data_18329
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18329
_Entry.PDB_ID 2LQU
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 18329
_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 ALA N N 25 125.000 125.000 127.177 -2.177 18329
2 1 1 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.355 0.015 18329
3 1 1 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.362 -0.062 18329
4 1 1 . 1 1 2 2 ALA CB C 25 19.700 19.700 17.799 1.901 18329
5 1 1 . 1 1 2 2 ALA H H 25 8.690 8.690 8.228 0.462 18329
6 1 1 . 1 1 3 3 GLY N N 26 106.920 106.920 108.905 -1.985 18329
7 1 1 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.554 -1.554 18329
8 1 1 . 1 1 3 3 GLY H H 26 7.940 7.940 7.951 -0.011 18329
9 1 1 . 1 1 4 4 LEU N N 27 119.140 119.140 123.819 -4.679 18329
10 1 1 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.451 -0.041 18329
11 1 1 . 1 1 4 4 LEU C C 27 177.100 177.100 175.851 1.249 18329
12 1 1 . 1 1 4 4 LEU CA C 27 54.400 54.400 55.321 -0.921 18329
13 1 1 . 1 1 4 4 LEU CB C 27 42.100 42.100 43.052 -0.952 18329
14 1 1 . 1 1 4 4 LEU H H 27 8.210 8.210 8.566 -0.356 18329
15 1 1 . 1 1 5 5 THR N N 28 112.940 112.940 111.330 1.610 18329
16 1 1 . 1 1 5 5 THR HA H 28 4.650 4.650 3.899 0.751 18329
17 1 1 . 1 1 5 5 THR C C 28 175.500 175.500 174.958 0.542 18329
18 1 1 . 1 1 5 5 THR CA C 28 60.100 60.100 62.654 -2.554 18329
19 1 1 . 1 1 5 5 THR CB C 28 72.600 72.600 68.273 4.327 18329
20 1 1 . 1 1 5 5 THR H H 28 9.220 9.220 7.971 1.249 18329
21 1 1 . 1 1 6 6 GLY N N 29 108.230 108.230 108.587 -0.357 18329
22 1 1 . 1 1 6 6 GLY C C 29 174.800 174.800 175.320 -0.520 18329
23 1 1 . 1 1 6 6 GLY CA C 29 46.000 46.000 44.764 1.236 18329
24 1 1 . 1 1 6 6 GLY H H 29 8.520 8.520 8.580 -0.060 18329
25 1 1 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.300 -0.260 18329
26 1 1 . 1 1 7 7 ALA CA C 30 54.800 54.800 53.648 1.152 18329
27 1 1 . 1 1 7 7 ALA CB C 30 18.200 18.200 18.775 -0.575 18329
28 1 1 . 1 1 8 8 THR N N 31 116.970 116.970 115.588 1.382 18329
29 1 1 . 1 1 8 8 THR HA H 31 3.740 3.740 3.850 -0.110 18329
30 1 1 . 1 1 8 8 THR C C 31 175.300 175.300 176.526 -1.226 18329
31 1 1 . 1 1 8 8 THR CA C 31 67.000 67.000 66.380 0.620 18329
32 1 1 . 1 1 8 8 THR CB C 31 68.700 68.700 68.557 0.143 18329
33 1 1 . 1 1 8 8 THR H H 31 8.110 8.110 8.158 -0.048 18329
34 1 1 . 1 1 9 9 LYS N N 32 120.540 120.540 121.725 -1.185 18329
35 1 1 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.071 -0.481 18329
36 1 1 . 1 1 9 9 LYS C C 32 176.900 176.900 178.432 -1.532 18329
37 1 1 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.185 0.615 18329
38 1 1 . 1 1 9 9 LYS CB C 32 32.400 32.400 32.003 0.397 18329
39 1 1 . 1 1 9 9 LYS H H 32 6.860 6.860 7.598 -0.738 18329
40 1 1 . 1 1 10 10 ILE N N 33 115.940 115.940 115.654 0.286 18329
41 1 1 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.809 -0.099 18329
42 1 1 . 1 1 10 10 ILE C C 33 179.000 179.000 177.798 1.202 18329
43 1 1 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.361 -0.361 18329
44 1 1 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.404 0.596 18329
45 1 1 . 1 1 10 10 ILE H H 33 7.380 7.380 7.955 -0.575 18329
46 1 1 . 1 1 11 11 ARG N N 34 118.350 118.350 121.201 -2.851 18329
47 1 1 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.065 -0.025 18329
48 1 1 . 1 1 11 11 ARG C C 34 180.000 180.000 178.809 1.191 18329
49 1 1 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.704 -0.304 18329
50 1 1 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.255 0.045 18329
51 1 1 . 1 1 11 11 ARG H H 34 8.250 8.250 8.015 0.235 18329
52 1 1 . 1 1 12 12 LEU N N 35 117.420 117.420 119.046 -1.626 18329
53 1 1 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.066 0.104 18329
54 1 1 . 1 1 12 12 LEU C C 35 179.000 179.000 179.065 -0.065 18329
55 1 1 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.591 0.409 18329
56 1 1 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.785 -0.985 18329
57 1 1 . 1 1 12 12 LEU H H 35 8.340 8.340 7.817 0.523 18329
58 1 1 . 1 1 13 13 GLU N N 36 117.890 117.890 120.140 -2.250 18329
59 1 1 . 1 1 13 13 GLU HA H 36 4.020 4.020 4.056 -0.036 18329
60 1 1 . 1 1 13 13 GLU C C 36 180.100 180.100 179.054 1.046 18329
61 1 1 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.633 0.567 18329
62 1 1 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.312 -1.012 18329
63 1 1 . 1 1 13 13 GLU H H 36 8.610 8.610 7.965 0.645 18329
64 1 1 . 1 1 14 14 ARG N N 37 121.100 121.100 118.107 2.993 18329
65 1 1 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.070 0.170 18329
66 1 1 . 1 1 14 14 ARG C C 37 178.100 178.100 178.874 -0.774 18329
67 1 1 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.503 -1.003 18329
68 1 1 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.256 -0.056 18329
69 1 1 . 1 1 14 14 ARG H H 37 7.980 7.980 7.969 0.011 18329
70 1 1 . 1 1 15 15 SER N N 38 115.420 115.420 114.027 1.393 18329
71 1 1 . 1 1 15 15 SER HA H 38 4.380 4.380 4.594 -0.214 18329
72 1 1 . 1 1 15 15 SER C C 38 177.300 177.300 175.631 1.669 18329
73 1 1 . 1 1 15 15 SER CA C 38 62.200 62.200 60.639 1.561 18329
74 1 1 . 1 1 15 15 SER CB C 38 63.200 63.200 63.220 -0.020 18329
75 1 1 . 1 1 15 15 SER H H 38 8.230 8.230 7.947 0.283 18329
76 1 1 . 1 1 16 16 ALA N N 39 123.970 123.970 123.596 0.374 18329
77 1 1 . 1 1 16 16 ALA HA H 39 3.630 3.630 4.244 -0.614 18329
78 1 1 . 1 1 16 16 ALA C C 39 179.500 179.500 179.862 -0.362 18329
79 1 1 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.556 0.144 18329
80 1 1 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.788 -0.788 18329
81 1 1 . 1 1 16 16 ALA H H 39 8.280 8.280 7.912 0.368 18329
82 1 1 . 1 1 17 17 LYS N N 40 121.690 121.690 119.779 1.911 18329
83 1 1 . 1 1 17 17 LYS HA H 40 4.090 4.090 3.980 0.110 18329
84 1 1 . 1 1 17 17 LYS C C 40 178.000 178.000 178.229 -0.229 18329
85 1 1 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.753 -1.353 18329
86 1 1 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.153 -0.353 18329
87 1 1 . 1 1 17 17 LYS H H 40 7.930 7.930 7.832 0.098 18329
88 1 1 . 1 1 18 18 ASP N N 41 118.730 118.730 118.026 0.704 18329
89 1 1 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.456 -0.096 18329
90 1 1 . 1 1 18 18 ASP C C 41 179.900 179.900 178.544 1.356 18329
91 1 1 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.733 0.967 18329
92 1 1 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.203 -0.603 18329
93 1 1 . 1 1 18 18 ASP H H 41 8.320 8.320 7.721 0.599 18329
94 1 1 . 1 1 19 19 ILE N N 42 118.180 118.180 119.118 -0.938 18329
95 1 1 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.752 -0.062 18329
96 1 1 . 1 1 19 19 ILE C C 42 177.400 177.400 177.804 -0.404 18329
97 1 1 . 1 1 19 19 ILE CA C 42 65.200 65.200 64.826 0.374 18329
98 1 1 . 1 1 19 19 ILE CB C 42 37.900 37.900 36.812 1.088 18329
99 1 1 . 1 1 19 19 ILE H H 42 7.420 7.420 7.894 -0.474 18329
100 1 1 . 1 1 20 20 THR N N 43 113.360 113.360 111.472 1.888 18329
101 1 1 . 1 1 20 20 THR HA H 43 3.770 3.770 4.052 -0.282 18329
102 1 1 . 1 1 20 20 THR C C 43 177.800 177.800 176.634 1.166 18329
103 1 1 . 1 1 20 20 THR CA C 43 66.400 66.400 65.350 1.050 18329
104 1 1 . 1 1 20 20 THR CB C 43 67.400 67.400 68.731 -1.331 18329
105 1 1 . 1 1 20 20 THR H H 43 7.610 7.610 7.472 0.138 18329
106 1 1 . 1 1 21 21 ASP N N 44 123.650 123.650 121.719 1.931 18329
107 1 1 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.434 -0.024 18329
108 1 1 . 1 1 21 21 ASP C C 44 179.200 179.200 178.655 0.545 18329
109 1 1 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.156 0.044 18329
110 1 1 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.156 -0.556 18329
111 1 1 . 1 1 21 21 ASP H H 44 9.260 9.260 8.322 0.938 18329
112 1 1 . 1 1 22 22 GLU N N 45 123.560 123.560 118.982 4.578 18329
113 1 1 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.186 0.184 18329
114 1 1 . 1 1 22 22 GLU C C 45 178.500 178.500 179.471 -0.971 18329
115 1 1 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.759 -0.559 18329
116 1 1 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.737 -0.537 18329
117 1 1 . 1 1 22 22 GLU H H 45 7.750 7.750 7.806 -0.056 18329
118 1 1 . 1 1 23 23 ILE N N 46 119.940 119.940 115.971 3.969 18329
119 1 1 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.714 -0.094 18329
120 1 1 . 1 1 23 23 ILE C C 46 177.600 177.600 177.378 0.222 18329
121 1 1 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.466 1.133 18329
122 1 1 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.269 -0.269 18329
123 1 1 . 1 1 23 23 ILE H H 46 8.360 8.360 7.333 1.027 18329
124 1 1 . 1 1 24 24 ASP N N 47 120.730 120.730 120.848 -0.118 18329
125 1 1 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.410 -0.010 18329
126 1 1 . 1 1 24 24 ASP C C 47 178.900 178.900 178.179 0.721 18329
127 1 1 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.102 0.398 18329
128 1 1 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.177 -0.277 18329
129 1 1 . 1 1 24 24 ASP H H 47 8.280 8.280 8.108 0.172 18329
130 1 1 . 1 1 25 25 ALA N N 48 123.870 123.870 121.759 2.111 18329
131 1 1 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.070 0.050 18329
132 1 1 . 1 1 25 25 ALA C C 48 180.400 180.400 179.454 0.946 18329
133 1 1 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.767 0.733 18329
134 1 1 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.215 -0.415 18329
135 1 1 . 1 1 25 25 ALA H H 48 7.880 7.880 7.628 0.252 18329
136 1 1 . 1 1 26 26 ILE N N 49 121.970 121.970 117.977 3.993 18329
137 1 1 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.606 0.124 18329
138 1 1 . 1 1 26 26 ILE C C 49 178.400 178.400 177.887 0.513 18329
139 1 1 . 1 1 26 26 ILE CA C 49 65.900 65.900 65.050 0.850 18329
140 1 1 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.687 -0.187 18329
141 1 1 . 1 1 26 26 ILE H H 49 8.710 8.710 7.448 1.262 18329
142 1 1 . 1 1 27 27 LYS N N 50 119.820 119.820 119.950 -0.130 18329
143 1 1 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.618 0.262 18329
144 1 1 . 1 1 27 27 LYS C C 50 179.900 179.900 179.138 0.762 18329
145 1 1 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.389 1.011 18329
146 1 1 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.881 0.019 18329
147 1 1 . 1 1 27 27 LYS H H 50 8.540 8.540 7.701 0.839 18329
148 1 1 . 1 1 28 28 LYS N N 51 121.960 121.960 118.276 3.684 18329
149 1 1 . 1 1 28 28 LYS HA H 51 4.090 4.090 4.009 0.081 18329
150 1 1 . 1 1 28 28 LYS C C 51 179.200 179.200 179.111 0.089 18329
151 1 1 . 1 1 28 28 LYS CA C 51 59.300 59.300 58.664 0.636 18329
152 1 1 . 1 1 28 28 LYS CB C 51 31.400 31.400 31.944 -0.544 18329
153 1 1 . 1 1 28 28 LYS H H 51 8.070 8.070 7.355 0.715 18329
154 1 1 . 1 1 29 29 ASP N N 52 121.710 121.710 119.074 2.636 18329
155 1 1 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.468 0.002 18329
156 1 1 . 1 1 29 29 ASP C C 52 178.500 178.500 178.736 -0.236 18329
157 1 1 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.713 0.287 18329
158 1 1 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.970 0.030 18329
159 1 1 . 1 1 29 29 ASP H H 52 8.340 8.340 7.934 0.406 18329
160 1 1 . 1 1 30 30 ALA N N 53 121.990 121.990 121.754 0.236 18329
161 1 1 . 1 1 30 30 ALA HA H 53 3.340 3.340 3.845 -0.505 18329
162 1 1 . 1 1 30 30 ALA C C 53 179.500 179.500 179.255 0.245 18329
163 1 1 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.482 0.618 18329
164 1 1 . 1 1 30 30 ALA CB C 53 18.100 18.100 17.848 0.252 18329
165 1 1 . 1 1 30 30 ALA H H 53 8.800 8.800 8.202 0.598 18329
166 1 1 . 1 1 31 31 ALA N N 54 119.970 119.970 120.773 -0.803 18329
167 1 1 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.002 0.148 18329
168 1 1 . 1 1 31 31 ALA C C 54 181.600 181.600 178.788 2.812 18329
169 1 1 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.245 0.455 18329
170 1 1 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.376 -0.576 18329
171 1 1 . 1 1 31 31 ALA H H 54 7.730 7.730 7.322 0.408 18329
172 1 1 . 1 1 32 32 LEU N N 55 119.660 119.660 117.666 1.994 18329
173 1 1 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.040 0.100 18329
174 1 1 . 1 1 32 32 LEU C C 55 179.100 179.100 177.301 1.799 18329
175 1 1 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.898 0.102 18329
176 1 1 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.920 -0.020 18329
177 1 1 . 1 1 32 32 LEU H H 55 7.660 7.660 7.342 0.318 18329
178 1 1 . 1 1 33 33 LYS N N 56 117.160 117.160 118.015 -0.855 18329
179 1 1 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.404 -0.194 18329
180 1 1 . 1 1 33 33 LYS C C 56 176.600 176.600 175.906 0.694 18329
181 1 1 . 1 1 33 33 LYS CA C 56 56.100 56.100 54.972 1.128 18329
182 1 1 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.930 -0.730 18329
183 1 1 . 1 1 33 33 LYS H H 56 7.610 7.610 7.278 0.332 18329
184 1 1 . 1 1 34 34 GLY N N 57 108.680 108.680 110.331 -1.651 18329
185 1 1 . 1 1 34 34 GLY C C 57 174.400 174.400 173.896 0.504 18329
186 1 1 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.250 0.950 18329
187 1 1 . 1 1 34 34 GLY H H 57 7.710 7.710 8.470 -0.760 18329
188 1 1 . 1 1 35 35 VAL N N 58 121.000 121.000 124.280 -3.280 18329
189 1 1 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.332 -0.432 18329
190 1 1 . 1 1 35 35 VAL C C 58 174.200 174.200 175.291 -1.091 18329
191 1 1 . 1 1 35 35 VAL CA C 58 61.500 61.500 60.538 0.962 18329
192 1 1 . 1 1 35 35 VAL CB C 58 32.800 32.800 34.507 -1.707 18329
193 1 1 . 1 1 35 35 VAL H H 58 7.990 7.990 7.494 0.496 18329
194 1 1 . 1 1 36 36 ASN N N 59 124.960 124.960 124.969 -0.009 18329
195 1 1 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.574 0.096 18329
