 . 1 1 89 89 ALA H H 89 8.870 8.870 8.157 0.713 18016
7961 1 14 . 1 1 90 90 LEU N N 90 119.400 119.400 117.062 2.338 18016
7962 1 14 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.982 0.228 18016
7963 1 14 . 1 1 90 90 LEU C C 90 179.100 179.100 178.837 0.263 18016
7964 1 14 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.233 0.266 18016
7965 1 14 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.585 0.115 18016
7966 1 14 . 1 1 90 90 LEU H H 90 7.390 7.390 7.504 -0.114 18016
7967 1 14 . 1 1 91 91 GLN N N 91 114.500 114.500 115.879 -1.379 18016
7968 1 14 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.363 0.337 18016
7969 1 14 . 1 1 91 91 GLN C C 91 175.800 175.800 176.960 -1.160 18016
7970 1 14 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.678 -2.178 18016
7971 1 14 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.211 -2.111 18016
7972 1 14 . 1 1 91 91 GLN H H 91 7.810 7.810 7.753 0.057 18016
7973 1 14 . 1 1 92 92 GLY N N 92 107.900 107.900 105.886 2.014 18016
7974 1 14 . 1 1 92 92 GLY C C 92 172.100 172.100 172.097 0.003 18016
7975 1 14 . 1 1 92 92 GLY CA C 92 44.000 44.000 44.783 -0.783 18016
7976 1 14 . 1 1 92 92 GLY H H 92 7.710 7.710 8.234 -0.524 18016
7977 1 14 . 1 1 93 93 TRP N N 93 114.200 114.200 122.375 -8.175 18016
7978 1 14 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.467 1.533 18016
7979 1 14 . 1 1 93 93 TRP CB C 93 29.200 29.200 31.148 -1.948 18016
7980 1 14 . 1 1 93 93 TRP H H 93 8.450 8.450 8.378 0.072 18016
7981 1 14 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.134 0.326 18016
7982 1 14 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.861 -1.061 18016
7983 1 14 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.370 0.230 18016
7984 1 14 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.116 -0.616 18016
7985 1 14 . 1 1 95 95 LEU C C 95 175.000 175.000 177.061 -2.061 18016
7986 1 14 . 1 1 95 95 LEU CA C 95 56.100 56.100 55.910 0.190 18016
7987 1 14 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.209 1.891 18016
7988 1 14 . 1 1 96 96 ASP N N 96 114.000 114.000 116.542 -2.542 18016
7989 1 14 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.551 0.399 18016
7990 1 14 . 1 1 96 96 ASP C C 96 175.800 175.800 176.113 -0.313 18016
7991 1 14 . 1 1 96 96 ASP CA C 96 54.000 54.000 55.229 -1.229 18016
7992 1 14 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.671 0.229 18016
7993 1 14 . 1 1 96 96 ASP H H 96 7.230 7.230 7.430 -0.200 18016
7994 1 14 . 1 1 97 97 ASP N N 97 123.200 123.200 121.133 2.067 18016
7995 1 14 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.979 -0.369 18016
7996 1 14 . 1 1 97 97 ASP CA C 97 53.500 53.500 50.976 2.524 18016
7997 1 14 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.743 -4.043 18016
7998 1 14 . 1 1 97 97 ASP H H 97 7.420 7.420 7.698 -0.278 18016
7999 1 14 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.587 -0.297 18016
8000 1 14 . 1 1 98 98 PRO C C 98 177.500 177.500 176.408 1.092 18016
8001 1 14 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.327 0.373 18016
8002 1 14 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.555 -1.655 18016
8003 1 14 . 1 1 99 99 ARG N N 99 121.300 121.300 120.753 0.547 18016
8004 1 14 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.430 -0.720 18016
8005 1 14 . 1 1 99 99 ARG C C 99 176.500 176.500 175.887 0.613 18016
8006 1 14 . 1 1 99 99 ARG CA C 99 56.100 56.100 55.947 0.152 18016
8007 1 14 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.909 -0.409 18016
8008 1 14 . 1 1 99 99 ARG H H 99 8.390 8.390 8.263 0.127 18016
8009 1 14 . 1 1 100 100 ASP N N 100 119.600 119.600 116.978 2.622 18016
8010 1 14 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.583 -0.083 18016
8011 1 14 . 1 1 100 100 ASP C C 100 177.000 177.000 176.109 0.891 18016
8012 1 14 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.899 0.801 18016
8013 1 14 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.541 -1.641 18016
8014 1 14 . 1 1 100 100 ASP H H 100 8.260 8.260 7.600 0.660 18016
8015 1 14 . 1 1 101 101 GLY N N 101 109.300 109.300 111.572 -2.272 18016
8016 1 14 . 1 1 101 101 GLY CA C 101 45.400 45.400 45.243 0.157 18016
8017 1 14 . 1 1 101 101 GLY H H 101 8.450 8.450 8.349 0.101 18016
8018 1 14 . 1 1 102 102 GLU N N 102 119.800 119.800 120.249 -0.449 18016
8019 1 14 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.042 0.268 18016
8020 1 14 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.670 -0.670 18016
8021 1 14 . 1 1 102 102 GLU CB C 102 30.500 30.500 28.673 1.827 18016
8022 1 14 . 1 1 102 102 GLU H H 102 8.140 8.140 8.338 -0.198 18016
8023 1 14 . 1 1 103 103 GLU N N 103 123.000 123.000 126.116 -3.116 18016
8024 1 14 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.699 -0.139 18016
8025 1 14 . 1 1 103 103 GLU CA C 103 54.300 54.300 53.480 0.820 18016
8026 1 14 . 1 1 103 103 GLU CB C 103 29.600 29.600 28.389 1.211 18016
8027 1 14 . 1 1 103 103 GLU H H 103 8.580 8.580 8.092 0.488 18016
8028 1 14 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.402 0.078 18016
8029 1 14 . 1 1 104 104 PRO C C 104 176.800 176.800 175.957 0.843 18016
8030 1 14 . 1 1 104 104 PRO CA C 104 63.400 63.400 62.981 0.419 18016
8031 1 14 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.314 -0.214 18016
8032 1 14 . 1 1 105 105 ASP N N 105 120.400 120.400 121.754 -1.354 18016
8033 1 14 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.648 -0.068 18016
8034 1 14 . 1 1 105 105 ASP C C 105 177.100 177.100 176.814 0.286 18016
8035 1 14 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.035 0.265 18016
8036 1 14 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.934 -0.534 18016
8037 1 14 . 1 1 105 105 ASP H H 105 8.500 8.500 8.355 0.145 18016
8038 1 14 . 1 1 106 106 GLY N N 106 109.300 109.300 112.649 -3.349 18016
8039 1 14 . 1 1 106 106 GLY C C 106 174.600 174.600 173.759 0.841 18016
8040 1 14 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.612 -0.212 18016
8041 1 14 . 1 1 106 106 GLY H H 106 8.360 8.360 9.043 -0.683 18016
8042 1 14 . 1 1 107 107 GLU N N 107 120.400 120.400 118.314 2.086 18016
8043 1 14 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.344 -0.004 18016
8044 1 14 . 1 1 107 107 GLU C C 107 177.100 177.100 175.090 2.010 18016
8045 1 14 . 1 1 107 107 GLU CA C 107 56.500 56.500 55.645 0.855 18016
8046 1 14 . 1 1 107 107 GLU CB C 107 30.200 30.200 30.238 -0.038 18016
8047 1 14 . 1 1 107 107 GLU H H 107 8.410 8.410 7.853 0.557 18016
8048 1 14 . 1 1 108 108 SER N N 108 116.600 116.600 114.671 1.929 18016
8049 1 14 . 1 1 108 108 SER HA H 108 4.450 4.450 4.648 -0.198 18016
8050 1 14 . 1 1 108 108 SER C C 108 175.300 175.300 174.544 0.756 18016
8051 1 14 . 1 1 108 108 SER CA C 108 58.700 58.700 57.603 1.097 18016
8052 1 14 . 1 1 108 108 SER CB C 108 63.800 63.800 63.048 0.752 18016
8053 1 14 . 1 1 108 108 SER H H 108 8.460 8.460 8.541 -0.081 18016
8054 1 14 . 1 1 109 109 GLY N N 109 110.800 110.800 110.392 0.408 18016
8055 1 14 . 1 1 109 109 GLY C C 109 174.500 174.500 173.157 1.343 18016
8056 1 14 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.628 0.672 18016
8057 1 14 . 1 1 109 109 GLY H H 109 8.500 8.500 8.338 0.162 18016
8058 1 14 . 1 1 110 110 GLY N N 110 108.800 108.800 107.246 1.554 18016
8059 1 14 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.671 -1.271 18016
8060 1 14 . 1 1 110 110 GLY H H 110 8.140 8.140 7.232 0.908 18016
8061 1 14 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.611 -0.001 18016
8062 1 14 . 1 1 111 111 PRO C C 111 176.000 176.000 176.111 -0.111 18016
8063 1 14 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.065 -0.465 18016
8064 1 14 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.430 2.170 18016
8065 1 15 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.691 -0.261 18016
8066 1 15 . 1 1 2 2 PRO C C 2 177.600 177.600 176.087 1.513 18016
8067 1 15 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.613 0.687 18016
8068 1 15 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.729 -0.429 18016
8069 1 15 . 1 1 3 3 GLY N N 3 110.000 110.000 107.875 2.125 18016
8070 1 15 . 1 1 3 3 GLY C C 3 174.200 174.200 172.820 1.380 18016
8071 1 15 . 1 1 3 3 GLY CA C 3 45.400 45.400 44.753 0.647 18016
8072 1 15 . 1 1 3 3 GLY H H 3 8.700 8.700 8.725 -0.025 18016
8073 1 15 . 1 1 4 4 SER N N 4 115.400 115.400 116.651 -1.251 18016
8074 1 15 . 1 1 4 4 SER HA H 4 4.440 4.440 4.722 -0.282 18016
8075 1 15 . 1 1 4 4 SER C C 4 174.800 174.800 174.210 0.590 18016
8076 1 15 . 1 1 4 4 SER CA C 4 58.400 58.400 57.590 0.810 18016
8077 1 15 . 1 1 4 4 SER CB C 4 63.800 63.800 65.588 -1.788 18016
8078 1 15 . 1 1 4 4 SER H H 4 8.210 8.210 7.947 0.264 18016
8079 1 15 . 1 1 5 5 MET N N 5 122.200 122.200 119.720 2.480 18016
8080 1 15 . 1 1 5 5 MET HA H 5 4.510 4.510 4.746 -0.236 18016
8081 1 15 . 1 1 5 5 MET CA C 5 55.600 55.600 55.743 -0.143 18016
8082 1 15 . 1 1 5 5 MET CB C 5 32.900 32.900 33.952 -1.052 18016
8083 1 15 . 1 1 5 5 MET H H 5 8.570 8.570 8.968 -0.398 18016
8084 1 15 . 1 1 6 6 VAL N N 6 120.000 120.000 117.255 2.745 18016
8085 1 15 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.194 -0.144 18016
8086 1 15 . 1 1 6 6 VAL C C 6 175.700 175.700 175.586 0.114 18016
8087 1 15 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.353 1.347 18016
8088 1 15 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.340 0.160 18016
8089 1 15 . 1 1 6 6 VAL H H 6 8.150 8.150 7.981 0.169 18016
8090 1 15 . 1 1 7 7 ASN N N 7 122.000 122.000 119.059 2.941 18016
8091 1 15 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.497 0.163 18016
8092 1 15 . 1 1 7 7 ASN C C 7 175.200 175.200 176.884 -1.684 18016
8093 1 15 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.355 -1.155 18016
8094 1 15 . 1 1 7 7 ASN CB C 7 38.900 38.900 38.890 0.010 18016
8095 1 15 . 1 1 7 7 ASN H H 7 8.010 8.010 8.547 -0.537 18016
8096 1 15 . 1 1 8 8 ALA N N 8 126.500 126.500 125.407 1.093 18016
8097 1 15 . 1 1 8 8 ALA C C 8 180.200 180.200 179.430 0.770 18016
8098 1 15 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.133 0.367 18016
8099 1 15 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.924 -0.524 18016
8100 1 15 . 1 1 8 8 ALA H H 8 9.020 9.020 8.919 0.101 18016
8101 1 15 . 1 1 9 9 PHE N N 9 121.300 121.300 119.617 1.683 18016
8102 1 15 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.106 0.184 18016
8103 1 15 . 1 1 9 9 PHE C C 9 177.200 177.200 177.245 -0.045 18016
8104 1 15 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.761 -0.461 18016
8105 1 15 . 1 1 9 9 PHE CB C 9 39.200 39.200 39.265 -0.065 18016
8106 1 15 . 1 1 9 9 PHE H H 9 8.570 8.570 8.731 -0.161 18016
8107 1 15 . 1 1 10 10 LEU N N 10 117.200 117.200 119.220 -2.020 18016
8108 1 15 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.840 -0.140 18016
8109 1 15 . 1 1 10 10 LEU C C 10 179.700 179.700 179.013 0.687 18016
8110 1 15 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.680 -0.080 18016
8111 1 15 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.522 0.178 18016
8112 1 15 . 1 1 10 10 LEU H H 10 8.150 8.150 7.978 0.172 18016
8113 1 15 . 1 1 11 11 ALA N N 11 121.500 121.500 121.930 -0.430 18016
8114 1 15 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.876 0.144 18016
8115 1 15 . 1 1 11 11 ALA C C 11 180.900 180.900 179.492 1.408 18016
8116 1 15 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.557 -0.557 18016
8117 1 15 . 1 1 11 11 ALA CB C 11 18.000 18.000 17.977 0.022 18016
8118 1 15 . 1 1 11 11 ALA H H 11 8.460 8.460 8.692 -0.232 18016
8119 1 15 . 1 1 12 12 LYS N N 12 120.700 120.700 119.010 1.690 18016
8120 1 15 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.048 0.002 18016
8121 1 15 . 1 1 12 12 LYS C C 12 179.700 179.700 178.942 0.758 18016
8122 1 15 . 1 1 12 12 LYS CA C 12 59.200 59.200 59.294 -0.094 18016
8123 1 15 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.416 -0.816 18016
8124 1 15 . 1 1 12 12 LYS H H 12 7.820 7.820 7.490 0.330 18016
8125 1 15 . 1 1 13 13 ILE N N 13 120.100 120.100 119.695 0.405 18016
8126 1 15 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.715 -0.025 18016
8127 1 15 . 1 1 13 13 ILE C C 13 178.100 178.100 178.164 -0.064 18016
8128 1 15 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.883 -0.883 18016
8129 1 15 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.563 -1.163 18016
8130 1 15 . 1 1 13 13 ILE H H 13 7.640 7.640 7.854 -0.214 18016
8131 1 15 . 1 1 14 14 ALA N N 14 122.700 122.700 122.099 0.601 18016
8132 1 15 . 1 1 14 14 ALA HA H 14 3.860 3.860 4.014 -0.154 18016
8133 1 15 . 1 1 14 14 ALA C C 14 179.000 179.000 179.620 -0.620 18016
8134 1 15 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.324 0.676 18016
8135 1 15 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.116 -0.116 18016
8136 1 15 . 1 1 14 14 ALA H H 14 8.680 8.680 8.524 0.156 18016
8137 1 15 . 1 1 15 15 ALA N N 15 118.700 118.700 121.618 -2.918 18016
8138 1 15 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.114 -0.024 18016
8139 1 15 . 1 1 15 15 ALA C C 15 180.400 180.400 179.111 1.289 18016
8140 1 15 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.848 0.152 18016
8141 1 15 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.320 -0.619 18016
8142 1 15 . 1 1 15 15 ALA H H 15 8.070 8.070 8.302 -0.232 18016
8143 1 15 . 1 1 16 16 TRP N N 16 122.900 122.900 120.936 1.964 18016
8144 1 15 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.237 0.323 18016
8145 1 15 . 1 1 16 16 TRP C C 16 178.400 178.400 178.184 0.216 18016
8146 1 15 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.118 -1.518 18016
8147 1 15 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.250 -0.950 18016
8148 1 15 . 1 1 16 16 TRP H H 16 7.820 7.820 8.178 -0.358 18016
8149 1 15 . 1 1 17 17 LEU N N 17 120.400 120.400 119.096 1.304 18016
8150 1 15 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.082 0.528 18016
8151 1 15 . 1 1 17 17 LEU C C 17 179.000 179.000 178.569 0.431 18016
8152 1 15 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.695 0.205 18016
8153 1 15 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.422 0.578 18016
8154 1 15 . 1 1 17 17 LEU H H 17 8.630 8.630 8.429 0.201 18016
8155 1 15 . 1 1 18 18 ASN N N 18 116.200 116.200 117.290 -1.090 18016
8156 1 15 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.326 -0.016 18016
8157 1 15 . 1 1 18 18 ASN C C 18 177.100 177.100 176.632 0.468 18016
8158 1 15 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.909 -0.309 18016
8159 1 15 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.833 0.367 18016
8160 1 15 . 1 1 18 18 ASN H H 18 8.350 8.350 8.288 0.062 18016
8161 1 15 . 1 1 19 19 ALA N N 19 119.600 119.600 119.492 0.108 18016
8162 1 15 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.224 -0.134 18016
8163 1 15 . 1 1 19 19 ALA C C 19 180.100 180.100 178.637 1.463 18016
8164 1 15 . 1 1 19 19 ALA CA C 19 54.200 54.200 53.906 0.294 18016
8165 1 15 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.660 -1.060 18016
8166 1 15 . 1 1 19 19 ALA H H 19 7.920 7.920 7.778 0.142 18016
8167 1 15 . 1 1 20 20 GLY N N 20 103.500 103.500 105.040 -1.540 18016
8168 1 15 . 1 1 20 20 GLY C C 20 173.800 173.800 174.019 -0.219 18016
8169 1 15 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.419 0.381 18016
8170 1 15 . 1 1 20 20 GLY H H 20 7.700 7.700 7.065 0.635 18016
8171 1 15 . 1 1 21 21 TYR N N 21 119.900 119.900 117.745 2.155 18016
8172 1 15 . 1 1 21 21 TYR HA H 21 5.170 5.170 5.308 -0.138 18016
8173 1 15 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.437 1.963 18016
8174 1 15 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.920 -1.121 18016
8175 1 15 . 1 1 21 21 TYR H H 21 7.980 7.980 8.154 -0.174 18016
8176 1 15 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.366 0.134 18016
8177 1 15 . 1 1 22 22 PRO C C 22 178.700 178.700 176.631 2.069 18016
8178 1 15 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.472 0.528 18016
8179 1 15 . 1 1 22 22 PRO CB C 22 32.000 32.000 31.896 0.104 18016
8180 1 15 . 1 1 23 23 GLU N N 23 116.300 116.300 117.600 -1.300 18016
8181 1 15 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.317 0.253 18016
8182 1 15 . 1 1 23 23 GLU C C 23 176.300 176.300 176.170 0.130 18016
8183 1 15 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.450 -0.850 18016
8184 1 15 . 1 1 23 23 GLU CB C 23 29.500 29.500 28.454 1.046 18016
8185 1 15 . 1 1 23 23 GLU H H 23 8.680 8.680 7.820 0.860 18016
8186 1 15 . 1 1 24 24 GLY N N 24 108.100 108.100 109.005 -0.905 18016
8187 1 15 . 1 1 24 24 GLY C C 24 173.100 173.100 171.929 1.171 18016
8188 1 15 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.412 -1.512 18016
8189 1 15 . 1 1 24 24 GLY H H 24 7.230 7.230 7.521 -0.291 18016
8190 1 15 . 1 1 25 25 VAL N N 25 121.500 121.500 120.207 1.293 18016
8191 1 15 . 1 1 25 25 VAL HA H 25 3.590 3.590 4.299 -0.709 18016
8192 1 15 . 1 1 25 25 VAL CA C 25 59.300 59.300 57.606 1.694 18016
8193 1 15 . 1 1 25 25 VAL CB C 25 32.100 32.100 34.689 -2.589 18016
8194 1 15 . 1 1 25 25 VAL H H 25 8.050 8.050 8.020 0.030 18016
8195 1 15 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.534 -0.214 18016
8196 1 15 . 1 1 26 26 PRO C C 26 177.600 177.600 177.690 -0.090 18016
8197 1 15 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.651 0.249 18016
8198 1 15 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.913 0.187 18016
8199 1 15 . 1 1 27 27 GLY N N 27 109.000 109.000 108.614 0.386 18016
8200 1 15 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.749 1.351 18016
8201 1 15 . 1 1 27 27 GLY H H 27 8.930 8.930 8.782 0.148 18016
8202 1 15 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.213 0.177 18016
8203 1 15 . 1 1 28 28 PRO C C 28 175.800 175.800 177.103 -1.303 18016
8204 1 15 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.862 -0.462 18016
8205 1 15 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.490 0.410 18016
8206 1 15 . 1 1 29 29 ASP N N 29 115.000 115.000 115.385 -0.385 18016
8207 1 15 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.625 -0.135 18016
8208 1 15 . 1 1 29 29 ASP C C 29 177.000 177.000 177.867 -0.867 18016
8209 1 15 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.846 -1.946 18016
8210 1 15 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.415 -0.715 18016
8211 1 15 . 1 1 29 29 ASP H H 29 7.760 7.760 7.756 0.004 18016
8212 1 15 . 1 1 30 30 ARG N N 30 119.900 119.900 121.424 -1.524 18016
8213 1 15 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.944 -0.374 18016
8214 1 15 . 1 1 30 30 ARG C C 30 176.500 176.500 178.609 -2.109 18016
8215 1 15 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.725 2.175 18016
8216 1 15 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.220 0.280 18016
8217 1 15 . 1 1 30 30 ARG H H 30 7.460 7.460 7.976 -0.516 18016
8218 1 15 . 1 1 31 31 VAL N N 31 117.600 117.600 120.114 -2.514 18016
8219 1 15 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.859 -0.039 18016
8220 1 15 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.380 0.320 18016
8221 1 15 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.256 -0.456 18016
8222 1 15 . 1 1 31 31 VAL H H 31 9.080 9.080 8.282 0.798 18016
8223 1 15 . 1 1 32 32 PRO C C 32 177.000 177.000 178.578 -1.578 18016
8224 1 15 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.959 -0.759 18016
8225 1 15 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.319 -0.519 18016
8226 1 15 . 1 1 33 33 LEU N N 33 115.200 115.200 120.991 -5.791 18016
8227 1 15 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.104 0.016 18016
8228 1 15 . 1 1 33 33 LEU C C 33 178.600 178.600 178.425 0.175 18016
8229 1 15 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.060 0.340 18016
8230 1 15 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.323 0.177 18016
8231 1 15 . 1 1 33 33 LEU H H 33 8.010 8.010 8.145 -0.135 18016
8232 1 15 . 1 1 34 34 LEU N N 34 120.400 120.400 119.092 1.308 18016
8233 1 15 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.074 -0.144 18016
8234 1 15 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.590 0.510 18016
8235 1 15 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.370 0.530 18016
8236 1 15 . 1 1 34 34 LEU H H 34 8.220 8.220 8.435 -0.215 18016
8237 1 15 . 1 1 35 35 ALA N N 35 123.100 123.100 123.455 -0.355 18016
8238 1 15 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.062 -0.022 18016
8239 1 15 . 1 1 35 35 ALA C C 35 179.500 179.500 179.665 -0.165 18016
8240 1 15 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.135 0.366 18016
8241 1 15 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.436 -0.536 18016
8242 1 15 . 1 1 35 35 ALA H H 35 8.560 8.560 8.250 0.310 18016
8243 1 15 . 1 1 36 36 LEU N N 36 117.600 117.600 119.558 -1.958 18016
8244 1 15 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.225 -0.105 18016
8245 1 15 . 1 1 36 36 LEU C C 36 180.100 180.100 179.462 0.638 18016
8246 1 15 . 1 1 36 36 LEU CA C 36 58.200 58.200 58.044 0.156 18016
8247 1 15 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.547 1.253 18016
8248 1 15 . 1 1 36 36 LEU H H 36 7.850 7.850 8.179 -0.329 18016
8249 1 15 . 1 1 37 37 LEU N N 37 116.700 116.700 119.256 -2.556 18016
8250 1 15 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.083 0.017 18016
8251 1 15 . 1 1 37 37 LEU C C 37 180.100 180.100 179.307 0.793 18016
8252 1 15 . 1 1 37 37 LEU CA C 37 58.300 58.300 57.963 0.337 18016
8253 1 15 . 1 1 37 37 LEU CB C 37 42.200 42.200 40.875 1.325 18016
8254 1 15 . 1 1 37 37 LEU H H 37 8.730 8.730 8.445 0.285 18016
8255 1 15 . 1 1 38 38 THR N N 38 110.600 110.600 108.831 1.769 18016
8256 1 15 . 1 1 38 38 THR HA H 38 4.440 4.440 4.124 0.316 18016
8257 1 15 . 1 1 38 38 THR C C 38 175.100 175.100 176.829 -1.729 18016
8258 1 15 . 1 1 38 38 THR CA C 38 64.200 64.200 64.537 -0.337 18016
8259 1 15 . 1 1 38 38 THR CB C 38 70.000 70.000 68.531 1.469 18016
8260 1 15 . 1 1 38 38 THR H H 38 8.660 8.660 8.542 0.118 18016
8261 1 15 . 1 1 39 39 ARG N N 39 118.000 118.000 121.844 -3.844 18016
8262 1 15 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.155 0.125 18016