196 1 1 . 1 1 36 36 ASN C C 59 175.700 175.700 176.053 -0.353 18329
197 1 1 . 1 1 36 36 ASN CA C 59 51.600 51.600 54.333 -2.733 18329
198 1 1 . 1 1 36 36 ASN CB C 59 39.100 39.100 38.808 0.292 18329
199 1 1 . 1 1 36 36 ASN H H 59 8.460 8.460 8.504 -0.044 18329
200 1 1 . 1 1 37 37 PHE N N 60 124.460 124.460 121.075 3.385 18329
201 1 1 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.233 -0.093 18329
202 1 1 . 1 1 37 37 PHE C C 60 177.000 177.000 173.635 3.365 18329
203 1 1 . 1 1 37 37 PHE CA C 60 60.400 60.400 59.391 1.009 18329
204 1 1 . 1 1 37 37 PHE CB C 60 39.200 39.200 37.891 1.309 18329
205 1 1 . 1 1 37 37 PHE H H 60 8.780 8.780 8.229 0.551 18329
206 1 1 . 1 1 38 38 ASP N N 61 119.270 119.270 119.805 -0.535 18329
207 1 1 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.315 0.175 18329
208 1 1 . 1 1 38 38 ASP C C 61 177.000 177.000 174.498 2.502 18329
209 1 1 . 1 1 38 38 ASP CA C 61 55.500 55.500 54.431 1.069 18329
210 1 1 . 1 1 38 38 ASP CB C 61 40.000 40.000 40.988 -0.988 18329
211 1 1 . 1 1 38 38 ASP H H 61 8.400 8.400 7.666 0.734 18329
212 1 1 . 1 1 39 39 ALA N N 62 122.020 122.020 121.846 0.174 18329
213 1 1 . 1 1 39 39 ALA HA H 62 4.200 4.200 3.933 0.267 18329
214 1 1 . 1 1 39 39 ALA C C 62 178.300 178.300 177.125 1.175 18329
215 1 1 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.737 0.163 18329
216 1 1 . 1 1 39 39 ALA CB C 62 18.500 18.500 17.402 1.098 18329
217 1 1 . 1 1 39 39 ALA H H 62 7.740 7.740 8.151 -0.411 18329
218 1 1 . 1 1 40 40 PHE N N 63 116.940 116.940 116.250 0.690 18329
219 1 1 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.382 -0.002 18329
220 1 1 . 1 1 40 40 PHE C C 63 176.100 176.100 175.492 0.608 18329
221 1 1 . 1 1 40 40 PHE CA C 63 58.300 58.300 57.298 1.002 18329
222 1 1 . 1 1 40 40 PHE CB C 63 38.800 38.800 38.925 -0.125 18329
223 1 1 . 1 1 40 40 PHE H H 63 7.730 7.730 7.809 -0.079 18329
224 1 1 . 1 1 41 41 LYS N N 64 119.840 119.840 121.274 -1.434 18329
225 1 1 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.186 0.034 18329
226 1 1 . 1 1 41 41 LYS C C 64 176.100 176.100 176.935 -0.835 18329
227 1 1 . 1 1 41 41 LYS CA C 64 56.600 56.600 57.067 -0.467 18329
228 1 1 . 1 1 41 41 LYS CB C 64 32.900 32.900 32.515 0.385 18329
229 1 1 . 1 1 41 41 LYS H H 64 7.650 7.650 7.524 0.126 18329
230 1 1 . 1 1 42 42 ASP N N 65 120.770 120.770 122.429 -1.659 18329
231 1 1 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.231 0.339 18329
232 1 1 . 1 1 42 42 ASP C C 65 176.100 176.100 175.871 0.229 18329
233 1 1 . 1 1 42 42 ASP CA C 65 54.200 54.200 56.435 -2.235 18329
234 1 1 . 1 1 42 42 ASP CB C 65 40.900 40.900 40.959 -0.058 18329
235 1 1 . 1 1 42 42 ASP H H 65 8.030 8.030 8.768 -0.738 18329
236 1 1 . 1 1 43 43 LYS N N 66 122.070 122.070 121.511 0.559 18329
237 1 1 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.525 -0.245 18329
238 1 1 . 1 1 43 43 LYS C C 66 176.800 176.800 175.353 1.447 18329
239 1 1 . 1 1 43 43 LYS CA C 66 56.500 56.500 55.694 0.806 18329
240 1 1 . 1 1 43 43 LYS CB C 66 32.800 32.800 34.931 -2.131 18329
241 1 1 . 1 1 43 43 LYS H H 66 8.180 8.180 8.254 -0.074 18329
242 1 1 . 1 1 44 44 LYS N N 67 122.170 122.170 123.654 -1.484 18329
243 1 1 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.413 -0.063 18329
244 1 1 . 1 1 44 44 LYS C C 67 177.000 177.000 176.059 0.941 18329
245 1 1 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.278 0.322 18329
246 1 1 . 1 1 44 44 LYS CB C 67 32.800 32.800 33.062 -0.262 18329
247 1 1 . 1 1 44 44 LYS H H 67 8.460 8.460 8.345 0.115 18329
248 1 1 . 1 1 45 45 THR N N 68 114.390 114.390 116.617 -2.227 18329
249 1 1 . 1 1 45 45 THR HA H 68 4.330 4.330 4.560 -0.230 18329
250 1 1 . 1 1 45 45 THR C C 68 175.200 175.200 174.362 0.838 18329
251 1 1 . 1 1 45 45 THR CA C 68 62.000 62.000 62.053 -0.053 18329
252 1 1 . 1 1 45 45 THR CB C 68 69.900 69.900 70.398 -0.498 18329
253 1 1 . 1 1 45 45 THR H H 68 8.120 8.120 8.078 0.042 18329
254 1 1 . 1 1 46 46 GLY N N 69 111.200 111.200 113.386 -2.186 18329
255 1 1 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.312 -0.112 18329
256 1 1 . 1 1 46 46 GLY H H 69 8.450 8.450 8.167 0.283 18329
257 1 1 . 1 1 47 47 SER CA C 70 58.400 58.400 59.193 -0.793 18329
258 1 1 . 1 1 47 47 SER CB C 70 64.000 64.000 62.670 1.330 18329
259 1 1 . 1 1 48 48 GLY N N 71 111.200 111.200 110.710 0.490 18329
260 1 1 . 1 1 48 48 GLY CA C 71 45.000 45.000 45.578 -0.578 18329
261 1 1 . 1 1 48 48 GLY H H 71 8.580 8.580 8.666 -0.086 18329
262 1 1 . 1 1 49 49 VAL N N 72 118.910 118.910 122.267 -3.357 18329
263 1 1 . 1 1 49 49 VAL HA H 72 4.130 4.130 3.942 0.188 18329
264 1 1 . 1 1 49 49 VAL C C 72 176.100 176.100 177.389 -1.289 18329
265 1 1 . 1 1 49 49 VAL CA C 72 62.100 62.100 63.468 -1.369 18329
266 1 1 . 1 1 49 49 VAL CB C 72 32.500 32.500 31.682 0.818 18329
267 1 1 . 1 1 49 49 VAL H H 72 7.860 7.860 8.239 -0.379 18329
268 1 1 . 1 1 50 50 SER N N 73 118.500 118.500 121.152 -2.652 18329
269 1 1 . 1 1 50 50 SER C C 73 176.100 176.100 175.017 1.083 18329
270 1 1 . 1 1 50 50 SER CA C 73 58.300 58.300 61.155 -2.855 18329
271 1 1 . 1 1 50 50 SER CB C 73 63.800 63.800 61.919 1.881 18329
272 1 1 . 1 1 50 50 SER H H 73 8.300 8.300 8.913 -0.613 18329
273 1 1 . 1 1 51 51 GLU N N 74 122.560 122.560 125.808 -3.248 18329
274 1 1 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.238 0.032 18329
275 1 1 . 1 1 51 51 GLU CA C 74 55.700 55.700 55.116 0.584 18329
276 1 1 . 1 1 51 51 GLU CB C 74 30.500 30.500 28.836 1.664 18329
277 1 1 . 1 1 51 51 GLU H H 74 8.360 8.360 8.220 0.140 18329
278 1 1 . 1 1 52 52 ASN N N 75 122.830 122.830 124.680 -1.850 18329
279 1 1 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.514 0.306 18329
280 1 1 . 1 1 52 52 ASN C C 75 174.800 174.800 174.720 0.080 18329
281 1 1 . 1 1 52 52 ASN CA C 75 51.400 51.400 52.627 -1.227 18329
282 1 1 . 1 1 52 52 ASN CB C 75 39.200 39.200 37.832 1.368 18329
283 1 1 . 1 1 52 52 ASN H H 75 8.450 8.450 8.093 0.357 18329
284 1 1 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.200 -0.020 18329
285 1 1 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.331 0.869 18329
286 1 1 . 1 1 53 53 PRO CB C 76 32.000 32.000 31.422 0.578 18329
287 1 1 . 1 1 54 54 PHE N N 77 118.060 118.060 119.211 -1.151 18329
288 1 1 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.260 0.010 18329
289 1 1 . 1 1 54 54 PHE C C 77 177.500 177.500 177.030 0.470 18329
290 1 1 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.333 0.167 18329
291 1 1 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.023 0.377 18329
292 1 1 . 1 1 54 54 PHE H H 77 8.430 8.430 7.884 0.546 18329
293 1 1 . 1 1 55 55 ILE N N 78 119.350 119.350 118.859 0.491 18329
294 1 1 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.697 -0.197 18329
295 1 1 . 1 1 55 55 ILE C C 78 177.400 177.400 177.735 -0.335 18329
296 1 1 . 1 1 55 55 ILE CA C 78 63.500 63.500 65.377 -1.877 18329
297 1 1 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.564 -0.564 18329
298 1 1 . 1 1 55 55 ILE H H 78 7.540 7.540 7.833 -0.293 18329
299 1 1 . 1 1 56 56 LEU N N 79 118.450 118.450 120.350 -1.900 18329
300 1 1 . 1 1 56 56 LEU HA H 79 4.150 4.150 3.957 0.193 18329
301 1 1 . 1 1 56 56 LEU C C 79 179.200 179.200 179.346 -0.146 18329
302 1 1 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.461 -0.661 18329
303 1 1 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.385 -0.285 18329
304 1 1 . 1 1 56 56 LEU H H 79 7.260 7.260 8.058 -0.798 18329
305 1 1 . 1 1 57 57 GLU N N 80 117.980 117.980 117.691 0.289 18329
306 1 1 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.823 -0.173 18329
307 1 1 . 1 1 57 57 GLU C C 80 178.700 178.700 179.000 -0.300 18329
308 1 1 . 1 1 57 57 GLU CA C 80 59.300 59.300 59.240 0.059 18329
309 1 1 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.462 0.038 18329
310 1 1 . 1 1 57 57 GLU H H 80 7.890 7.890 8.333 -0.443 18329
311 1 1 . 1 1 58 58 ALA N N 81 122.040 122.040 122.432 -0.392 18329
312 1 1 . 1 1 58 58 ALA HA H 81 3.800 3.800 3.919 -0.119 18329
313 1 1 . 1 1 58 58 ALA C C 81 179.500 179.500 179.034 0.466 18329
314 1 1 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.871 0.329 18329
315 1 1 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.041 0.758 18329
316 1 1 . 1 1 58 58 ALA H H 81 8.400 8.400 8.117 0.283 18329
317 1 1 . 1 1 59 59 LYS N N 82 116.000 116.000 117.826 -1.826 18329
318 1 1 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.034 -0.184 18329
319 1 1 . 1 1 59 59 LYS C C 82 180.300 180.300 178.803 1.497 18329
320 1 1 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.286 1.814 18329
321 1 1 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.469 -0.269 18329
322 1 1 . 1 1 59 59 LYS H H 82 8.000 8.000 8.255 -0.255 18329
323 1 1 . 1 1 60 60 VAL N N 83 122.920 122.920 118.770 4.150 18329
324 1 1 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.838 -0.508 18329
325 1 1 . 1 1 60 60 VAL C C 83 178.300 178.300 178.028 0.272 18329
326 1 1 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.526 2.374 18329
327 1 1 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.976 -0.776 18329
328 1 1 . 1 1 60 60 VAL H H 83 8.110 8.110 7.475 0.635 18329
329 1 1 . 1 1 61 61 ARG N N 84 121.770 121.770 119.730 2.040 18329
330 1 1 . 1 1 61 61 ARG C C 84 179.500 179.500 178.641 0.859 18329
331 1 1 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.276 -0.076 18329
332 1 1 . 1 1 61 61 ARG CB C 84 30.800 30.800 30.049 0.751 18329
333 1 1 . 1 1 61 61 ARG H H 84 8.710 8.710 7.326 1.384 18329
334 1 1 . 1 1 62 62 ALA N N 85 119.450 119.450 120.615 -1.165 18329
335 1 1 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.120 -0.230 18329
336 1 1 . 1 1 62 62 ALA C C 85 179.500 179.500 178.856 0.644 18329
337 1 1 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.276 -0.277 18329
338 1 1 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.630 0.370 18329
339 1 1 . 1 1 62 62 ALA H H 85 8.700 8.700 8.350 0.350 18329
340 1 1 . 1 1 63 63 THR N N 86 106.650 106.650 110.313 -3.663 18329
341 1 1 . 1 1 63 63 THR HA H 86 3.970 3.970 4.164 -0.194 18329
342 1 1 . 1 1 63 63 THR C C 86 177.700 177.700 176.432 1.268 18329
343 1 1 . 1 1 63 63 THR CA C 86 66.000 66.000 65.320 0.679 18329
344 1 1 . 1 1 63 63 THR CB C 86 68.200 68.200 68.353 -0.153 18329
345 1 1 . 1 1 63 63 THR H H 86 8.150 8.150 7.657 0.492 18329
346 1 1 . 1 1 64 64 THR N N 87 120.430 120.430 119.625 0.805 18329
347 1 1 . 1 1 64 64 THR HA H 87 4.050 4.050 3.999 0.051 18329
348 1 1 . 1 1 64 64 THR C C 87 176.800 176.800 176.206 0.594 18329
349 1 1 . 1 1 64 64 THR CA C 87 67.300 67.300 67.294 0.006 18329
350 1 1 . 1 1 64 64 THR CB C 87 68.600 68.600 68.135 0.465 18329
351 1 1 . 1 1 64 64 THR H H 87 7.920 7.920 7.731 0.189 18329
352 1 1 . 1 1 65 65 VAL N N 88 119.230 119.230 120.368 -1.138 18329
353 1 1 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.846 0.134 18329
354 1 1 . 1 1 65 65 VAL C C 88 178.500 178.500 177.035 1.465 18329
355 1 1 . 1 1 65 65 VAL CA C 88 65.600 65.600 64.827 0.773 18329
356 1 1 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.142 0.558 18329
357 1 1 . 1 1 65 65 VAL H H 88 7.380 7.380 7.454 -0.074 18329
358 1 1 . 1 1 66 66 ALA N N 89 124.260 124.260 122.296 1.964 18329
359 1 1 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.930 0.320 18329
360 1 1 . 1 1 66 66 ALA C C 89 179.900 179.900 179.127 0.773 18329
361 1 1 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.119 -0.219 18329
362 1 1 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.192 1.308 18329
363 1 1 . 1 1 66 66 ALA H H 89 8.390 8.390 7.557 0.833 18329
364 1 1 . 1 1 67 67 GLU N N 90 120.180 120.180 118.880 1.300 18329
365 1 1 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.989 -0.269 18329
366 1 1 . 1 1 67 67 GLU C C 90 177.600 177.600 178.940 -1.340 18329
367 1 1 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.424 0.476 18329
368 1 1 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.349 -1.049 18329
369 1 1 . 1 1 67 67 GLU H H 90 8.520 8.520 8.267 0.253 18329
370 1 1 . 1 1 68 68 LYS N N 91 116.340 116.340 118.344 -2.004 18329
371 1 1 . 1 1 68 68 LYS HA H 91 3.960 3.960 3.982 -0.022 18329
372 1 1 . 1 1 68 68 LYS C C 91 179.200 179.200 178.999 0.201 18329
373 1 1 . 1 1 68 68 LYS CA C 91 59.800 59.800 59.242 0.558 18329
374 1 1 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.237 -0.237 18329
375 1 1 . 1 1 68 68 LYS H H 91 7.210 7.210 7.510 -0.300 18329
376 1 1 . 1 1 69 69 PHE N N 92 120.990 120.990 119.165 1.825 18329
377 1 1 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.213 0.297 18329
378 1 1 . 1 1 69 69 PHE C C 92 175.100 175.100 177.423 -2.323 18329
379 1 1 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.355 -1.555 18329
380 1 1 . 1 1 69 69 PHE CB C 92 39.200 39.200 38.900 0.300 18329
381 1 1 . 1 1 69 69 PHE H H 92 7.180 7.180 7.522 -0.342 18329
382 1 1 . 1 1 70 70 VAL N N 93 120.330 120.330 119.263 1.067 18329
383 1 1 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.636 -0.546 18329
384 1 1 . 1 1 70 70 VAL C C 93 177.500 177.500 177.794 -0.294 18329
385 1 1 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.810 0.090 18329
386 1 1 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.403 -0.003 18329
387 1 1 . 1 1 70 70 VAL H H 93 7.930 7.930 7.619 0.311 18329
388 1 1 . 1 1 71 71 ILE N N 94 120.410 120.410 119.062 1.348 18329
389 1 1 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.576 0.254 18329
390 1 1 . 1 1 71 71 ILE C C 94 177.700 177.700 177.392 0.308 18329
391 1 1 . 1 1 71 71 ILE CA C 94 65.000 65.000 65.222 -0.221 18329
392 1 1 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.009 0.291 18329
393 1 1 . 1 1 71 71 ILE H H 94 8.180 8.180 7.415 0.765 18329