8263 1 15 . 1 1 39 39 ARG C C 39 177.300 177.300 177.628 -0.328 18016
8264 1 15 . 1 1 39 39 ARG CA C 39 58.300 58.300 57.881 0.419 18016
8265 1 15 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.946 0.254 18016
8266 1 15 . 1 1 39 39 ARG H H 39 7.180 7.180 7.701 -0.521 18016
8267 1 15 . 1 1 40 40 ARG N N 40 114.400 114.400 120.060 -5.660 18016
8268 1 15 . 1 1 40 40 ARG C C 40 174.800 174.800 174.123 0.677 18016
8269 1 15 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.465 -0.165 18016
8270 1 15 . 1 1 40 40 ARG CB C 40 34.600 34.600 30.374 4.226 18016
8271 1 15 . 1 1 40 40 ARG H H 40 7.520 7.520 7.801 -0.281 18016
8272 1 15 . 1 1 41 41 LEU N N 41 119.400 119.400 121.217 -1.817 18016
8273 1 15 . 1 1 41 41 LEU C C 41 177.100 177.100 175.989 1.111 18016
8274 1 15 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.670 -0.970 18016
8275 1 15 . 1 1 41 41 LEU CB C 41 44.400 44.400 46.089 -1.689 18016
8276 1 15 . 1 1 41 41 LEU H H 41 8.380 8.380 8.051 0.329 18016
8277 1 15 . 1 1 42 42 THR N N 42 112.000 112.000 115.191 -3.191 18016
8278 1 15 . 1 1 42 42 THR HA H 42 4.440 4.440 4.639 -0.199 18016
8279 1 15 . 1 1 42 42 THR C C 42 175.800 175.800 175.037 0.763 18016
8280 1 15 . 1 1 42 42 THR CA C 42 60.500 60.500 60.441 0.059 18016
8281 1 15 . 1 1 42 42 THR CB C 42 70.800 70.800 70.751 0.049 18016
8282 1 15 . 1 1 42 42 THR H H 42 9.330 9.330 8.411 0.919 18016
8283 1 15 . 1 1 43 43 ASN N N 43 119.900 119.900 119.962 -0.062 18016
8284 1 15 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.386 -0.136 18016
8285 1 15 . 1 1 43 43 ASN C C 43 177.900 177.900 177.279 0.621 18016
8286 1 15 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.884 -0.184 18016
8287 1 15 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.176 -0.976 18016
8288 1 15 . 1 1 43 43 ASN H H 43 9.140 9.140 8.840 0.300 18016
8289 1 15 . 1 1 44 44 ASP N N 44 118.000 118.000 120.017 -2.017 18016
8290 1 15 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.382 0.018 18016
8291 1 15 . 1 1 44 44 ASP C C 44 179.600 179.600 178.476 1.124 18016
8292 1 15 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.280 0.020 18016
8293 1 15 . 1 1 44 44 ASP H H 44 8.360 8.360 8.749 -0.389 18016
8294 1 15 . 1 1 45 45 GLU N N 45 122.600 122.600 120.334 2.266 18016
8295 1 15 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.088 -0.118 18016
8296 1 15 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.230 0.171 18016
8297 1 15 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.815 0.485 18016
8298 1 15 . 1 1 45 45 GLU H H 45 7.850 7.850 7.692 0.158 18016
8299 1 15 . 1 1 46 46 ILE N N 46 118.900 118.900 120.629 -1.729 18016
8300 1 15 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.742 -0.312 18016
8301 1 15 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.248 1.752 18016
8302 1 15 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.766 -0.066 18016
8303 1 15 . 1 1 46 46 ILE H H 46 8.290 8.290 8.257 0.033 18016
8304 1 15 . 1 1 47 47 LYS N N 47 118.900 118.900 119.514 -0.614 18016
8305 1 15 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.925 -0.055 18016
8306 1 15 . 1 1 47 47 LYS C C 47 178.400 178.400 178.819 -0.419 18016
8307 1 15 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.824 0.476 18016
8308 1 15 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.218 0.382 18016
8309 1 15 . 1 1 47 47 LYS H H 47 8.290 8.290 8.176 0.114 18016
8310 1 15 . 1 1 48 48 ALA N N 48 121.100 121.100 123.029 -1.929 18016
8311 1 15 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.957 0.213 18016
8312 1 15 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.316 -0.215 18016
8313 1 15 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.214 -0.214 18016
8314 1 15 . 1 1 48 48 ALA H H 48 7.710 7.710 8.089 -0.379 18016
8315 1 15 . 1 1 49 49 ILE N N 49 119.900 119.900 117.875 2.025 18016
8316 1 15 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.734 -0.084 18016
8317 1 15 . 1 1 49 49 ILE C C 49 177.300 177.300 178.148 -0.848 18016
8318 1 15 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.506 1.494 18016
8319 1 15 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.513 1.587 18016
8320 1 15 . 1 1 49 49 ILE H H 49 8.130 8.130 8.296 -0.166 18016
8321 1 15 . 1 1 50 50 ALA N N 50 122.000 122.000 122.463 -0.463 18016
8322 1 15 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.034 -0.174 18016
8323 1 15 . 1 1 50 50 ALA C C 50 179.800 179.800 179.836 -0.036 18016
8324 1 15 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.356 0.344 18016
8325 1 15 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.129 -0.229 18016
8326 1 15 . 1 1 50 50 ALA H H 50 8.730 8.730 7.490 1.240 18016
8327 1 15 . 1 1 51 51 GLU N N 51 116.900 116.900 118.691 -1.791 18016
8328 1 15 . 1 1 51 51 GLU HA H 51 4.020 4.020 3.966 0.054 18016
8329 1 15 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.820 -0.420 18016
8330 1 15 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.137 0.363 18016
8331 1 15 . 1 1 51 51 GLU H H 51 8.220 8.220 8.319 -0.099 18016
8332 1 15 . 1 1 52 52 ASP N N 52 120.300 120.300 119.925 0.375 18016
8333 1 15 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.460 -0.070 18016
8334 1 15 . 1 1 52 52 ASP C C 52 178.900 178.900 178.761 0.139 18016
8335 1 15 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.071 0.429 18016
8336 1 15 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.160 1.340 18016
8337 1 15 . 1 1 52 52 ASP H H 52 7.700 7.700 7.988 -0.288 18016
8338 1 15 . 1 1 53 53 LEU N N 53 118.300 118.300 120.130 -1.830 18016
8339 1 15 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.942 -0.212 18016
8340 1 15 . 1 1 53 53 LEU C C 53 179.000 179.000 179.062 -0.062 18016
8341 1 15 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.685 -0.185 18016
8342 1 15 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.851 -0.751 18016
8343 1 15 . 1 1 53 53 LEU H H 53 8.290 8.290 7.589 0.701 18016
8344 1 15 . 1 1 54 54 GLU N N 54 118.700 118.700 118.943 -0.243 18016
8345 1 15 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.836 0.384 18016
8346 1 15 . 1 1 54 54 GLU C C 54 178.200 178.200 177.246 0.954 18016
8347 1 15 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.515 0.185 18016
8348 1 15 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.215 0.685 18016
8349 1 15 . 1 1 54 54 GLU H H 54 8.070 8.070 8.432 -0.362 18016
8350 1 15 . 1 1 55 55 LYS N N 55 117.700 117.700 117.267 0.433 18016
8351 1 15 . 1 1 55 55 LYS HA H 55 4.150 4.150 3.980 0.170 18016
8352 1 15 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.534 -0.234 18016
8353 1 15 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.466 0.234 18016
8354 1 15 . 1 1 55 55 LYS H H 55 7.750 7.750 7.371 0.379 18016
8355 1 15 . 1 1 56 56 ARG N N 56 117.100 117.100 117.331 -0.231 18016
8356 1 15 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.175 0.095 18016
8357 1 15 . 1 1 56 56 ARG CA C 56 56.800 56.800 58.004 -1.204 18016
8358 1 15 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.407 -0.407 18016
8359 1 15 . 1 1 56 56 ARG H H 56 8.270 8.270 7.333 0.937 18016
8360 1 15 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.472 -0.112 18016
8361 1 15 . 1 1 57 57 ALA CA C 57 52.100 52.100 51.926 0.174 18016
8362 1 15 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.858 -1.658 18016
8363 1 15 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.575 -0.065 18016
8364 1 15 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.987 0.213 18016
8365 1 15 . 1 1 58 58 HIS CB C 58 27.300 27.300 28.234 -0.934 18016
8366 1 15 . 1 1 59 59 PHE N N 59 120.400 120.400 124.854 -4.454 18016
8367 1 15 . 1 1 59 59 PHE C C 59 175.500 175.500 175.450 0.050 18016
8368 1 15 . 1 1 59 59 PHE CA C 59 57.200 57.200 56.896 0.304 18016
8369 1 15 . 1 1 59 59 PHE CB C 59 39.300 39.300 37.671 1.629 18016
8370 1 15 . 1 1 59 59 PHE H H 59 7.710 7.710 8.265 -0.555 18016
8371 1 15 . 1 1 60 60 ASP N N 60 120.800 120.800 121.239 -0.439 18016
8372 1 15 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.708 -0.218 18016
8373 1 15 . 1 1 60 60 ASP CA C 60 54.300 54.300 54.637 -0.337 18016
8374 1 15 . 1 1 60 60 ASP CB C 60 41.100 41.100 39.302 1.798 18016
8375 1 15 . 1 1 60 60 ASP H H 60 8.180 8.180 8.499 -0.319 18016
8376 1 15 . 1 1 61 61 HIS N N 61 118.300 118.300 116.684 1.616 18016
8377 1 15 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.741 -0.351 18016
8378 1 15 . 1 1 61 61 HIS CA C 61 56.700 56.700 57.232 -0.532 18016
8379 1 15 . 1 1 61 61 HIS CB C 61 28.800 28.800 32.939 -4.139 18016
8380 1 15 . 1 1 61 61 HIS H H 61 8.550 8.550 8.261 0.289 18016
8381 1 15 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.388 -0.379 18016
8382 1 15 . 1 1 62 62 ILE C C 62 173.800 173.800 174.287 -0.487 18016
8383 1 15 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.439 6.061 18016
8384 1 15 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.229 1.871 18016
8385 1 15 . 1 1 63 63 ASP N N 63 125.100 125.100 121.563 3.537 18016
8386 1 15 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.399 0.201 18016
8387 1 15 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.483 -2.683 18016
8388 1 15 . 1 1 63 63 ASP CB C 63 40.500 40.500 40.953 -0.453 18016
8389 1 15 . 1 1 63 63 ASP H H 63 8.360 8.360 7.898 0.462 18016
8390 1 15 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.814 -0.144 18016
8391 1 15 . 1 1 64 64 ILE C C 64 177.000 177.000 177.154 -0.154 18016
8392 1 15 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.607 -1.507 18016
8393 1 15 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.556 -1.956 18016
8394 1 15 . 1 1 65 65 GLY N N 65 107.600 107.600 106.534 1.066 18016
8395 1 15 . 1 1 65 65 GLY C C 65 177.000 177.000 176.430 0.570 18016
8396 1 15 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.715 0.585 18016
8397 1 15 . 1 1 65 65 GLY H H 65 8.440 8.440 8.285 0.155 18016
8398 1 15 . 1 1 66 66 VAL N N 66 121.800 121.800 122.951 -1.151 18016
8399 1 15 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.699 0.061 18016
8400 1 15 . 1 1 66 66 VAL C C 66 178.500 178.500 177.198 1.302 18016
8401 1 15 . 1 1 66 66 VAL CA C 66 65.600 65.600 64.516 1.084 18016
8402 1 15 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.996 0.004 18016
8403 1 15 . 1 1 66 66 VAL H H 66 7.550 7.550 7.419 0.131 18016
8404 1 15 . 1 1 67 67 LEU N N 67 120.900 120.900 119.456 1.444 18016
8405 1 15 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.004 0.066 18016
8406 1 15 . 1 1 67 67 LEU C C 67 179.000 179.000 179.152 -0.152 18016
8407 1 15 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.760 -0.160 18016
8408 1 15 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.379 1.921 18016
8409 1 15 . 1 1 67 67 LEU H H 67 7.650 7.650 7.502 0.148 18016
8410 1 15 . 1 1 68 68 ILE N N 68 118.900 118.900 117.870 1.030 18016
8411 1 15 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.787 -0.077 18016
8412 1 15 . 1 1 68 68 ILE C C 68 179.500 179.500 178.364 1.136 18016
8413 1 15 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.830 0.370 18016
8414 1 15 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.509 -0.009 18016
8415 1 15 . 1 1 68 68 ILE H H 68 8.580 8.580 7.636 0.944 18016
8416 1 15 . 1 1 69 69 THR N N 69 118.100 118.100 114.645 3.455 18016
8417 1 15 . 1 1 69 69 THR HA H 69 3.940 3.940 4.069 -0.129 18016
8418 1 15 . 1 1 69 69 THR C C 69 176.200 176.200 176.067 0.133 18016
8419 1 15 . 1 1 69 69 THR CA C 69 66.600 66.600 66.273 0.327 18016
8420 1 15 . 1 1 69 69 THR CB C 69 68.500 68.500 68.416 0.084 18016
8421 1 15 . 1 1 69 69 THR H H 69 7.840 7.840 7.809 0.031 18016
8422 1 15 . 1 1 70 70 GLN N N 70 121.600 121.600 120.995 0.605 18016
8423 1 15 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.121 -0.011 18016
8424 1 15 . 1 1 70 70 GLN C C 70 178.100 178.100 178.070 0.030 18016
8425 1 15 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.675 0.425 18016
8426 1 15 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.703 -0.403 18016
8427 1 15 . 1 1 70 70 GLN H H 70 8.100 8.100 7.547 0.553 18016
8428 1 15 . 1 1 71 71 MET N N 71 118.700 118.700 117.840 0.860 18016
8429 1 15 . 1 1 71 71 MET HA H 71 4.010 4.010 4.338 -0.328 18016
8430 1 15 . 1 1 71 71 MET C C 71 176.300 176.300 178.222 -1.922 18016
8431 1 15 . 1 1 71 71 MET CA C 71 58.100 58.100 58.919 -0.819 18016
8432 1 15 . 1 1 71 71 MET CB C 71 33.600 33.600 32.741 0.859 18016
8433 1 15 . 1 1 71 71 MET H H 71 8.350 8.350 8.267 0.083 18016
8434 1 15 . 1 1 72 72 THR N N 72 111.600 111.600 111.449 0.151 18016
8435 1 15 . 1 1 72 72 THR HA H 72 3.940 3.940 4.140 -0.200 18016
8436 1 15 . 1 1 72 72 THR C C 72 175.800 175.800 175.528 0.272 18016
8437 1 15 . 1 1 72 72 THR CA C 72 65.300 65.300 64.809 0.491 18016
8438 1 15 . 1 1 72 72 THR CB C 72 69.100 69.100 69.208 -0.108 18016
8439 1 15 . 1 1 72 72 THR H H 72 7.840 7.840 7.601 0.239 18016
8440 1 15 . 1 1 73 73 ASP N N 73 121.100 121.100 119.898 1.202 18016
8441 1 15 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.689 -0.159 18016
8442 1 15 . 1 1 73 73 ASP C C 73 176.600 176.600 175.756 0.844 18016
8443 1 15 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.404 0.796 18016
8444 1 15 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.486 -1.086 18016
8445 1 15 . 1 1 73 73 ASP H H 73 7.840 7.840 7.694 0.146 18016
8446 1 15 . 1 1 74 74 GLU N N 74 121.100 121.100 119.338 1.762 18016
8447 1 15 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.591 -0.251 18016
8448 1 15 . 1 1 74 74 GLU C C 74 173.800 173.800 175.124 -1.324 18016
8449 1 15 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.528 -0.028 18016
8450 1 15 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.361 -0.761 18016
8451 1 15 . 1 1 74 74 GLU H H 74 7.980 7.980 8.493 -0.513 18016
8452 1 15 . 1 1 75 75 MET N N 75 125.800 125.800 125.732 0.068 18016
8453 1 15 . 1 1 75 75 MET HA H 75 4.710 4.710 4.850 -0.140 18016
8454 1 15 . 1 1 75 75 MET CA C 75 53.800 53.800 54.423 -0.623 18016
8455 1 15 . 1 1 75 75 MET CB C 75 31.700 31.700 31.745 -0.045 18016
8456 1 15 . 1 1 75 75 MET H H 75 8.380 8.380 8.545 -0.165 18016
8457 1 15 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.425 0.085 18016
8458 1 15 . 1 1 76 76 PRO C C 76 175.700 175.700 176.540 -0.840 18016
8459 1 15 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.433 -1.433 18016
8460 1 15 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.187 -0.387 18016
8461 1 15 . 1 1 77 77 ARG N N 77 119.700 119.700 118.680 1.020 18016
8462 1 15 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.661 -0.391 18016
8463 1 15 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.800 1.000 18016
8464 1 15 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.683 -1.983 18016
8465 1 15 . 1 1 77 77 ARG H H 77 8.940 8.940 7.973 0.967 18016
8466 1 15 . 1 1 78 78 GLU N N 78 124.700 124.700 124.739 -0.039 18016
8467 1 15 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.995 -0.035 18016
8468 1 15 . 1 1 78 78 GLU C C 78 179.000 179.000 178.266 0.734 18016
8469 1 15 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.756 0.044 18016
8470 1 15 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.695 -0.695 18016
8471 1 15 . 1 1 78 78 GLU H H 78 9.170 9.170 8.991 0.179 18016
8472 1 15 . 1 1 79 79 GLU N N 79 116.800 116.800 120.396 -3.596 18016
8473 1 15 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.082 0.038 18016
8474 1 15 . 1 1 79 79 GLU C C 79 179.100 179.100 178.566 0.534 18016
8475 1 15 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.748 -0.048 18016
8476 1 15 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.278 -0.278 18016
8477 1 15 . 1 1 79 79 GLU H H 79 9.660 9.660 8.728 0.932 18016
8478 1 15 . 1 1 80 80 ASP N N 80 120.000 120.000 117.997 2.003 18016
8479 1 15 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.446 0.244 18016
8480 1 15 . 1 1 80 80 ASP C C 80 177.300 177.300 178.745 -1.445 18016
8481 1 15 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.591 -0.191 18016
8482 1 15 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.591 1.009 18016
8483 1 15 . 1 1 80 80 ASP H H 80 7.310 7.310 8.348 -1.038 18016
8484 1 15 . 1 1 81 81 ILE N N 81 120.100 120.100 119.617 0.483 18016
8485 1 15 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.724 -0.234 18016
8486 1 15 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.706 0.594 18016
8487 1 15 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.973 0.327 18016
8488 1 15 . 1 1 81 81 ILE H H 81 7.610 7.610 8.104 -0.494 18016
8489 1 15 . 1 1 82 82 GLU N N 82 118.100 118.100 120.240 -2.140 18016
8490 1 15 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.065 0.215 18016
8491 1 15 . 1 1 82 82 GLU C C 82 177.800 177.800 178.678 -0.878 18016
8492 1 15 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.399 -1.399 18016
8493 1 15 . 1 1 82 82 GLU CB C 82 28.800 28.800 28.892 -0.092 18016
8494 1 15 . 1 1 82 82 GLU H H 82 8.550 8.550 8.534 0.016 18016
8495 1 15 . 1 1 83 83 ARG N N 83 119.900 119.900 120.463 -0.563 18016
8496 1 15 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.100 -0.070 18016
8497 1 15 . 1 1 83 83 ARG C C 83 179.400 179.400 178.742 0.658 18016
8498 1 15 . 1 1 83 83 ARG CA C 83 59.900 59.900 58.961 0.939 18016
8499 1 15 . 1 1 83 83 ARG CB C 83 29.600 29.600 29.906 -0.306 18016
8500 1 15 . 1 1 83 83 ARG H H 83 7.590 7.590 8.099 -0.509 18016
8501 1 15 . 1 1 84 84 VAL N N 84 120.400 120.400 119.607 0.793 18016
8502 1 15 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.818 -0.068 18016
8503 1 15 . 1 1 84 84 VAL C C 84 177.400 177.400 177.501 -0.101 18016
8504 1 15 . 1 1 84 84 VAL CA C 84 66.900 66.900 66.020 0.880 18016
8505 1 15 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.890 0.010 18016
8506 1 15 . 1 1 84 84 VAL H H 84 7.550 7.550 8.348 -0.798 18016
8507 1 15 . 1 1 85 85 ARG N N 85 121.600 121.600 119.582 2.018 18016
8508 1 15 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.248 -0.238 18016
8509 1 15 . 1 1 85 85 ARG C C 85 178.100 178.100 178.903 -0.803 18016
8510 1 15 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.868 1.032 18016
8511 1 15 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.890 0.310 18016
8512 1 15 . 1 1 85 85 ARG H H 85 9.090 9.090 8.464 0.626 18016
8513 1 15 . 1 1 86 86 ARG N N 86 115.600 115.600 118.972 -3.372 18016
8514 1 15 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.079 -0.199 18016
8515 1 15 . 1 1 86 86 ARG C C 86 179.000 179.000 178.583 0.417 18016
8516 1 15 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.089 0.312 18016
8517 1 15 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.494 0.906 18016
8518 1 15 . 1 1 86 86 ARG H H 86 8.660 8.660 8.486 0.174 18016
8519 1 15 . 1 1 87 87 HIS N N 87 118.000 118.000 120.117 -2.117 18016
8520 1 15 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.306 0.054 18016
8521 1 15 . 1 1 87 87 HIS C C 87 178.400 178.400 177.646 0.754 18016
8522 1 15 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.603 -0.003 18016
8523 1 15 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.030 0.669 18016
8524 1 15 . 1 1 87 87 HIS H H 87 7.640 7.640 7.882 -0.242 18016
8525 1 15 . 1 1 88 88 LEU N N 88 119.600 119.600 118.918 0.682 18016
8526 1 15 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.132 -0.552 18016
8527 1 15 . 1 1 88 88 LEU C C 88 180.000 180.000 179.008 0.992 18016
8528 1 15 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.149 0.051 18016
8529 1 15 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.186 1.414 18016
8530 1 15 . 1 1 88 88 LEU H H 88 8.650 8.650 8.686 -0.036 18016
8531 1 15 . 1 1 89 89 ALA N N 89 118.500 118.500 122.646 -4.146 18016
8532 1 15 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.763 0.597 18016
8533 1 15 . 1 1 89 89 ALA C C 89 180.400 180.400 180.042 0.358 18016
8534 1 15 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.696 -1.096 18016
8535 1 15 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.434 -0.334 18016
8536 1 15 . 1 1 89 89 ALA H H 89 8.870 8.870 8.327 0.543 18016
8537 1 15 . 1 1 90 90 LEU N N 90 119.400 119.400 117.788 1.612 18016
8538 1 15 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.935 0.275 18016
8539 1 15 . 1 1 90 90 LEU C C 90 179.100 179.100 179.242 -0.142 18016
8540 1 15 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.177 0.323 18016
8541 1 15 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.639 0.061 18016
8542 1 15 . 1 1 90 90 LEU H H 90 7.390 7.390 7.623 -0.233 18016
8543 1 15 . 1 1 91 91 GLN N N 91 114.500 114.500 116.586 -2.086 18016
8544 1 15 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.243 0.457 18016
8545 1 15 . 1 1 91 91 GLN C C 91 175.800 175.800 177.059 -1.259 18016
8546 1 15 . 1 1 91 91 GLN CA C 91 54.500 54.500 57.079 -2.579 18016
8547 1 15 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.901 -1.802 18016
8548 1 15 . 1 1 91 91 GLN H H 91 7.810 7.810 7.753 0.057 18016
8549 1 15 . 1 1 92 92 GLY N N 92 107.900 107.900 105.111 2.789 18016
8550 1 15 . 1 1 92 92 GLY C C 92 172.100 172.100 172.079 0.021 18016
8551 1 15 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.459 -1.459 18016
8552 1 15 . 1 1 92 92 GLY H H 92 7.710 7.710 8.311 -0.601 18016
8553 1 15 . 1 1 93 93 TRP N N 93 114.200 114.200 121.351 -7.151 18016
8554 1 15 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.784 1.216 18016
8555 1 15 . 1 1 93 93 TRP CB C 93 29.200 29.200 31.979 -2.779 18016
8556 1 15 . 1 1 93 93 TRP H H 93 8.450 8.450 8.569 -0.119 18016
8557 1 15 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.217 0.243 18016
8558 1 15 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.690 -0.890 18016
8559 1 15 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.259 0.341 18016
8560 1 15 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.174 -0.674 18016
8561 1 15 . 1 1 95 95 LEU C C 95 175.000 175.000 177.557 -2.557 18016
8562 1 15 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.352 -0.252 18016
8563 1 15 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.705 1.395 18016
8564 1 15 . 1 1 96 96 ASP N N 96 114.000 114.000 118.889 -4.889 18016
8565 1 15 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.748 0.202 18016
8566 1 15 . 1 1 96 96 ASP C C 96 175.800 175.800 175.537 0.263 18016
8567 1 15 . 1 1 96 96 ASP CA C 96 54.000 54.000 54.349 -0.349 18016
8568 1 15 . 1 1 96 96 ASP CB C 96 41.900 41.900 42.190 -0.290 18016
8569 1 15 . 1 1 96 96 ASP H H 96 7.230 7.230 7.573 -0.343 18016
8570 1 15 . 1 1 97 97 ASP N N 97 123.200 123.200 121.420 1.780 18016
8571 1 15 . 1 1 97 97 ASP HA H 97 4.610 4.610 5.148 -0.538 18016
8572 1 15 . 1 1 97 97 ASP CA C 97 53.500 53.500 52.171 1.329 18016
8573 1 15 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.476 -3.776 18016
8574 1 15 . 1 1 97 97 ASP H H 97 7.420 7.420 7.717 -0.297 18016
8575 1 15 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.669 -0.379 18016
8576 1 15 . 1 1 98 98 PRO C C 98 177.500 177.500 176.244 1.256 18016
8577 1 15 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.665 0.035 18016
8578 1 15 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.113 -1.213 18016
8579 1 15 . 1 1 99 99 ARG N N 99 121.300 121.300 122.595 -1.295 18016
8580 1 15 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.491 -0.781 18016
8581 1 15 . 1 1 99 99 ARG C C 99 176.500 176.500 175.702 0.798 18016
8582 1 15 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.077 -0.977 18016
8583 1 15 . 1 1 99 99 ARG CB C 99 30.500 30.500 31.750 -1.250 18016
8584 1 15 . 1 1 99 99 ARG H H 99 8.390 8.390 8.570 -0.180 18016
8585 1 15 . 1 1 100 100 ASP N N 100 119.600 119.600 118.421 1.179 18016
8586 1 15 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.752 -0.252 18016
8587 1 15 . 1 1 100 100 ASP C C 100 177.000 177.000 175.656 1.344 18016
8588 1 15 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.821 0.879 18016
8589 1 15 . 1 1 100 100 ASP CB C 100 40.900 40.900 41.840 -0.940 18016
8590 1 15 . 1 1 100 100 ASP H H 100 8.260 8.260 7.843 0.417 18016
8591 1 15 . 1 1 101 101 GLY N N 101 109.300 109.300 109.132 0.168 18016
8592 1 15 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.234 1.166 18016
8593 1 15 . 1 1 101 101 GLY H H 101 8.450 8.450 7.836 0.614 18016
8594 1 15 . 1 1 102 102 GLU N N 102 119.800 119.800 121.641 -1.841 18016
8595 1 15 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.162 0.148 18016
8596 1 15 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.212 -0.213 18016
8597 1 15 . 1 1 102 102 GLU CB C 102 30.500 30.500 29.292 1.208 18016
8598 1 15 . 1 1 102 102 GLU H H 102 8.140 8.140 7.823 0.317 18016
8599 1 15 . 1 1 103 103 GLU N N 103 123.000 123.000 126.583 -3.583 18016
8600 1 15 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.405 0.155 18016
8601 1 15 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.556 -0.256 18016
8602 1 15 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.503 0.097 18016
8603 1 15 . 1 1 103 103 GLU H H 103 8.580 8.580 8.317 0.263 18016
8604 1 15 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.351 0.129 18016
8605 1 15 . 1 1 104 104 PRO C C 104 176.800 176.800 176.088 0.712 18016
8606 1 15 . 1 1 104 104 PRO CA C 104 63.400 63.400 62.745 0.655 18016
8607 1 15 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.402 -0.302 18016
8608 1 15 . 1 1 105 105 ASP N N 105 120.400 120.400 121.524 -1.124 18016
8609 1 15 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.428 0.152 18016
8610 1 15 . 1 1 105 105 ASP C C 105 177.100 177.100 176.560 0.540 18016
8611 1 15 . 1 1 105 105 ASP CA C 105 54.300 54.300 55.173 -0.873 18016
8612 1 15 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.229 0.171 18016
8613 1 15 . 1 1 105 105 ASP H H 105 8.500 8.500 8.451 0.049 18016
8614 1 15 . 1 1 106 106 GLY N N 106 109.300 109.300 112.097 -2.797 18016
8615 1 15 . 1 1 106 106 GLY C C 106 174.600 174.600 172.942 1.658 18016
8616 1 15 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.025 0.375 18016
8617 1 15 . 1 1 106 106 GLY H H 106 8.360 8.360 8.175 0.185 18016
8618 1 15 . 1 1 107 107 GLU N N 107 120.400 120.400 120.287 0.113 18016
8619 1 15 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.574 -0.234 18016
8620 1 15 . 1 1 107 107 GLU C C 107 177.100 177.100 176.212 0.888 18016
8621 1 15 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.304 0.196 18016
8622 1 15 . 1 1 107 107 GLU CB C 107 30.200 30.200 31.018 -0.818 18016
8623 1 15 . 1 1 107 107 GLU H H 107 8.410 8.410 8.577 -0.167 18016
8624 1 15 . 1 1 108 108 SER N N 108 116.600 116.600 121.671 -5.071 18016
8625 1 15 . 1 1 108 108 SER HA H 108 4.450 4.450 4.517 -0.067 18016
8626 1 15 . 1 1 108 108 SER C C 108 175.300 175.300 175.206 0.094 18016
8627 1 15 . 1 1 108 108 SER CA C 108 58.700 58.700 58.075 0.625 18016
8628 1 15 . 1 1 108 108 SER CB C 108 63.800 63.800 62.803 0.997 18016
8629 1 15 . 1 1 108 108 SER H H 108 8.460 8.460 8.786 -0.326 18016
8630 1 15 . 1 1 109 109 GLY N N 109 110.800 110.800 113.111 -2.311 18016
8631 1 15 . 1 1 109 109 GLY C C 109 174.500 174.500 173.898 0.602 18016
8632 1 15 . 1 1 109 109 GLY CA C 109 45.300 45.300 44.927 0.373 18016
8633 1 15 . 1 1 109 109 GLY H H 109 8.500 8.500 8.394 0.106 18016
8634 1 15 . 1 1 110 110 GLY N N 110 108.800 108.800 111.078 -2.278 18016
8635 1 15 . 1 1 110 110 GLY CA C 110 44.400 44.400 45.398 -0.997 18016
8636 1 15 . 1 1 110 110 GLY H H 110 8.140 8.140 7.501 0.639 18016
8637 1 15 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.558 0.052 18016
8638 1 15 . 1 1 111 111 PRO C C 111 176.000 176.000 176.173 -0.173 18016
8639 1 15 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.445 -0.845 18016
8640 1 15 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.374 2.226 18016
8641 1 16 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.713 -0.283 18016
8642 1 16 . 1 1 2 2 PRO C C 2 177.600 177.600 176.737 0.863 18016
8643 1 16 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.502 0.798 18016
8644 1 16 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.706 -0.407 18016
8645 1 16 . 1 1 3 3 GLY N N 3 110.000 110.000 106.918 3.082 18016
8646 1 16 . 1 1 3 3 GLY C C 3 174.200 174.200 173.226 0.974 18016
8647 1 16 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.152 0.248 18016
8648 1 16 . 1 1 3 3 GLY H H 3 8.700 8.700 8.138 0.562 18016
8649 1 16 . 1 1 4 4 SER N N 4 115.400 115.400 115.766 -0.366 18016
8650 1 16 . 1 1 4 4 SER HA H 4 4.440 4.440 4.158 0.282 18016
8651 1 16 . 1 1 4 4 SER C C 4 174.800 174.800 175.359 -0.559 18016
8652 1 16 . 1 1 4 4 SER CA C 4 58.400 58.400 59.209 -0.809 18016
8653 1 16 . 1 1 4 4 SER CB C 4 63.800 63.800 62.308 1.492 18016
8654 1 16 . 1 1 4 4 SER H H 4 8.210 8.210 8.576 -0.366 18016
8655 1 16 . 1 1 5 5 MET N N 5 122.200 122.200 115.608 6.592 18016
8656 1 16 . 1 1 5 5 MET HA H 5 4.510 4.510 4.257 0.253 18016
8657 1 16 . 1 1 5 5 MET CA C 5 55.600 55.600 57.657 -2.057 18016
8658 1 16 . 1 1 5 5 MET CB C 5 32.900 32.900 32.845 0.055 18016
8659 1 16 . 1 1 5 5 MET H H 5 8.570 8.570 7.961 0.609 18016
8660 1 16 . 1 1 6 6 VAL N N 6 120.000 120.000 115.602 4.398 18016
8661 1 16 . 1 1 6 6 VAL HA H 6 4.050 4.050 3.977 0.073 18016
8662 1 16 . 1 1 6 6 VAL C C 6 175.700 175.700 175.873 -0.173 18016
8663 1 16 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.871 0.829 18016
8664 1 16 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.194 0.306 18016
8665 1 16 . 1 1 6 6 VAL H H 6 8.150 8.150 7.437 0.713 18016
8666 1 16 . 1 1 7 7 ASN N N 7 122.000 122.000 118.232 3.768 18016
8667 1 16 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.574 0.086 18016
8668 1 16 . 1 1 7 7 ASN C C 7 175.200 175.200 176.930 -1.730 18016
8669 1 16 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.034 -0.834 18016
8670 1 16 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.581 -0.681 18016
8671 1 16 . 1 1 7 7 ASN H H 7 8.010 8.010 8.280 -0.270 18016
8672 1 16 . 1 1 8 8 ALA N N 8 126.500 126.500 124.787 1.713 18016
8673 1 16 . 1 1 8 8 ALA C C 8 180.200 180.200 179.486 0.714 18016
8674 1 16 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.241 0.259 18016
8675 1 16 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.753 -0.353 18016
8676 1 16 . 1 1 8 8 ALA H H 8 9.020 9.020 8.686 0.334 18016
8677 1 16 . 1 1 9 9 PHE N N 9 121.300 121.300 119.447 1.853 18016
8678 1 16 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.082 0.208 18016
8679 1 16 . 1 1 9 9 PHE C C 9 177.200 177.200 177.309 -0.109 18016
8680 1 16 . 1 1 9 9 PHE CA C 9 61.300 61.300 62.109 -0.809 18016
8681 1 16 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.975 0.225 18016
8682 1 16 . 1 1 9 9 PHE H H 9 8.570 8.570 7.875 0.695 18016
8683 1 16 . 1 1 10 10 LEU N N 10 117.200 117.200 119.198 -1.998 18016
8684 1 16 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.085 -0.385 18016
8685 1 16 . 1 1 10 10 LEU C C 10 179.700 179.700 179.292 0.408 18016
8686 1 16 . 1 1 10 10 LEU CA C 10 57.600 57.600 58.019 -0.419 18016
8687 1 16 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.616 0.084 18016
8688 1 16 . 1 1 10 10 LEU H H 10 8.150 8.150 8.037 0.113 18016
8689 1 16 . 1 1 11 11 ALA N N 11 121.500 121.500 121.800 -0.300 18016
8690 1 16 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.935 0.085 18016
8691 1 16 . 1 1 11 11 ALA C C 11 180.900 180.900 179.529 1.371 18016
8692 1 16 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.484 -0.484 18016
8693 1 16 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.072 -0.072 18016
8694 1 16 . 1 1 11 11 ALA H H 11 8.460 8.460 8.621 -0.161 18016
8695 1 16 . 1 1 12 12 LYS N N 12 120.700 120.700 119.562 1.138 18016
8696 1 16 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.040 0.010 18016
8697 1 16 . 1 1 12 12 LYS C C 12 179.700 179.700 178.743 0.957 18016
8698 1 16 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.700 0.500 18016
8699 1 16 . 1 1 12 12 LYS CB C 12 31.600 31.600 31.884 -0.284 18016
8700 1 16 . 1 1 12 12 LYS H H 12 7.820 7.820 7.856 -0.036 18016
8701 1 16 . 1 1 13 13 ILE N N 13 120.100 120.100 119.461 0.639 18016
8702 1 16 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.848 -0.158 18016
8703 1 16 . 1 1 13 13 ILE C C 13 178.100 178.100 178.216 -0.116 18016
8704 1 16 . 1 1 13 13 ILE CA C 13 63.000 63.000 64.035 -1.035 18016
8705 1 16 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.698 -1.298 18016
8706 1 16 . 1 1 13 13 ILE H H 13 7.640 7.640 7.969 -0.329 18016
8707 1 16 . 1 1 14 14 ALA N N 14 122.700 122.700 122.242 0.458 18016
8708 1 16 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.990 -0.130 18016
8709 1 16 . 1 1 14 14 ALA C C 14 179.000 179.000 179.604 -0.604 18016
8710 1 16 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.473 0.527 18016
8711 1 16 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.065 -0.065 18016
8712 1 16 . 1 1 14 14 ALA H H 14 8.680 8.680 8.426 0.254 18016
8713 1 16 . 1 1 15 15 ALA N N 15 118.700 118.700 121.917 -3.217 18016
8714 1 16 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.071 0.019 18016
8715 1 16 . 1 1 15 15 ALA C C 15 180.400 180.400 178.905 1.495 18016
8716 1 16 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.788 0.212 18016
8717 1 16 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.453 -0.753 18016
8718 1 16 . 1 1 15 15 ALA H H 15 8.070 8.070 8.081 -0.011 18016
8719 1 16 . 1 1 16 16 TRP N N 16 122.900 122.900 121.342 1.558 18016
8720 1 16 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.258 0.302 18016
8721 1 16 . 1 1 16 16 TRP C C 16 178.400 178.400 178.019 0.381 18016
8722 1 16 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.368 -1.768 18016
8723 1 16 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.094 -0.794 18016
8724 1 16 . 1 1 16 16 TRP H H 16 7.820 7.820 8.299 -0.479 18016
8725 1 16 . 1 1 17 17 LEU N N 17 120.400 120.400 118.992 1.408 18016
8726 1 16 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.170 0.440 18016
8727 1 16 . 1 1 17 17 LEU C C 17 179.000 179.000 178.744 0.256 18016
8728 1 16 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.781 0.120 18016
8729 1 16 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.550 0.450 18016
8730 1 16 . 1 1 17 17 LEU H H 17 8.630 8.630 8.570 0.060 18016
8731 1 16 . 1 1 18 18 ASN N N 18 116.200 116.200 117.181 -0.981 18016
8732 1 16 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.572 -0.262 18016
8733 1 16 . 1 1 18 18 ASN C C 18 177.100 177.100 177.192 -0.092 18016
8734 1 16 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.833 -0.233 18016
8735 1 16 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.918 0.282 18016
8736 1 16 . 1 1 18 18 ASN H H 18 8.350 8.350 8.289 0.061 18016
8737 1 16 . 1 1 19 19 ALA N N 19 119.600 119.600 120.858 -1.258 18016
8738 1 16 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.257 -0.167 18016
8739 1 16 . 1 1 19 19 ALA C C 19 180.100 180.100 178.872 1.228 18016
8740 1 16 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.175 0.025 18016
8741 1 16 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.470 -0.870 18016
8742 1 16 . 1 1 19 19 ALA H H 19 7.920 7.920 8.210 -0.290 18016
8743 1 16 . 1 1 20 20 GLY N N 20 103.500 103.500 105.617 -2.117 18016
8744 1 16 . 1 1 20 20 GLY C C 20 173.800 173.800 173.651 0.149 18016
8745 1 16 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.195 0.605 18016
8746 1 16 . 1 1 20 20 GLY H H 20 7.700 7.700 7.327 0.373 18016
8747 1 16 . 1 1 21 21 TYR N N 21 119.900 119.900 118.251 1.649 18016
8748 1 16 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.867 0.303 18016
8749 1 16 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.360 1.040 18016
8750 1 16 . 1 1 21 21 TYR CB C 21 37.800 37.800 39.083 -1.283 18016
8751 1 16 . 1 1 21 21 TYR H H 21 7.980 7.980 7.999 -0.019 18016
8752 1 16 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.461 0.039 18016
8753 1 16 . 1 1 22 22 PRO C C 22 178.700 178.700 177.003 1.697 18016
8754 1 16 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.091 0.909 18016
8755 1 16 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.366 -0.366 18016
8756 1 16 . 1 1 23 23 GLU N N 23 116.300 116.300 116.677 -0.377 18016
8757 1 16 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.362 0.208 18016
8758 1 16 . 1 1 23 23 GLU C C 23 176.300 176.300 176.059 0.241 18016
8759 1 16 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.730 -1.130 18016
8760 1 16 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.564 -0.063 18016
8761 1 16 . 1 1 23 23 GLU H H 23 8.680 8.680 8.061 0.619 18016
8762 1 16 . 1 1 24 24 GLY N N 24 108.100 108.100 108.182 -0.082 18016
8763 1 16 . 1 1 24 24 GLY C C 24 173.100 173.100 172.889 0.211 18016
8764 1 16 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.310 -1.410 18016
8765 1 16 . 1 1 24 24 GLY H H 24 7.230 7.230 7.283 -0.053 18016
8766 1 16 . 1 1 25 25 VAL N N 25 121.500 121.500 120.730 0.770 18016
8767 1 16 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.803 -0.213 18016
8768 1 16 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.754 0.546 18016
8769 1 16 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.313 -0.213 18016
8770 1 16 . 1 1 25 25 VAL H H 25 8.050 8.050 8.079 -0.029 18016
8771 1 16 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.398 -0.078 18016
8772 1 16 . 1 1 26 26 PRO C C 26 177.600 177.600 177.879 -0.279 18016
8773 1 16 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.513 0.387 18016
8774 1 16 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.020 0.080 18016
8775 1 16 . 1 1 27 27 GLY N N 27 109.000 109.000 109.388 -0.388 18016
8776 1 16 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.608 1.492 18016
8777 1 16 . 1 1 27 27 GLY H H 27 8.930 8.930 8.814 0.116 18016
8778 1 16 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.275 0.115 18016
8779 1 16 . 1 1 28 28 PRO C C 28 175.800 175.800 176.194 -0.394 18016
8780 1 16 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.142 0.258 18016
8781 1 16 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.330 0.570 18016
8782 1 16 . 1 1 29 29 ASP N N 29 115.000 115.000 118.782 -3.782 18016
8783 1 16 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.801 -0.311 18016
8784 1 16 . 1 1 29 29 ASP C C 29 177.000 177.000 178.058 -1.058 18016
8785 1 16 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.922 -2.022 18016
8786 1 16 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.492 -0.792 18016
8787 1 16 . 1 1 29 29 ASP H H 29 7.760 7.760 7.885 -0.125 18016
8788 1 16 . 1 1 30 30 ARG N N 30 119.900 119.900 122.009 -2.109 18016
8789 1 16 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.941 -0.371 18016
8790 1 16 . 1 1 30 30 ARG C C 30 176.500 176.500 178.473 -1.973 18016
8791 1 16 . 1 1 30 30 ARG CA C 30 61.900 61.900 60.059 1.841 18016
8792 1 16 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.352 0.148 18016
8793 1 16 . 1 1 30 30 ARG H H 30 7.460 7.460 8.164 -0.704 18016
8794 1 16 . 1 1 31 31 VAL N N 31 117.600 117.600 119.796 -2.196 18016
8795 1 16 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.845 -0.025 18016
8796 1 16 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.563 0.137 18016
8797 1 16 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.370 -0.570 18016
8798 1 16 . 1 1 31 31 VAL H H 31 9.080 9.080 8.214 0.866 18016
8799 1 16 . 1 1 32 32 PRO C C 32 177.000 177.000 178.673 -1.673 18016
8800 1 16 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.885 -0.685 18016
8801 1 16 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.167 -0.367 18016
8802 1 16 . 1 1 33 33 LEU N N 33 115.200 115.200 121.048 -5.848 18016
8803 1 16 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.113 0.007 18016
8804 1 16 . 1 1 33 33 LEU C C 33 178.600 178.600 178.515 0.085 18016
8805 1 16 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.072 0.328 18016
8806 1 16 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.318 0.182 18016
8807 1 16 . 1 1 33 33 LEU H H 33 8.010 8.010 8.005 0.005 18016
8808 1 16 . 1 1 34 34 LEU N N 34 120.400 120.400 119.042 1.358 18016
8809 1 16 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.067 -0.137 18016
8810 1 16 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.565 0.535 18016
8811 1 16 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.219 0.681 18016
8812 1 16 . 1 1 34 34 LEU H H 34 8.220 8.220 8.330 -0.110 18016
8813 1 16 . 1 1 35 35 ALA N N 35 123.100 123.100 122.939 0.161 18016
8814 1 16 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.013 0.027 18016
8815 1 16 . 1 1 35 35 ALA C C 35 179.500 179.500 179.891 -0.391 18016
8816 1 16 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.254 0.246 18016
8817 1 16 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.294 -0.394 18016
8818 1 16 . 1 1 35 35 ALA H H 35 8.560 8.560 8.087 0.473 18016
8819 1 16 . 1 1 36 36 LEU N N 36 117.600 117.600 119.321 -1.721 18016
8820 1 16 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.291 -0.171 18016
8821 1 16 . 1 1 36 36 LEU C C 36 180.100 180.100 179.364 0.736 18016
8822 1 16 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.733 0.466 18016
8823 1 16 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.630 1.170 18016
8824 1 16 . 1 1 36 36 LEU H H 36 7.850 7.850 8.148 -0.298 18016
8825 1 16 . 1 1 37 37 LEU N N 37 116.700 116.700 120.327 -3.627 18016
8826 1 16 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.135 -0.035 18016
8827 1 16 . 1 1 37 37 LEU C C 37 180.100 180.100 178.833 1.267 18016
8828 1 16 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.175 0.125 18016
8829 1 16 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.635 0.565 18016
8830 1 16 . 1 1 37 37 LEU H H 37 8.730 8.730 8.387 0.343 18016
8831 1 16 . 1 1 38 38 THR N N 38 110.600 110.600 108.360 2.240 18016
8832 1 16 . 1 1 38 38 THR HA H 38 4.440 4.440 4.109 0.331 18016
8833 1 16 . 1 1 38 38 THR C C 38 175.100 175.100 175.832 -0.732 18016
8834 1 16 . 1 1 38 38 THR CA C 38 64.200 64.200 64.074 0.126 18016
8835 1 16 . 1 1 38 38 THR CB C 38 70.000 70.000 68.843 1.157 18016
8836 1 16 . 1 1 38 38 THR H H 38 8.660 8.660 8.316 0.344 18016
8837 1 16 . 1 1 39 39 ARG N N 39 118.000 118.000 120.397 -2.397 18016
8838 1 16 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.126 0.154 18016
8839 1 16 . 1 1 39 39 ARG C C 39 177.300 177.300 177.943 -0.643 18016
8840 1 16 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.492 -0.192 18016
8841 1 16 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.408 -0.208 18016
8842 1 16 . 1 1 39 39 ARG H H 39 7.180 7.180 7.516 -0.337 18016
8843 1 16 . 1 1 40 40 ARG N N 40 114.400 114.400 115.371 -0.971 18016
8844 1 16 . 1 1 40 40 ARG C C 40 174.800 174.800 175.727 -0.927 18016
8845 1 16 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.970 -0.670 18016
8846 1 16 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.342 3.258 18016
8847 1 16 . 1 1 40 40 ARG H H 40 7.520 7.520 7.673 -0.153 18016
8848 1 16 . 1 1 41 41 LEU N N 41 119.400 119.400 120.453 -1.053 18016
8849 1 16 . 1 1 41 41 LEU C C 41 177.100 177.100 177.131 -0.031 18016
8850 1 16 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.243 -0.543 18016
8851 1 16 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.663 0.738 18016
8852 1 16 . 1 1 41 41 LEU H H 41 8.380 8.380 7.335 1.045 18016
8853 1 16 . 1 1 42 42 THR N N 42 112.000 112.000 114.019 -2.019 18016
8854 1 16 . 1 1 42 42 THR HA H 42 4.440 4.440 4.310 0.130 18016
8855 1 16 . 1 1 42 42 THR C C 42 175.800 175.800 175.361 0.439 18016
8856 1 16 . 1 1 42 42 THR CA C 42 60.500 60.500 61.185 -0.685 18016
8857 1 16 . 1 1 42 42 THR CB C 42 70.800 70.800 70.291 0.509 18016
8858 1 16 . 1 1 42 42 THR H H 42 9.330 9.330 8.947 0.383 18016
8859 1 16 . 1 1 43 43 ASN N N 43 119.900 119.900 120.289 -0.389 18016
8860 1 16 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.429 -0.179 18016
8861 1 16 . 1 1 43 43 ASN C C 43 177.900 177.900 177.096 0.804 18016
8862 1 16 . 1 1 43 43 ASN CA C 43 56.700 56.700 56.759 -0.059 18016
8863 1 16 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.167 -0.967 18016
8864 1 16 . 1 1 43 43 ASN H H 43 9.140 9.140 8.864 0.276 18016
8865 1 16 . 1 1 44 44 ASP N N 44 118.000 118.000 119.139 -1.139 18016