394 1 1 . 1 1 72 72 ALA N N 95 122.440 122.440 122.387 0.053 18329
395 1 1 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.898 0.062 18329
396 1 1 . 1 1 72 72 ALA C C 95 179.600 179.600 179.569 0.031 18329
397 1 1 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.066 0.834 18329
398 1 1 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.858 -0.657 18329
399 1 1 . 1 1 72 72 ALA H H 95 7.340 7.340 7.433 -0.093 18329
400 1 1 . 1 1 73 73 ILE N N 96 119.330 119.330 119.961 -0.631 18329
401 1 1 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.641 -0.201 18329
402 1 1 . 1 1 73 73 ILE C C 96 177.400 177.400 177.905 -0.505 18329
403 1 1 . 1 1 73 73 ILE CA C 96 62.800 62.800 64.406 -1.606 18329
404 1 1 . 1 1 73 73 ILE CB C 96 34.400 34.400 37.357 -2.957 18329
405 1 1 . 1 1 73 73 ILE H H 96 7.820 7.820 7.485 0.335 18329
406 1 1 . 1 1 74 74 GLU N N 97 118.440 118.440 120.543 -2.103 18329
407 1 1 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.891 -0.201 18329
408 1 1 . 1 1 74 74 GLU C C 97 180.500 180.500 178.890 1.610 18329
409 1 1 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.617 0.083 18329
410 1 1 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.288 0.412 18329
411 1 1 . 1 1 74 74 GLU H H 97 8.380 8.380 7.585 0.795 18329
412 1 1 . 1 1 75 75 GLU N N 98 120.470 120.470 119.800 0.670 18329
413 1 1 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.045 -0.105 18329
414 1 1 . 1 1 75 75 GLU C C 98 180.600 180.600 178.755 1.845 18329
415 1 1 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.163 0.537 18329
416 1 1 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.757 0.443 18329
417 1 1 . 1 1 75 75 GLU H H 98 8.800 8.800 8.293 0.507 18329
418 1 1 . 1 1 76 76 GLU N N 99 119.230 119.230 119.632 -0.402 18329
419 1 1 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.064 0.076 18329
420 1 1 . 1 1 76 76 GLU C C 99 178.900 178.900 178.684 0.216 18329
421 1 1 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.862 -0.262 18329
422 1 1 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.635 -0.335 18329
423 1 1 . 1 1 76 76 GLU H H 99 8.840 8.840 8.454 0.386 18329
424 1 1 . 1 1 77 77 ALA N N 100 121.950 121.950 121.746 0.204 18329
425 1 1 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.163 -0.163 18329
426 1 1 . 1 1 77 77 ALA C C 100 179.000 179.000 179.619 -0.619 18329
427 1 1 . 1 1 77 77 ALA CA C 100 56.300 56.300 56.010 0.291 18329
428 1 1 . 1 1 77 77 ALA CB C 100 16.800 16.800 17.971 -1.171 18329
429 1 1 . 1 1 77 77 ALA H H 100 9.400 9.400 8.281 1.119 18329
430 1 1 . 1 1 78 78 THR N N 101 111.820 111.820 112.648 -0.828 18329
431 1 1 . 1 1 78 78 THR HA H 101 3.750 3.750 4.044 -0.294 18329
432 1 1 . 1 1 78 78 THR CA C 101 67.500 67.500 65.939 1.561 18329
433 1 1 . 1 1 78 78 THR CB C 101 68.600 68.600 68.398 0.202 18329
434 1 1 . 1 1 78 78 THR H H 101 7.770 7.770 7.625 0.145 18329
435 1 1 . 1 1 79 79 LYS N N 102 122.940 122.940 119.524 3.416 18329
436 1 1 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.236 -0.146 18329
437 1 1 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.324 0.876 18329
438 1 1 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.507 -0.007 18329
439 1 1 . 1 1 79 79 LYS H H 102 7.870 7.870 7.488 0.382 18329
440 1 1 . 1 1 80 80 LEU N N 103 117.690 117.690 121.770 -4.080 18329
441 1 1 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.078 0.412 18329
442 1 1 . 1 1 80 80 LEU C C 103 178.140 178.140 177.470 0.670 18329
443 1 1 . 1 1 80 80 LEU CA C 103 54.000 54.000 56.035 -2.035 18329
444 1 1 . 1 1 80 80 LEU CB C 103 43.100 43.100 41.745 1.355 18329
445 1 1 . 1 1 80 80 LEU H H 103 7.550 7.550 8.306 -0.756 18329
446 1 1 . 1 1 81 81 LYS N N 104 122.210 122.210 118.539 3.671 18329
447 1 1 . 1 1 81 81 LYS HA H 104 3.930 3.930 3.984 -0.054 18329
448 1 1 . 1 1 81 81 LYS C C 104 178.000 178.000 176.801 1.199 18329
449 1 1 . 1 1 81 81 LYS CA C 104 61.300 61.300 58.897 2.403 18329
450 1 1 . 1 1 81 81 LYS CB C 104 32.800 32.800 32.279 0.520 18329
451 1 1 . 1 1 81 81 LYS H H 104 7.500 7.500 7.655 -0.155 18329
452 1 1 . 1 1 82 82 GLU N N 105 114.920 114.920 116.693 -1.773 18329
453 1 1 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.137 0.423 18329
454 1 1 . 1 1 82 82 GLU C C 105 177.900 177.900 177.157 0.743 18329
455 1 1 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.523 0.137 18329
456 1 1 . 1 1 82 82 GLU CB C 105 30.400 30.400 29.817 0.583 18329
457 1 1 . 1 1 82 82 GLU H H 105 8.780 8.780 7.960 0.820 18329
458 1 1 . 1 1 83 83 THR N N 106 107.260 107.260 111.198 -3.938 18329
459 1 1 . 1 1 83 83 THR HA H 106 4.550 4.550 3.841 0.709 18329
460 1 1 . 1 1 83 83 THR C C 106 176.300 176.300 174.842 1.458 18329
461 1 1 . 1 1 83 83 THR CA C 106 61.900 61.900 64.201 -2.300 18329
462 1 1 . 1 1 83 83 THR CB C 106 70.400 70.400 68.403 1.997 18329
463 1 1 . 1 1 83 83 THR H H 106 7.570 7.570 8.610 -1.040 18329
464 1 1 . 1 1 84 84 GLY N N 107 112.110 112.110 112.000 0.110 18329
465 1 1 . 1 1 84 84 GLY C C 107 172.800 172.800 172.874 -0.074 18329
466 1 1 . 1 1 84 84 GLY CA C 107 45.400 45.400 44.680 0.720 18329
467 1 1 . 1 1 84 84 GLY H H 107 9.000 9.000 8.357 0.643 18329
468 1 1 . 1 1 85 85 SER N N 108 119.030 119.030 114.845 4.185 18329
469 1 1 . 1 1 85 85 SER CA C 108 56.300 56.300 58.554 -2.254 18329
470 1 1 . 1 1 85 85 SER CB C 108 66.300 66.300 63.257 3.043 18329
471 1 1 . 1 1 85 85 SER H H 108 8.950 8.950 8.639 0.311 18329
472 1 1 . 1 1 86 86 SER HA H 109 4.480 4.480 4.426 0.054 18329
473 1 1 . 1 1 86 86 SER C C 109 177.000 177.000 176.953 0.047 18329
474 1 1 . 1 1 86 86 SER CA C 109 61.600 61.600 60.663 0.937 18329
475 1 1 . 1 1 86 86 SER CB C 109 62.900 62.900 63.310 -0.410 18329
476 1 1 . 1 1 87 87 GLY N N 110 108.100 108.100 109.935 -1.835 18329
477 1 1 . 1 1 87 87 GLY C C 110 177.100 177.100 176.376 0.724 18329
478 1 1 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.962 -0.762 18329
479 1 1 . 1 1 87 87 GLY H H 110 8.480 8.480 8.529 -0.049 18329
480 1 1 . 1 1 88 88 GLU N N 111 123.040 123.040 122.226 0.814 18329
481 1 1 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.124 -0.434 18329
482 1 1 . 1 1 88 88 GLU C C 111 177.700 177.700 179.068 -1.368 18329
483 1 1 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.066 1.434 18329
484 1 1 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.023 -0.323 18329
485 1 1 . 1 1 88 88 GLU H H 111 7.560 7.560 7.598 -0.038 18329
486 1 1 . 1 1 89 89 PHE N N 112 118.270 118.270 119.352 -1.082 18329
487 1 1 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.365 0.055 18329
488 1 1 . 1 1 89 89 PHE C C 112 178.600 178.600 177.983 0.617 18329
489 1 1 . 1 1 89 89 PHE CA C 112 61.100 61.100 60.826 0.274 18329
490 1 1 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.447 -0.547 18329
491 1 1 . 1 1 89 89 PHE H H 112 7.200 7.200 7.606 -0.406 18329
492 1 1 . 1 1 90 90 SER N N 113 115.980 115.980 115.335 0.645 18329
493 1 1 . 1 1 90 90 SER HA H 113 4.290 4.290 4.137 0.153 18329
494 1 1 . 1 1 90 90 SER C C 113 178.600 178.600 176.453 2.147 18329
495 1 1 . 1 1 90 90 SER CA C 113 62.700 62.700 62.102 0.598 18329
496 1 1 . 1 1 90 90 SER CB C 113 62.800 62.800 62.979 -0.179 18329
497 1 1 . 1 1 90 90 SER H H 113 8.830 8.830 8.818 0.012 18329
498 1 1 . 1 1 91 91 ALA N N 114 123.130 123.130 123.543 -0.413 18329
499 1 1 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.200 0.180 18329
500 1 1 . 1 1 91 91 ALA C C 114 181.300 181.300 179.681 1.619 18329
501 1 1 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.903 -0.203 18329
502 1 1 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.238 0.162 18329
503 1 1 . 1 1 91 91 ALA H H 114 7.580 7.580 7.566 0.014 18329
504 1 1 . 1 1 92 92 MET N N 115 118.700 118.700 117.585 1.115 18329
505 1 1 . 1 1 92 92 MET HA H 115 3.980 3.980 4.336 -0.356 18329
506 1 1 . 1 1 92 92 MET C C 115 178.000 178.000 178.433 -0.433 18329
507 1 1 . 1 1 92 92 MET CA C 115 61.000 61.000 57.326 3.674 18329
508 1 1 . 1 1 92 92 MET CB C 115 31.400 31.400 31.859 -0.459 18329
509 1 1 . 1 1 92 92 MET H H 115 7.880 7.880 8.030 -0.150 18329
510 1 1 . 1 1 93 93 TYR N N 116 119.200 119.200 121.069 -1.869 18329
511 1 1 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.156 0.124 18329
512 1 1 . 1 1 93 93 TYR C C 116 176.300 176.300 177.229 -0.929 18329
513 1 1 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.645 0.455 18329
514 1 1 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.437 -0.137 18329
515 1 1 . 1 1 93 93 TYR H H 116 7.870 7.870 8.039 -0.169 18329
516 1 1 . 1 1 94 94 ASP N N 117 120.210 120.210 120.263 -0.053 18329
517 1 1 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.475 -0.285 18329
518 1 1 . 1 1 94 94 ASP C C 117 179.000 179.000 178.306 0.694 18329
519 1 1 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.367 0.333 18329
520 1 1 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.546 -0.546 18329
521 1 1 . 1 1 94 94 ASP H H 117 8.720 8.720 8.035 0.685 18329
522 1 1 . 1 1 95 95 LEU N N 118 118.420 118.420 119.818 -1.398 18329
523 1 1 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.002 0.208 18329
524 1 1 . 1 1 95 95 LEU C C 118 178.600 178.600 179.183 -0.583 18329
525 1 1 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.776 -0.076 18329
526 1 1 . 1 1 95 95 LEU CB C 118 43.100 43.100 42.000 1.100 18329
527 1 1 . 1 1 95 95 LEU H H 118 7.510 7.510 7.507 0.003 18329
528 1 1 . 1 1 96 96 MET N N 119 118.470 118.470 119.305 -0.835 18329
529 1 1 . 1 1 96 96 MET HA H 119 3.990 3.990 4.058 -0.068 18329
530 1 1 . 1 1 96 96 MET C C 119 177.500 177.500 178.203 -0.703 18329
531 1 1 . 1 1 96 96 MET CA C 119 60.500 60.500 57.654 2.845 18329
532 1 1 . 1 1 96 96 MET CB C 119 33.900 33.900 31.537 2.363 18329
533 1 1 . 1 1 96 96 MET H H 119 7.820 7.820 7.356 0.464 18329
534 1 1 . 1 1 97 97 PHE N N 120 119.580 119.580 120.688 -1.108 18329
535 1 1 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.073 -0.263 18329
536 1 1 . 1 1 97 97 PHE C C 120 178.800 178.800 177.804 0.996 18329
537 1 1 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.596 0.204 18329
538 1 1 . 1 1 97 97 PHE CB C 120 39.200 39.200 39.049 0.151 18329
539 1 1 . 1 1 97 97 PHE H H 120 8.940 8.940 7.903 1.037 18329
540 1 1 . 1 1 98 98 GLU N N 121 119.940 119.940 117.690 2.250 18329
541 1 1 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.078 -0.198 18329
542 1 1 . 1 1 98 98 GLU C C 121 180.800 180.800 178.783 2.017 18329
543 1 1 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.210 0.590 18329
544 1 1 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.428 -0.228 18329
545 1 1 . 1 1 98 98 GLU H H 121 8.690 8.690 8.624 0.066 18329
546 1 1 . 1 1 99 99 VAL N N 122 115.350 115.350 117.289 -1.939 18329
547 1 1 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.750 -0.010 18329
548 1 1 . 1 1 99 99 VAL C C 122 176.500 176.500 177.185 -0.685 18329
549 1 1 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.722 -0.221 18329
550 1 1 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.780 -0.480 18329
551 1 1 . 1 1 99 99 VAL H H 122 8.210 8.210 7.902 0.308 18329
552 1 1 . 1 1 100 100 SER N N 123 115.450 115.450 115.859 -0.409 18329
553 1 1 . 1 1 100 100 SER HA H 123 4.270 4.270 4.009 0.261 18329
554 1 1 . 1 1 100 100 SER C C 123 174.700 174.700 176.509 -1.809 18329
555 1 1 . 1 1 100 100 SER CA C 123 62.000 62.000 61.133 0.867 18329
556 1 1 . 1 1 100 100 SER H H 123 7.520 7.520 8.072 -0.552 18329
557 1 1 . 1 1 101 101 LYS N N 124 120.310 120.310 122.467 -2.157 18329
558 1 1 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.118 -0.148 18329
559 1 1 . 1 1 101 101 LYS C C 124 176.600 176.600 175.577 1.023 18329
560 1 1 . 1 1 101 101 LYS CA C 124 61.100 61.100 60.482 0.618 18329
561 1 1 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.607 -2.107 18329
562 1 1 . 1 1 101 101 LYS H H 124 6.930 6.930 7.347 -0.417 18329
563 1 1 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.122 0.138 18329
564 1 1 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.876 -0.676 18329
565 1 1 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.203 -0.603 18329
566 1 1 . 1 1 103 103 LEU N N 126 116.020 116.020 115.698 0.322 18329
567 1 1 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.134 -0.254 18329
568 1 1 . 1 1 103 103 LEU C C 126 177.900 177.900 178.838 -0.938 18329
569 1 1 . 1 1 103 103 LEU CA C 126 57.700 57.700 56.631 1.069 18329
570 1 1 . 1 1 103 103 LEU CB C 126 41.800 41.800 40.736 1.064 18329
571 1 1 . 1 1 103 103 LEU H H 126 6.520 6.520 7.394 -0.874 18329
572 1 1 . 1 1 104 104 GLN N N 127 120.500 120.500 120.231 0.269 18329
573 1 1 . 1 1 104 104 GLN C C 127 180.600 180.600 178.363 2.237 18329
574 1 1 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.641 -0.341 18329
575 1 1 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.188 0.812 18329
576 1 1 . 1 1 104 104 GLN H H 127 8.160 8.160 7.988 0.172 18329
577 1 1 . 1 1 105 105 LYS N N 128 120.000 120.000 118.273 1.727 18329
578 1 1 . 1 1 105 105 LYS HA H 128 4.050 4.050 3.935 0.115 18329
579 1 1 . 1 1 105 105 LYS C C 128 177.100 177.100 179.241 -2.141 18329
580 1 1 . 1 1 105 105 LYS CA C 128 58.500 58.500 58.719 -0.219 18329
581 1 1 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.082 -0.682 18329
582 1 1 . 1 1 105 105 LYS H H 128 7.810 7.810 7.455 0.355 18329
583 1 1 . 1 1 106 106 LEU N N 129 118.530 118.530 117.491 1.039 18329
584 1 1 . 1 1 106 106 LEU HA H 129 3.970 3.970 3.957 0.013 18329
585 1 1 . 1 1 106 106 LEU C C 129 175.200 175.200 176.287 -1.087 18329
586 1 1 . 1 1 106 106 LEU CA C 129 54.500 54.500 55.667 -1.167 18329
587 1 1 . 1 1 106 106 LEU CB C 129 42.400 42.400 43.004 -0.604 18329
588 1 1 . 1 1 106 106 LEU H H 129 7.220 7.220 7.376 -0.156 18329