8866 1 16 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.412 -0.012 18016
8867 1 16 . 1 1 44 44 ASP C C 44 179.600 179.600 178.498 1.102 18016
8868 1 16 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.468 -0.168 18016
8869 1 16 . 1 1 44 44 ASP H H 44 8.360 8.360 8.705 -0.345 18016
8870 1 16 . 1 1 45 45 GLU N N 45 122.600 122.600 120.656 1.944 18016
8871 1 16 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.069 -0.099 18016
8872 1 16 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.114 0.286 18016
8873 1 16 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.765 0.535 18016
8874 1 16 . 1 1 45 45 GLU H H 45 7.850 7.850 7.671 0.179 18016
8875 1 16 . 1 1 46 46 ILE N N 46 118.900 118.900 120.536 -1.636 18016
8876 1 16 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.765 -0.335 18016
8877 1 16 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.216 1.784 18016
8878 1 16 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.739 -0.039 18016
8879 1 16 . 1 1 46 46 ILE H H 46 8.290 8.290 8.251 0.039 18016
8880 1 16 . 1 1 47 47 LYS N N 47 118.900 118.900 119.650 -0.750 18016
8881 1 16 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.892 -0.022 18016
8882 1 16 . 1 1 47 47 LYS C C 47 178.400 178.400 178.883 -0.483 18016
8883 1 16 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.908 0.392 18016
8884 1 16 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.148 0.452 18016
8885 1 16 . 1 1 47 47 LYS H H 47 8.290 8.290 8.132 0.158 18016
8886 1 16 . 1 1 48 48 ALA N N 48 121.100 121.100 122.257 -1.157 18016
8887 1 16 . 1 1 48 48 ALA HA H 48 4.170 4.170 3.993 0.177 18016
8888 1 16 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.225 -0.125 18016
8889 1 16 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.288 -0.288 18016
8890 1 16 . 1 1 48 48 ALA H H 48 7.710 7.710 8.136 -0.426 18016
8891 1 16 . 1 1 49 49 ILE N N 49 119.900 119.900 117.606 2.294 18016
8892 1 16 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.763 -0.113 18016
8893 1 16 . 1 1 49 49 ILE C C 49 177.300 177.300 177.973 -0.673 18016
8894 1 16 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.448 1.552 18016
8895 1 16 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.420 1.680 18016
8896 1 16 . 1 1 49 49 ILE H H 49 8.130 8.130 8.205 -0.075 18016
8897 1 16 . 1 1 50 50 ALA N N 50 122.000 122.000 122.640 -0.640 18016
8898 1 16 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.019 -0.159 18016
8899 1 16 . 1 1 50 50 ALA C C 50 179.800 179.800 179.844 -0.044 18016
8900 1 16 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.419 0.281 18016
8901 1 16 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.081 -0.181 18016
8902 1 16 . 1 1 50 50 ALA H H 50 8.730 8.730 7.824 0.906 18016
8903 1 16 . 1 1 51 51 GLU N N 51 116.900 116.900 118.263 -1.363 18016
8904 1 16 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.026 -0.006 18016
8905 1 16 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.375 0.025 18016
8906 1 16 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.323 0.177 18016
8907 1 16 . 1 1 51 51 GLU H H 51 8.220 8.220 8.336 -0.116 18016
8908 1 16 . 1 1 52 52 ASP N N 52 120.300 120.300 119.677 0.623 18016
8909 1 16 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.523 -0.133 18016
8910 1 16 . 1 1 52 52 ASP C C 52 178.900 178.900 178.685 0.215 18016
8911 1 16 . 1 1 52 52 ASP CA C 52 57.500 57.500 57.035 0.466 18016
8912 1 16 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.123 1.377 18016
8913 1 16 . 1 1 52 52 ASP H H 52 7.700 7.700 7.774 -0.074 18016
8914 1 16 . 1 1 53 53 LEU N N 53 118.300 118.300 120.336 -2.036 18016
8915 1 16 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.994 -0.264 18016
8916 1 16 . 1 1 53 53 LEU C C 53 179.000 179.000 178.914 0.086 18016
8917 1 16 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.787 -0.287 18016
8918 1 16 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.866 -0.766 18016
8919 1 16 . 1 1 53 53 LEU H H 53 8.290 8.290 8.024 0.266 18016
8920 1 16 . 1 1 54 54 GLU N N 54 118.700 118.700 118.427 0.273 18016
8921 1 16 . 1 1 54 54 GLU HA H 54 4.220 4.220 3.969 0.251 18016
8922 1 16 . 1 1 54 54 GLU C C 54 178.200 178.200 178.604 -0.404 18016
8923 1 16 . 1 1 54 54 GLU CA C 54 58.700 58.700 59.865 -1.165 18016
8924 1 16 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.242 0.658 18016
8925 1 16 . 1 1 54 54 GLU H H 54 8.070 8.070 8.781 -0.711 18016
8926 1 16 . 1 1 55 55 LYS N N 55 117.700 117.700 118.787 -1.087 18016
8927 1 16 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.171 -0.021 18016
8928 1 16 . 1 1 55 55 LYS CA C 55 58.300 58.300 58.111 0.188 18016
8929 1 16 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.215 0.485 18016
8930 1 16 . 1 1 55 55 LYS H H 55 7.750 7.750 7.526 0.224 18016
8931 1 16 . 1 1 56 56 ARG N N 56 117.100 117.100 117.748 -0.648 18016
8932 1 16 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.151 0.119 18016
8933 1 16 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.699 -0.899 18016
8934 1 16 . 1 1 56 56 ARG CB C 56 31.000 31.000 30.596 0.404 18016
8935 1 16 . 1 1 56 56 ARG H H 56 8.270 8.270 7.407 0.863 18016
8936 1 16 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.209 0.151 18016
8937 1 16 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.037 0.063 18016
8938 1 16 . 1 1 57 57 ALA CB C 57 19.200 19.200 19.794 -0.594 18016
8939 1 16 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.568 -0.058 18016
8940 1 16 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.046 1.154 18016
8941 1 16 . 1 1 58 58 HIS CB C 58 27.300 27.300 28.552 -1.252 18016
8942 1 16 . 1 1 59 59 PHE N N 59 120.400 120.400 126.123 -5.723 18016
8943 1 16 . 1 1 59 59 PHE C C 59 175.500 175.500 176.380 -0.880 18016
8944 1 16 . 1 1 59 59 PHE CA C 59 57.200 57.200 56.287 0.913 18016
8945 1 16 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.916 -0.616 18016
8946 1 16 . 1 1 59 59 PHE H H 59 7.710 7.710 7.984 -0.274 18016
8947 1 16 . 1 1 60 60 ASP N N 60 120.800 120.800 125.080 -4.280 18016
8948 1 16 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.321 0.169 18016
8949 1 16 . 1 1 60 60 ASP CA C 60 54.300 54.300 56.572 -2.272 18016
8950 1 16 . 1 1 60 60 ASP CB C 60 41.100 41.100 40.243 0.857 18016
8951 1 16 . 1 1 60 60 ASP H H 60 8.180 8.180 8.994 -0.814 18016
8952 1 16 . 1 1 61 61 HIS N N 61 118.300 118.300 117.335 0.965 18016
8953 1 16 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.496 -0.106 18016
8954 1 16 . 1 1 61 61 HIS CA C 61 56.700 56.700 57.248 -0.548 18016
8955 1 16 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.635 -0.835 18016
8956 1 16 . 1 1 61 61 HIS H H 61 8.550 8.550 8.089 0.461 18016
8957 1 16 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.372 -0.362 18016
8958 1 16 . 1 1 62 62 ILE C C 62 173.800 173.800 174.815 -1.015 18016
8959 1 16 . 1 1 62 62 ILE CA C 62 66.500 66.500 59.927 6.573 18016
8960 1 16 . 1 1 62 62 ILE CB C 62 40.100 40.100 38.853 1.247 18016
8961 1 16 . 1 1 63 63 ASP N N 63 125.100 125.100 122.756 2.344 18016
8962 1 16 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.407 0.193 18016
8963 1 16 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.642 -2.842 18016
8964 1 16 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.578 -2.078 18016
8965 1 16 . 1 1 63 63 ASP H H 63 8.360 8.360 7.618 0.742 18016
8966 1 16 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.902 -0.232 18016
8967 1 16 . 1 1 64 64 ILE C C 64 177.000 177.000 176.691 0.309 18016
8968 1 16 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.196 -1.096 18016
8969 1 16 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.330 -1.730 18016
8970 1 16 . 1 1 65 65 GLY N N 65 107.600 107.600 107.723 -0.123 18016
8971 1 16 . 1 1 65 65 GLY C C 65 177.000 177.000 175.826 1.174 18016
8972 1 16 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.888 0.412 18016
8973 1 16 . 1 1 65 65 GLY H H 65 8.440 8.440 7.815 0.625 18016
8974 1 16 . 1 1 66 66 VAL N N 66 121.800 121.800 122.895 -1.095 18016
8975 1 16 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.579 0.181 18016
8976 1 16 . 1 1 66 66 VAL C C 66 178.500 178.500 177.693 0.807 18016
8977 1 16 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.827 -0.227 18016
8978 1 16 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.742 0.258 18016
8979 1 16 . 1 1 66 66 VAL H H 66 7.550 7.550 8.017 -0.467 18016
8980 1 16 . 1 1 67 67 LEU N N 67 120.900 120.900 119.051 1.849 18016
8981 1 16 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.024 0.046 18016
8982 1 16 . 1 1 67 67 LEU C C 67 179.000 179.000 179.188 -0.188 18016
8983 1 16 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.901 -0.301 18016
8984 1 16 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.268 2.032 18016
8985 1 16 . 1 1 67 67 LEU H H 67 7.650 7.650 7.474 0.176 18016
8986 1 16 . 1 1 68 68 ILE N N 68 118.900 118.900 117.560 1.340 18016
8987 1 16 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.767 -0.057 18016
8988 1 16 . 1 1 68 68 ILE C C 68 179.500 179.500 178.579 0.921 18016
8989 1 16 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.999 0.201 18016
8990 1 16 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.492 0.008 18016
8991 1 16 . 1 1 68 68 ILE H H 68 8.580 8.580 7.461 1.119 18016
8992 1 16 . 1 1 69 69 THR N N 69 118.100 118.100 114.631 3.469 18016
8993 1 16 . 1 1 69 69 THR HA H 69 3.940 3.940 4.067 -0.127 18016
8994 1 16 . 1 1 69 69 THR C C 69 176.200 176.200 176.584 -0.384 18016
8995 1 16 . 1 1 69 69 THR CA C 69 66.600 66.600 66.010 0.590 18016
8996 1 16 . 1 1 69 69 THR CB C 69 68.500 68.500 68.568 -0.068 18016
8997 1 16 . 1 1 69 69 THR H H 69 7.840 7.840 7.757 0.083 18016
8998 1 16 . 1 1 70 70 GLN N N 70 121.600 121.600 120.998 0.602 18016
8999 1 16 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.116 -0.006 18016
9000 1 16 . 1 1 70 70 GLN C C 70 178.100 178.100 178.127 -0.027 18016
9001 1 16 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.644 0.456 18016
9002 1 16 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.598 -0.298 18016
9003 1 16 . 1 1 70 70 GLN H H 70 8.100 8.100 7.350 0.750 18016
9004 1 16 . 1 1 71 71 MET N N 71 118.700 118.700 119.894 -1.194 18016
9005 1 16 . 1 1 71 71 MET HA H 71 4.010 4.010 4.336 -0.326 18016
9006 1 16 . 1 1 71 71 MET C C 71 176.300 176.300 178.883 -2.583 18016
9007 1 16 . 1 1 71 71 MET CA C 71 58.100 58.100 59.208 -1.108 18016
9008 1 16 . 1 1 71 71 MET CB C 71 33.600 33.600 32.697 0.903 18016
9009 1 16 . 1 1 71 71 MET H H 71 8.350 8.350 8.680 -0.330 18016
9010 1 16 . 1 1 72 72 THR N N 72 111.600 111.600 111.785 -0.185 18016
9011 1 16 . 1 1 72 72 THR HA H 72 3.940 3.940 4.062 -0.122 18016
9012 1 16 . 1 1 72 72 THR C C 72 175.800 175.800 175.598 0.202 18016
9013 1 16 . 1 1 72 72 THR CA C 72 65.300 65.300 65.053 0.247 18016
9014 1 16 . 1 1 72 72 THR CB C 72 69.100 69.100 68.958 0.142 18016
9015 1 16 . 1 1 72 72 THR H H 72 7.840 7.840 7.834 0.006 18016
9016 1 16 . 1 1 73 73 ASP N N 73 121.100 121.100 120.019 1.081 18016
9017 1 16 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.641 -0.111 18016
9018 1 16 . 1 1 73 73 ASP C C 73 176.600 176.600 175.690 0.910 18016
9019 1 16 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.373 0.827 18016
9020 1 16 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.371 -0.971 18016
9021 1 16 . 1 1 73 73 ASP H H 73 7.840 7.840 7.633 0.207 18016
9022 1 16 . 1 1 74 74 GLU N N 74 121.100 121.100 119.393 1.707 18016
9023 1 16 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.604 -0.264 18016
9024 1 16 . 1 1 74 74 GLU C C 74 173.800 173.800 175.076 -1.276 18016
9025 1 16 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.467 0.033 18016
9026 1 16 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.407 -0.807 18016
9027 1 16 . 1 1 74 74 GLU H H 74 7.980 7.980 8.389 -0.409 18016
9028 1 16 . 1 1 75 75 MET N N 75 125.800 125.800 125.891 -0.091 18016
9029 1 16 . 1 1 75 75 MET HA H 75 4.710 4.710 4.835 -0.125 18016
9030 1 16 . 1 1 75 75 MET CA C 75 53.800 53.800 54.383 -0.583 18016
9031 1 16 . 1 1 75 75 MET CB C 75 31.700 31.700 31.816 -0.116 18016
9032 1 16 . 1 1 75 75 MET H H 75 8.380 8.380 8.540 -0.160 18016
9033 1 16 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.430 0.080 18016
9034 1 16 . 1 1 76 76 PRO C C 76 175.700 175.700 176.947 -1.247 18016
9035 1 16 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.899 -1.899 18016
9036 1 16 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.238 -0.438 18016
9037 1 16 . 1 1 77 77 ARG N N 77 119.700 119.700 118.725 0.975 18016
9038 1 16 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.585 -0.315 18016
9039 1 16 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.049 0.751 18016
9040 1 16 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.797 -2.097 18016
9041 1 16 . 1 1 77 77 ARG H H 77 8.940 8.940 8.160 0.780 18016
9042 1 16 . 1 1 78 78 GLU N N 78 124.700 124.700 126.158 -1.458 18016
9043 1 16 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.977 -0.017 18016
9044 1 16 . 1 1 78 78 GLU C C 78 179.000 179.000 178.222 0.778 18016
9045 1 16 . 1 1 78 78 GLU CA C 78 59.800 59.800 60.121 -0.321 18016
9046 1 16 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.675 -0.676 18016
9047 1 16 . 1 1 78 78 GLU H H 78 9.170 9.170 9.016 0.154 18016
9048 1 16 . 1 1 79 79 GLU N N 79 116.800 116.800 120.291 -3.491 18016
9049 1 16 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.209 -0.089 18016
9050 1 16 . 1 1 79 79 GLU C C 79 179.100 179.100 178.279 0.821 18016
9051 1 16 . 1 1 79 79 GLU CA C 79 59.700 59.700 60.022 -0.322 18016
9052 1 16 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.280 -0.280 18016
9053 1 16 . 1 1 79 79 GLU H H 79 9.660 9.660 8.752 0.908 18016
9054 1 16 . 1 1 80 80 ASP N N 80 120.000 120.000 118.691 1.309 18016
9055 1 16 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.443 0.247 18016
9056 1 16 . 1 1 80 80 ASP C C 80 177.300 177.300 178.754 -1.454 18016
9057 1 16 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.122 0.278 18016
9058 1 16 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.227 1.373 18016
9059 1 16 . 1 1 80 80 ASP H H 80 7.310 7.310 8.387 -1.077 18016
9060 1 16 . 1 1 81 81 ILE N N 81 120.100 120.100 120.048 0.052 18016
9061 1 16 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.697 -0.207 18016
9062 1 16 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.733 0.567 18016
9063 1 16 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.921 0.379 18016
9064 1 16 . 1 1 81 81 ILE H H 81 7.610 7.610 8.311 -0.701 18016
9065 1 16 . 1 1 82 82 GLU N N 82 118.100 118.100 119.907 -1.807 18016
9066 1 16 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.031 0.249 18016
9067 1 16 . 1 1 82 82 GLU C C 82 177.800 177.800 179.005 -1.205 18016
9068 1 16 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.649 -1.649 18016
9069 1 16 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.012 -0.213 18016
9070 1 16 . 1 1 82 82 GLU H H 82 8.550 8.550 8.606 -0.056 18016
9071 1 16 . 1 1 83 83 ARG N N 83 119.900 119.900 120.442 -0.542 18016
9072 1 16 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.040 -0.010 18016
9073 1 16 . 1 1 83 83 ARG C C 83 179.400 179.400 178.956 0.444 18016
9074 1 16 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.267 0.633 18016
9075 1 16 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.139 -0.539 18016
9076 1 16 . 1 1 83 83 ARG H H 83 7.590 7.590 8.197 -0.607 18016
9077 1 16 . 1 1 84 84 VAL N N 84 120.400 120.400 120.119 0.281 18016
9078 1 16 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.879 -0.129 18016
9079 1 16 . 1 1 84 84 VAL C C 84 177.400 177.400 177.862 -0.462 18016
9080 1 16 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.923 0.977 18016
9081 1 16 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.800 0.100 18016
9082 1 16 . 1 1 84 84 VAL H H 84 7.550 7.550 8.304 -0.754 18016
9083 1 16 . 1 1 85 85 ARG N N 85 121.600 121.600 119.135 2.465 18016
9084 1 16 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.286 -0.276 18016
9085 1 16 . 1 1 85 85 ARG C C 85 178.100 178.100 179.023 -0.923 18016
9086 1 16 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.900 1.000 18016
9087 1 16 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.956 0.244 18016
9088 1 16 . 1 1 85 85 ARG H H 85 9.090 9.090 8.507 0.583 18016
9089 1 16 . 1 1 86 86 ARG N N 86 115.600 115.600 118.746 -3.146 18016
9090 1 16 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.137 -0.257 18016
9091 1 16 . 1 1 86 86 ARG C C 86 179.000 179.000 178.891 0.109 18016
9092 1 16 . 1 1 86 86 ARG CA C 86 59.400 59.400 58.906 0.494 18016
9093 1 16 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.744 0.655 18016
9094 1 16 . 1 1 86 86 ARG H H 86 8.660 8.660 8.466 0.194 18016
9095 1 16 . 1 1 87 87 HIS N N 87 118.000 118.000 120.402 -2.402 18016
9096 1 16 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.428 -0.068 18016
9097 1 16 . 1 1 87 87 HIS C C 87 178.400 178.400 177.331 1.069 18016
9098 1 16 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.370 0.230 18016
9099 1 16 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.235 0.465 18016
9100 1 16 . 1 1 87 87 HIS H H 87 7.640 7.640 8.196 -0.556 18016
9101 1 16 . 1 1 88 88 LEU N N 88 119.600 119.600 119.112 0.488 18016
9102 1 16 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.177 -0.597 18016
9103 1 16 . 1 1 88 88 LEU C C 88 180.000 180.000 178.784 1.216 18016
9104 1 16 . 1 1 88 88 LEU CA C 88 57.200 57.200 56.913 0.287 18016
9105 1 16 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.339 1.261 18016
9106 1 16 . 1 1 88 88 LEU H H 88 8.650 8.650 8.617 0.033 18016
9107 1 16 . 1 1 89 89 ALA N N 89 118.500 118.500 122.366 -3.866 18016
9108 1 16 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.694 0.666 18016
9109 1 16 . 1 1 89 89 ALA C C 89 180.400 180.400 179.581 0.819 18016
9110 1 16 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.868 -1.268 18016
9111 1 16 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.423 -0.323 18016
9112 1 16 . 1 1 89 89 ALA H H 89 8.870 8.870 8.183 0.687 18016
9113 1 16 . 1 1 90 90 LEU N N 90 119.400 119.400 117.265 2.135 18016
9114 1 16 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.971 0.239 18016
9115 1 16 . 1 1 90 90 LEU C C 90 179.100 179.100 178.844 0.256 18016
9116 1 16 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.044 0.456 18016
9117 1 16 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.512 0.188 18016
9118 1 16 . 1 1 90 90 LEU H H 90 7.390 7.390 7.508 -0.118 18016
9119 1 16 . 1 1 91 91 GLN N N 91 114.500 114.500 116.000 -1.500 18016
9120 1 16 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.387 0.313 18016
9121 1 16 . 1 1 91 91 GLN C C 91 175.800 175.800 176.800 -1.000 18016
9122 1 16 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.080 -1.580 18016
9123 1 16 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.085 -1.985 18016
9124 1 16 . 1 1 91 91 GLN H H 91 7.810 7.810 7.887 -0.077 18016
9125 1 16 . 1 1 92 92 GLY N N 92 107.900 107.900 105.289 2.611 18016
9126 1 16 . 1 1 92 92 GLY C C 92 172.100 172.100 171.800 0.300 18016
9127 1 16 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.048 -1.048 18016
9128 1 16 . 1 1 92 92 GLY H H 92 7.710 7.710 8.140 -0.430 18016
9129 1 16 . 1 1 93 93 TRP N N 93 114.200 114.200 122.167 -7.967 18016
9130 1 16 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.502 1.498 18016
9131 1 16 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.622 -1.423 18016
9132 1 16 . 1 1 93 93 TRP H H 93 8.450 8.450 8.430 0.020 18016
9133 1 16 . 1 1 94 94 PRO HA H 94 4.460 4.460 3.947 0.513 18016
9134 1 16 . 1 1 94 94 PRO CA C 94 62.800 62.800 64.401 -1.601 18016
9135 1 16 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.032 0.568 18016
9136 1 16 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.186 -0.686 18016
9137 1 16 . 1 1 95 95 LEU C C 95 175.000 175.000 178.627 -3.627 18016
9138 1 16 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.535 -0.435 18016
9139 1 16 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.435 1.665 18016
9140 1 16 . 1 1 96 96 ASP N N 96 114.000 114.000 120.307 -6.307 18016
9141 1 16 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.583 0.367 18016
9142 1 16 . 1 1 96 96 ASP C C 96 175.800 175.800 176.572 -0.772 18016
9143 1 16 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.864 -2.864 18016
9144 1 16 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.695 0.205 18016
9145 1 16 . 1 1 96 96 ASP H H 96 7.230 7.230 7.743 -0.513 18016
9146 1 16 . 1 1 97 97 ASP N N 97 123.200 123.200 118.955 4.245 18016
9147 1 16 . 1 1 97 97 ASP HA H 97 4.610 4.610 5.018 -0.408 18016
9148 1 16 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.131 2.369 18016
9149 1 16 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.000 -4.300 18016
9150 1 16 . 1 1 97 97 ASP H H 97 7.420 7.420 7.821 -0.401 18016
9151 1 16 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.159 0.131 18016
9152 1 16 . 1 1 98 98 PRO C C 98 177.500 177.500 176.417 1.083 18016
9153 1 16 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.033 0.667 18016
9154 1 16 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.306 -1.407 18016
9155 1 16 . 1 1 99 99 ARG N N 99 121.300 121.300 121.082 0.218 18016
9156 1 16 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.257 -0.547 18016
9157 1 16 . 1 1 99 99 ARG C C 99 176.500 176.500 176.514 -0.014 18016
9158 1 16 . 1 1 99 99 ARG CA C 99 56.100 56.100 56.935 -0.835 18016
9159 1 16 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.441 0.059 18016
9160 1 16 . 1 1 99 99 ARG H H 99 8.390 8.390 7.851 0.539 18016
9161 1 16 . 1 1 100 100 ASP N N 100 119.600 119.600 117.952 1.648 18016
9162 1 16 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.646 -0.146 18016
9163 1 16 . 1 1 100 100 ASP C C 100 177.000 177.000 175.620 1.380 18016
9164 1 16 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.855 0.845 18016
9165 1 16 . 1 1 100 100 ASP CB C 100 40.900 40.900 42.453 -1.554 18016
9166 1 16 . 1 1 100 100 ASP H H 100 8.260 8.260 7.528 0.732 18016
9167 1 16 . 1 1 101 101 GLY N N 101 109.300 109.300 109.321 -0.021 18016
9168 1 16 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.799 0.601 18016
9169 1 16 . 1 1 101 101 GLY H H 101 8.450 8.450 8.252 0.198 18016
9170 1 16 . 1 1 102 102 GLU N N 102 119.800 119.800 120.668 -0.868 18016
9171 1 16 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.143 0.167 18016
9172 1 16 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.447 -0.446 18016
9173 1 16 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.215 0.285 18016
9174 1 16 . 1 1 102 102 GLU H H 102 8.140 8.140 8.390 -0.250 18016
9175 1 16 . 1 1 103 103 GLU N N 103 123.000 123.000 125.124 -2.124 18016
9176 1 16 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.448 0.112 18016
9177 1 16 . 1 1 103 103 GLU CA C 103 54.300 54.300 53.950 0.350 18016
9178 1 16 . 1 1 103 103 GLU CB C 103 29.600 29.600 30.397 -0.797 18016
9179 1 16 . 1 1 103 103 GLU H H 103 8.580 8.580 8.650 -0.070 18016
9180 1 16 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.517 -0.037 18016
9181 1 16 . 1 1 104 104 PRO C C 104 176.800 176.800 176.156 0.644 18016
9182 1 16 . 1 1 104 104 PRO CA C 104 63.400 63.400 62.448 0.952 18016
9183 1 16 . 1 1 104 104 PRO CB C 104 32.100 32.100 32.359 -0.259 18016
9184 1 16 . 1 1 105 105 ASP N N 105 120.400 120.400 119.152 1.248 18016
9185 1 16 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.532 0.048 18016
9186 1 16 . 1 1 105 105 ASP C C 105 177.100 177.100 176.699 0.401 18016
9187 1 16 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.560 -0.260 18016
9188 1 16 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.238 0.162 18016
9189 1 16 . 1 1 105 105 ASP H H 105 8.500 8.500 8.384 0.116 18016
9190 1 16 . 1 1 106 106 GLY N N 106 109.300 109.300 110.696 -1.396 18016
9191 1 16 . 1 1 106 106 GLY C C 106 174.600 174.600 173.848 0.752 18016
9192 1 16 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.263 0.137 18016
9193 1 16 . 1 1 106 106 GLY H H 106 8.360 8.360 8.271 0.089 18016
9194 1 16 . 1 1 107 107 GLU N N 107 120.400 120.400 120.854 -0.454 18016
9195 1 16 . 1 1 107 107 GLU HA H 107 4.340 4.340 3.832 0.508 18016
9196 1 16 . 1 1 107 107 GLU C C 107 177.100 177.100 175.727 1.373 18016
9197 1 16 . 1 1 107 107 GLU CA C 107 56.500 56.500 57.860 -1.360 18016
9198 1 16 . 1 1 107 107 GLU CB C 107 30.200 30.200 27.956 2.244 18016
9199 1 16 . 1 1 107 107 GLU H H 107 8.410 8.410 8.880 -0.470 18016
9200 1 16 . 1 1 108 108 SER N N 108 116.600 116.600 113.734 2.866 18016
9201 1 16 . 1 1 108 108 SER HA H 108 4.450 4.450 4.519 -0.069 18016
9202 1 16 . 1 1 108 108 SER C C 108 175.300 175.300 175.674 -0.374 18016
9203 1 16 . 1 1 108 108 SER CA C 108 58.700 58.700 58.627 0.073 18016
9204 1 16 . 1 1 108 108 SER CB C 108 63.800 63.800 64.371 -0.571 18016
9205 1 16 . 1 1 108 108 SER H H 108 8.460 8.460 8.220 0.240 18016
9206 1 16 . 1 1 109 109 GLY N N 109 110.800 110.800 111.329 -0.529 18016
9207 1 16 . 1 1 109 109 GLY C C 109 174.500 174.500 174.519 -0.019 18016
9208 1 16 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.298 0.002 18016
9209 1 16 . 1 1 109 109 GLY H H 109 8.500 8.500 8.262 0.238 18016
9210 1 16 . 1 1 110 110 GLY N N 110 108.800 108.800 112.003 -3.203 18016
9211 1 16 . 1 1 110 110 GLY CA C 110 44.400 44.400 42.963 1.437 18016
9212 1 16 . 1 1 110 110 GLY H H 110 8.140 8.140 7.834 0.306 18016
9213 1 16 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.476 0.134 18016
9214 1 16 . 1 1 111 111 PRO C C 111 176.000 176.000 176.160 -0.160 18016
9215 1 16 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.492 -0.892 18016
9216 1 16 . 1 1 111 111 PRO CB C 111 34.600 34.600 31.931 2.669 18016
9217 1 17 . 1 1 2 2 PRO HA H 2 4.430 4.430 4.576 -0.146 18016
9218 1 17 . 1 1 2 2 PRO C C 2 177.600 177.600 177.523 0.077 18016
9219 1 17 . 1 1 2 2 PRO CA C 2 63.300 63.300 63.384 -0.084 18016
9220 1 17 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.742 -0.442 18016
9221 1 17 . 1 1 3 3 GLY N N 3 110.000 110.000 103.676 6.324 18016
9222 1 17 . 1 1 3 3 GLY C C 3 174.200 174.200 174.897 -0.697 18016
9223 1 17 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.340 0.061 18016
9224 1 17 . 1 1 3 3 GLY H H 3 8.700 8.700 8.646 0.054 18016
9225 1 17 . 1 1 4 4 SER N N 4 115.400 115.400 115.376 0.024 18016
9226 1 17 . 1 1 4 4 SER HA H 4 4.440 4.440 4.749 -0.309 18016
9227 1 17 . 1 1 4 4 SER C C 4 174.800 174.800 172.812 1.988 18016
9228 1 17 . 1 1 4 4 SER CA C 4 58.400 58.400 58.586 -0.186 18016
9229 1 17 . 1 1 4 4 SER CB C 4 63.800 63.800 65.487 -1.687 18016
9230 1 17 . 1 1 4 4 SER H H 4 8.210 8.210 8.708 -0.498 18016
9231 1 17 . 1 1 5 5 MET N N 5 122.200 122.200 120.349 1.851 18016
9232 1 17 . 1 1 5 5 MET HA H 5 4.510 4.510 4.818 -0.308 18016
9233 1 17 . 1 1 5 5 MET CA C 5 55.600 55.600 55.242 0.358 18016
9234 1 17 . 1 1 5 5 MET CB C 5 32.900 32.900 34.740 -1.840 18016
9235 1 17 . 1 1 5 5 MET H H 5 8.570 8.570 7.941 0.629 18016
9236 1 17 . 1 1 6 6 VAL N N 6 120.000 120.000 119.963 0.037 18016
9237 1 17 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.490 -0.440 18016
9238 1 17 . 1 1 6 6 VAL C C 6 175.700 175.700 174.566 1.134 18016
9239 1 17 . 1 1 6 6 VAL CA C 6 62.700 62.700 60.436 2.264 18016
9240 1 17 . 1 1 6 6 VAL CB C 6 32.500 32.500 33.685 -1.185 18016
9241 1 17 . 1 1 6 6 VAL H H 6 8.150 8.150 8.231 -0.081 18016
9242 1 17 . 1 1 7 7 ASN N N 7 122.000 122.000 118.712 3.288 18016
9243 1 17 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.612 0.048 18016
9244 1 17 . 1 1 7 7 ASN C C 7 175.200 175.200 176.941 -1.741 18016
9245 1 17 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.807 -0.607 18016
9246 1 17 . 1 1 7 7 ASN CB C 7 38.900 38.900 40.120 -1.220 18016
9247 1 17 . 1 1 7 7 ASN H H 7 8.010 8.010 8.264 -0.254 18016
9248 1 17 . 1 1 8 8 ALA N N 8 126.500 126.500 125.789 0.711 18016
9249 1 17 . 1 1 8 8 ALA C C 8 180.200 180.200 179.589 0.611 18016
9250 1 17 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.112 0.388 18016
9251 1 17 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.813 -0.413 18016
9252 1 17 . 1 1 8 8 ALA H H 8 9.020 9.020 8.715 0.305 18016
9253 1 17 . 1 1 9 9 PHE N N 9 121.300 121.300 119.394 1.906 18016
9254 1 17 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.103 0.187 18016
9255 1 17 . 1 1 9 9 PHE C C 9 177.200 177.200 177.232 -0.032 18016
9256 1 17 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.640 -0.340 18016
9257 1 17 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.928 0.272 18016
9258 1 17 . 1 1 9 9 PHE H H 9 8.570 8.570 7.963 0.607 18016
9259 1 17 . 1 1 10 10 LEU N N 10 117.200 117.200 119.611 -2.411 18016
9260 1 17 . 1 1 10 10 LEU HA H 10 3.700 3.700 4.166 -0.466 18016
9261 1 17 . 1 1 10 10 LEU C C 10 179.700 179.700 179.334 0.366 18016
9262 1 17 . 1 1 10 10 LEU CA C 10 57.600 57.600 58.125 -0.525 18016
9263 1 17 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.669 0.031 18016
9264 1 17 . 1 1 10 10 LEU H H 10 8.150 8.150 8.058 0.092 18016
9265 1 17 . 1 1 11 11 ALA N N 11 121.500 121.500 121.389 0.111 18016
9266 1 17 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.995 0.025 18016
9267 1 17 . 1 1 11 11 ALA C C 11 180.900 180.900 179.567 1.333 18016
9268 1 17 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.232 -0.232 18016
9269 1 17 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.185 -0.185 18016
9270 1 17 . 1 1 11 11 ALA H H 11 8.460 8.460 8.749 -0.289 18016
9271 1 17 . 1 1 12 12 LYS N N 12 120.700 120.700 119.570 1.130 18016
9272 1 17 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.086 -0.036 18016
9273 1 17 . 1 1 12 12 LYS C C 12 179.700 179.700 178.832 0.868 18016
9274 1 17 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.651 0.548 18016
9275 1 17 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.008 -0.408 18016
9276 1 17 . 1 1 12 12 LYS H H 12 7.820 7.820 7.694 0.126 18016
9277 1 17 . 1 1 13 13 ILE N N 13 120.100 120.100 119.609 0.491 18016
9278 1 17 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.846 -0.156 18016
9279 1 17 . 1 1 13 13 ILE C C 13 178.100 178.100 178.284 -0.184 18016
9280 1 17 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.882 -0.882 18016
9281 1 17 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.726 -1.326 18016
9282 1 17 . 1 1 13 13 ILE H H 13 7.640 7.640 8.102 -0.462 18016
9283 1 17 . 1 1 14 14 ALA N N 14 122.700 122.700 122.291 0.409 18016
9284 1 17 . 1 1 14 14 ALA HA H 14 3.860 3.860 4.027 -0.167 18016
9285 1 17 . 1 1 14 14 ALA C C 14 179.000 179.000 179.658 -0.658 18016
9286 1 17 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.523 0.477 18016
9287 1 17 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.117 -0.117 18016
9288 1 17 . 1 1 14 14 ALA H H 14 8.680 8.680 8.636 0.044 18016
9289 1 17 . 1 1 15 15 ALA N N 15 118.700 118.700 121.582 -2.882 18016
9290 1 17 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.104 -0.014 18016
9291 1 17 . 1 1 15 15 ALA C C 15 180.400 180.400 178.897 1.503 18016
9292 1 17 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.800 0.200 18016
9293 1 17 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.520 -0.820 18016
9294 1 17 . 1 1 15 15 ALA H H 15 8.070 8.070 8.110 -0.040 18016
9295 1 17 . 1 1 16 16 TRP N N 16 122.900 122.900 121.537 1.363 18016
9296 1 17 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.295 0.265 18016
9297 1 17 . 1 1 16 16 TRP C C 16 178.400 178.400 177.865 0.535 18016
9298 1 17 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.483 -1.883 18016
9299 1 17 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.214 -0.914 18016
9300 1 17 . 1 1 16 16 TRP H H 16 7.820 7.820 8.388 -0.568 18016
9301 1 17 . 1 1 17 17 LEU N N 17 120.400 120.400 119.219 1.181 18016
9302 1 17 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.257 0.353 18016
9303 1 17 . 1 1 17 17 LEU C C 17 179.000 179.000 178.582 0.418 18016
9304 1 17 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.604 0.296 18016
9305 1 17 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.560 0.440 18016
9306 1 17 . 1 1 17 17 LEU H H 17 8.630 8.630 8.553 0.077 18016
9307 1 17 . 1 1 18 18 ASN N N 18 116.200 116.200 117.416 -1.216 18016
9308 1 17 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.331 -0.021 18016
9309 1 17 . 1 1 18 18 ASN C C 18 177.100 177.100 177.191 -0.091 18016
9310 1 17 . 1 1 18 18 ASN CA C 18 55.600 55.600 56.150 -0.550 18016
9311 1 17 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.777 0.423 18016
9312 1 17 . 1 1 18 18 ASN H H 18 8.350 8.350 8.301 0.049 18016
9313 1 17 . 1 1 19 19 ALA N N 19 119.600 119.600 119.799 -0.199 18016
9314 1 17 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.214 -0.124 18016
9315 1 17 . 1 1 19 19 ALA C C 19 180.100 180.100 178.871 1.229 18016
9316 1 17 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.161 0.039 18016
9317 1 17 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.475 -0.875 18016
9318 1 17 . 1 1 19 19 ALA H H 19 7.920 7.920 8.085 -0.165 18016
9319 1 17 . 1 1 20 20 GLY N N 20 103.500 103.500 104.780 -1.280 18016
9320 1 17 . 1 1 20 20 GLY C C 20 173.800 173.800 173.956 -0.156 18016
9321 1 17 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.487 0.313 18016
9322 1 17 . 1 1 20 20 GLY H H 20 7.700 7.700 7.377 0.323 18016
9323 1 17 . 1 1 21 21 TYR N N 21 119.900 119.900 117.244 2.656 18016
9324 1 17 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.905 0.265 18016
9325 1 17 . 1 1 21 21 TYR CA C 21 56.400 56.400 55.352 1.048 18016
9326 1 17 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.643 -0.843 18016
9327 1 17 . 1 1 21 21 TYR H H 21 7.980 7.980 8.036 -0.056 18016
9328 1 17 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.476 0.024 18016
9329 1 17 . 1 1 22 22 PRO C C 22 178.700 178.700 176.865 1.835 18016
9330 1 17 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.022 0.978 18016
9331 1 17 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.085 -0.085 18016
9332 1 17 . 1 1 23 23 GLU N N 23 116.300 116.300 115.548 0.752 18016
9333 1 17 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.390 0.180 18016
9334 1 17 . 1 1 23 23 GLU C C 23 176.300 176.300 176.510 -0.210 18016
9335 1 17 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.616 -1.016 18016
9336 1 17 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.768 -0.268 18016
9337 1 17 . 1 1 23 23 GLU H H 23 8.680 8.680 8.091 0.589 18016
9338 1 17 . 1 1 24 24 GLY N N 24 108.100 108.100 109.237 -1.137 18016
9339 1 17 . 1 1 24 24 GLY C C 24 173.100 173.100 173.328 -0.228 18016
9340 1 17 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.558 -1.658 18016
9341 1 17 . 1 1 24 24 GLY H H 24 7.230 7.230 7.551 -0.321 18016
9342 1 17 . 1 1 25 25 VAL N N 25 121.500 121.500 121.427 0.073 18016
9343 1 17 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.774 -0.184 18016
9344 1 17 . 1 1 25 25 VAL CA C 25 59.300 59.300 59.170 0.130 18016
9345 1 17 . 1 1 25 25 VAL CB C 25 32.100 32.100 31.289 0.811 18016
9346 1 17 . 1 1 25 25 VAL H H 25 8.050 8.050 7.900 0.150 18016
9347 1 17 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.413 -0.093 18016
9348 1 17 . 1 1 26 26 PRO C C 26 177.600 177.600 178.156 -0.556 18016
9349 1 17 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.627 0.273 18016
9350 1 17 . 1 1 26 26 PRO CB C 26 33.100 33.100 32.988 0.112 18016
9351 1 17 . 1 1 27 27 GLY N N 27 109.000 109.000 109.097 -0.097 18016
9352 1 17 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.809 1.291 18016
9353 1 17 . 1 1 27 27 GLY H H 27 8.930 8.930 8.806 0.124 18016
9354 1 17 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.287 0.103 18016
9355 1 17 . 1 1 28 28 PRO C C 28 175.800 175.800 177.177 -1.377 18016
9356 1 17 . 1 1 28 28 PRO CA C 28 64.400 64.400 65.075 -0.675 18016
9357 1 17 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.441 0.459 18016
9358 1 17 . 1 1 29 29 ASP N N 29 115.000 115.000 117.065 -2.065 18016
9359 1 17 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.717 -0.227 18016
9360 1 17 . 1 1 29 29 ASP C C 29 177.000 177.000 178.069 -1.069 18016
9361 1 17 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.953 -2.053 18016
9362 1 17 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.180 -0.480 18016
9363 1 17 . 1 1 29 29 ASP H H 29 7.760 7.760 7.919 -0.159 18016
9364 1 17 . 1 1 30 30 ARG N N 30 119.900 119.900 121.731 -1.831 18016
9365 1 17 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.924 -0.354 18016
9366 1 17 . 1 1 30 30 ARG C C 30 176.500 176.500 178.512 -2.012 18016
9367 1 17 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.890 2.010 18016
9368 1 17 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.316 0.184 18016
9369 1 17 . 1 1 30 30 ARG H H 30 7.460 7.460 8.123 -0.663 18016
9370 1 17 . 1 1 31 31 VAL N N 31 117.600 117.600 120.096 -2.496 18016
9371 1 17 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.823 -0.003 18016
9372 1 17 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.589 0.111 18016
9373 1 17 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.351 -0.551 18016
9374 1 17 . 1 1 31 31 VAL H H 31 9.080 9.080 8.228 0.852 18016
9375 1 17 . 1 1 32 32 PRO C C 32 177.000 177.000 178.604 -1.604 18016
9376 1 17 . 1 1 32 32 PRO CA C 32 65.200 65.200 66.005 -0.805 18016
9377 1 17 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.216 -0.416 18016
9378 1 17 . 1 1 33 33 LEU N N 33 115.200 115.200 120.766 -5.566 18016
9379 1 17 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.067 0.053 18016
9380 1 17 . 1 1 33 33 LEU C C 33 178.600 178.600 178.535 0.065 18016
9381 1 17 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.076 0.324 18016
9382 1 17 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.301 0.199 18016
9383 1 17 . 1 1 33 33 LEU H H 33 8.010 8.010 8.094 -0.084 18016
9384 1 17 . 1 1 34 34 LEU N N 34 120.400 120.400 119.119 1.281 18016
9385 1 17 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.039 -0.109 18016
9386 1 17 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.585 0.515 18016
9387 1 17 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.272 0.628 18016
9388 1 17 . 1 1 34 34 LEU H H 34 8.220 8.220 8.363 -0.143 18016
9389 1 17 . 1 1 35 35 ALA N N 35 123.100 123.100 122.519 0.581 18016
9390 1 17 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.055 -0.015 18016
9391 1 17 . 1 1 35 35 ALA C C 35 179.500 179.500 179.114 0.386 18016
9392 1 17 . 1 1 35 35 ALA CA C 35 55.500 55.500 54.975 0.525 18016
9393 1 17 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.443 -0.543 18016
9394 1 17 . 1 1 35 35 ALA H H 35 8.560 8.560 7.960 0.600 18016
9395 1 17 . 1 1 36 36 LEU N N 36 117.600 117.600 118.706 -1.106 18016
9396 1 17 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.272 -0.152 18016
9397 1 17 . 1 1 36 36 LEU C C 36 180.100 180.100 179.244 0.856 18016
9398 1 17 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.521 0.679 18016
9399 1 17 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.995 0.805 18016
9400 1 17 . 1 1 36 36 LEU H H 36 7.850 7.850 7.923 -0.073 18016
9401 1 17 . 1 1 37 37 LEU N N 37 116.700 116.700 119.928 -3.228 18016
9402 1 17 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.026 0.074 18016
9403 1 17 . 1 1 37 37 LEU C C 37 180.100 180.100 179.146 0.954 18016
9404 1 17 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.352 -0.052 18016
9405 1 17 . 1 1 37 37 LEU CB C 37 42.200 42.200 40.975 1.225 18016
9406 1 17 . 1 1 37 37 LEU H H 37 8.730 8.730 8.549 0.181 18016
9407 1 17 . 1 1 38 38 THR N N 38 110.600 110.600 109.018 1.582 18016
9408 1 17 . 1 1 38 38 THR HA H 38 4.440 4.440 4.258 0.182 18016
9409 1 17 . 1 1 38 38 THR C C 38 175.100 175.100 175.928 -0.828 18016
9410 1 17 . 1 1 38 38 THR CA C 38 64.200 64.200 64.623 -0.423 18016
9411 1 17 . 1 1 38 38 THR CB C 38 70.000 70.000 68.299 1.701 18016
9412 1 17 . 1 1 38 38 THR H H 38 8.660 8.660 8.611 0.049 18016
9413 1 17 . 1 1 39 39 ARG N N 39 118.000 118.000 119.926 -1.926 18016
9414 1 17 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.246 0.034 18016
9415 1 17 . 1 1 39 39 ARG C C 39 177.300 177.300 177.535 -0.235 18016
9416 1 17 . 1 1 39 39 ARG CA C 39 58.300 58.300 57.516 0.784 18016
9417 1 17 . 1 1 39 39 ARG CB C 39 30.200 30.200 29.962 0.239 18016
9418 1 17 . 1 1 39 39 ARG H H 39 7.180 7.180 7.619 -0.439 18016
9419 1 17 . 1 1 40 40 ARG N N 40 114.400 114.400 116.749 -2.349 18016
9420 1 17 . 1 1 40 40 ARG C C 40 174.800 174.800 176.737 -1.937 18016
9421 1 17 . 1 1 40 40 ARG CA C 40 55.300 55.300 56.494 -1.194 18016
9422 1 17 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.607 2.993 18016
9423 1 17 . 1 1 40 40 ARG H H 40 7.520 7.520 7.765 -0.245 18016
9424 1 17 . 1 1 41 41 LEU N N 41 119.400 119.400 121.777 -2.377 18016
9425 1 17 . 1 1 41 41 LEU C C 41 177.100 177.100 177.264 -0.164 18016
9426 1 17 . 1 1 41 41 LEU CA C 41 53.700 53.700 55.478 -1.778 18016
9427 1 17 . 1 1 41 41 LEU CB C 41 44.400 44.400 41.873 2.527 18016
9428 1 17 . 1 1 41 41 LEU H H 41 8.380 8.380 8.086 0.294 18016
9429 1 17 . 1 1 42 42 THR N N 42 112.000 112.000 116.772 -4.772 18016
9430 1 17 . 1 1 42 42 THR HA H 42 4.440 4.440 4.341 0.099 18016
9431 1 17 . 1 1 42 42 THR C C 42 175.800 175.800 175.930 -0.130 18016
9432 1 17 . 1 1 42 42 THR CA C 42 60.500 60.500 60.924 -0.424 18016
9433 1 17 . 1 1 42 42 THR CB C 42 70.800 70.800 70.072 0.728 18016
9434 1 17 . 1 1 42 42 THR H H 42 9.330 9.330 8.946 0.384 18016
9435 1 17 . 1 1 43 43 ASN N N 43 119.900 119.900 119.664 0.236 18016
9436 1 17 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.346 -0.096 18016
9437 1 17 . 1 1 43 43 ASN C C 43 177.900 177.900 177.401 0.499 18016
9438 1 17 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.901 -1.201 18016
9439 1 17 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.120 -0.920 18016
9440 1 17 . 1 1 43 43 ASN H H 43 9.140 9.140 8.758 0.382 18016
9441 1 17 . 1 1 44 44 ASP N N 44 118.000 118.000 119.122 -1.122 18016
9442 1 17 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.352 0.048 18016
9443 1 17 . 1 1 44 44 ASP C C 44 179.600 179.600 178.224 1.376 18016
9444 1 17 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.744 -0.444 18016
9445 1 17 . 1 1 44 44 ASP H H 44 8.360 8.360 8.652 -0.292 18016
9446 1 17 . 1 1 45 45 GLU N N 45 122.600 122.600 120.067 2.533 18016
9447 1 17 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.054 -0.084 18016
9448 1 17 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.070 0.330 18016
9449 1 17 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.778 0.522 18016
9450 1 17 . 1 1 45 45 GLU H H 45 7.850 7.850 7.614 0.236 18016
9451 1 17 . 1 1 46 46 ILE N N 46 118.900 118.900 120.790 -1.890 18016
9452 1 17 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.762 -0.332 18016
9453 1 17 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.265 1.735 18016
9454 1 17 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.761 -0.061 18016
9455 1 17 . 1 1 46 46 ILE H H 46 8.290 8.290 8.460 -0.170 18016
9456 1 17 . 1 1 47 47 LYS N N 47 118.900 118.900 119.194 -0.294 18016
9457 1 17 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.986 -0.116 18016
9458 1 17 . 1 1 47 47 LYS C C 47 178.400 178.400 178.754 -0.354 18016
9459 1 17 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.909 0.391 18016
9460 1 17 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.307 0.293 18016
9461 1 17 . 1 1 47 47 LYS H H 47 8.290 8.290 8.166 0.124 18016
9462 1 17 . 1 1 48 48 ALA N N 48 121.100 121.100 123.446 -2.346 18016
9463 1 17 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.120 0.050 18016
9464 1 17 . 1 1 48 48 ALA CA C 48 55.100 55.100 54.954 0.146 18016
9465 1 17 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.349 -0.349 18016
9466 1 17 . 1 1 48 48 ALA H H 48 7.710 7.710 8.142 -0.432 18016
9467 1 17 . 1 1 49 49 ILE N N 49 119.900 119.900 118.179 1.721 18016
9468 1 17 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.745 -0.095 18016
9469 1 17 . 1 1 49 49 ILE C C 49 177.300 177.300 178.030 -0.730 18016
9470 1 17 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.748 1.252 18016