589 1 1 . 1 1 107 107 GLY N N 130 101.490 101.490 105.119 -3.629 18329
590 1 1 . 1 1 107 107 GLY C C 130 174.800 174.800 173.584 1.216 18329
591 1 1 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.212 0.888 18329
592 1 1 . 1 1 107 107 GLY H H 130 7.560 7.560 7.608 -0.048 18329
593 1 1 . 1 1 108 108 ILE N N 131 121.340 121.340 121.012 0.328 18329
594 1 1 . 1 1 108 108 ILE HA H 131 4.150 4.150 4.116 0.034 18329
595 1 1 . 1 1 108 108 ILE C C 131 174.300 174.300 175.919 -1.619 18329
596 1 1 . 1 1 108 108 ILE CA C 131 60.400 60.400 61.055 -0.655 18329
597 1 1 . 1 1 108 108 ILE CB C 131 35.200 35.200 38.632 -3.432 18329
598 1 1 . 1 1 108 108 ILE H H 131 7.290 7.290 8.081 -0.791 18329
599 1 1 . 1 1 109 109 GLN N N 132 125.650 125.650 117.430 8.220 18329
600 1 1 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.438 -0.428 18329
601 1 1 . 1 1 109 109 GLN C C 132 176.800 176.800 176.364 0.436 18329
602 1 1 . 1 1 109 109 GLN CA C 132 57.600 57.600 55.507 2.093 18329
603 1 1 . 1 1 109 109 GLN CB C 132 29.000 29.000 30.932 -1.932 18329
604 1 1 . 1 1 109 109 GLN H H 132 8.080 8.080 8.000 0.080 18329
605 1 1 . 1 1 110 110 GLU N N 133 114.890 114.890 122.255 -7.365 18329
606 1 1 . 1 1 110 110 GLU HA H 133 4.150 4.150 4.430 -0.280 18329
607 1 1 . 1 1 110 110 GLU C C 133 177.100 177.100 176.465 0.635 18329
608 1 1 . 1 1 110 110 GLU CA C 133 57.100 57.100 55.944 1.156 18329
609 1 1 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.033 -0.733 18329
610 1 1 . 1 1 110 110 GLU H H 133 9.270 9.270 8.774 0.496 18329
611 1 1 . 1 1 111 111 MET N N 134 121.210 121.210 121.681 -0.471 18329
612 1 1 . 1 1 111 111 MET HA H 134 4.350 4.350 4.108 0.242 18329
613 1 1 . 1 1 111 111 MET C C 134 177.500 177.500 177.205 0.295 18329
614 1 1 . 1 1 111 111 MET CA C 134 57.900 57.900 58.876 -0.976 18329
615 1 1 . 1 1 111 111 MET CB C 134 33.300 33.300 32.339 0.961 18329
616 1 1 . 1 1 111 111 MET H H 134 7.620 7.620 7.819 -0.199 18329
617 1 1 . 1 1 112 112 THR N N 135 113.170 113.170 109.427 3.743 18329
618 1 1 . 1 1 112 112 THR HA H 135 3.920 3.920 3.969 -0.049 18329
619 1 1 . 1 1 112 112 THR C C 135 176.400 176.400 176.274 0.126 18329
620 1 1 . 1 1 112 112 THR CA C 135 65.900 65.900 65.312 0.588 18329
621 1 1 . 1 1 112 112 THR CB C 135 68.200 68.200 68.371 -0.171 18329
622 1 1 . 1 1 112 112 THR H H 135 8.320 8.320 8.661 -0.341 18329
623 1 1 . 1 1 113 113 LYS N N 136 123.440 123.440 121.132 2.308 18329
624 1 1 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.328 -0.398 18329
625 1 1 . 1 1 113 113 LYS C C 136 177.600 177.600 178.490 -0.890 18329
626 1 1 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.215 -0.916 18329
627 1 1 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.550 -0.550 18329
628 1 1 . 1 1 113 113 LYS H H 136 8.060 8.060 7.217 0.843 18329
629 1 1 . 1 1 114 114 THR N N 137 114.590 114.590 118.204 -3.614 18329
630 1 1 . 1 1 114 114 THR HA H 137 4.000 4.000 4.095 -0.095 18329
631 1 1 . 1 1 114 114 THR C C 137 176.800 176.800 176.643 0.157 18329
632 1 1 . 1 1 114 114 THR CA C 137 67.600 67.600 67.355 0.245 18329
633 1 1 . 1 1 114 114 THR CB C 137 69.200 69.200 68.557 0.643 18329
634 1 1 . 1 1 114 114 THR H H 137 7.950 7.950 8.504 -0.554 18329
635 1 1 . 1 1 115 115 VAL N N 138 119.080 119.080 120.219 -1.139 18329
636 1 1 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.781 0.039 18329
637 1 1 . 1 1 115 115 VAL C C 138 176.900 176.900 177.267 -0.367 18329
638 1 1 . 1 1 115 115 VAL CA C 138 66.800 66.800 65.896 0.904 18329
639 1 1 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.881 0.619 18329
640 1 1 . 1 1 115 115 VAL H H 138 7.320 7.320 8.628 -1.308 18329
641 1 1 . 1 1 116 116 SER N N 139 116.630 116.630 113.854 2.776 18329
642 1 1 . 1 1 116 116 SER HA H 139 4.680 4.680 4.399 0.281 18329
643 1 1 . 1 1 116 116 SER C C 139 179.000 179.000 176.896 2.104 18329
644 1 1 . 1 1 116 116 SER CA C 139 61.400 61.400 61.386 0.014 18329
645 1 1 . 1 1 116 116 SER CB C 139 62.800 62.800 62.818 -0.018 18329
646 1 1 . 1 1 116 116 SER H H 139 8.990 8.990 7.760 1.230 18329
647 1 1 . 1 1 117 117 ASP N N 140 124.220 124.220 123.557 0.663 18329
648 1 1 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.532 -0.172 18329
649 1 1 . 1 1 117 117 ASP C C 140 179.900 179.900 177.239 2.661 18329
650 1 1 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.592 0.708 18329
651 1 1 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.689 -1.189 18329
652 1 1 . 1 1 117 117 ASP H H 140 9.480 9.480 8.602 0.878 18329
653 1 1 . 1 1 118 118 ALA N N 141 121.420 121.420 120.705 0.715 18329
654 1 1 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.244 0.036 18329
655 1 1 . 1 1 118 118 ALA C C 141 179.800 179.800 179.052 0.748 18329
656 1 1 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.422 -0.022 18329
657 1 1 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.358 0.642 18329
658 1 1 . 1 1 118 118 ALA H H 141 7.340 7.340 7.583 -0.243 18329
659 1 1 . 1 1 119 119 ALA N N 142 121.680 121.680 120.539 1.141 18329
660 1 1 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.047 0.083 18329
661 1 1 . 1 1 119 119 ALA C C 142 178.800 178.800 179.398 -0.598 18329
662 1 1 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.774 -1.574 18329
663 1 1 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.463 -0.163 18329
664 1 1 . 1 1 119 119 ALA H H 142 7.890 7.890 7.698 0.192 18329
665 1 1 . 1 1 120 120 GLU N N 143 117.690 117.690 117.416 0.274 18329
666 1 1 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.068 -0.128 18329
667 1 1 . 1 1 120 120 GLU C C 143 178.100 178.100 178.654 -0.554 18329
668 1 1 . 1 1 120 120 GLU CA C 143 58.700 58.700 58.735 -0.035 18329
669 1 1 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.311 0.189 18329
670 1 1 . 1 1 120 120 GLU H H 143 7.500 7.500 7.877 -0.377 18329
671 1 1 . 1 1 121 121 GLU N N 144 115.680 115.680 119.517 -3.837 18329
672 1 1 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.168 -0.008 18329
673 1 1 . 1 1 121 121 GLU C C 144 176.100 176.100 176.973 -0.873 18329
674 1 1 . 1 1 121 121 GLU CA C 144 56.900 56.900 58.272 -1.372 18329
675 1 1 . 1 1 121 121 GLU CB C 144 31.100 31.100 30.378 0.722 18329
676 1 1 . 1 1 121 121 GLU H H 144 6.970 6.970 7.730 -0.760 18329
677 1 1 . 1 1 122 122 ASN N N 145 117.750 117.750 115.555 2.195 18329
678 1 1 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.037 -0.047 18329
679 1 1 . 1 1 122 122 ASN C C 145 185.300 185.300 172.647 12.653 18329
680 1 1 . 1 1 122 122 ASN CA C 145 50.200 50.200 51.295 -1.095 18329
681 1 1 . 1 1 122 122 ASN CB C 145 41.100 41.100 39.827 1.274 18329
682 1 1 . 1 1 122 122 ASN H H 145 7.670 7.670 8.030 -0.360 18329
683 1 1 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.463 0.167 18329
684 1 1 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.231 -1.231 18329
685 1 1 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.502 -0.202 18329
686 1 1 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.204 0.236 18329
687 1 1 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.801 -0.901 18329
688 1 1 . 1 1 124 124 PRO CB C 147 28.400 28.400 31.856 -3.456 18329
689 1 1 . 1 1 125 125 THR N N 148 106.090 106.090 116.013 -9.923 18329
690 1 1 . 1 1 125 125 THR HA H 148 4.530 4.530 4.461 0.069 18329
691 1 1 . 1 1 125 125 THR C C 148 174.300 174.300 173.383 0.917 18329
692 1 1 . 1 1 125 125 THR CA C 148 61.200 61.200 61.745 -0.545 18329
693 1 1 . 1 1 125 125 THR CB C 148 68.600 68.600 70.050 -1.450 18329
694 1 1 . 1 1 125 125 THR H H 148 7.800 7.800 8.034 -0.234 18329
695 1 1 . 1 1 126 126 THR N N 149 108.650 108.650 114.079 -5.429 18329
696 1 1 . 1 1 126 126 THR HA H 149 4.170 4.170 4.492 -0.322 18329
697 1 1 . 1 1 126 126 THR C C 149 173.100 173.100 173.538 -0.438 18329
698 1 1 . 1 1 126 126 THR CA C 149 58.800 58.800 60.304 -1.504 18329
699 1 1 . 1 1 126 126 THR CB C 149 73.100 73.100 71.649 1.451 18329
700 1 1 . 1 1 126 126 THR H H 149 7.350 7.350 7.170 0.180 18329
701 1 1 . 1 1 127 127 ALA N N 150 123.270 123.270 123.756 -0.486 18329
702 1 1 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.647 -0.627 18329
703 1 1 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.119 -0.119 18329
704 1 1 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.619 0.081 18329
705 1 1 . 1 1 127 127 ALA H H 150 7.750 7.750 8.585 -0.835 18329
706 1 1 . 1 1 128 128 GLN N N 151 114.920 114.920 116.177 -1.257 18329
707 1 1 . 1 1 128 128 GLN HA H 151 3.750 3.750 3.954 -0.204 18329
708 1 1 . 1 1 128 128 GLN C C 151 178.400 178.400 178.438 -0.038 18329
709 1 1 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.168 0.632 18329
710 1 1 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.167 -0.967 18329
711 1 1 . 1 1 128 128 GLN H H 151 8.300 8.300 8.733 -0.433 18329
712 1 1 . 1 1 129 129 GLY N N 152 107.280 107.280 107.842 -0.562 18329
713 1 1 . 1 1 129 129 GLY C C 152 174.900 174.900 175.549 -0.649 18329
714 1 1 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.588 0.612 18329
715 1 1 . 1 1 129 129 GLY H H 152 7.920 7.920 7.512 0.408 18329
716 1 1 . 1 1 130 130 VAL N N 153 119.440 119.440 122.191 -2.751 18329
717 1 1 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.614 -0.144 18329
718 1 1 . 1 1 130 130 VAL C C 153 177.700 177.700 177.323 0.377 18329
719 1 1 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.675 2.125 18329
720 1 1 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.762 -0.062 18329
721 1 1 . 1 1 130 130 VAL H H 153 7.390 7.390 7.184 0.206 18329
722 1 1 . 1 1 131 131 LEU N N 154 118.990 118.990 119.776 -0.786 18329
723 1 1 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.891 0.019 18329
724 1 1 . 1 1 131 131 LEU C C 154 180.400 180.400 178.489 1.911 18329
725 1 1 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.831 -0.531 18329
726 1 1 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.283 -0.283 18329
727 1 1 . 1 1 131 131 LEU H H 154 8.640 8.640 7.567 1.073 18329
728 1 1 . 1 1 132 132 GLU N N 155 120.980 120.980 119.889 1.091 18329
729 1 1 . 1 1 132 132 GLU HA H 155 4.120 4.120 3.963 0.157 18329
730 1 1 . 1 1 132 132 GLU C C 155 179.400 179.400 179.046 0.354 18329
731 1 1 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.642 -0.743 18329
732 1 1 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.334 -0.134 18329
733 1 1 . 1 1 132 132 GLU H H 155 8.000 8.000 7.429 0.571 18329
734 1 1 . 1 1 133 133 ILE N N 156 121.830 121.830 120.404 1.426 18329
735 1 1 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.666 -0.086 18329
736 1 1 . 1 1 133 133 ILE C C 156 178.000 178.000 177.845 0.155 18329
737 1 1 . 1 1 133 133 ILE CA C 156 65.500 65.500 64.687 0.813 18329
738 1 1 . 1 1 133 133 ILE CB C 156 39.600 39.600 37.690 1.910 18329
739 1 1 . 1 1 133 133 ILE H H 156 8.040 8.040 7.372 0.668 18329
740 1 1 . 1 1 134 134 ALA N N 157 121.470 121.470 122.283 -0.813 18329
741 1 1 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.854 0.046 18329
742 1 1 . 1 1 134 134 ALA C C 157 178.800 178.800 179.579 -0.779 18329
743 1 1 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.676 -0.376 18329
744 1 1 . 1 1 134 134 ALA CB C 157 18.100 18.100 17.982 0.118 18329
745 1 1 . 1 1 134 134 ALA H H 157 8.950 8.950 8.491 0.459 18329
746 1 1 . 1 1 135 135 LYS N N 158 118.470 118.470 117.856 0.614 18329
747 1 1 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.938 -0.028 18329
748 1 1 . 1 1 135 135 LYS C C 158 179.300 179.300 179.320 -0.020 18329
749 1 1 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.726 -0.226 18329
750 1 1 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.232 -0.832 18329
751 1 1 . 1 1 135 135 LYS H H 158 8.000 8.000 7.934 0.066 18329
752 1 1 . 1 1 136 136 LYS N N 159 118.000 118.000 119.238 -1.238 18329
753 1 1 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.071 -0.021 18329
754 1 1 . 1 1 136 136 LYS C C 159 180.200 180.200 179.458 0.742 18329
755 1 1 . 1 1 136 136 LYS CA C 159 59.500 59.500 58.895 0.605 18329
756 1 1 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.122 -1.222 18329
757 1 1 . 1 1 136 136 LYS H H 159 7.530 7.530 7.817 -0.287 18329
758 1 1 . 1 1 137 137 MET N N 160 120.990 120.990 119.772 1.218 18329
759 1 1 . 1 1 137 137 MET HA H 160 3.800 3.800 4.242 -0.442 18329
760 1 1 . 1 1 137 137 MET C C 160 177.400 177.400 178.626 -1.226 18329
761 1 1 . 1 1 137 137 MET CA C 160 60.600 60.600 59.482 1.118 18329
762 1 1 . 1 1 137 137 MET CB C 160 31.800 31.800 32.842 -1.042 18329
763 1 1 . 1 1 137 137 MET H H 160 8.660 8.660 8.510 0.150 18329
764 1 1 . 1 1 138 138 ARG N N 161 119.480 119.480 120.034 -0.554 18329
765 1 1 . 1 1 138 138 ARG HA H 161 3.800 3.800 4.072 -0.272 18329
766 1 1 . 1 1 138 138 ARG C C 161 177.900 177.900 179.036 -1.136 18329
767 1 1 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.713 0.887 18329
768 1 1 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.256 -0.457 18329
769 1 1 . 1 1 138 138 ARG H H 161 9.280 9.280 8.381 0.899 18329
770 1 1 . 1 1 139 139 GLU N N 162 118.700 118.700 118.454 0.246 18329
771 1 1 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.060 -0.060 18329
772 1 1 . 1 1 139 139 GLU C C 162 179.100 179.100 178.644 0.456 18329
773 1 1 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.228 0.572 18329
774 1 1 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.322 0.178 18329
775 1 1 . 1 1 139 139 GLU H H 162 8.430 8.430 8.283 0.147 18329
776 1 1 . 1 1 140 140 LYS N N 163 119.310 119.310 119.625 -0.315 18329
777 1 1 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.109 0.101 18329
778 1 1 . 1 1 140 140 LYS C C 163 177.900 177.900 179.603 -1.703 18329