9471 1 17 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.505 1.595 18016
9472 1 17 . 1 1 49 49 ILE H H 49 8.130 8.130 8.338 -0.208 18016
9473 1 17 . 1 1 50 50 ALA N N 50 122.000 122.000 122.597 -0.597 18016
9474 1 17 . 1 1 50 50 ALA HA H 50 3.860 3.860 4.009 -0.149 18016
9475 1 17 . 1 1 50 50 ALA C C 50 179.800 179.800 179.727 0.073 18016
9476 1 17 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.419 0.281 18016
9477 1 17 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.061 -0.161 18016
9478 1 17 . 1 1 50 50 ALA H H 50 8.730 8.730 7.518 1.212 18016
9479 1 17 . 1 1 51 51 GLU N N 51 116.900 116.900 117.977 -1.077 18016
9480 1 17 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.207 -0.187 18016
9481 1 17 . 1 1 51 51 GLU CA C 51 59.400 59.400 58.807 0.593 18016
9482 1 17 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.557 -0.057 18016
9483 1 17 . 1 1 51 51 GLU H H 51 8.220 8.220 8.320 -0.100 18016
9484 1 17 . 1 1 52 52 ASP N N 52 120.300 120.300 119.682 0.618 18016
9485 1 17 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.509 -0.119 18016
9486 1 17 . 1 1 52 52 ASP C C 52 178.900 178.900 179.022 -0.122 18016
9487 1 17 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.838 0.662 18016
9488 1 17 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.145 1.355 18016
9489 1 17 . 1 1 52 52 ASP H H 52 7.700 7.700 7.916 -0.216 18016
9490 1 17 . 1 1 53 53 LEU N N 53 118.300 118.300 120.414 -2.114 18016
9491 1 17 . 1 1 53 53 LEU HA H 53 3.730 3.730 4.028 -0.298 18016
9492 1 17 . 1 1 53 53 LEU C C 53 179.000 179.000 179.252 -0.252 18016
9493 1 17 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.477 0.023 18016
9494 1 17 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.813 -0.713 18016
9495 1 17 . 1 1 53 53 LEU H H 53 8.290 8.290 8.162 0.128 18016
9496 1 17 . 1 1 54 54 GLU N N 54 118.700 118.700 118.706 -0.006 18016
9497 1 17 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.039 0.181 18016
9498 1 17 . 1 1 54 54 GLU C C 54 178.200 178.200 177.417 0.783 18016
9499 1 17 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.740 -0.040 18016
9500 1 17 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.287 0.613 18016
9501 1 17 . 1 1 54 54 GLU H H 54 8.070 8.070 8.512 -0.442 18016
9502 1 17 . 1 1 55 55 LYS N N 55 117.700 117.700 116.273 1.427 18016
9503 1 17 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.106 0.044 18016
9504 1 17 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.586 0.714 18016
9505 1 17 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.242 0.458 18016
9506 1 17 . 1 1 55 55 LYS H H 55 7.750 7.750 7.525 0.225 18016
9507 1 17 . 1 1 56 56 ARG N N 56 117.100 117.100 118.054 -0.954 18016
9508 1 17 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.184 0.086 18016
9509 1 17 . 1 1 56 56 ARG CA C 56 56.800 56.800 58.266 -1.466 18016
9510 1 17 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.226 -0.226 18016
9511 1 17 . 1 1 56 56 ARG H H 56 8.270 8.270 7.770 0.500 18016
9512 1 17 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.347 0.013 18016
9513 1 17 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.179 -0.079 18016
9514 1 17 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.268 -1.068 18016
9515 1 17 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.578 -0.068 18016
9516 1 17 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.424 0.776 18016
9517 1 17 . 1 1 58 58 HIS CB C 58 27.300 27.300 28.454 -1.155 18016
9518 1 17 . 1 1 59 59 PHE N N 59 120.400 120.400 124.613 -4.213 18016
9519 1 17 . 1 1 59 59 PHE C C 59 175.500 175.500 176.588 -1.088 18016
9520 1 17 . 1 1 59 59 PHE CA C 59 57.200 57.200 58.131 -0.931 18016
9521 1 17 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.877 -0.577 18016
9522 1 17 . 1 1 59 59 PHE H H 59 7.710 7.710 8.083 -0.373 18016
9523 1 17 . 1 1 60 60 ASP N N 60 120.800 120.800 118.234 2.566 18016
9524 1 17 . 1 1 60 60 ASP HA H 60 4.490 4.490 3.956 0.534 18016
9525 1 17 . 1 1 60 60 ASP CA C 60 54.300 54.300 56.055 -1.755 18016
9526 1 17 . 1 1 60 60 ASP CB C 60 41.100 41.100 39.437 1.663 18016
9527 1 17 . 1 1 60 60 ASP H H 60 8.180 8.180 8.465 -0.285 18016
9528 1 17 . 1 1 61 61 HIS N N 61 118.300 118.300 119.764 -1.464 18016
9529 1 17 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.334 0.056 18016
9530 1 17 . 1 1 61 61 HIS CA C 61 56.700 56.700 58.282 -1.581 18016
9531 1 17 . 1 1 61 61 HIS CB C 61 28.800 28.800 29.900 -1.100 18016
9532 1 17 . 1 1 61 61 HIS H H 61 8.550 8.550 8.295 0.255 18016
9533 1 17 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.117 -0.107 18016
9534 1 17 . 1 1 62 62 ILE C C 62 173.800 173.800 175.025 -1.225 18016
9535 1 17 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.424 6.076 18016
9536 1 17 . 1 1 62 62 ILE CB C 62 40.100 40.100 36.650 3.450 18016
9537 1 17 . 1 1 63 63 ASP N N 63 125.100 125.100 122.491 2.609 18016
9538 1 17 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.417 0.183 18016
9539 1 17 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.574 -2.774 18016
9540 1 17 . 1 1 63 63 ASP CB C 63 40.500 40.500 42.973 -2.473 18016
9541 1 17 . 1 1 63 63 ASP H H 63 8.360 8.360 7.748 0.612 18016
9542 1 17 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.924 -0.254 18016
9543 1 17 . 1 1 64 64 ILE C C 64 177.000 177.000 176.496 0.504 18016
9544 1 17 . 1 1 64 64 ILE CA C 64 62.100 62.100 62.978 -0.878 18016
9545 1 17 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.396 -1.796 18016
9546 1 17 . 1 1 65 65 GLY N N 65 107.600 107.600 108.130 -0.530 18016
9547 1 17 . 1 1 65 65 GLY C C 65 177.000 177.000 175.844 1.156 18016
9548 1 17 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.897 0.403 18016
9549 1 17 . 1 1 65 65 GLY H H 65 8.440 8.440 7.877 0.563 18016
9550 1 17 . 1 1 66 66 VAL N N 66 121.800 121.800 122.216 -0.416 18016
9551 1 17 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.619 0.141 18016
9552 1 17 . 1 1 66 66 VAL C C 66 178.500 178.500 177.563 0.937 18016
9553 1 17 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.602 -0.002 18016
9554 1 17 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.671 0.329 18016
9555 1 17 . 1 1 66 66 VAL H H 66 7.550 7.550 8.278 -0.728 18016
9556 1 17 . 1 1 67 67 LEU N N 67 120.900 120.900 118.716 2.184 18016
9557 1 17 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.005 0.065 18016
9558 1 17 . 1 1 67 67 LEU C C 67 179.000 179.000 179.192 -0.192 18016
9559 1 17 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.691 -0.092 18016
9560 1 17 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.472 1.828 18016
9561 1 17 . 1 1 67 67 LEU H H 67 7.650 7.650 7.478 0.172 18016
9562 1 17 . 1 1 68 68 ILE N N 68 118.900 118.900 117.591 1.309 18016
9563 1 17 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.789 -0.079 18016
9564 1 17 . 1 1 68 68 ILE C C 68 179.500 179.500 178.403 1.097 18016
9565 1 17 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.841 0.359 18016
9566 1 17 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.524 -0.024 18016
9567 1 17 . 1 1 68 68 ILE H H 68 8.580 8.580 7.477 1.103 18016
9568 1 17 . 1 1 69 69 THR N N 69 118.100 118.100 115.610 2.490 18016
9569 1 17 . 1 1 69 69 THR HA H 69 3.940 3.940 4.010 -0.070 18016
9570 1 17 . 1 1 69 69 THR C C 69 176.200 176.200 176.444 -0.244 18016
9571 1 17 . 1 1 69 69 THR CA C 69 66.600 66.600 65.919 0.681 18016
9572 1 17 . 1 1 69 69 THR CB C 69 68.500 68.500 68.505 -0.005 18016
9573 1 17 . 1 1 69 69 THR H H 69 7.840 7.840 7.638 0.202 18016
9574 1 17 . 1 1 70 70 GLN N N 70 121.600 121.600 120.400 1.200 18016
9575 1 17 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.133 -0.023 18016
9576 1 17 . 1 1 70 70 GLN C C 70 178.100 178.100 178.117 -0.017 18016
9577 1 17 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.738 0.362 18016
9578 1 17 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.881 -0.581 18016
9579 1 17 . 1 1 70 70 GLN H H 70 8.100 8.100 7.570 0.530 18016
9580 1 17 . 1 1 71 71 MET N N 71 118.700 118.700 119.445 -0.745 18016
9581 1 17 . 1 1 71 71 MET HA H 71 4.010 4.010 4.407 -0.397 18016
9582 1 17 . 1 1 71 71 MET C C 71 176.300 176.300 178.865 -2.565 18016
9583 1 17 . 1 1 71 71 MET CA C 71 58.100 58.100 59.046 -0.946 18016
9584 1 17 . 1 1 71 71 MET CB C 71 33.600 33.600 32.646 0.954 18016
9585 1 17 . 1 1 71 71 MET H H 71 8.350 8.350 8.628 -0.278 18016
9586 1 17 . 1 1 72 72 THR N N 72 111.600 111.600 112.138 -0.538 18016
9587 1 17 . 1 1 72 72 THR HA H 72 3.940 3.940 4.028 -0.088 18016
9588 1 17 . 1 1 72 72 THR C C 72 175.800 175.800 175.658 0.142 18016
9589 1 17 . 1 1 72 72 THR CA C 72 65.300 65.300 65.069 0.231 18016
9590 1 17 . 1 1 72 72 THR CB C 72 69.100 69.100 68.985 0.115 18016
9591 1 17 . 1 1 72 72 THR H H 72 7.840 7.840 7.867 -0.027 18016
9592 1 17 . 1 1 73 73 ASP N N 73 121.100 121.100 119.351 1.749 18016
9593 1 17 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.671 -0.141 18016
9594 1 17 . 1 1 73 73 ASP C C 73 176.600 176.600 176.090 0.510 18016
9595 1 17 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.616 0.584 18016
9596 1 17 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.240 -0.840 18016
9597 1 17 . 1 1 73 73 ASP H H 73 7.840 7.840 7.653 0.187 18016
9598 1 17 . 1 1 74 74 GLU N N 74 121.100 121.100 118.738 2.362 18016
9599 1 17 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.623 -0.283 18016
9600 1 17 . 1 1 74 74 GLU C C 74 173.800 173.800 175.249 -1.449 18016
9601 1 17 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.447 0.053 18016
9602 1 17 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.750 -1.150 18016
9603 1 17 . 1 1 74 74 GLU H H 74 7.980 7.980 8.482 -0.502 18016
9604 1 17 . 1 1 75 75 MET N N 75 125.800 125.800 126.729 -0.929 18016
9605 1 17 . 1 1 75 75 MET HA H 75 4.710 4.710 4.706 0.004 18016
9606 1 17 . 1 1 75 75 MET CA C 75 53.800 53.800 54.157 -0.357 18016
9607 1 17 . 1 1 75 75 MET CB C 75 31.700 31.700 32.164 -0.464 18016
9608 1 17 . 1 1 75 75 MET H H 75 8.380 8.380 8.641 -0.261 18016
9609 1 17 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.379 0.131 18016
9610 1 17 . 1 1 76 76 PRO C C 76 175.700 175.700 176.348 -0.648 18016
9611 1 17 . 1 1 76 76 PRO CA C 76 62.000 62.000 64.191 -2.191 18016
9612 1 17 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.321 -0.521 18016
9613 1 17 . 1 1 77 77 ARG N N 77 119.700 119.700 118.425 1.275 18016
9614 1 17 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.557 -0.287 18016
9615 1 17 . 1 1 77 77 ARG CA C 77 55.800 55.800 54.960 0.840 18016
9616 1 17 . 1 1 77 77 ARG CB C 77 30.700 30.700 33.030 -2.330 18016
9617 1 17 . 1 1 77 77 ARG H H 77 8.940 8.940 8.054 0.886 18016
9618 1 17 . 1 1 78 78 GLU N N 78 124.700 124.700 124.804 -0.104 18016
9619 1 17 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.990 -0.030 18016
9620 1 17 . 1 1 78 78 GLU C C 78 179.000 179.000 178.243 0.757 18016
9621 1 17 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.768 0.032 18016
9622 1 17 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.722 -0.722 18016
9623 1 17 . 1 1 78 78 GLU H H 78 9.170 9.170 9.006 0.164 18016
9624 1 17 . 1 1 79 79 GLU N N 79 116.800 116.800 120.509 -3.709 18016
9625 1 17 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.266 -0.146 18016
9626 1 17 . 1 1 79 79 GLU C C 79 179.100 179.100 178.549 0.551 18016
9627 1 17 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.892 -0.192 18016
9628 1 17 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.290 -0.290 18016
9629 1 17 . 1 1 79 79 GLU H H 79 9.660 9.660 8.765 0.895 18016
9630 1 17 . 1 1 80 80 ASP N N 80 120.000 120.000 118.719 1.281 18016
9631 1 17 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.446 0.244 18016
9632 1 17 . 1 1 80 80 ASP C C 80 177.300 177.300 178.722 -1.422 18016
9633 1 17 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.361 0.039 18016
9634 1 17 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.487 1.113 18016
9635 1 17 . 1 1 80 80 ASP H H 80 7.310 7.310 8.407 -1.097 18016
9636 1 17 . 1 1 81 81 ILE N N 81 120.100 120.100 120.169 -0.069 18016
9637 1 17 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.725 -0.235 18016
9638 1 17 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.477 0.823 18016
9639 1 17 . 1 1 81 81 ILE CB C 81 38.300 38.300 38.008 0.292 18016
9640 1 17 . 1 1 81 81 ILE H H 81 7.610 7.610 8.178 -0.568 18016
9641 1 17 . 1 1 82 82 GLU N N 82 118.100 118.100 119.179 -1.079 18016
9642 1 17 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.095 0.185 18016
9643 1 17 . 1 1 82 82 GLU C C 82 177.800 177.800 178.774 -0.974 18016
9644 1 17 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.270 -1.270 18016
9645 1 17 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.083 -0.283 18016
9646 1 17 . 1 1 82 82 GLU H H 82 8.550 8.550 8.609 -0.059 18016
9647 1 17 . 1 1 83 83 ARG N N 83 119.900 119.900 121.197 -1.297 18016
9648 1 17 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.098 -0.068 18016
9649 1 17 . 1 1 83 83 ARG C C 83 179.400 179.400 178.825 0.575 18016
9650 1 17 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.351 0.549 18016
9651 1 17 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.411 -0.811 18016
9652 1 17 . 1 1 83 83 ARG H H 83 7.590 7.590 8.196 -0.606 18016
9653 1 17 . 1 1 84 84 VAL N N 84 120.400 120.400 119.853 0.547 18016
9654 1 17 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.886 -0.136 18016
9655 1 17 . 1 1 84 84 VAL C C 84 177.400 177.400 177.492 -0.092 18016
9656 1 17 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.517 1.383 18016
9657 1 17 . 1 1 84 84 VAL CB C 84 31.900 31.900 31.784 0.116 18016
9658 1 17 . 1 1 84 84 VAL H H 84 7.550 7.550 8.411 -0.861 18016
9659 1 17 . 1 1 85 85 ARG N N 85 121.600 121.600 119.895 1.705 18016
9660 1 17 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.286 -0.276 18016
9661 1 17 . 1 1 85 85 ARG C C 85 178.100 178.100 178.595 -0.495 18016
9662 1 17 . 1 1 85 85 ARG CA C 85 60.900 60.900 60.091 0.809 18016
9663 1 17 . 1 1 85 85 ARG CB C 85 30.200 30.200 30.038 0.162 18016
9664 1 17 . 1 1 85 85 ARG H H 85 9.090 9.090 8.487 0.603 18016
9665 1 17 . 1 1 86 86 ARG N N 86 115.600 115.600 118.244 -2.644 18016
9666 1 17 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.145 -0.265 18016
9667 1 17 . 1 1 86 86 ARG C C 86 179.000 179.000 178.654 0.346 18016
9668 1 17 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.031 0.369 18016
9669 1 17 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.507 0.893 18016
9670 1 17 . 1 1 86 86 ARG H H 86 8.660 8.660 8.503 0.157 18016
9671 1 17 . 1 1 87 87 HIS N N 87 118.000 118.000 120.130 -2.130 18016
9672 1 17 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.305 0.055 18016
9673 1 17 . 1 1 87 87 HIS C C 87 178.400 178.400 177.422 0.978 18016
9674 1 17 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.431 0.169 18016
9675 1 17 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.029 0.671 18016
9676 1 17 . 1 1 87 87 HIS H H 87 7.640 7.640 7.730 -0.090 18016
9677 1 17 . 1 1 88 88 LEU N N 88 119.600 119.600 118.768 0.832 18016
9678 1 17 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.144 -0.564 18016
9679 1 17 . 1 1 88 88 LEU C C 88 180.000 180.000 179.007 0.993 18016
9680 1 17 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.060 0.140 18016
9681 1 17 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.205 1.395 18016
9682 1 17 . 1 1 88 88 LEU H H 88 8.650 8.650 8.579 0.071 18016
9683 1 17 . 1 1 89 89 ALA N N 89 118.500 118.500 122.660 -4.160 18016
9684 1 17 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.812 0.548 18016
9685 1 17 . 1 1 89 89 ALA C C 89 180.400 180.400 180.033 0.367 18016
9686 1 17 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.806 -1.206 18016
9687 1 17 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.502 -0.402 18016
9688 1 17 . 1 1 89 89 ALA H H 89 8.870 8.870 8.370 0.500 18016
9689 1 17 . 1 1 90 90 LEU N N 90 119.400 119.400 117.514 1.886 18016
9690 1 17 . 1 1 90 90 LEU HA H 90 4.210 4.210 4.002 0.208 18016
9691 1 17 . 1 1 90 90 LEU C C 90 179.100 179.100 179.096 0.004 18016
9692 1 17 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.054 0.446 18016
9693 1 17 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.629 0.071 18016
9694 1 17 . 1 1 90 90 LEU H H 90 7.390 7.390 7.803 -0.413 18016
9695 1 17 . 1 1 91 91 GLN N N 91 114.500 114.500 116.018 -1.518 18016
9696 1 17 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.381 0.319 18016
9697 1 17 . 1 1 91 91 GLN C C 91 175.800 175.800 176.827 -1.027 18016
9698 1 17 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.129 -1.629 18016
9699 1 17 . 1 1 91 91 GLN CB C 91 28.100 28.100 29.983 -1.883 18016
9700 1 17 . 1 1 91 91 GLN H H 91 7.810 7.810 7.909 -0.099 18016
9701 1 17 . 1 1 92 92 GLY N N 92 107.900 107.900 105.245 2.655 18016
9702 1 17 . 1 1 92 92 GLY C C 92 172.100 172.100 171.704 0.396 18016
9703 1 17 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.108 -1.109 18016
9704 1 17 . 1 1 92 92 GLY H H 92 7.710 7.710 8.199 -0.489 18016
9705 1 17 . 1 1 93 93 TRP N N 93 114.200 114.200 121.849 -7.649 18016
9706 1 17 . 1 1 93 93 TRP CA C 93 56.000 56.000 55.001 0.999 18016
9707 1 17 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.567 -1.367 18016
9708 1 17 . 1 1 93 93 TRP H H 93 8.450 8.450 8.360 0.090 18016
9709 1 17 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.028 0.432 18016
9710 1 17 . 1 1 94 94 PRO CA C 94 62.800 62.800 64.103 -1.303 18016
9711 1 17 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.017 0.583 18016
9712 1 17 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.113 -0.613 18016
9713 1 17 . 1 1 95 95 LEU C C 95 175.000 175.000 177.959 -2.959 18016
9714 1 17 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.539 -0.439 18016
9715 1 17 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.687 1.413 18016
9716 1 17 . 1 1 96 96 ASP N N 96 114.000 114.000 119.156 -5.156 18016
9717 1 17 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.670 0.280 18016
9718 1 17 . 1 1 96 96 ASP C C 96 175.800 175.800 176.000 -0.200 18016
9719 1 17 . 1 1 96 96 ASP CA C 96 54.000 54.000 55.830 -1.830 18016
9720 1 17 . 1 1 96 96 ASP CB C 96 41.900 41.900 42.057 -0.157 18016
9721 1 17 . 1 1 96 96 ASP H H 96 7.230 7.230 7.685 -0.455 18016
9722 1 17 . 1 1 97 97 ASP N N 97 123.200 123.200 119.403 3.797 18016
9723 1 17 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.995 -0.385 18016
9724 1 17 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.409 2.091 18016
9725 1 17 . 1 1 97 97 ASP CB C 97 38.700 38.700 43.593 -4.893 18016
9726 1 17 . 1 1 97 97 ASP H H 97 7.420 7.420 7.782 -0.362 18016
9727 1 17 . 1 1 98 98 PRO HA H 98 4.290 4.290 4.975 -0.685 18016
9728 1 17 . 1 1 98 98 PRO C C 98 177.500 177.500 177.163 0.337 18016
9729 1 17 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.383 0.317 18016
9730 1 17 . 1 1 98 98 PRO CB C 98 31.900 31.900 33.531 -1.631 18016
9731 1 17 . 1 1 99 99 ARG N N 99 121.300 121.300 120.884 0.416 18016
9732 1 17 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.103 -0.393 18016
9733 1 17 . 1 1 99 99 ARG C C 99 176.500 176.500 176.466 0.034 18016
9734 1 17 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.877 -1.778 18016
9735 1 17 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.219 0.281 18016
9736 1 17 . 1 1 99 99 ARG H H 99 8.390 8.390 8.458 -0.068 18016
9737 1 17 . 1 1 100 100 ASP N N 100 119.600 119.600 119.447 0.153 18016
9738 1 17 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.611 -0.111 18016
9739 1 17 . 1 1 100 100 ASP C C 100 177.000 177.000 176.211 0.789 18016
9740 1 17 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.820 0.880 18016
9741 1 17 . 1 1 100 100 ASP CB C 100 40.900 40.900 41.906 -1.006 18016
9742 1 17 . 1 1 100 100 ASP H H 100 8.260 8.260 7.724 0.536 18016
9743 1 17 . 1 1 101 101 GLY N N 101 109.300 109.300 111.169 -1.869 18016
9744 1 17 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.985 0.415 18016
9745 1 17 . 1 1 101 101 GLY H H 101 8.450 8.450 8.440 0.010 18016
9746 1 17 . 1 1 102 102 GLU N N 102 119.800 119.800 121.283 -1.483 18016
9747 1 17 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.334 -0.024 18016
9748 1 17 . 1 1 102 102 GLU CA C 102 56.000 56.000 55.925 0.075 18016
9749 1 17 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.613 -0.113 18016
9750 1 17 . 1 1 102 102 GLU H H 102 8.140 8.140 7.988 0.152 18016
9751 1 17 . 1 1 103 103 GLU N N 103 123.000 123.000 126.037 -3.037 18016
9752 1 17 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.417 0.143 18016
9753 1 17 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.556 -0.256 18016
9754 1 17 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.687 -0.087 18016
9755 1 17 . 1 1 103 103 GLU H H 103 8.580 8.580 8.491 0.089 18016
9756 1 17 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.259 0.221 18016
9757 1 17 . 1 1 104 104 PRO C C 104 176.800 176.800 176.409 0.391 18016
9758 1 17 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.971 -0.571 18016
9759 1 17 . 1 1 104 104 PRO CB C 104 32.100 32.100 31.965 0.135 18016
9760 1 17 . 1 1 105 105 ASP N N 105 120.400 120.400 119.650 0.750 18016
9761 1 17 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.629 -0.049 18016
9762 1 17 . 1 1 105 105 ASP C C 105 177.100 177.100 176.246 0.854 18016
9763 1 17 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.598 -0.298 18016
9764 1 17 . 1 1 105 105 ASP CB C 105 41.400 41.400 40.030 1.370 18016
9765 1 17 . 1 1 105 105 ASP H H 105 8.500 8.500 8.129 0.371 18016
9766 1 17 . 1 1 106 106 GLY N N 106 109.300 109.300 110.700 -1.400 18016
9767 1 17 . 1 1 106 106 GLY C C 106 174.600 174.600 174.480 0.120 18016
9768 1 17 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.275 0.125 18016
9769 1 17 . 1 1 106 106 GLY H H 106 8.360 8.360 8.042 0.318 18016
9770 1 17 . 1 1 107 107 GLU N N 107 120.400 120.400 121.839 -1.439 18016
9771 1 17 . 1 1 107 107 GLU HA H 107 4.340 4.340 3.855 0.485 18016
9772 1 17 . 1 1 107 107 GLU C C 107 177.100 177.100 177.602 -0.502 18016