779 1 1 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.964 -0.063 18329
780 1 1 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.538 -1.438 18329
781 1 1 . 1 1 140 140 LYS H H 163 7.440 7.440 7.598 -0.158 18329
782 1 1 . 1 1 141 141 LEU N N 164 117.630 117.630 120.835 -3.205 18329
783 1 1 . 1 1 141 141 LEU HA H 164 3.890 3.890 3.998 -0.108 18329
784 1 1 . 1 1 141 141 LEU C C 164 178.700 178.700 178.982 -0.282 18329
785 1 1 . 1 1 141 141 LEU CA C 164 58.000 58.000 58.047 -0.047 18329
786 1 1 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.839 -0.339 18329
787 1 1 . 1 1 141 141 LEU H H 164 8.180 8.180 8.418 -0.238 18329
788 1 1 . 1 1 142 142 GLN N N 165 117.710 117.710 117.697 0.013 18329
789 1 1 . 1 1 142 142 GLN HA H 165 4.310 4.310 4.048 0.262 18329
790 1 1 . 1 1 142 142 GLN C C 165 179.200 179.200 178.174 1.026 18329
791 1 1 . 1 1 142 142 GLN CA C 165 58.500 58.500 58.439 0.061 18329
792 1 1 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.521 -1.021 18329
793 1 1 . 1 1 142 142 GLN H H 165 8.730 8.730 7.929 0.801 18329
794 1 1 . 1 1 143 143 ARG N N 166 121.410 121.410 119.699 1.711 18329
795 1 1 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.053 0.137 18329
796 1 1 . 1 1 143 143 ARG C C 166 179.700 179.700 178.100 1.600 18329
797 1 1 . 1 1 143 143 ARG CA C 166 59.800 59.800 58.934 0.866 18329
798 1 1 . 1 1 143 143 ARG CB C 166 30.200 30.200 30.033 0.167 18329
799 1 1 . 1 1 143 143 ARG H H 166 8.050 8.050 8.297 -0.247 18329
800 1 1 . 1 1 144 144 VAL N N 167 120.950 120.950 115.642 5.308 18329
801 1 1 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.761 -0.001 18329
802 1 1 . 1 1 144 144 VAL C C 167 179.200 179.200 177.468 1.732 18329
803 1 1 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.613 -0.213 18329
804 1 1 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.009 1.091 18329
805 1 1 . 1 1 144 144 VAL H H 167 8.190 8.190 7.463 0.727 18329
806 1 1 . 1 1 145 145 HIS N N 168 123.520 123.520 118.746 4.774 18329
807 1 1 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.460 -0.560 18329
808 1 1 . 1 1 145 145 HIS C C 168 177.100 177.100 177.470 -0.370 18329
809 1 1 . 1 1 145 145 HIS CA C 168 61.300 61.300 58.512 2.788 18329
810 1 1 . 1 1 145 145 HIS CB C 168 29.900 29.900 29.846 0.054 18329
811 1 1 . 1 1 145 145 HIS H H 168 9.240 9.240 8.065 1.175 18329
812 1 1 . 1 1 146 146 THR N N 169 115.020 115.020 116.914 -1.894 18329
813 1 1 . 1 1 146 146 THR HA H 169 3.860 3.860 3.877 -0.017 18329
814 1 1 . 1 1 146 146 THR C C 169 175.700 175.700 176.568 -0.868 18329
815 1 1 . 1 1 146 146 THR CA C 169 67.200 67.200 66.860 0.340 18329
816 1 1 . 1 1 146 146 THR CB C 169 69.300 69.300 68.461 0.839 18329
817 1 1 . 1 1 146 146 THR H H 169 8.750 8.750 7.596 1.154 18329
818 1 1 . 1 1 147 147 LYS N N 170 120.300 120.300 121.203 -0.903 18329
819 1 1 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.913 0.087 18329
820 1 1 . 1 1 147 147 LYS C C 170 179.300 179.300 178.903 0.397 18329
821 1 1 . 1 1 147 147 LYS CA C 170 59.100 59.100 60.491 -1.391 18329
822 1 1 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.231 -0.431 18329
823 1 1 . 1 1 147 147 LYS H H 170 8.020 8.020 7.916 0.104 18329
824 1 1 . 1 1 148 148 ASN N N 171 117.600 117.600 118.860 -1.260 18329
825 1 1 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.568 -0.248 18329
826 1 1 . 1 1 148 148 ASN C C 171 175.400 175.400 177.943 -2.543 18329
827 1 1 . 1 1 148 148 ASN CA C 171 57.700 57.700 56.279 1.421 18329
828 1 1 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.638 1.062 18329
829 1 1 . 1 1 148 148 ASN H H 171 7.810 7.810 7.714 0.096 18329
830 1 1 . 1 1 149 149 TYR N N 172 121.560 121.560 121.788 -0.228 18329
831 1 1 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.239 -0.349 18329
832 1 1 . 1 1 149 149 TYR C C 172 176.900 176.900 177.772 -0.872 18329
833 1 1 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.956 -0.457 18329
834 1 1 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.383 0.537 18329
835 1 1 . 1 1 149 149 TYR H H 172 9.020 9.020 8.181 0.839 18329
836 1 1 . 1 1 150 150 CYS N N 173 116.050 116.050 118.064 -2.014 18329
837 1 1 . 1 1 150 150 CYS C C 173 177.100 177.100 176.451 0.649 18329
838 1 1 . 1 1 150 150 CYS CA C 173 58.400 58.400 61.123 -2.723 18329
839 1 1 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.393 12.207 18329
840 1 1 . 1 1 150 150 CYS H H 173 8.810 8.810 8.387 0.423 18329
841 1 1 . 1 1 151 151 THR N N 174 117.190 117.190 115.201 1.989 18329
842 1 1 . 1 1 151 151 THR HA H 174 3.880 3.880 4.011 -0.131 18329
843 1 1 . 1 1 151 151 THR C C 174 176.000 176.000 176.915 -0.915 18329
844 1 1 . 1 1 151 151 THR CA C 174 66.900 66.900 65.329 1.571 18329
845 1 1 . 1 1 151 151 THR CB C 174 68.500 68.500 68.247 0.253 18329
846 1 1 . 1 1 151 151 THR H H 174 7.720 7.720 8.290 -0.570 18329
847 1 1 . 1 1 152 152 LEU N N 175 123.110 123.110 121.930 1.180 18329
848 1 1 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.001 -0.191 18329
849 1 1 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.484 0.516 18329
850 1 1 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.161 0.339 18329
851 1 1 . 1 1 152 152 LEU H H 175 7.870 7.870 7.789 0.081 18329
852 1 1 . 1 1 153 153 LYS N N 176 117.270 117.270 118.819 -1.549 18329
853 1 1 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.877 -0.177 18329
854 1 1 . 1 1 153 153 LYS C C 176 179.100 179.100 177.679 1.421 18329
855 1 1 . 1 1 153 153 LYS CA C 176 56.700 56.700 58.550 -1.851 18329
856 1 1 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.706 -1.806 18329
857 1 1 . 1 1 153 153 LYS H H 176 7.900 7.900 7.557 0.343 18329
858 1 1 . 1 1 154 154 LYS N N 177 119.290 119.290 118.870 0.420 18329
859 1 1 . 1 1 154 154 LYS HA H 177 4.260 4.260 3.911 0.349 18329
860 1 1 . 1 1 154 154 LYS C C 177 178.100 178.100 178.387 -0.287 18329
861 1 1 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.401 -1.601 18329
862 1 1 . 1 1 154 154 LYS CB C 177 31.800 31.800 31.722 0.078 18329
863 1 1 . 1 1 154 154 LYS H H 177 7.540 7.540 7.859 -0.319 18329
864 1 1 . 1 1 155 155 LYS N N 178 118.910 118.910 118.972 -0.062 18329
865 1 1 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.055 -0.005 18329
866 1 1 . 1 1 155 155 LYS C C 178 178.100 178.100 178.006 0.094 18329
867 1 1 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.825 -0.826 18329
868 1 1 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.012 0.188 18329
869 1 1 . 1 1 155 155 LYS H H 178 7.630 7.630 7.742 -0.112 18329
870 1 1 . 1 1 156 156 GLU N N 179 117.950 117.950 117.102 0.848 18329
871 1 1 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.191 -0.081 18329
872 1 1 . 1 1 156 156 GLU C C 179 176.700 176.700 178.008 -1.308 18329
873 1 1 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.215 -0.715 18329
874 1 1 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.665 -0.065 18329
875 1 1 . 1 1 156 156 GLU H H 179 7.560 7.560 7.627 -0.067 18329
876 1 1 . 1 1 157 157 ASN N N 180 116.590 116.590 115.773 0.817 18329
877 1 1 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.521 0.199 18329
878 1 1 . 1 1 157 157 ASN C C 180 175.000 175.000 176.250 -1.250 18329
879 1 1 . 1 1 157 157 ASN CA C 180 52.700 52.700 54.851 -2.151 18329
880 1 1 . 1 1 157 157 ASN CB C 180 38.800 38.800 39.175 -0.375 18329
881 1 1 . 1 1 157 157 ASN H H 180 7.820 7.820 7.982 -0.162 18329
882 1 1 . 1 1 158 158 SER HA H 181 4.450 4.450 4.053 0.397 18329
883 1 1 . 1 1 158 158 SER CA C 181 60.400 60.400 60.791 -0.391 18329
884 1 1 . 1 1 158 158 SER CB C 181 63.500 63.500 62.008 1.492 18329
885 1 1 . 1 1 158 158 SER H H 181 8.030 8.030 8.802 -0.772 18329
886 1 1 . 1 1 159 159 THR N N 182 112.800 112.800 114.350 -1.550 18329
887 1 1 . 1 1 159 159 THR HA H 182 4.380 4.380 4.234 0.146 18329
888 1 1 . 1 1 159 159 THR C C 182 174.300 174.300 174.810 -0.510 18329
889 1 1 . 1 1 159 159 THR CA C 182 61.800 61.800 63.629 -1.829 18329
890 1 1 . 1 1 159 159 THR CB C 182 69.100 69.100 69.216 -0.116 18329
891 1 1 . 1 1 159 159 THR H H 182 8.070 8.070 8.065 0.005 18329
892 1 1 . 1 1 160 160 PHE N N 183 123.120 123.120 120.017 3.103 18329
893 1 1 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.297 0.143 18329
894 1 1 . 1 1 160 160 PHE C C 183 175.100 175.100 176.043 -0.943 18329
895 1 1 . 1 1 160 160 PHE CA C 183 58.900 58.900 58.448 0.452 18329
896 1 1 . 1 1 160 160 PHE CB C 183 40.000 40.000 38.052 1.948 18329
897 1 1 . 1 1 160 160 PHE H H 183 7.900 7.900 8.050 -0.150 18329
898 1 1 . 1 1 161 161 THR N N 184 119.330 119.330 112.459 6.871 18329
899 1 1 . 1 1 161 161 THR HA H 184 4.190 4.190 4.272 -0.082 18329
900 1 1 . 1 1 161 161 THR CA C 184 60.700 60.700 62.498 -1.798 18329
901 1 1 . 1 1 161 161 THR CB C 184 70.700 70.700 68.148 2.552 18329
902 1 1 . 1 1 161 161 THR H H 184 7.810 7.810 8.424 -0.614 18329
903 1 1 . 1 1 162 162 ASP N N 185 123.190 123.190 121.181 2.009 18329
904 1 1 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.698 -0.288 18329
905 1 1 . 1 1 162 162 ASP C C 185 176.900 176.900 174.635 2.265 18329
906 1 1 . 1 1 162 162 ASP CA C 185 53.900 53.900 54.805 -0.905 18329
907 1 1 . 1 1 162 162 ASP CB C 185 44.000 44.000 42.061 1.939 18329
908 1 1 . 1 1 162 162 ASP H H 185 8.000 8.000 7.820 0.180 18329
909 1 1 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.576 -0.096 18329
910 1 1 . 1 1 163 163 GLU CA C 186 58.800 58.800 56.047 2.753 18329
911 1 1 . 1 1 163 163 GLU CB C 186 28.100 28.100 30.648 -2.548 18329
912 1 1 . 1 1 166 166 LYS N N 189 118.150 118.150 124.332 -6.182 18329
913 1 1 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.495 -0.275 18329
914 1 1 . 1 1 166 166 LYS C C 189 177.500 177.500 176.378 1.122 18329
915 1 1 . 1 1 166 166 LYS CA C 189 58.000 58.000 56.326 1.674 18329
916 1 1 . 1 1 166 166 LYS CB C 189 32.600 32.600 32.224 0.376 18329
917 1 1 . 1 1 166 166 LYS H H 189 8.890 8.890 8.216 0.674 18329
918 1 1 . 1 1 167 167 ASN N N 190 116.210 116.210 121.139 -4.929 18329
919 1 1 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.678 0.282 18329
920 1 1 . 1 1 167 167 ASN C C 190 174.900 174.900 175.234 -0.334 18329
921 1 1 . 1 1 167 167 ASN CA C 190 52.900 52.900 53.333 -0.433 18329
922 1 1 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.522 -0.122 18329
923 1 1 . 1 1 167 167 ASN H H 190 8.030 8.030 8.721 -0.691 18329
924 1 2 . 1 1 2 2 ALA N N 25 125.000 125.000 124.915 0.085 18329
925 1 2 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.168 0.202 18329
926 1 2 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.644 -0.344 18329
927 1 2 . 1 1 2 2 ALA CB C 25 19.700 19.700 18.181 1.519 18329
928 1 2 . 1 1 2 2 ALA H H 25 8.690 8.690 8.233 0.457 18329
929 1 2 . 1 1 3 3 GLY N N 26 106.920 106.920 105.967 0.953 18329
930 1 2 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.168 -1.168 18329
931 1 2 . 1 1 3 3 GLY H H 26 7.940 7.940 7.964 -0.024 18329
932 1 2 . 1 1 4 4 LEU N N 27 119.140 119.140 122.780 -3.640 18329
933 1 2 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.556 -0.146 18329
934 1 2 . 1 1 4 4 LEU C C 27 177.100 177.100 177.731 -0.631 18329
935 1 2 . 1 1 4 4 LEU CA C 27 54.400 54.400 53.325 1.075 18329
936 1 2 . 1 1 4 4 LEU CB C 27 42.100 42.100 40.583 1.517 18329
937 1 2 . 1 1 4 4 LEU H H 27 8.210 8.210 8.056 0.154 18329
938 1 2 . 1 1 5 5 THR N N 28 112.940 112.940 111.092 1.848 18329
939 1 2 . 1 1 5 5 THR HA H 28 4.650 4.650 3.991 0.659 18329
940 1 2 . 1 1 5 5 THR C C 28 175.500 175.500 175.989 -0.489 18329
941 1 2 . 1 1 5 5 THR CA C 28 60.100 60.100 64.535 -4.435 18329
942 1 2 . 1 1 5 5 THR CB C 28 72.600 72.600 69.200 3.400 18329
943 1 2 . 1 1 5 5 THR H H 28 9.220 9.220 7.490 1.730 18329
944 1 2 . 1 1 6 6 GLY N N 29 108.230 108.230 107.728 0.502 18329
945 1 2 . 1 1 6 6 GLY C C 29 174.800 174.800 174.151 0.649 18329
946 1 2 . 1 1 6 6 GLY CA C 29 46.000 46.000 44.978 1.022 18329
947 1 2 . 1 1 6 6 GLY H H 29 8.520 8.520 7.808 0.712 18329
948 1 2 . 1 1 7 7 ALA HA H 30 4.040 4.040 3.911 0.129 18329
949 1 2 . 1 1 7 7 ALA CA C 30 54.800 54.800 55.658 -0.858 18329
950 1 2 . 1 1 7 7 ALA CB C 30 18.200 18.200 18.237 -0.037 18329
951 1 2 . 1 1 8 8 THR N N 31 116.970 116.970 114.930 2.040 18329
952 1 2 . 1 1 8 8 THR HA H 31 3.740 3.740 3.875 -0.135 18329
953 1 2 . 1 1 8 8 THR C C 31 175.300 175.300 176.751 -1.451 18329
954 1 2 . 1 1 8 8 THR CA C 31 67.000 67.000 66.443 0.557 18329
955 1 2 . 1 1 8 8 THR CB C 31 68.700 68.700 68.412 0.288 18329
956 1 2 . 1 1 8 8 THR H H 31 8.110 8.110 8.151 -0.041 18329
957 1 2 . 1 1 9 9 LYS N N 32 120.540 120.540 122.481 -1.941 18329
958 1 2 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.071 -0.481 18329
959 1 2 . 1 1 9 9 LYS C C 32 176.900 176.900 178.928 -2.028 18329
960 1 2 . 1 1 9 9 LYS CA C 32 59.800 59.800 58.754 1.046 18329
961 1 2 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.612 0.788 18329
962 1 2 . 1 1 9 9 LYS H H 32 6.860 6.860 7.351 -0.491 18329
963 1 2 . 1 1 10 10 ILE N N 33 115.940 115.940 120.325 -4.385 18329
964 1 2 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.736 -0.026 18329
965 1 2 . 1 1 10 10 ILE C C 33 179.000 179.000 178.348 0.652 18329
966 1 2 . 1 1 10 10 ILE CA C 33 64.000 64.000 65.592 -1.592 18329
967 1 2 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.863 0.137 18329
968 1 2 . 1 1 10 10 ILE H H 33 7.380 7.380 8.745 -1.365 18329
969 1 2 . 1 1 11 11 ARG N N 34 118.350 118.350 120.375 -2.025 18329
970 1 2 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.000 0.040 18329
971 1 2 . 1 1 11 11 ARG C C 34 180.000 180.000 178.807 1.193 18329
972 1 2 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.925 -0.525 18329
973 1 2 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.162 0.138 18329