9773 1 17 . 1 1 107 107 GLU CA C 107 56.500 56.500 58.515 -2.015 18016
9774 1 17 . 1 1 107 107 GLU CB C 107 30.200 30.200 29.043 1.157 18016
9775 1 17 . 1 1 107 107 GLU H H 107 8.410 8.410 8.683 -0.273 18016
9776 1 17 . 1 1 108 108 SER N N 108 116.600 116.600 116.895 -0.295 18016
9777 1 17 . 1 1 108 108 SER HA H 108 4.450 4.450 4.117 0.333 18016
9778 1 17 . 1 1 108 108 SER C C 108 175.300 175.300 176.324 -1.024 18016
9779 1 17 . 1 1 108 108 SER CA C 108 58.700 58.700 60.795 -2.095 18016
9780 1 17 . 1 1 108 108 SER CB C 108 63.800 63.800 63.587 0.213 18016
9781 1 17 . 1 1 108 108 SER H H 108 8.460 8.460 8.331 0.129 18016
9782 1 17 . 1 1 109 109 GLY N N 109 110.800 110.800 110.165 0.635 18016
9783 1 17 . 1 1 109 109 GLY C C 109 174.500 174.500 174.300 0.200 18016
9784 1 17 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.295 0.005 18016
9785 1 17 . 1 1 109 109 GLY H H 109 8.500 8.500 8.588 -0.088 18016
9786 1 17 . 1 1 110 110 GLY N N 110 108.800 108.800 108.506 0.294 18016
9787 1 17 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.751 -0.351 18016
9788 1 17 . 1 1 110 110 GLY H H 110 8.140 8.140 7.744 0.396 18016
9789 1 17 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.476 0.134 18016
9790 1 17 . 1 1 111 111 PRO C C 111 176.000 176.000 176.810 -0.810 18016
9791 1 17 . 1 1 111 111 PRO CA C 111 62.600 62.600 63.933 -1.333 18016
9792 1 17 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.129 2.471 18016
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 95 2.191 0.345 2.175 18016
2 1 1 "Average Difference" HA 112 0.252 0.040 0.250 18016
3 1 1 "Average Difference" C 83 0.998 -0.086 1.000 18016
4 1 1 "Average Difference" CA 109 1.086 -0.061 1.089 18016
5 1 1 "Average Difference" CB 100 1.044 0.056 1.048 18016
6 1 1 "Average Difference" HN 95 0.436 -0.038 0.437 18016
7 1 2 "Average Difference" N 95 2.451 0.253 2.451 18016
8 1 2 "Average Difference" HA 112 0.282 -0.001 0.283 18016
9 1 2 "Average Difference" C 83 0.924 -0.005 0.930 18016
10 1 2 "Average Difference" CA 109 1.089 -0.050 1.093 18016
11 1 2 "Average Difference" CB 100 1.054 0.009 1.060 18016
12 1 2 "Average Difference" HN 95 0.455 -0.063 0.453 18016
13 1 3 "Average Difference" N 95 2.341 0.288 2.335 18016
14 1 3 "Average Difference" HA 112 0.245 0.012 0.246 18016
15 1 3 "Average Difference" C 83 0.983 -0.093 0.984 18016
16 1 3 "Average Difference" CA 109 1.149 -0.029 1.153 18016
17 1 3 "Average Difference" CB 100 1.136 0.056 1.141 18016
18 1 3 "Average Difference" HN 95 0.451 -0.044 0.452 18016
19 1 4 "Average Difference" N 95 2.379 0.183 2.384 18016
20 1 4 "Average Difference" HA 112 0.251 0.023 0.251 18016
21 1 4 "Average Difference" C 83 1.057 -0.175 1.048 18016
22 1 4 "Average Difference" CA 109 0.993 -0.205 0.976 18016
23 1 4 "Average Difference" CB 100 1.142 0.143 1.139 18016
24 1 4 "Average Difference" HN 95 0.442 -0.070 0.439 18016
25 1 5 "Average Difference" N 95 2.465 0.468 2.433 18016
26 1 5 "Average Difference" HA 112 0.246 0.029 0.245 18016
27 1 5 "Average Difference" C 83 0.943 -0.106 0.942 18016
28 1 5 "Average Difference" CA 109 1.172 -0.097 1.173 18016
29 1 5 "Average Difference" CB 100 1.150 0.098 1.152 18016
30 1 5 "Average Difference" HN 95 0.446 -0.081 0.441 18016
31 1 6 "Average Difference" N 95 2.319 0.087 2.329 18016
32 1 6 "Average Difference" HA 112 0.249 0.004 0.250 18016
33 1 6 "Average Difference" C 83 0.914 -0.053 0.918 18016
34 1 6 "Average Difference" CA 109 1.054 -0.009 1.059 18016
35 1 6 "Average Difference" CB 100 1.146 0.012 1.152 18016
36 1 6 "Average Difference" HN 95 0.440 -0.074 0.436 18016
37 1 7 "Average Difference" N 95 2.124 0.209 2.125 18016
38 1 7 "Average Difference" HA 112 0.231 0.036 0.229 18016
39 1 7 "Average Difference" C 83 0.975 -0.101 0.976 18016
40 1 7 "Average Difference" CA 109 1.094 -0.041 1.098 18016
41 1 7 "Average Difference" CB 100 1.182 0.004 1.188 18016
42 1 7 "Average Difference" HN 95 0.420 -0.049 0.419 18016
43 1 8 "Average Difference" N 95 2.449 0.094 2.460 18016
44 1 8 "Average Difference" HA 112 0.269 0.022 0.270 18016
45 1 8 "Average Difference" C 83 1.007 -0.100 1.008 18016
46 1 8 "Average Difference" CA 109 1.068 -0.055 1.072 18016
47 1 8 "Average Difference" CB 100 1.059 0.034 1.064 18016
48 1 8 "Average Difference" HN 95 0.422 -0.061 0.420 18016
49 1 9 "Average Difference" N 95 2.254 0.274 2.249 18016
50 1 9 "Average Difference" HA 112 0.252 0.036 0.250 18016
51 1 9 "Average Difference" C 83 1.009 -0.076 1.012 18016
52 1 9 "Average Difference" CA 109 1.153 -0.098 1.154 18016
53 1 9 "Average Difference" CB 100 1.136 0.071 1.139 18016
54 1 9 "Average Difference" HN 95 0.434 -0.053 0.433 18016
55 1 10 "Average Difference" N 95 2.452 0.303 2.447 18016
56 1 10 "Average Difference" HA 112 0.282 0.029 0.281 18016
57 1 10 "Average Difference" C 83 0.961 -0.083 0.963 18016
58 1 10 "Average Difference" CA 109 1.098 -0.099 1.099 18016
59 1 10 "Average Difference" CB 100 1.014 0.018 1.019 18016
60 1 10 "Average Difference" HN 95 0.434 -0.088 0.427 18016
61 1 11 "Average Difference" N 95 2.275 0.262 2.272 18016
62 1 11 "Average Difference" HA 112 0.255 0.016 0.255 18016
63 1 11 "Average Difference" C 83 0.999 -0.136 0.996 18016
64 1 11 "Average Difference" CA 109 1.052 -0.013 1.057 18016
65 1 11 "Average Difference" CB 100 1.050 0.074 1.053 18016
66 1 11 "Average Difference" HN 95 0.415 -0.067 0.411 18016
67 1 12 "Average Difference" N 95 2.444 0.327 2.435 18016
68 1 12 "Average Difference" HA 112 0.248 0.042 0.245 18016
69 1 12 "Average Difference" C 83 1.044 -0.190 1.032 18016
70 1 12 "Average Difference" CA 109 1.092 -0.075 1.095 18016
71 1 12 "Average Difference" CB 100 1.165 0.193 1.155 18016
72 1 12 "Average Difference" HN 95 0.460 -0.057 0.459 18016
73 1 13 "Average Difference" N 95 2.302 0.293 2.296 18016
74 1 13 "Average Difference" HA 112 0.267 0.039 0.265 18016
75 1 13 "Average Difference" C 83 0.928 -0.073 0.931 18016
76 1 13 "Average Difference" CA 109 1.106 -0.119 1.104 18016
77 1 13 "Average Difference" CB 100 1.131 0.177 1.123 18016
78 1 13 "Average Difference" HN 95 0.430 -0.046 0.430 18016
79 1 14 "Average Difference" N 95 2.181 0.271 2.175 18016
80 1 14 "Average Difference" HA 112 0.237 0.029 0.236 18016
81 1 14 "Average Difference" C 83 0.952 -0.112 0.951 18016
82 1 14 "Average Difference" CA 109 1.153 -0.120 1.152 18016
83 1 14 "Average Difference" CB 100 1.074 0.022 1.079 18016
84 1 14 "Average Difference" HN 95 0.449 -0.056 0.447 18016
85 1 15 "Average Difference" N 95 2.270 0.482 2.230 18016
86 1 15 "Average Difference" HA 112 0.260 0.031 0.260 18016
87 1 15 "Average Difference" C 83 0.950 -0.169 0.940 18016
88 1 15 "Average Difference" CA 109 1.050 -0.078 1.052 18016
89 1 15 "Average Difference" CB 100 1.198 0.106 1.199 18016
90 1 15 "Average Difference" HN 95 0.433 -0.062 0.431 18016
91 1 16 "Average Difference" N 95 2.396 0.312 2.388 18016
92 1 16 "Average Difference" HA 112 0.251 0.008 0.252 18016
93 1 16 "Average Difference" C 83 0.965 -0.009 0.971 18016
94 1 16 "Average Difference" CA 109 1.156 0.004 1.161 18016
95 1 16 "Average Difference" CB 100 1.038 0.028 1.043 18016
96 1 16 "Average Difference" HN 95 0.464 -0.072 0.461 18016
97 1 17 "Average Difference" N 95 2.202 0.318 2.191 18016
98 1 17 "Average Difference" HA 112 0.251 0.019 0.251 18016
99 1 17 "Average Difference" C 83 0.956 0.041 0.961 18016
100 1 17 "Average Difference" CA 109 1.141 0.069 1.144 18016
101 1 17 "Average Difference" CB 100 1.170 0.060 1.175 18016
102 1 17 "Average Difference" HN 95 0.425 -0.031 0.426 18016
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 18016
_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 4.560 -0.130 18016
2 1 . 1 1 2 2 PRO C C 2 177.600 177.600 176.676 0.924 18016
3 1 . 1 1 2 2 PRO CA C 2 63.300 63.300 62.721 0.578 18016
4 1 . 1 1 2 2 PRO CB C 2 32.300 32.300 32.150 0.149 18016
5 1 . 1 1 3 3 GLY N N 3 110.000 110.000 109.455 0.545 18016
6 1 . 1 1 3 3 GLY C C 3 174.200 174.200 173.856 0.344 18016
7 1 . 1 1 3 3 GLY CA C 3 45.400 45.400 45.186 0.214 18016
8 1 . 1 1 3 3 GLY H H 3 8.700 8.700 8.397 0.303 18016
9 1 . 1 1 4 4 SER N N 4 115.400 115.400 117.563 -2.163 18016
10 1 . 1 1 4 4 SER HA H 4 4.440 4.440 4.679 -0.239 18016
11 1 . 1 1 4 4 SER C C 4 174.800 174.800 174.269 0.531 18016
12 1 . 1 1 4 4 SER CA C 4 58.400 58.400 58.067 0.333 18016
13 1 . 1 1 4 4 SER CB C 4 63.800 63.800 63.939 -0.139 18016
14 1 . 1 1 4 4 SER H H 4 8.210 8.210 8.169 0.041 18016
15 1 . 1 1 5 5 MET N N 5 122.200 122.200 121.950 0.250 18016
16 1 . 1 1 5 5 MET HA H 5 4.510 4.510 4.657 -0.147 18016
17 1 . 1 1 5 5 MET CA C 5 55.600 55.600 55.769 -0.169 18016
18 1 . 1 1 5 5 MET CB C 5 32.900 32.900 33.733 -0.833 18016
19 1 . 1 1 5 5 MET H H 5 8.570 8.570 8.597 -0.027 18016
20 1 . 1 1 6 6 VAL N N 6 120.000 120.000 117.686 2.314 18016
21 1 . 1 1 6 6 VAL HA H 6 4.050 4.050 4.233 -0.183 18016
22 1 . 1 1 6 6 VAL C C 6 175.700 175.700 175.297 0.403 18016
23 1 . 1 1 6 6 VAL CA C 6 62.700 62.700 61.120 1.580 18016
24 1 . 1 1 6 6 VAL CB C 6 32.500 32.500 32.631 -0.131 18016
25 1 . 1 1 6 6 VAL H H 6 8.150 8.150 7.825 0.325 18016
26 1 . 1 1 7 7 ASN N N 7 122.000 122.000 118.617 3.383 18016
27 1 . 1 1 7 7 ASN HA H 7 4.660 4.660 4.586 0.074 18016
28 1 . 1 1 7 7 ASN C C 7 175.200 175.200 176.927 -1.727 18016
29 1 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.771 -0.571 18016
30 1 . 1 1 7 7 ASN CB C 7 38.900 38.900 39.458 -0.558 18016
31 1 . 1 1 7 7 ASN H H 7 8.010 8.010 8.367 -0.357 18016
32 1 . 1 1 8 8 ALA N N 8 126.500 126.500 126.048 0.452 18016
33 1 . 1 1 8 8 ALA C C 8 180.200 180.200 179.471 0.729 18016
34 1 . 1 1 8 8 ALA CA C 8 55.500 55.500 55.324 0.176 18016
35 1 . 1 1 8 8 ALA CB C 8 18.400 18.400 18.823 -0.423 18016
36 1 . 1 1 8 8 ALA H H 8 9.020 9.020 8.746 0.274 18016
37 1 . 1 1 9 9 PHE N N 9 121.300 121.300 119.134 2.166 18016
38 1 . 1 1 9 9 PHE HA H 9 4.290 4.290 4.093 0.197 18016
39 1 . 1 1 9 9 PHE C C 9 177.200 177.200 177.137 0.063 18016
40 1 . 1 1 9 9 PHE CA C 9 61.300 61.300 61.636 -0.336 18016
41 1 . 1 1 9 9 PHE CB C 9 39.200 39.200 38.988 0.212 18016
42 1 . 1 1 9 9 PHE H H 9 8.570 8.570 8.254 0.316 18016
43 1 . 1 1 10 10 LEU N N 10 117.200 117.200 119.305 -2.105 18016
44 1 . 1 1 10 10 LEU HA H 10 3.700 3.700 3.974 -0.274 18016
45 1 . 1 1 10 10 LEU C C 10 179.700 179.700 179.145 0.555 18016
46 1 . 1 1 10 10 LEU CA C 10 57.600 57.600 57.577 0.023 18016
47 1 . 1 1 10 10 LEU CB C 10 40.700 40.700 40.475 0.225 18016
48 1 . 1 1 10 10 LEU H H 10 8.150 8.150 7.919 0.231 18016
49 1 . 1 1 11 11 ALA N N 11 121.500 121.500 122.129 -0.629 18016
50 1 . 1 1 11 11 ALA HA H 11 4.020 4.020 3.929 0.091 18016
51 1 . 1 1 11 11 ALA C C 11 180.900 180.900 179.535 1.365 18016
52 1 . 1 1 11 11 ALA CA C 11 55.000 55.000 55.413 -0.413 18016
53 1 . 1 1 11 11 ALA CB C 11 18.000 18.000 18.114 -0.114 18016
54 1 . 1 1 11 11 ALA H H 11 8.460 8.460 8.689 -0.229 18016
55 1 . 1 1 12 12 LYS N N 12 120.700 120.700 119.209 1.491 18016
56 1 . 1 1 12 12 LYS HA H 12 4.050 4.050 4.036 0.014 18016
57 1 . 1 1 12 12 LYS C C 12 179.700 179.700 178.887 0.813 18016
58 1 . 1 1 12 12 LYS CA C 12 59.200 59.200 58.986 0.214 18016
59 1 . 1 1 12 12 LYS CB C 12 31.600 31.600 32.082 -0.482 18016
60 1 . 1 1 12 12 LYS H H 12 7.820 7.820 7.749 0.071 18016
61 1 . 1 1 13 13 ILE N N 13 120.100 120.100 119.657 0.443 18016
62 1 . 1 1 13 13 ILE HA H 13 3.690 3.690 3.818 -0.128 18016
63 1 . 1 1 13 13 ILE C C 13 178.100 178.100 178.163 -0.063 18016
64 1 . 1 1 13 13 ILE CA C 13 63.000 63.000 63.818 -0.818 18016
65 1 . 1 1 13 13 ILE CB C 13 35.400 35.400 36.602 -1.202 18016
66 1 . 1 1 13 13 ILE H H 13 7.640 7.640 7.925 -0.285 18016
67 1 . 1 1 14 14 ALA N N 14 122.700 122.700 122.267 0.433 18016
68 1 . 1 1 14 14 ALA HA H 14 3.860 3.860 3.965 -0.105 18016
69 1 . 1 1 14 14 ALA C C 14 179.000 179.000 179.576 -0.576 18016
70 1 . 1 1 14 14 ALA CA C 14 56.000 56.000 55.466 0.534 18016
71 1 . 1 1 14 14 ALA CB C 14 18.000 18.000 18.048 -0.048 18016
72 1 . 1 1 14 14 ALA H H 14 8.680 8.680 8.461 0.219 18016
73 1 . 1 1 15 15 ALA N N 15 118.700 118.700 121.653 -2.953 18016
74 1 . 1 1 15 15 ALA HA H 15 4.090 4.090 4.073 0.017 18016
75 1 . 1 1 15 15 ALA C C 15 180.400 180.400 178.995 1.405 18016
76 1 . 1 1 15 15 ALA CA C 15 55.000 55.000 54.818 0.182 18016
77 1 . 1 1 15 15 ALA CB C 15 17.700 17.700 18.431 -0.731 18016
78 1 . 1 1 15 15 ALA H H 15 8.070 8.070 8.122 -0.052 18016
79 1 . 1 1 16 16 TRP N N 16 122.900 122.900 121.240 1.660 18016
80 1 . 1 1 16 16 TRP HA H 16 4.560 4.560 4.251 0.309 18016
81 1 . 1 1 16 16 TRP C C 16 178.400 178.400 178.012 0.388 18016
82 1 . 1 1 16 16 TRP CA C 16 59.600 59.600 61.299 -1.699 18016
83 1 . 1 1 16 16 TRP CB C 16 28.300 28.300 29.137 -0.837 18016
84 1 . 1 1 16 16 TRP H H 16 7.820 7.820 8.256 -0.436 18016
85 1 . 1 1 17 17 LEU N N 17 120.400 120.400 119.180 1.220 18016
86 1 . 1 1 17 17 LEU HA H 17 3.610 3.610 3.199 0.411 18016
87 1 . 1 1 17 17 LEU C C 17 179.000 179.000 178.705 0.295 18016
88 1 . 1 1 17 17 LEU CA C 17 57.900 57.900 57.718 0.182 18016
89 1 . 1 1 17 17 LEU CB C 17 42.000 42.000 41.571 0.429 18016
90 1 . 1 1 17 17 LEU H H 17 8.630 8.630 8.455 0.175 18016
91 1 . 1 1 18 18 ASN N N 18 116.200 116.200 117.050 -0.850 18016
92 1 . 1 1 18 18 ASN HA H 18 4.310 4.310 4.505 -0.195 18016
93 1 . 1 1 18 18 ASN C C 18 177.100 177.100 176.997 0.103 18016
94 1 . 1 1 18 18 ASN CA C 18 55.600 55.600 55.848 -0.248 18016
95 1 . 1 1 18 18 ASN CB C 18 39.200 39.200 38.898 0.302 18016
96 1 . 1 1 18 18 ASN H H 18 8.350 8.350 8.350 -0.000 18016
97 1 . 1 1 19 19 ALA N N 19 119.600 119.600 120.417 -0.817 18016
98 1 . 1 1 19 19 ALA HA H 19 4.090 4.090 4.229 -0.139 18016
99 1 . 1 1 19 19 ALA C C 19 180.100 180.100 178.898 1.202 18016
100 1 . 1 1 19 19 ALA CA C 19 54.200 54.200 54.142 0.058 18016
101 1 . 1 1 19 19 ALA CB C 19 17.600 17.600 18.531 -0.931 18016
102 1 . 1 1 19 19 ALA H H 19 7.920 7.920 8.048 -0.128 18016
103 1 . 1 1 20 20 GLY N N 20 103.500 103.500 105.417 -1.917 18016
104 1 . 1 1 20 20 GLY C C 20 173.800 173.800 173.922 -0.122 18016
105 1 . 1 1 20 20 GLY CA C 20 45.800 45.800 45.284 0.516 18016
106 1 . 1 1 20 20 GLY H H 20 7.700 7.700 7.422 0.278 18016
107 1 . 1 1 21 21 TYR N N 21 119.900 119.900 118.166 1.734 18016
108 1 . 1 1 21 21 TYR HA H 21 5.170 5.170 4.963 0.207 18016
109 1 . 1 1 21 21 TYR CA C 21 56.400 56.400 54.911 1.489 18016
110 1 . 1 1 21 21 TYR CB C 21 37.800 37.800 38.694 -0.894 18016
111 1 . 1 1 21 21 TYR H H 21 7.980 7.980 7.969 0.011 18016
112 1 . 1 1 22 22 PRO HA H 22 4.500 4.500 4.471 0.029 18016
113 1 . 1 1 22 22 PRO C C 22 178.700 178.700 177.035 1.665 18016
114 1 . 1 1 22 22 PRO CA C 22 65.000 65.000 64.296 0.704 18016
115 1 . 1 1 22 22 PRO CB C 22 32.000 32.000 32.194 -0.194 18016
116 1 . 1 1 23 23 GLU N N 23 116.300 116.300 117.272 -0.972 18016
117 1 . 1 1 23 23 GLU HA H 23 4.570 4.570 4.382 0.188 18016
118 1 . 1 1 23 23 GLU C C 23 176.300 176.300 176.457 -0.157 18016
119 1 . 1 1 23 23 GLU CA C 23 54.600 54.600 55.850 -1.250 18016
120 1 . 1 1 23 23 GLU CB C 23 29.500 29.500 29.583 -0.083 18016
121 1 . 1 1 23 23 GLU H H 23 8.680 8.680 8.233 0.447 18016
122 1 . 1 1 24 24 GLY N N 24 108.100 108.100 108.332 -0.232 18016
123 1 . 1 1 24 24 GLY C C 24 173.100 173.100 172.684 0.416 18016
124 1 . 1 1 24 24 GLY CA C 24 42.900 42.900 44.536 -1.636 18016
125 1 . 1 1 24 24 GLY H H 24 7.230 7.230 7.606 -0.376 18016
126 1 . 1 1 25 25 VAL N N 25 121.500 121.500 120.287 1.213 18016
127 1 . 1 1 25 25 VAL HA H 25 3.590 3.590 3.873 -0.283 18016
128 1 . 1 1 25 25 VAL CA C 25 59.300 59.300 58.461 0.839 18016
129 1 . 1 1 25 25 VAL CB C 25 32.100 32.100 32.414 -0.314 18016
130 1 . 1 1 25 25 VAL H H 25 8.050 8.050 7.995 0.055 18016
131 1 . 1 1 26 26 PRO HA H 26 4.320 4.320 4.454 -0.134 18016
132 1 . 1 1 26 26 PRO C C 26 177.600 177.600 177.944 -0.344 18016
133 1 . 1 1 26 26 PRO CA C 26 62.900 62.900 62.501 0.399 18016
134 1 . 1 1 26 26 PRO CB C 26 33.100 33.100 33.022 0.078 18016
135 1 . 1 1 27 27 GLY N N 27 109.000 109.000 109.373 -0.373 18016
136 1 . 1 1 27 27 GLY CA C 27 49.100 49.100 47.737 1.363 18016
137 1 . 1 1 27 27 GLY H H 27 8.930 8.930 8.823 0.107 18016
138 1 . 1 1 28 28 PRO HA H 28 4.390 4.390 4.293 0.097 18016
139 1 . 1 1 28 28 PRO C C 28 175.800 175.800 176.843 -1.043 18016
140 1 . 1 1 28 28 PRO CA C 28 64.400 64.400 64.717 -0.317 18016
141 1 . 1 1 28 28 PRO CB C 28 31.900 31.900 31.443 0.457 18016
142 1 . 1 1 29 29 ASP N N 29 115.000 115.000 116.804 -1.804 18016
143 1 . 1 1 29 29 ASP HA H 29 4.490 4.490 4.734 -0.244 18016
144 1 . 1 1 29 29 ASP C C 29 177.000 177.000 177.925 -0.925 18016
145 1 . 1 1 29 29 ASP CA C 29 53.900 53.900 55.975 -2.075 18016
146 1 . 1 1 29 29 ASP CB C 29 40.700 40.700 41.518 -0.818 18016
147 1 . 1 1 29 29 ASP H H 29 7.760 7.760 7.869 -0.109 18016
148 1 . 1 1 30 30 ARG N N 30 119.900 119.900 121.688 -1.788 18016
149 1 . 1 1 30 30 ARG HA H 30 3.570 3.570 3.900 -0.330 18016
150 1 . 1 1 30 30 ARG C C 30 176.500 176.500 178.512 -2.012 18016
151 1 . 1 1 30 30 ARG CA C 30 61.900 61.900 59.890 2.010 18016
152 1 . 1 1 30 30 ARG CB C 30 30.500 30.500 30.265 0.235 18016
153 1 . 1 1 30 30 ARG H H 30 7.460 7.460 8.117 -0.657 18016
154 1 . 1 1 31 31 VAL N N 31 117.600 117.600 119.779 -2.179 18016
155 1 . 1 1 31 31 VAL HA H 31 3.820 3.820 3.869 -0.049 18016
156 1 . 1 1 31 31 VAL CA C 31 68.700 68.700 68.349 0.351 18016
157 1 . 1 1 31 31 VAL CB C 31 28.800 28.800 29.144 -0.344 18016
158 1 . 1 1 31 31 VAL H H 31 9.080 9.080 8.242 0.838 18016
159 1 . 1 1 32 32 PRO C C 32 177.000 177.000 178.752 -1.752 18016
160 1 . 1 1 32 32 PRO CA C 32 65.200 65.200 65.888 -0.688 18016
161 1 . 1 1 32 32 PRO CB C 32 30.800 30.800 31.226 -0.426 18016
162 1 . 1 1 33 33 LEU N N 33 115.200 115.200 120.959 -5.759 18016
163 1 . 1 1 33 33 LEU HA H 33 4.120 4.120 4.100 0.020 18016
164 1 . 1 1 33 33 LEU C C 33 178.600 178.600 178.516 0.084 18016
165 1 . 1 1 33 33 LEU CA C 33 58.400 58.400 58.055 0.346 18016
166 1 . 1 1 33 33 LEU CB C 33 41.500 41.500 41.323 0.177 18016
167 1 . 1 1 33 33 LEU H H 33 8.010 8.010 8.122 -0.112 18016
168 1 . 1 1 34 34 LEU N N 34 120.400 120.400 119.140 1.260 18016
169 1 . 1 1 34 34 LEU HA H 34 3.930 3.930 4.062 -0.132 18016
170 1 . 1 1 34 34 LEU CA C 34 58.100 58.100 57.539 0.561 18016
171 1 . 1 1 34 34 LEU CB C 34 40.900 40.900 40.316 0.584 18016
172 1 . 1 1 34 34 LEU H H 34 8.220 8.220 8.355 -0.135 18016
173 1 . 1 1 35 35 ALA N N 35 123.100 123.100 122.737 0.363 18016
174 1 . 1 1 35 35 ALA HA H 35 4.040 4.040 4.067 -0.027 18016
175 1 . 1 1 35 35 ALA C C 35 179.500 179.500 179.438 0.062 18016
176 1 . 1 1 35 35 ALA CA C 35 55.500 55.500 55.059 0.441 18016
177 1 . 1 1 35 35 ALA CB C 35 17.900 17.900 18.430 -0.530 18016
178 1 . 1 1 35 35 ALA H H 35 8.560 8.560 8.057 0.503 18016
179 1 . 1 1 36 36 LEU N N 36 117.600 117.600 118.924 -1.324 18016
180 1 . 1 1 36 36 LEU HA H 36 4.120 4.120 4.263 -0.143 18016
181 1 . 1 1 36 36 LEU C C 36 180.100 180.100 179.238 0.862 18016
182 1 . 1 1 36 36 LEU CA C 36 58.200 58.200 57.578 0.622 18016
183 1 . 1 1 36 36 LEU CB C 36 42.800 42.800 41.751 1.049 18016
184 1 . 1 1 36 36 LEU H H 36 7.850 7.850 8.008 -0.158 18016
185 1 . 1 1 37 37 LEU N N 37 116.700 116.700 120.104 -3.404 18016
186 1 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.063 0.037 18016
187 1 . 1 1 37 37 LEU C C 37 180.100 180.100 178.759 1.341 18016
188 1 . 1 1 37 37 LEU CA C 37 58.300 58.300 58.205 0.095 18016
189 1 . 1 1 37 37 LEU CB C 37 42.200 42.200 41.761 0.439 18016
190 1 . 1 1 37 37 LEU H H 37 8.730 8.730 8.402 0.328 18016
191 1 . 1 1 38 38 THR N N 38 110.600 110.600 108.926 1.674 18016
192 1 . 1 1 38 38 THR HA H 38 4.440 4.440 4.126 0.314 18016
193 1 . 1 1 38 38 THR C C 38 175.100 175.100 176.104 -1.004 18016
194 1 . 1 1 38 38 THR CA C 38 64.200 64.200 64.301 -0.101 18016
195 1 . 1 1 38 38 THR CB C 38 70.000 70.000 68.580 1.420 18016
196 1 . 1 1 38 38 THR H H 38 8.660 8.660 8.425 0.235 18016
197 1 . 1 1 39 39 ARG N N 39 118.000 118.000 120.986 -2.986 18016
198 1 . 1 1 39 39 ARG HA H 39 4.280 4.280 4.159 0.121 18016
199 1 . 1 1 39 39 ARG C C 39 177.300 177.300 177.698 -0.398 18016
200 1 . 1 1 39 39 ARG CA C 39 58.300 58.300 58.130 0.170 18016
201 1 . 1 1 39 39 ARG CB C 39 30.200 30.200 30.028 0.172 18016
202 1 . 1 1 39 39 ARG H H 39 7.180 7.180 7.592 -0.412 18016
203 1 . 1 1 40 40 ARG N N 40 114.400 114.400 116.712 -2.312 18016
204 1 . 1 1 40 40 ARG C C 40 174.800 174.800 175.746 -0.946 18016
205 1 . 1 1 40 40 ARG CA C 40 55.300 55.300 55.990 -0.690 18016
206 1 . 1 1 40 40 ARG CB C 40 34.600 34.600 31.197 3.403 18016
207 1 . 1 1 40 40 ARG H H 40 7.520 7.520 7.740 -0.220 18016
208 1 . 1 1 41 41 LEU N N 41 119.400 119.400 121.016 -1.616 18016
209 1 . 1 1 41 41 LEU C C 41 177.100 177.100 176.710 0.390 18016
210 1 . 1 1 41 41 LEU CA C 41 53.700 53.700 54.817 -1.117 18016
211 1 . 1 1 41 41 LEU CB C 41 44.400 44.400 43.955 0.445 18016
212 1 . 1 1 41 41 LEU H H 41 8.380 8.380 7.754 0.626 18016
213 1 . 1 1 42 42 THR N N 42 112.000 112.000 114.889 -2.889 18016
214 1 . 1 1 42 42 THR HA H 42 4.440 4.440 4.443 -0.003 18016
215 1 . 1 1 42 42 THR C C 42 175.800 175.800 175.507 0.293 18016
216 1 . 1 1 42 42 THR CA C 42 60.500 60.500 60.707 -0.207 18016
217 1 . 1 1 42 42 THR CB C 42 70.800 70.800 70.389 0.411 18016
218 1 . 1 1 42 42 THR H H 42 9.330 9.330 8.846 0.484 18016
219 1 . 1 1 43 43 ASN N N 43 119.900 119.900 120.057 -0.157 18016
220 1 . 1 1 43 43 ASN HA H 43 4.250 4.250 4.384 -0.134 18016
221 1 . 1 1 43 43 ASN C C 43 177.900 177.900 177.272 0.628 18016
222 1 . 1 1 43 43 ASN CA C 43 56.700 56.700 57.120 -0.420 18016
223 1 . 1 1 43 43 ASN CB C 43 37.200 37.200 38.209 -1.009 18016
224 1 . 1 1 43 43 ASN H H 43 9.140 9.140 8.805 0.335 18016
225 1 . 1 1 44 44 ASP N N 44 118.000 118.000 119.569 -1.569 18016
226 1 . 1 1 44 44 ASP HA H 44 4.400 4.400 4.380 0.020 18016
227 1 . 1 1 44 44 ASP C C 44 179.600 179.600 178.385 1.215 18016
228 1 . 1 1 44 44 ASP CB C 44 40.300 40.300 40.639 -0.339 18016
229 1 . 1 1 44 44 ASP H H 44 8.360 8.360 8.684 -0.324 18016
230 1 . 1 1 45 45 GLU N N 45 122.600 122.600 120.227 2.373 18016