974 1 2 . 1 1 11 11 ARG H H 34 8.250 8.250 8.555 -0.305 18329
975 1 2 . 1 1 12 12 LEU N N 35 117.420 117.420 119.620 -2.200 18329
976 1 2 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.030 0.140 18329
977 1 2 . 1 1 12 12 LEU C C 35 179.000 179.000 178.904 0.096 18329
978 1 2 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.974 0.027 18329
979 1 2 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.813 -1.013 18329
980 1 2 . 1 1 12 12 LEU H H 35 8.340 8.340 8.099 0.241 18329
981 1 2 . 1 1 13 13 GLU N N 36 117.890 117.890 120.005 -2.115 18329
982 1 2 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.912 0.108 18329
983 1 2 . 1 1 13 13 GLU C C 36 180.100 180.100 178.607 1.493 18329
984 1 2 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.906 0.294 18329
985 1 2 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.671 -1.371 18329
986 1 2 . 1 1 13 13 GLU H H 36 8.610 8.610 8.286 0.324 18329
987 1 2 . 1 1 14 14 ARG N N 37 121.100 121.100 119.900 1.200 18329
988 1 2 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.063 0.177 18329
989 1 2 . 1 1 14 14 ARG C C 37 178.100 178.100 178.746 -0.646 18329
990 1 2 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.511 -1.011 18329
991 1 2 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.349 -0.149 18329
992 1 2 . 1 1 14 14 ARG H H 37 7.980 7.980 8.438 -0.458 18329
993 1 2 . 1 1 15 15 SER N N 38 115.420 115.420 114.932 0.488 18329
994 1 2 . 1 1 15 15 SER HA H 38 4.380 4.380 4.452 -0.072 18329
995 1 2 . 1 1 15 15 SER C C 38 177.300 177.300 175.953 1.347 18329
996 1 2 . 1 1 15 15 SER CA C 38 62.200 62.200 60.822 1.378 18329
997 1 2 . 1 1 15 15 SER CB C 38 63.200 63.200 63.450 -0.250 18329
998 1 2 . 1 1 15 15 SER H H 38 8.230 8.230 8.309 -0.079 18329
999 1 2 . 1 1 16 16 ALA N N 39 123.970 123.970 123.873 0.097 18329
1000 1 2 . 1 1 16 16 ALA HA H 39 3.630 3.630 4.224 -0.594 18329
1001 1 2 . 1 1 16 16 ALA C C 39 179.500 179.500 179.361 0.139 18329
1002 1 2 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.633 0.067 18329
1003 1 2 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.528 -0.528 18329
1004 1 2 . 1 1 16 16 ALA H H 39 8.280 8.280 8.101 0.179 18329
1005 1 2 . 1 1 17 17 LYS N N 40 121.690 121.690 119.467 2.223 18329
1006 1 2 . 1 1 17 17 LYS HA H 40 4.090 4.090 4.009 0.081 18329
1007 1 2 . 1 1 17 17 LYS C C 40 178.000 178.000 177.848 0.152 18329
1008 1 2 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.348 -0.948 18329
1009 1 2 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.267 -0.467 18329
1010 1 2 . 1 1 17 17 LYS H H 40 7.930 7.930 8.311 -0.381 18329
1011 1 2 . 1 1 18 18 ASP N N 41 118.730 118.730 119.070 -0.340 18329
1012 1 2 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.479 -0.119 18329
1013 1 2 . 1 1 18 18 ASP C C 41 179.900 179.900 178.738 1.162 18329
1014 1 2 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.849 0.852 18329
1015 1 2 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.329 -0.729 18329
1016 1 2 . 1 1 18 18 ASP H H 41 8.320 8.320 7.668 0.652 18329
1017 1 2 . 1 1 19 19 ILE N N 42 118.180 118.180 120.103 -1.923 18329
1018 1 2 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.743 -0.053 18329
1019 1 2 . 1 1 19 19 ILE C C 42 177.400 177.400 177.834 -0.434 18329
1020 1 2 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.399 -0.199 18329
1021 1 2 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.868 0.032 18329
1022 1 2 . 1 1 19 19 ILE H H 42 7.420 7.420 7.822 -0.402 18329
1023 1 2 . 1 1 20 20 THR N N 43 113.360 113.360 111.785 1.575 18329
1024 1 2 . 1 1 20 20 THR HA H 43 3.770 3.770 4.023 -0.253 18329
1025 1 2 . 1 1 20 20 THR C C 43 177.800 177.800 176.242 1.558 18329
1026 1 2 . 1 1 20 20 THR CA C 43 66.400 66.400 65.392 1.008 18329
1027 1 2 . 1 1 20 20 THR CB C 43 67.400 67.400 68.583 -1.183 18329
1028 1 2 . 1 1 20 20 THR H H 43 7.610 7.610 7.550 0.060 18329
1029 1 2 . 1 1 21 21 ASP N N 44 123.650 123.650 121.974 1.676 18329
1030 1 2 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.402 0.008 18329
1031 1 2 . 1 1 21 21 ASP C C 44 179.200 179.200 178.033 1.167 18329
1032 1 2 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.172 0.028 18329
1033 1 2 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.724 -1.124 18329
1034 1 2 . 1 1 21 21 ASP H H 44 9.260 9.260 8.063 1.197 18329
1035 1 2 . 1 1 22 22 GLU N N 45 123.560 123.560 118.740 4.820 18329
1036 1 2 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.128 0.242 18329
1037 1 2 . 1 1 22 22 GLU C C 45 178.500 178.500 179.371 -0.871 18329
1038 1 2 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.942 -0.742 18329
1039 1 2 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.738 -0.538 18329
1040 1 2 . 1 1 22 22 GLU H H 45 7.750 7.750 7.822 -0.072 18329
1041 1 2 . 1 1 23 23 ILE N N 46 119.940 119.940 115.111 4.829 18329
1042 1 2 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.791 -0.171 18329
1043 1 2 . 1 1 23 23 ILE C C 46 177.600 177.600 177.541 0.059 18329
1044 1 2 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.176 1.424 18329
1045 1 2 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.455 -0.454 18329
1046 1 2 . 1 1 23 23 ILE H H 46 8.360 8.360 7.298 1.062 18329
1047 1 2 . 1 1 24 24 ASP N N 47 120.730 120.730 121.640 -0.910 18329
1048 1 2 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.383 0.017 18329
1049 1 2 . 1 1 24 24 ASP C C 47 178.900 178.900 178.278 0.622 18329
1050 1 2 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.406 0.094 18329
1051 1 2 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.125 -0.225 18329
1052 1 2 . 1 1 24 24 ASP H H 47 8.280 8.280 8.047 0.233 18329
1053 1 2 . 1 1 25 25 ALA N N 48 123.870 123.870 121.156 2.714 18329
1054 1 2 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.052 0.068 18329
1055 1 2 . 1 1 25 25 ALA C C 48 180.400 180.400 179.294 1.106 18329
1056 1 2 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.904 0.596 18329
1057 1 2 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.414 -0.614 18329
1058 1 2 . 1 1 25 25 ALA H H 48 7.880 7.880 7.517 0.363 18329
1059 1 2 . 1 1 26 26 ILE N N 49 121.970 121.970 117.735 4.235 18329
1060 1 2 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.884 -0.154 18329
1061 1 2 . 1 1 26 26 ILE C C 49 178.400 178.400 178.123 0.277 18329
1062 1 2 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.677 1.223 18329
1063 1 2 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.747 -0.247 18329
1064 1 2 . 1 1 26 26 ILE H H 49 8.710 8.710 7.483 1.227 18329
1065 1 2 . 1 1 27 27 LYS N N 50 119.820 119.820 120.029 -0.209 18329
1066 1 2 . 1 1 27 27 LYS HA H 50 3.880 3.880 4.152 -0.272 18329
1067 1 2 . 1 1 27 27 LYS C C 50 179.900 179.900 179.219 0.681 18329
1068 1 2 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.772 0.628 18329
1069 1 2 . 1 1 27 27 LYS CB C 50 31.900 31.900 32.106 -0.206 18329
1070 1 2 . 1 1 27 27 LYS H H 50 8.540 8.540 7.897 0.643 18329
1071 1 2 . 1 1 28 28 LYS N N 51 121.960 121.960 118.822 3.138 18329
1072 1 2 . 1 1 28 28 LYS HA H 51 4.090 4.090 4.059 0.031 18329
1073 1 2 . 1 1 28 28 LYS C C 51 179.200 179.200 179.052 0.148 18329
1074 1 2 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.321 -0.021 18329
1075 1 2 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.336 -0.936 18329
1076 1 2 . 1 1 28 28 LYS H H 51 8.070 8.070 7.582 0.488 18329
1077 1 2 . 1 1 29 29 ASP N N 52 121.710 121.710 119.604 2.106 18329
1078 1 2 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.493 -0.023 18329
1079 1 2 . 1 1 29 29 ASP C C 52 178.500 178.500 178.586 -0.086 18329
1080 1 2 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.857 0.143 18329
1081 1 2 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.314 0.686 18329
1082 1 2 . 1 1 29 29 ASP H H 52 8.340 8.340 7.856 0.484 18329
1083 1 2 . 1 1 30 30 ALA N N 53 121.990 121.990 121.618 0.372 18329
1084 1 2 . 1 1 30 30 ALA HA H 53 3.340 3.340 4.096 -0.756 18329
1085 1 2 . 1 1 30 30 ALA C C 53 179.500 179.500 179.397 0.103 18329
1086 1 2 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.663 0.438 18329
1087 1 2 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.431 -0.331 18329
1088 1 2 . 1 1 30 30 ALA H H 53 8.800 8.800 7.917 0.883 18329
1089 1 2 . 1 1 31 31 ALA N N 54 119.970 119.970 121.888 -1.918 18329
1090 1 2 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.103 0.047 18329
1091 1 2 . 1 1 31 31 ALA C C 54 181.600 181.600 178.515 3.085 18329
1092 1 2 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.338 0.362 18329
1093 1 2 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.330 -0.530 18329
1094 1 2 . 1 1 31 31 ALA H H 54 7.730 7.730 7.567 0.163 18329
1095 1 2 . 1 1 32 32 LEU N N 55 119.660 119.660 116.535 3.125 18329
1096 1 2 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.057 0.083 18329
1097 1 2 . 1 1 32 32 LEU C C 55 179.100 179.100 177.030 2.070 18329
1098 1 2 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.638 0.362 18329
1099 1 2 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.573 0.327 18329
1100 1 2 . 1 1 32 32 LEU H H 55 7.660 7.660 7.599 0.061 18329
1101 1 2 . 1 1 33 33 LYS N N 56 117.160 117.160 117.301 -0.141 18329
1102 1 2 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.498 -0.288 18329
1103 1 2 . 1 1 33 33 LYS C C 56 176.600 176.600 176.795 -0.195 18329
1104 1 2 . 1 1 33 33 LYS CA C 56 56.100 56.100 55.062 1.038 18329
1105 1 2 . 1 1 33 33 LYS CB C 56 33.200 33.200 34.513 -1.313 18329
1106 1 2 . 1 1 33 33 LYS H H 56 7.610 7.610 7.590 0.020 18329
1107 1 2 . 1 1 34 34 GLY N N 57 108.680 108.680 111.643 -2.963 18329
1108 1 2 . 1 1 34 34 GLY C C 57 174.400 174.400 173.838 0.562 18329
1109 1 2 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.216 0.984 18329
1110 1 2 . 1 1 34 34 GLY H H 57 7.710 7.710 8.681 -0.971 18329
1111 1 2 . 1 1 35 35 VAL N N 58 121.000 121.000 120.419 0.581 18329
1112 1 2 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.241 -0.341 18329
1113 1 2 . 1 1 35 35 VAL C C 58 174.200 174.200 174.943 -0.743 18329
1114 1 2 . 1 1 35 35 VAL CA C 58 61.500 61.500 60.844 0.656 18329
1115 1 2 . 1 1 35 35 VAL CB C 58 32.800 32.800 33.769 -0.969 18329
1116 1 2 . 1 1 35 35 VAL H H 58 7.990 7.990 7.738 0.252 18329
1117 1 2 . 1 1 36 36 ASN N N 59 124.960 124.960 125.679 -0.719 18329
1118 1 2 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.829 -0.159 18329
1119 1 2 . 1 1 36 36 ASN C C 59 175.700 175.700 175.562 0.138 18329
1120 1 2 . 1 1 36 36 ASN CA C 59 51.600 51.600 52.585 -0.985 18329
1121 1 2 . 1 1 36 36 ASN CB C 59 39.100 39.100 38.954 0.146 18329
1122 1 2 . 1 1 36 36 ASN H H 59 8.460 8.460 8.338 0.122 18329
1123 1 2 . 1 1 37 37 PHE N N 60 124.460 124.460 120.308 4.152 18329
1124 1 2 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.331 -0.191 18329
1125 1 2 . 1 1 37 37 PHE C C 60 177.000 177.000 175.322 1.678 18329
1126 1 2 . 1 1 37 37 PHE CA C 60 60.400 60.400 59.621 0.779 18329
1127 1 2 . 1 1 37 37 PHE CB C 60 39.200 39.200 38.443 0.757 18329
1128 1 2 . 1 1 37 37 PHE H H 60 8.780 8.780 8.553 0.227 18329
1129 1 2 . 1 1 38 38 ASP N N 61 119.270 119.270 116.818 2.452 18329
1130 1 2 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.107 0.383 18329
1131 1 2 . 1 1 38 38 ASP C C 61 177.000 177.000 175.302 1.698 18329
1132 1 2 . 1 1 38 38 ASP CA C 61 55.500 55.500 56.828 -1.328 18329
1133 1 2 . 1 1 38 38 ASP CB C 61 40.000 40.000 39.788 0.213 18329
1134 1 2 . 1 1 38 38 ASP H H 61 8.400 8.400 8.319 0.081 18329
1135 1 2 . 1 1 39 39 ALA N N 62 122.020 122.020 121.364 0.656 18329
1136 1 2 . 1 1 39 39 ALA HA H 62 4.200 4.200 3.745 0.455 18329
1137 1 2 . 1 1 39 39 ALA C C 62 178.300 178.300 177.247 1.053 18329
1138 1 2 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.144 0.756 18329
1139 1 2 . 1 1 39 39 ALA CB C 62 18.500 18.500 17.721 0.779 18329
1140 1 2 . 1 1 39 39 ALA H H 62 7.740 7.740 8.182 -0.442 18329
1141 1 2 . 1 1 40 40 PHE N N 63 116.940 116.940 120.128 -3.188 18329
1142 1 2 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.204 0.176 18329
1143 1 2 . 1 1 40 40 PHE C C 63 176.100 176.100 176.289 -0.189 18329
1144 1 2 . 1 1 40 40 PHE CA C 63 58.300 58.300 58.909 -0.609 18329
1145 1 2 . 1 1 40 40 PHE CB C 63 38.800 38.800 39.285 -0.485 18329
1146 1 2 . 1 1 40 40 PHE H H 63 7.730 7.730 7.679 0.051 18329
1147 1 2 . 1 1 41 41 LYS N N 64 119.840 119.840 121.825 -1.985 18329
1148 1 2 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.445 -0.225 18329
1149 1 2 . 1 1 41 41 LYS C C 64 176.100 176.100 175.946 0.154 18329
1150 1 2 . 1 1 41 41 LYS CA C 64 56.600 56.600 56.504 0.096 18329
1151 1 2 . 1 1 41 41 LYS CB C 64 32.900 32.900 33.279 -0.379 18329
1152 1 2 . 1 1 41 41 LYS H H 64 7.650 7.650 8.515 -0.865 18329
1153 1 2 . 1 1 42 42 ASP N N 65 120.770 120.770 118.005 2.765 18329
1154 1 2 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.611 -0.040 18329
1155 1 2 . 1 1 42 42 ASP C C 65 176.100 176.100 176.567 -0.467 18329
1156 1 2 . 1 1 42 42 ASP CA C 65 54.200 54.200 54.868 -0.668 18329
1157 1 2 . 1 1 42 42 ASP CB C 65 40.900 40.900 40.748 0.152 18329
1158 1 2 . 1 1 42 42 ASP H H 65 8.030 8.030 8.350 -0.320 18329
1159 1 2 . 1 1 43 43 LYS N N 66 122.070 122.070 120.852 1.218 18329
1160 1 2 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.140 0.140 18329
1161 1 2 . 1 1 43 43 LYS C C 66 176.800 176.800 176.829 -0.029 18329
1162 1 2 . 1 1 43 43 LYS CA C 66 56.500 56.500 57.139 -0.639 18329
1163 1 2 . 1 1 43 43 LYS CB C 66 32.800 32.800 32.577 0.223 18329
1164 1 2 . 1 1 43 43 LYS H H 66 8.180 8.180 8.369 -0.189 18329
1165 1 2 . 1 1 44 44 LYS N N 67 122.170 122.170 119.468 2.702 18329
1166 1 2 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.173 0.177 18329
1167 1 2 . 1 1 44 44 LYS C C 67 177.000 177.000 177.240 -0.240 18329
1168 1 2 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.948 -0.348 18329
1169 1 2 . 1 1 44 44 LYS CB C 67 32.800 32.800 33.085 -0.285 18329
1170 1 2 . 1 1 44 44 LYS H H 67 8.460 8.460 7.814 0.646 18329
1171 1 2 . 1 1 45 45 THR N N 68 114.390 114.390 119.445 -5.055 18329
1172 1 2 . 1 1 45 45 THR HA H 68 4.330 4.330 4.460 -0.130 18329
1173 1 2 . 1 1 45 45 THR C C 68 175.200 175.200 175.449 -0.249 18329
1174 1 2 . 1 1 45 45 THR CA C 68 62.000 62.000 62.177 -0.177 18329
1175 1 2 . 1 1 45 45 THR CB C 68 69.900 69.900 69.939 -0.039 18329
1176 1 2 . 1 1 45 45 THR H H 68 8.120 8.120 8.312 -0.192 18329
1177 1 2 . 1 1 46 46 GLY N N 69 111.200 111.200 109.073 2.127 18329
1178 1 2 . 1 1 46 46 GLY CA C 69 45.200 45.200 44.641 0.560 18329
1179 1 2 . 1 1 46 46 GLY H H 69 8.450 8.450 8.452 -0.002 18329
1180 1 2 . 1 1 47 47 SER CA C 70 58.400 58.400 58.411 -0.011 18329
1181 1 2 . 1 1 47 47 SER CB C 70 64.000 64.000 63.868 0.132 18329
1182 1 2 . 1 1 48 48 GLY N N 71 111.200 111.200 112.275 -1.075 18329
1183 1 2 . 1 1 48 48 GLY CA C 71 45.000 45.000 46.201 -1.201 18329
1184 1 2 . 1 1 48 48 GLY H H 71 8.580 8.580 8.598 -0.018 18329
1185 1 2 . 1 1 49 49 VAL N N 72 118.910 118.910 118.873 0.037 18329
1186 1 2 . 1 1 49 49 VAL HA H 72 4.130 4.130 4.048 0.082 18329
1187 1 2 . 1 1 49 49 VAL C C 72 176.100 176.100 176.506 -0.406 18329
1188 1 2 . 1 1 49 49 VAL CA C 72 62.100 62.100 62.541 -0.441 18329
1189 1 2 . 1 1 49 49 VAL CB C 72 32.500 32.500 32.767 -0.267 18329
1190 1 2 . 1 1 49 49 VAL H H 72 7.860 7.860 7.497 0.363 18329
1191 1 2 . 1 1 50 50 SER N N 73 118.500 118.500 116.627 1.873 18329
1192 1 2 . 1 1 50 50 SER C C 73 176.100 176.100 173.297 2.803 18329
1193 1 2 . 1 1 50 50 SER CA C 73 58.300 58.300 58.567 -0.267 18329
1194 1 2 . 1 1 50 50 SER CB C 73 63.800 63.800 61.857 1.943 18329
1195 1 2 . 1 1 50 50 SER H H 73 8.300 8.300 8.429 -0.129 18329
1196 1 2 . 1 1 51 51 GLU N N 74 122.560 122.560 122.703 -0.143 18329
1197 1 2 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.491 -0.221 18329
1198 1 2 . 1 1 51 51 GLU CA C 74 55.700 55.700 56.228 -0.528 18329
1199 1 2 . 1 1 51 51 GLU CB C 74 30.500 30.500 32.770 -2.270 18329
1200 1 2 . 1 1 51 51 GLU H H 74 8.360 8.360 7.954 0.406 18329
1201 1 2 . 1 1 52 52 ASN N N 75 122.830 122.830 119.540 3.290 18329
1202 1 2 . 1 1 52 52 ASN HA H 75 4.820 4.820 5.056 -0.236 18329
1203 1 2 . 1 1 52 52 ASN C C 75 174.800 174.800 174.534 0.266 18329
1204 1 2 . 1 1 52 52 ASN CA C 75 51.400 51.400 51.695 -0.295 18329
1205 1 2 . 1 1 52 52 ASN CB C 75 39.200 39.200 38.836 0.364 18329
1206 1 2 . 1 1 52 52 ASN H H 75 8.450 8.450 8.517 -0.067 18329
1207 1 2 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.511 -0.331 18329
1208 1 2 . 1 1 53 53 PRO CA C 76 65.200 65.200 63.863 1.337 18329
1209 1 2 . 1 1 53 53 PRO CB C 76 32.000 32.000 32.000 -0.000 18329
1210 1 2 . 1 1 54 54 PHE N N 77 118.060 118.060 121.137 -3.077 18329
1211 1 2 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.199 0.071 18329
1212 1 2 . 1 1 54 54 PHE C C 77 177.500 177.500 176.929 0.571 18329
1213 1 2 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.858 -0.357 18329
1214 1 2 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.289 0.111 18329
1215 1 2 . 1 1 54 54 PHE H H 77 8.430 8.430 7.940 0.490 18329
1216 1 2 . 1 1 55 55 ILE N N 78 119.350 119.350 118.357 0.993 18329
1217 1 2 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.699 -0.199 18329
1218 1 2 . 1 1 55 55 ILE C C 78 177.400 177.400 177.021 0.379 18329
1219 1 2 . 1 1 55 55 ILE CA C 78 63.500 63.500 63.428 0.072 18329
1220 1 2 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.803 -0.803 18329
1221 1 2 . 1 1 55 55 ILE H H 78 7.540 7.540 7.968 -0.428 18329
1222 1 2 . 1 1 56 56 LEU N N 79 118.450 118.450 120.295 -1.845 18329
1223 1 2 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.054 0.096 18329
1224 1 2 . 1 1 56 56 LEU C C 79 179.200 179.200 179.159 0.041 18329
1225 1 2 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.336 -0.536 18329
1226 1 2 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.825 -0.725 18329
1227 1 2 . 1 1 56 56 LEU H H 79 7.260 7.260 7.580 -0.320 18329
1228 1 2 . 1 1 57 57 GLU N N 80 117.980 117.980 118.848 -0.868 18329
1229 1 2 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.860 -0.210 18329
1230 1 2 . 1 1 57 57 GLU C C 80 178.700 178.700 178.882 -0.182 18329
1231 1 2 . 1 1 57 57 GLU CA C 80 59.300 59.300 59.120 0.180 18329
1232 1 2 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.154 0.346 18329
1233 1 2 . 1 1 57 57 GLU H H 80 7.890 7.890 7.863 0.027 18329
1234 1 2 . 1 1 58 58 ALA N N 81 122.040 122.040 122.301 -0.261 18329
1235 1 2 . 1 1 58 58 ALA HA H 81 3.800 3.800 3.974 -0.174 18329
1236 1 2 . 1 1 58 58 ALA C C 81 179.500 179.500 178.522 0.978 18329
1237 1 2 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.697 0.503 18329
1238 1 2 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.027 0.773 18329
1239 1 2 . 1 1 58 58 ALA H H 81 8.400 8.400 7.629 0.771 18329
1240 1 2 . 1 1 59 59 LYS N N 82 116.000 116.000 118.092 -2.092 18329
1241 1 2 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.096 -0.246 18329
1242 1 2 . 1 1 59 59 LYS C C 82 180.300 180.300 178.427 1.873 18329
1243 1 2 . 1 1 59 59 LYS CA C 82 61.100 61.100 58.887 2.213 18329
1244 1 2 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.403 -0.203 18329
1245 1 2 . 1 1 59 59 LYS H H 82 8.000 8.000 7.509 0.491 18329
1246 1 2 . 1 1 60 60 VAL N N 83 122.920 122.920 119.286 3.634 18329
1247 1 2 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.703 -0.373 18329
1248 1 2 . 1 1 60 60 VAL C C 83 178.300 178.300 178.300 0.000 18329
1249 1 2 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.951 1.949 18329
1250 1 2 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.680 -0.480 18329
1251 1 2 . 1 1 60 60 VAL H H 83 8.110 8.110 7.644 0.466 18329
1252 1 2 . 1 1 61 61 ARG N N 84 121.770 121.770 119.307 2.463 18329
1253 1 2 . 1 1 61 61 ARG C C 84 179.500 179.500 178.428 1.072 18329
1254 1 2 . 1 1 61 61 ARG CA C 84 59.200 59.200 58.752 0.448 18329
1255 1 2 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.177 1.623 18329
1256 1 2 . 1 1 61 61 ARG H H 84 8.710 8.710 7.644 1.066 18329
1257 1 2 . 1 1 62 62 ALA N N 85 119.450 119.450 121.576 -2.126 18329
1258 1 2 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.112 -0.222 18329
1259 1 2 . 1 1 62 62 ALA C C 85 179.500 179.500 179.015 0.485 18329
1260 1 2 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.272 -0.272 18329
1261 1 2 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.452 0.548 18329
1262 1 2 . 1 1 62 62 ALA H H 85 8.700 8.700 7.595 1.105 18329
1263 1 2 . 1 1 63 63 THR N N 86 106.650 106.650 111.107 -4.457 18329
1264 1 2 . 1 1 63 63 THR HA H 86 3.970 3.970 3.992 -0.022 18329
1265 1 2 . 1 1 63 63 THR C C 86 177.700 177.700 177.106 0.594 18329
1266 1 2 . 1 1 63 63 THR CA C 86 66.000 66.000 66.236 -0.236 18329
1267 1 2 . 1 1 63 63 THR CB C 86 68.200 68.200 68.704 -0.504 18329
1268 1 2 . 1 1 63 63 THR H H 86 8.150 8.150 7.793 0.357 18329
1269 1 2 . 1 1 64 64 THR N N 87 120.430 120.430 119.967 0.463 18329
1270 1 2 . 1 1 64 64 THR HA H 87 4.050 4.050 4.000 0.050 18329
1271 1 2 . 1 1 64 64 THR C C 87 176.800 176.800 176.270 0.530 18329
1272 1 2 . 1 1 64 64 THR CA C 87 67.300 67.300 66.661 0.639 18329
1273 1 2 . 1 1 64 64 THR CB C 87 68.600 68.600 68.913 -0.313 18329
1274 1 2 . 1 1 64 64 THR H H 87 7.920 7.920 7.738 0.182 18329
1275 1 2 . 1 1 65 65 VAL N N 88 119.230 119.230 120.920 -1.690 18329
1276 1 2 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.749 0.231 18329
1277 1 2 . 1 1 65 65 VAL C C 88 178.500 178.500 177.571 0.929 18329
1278 1 2 . 1 1 65 65 VAL CA C 88 65.600 65.600 65.948 -0.348 18329
1279 1 2 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.255 0.445 18329
1280 1 2 . 1 1 65 65 VAL H H 88 7.380 7.380 7.488 -0.108 18329
1281 1 2 . 1 1 66 66 ALA N N 89 124.260 124.260 121.458 2.802 18329
1282 1 2 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.965 0.285 18329
1283 1 2 . 1 1 66 66 ALA C C 89 179.900 179.900 179.455 0.445 18329
1284 1 2 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.292 -0.392 18329
1285 1 2 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.091 1.409 18329
1286 1 2 . 1 1 66 66 ALA H H 89 8.390 8.390 7.953 0.437 18329
1287 1 2 . 1 1 67 67 GLU N N 90 120.180 120.180 118.312 1.868 18329
1288 1 2 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.988 -0.268 18329
1289 1 2 . 1 1 67 67 GLU C C 90 177.600 177.600 178.720 -1.120 18329
1290 1 2 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.915 -0.015 18329
1291 1 2 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.400 -1.100 18329
1292 1 2 . 1 1 67 67 GLU H H 90 8.520 8.520 8.152 0.368 18329
1293 1 2 . 1 1 68 68 LYS N N 91 116.340 116.340 117.694 -1.354 18329
1294 1 2 . 1 1 68 68 LYS HA H 91 3.960 3.960 3.993 -0.033 18329
1295 1 2 . 1 1 68 68 LYS C C 91 179.200 179.200 178.837 0.363 18329
1296 1 2 . 1 1 68 68 LYS CA C 91 59.800 59.800 59.156 0.644 18329
1297 1 2 . 1 1 68 68 LYS CB C 91 32.000 32.000 31.991 0.009 18329
1298 1 2 . 1 1 68 68 LYS H H 91 7.210 7.210 7.703 -0.493 18329
1299 1 2 . 1 1 69 69 PHE N N 92 120.990 120.990 119.193 1.797 18329
1300 1 2 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.210 0.300 18329
1301 1 2 . 1 1 69 69 PHE C C 92 175.100 175.100 176.719 -1.619 18329
1302 1 2 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.151 -1.351 18329
1303 1 2 . 1 1 69 69 PHE CB C 92 39.200 39.200 38.966 0.234 18329
1304 1 2 . 1 1 69 69 PHE H H 92 7.180 7.180 7.542 -0.362 18329
1305 1 2 . 1 1 70 70 VAL N N 93 120.330 120.330 119.403 0.927 18329
1306 1 2 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.549 -0.459 18329
1307 1 2 . 1 1 70 70 VAL C C 93 177.500 177.500 177.709 -0.209 18329
1308 1 2 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.681 0.219 18329
1309 1 2 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.389 0.011 18329
1310 1 2 . 1 1 70 70 VAL H H 93 7.930 7.930 7.545 0.385 18329
1311 1 2 . 1 1 71 71 ILE N N 94 120.410 120.410 119.468 0.942 18329
1312 1 2 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.575 0.255 18329
1313 1 2 . 1 1 71 71 ILE C C 94 177.700 177.700 177.900 -0.200 18329
1314 1 2 . 1 1 71 71 ILE CA C 94 65.000 65.000 65.373 -0.373 18329
1315 1 2 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.325 -0.025 18329
1316 1 2 . 1 1 71 71 ILE H H 94 8.180 8.180 7.419 0.761 18329
1317 1 2 . 1 1 72 72 ALA N N 95 122.440 122.440 121.741 0.699 18329
1318 1 2 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.914 0.046 18329
1319 1 2 . 1 1 72 72 ALA C C 95 179.600 179.600 179.391 0.209 18329
1320 1 2 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.152 0.748 18329
1321 1 2 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.996 -0.796 18329
1322 1 2 . 1 1 72 72 ALA H H 95 7.340 7.340 7.543 -0.203 18329
1323 1 2 . 1 1 73 73 ILE N N 96 119.330 119.330 117.986 1.344 18329
1324 1 2 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.663 -0.223 18329
1325 1 2 . 1 1 73 73 ILE C C 96 177.400 177.400 177.847 -0.447 18329
1326 1 2 . 1 1 73 73 ILE CA C 96 62.800 62.800 63.141 -0.341 18329
1327 1 2 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.403 -2.003 18329
1328 1 2 . 1 1 73 73 ILE H H 96 7.820 7.820 7.531 0.289 18329
1329 1 2 . 1 1 74 74 GLU N N 97 118.440 118.440 121.333 -2.893 18329
1330 1 2 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.848 -0.158 18329
1331 1 2 . 1 1 74 74 GLU C C 97 180.500 180.500 178.876 1.624 18329
1332 1 2 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.861 -0.161 18329
1333 1 2 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.360 0.340 18329
1334 1 2 . 1 1 74 74 GLU H H 97 8.380 8.380 7.761 0.619 18329
1335 1 2 . 1 1 75 75 GLU N N 98 120.470 120.470 118.420 2.050 18329
1336 1 2 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.043 -0.103 18329
1337 1 2 . 1 1 75 75 GLU C C 98 180.600 180.600 179.329 1.271 18329
1338 1 2 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.171 0.529 18329
1339 1 2 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.215 0.985 18329
1340 1 2 . 1 1 75 75 GLU H H 98 8.800 8.800 7.744 1.056 18329
1341 1 2 . 1 1 76 76 GLU N N 99 119.230 119.230 118.875 0.355 18329
1342 1 2 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.082 0.058 18329
1343 1 2 . 1 1 76 76 GLU C C 99 178.900 178.900 178.920 -0.020 18329
1344 1 2 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.714 -0.114 18329
1345 1 2 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.328 -0.029 18329
1346 1 2 . 1 1 76 76 GLU H H 99 8.840 8.840 7.732 1.108 18329
1347 1 2 . 1 1 77 77 ALA N N 100 121.950 121.950 121.748 0.202 18329
1348 1 2 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.215 -0.215 18329
1349 1 2 . 1 1 77 77 ALA C C 100 179.000 179.000 179.410 -0.410 18329
1350 1 2 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.066 1.234 18329
1351 1 2 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.293 -1.493 18329
1352 1 2 . 1 1 77 77 ALA H H 100 9.400 9.400 7.971 1.429 18329
1353 1 2 . 1 1 78 78 THR N N 101 111.820 111.820 113.723 -1.903 18329
1354 1 2 . 1 1 78 78 THR HA H 101 3.750 3.750 3.976 -0.226 18329
1355 1 2 . 1 1 78 78 THR CA C 101 67.500 67.500 66.962 0.538 18329
1356 1 2 . 1 1 78 78 THR CB C 101 68.600 68.600 68.602 -0.002 18329
1357 1 2 . 1 1 78 78 THR H H 101 7.770 7.770 7.689 0.081 18329
1358 1 2 . 1 1 79 79 LYS N N 102 122.940 122.940 117.026 5.914 18329
1359 1 2 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.181 -0.091 18329
1360 1 2 . 1 1 79 79 LYS CA C 102 59.200 59.200 57.913 1.288 18329