231 1 . 1 1 45 45 GLU HA H 45 3.970 3.970 4.052 -0.082 18016
232 1 . 1 1 45 45 GLU CA C 45 59.400 59.400 59.198 0.202 18016
233 1 . 1 1 45 45 GLU CB C 45 30.300 30.300 29.822 0.478 18016
234 1 . 1 1 45 45 GLU H H 45 7.850 7.850 7.670 0.180 18016
235 1 . 1 1 46 46 ILE N N 46 118.900 118.900 120.688 -1.788 18016
236 1 . 1 1 46 46 ILE HA H 46 3.430 3.430 3.754 -0.324 18016
237 1 . 1 1 46 46 ILE CA C 46 66.000 66.000 64.235 1.765 18016
238 1 . 1 1 46 46 ILE CB C 46 37.700 37.700 37.757 -0.057 18016
239 1 . 1 1 46 46 ILE H H 46 8.290 8.290 8.310 -0.020 18016
240 1 . 1 1 47 47 LYS N N 47 118.900 118.900 119.425 -0.525 18016
241 1 . 1 1 47 47 LYS HA H 47 3.870 3.870 3.934 -0.064 18016
242 1 . 1 1 47 47 LYS C C 47 178.400 178.400 178.834 -0.434 18016
243 1 . 1 1 47 47 LYS CA C 47 60.300 60.300 59.828 0.472 18016
244 1 . 1 1 47 47 LYS CB C 47 32.600 32.600 32.209 0.391 18016
245 1 . 1 1 47 47 LYS H H 47 8.290 8.290 8.175 0.115 18016
246 1 . 1 1 48 48 ALA N N 48 121.100 121.100 123.003 -1.903 18016
247 1 . 1 1 48 48 ALA HA H 48 4.170 4.170 4.055 0.115 18016
248 1 . 1 1 48 48 ALA CA C 48 55.100 55.100 55.167 -0.067 18016
249 1 . 1 1 48 48 ALA CB C 48 18.000 18.000 18.205 -0.205 18016
250 1 . 1 1 48 48 ALA H H 48 7.710 7.710 8.126 -0.416 18016
251 1 . 1 1 49 49 ILE N N 49 119.900 119.900 118.001 1.899 18016
252 1 . 1 1 49 49 ILE HA H 49 3.650 3.650 3.734 -0.084 18016
253 1 . 1 1 49 49 ILE C C 49 177.300 177.300 178.048 -0.748 18016
254 1 . 1 1 49 49 ILE CA C 49 65.000 65.000 63.408 1.592 18016
255 1 . 1 1 49 49 ILE CB C 49 38.100 38.100 36.432 1.668 18016
256 1 . 1 1 49 49 ILE H H 49 8.130 8.130 8.251 -0.121 18016
257 1 . 1 1 50 50 ALA N N 50 122.000 122.000 122.636 -0.636 18016
258 1 . 1 1 50 50 ALA HA H 50 3.860 3.860 3.974 -0.114 18016
259 1 . 1 1 50 50 ALA C C 50 179.800 179.800 179.789 0.011 18016
260 1 . 1 1 50 50 ALA CA C 50 55.700 55.700 55.375 0.325 18016
261 1 . 1 1 50 50 ALA CB C 50 17.900 17.900 18.129 -0.229 18016
262 1 . 1 1 50 50 ALA H H 50 8.730 8.730 7.702 1.028 18016
263 1 . 1 1 51 51 GLU N N 51 116.900 116.900 118.100 -1.200 18016
264 1 . 1 1 51 51 GLU HA H 51 4.020 4.020 4.017 0.003 18016
265 1 . 1 1 51 51 GLU CA C 51 59.400 59.400 59.330 0.070 18016
266 1 . 1 1 51 51 GLU CB C 51 29.500 29.500 29.301 0.199 18016
267 1 . 1 1 51 51 GLU H H 51 8.220 8.220 8.396 -0.176 18016
268 1 . 1 1 52 52 ASP N N 52 120.300 120.300 119.868 0.432 18016
269 1 . 1 1 52 52 ASP HA H 52 4.390 4.390 4.473 -0.083 18016
270 1 . 1 1 52 52 ASP C C 52 178.900 178.900 178.739 0.161 18016
271 1 . 1 1 52 52 ASP CA C 52 57.500 57.500 56.977 0.523 18016
272 1 . 1 1 52 52 ASP CB C 52 42.500 42.500 41.074 1.426 18016
273 1 . 1 1 52 52 ASP H H 52 7.700 7.700 7.916 -0.216 18016
274 1 . 1 1 53 53 LEU N N 53 118.300 118.300 119.955 -1.655 18016
275 1 . 1 1 53 53 LEU HA H 53 3.730 3.730 3.976 -0.246 18016
276 1 . 1 1 53 53 LEU C C 53 179.000 179.000 178.961 0.039 18016
277 1 . 1 1 53 53 LEU CA C 53 57.500 57.500 57.577 -0.077 18016
278 1 . 1 1 53 53 LEU CB C 53 41.100 41.100 41.852 -0.752 18016
279 1 . 1 1 53 53 LEU H H 53 8.290 8.290 7.863 0.427 18016
280 1 . 1 1 54 54 GLU N N 54 118.700 118.700 118.132 0.568 18016
281 1 . 1 1 54 54 GLU HA H 54 4.220 4.220 4.037 0.183 18016
282 1 . 1 1 54 54 GLU C C 54 178.200 178.200 177.671 0.529 18016
283 1 . 1 1 54 54 GLU CA C 54 58.700 58.700 58.521 0.179 18016
284 1 . 1 1 54 54 GLU CB C 54 29.900 29.900 29.023 0.877 18016
285 1 . 1 1 54 54 GLU H H 54 8.070 8.070 8.444 -0.374 18016
286 1 . 1 1 55 55 LYS N N 55 117.700 117.700 117.344 0.356 18016
287 1 . 1 1 55 55 LYS HA H 55 4.150 4.150 4.072 0.078 18016
288 1 . 1 1 55 55 LYS CA C 55 58.300 58.300 57.924 0.376 18016
289 1 . 1 1 55 55 LYS CB C 55 32.700 32.700 32.357 0.343 18016
290 1 . 1 1 55 55 LYS H H 55 7.750 7.750 7.535 0.215 18016
291 1 . 1 1 56 56 ARG N N 56 117.100 117.100 117.436 -0.336 18016
292 1 . 1 1 56 56 ARG HA H 56 4.270 4.270 4.220 0.050 18016
293 1 . 1 1 56 56 ARG CA C 56 56.800 56.800 57.538 -0.738 18016
294 1 . 1 1 56 56 ARG CB C 56 31.000 31.000 31.264 -0.264 18016
295 1 . 1 1 56 56 ARG H H 56 8.270 8.270 7.621 0.649 18016
296 1 . 1 1 57 57 ALA HA H 57 4.360 4.360 4.412 -0.052 18016
297 1 . 1 1 57 57 ALA CA C 57 52.100 52.100 52.010 0.090 18016
298 1 . 1 1 57 57 ALA CB C 57 19.200 19.200 20.322 -1.122 18016
299 1 . 1 1 58 58 HIS HA H 58 4.510 4.510 4.648 -0.138 18016
300 1 . 1 1 58 58 HIS CA C 58 56.200 56.200 55.870 0.330 18016
301 1 . 1 1 58 58 HIS CB C 58 27.300 27.300 29.547 -2.247 18016
302 1 . 1 1 59 59 PHE N N 59 120.400 120.400 120.822 -0.422 18016
303 1 . 1 1 59 59 PHE C C 59 175.500 175.500 175.642 -0.142 18016
304 1 . 1 1 59 59 PHE CA C 59 57.200 57.200 57.390 -0.190 18016
305 1 . 1 1 59 59 PHE CB C 59 39.300 39.300 39.196 0.104 18016
306 1 . 1 1 59 59 PHE H H 59 7.710 7.710 8.169 -0.459 18016
307 1 . 1 1 60 60 ASP N N 60 120.800 120.800 120.801 -0.001 18016
308 1 . 1 1 60 60 ASP HA H 60 4.490 4.490 4.450 0.040 18016
309 1 . 1 1 60 60 ASP CA C 60 54.300 54.300 54.890 -0.590 18016
310 1 . 1 1 60 60 ASP CB C 60 41.100 41.100 41.210 -0.110 18016
311 1 . 1 1 60 60 ASP H H 60 8.180 8.180 8.222 -0.042 18016
312 1 . 1 1 61 61 HIS N N 61 118.300 118.300 118.151 0.149 18016
313 1 . 1 1 61 61 HIS HA H 61 4.390 4.390 4.616 -0.226 18016
314 1 . 1 1 61 61 HIS CA C 61 56.700 56.700 56.542 0.158 18016
315 1 . 1 1 61 61 HIS CB C 61 28.800 28.800 30.263 -1.463 18016
316 1 . 1 1 61 61 HIS H H 61 8.550 8.550 8.371 0.179 18016
317 1 . 1 1 62 62 ILE HA H 62 4.010 4.010 4.183 -0.173 18016
318 1 . 1 1 62 62 ILE C C 62 173.800 173.800 175.269 -1.469 18016
319 1 . 1 1 62 62 ILE CA C 62 66.500 66.500 60.746 5.754 18016
320 1 . 1 1 62 62 ILE CB C 62 40.100 40.100 37.912 2.188 18016
321 1 . 1 1 63 63 ASP N N 63 125.100 125.100 121.550 3.550 18016
322 1 . 1 1 63 63 ASP HA H 63 4.600 4.600 4.349 0.251 18016
323 1 . 1 1 63 63 ASP CA C 63 52.800 52.800 55.293 -2.493 18016
324 1 . 1 1 63 63 ASP CB C 63 40.500 40.500 41.780 -1.280 18016
325 1 . 1 1 63 63 ASP H H 63 8.360 8.360 7.759 0.601 18016
326 1 . 1 1 64 64 ILE HA H 64 3.670 3.670 3.926 -0.256 18016
327 1 . 1 1 64 64 ILE C C 64 177.000 177.000 176.732 0.268 18016
328 1 . 1 1 64 64 ILE CA C 64 62.100 62.100 63.223 -1.123 18016
329 1 . 1 1 64 64 ILE CB C 64 36.600 36.600 38.372 -1.772 18016
330 1 . 1 1 65 65 GLY N N 65 107.600 107.600 107.572 0.028 18016
331 1 . 1 1 65 65 GLY C C 65 177.000 177.000 175.935 1.065 18016
332 1 . 1 1 65 65 GLY CA C 65 47.300 47.300 46.903 0.397 18016
333 1 . 1 1 65 65 GLY H H 65 8.440 8.440 7.966 0.474 18016
334 1 . 1 1 66 66 VAL N N 66 121.800 121.800 122.331 -0.531 18016
335 1 . 1 1 66 66 VAL HA H 66 3.760 3.760 3.697 0.063 18016
336 1 . 1 1 66 66 VAL C C 66 178.500 178.500 177.524 0.976 18016
337 1 . 1 1 66 66 VAL CA C 66 65.600 65.600 65.212 0.388 18016
338 1 . 1 1 66 66 VAL CB C 66 32.000 32.000 31.800 0.200 18016
339 1 . 1 1 66 66 VAL H H 66 7.550 7.550 8.057 -0.507 18016
340 1 . 1 1 67 67 LEU N N 67 120.900 120.900 119.160 1.740 18016
341 1 . 1 1 67 67 LEU HA H 67 4.070 4.070 4.036 0.034 18016
342 1 . 1 1 67 67 LEU C C 67 179.000 179.000 179.187 -0.187 18016
343 1 . 1 1 67 67 LEU CA C 67 57.600 57.600 57.696 -0.096 18016
344 1 . 1 1 67 67 LEU CB C 67 42.300 42.300 40.468 1.832 18016
345 1 . 1 1 67 67 LEU H H 67 7.650 7.650 7.485 0.165 18016
346 1 . 1 1 68 68 ILE N N 68 118.900 118.900 117.930 0.970 18016
347 1 . 1 1 68 68 ILE HA H 68 3.710 3.710 3.783 -0.073 18016
348 1 . 1 1 68 68 ILE C C 68 179.500 179.500 178.355 1.145 18016
349 1 . 1 1 68 68 ILE CA C 68 65.200 65.200 64.891 0.309 18016
350 1 . 1 1 68 68 ILE CB C 68 37.500 37.500 37.455 0.045 18016
351 1 . 1 1 68 68 ILE H H 68 8.580 8.580 7.559 1.021 18016
352 1 . 1 1 69 69 THR N N 69 118.100 118.100 114.653 3.447 18016
353 1 . 1 1 69 69 THR HA H 69 3.940 3.940 4.053 -0.113 18016
354 1 . 1 1 69 69 THR C C 69 176.200 176.200 176.189 0.011 18016
355 1 . 1 1 69 69 THR CA C 69 66.600 66.600 66.086 0.514 18016
356 1 . 1 1 69 69 THR CB C 69 68.500 68.500 68.391 0.109 18016
357 1 . 1 1 69 69 THR H H 69 7.840 7.840 7.695 0.145 18016
358 1 . 1 1 70 70 GLN N N 70 121.600 121.600 120.369 1.231 18016
359 1 . 1 1 70 70 GLN HA H 70 4.110 4.110 4.152 -0.042 18016
360 1 . 1 1 70 70 GLN C C 70 178.100 178.100 178.075 0.025 18016
361 1 . 1 1 70 70 GLN CA C 70 59.100 59.100 58.596 0.504 18016
362 1 . 1 1 70 70 GLN CB C 70 28.300 28.300 28.706 -0.406 18016
363 1 . 1 1 70 70 GLN H H 70 8.100 8.100 7.446 0.654 18016
364 1 . 1 1 71 71 MET N N 71 118.700 118.700 118.466 0.234 18016
365 1 . 1 1 71 71 MET HA H 71 4.010 4.010 4.391 -0.381 18016
366 1 . 1 1 71 71 MET C C 71 176.300 176.300 178.418 -2.118 18016
367 1 . 1 1 71 71 MET CA C 71 58.100 58.100 58.994 -0.894 18016
368 1 . 1 1 71 71 MET CB C 71 33.600 33.600 32.746 0.854 18016
369 1 . 1 1 71 71 MET H H 71 8.350 8.350 8.519 -0.169 18016
370 1 . 1 1 72 72 THR N N 72 111.600 111.600 111.519 0.081 18016
371 1 . 1 1 72 72 THR HA H 72 3.940 3.940 4.127 -0.187 18016
372 1 . 1 1 72 72 THR C C 72 175.800 175.800 175.470 0.330 18016
373 1 . 1 1 72 72 THR CA C 72 65.300 65.300 64.919 0.381 18016
374 1 . 1 1 72 72 THR CB C 72 69.100 69.100 69.155 -0.055 18016
375 1 . 1 1 72 72 THR H H 72 7.840 7.840 7.746 0.094 18016
376 1 . 1 1 73 73 ASP N N 73 121.100 121.100 119.804 1.296 18016
377 1 . 1 1 73 73 ASP HA H 73 4.530 4.530 4.686 -0.156 18016
378 1 . 1 1 73 73 ASP C C 73 176.600 176.600 175.750 0.850 18016
379 1 . 1 1 73 73 ASP CA C 73 56.200 56.200 55.290 0.910 18016
380 1 . 1 1 73 73 ASP CB C 73 41.400 41.400 42.563 -1.163 18016
381 1 . 1 1 73 73 ASP H H 73 7.840 7.840 7.668 0.172 18016
382 1 . 1 1 74 74 GLU N N 74 121.100 121.100 119.232 1.868 18016
383 1 . 1 1 74 74 GLU HA H 74 4.340 4.340 4.587 -0.247 18016
384 1 . 1 1 74 74 GLU C C 74 173.800 173.800 175.165 -1.365 18016
385 1 . 1 1 74 74 GLU CA C 74 55.500 55.500 55.540 -0.040 18016
386 1 . 1 1 74 74 GLU CB C 74 30.600 30.600 31.556 -0.956 18016
387 1 . 1 1 74 74 GLU H H 74 7.980 7.980 8.405 -0.425 18016
388 1 . 1 1 75 75 MET N N 75 125.800 125.800 126.202 -0.402 18016
389 1 . 1 1 75 75 MET HA H 75 4.710 4.710 4.781 -0.071 18016
390 1 . 1 1 75 75 MET CA C 75 53.800 53.800 54.276 -0.477 18016
391 1 . 1 1 75 75 MET CB C 75 31.700 31.700 31.765 -0.065 18016
392 1 . 1 1 75 75 MET H H 75 8.380 8.380 8.594 -0.214 18016
393 1 . 1 1 76 76 PRO HA H 76 4.510 4.510 4.412 0.098 18016
394 1 . 1 1 76 76 PRO C C 76 175.700 175.700 176.486 -0.786 18016
395 1 . 1 1 76 76 PRO CA C 76 62.000 62.000 63.615 -1.615 18016
396 1 . 1 1 76 76 PRO CB C 76 31.800 31.800 32.262 -0.462 18016
397 1 . 1 1 77 77 ARG N N 77 119.700 119.700 118.096 1.604 18016
398 1 . 1 1 77 77 ARG HA H 77 4.270 4.270 4.610 -0.340 18016
399 1 . 1 1 77 77 ARG CA C 77 55.800 55.800 55.022 0.778 18016
400 1 . 1 1 77 77 ARG CB C 77 30.700 30.700 32.636 -1.936 18016
401 1 . 1 1 77 77 ARG H H 77 8.940 8.940 7.961 0.979 18016
402 1 . 1 1 78 78 GLU N N 78 124.700 124.700 124.922 -0.222 18016
403 1 . 1 1 78 78 GLU HA H 78 3.960 3.960 3.992 -0.032 18016
404 1 . 1 1 78 78 GLU C C 78 179.000 179.000 178.123 0.877 18016
405 1 . 1 1 78 78 GLU CA C 78 59.800 59.800 59.890 -0.090 18016
406 1 . 1 1 78 78 GLU CB C 78 29.000 29.000 29.626 -0.626 18016
407 1 . 1 1 78 78 GLU H H 78 9.170 9.170 8.970 0.200 18016
408 1 . 1 1 79 79 GLU N N 79 116.800 116.800 120.083 -3.283 18016
409 1 . 1 1 79 79 GLU HA H 79 4.120 4.120 4.133 -0.013 18016
410 1 . 1 1 79 79 GLU C C 79 179.100 179.100 178.430 0.670 18016
411 1 . 1 1 79 79 GLU CA C 79 59.700 59.700 59.813 -0.113 18016
412 1 . 1 1 79 79 GLU CB C 79 29.000 29.000 29.093 -0.093 18016
413 1 . 1 1 79 79 GLU H H 79 9.660 9.660 8.725 0.935 18016
414 1 . 1 1 80 80 ASP N N 80 120.000 120.000 118.803 1.197 18016
415 1 . 1 1 80 80 ASP HA H 80 4.690 4.690 4.459 0.231 18016
416 1 . 1 1 80 80 ASP C C 80 177.300 177.300 178.666 -1.366 18016
417 1 . 1 1 80 80 ASP CA C 80 57.400 57.400 57.466 -0.066 18016
418 1 . 1 1 80 80 ASP CB C 80 41.600 41.600 40.388 1.212 18016
419 1 . 1 1 80 80 ASP H H 80 7.310 7.310 8.269 -0.959 18016
420 1 . 1 1 81 81 ILE N N 81 120.100 120.100 120.327 -0.227 18016
421 1 . 1 1 81 81 ILE HA H 81 3.490 3.490 3.699 -0.209 18016
422 1 . 1 1 81 81 ILE CA C 81 66.300 66.300 65.691 0.609 18016
423 1 . 1 1 81 81 ILE CB C 81 38.300 38.300 37.977 0.323 18016
424 1 . 1 1 81 81 ILE H H 81 7.610 7.610 8.211 -0.601 18016
425 1 . 1 1 82 82 GLU N N 82 118.100 118.100 119.589 -1.489 18016
426 1 . 1 1 82 82 GLU HA H 82 4.280 4.280 4.058 0.222 18016
427 1 . 1 1 82 82 GLU C C 82 177.800 177.800 178.769 -0.969 18016
428 1 . 1 1 82 82 GLU CA C 82 58.000 58.000 59.475 -1.475 18016
429 1 . 1 1 82 82 GLU CB C 82 28.800 28.800 29.073 -0.273 18016
430 1 . 1 1 82 82 GLU H H 82 8.550 8.550 8.517 0.033 18016
431 1 . 1 1 83 83 ARG N N 83 119.900 119.900 120.405 -0.505 18016
432 1 . 1 1 83 83 ARG HA H 83 4.030 4.030 4.085 -0.055 18016
433 1 . 1 1 83 83 ARG C C 83 179.400 179.400 178.853 0.547 18016
434 1 . 1 1 83 83 ARG CA C 83 59.900 59.900 59.191 0.709 18016
435 1 . 1 1 83 83 ARG CB C 83 29.600 29.600 30.132 -0.532 18016
436 1 . 1 1 83 83 ARG H H 83 7.590 7.590 8.072 -0.482 18016
437 1 . 1 1 84 84 VAL N N 84 120.400 120.400 119.887 0.513 18016
438 1 . 1 1 84 84 VAL HA H 84 3.750 3.750 3.892 -0.142 18016
439 1 . 1 1 84 84 VAL C C 84 177.400 177.400 177.505 -0.105 18016
440 1 . 1 1 84 84 VAL CA C 84 66.900 66.900 65.814 1.086 18016
441 1 . 1 1 84 84 VAL CB C 84 31.900 31.900 32.006 -0.106 18016
442 1 . 1 1 84 84 VAL H H 84 7.550 7.550 8.456 -0.906 18016
443 1 . 1 1 85 85 ARG N N 85 121.600 121.600 119.775 1.825 18016
444 1 . 1 1 85 85 ARG HA H 85 4.010 4.010 4.271 -0.261 18016
445 1 . 1 1 85 85 ARG C C 85 178.100 178.100 178.827 -0.727 18016
446 1 . 1 1 85 85 ARG CA C 85 60.900 60.900 59.929 0.971 18016
447 1 . 1 1 85 85 ARG CB C 85 30.200 30.200 29.949 0.251 18016
448 1 . 1 1 85 85 ARG H H 85 9.090 9.090 8.462 0.628 18016
449 1 . 1 1 86 86 ARG N N 86 115.600 115.600 118.511 -2.911 18016
450 1 . 1 1 86 86 ARG HA H 86 3.880 3.880 4.116 -0.236 18016
451 1 . 1 1 86 86 ARG C C 86 179.000 179.000 178.635 0.365 18016
452 1 . 1 1 86 86 ARG CA C 86 59.400 59.400 59.028 0.372 18016
453 1 . 1 1 86 86 ARG CB C 86 30.400 30.400 29.547 0.853 18016
454 1 . 1 1 86 86 ARG H H 86 8.660 8.660 8.486 0.174 18016
455 1 . 1 1 87 87 HIS N N 87 118.000 118.000 120.104 -2.104 18016
456 1 . 1 1 87 87 HIS HA H 87 4.360 4.360 4.342 0.018 18016
457 1 . 1 1 87 87 HIS C C 87 178.400 178.400 177.486 0.914 18016
458 1 . 1 1 87 87 HIS CA C 87 59.600 59.600 59.249 0.351 18016
459 1 . 1 1 87 87 HIS CB C 87 30.700 30.700 30.094 0.606 18016
460 1 . 1 1 87 87 HIS H H 87 7.640 7.640 7.855 -0.215 18016
461 1 . 1 1 88 88 LEU N N 88 119.600 119.600 118.970 0.630 18016
462 1 . 1 1 88 88 LEU HA H 88 3.580 3.580 4.123 -0.543 18016
463 1 . 1 1 88 88 LEU C C 88 180.000 180.000 178.920 1.080 18016
464 1 . 1 1 88 88 LEU CA C 88 57.200 57.200 57.003 0.197 18016
465 1 . 1 1 88 88 LEU CB C 88 42.600 42.600 41.172 1.428 18016
466 1 . 1 1 88 88 LEU H H 88 8.650 8.650 8.576 0.074 18016
467 1 . 1 1 89 89 ALA N N 89 118.500 118.500 122.509 -4.009 18016
468 1 . 1 1 89 89 ALA HA H 89 5.360 5.360 4.701 0.659 18016
469 1 . 1 1 89 89 ALA C C 89 180.400 180.400 179.866 0.534 18016
470 1 . 1 1 89 89 ALA CA C 89 53.600 53.600 54.788 -1.188 18016
471 1 . 1 1 89 89 ALA CB C 89 18.100 18.100 18.423 -0.323 18016
472 1 . 1 1 89 89 ALA H H 89 8.870 8.870 8.269 0.601 18016
473 1 . 1 1 90 90 LEU N N 90 119.400 119.400 117.403 1.997 18016
474 1 . 1 1 90 90 LEU HA H 90 4.210 4.210 3.984 0.226 18016
475 1 . 1 1 90 90 LEU C C 90 179.100 179.100 179.062 0.038 18016
476 1 . 1 1 90 90 LEU CA C 90 57.500 57.500 57.109 0.391 18016
477 1 . 1 1 90 90 LEU CB C 90 41.700 41.700 41.654 0.046 18016
478 1 . 1 1 90 90 LEU H H 90 7.390 7.390 7.606 -0.216 18016
479 1 . 1 1 91 91 GLN N N 91 114.500 114.500 116.143 -1.643 18016
480 1 . 1 1 91 91 GLN HA H 91 4.700 4.700 4.338 0.362 18016
481 1 . 1 1 91 91 GLN C C 91 175.800 175.800 176.766 -0.966 18016
482 1 . 1 1 91 91 GLN CA C 91 54.500 54.500 56.619 -2.119 18016
483 1 . 1 1 91 91 GLN CB C 91 28.100 28.100 30.032 -1.932 18016
484 1 . 1 1 91 91 GLN H H 91 7.810 7.810 7.816 -0.006 18016
485 1 . 1 1 92 92 GLY N N 92 107.900 107.900 105.261 2.639 18016
486 1 . 1 1 92 92 GLY C C 92 172.100 172.100 171.770 0.330 18016
487 1 . 1 1 92 92 GLY CA C 92 44.000 44.000 45.078 -1.078 18016
488 1 . 1 1 92 92 GLY H H 92 7.710 7.710 8.253 -0.543 18016
489 1 . 1 1 93 93 TRP N N 93 114.200 114.200 121.981 -7.781 18016
490 1 . 1 1 93 93 TRP CA C 93 56.000 56.000 54.754 1.246 18016
491 1 . 1 1 93 93 TRP CB C 93 29.200 29.200 30.883 -1.683 18016
492 1 . 1 1 93 93 TRP H H 93 8.450 8.450 8.338 0.112 18016
493 1 . 1 1 94 94 PRO HA H 94 4.460 4.460 4.185 0.275 18016
494 1 . 1 1 94 94 PRO CA C 94 62.800 62.800 63.804 -1.004 18016
495 1 . 1 1 94 94 PRO CB C 94 31.600 31.600 31.213 0.387 18016
496 1 . 1 1 95 95 LEU HA H 95 3.500 3.500 4.103 -0.603 18016
497 1 . 1 1 95 95 LEU C C 95 175.000 175.000 177.896 -2.896 18016
498 1 . 1 1 95 95 LEU CA C 95 56.100 56.100 56.509 -0.409 18016
499 1 . 1 1 95 95 LEU CB C 95 42.100 42.100 40.720 1.380 18016
500 1 . 1 1 96 96 ASP N N 96 114.000 114.000 119.007 -5.007 18016
501 1 . 1 1 96 96 ASP HA H 96 4.950 4.950 4.608 0.342 18016
502 1 . 1 1 96 96 ASP C C 96 175.800 175.800 175.959 -0.159 18016
503 1 . 1 1 96 96 ASP CA C 96 54.000 54.000 56.313 -2.313 18016
504 1 . 1 1 96 96 ASP CB C 96 41.900 41.900 41.932 -0.032 18016
505 1 . 1 1 96 96 ASP H H 96 7.230 7.230 7.663 -0.433 18016
506 1 . 1 1 97 97 ASP N N 97 123.200 123.200 117.926 5.274 18016
507 1 . 1 1 97 97 ASP HA H 97 4.610 4.610 4.970 -0.360 18016
508 1 . 1 1 97 97 ASP CA C 97 53.500 53.500 51.644 1.856 18016
509 1 . 1 1 97 97 ASP CB C 97 38.700 38.700 42.781 -4.081 18016
510 1 . 1 1 97 97 ASP H H 97 7.420 7.420 7.749 -0.329 18016
511 1 . 1 1 98 98 PRO HA H 98 4.290 4.290 3.977 0.313 18016
512 1 . 1 1 98 98 PRO C C 98 177.500 177.500 176.665 0.835 18016
513 1 . 1 1 98 98 PRO CA C 98 62.700 62.700 62.426 0.274 18016
514 1 . 1 1 98 98 PRO CB C 98 31.900 31.900 32.679 -0.779 18016
515 1 . 1 1 99 99 ARG N N 99 121.300 121.300 120.682 0.618 18016
516 1 . 1 1 99 99 ARG HA H 99 3.710 3.710 4.247 -0.537 18016
517 1 . 1 1 99 99 ARG C C 99 176.500 176.500 176.031 0.469 18016
518 1 . 1 1 99 99 ARG CA C 99 56.100 56.100 57.239 -1.139 18016
519 1 . 1 1 99 99 ARG CB C 99 30.500 30.500 30.617 -0.117 18016
520 1 . 1 1 99 99 ARG H H 99 8.390 8.390 8.313 0.077 18016
521 1 . 1 1 100 100 ASP N N 100 119.600 119.600 118.065 1.535 18016
522 1 . 1 1 100 100 ASP HA H 100 4.500 4.500 4.642 -0.142 18016
523 1 . 1 1 100 100 ASP C C 100 177.000 177.000 175.772 1.228 18016
524 1 . 1 1 100 100 ASP CA C 100 54.700 54.700 53.677 1.023 18016
525 1 . 1 1 100 100 ASP CB C 100 40.900 40.900 41.994 -1.094 18016
526 1 . 1 1 100 100 ASP H H 100 8.260 8.260 7.748 0.512 18016
527 1 . 1 1 101 101 GLY N N 101 109.300 109.300 110.057 -0.757 18016
528 1 . 1 1 101 101 GLY CA C 101 45.400 45.400 44.927 0.473 18016
529 1 . 1 1 101 101 GLY H H 101 8.450 8.450 8.313 0.137 18016
530 1 . 1 1 102 102 GLU N N 102 119.800 119.800 121.651 -1.851 18016
531 1 . 1 1 102 102 GLU HA H 102 4.310 4.310 4.275 0.035 18016
532 1 . 1 1 102 102 GLU CA C 102 56.000 56.000 56.286 -0.286 18016
533 1 . 1 1 102 102 GLU CB C 102 30.500 30.500 30.239 0.261 18016
534 1 . 1 1 102 102 GLU H H 102 8.140 8.140 8.129 0.011 18016
535 1 . 1 1 103 103 GLU N N 103 123.000 123.000 125.188 -2.188 18016
536 1 . 1 1 103 103 GLU HA H 103 4.560 4.560 4.525 0.035 18016
537 1 . 1 1 103 103 GLU CA C 103 54.300 54.300 54.554 -0.254 18016
538 1 . 1 1 103 103 GLU CB C 103 29.600 29.600 29.926 -0.326 18016
539 1 . 1 1 103 103 GLU H H 103 8.580 8.580 8.479 0.101 18016
540 1 . 1 1 104 104 PRO HA H 104 4.480 4.480 4.447 0.033 18016
541 1 . 1 1 104 104 PRO C C 104 176.800 176.800 176.042 0.758 18016
542 1 . 1 1 104 104 PRO CA C 104 63.400 63.400 63.260 0.141 18016
543 1 . 1 1 104 104 PRO CB C 104 32.100 32.100 31.951 0.149 18016
544 1 . 1 1 105 105 ASP N N 105 120.400 120.400 119.839 0.561 18016
545 1 . 1 1 105 105 ASP HA H 105 4.580 4.580 4.638 -0.058 18016
546 1 . 1 1 105 105 ASP C C 105 177.100 177.100 176.222 0.878 18016
547 1 . 1 1 105 105 ASP CA C 105 54.300 54.300 54.272 0.028 18016
548 1 . 1 1 105 105 ASP CB C 105 41.400 41.400 41.176 0.224 18016
549 1 . 1 1 105 105 ASP H H 105 8.500 8.500 8.203 0.297 18016
550 1 . 1 1 106 106 GLY N N 106 109.300 109.300 110.591 -1.291 18016
551 1 . 1 1 106 106 GLY C C 106 174.600 174.600 174.019 0.581 18016
552 1 . 1 1 106 106 GLY CA C 106 45.400 45.400 45.330 0.070 18016
553 1 . 1 1 106 106 GLY H H 106 8.360 8.360 8.363 -0.003 18016
554 1 . 1 1 107 107 GLU N N 107 120.400 120.400 120.379 0.021 18016
555 1 . 1 1 107 107 GLU HA H 107 4.340 4.340 4.322 0.018 18016
556 1 . 1 1 107 107 GLU C C 107 177.100 177.100 176.047 1.053 18016
557 1 . 1 1 107 107 GLU CA C 107 56.500 56.500 56.393 0.107 18016
558 1 . 1 1 107 107 GLU CB C 107 30.200 30.200 29.685 0.514 18016
559 1 . 1 1 107 107 GLU H H 107 8.410 8.410 8.373 0.037 18016
560 1 . 1 1 108 108 SER N N 108 116.600 116.600 116.904 -0.304 18016
561 1 . 1 1 108 108 SER HA H 108 4.450 4.450 4.541 -0.091 18016
562 1 . 1 1 108 108 SER C C 108 175.300 175.300 174.990 0.310 18016
563 1 . 1 1 108 108 SER CA C 108 58.700 58.700 58.419 0.281 18016
564 1 . 1 1 108 108 SER CB C 108 63.800 63.800 63.677 0.123 18016
565 1 . 1 1 108 108 SER H H 108 8.460 8.460 8.352 0.108 18016
566 1 . 1 1 109 109 GLY N N 109 110.800 110.800 110.710 0.090 18016
567 1 . 1 1 109 109 GLY C C 109 174.500 174.500 173.920 0.580 18016
568 1 . 1 1 109 109 GLY CA C 109 45.300 45.300 45.079 0.221 18016
569 1 . 1 1 109 109 GLY H H 109 8.500 8.500 8.388 0.112 18016
570 1 . 1 1 110 110 GLY N N 110 108.800 108.800 109.011 -0.211 18016
571 1 . 1 1 110 110 GLY CA C 110 44.400 44.400 44.820 -0.420 18016
572 1 . 1 1 110 110 GLY H H 110 8.140 8.140 8.081 0.059 18016
573 1 . 1 1 111 111 PRO HA H 111 4.610 4.610 4.613 -0.003 18016
574 1 . 1 1 111 111 PRO C C 111 176.000 176.000 176.568 -0.568 18016
575 1 . 1 1 111 111 PRO CA C 111 62.600 62.600 62.996 -0.396 18016
576 1 . 1 1 111 111 PRO CB C 111 34.600 34.600 32.175 2.425 18016
stop_
save_