1361 1 2 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.015 0.485 18329
1362 1 2 . 1 1 79 79 LYS H H 102 7.870 7.870 7.869 0.001 18329
1363 1 2 . 1 1 80 80 LEU N N 103 117.690 117.690 116.157 1.533 18329
1364 1 2 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.558 -0.068 18329
1365 1 2 . 1 1 80 80 LEU C C 103 178.140 178.140 177.426 0.714 18329
1366 1 2 . 1 1 80 80 LEU CA C 103 54.000 54.000 54.509 -0.509 18329
1367 1 2 . 1 1 80 80 LEU CB C 103 43.100 43.100 42.889 0.211 18329
1368 1 2 . 1 1 80 80 LEU H H 103 7.550 7.550 7.538 0.012 18329
1369 1 2 . 1 1 81 81 LYS N N 104 122.210 122.210 120.548 1.662 18329
1370 1 2 . 1 1 81 81 LYS HA H 104 3.930 3.930 3.859 0.071 18329
1371 1 2 . 1 1 81 81 LYS C C 104 178.000 178.000 177.513 0.487 18329
1372 1 2 . 1 1 81 81 LYS CA C 104 61.300 61.300 59.255 2.045 18329
1373 1 2 . 1 1 81 81 LYS CB C 104 32.800 32.800 32.462 0.337 18329
1374 1 2 . 1 1 81 81 LYS H H 104 7.500 7.500 8.072 -0.572 18329
1375 1 2 . 1 1 82 82 GLU N N 105 114.920 114.920 116.463 -1.543 18329
1376 1 2 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.199 0.361 18329
1377 1 2 . 1 1 82 82 GLU C C 105 177.900 177.900 177.918 -0.018 18329
1378 1 2 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.487 0.173 18329
1379 1 2 . 1 1 82 82 GLU CB C 105 30.400 30.400 29.843 0.557 18329
1380 1 2 . 1 1 82 82 GLU H H 105 8.780 8.780 8.249 0.531 18329
1381 1 2 . 1 1 83 83 THR N N 106 107.260 107.260 114.516 -7.256 18329
1382 1 2 . 1 1 83 83 THR HA H 106 4.550 4.550 4.075 0.475 18329
1383 1 2 . 1 1 83 83 THR C C 106 176.300 176.300 175.003 1.297 18329
1384 1 2 . 1 1 83 83 THR CA C 106 61.900 61.900 64.829 -2.929 18329
1385 1 2 . 1 1 83 83 THR CB C 106 70.400 70.400 68.975 1.425 18329
1386 1 2 . 1 1 83 83 THR H H 106 7.570 7.570 8.240 -0.670 18329
1387 1 2 . 1 1 84 84 GLY N N 107 112.110 112.110 106.815 5.295 18329
1388 1 2 . 1 1 84 84 GLY C C 107 172.800 172.800 173.102 -0.302 18329
1389 1 2 . 1 1 84 84 GLY CA C 107 45.400 45.400 44.709 0.691 18329
1390 1 2 . 1 1 84 84 GLY H H 107 9.000 9.000 7.998 1.002 18329
1391 1 2 . 1 1 85 85 SER N N 108 119.030 119.030 116.270 2.760 18329
1392 1 2 . 1 1 85 85 SER CA C 108 56.300 56.300 56.414 -0.114 18329
1393 1 2 . 1 1 85 85 SER CB C 108 66.300 66.300 64.737 1.563 18329
1394 1 2 . 1 1 85 85 SER H H 108 8.950 8.950 8.244 0.706 18329
1395 1 2 . 1 1 86 86 SER HA H 109 4.480 4.480 4.512 -0.032 18329
1396 1 2 . 1 1 86 86 SER C C 109 177.000 177.000 176.606 0.394 18329
1397 1 2 . 1 1 86 86 SER CA C 109 61.600 61.600 60.970 0.630 18329
1398 1 2 . 1 1 86 86 SER CB C 109 62.900 62.900 62.604 0.296 18329
1399 1 2 . 1 1 87 87 GLY N N 110 108.100 108.100 110.362 -2.262 18329
1400 1 2 . 1 1 87 87 GLY C C 110 177.100 177.100 175.480 1.620 18329
1401 1 2 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.897 -0.697 18329
1402 1 2 . 1 1 87 87 GLY H H 110 8.480 8.480 8.005 0.475 18329
1403 1 2 . 1 1 88 88 GLU N N 111 123.040 123.040 123.012 0.028 18329
1404 1 2 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.014 -0.324 18329
1405 1 2 . 1 1 88 88 GLU C C 111 177.700 177.700 178.659 -0.959 18329
1406 1 2 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.842 0.658 18329
1407 1 2 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.167 -0.467 18329
1408 1 2 . 1 1 88 88 GLU H H 111 7.560 7.560 7.413 0.147 18329
1409 1 2 . 1 1 89 89 PHE N N 112 118.270 118.270 118.223 0.047 18329
1410 1 2 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.339 0.081 18329
1411 1 2 . 1 1 89 89 PHE C C 112 178.600 178.600 178.061 0.539 18329
1412 1 2 . 1 1 89 89 PHE CA C 112 61.100 61.100 61.294 -0.194 18329
1413 1 2 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.472 -0.572 18329
1414 1 2 . 1 1 89 89 PHE H H 112 7.200 7.200 7.516 -0.316 18329
1415 1 2 . 1 1 90 90 SER N N 113 115.980 115.980 116.204 -0.224 18329
1416 1 2 . 1 1 90 90 SER HA H 113 4.290 4.290 4.141 0.149 18329
1417 1 2 . 1 1 90 90 SER C C 113 178.600 178.600 176.301 2.299 18329
1418 1 2 . 1 1 90 90 SER CA C 113 62.700 62.700 62.667 0.033 18329
1419 1 2 . 1 1 90 90 SER CB C 113 62.800 62.800 62.796 0.004 18329
1420 1 2 . 1 1 90 90 SER H H 113 8.830 8.830 8.226 0.604 18329
1421 1 2 . 1 1 91 91 ALA N N 114 123.130 123.130 122.530 0.600 18329
1422 1 2 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.183 0.197 18329
1423 1 2 . 1 1 91 91 ALA C C 114 181.300 181.300 179.092 2.208 18329
1424 1 2 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.611 0.089 18329
1425 1 2 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.465 -0.065 18329
1426 1 2 . 1 1 91 91 ALA H H 114 7.580 7.580 7.824 -0.244 18329
1427 1 2 . 1 1 92 92 MET N N 115 118.700 118.700 119.789 -1.089 18329
1428 1 2 . 1 1 92 92 MET HA H 115 3.980 3.980 4.288 -0.308 18329
1429 1 2 . 1 1 92 92 MET C C 115 178.000 178.000 177.819 0.181 18329
1430 1 2 . 1 1 92 92 MET CA C 115 61.000 61.000 57.943 3.057 18329
1431 1 2 . 1 1 92 92 MET CB C 115 31.400 31.400 32.509 -1.109 18329
1432 1 2 . 1 1 92 92 MET H H 115 7.880 7.880 7.678 0.202 18329
1433 1 2 . 1 1 93 93 TYR N N 116 119.200 119.200 120.766 -1.566 18329
1434 1 2 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.091 0.189 18329
1435 1 2 . 1 1 93 93 TYR C C 116 176.300 176.300 177.281 -0.981 18329
1436 1 2 . 1 1 93 93 TYR CA C 116 62.100 62.100 62.077 0.023 18329
1437 1 2 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.308 -0.008 18329
1438 1 2 . 1 1 93 93 TYR H H 116 7.870 7.870 8.659 -0.789 18329
1439 1 2 . 1 1 94 94 ASP N N 117 120.210 120.210 119.591 0.619 18329
1440 1 2 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.461 -0.271 18329
1441 1 2 . 1 1 94 94 ASP C C 117 179.000 179.000 178.707 0.293 18329
1442 1 2 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.680 0.020 18329
1443 1 2 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.233 -0.233 18329
1444 1 2 . 1 1 94 94 ASP H H 117 8.720 8.720 8.075 0.645 18329
1445 1 2 . 1 1 95 95 LEU N N 118 118.420 118.420 121.539 -3.119 18329
1446 1 2 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.261 -0.051 18329
1447 1 2 . 1 1 95 95 LEU C C 118 178.600 178.600 178.752 -0.152 18329
1448 1 2 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.353 0.347 18329
1449 1 2 . 1 1 95 95 LEU CB C 118 43.100 43.100 42.117 0.983 18329
1450 1 2 . 1 1 95 95 LEU H H 118 7.510 7.510 7.718 -0.208 18329
1451 1 2 . 1 1 96 96 MET N N 119 118.470 118.470 119.457 -0.987 18329
1452 1 2 . 1 1 96 96 MET HA H 119 3.990 3.990 4.038 -0.048 18329
1453 1 2 . 1 1 96 96 MET C C 119 177.500 177.500 177.988 -0.488 18329
1454 1 2 . 1 1 96 96 MET CA C 119 60.500 60.500 57.778 2.722 18329
1455 1 2 . 1 1 96 96 MET CB C 119 33.900 33.900 31.975 1.925 18329
1456 1 2 . 1 1 96 96 MET H H 119 7.820 7.820 7.906 -0.086 18329
1457 1 2 . 1 1 97 97 PHE N N 120 119.580 119.580 120.291 -0.711 18329
1458 1 2 . 1 1 97 97 PHE HA H 120 3.810 3.810 3.976 -0.166 18329
1459 1 2 . 1 1 97 97 PHE C C 120 178.800 178.800 177.215 1.585 18329
1460 1 2 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.858 -0.058 18329
1461 1 2 . 1 1 97 97 PHE CB C 120 39.200 39.200 39.016 0.184 18329
1462 1 2 . 1 1 97 97 PHE H H 120 8.940 8.940 7.887 1.053 18329
1463 1 2 . 1 1 98 98 GLU N N 121 119.940 119.940 118.400 1.540 18329
1464 1 2 . 1 1 98 98 GLU HA H 121 3.880 3.880 3.990 -0.110 18329
1465 1 2 . 1 1 98 98 GLU C C 121 180.800 180.800 178.123 2.677 18329
1466 1 2 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.168 0.632 18329
1467 1 2 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.509 -0.309 18329
1468 1 2 . 1 1 98 98 GLU H H 121 8.690 8.690 8.042 0.648 18329
1469 1 2 . 1 1 99 99 VAL N N 122 115.350 115.350 116.430 -1.080 18329
1470 1 2 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.673 0.067 18329
1471 1 2 . 1 1 99 99 VAL C C 122 176.500 176.500 176.999 -0.499 18329
1472 1 2 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.630 -0.130 18329
1473 1 2 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.973 -0.673 18329
1474 1 2 . 1 1 99 99 VAL H H 122 8.210 8.210 7.583 0.627 18329
1475 1 2 . 1 1 100 100 SER N N 123 115.450 115.450 115.976 -0.526 18329
1476 1 2 . 1 1 100 100 SER HA H 123 4.270 4.270 4.024 0.246 18329
1477 1 2 . 1 1 100 100 SER C C 123 174.700 174.700 175.738 -1.038 18329
1478 1 2 . 1 1 100 100 SER CA C 123 62.000 62.000 61.550 0.450 18329
1479 1 2 . 1 1 100 100 SER H H 123 7.520 7.520 7.971 -0.451 18329
1480 1 2 . 1 1 101 101 LYS N N 124 120.310 120.310 121.307 -0.997 18329
1481 1 2 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.060 -0.090 18329
1482 1 2 . 1 1 101 101 LYS C C 124 176.600 176.600 176.586 0.014 18329
1483 1 2 . 1 1 101 101 LYS CA C 124 61.100 61.100 59.874 1.226 18329
1484 1 2 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.238 -1.738 18329
1485 1 2 . 1 1 101 101 LYS H H 124 6.930 6.930 7.483 -0.553 18329
1486 1 2 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.206 0.054 18329
1487 1 2 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.189 0.011 18329
1488 1 2 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.201 -0.601 18329
1489 1 2 . 1 1 103 103 LEU N N 126 116.020 116.020 118.603 -2.583 18329
1490 1 2 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.068 -0.188 18329
1491 1 2 . 1 1 103 103 LEU C C 126 177.900 177.900 179.083 -1.183 18329
1492 1 2 . 1 1 103 103 LEU CA C 126 57.700 57.700 57.615 0.084 18329
1493 1 2 . 1 1 103 103 LEU CB C 126 41.800 41.800 40.931 0.869 18329
1494 1 2 . 1 1 103 103 LEU H H 126 6.520 6.520 7.530 -1.010 18329
1495 1 2 . 1 1 104 104 GLN N N 127 120.500 120.500 118.896 1.604 18329
1496 1 2 . 1 1 104 104 GLN C C 127 180.600 180.600 178.307 2.293 18329
1497 1 2 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.676 -0.376 18329
1498 1 2 . 1 1 104 104 GLN CB C 127 29.000 29.000 27.718 1.282 18329
1499 1 2 . 1 1 104 104 GLN H H 127 8.160 8.160 7.893 0.267 18329
1500 1 2 . 1 1 105 105 LYS N N 128 120.000 120.000 119.878 0.122 18329
1501 1 2 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.069 -0.019 18329
1502 1 2 . 1 1 105 105 LYS C C 128 177.100 177.100 177.342 -0.242 18329
1503 1 2 . 1 1 105 105 LYS CA C 128 58.500 58.500 58.278 0.222 18329
1504 1 2 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.240 -0.840 18329
1505 1 2 . 1 1 105 105 LYS H H 128 7.810 7.810 7.494 0.316 18329
1506 1 2 . 1 1 106 106 LEU N N 129 118.530 118.530 117.817 0.713 18329
1507 1 2 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.725 -0.755 18329
1508 1 2 . 1 1 106 106 LEU C C 129 175.200 175.200 176.355 -1.155 18329
1509 1 2 . 1 1 106 106 LEU CA C 129 54.500 54.500 54.092 0.408 18329
1510 1 2 . 1 1 106 106 LEU CB C 129 42.400 42.400 42.045 0.355 18329
1511 1 2 . 1 1 106 106 LEU H H 129 7.220 7.220 7.791 -0.571 18329
1512 1 2 . 1 1 107 107 GLY N N 130 101.490 101.490 108.057 -6.567 18329
1513 1 2 . 1 1 107 107 GLY C C 130 174.800 174.800 173.792 1.008 18329
1514 1 2 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.878 0.222 18329
1515 1 2 . 1 1 107 107 GLY H H 130 7.560 7.560 8.056 -0.496 18329
1516 1 2 . 1 1 108 108 ILE N N 131 121.340 121.340 119.947 1.393 18329
1517 1 2 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.696 0.454 18329
1518 1 2 . 1 1 108 108 ILE C C 131 174.300 174.300 175.274 -0.974 18329
1519 1 2 . 1 1 108 108 ILE CA C 131 60.400 60.400 61.536 -1.136 18329
1520 1 2 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.056 -1.856 18329
1521 1 2 . 1 1 108 108 ILE H H 131 7.290 7.290 8.425 -1.135 18329
1522 1 2 . 1 1 109 109 GLN N N 132 125.650 125.650 127.288 -1.638 18329
1523 1 2 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.397 -0.387 18329
1524 1 2 . 1 1 109 109 GLN C C 132 176.800 176.800 175.334 1.466 18329
1525 1 2 . 1 1 109 109 GLN CA C 132 57.600 57.600 55.721 1.879 18329
1526 1 2 . 1 1 109 109 GLN CB C 132 29.000 29.000 28.346 0.654 18329
1527 1 2 . 1 1 109 109 GLN H H 132 8.080 8.080 8.598 -0.518 18329
1528 1 2 . 1 1 110 110 GLU N N 133 114.890 114.890 119.809 -4.919 18329
1529 1 2 . 1 1 110 110 GLU HA H 133 4.150 4.150 4.285 -0.135 18329
1530 1 2 . 1 1 110 110 GLU C C 133 177.100 177.100 176.803 0.297 18329
1531 1 2 . 1 1 110 110 GLU CA C 133 57.100 57.100 56.711 0.389 18329
1532 1 2 . 1 1 110 110 GLU CB C 133 27.300 27.300 29.006 -1.706 18329
1533 1 2 . 1 1 110 110 GLU H H 133 9.270 9.270 8.340 0.930 18329
1534 1 2 . 1 1 111 111 MET N N 134 121.210 121.210 121.327 -0.117 18329
1535 1 2 . 1 1 111 111 MET HA H 134 4.350 4.350 4.093 0.257 18329
1536 1 2 . 1 1 111 111 MET C C 134 177.500 177.500 177.431 0.069 18329
1537 1 2 . 1 1 111 111 MET CA C 134 57.900 57.900 59.611 -1.711 18329
1538 1 2 . 1 1 111 111 MET CB C 134 33.300 33.300 32.418 0.882 18329
1539 1 2 . 1 1 111 111 MET H H 134 7.620 7.620 8.366 -0.746 18329
1540 1 2 . 1 1 112 112 THR N N 135 113.170 113.170 114.693 -1.523 18329
1541 1 2 . 1 1 112 112 THR HA H 135 3.920 3.920 4.108 -0.188 18329
1542 1 2 . 1 1 112 112 THR C C 135 176.400 176.400 176.340 0.060 18329
1543 1 2 . 1 1 112 112 THR CA C 135 65.900 65.900 67.323 -1.423 18329
1544 1 2 . 1 1 112 112 THR CB C 135 68.200 68.200 68.080 0.120 18329
1545 1 2 . 1 1 112 112 THR H H 135 8.320 8.320 8.314 0.006 18329
1546 1 2 . 1 1 113 113 LYS N N 136 123.440 123.440 121.862 1.578 18329
1547 1 2 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.110 -0.180 18329
1548 1 2 . 1 1 113 113 LYS C C 136 177.600 177.600 179.629 -2.029 18329
1549 1 2 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.828 -1.528 18329
1550 1 2 . 1 1 113 113 LYS CB C 136 32.000 32.000 31.560 0.440 18329
1551 1 2 . 1 1 113 113 LYS H H 136 8.060 8.060 8.371 -0.311 18329
1552 1 2 . 1 1 114 114 THR N N 137 114.590 114.590 116.037 -1.447 18329
1553 1 2 . 1 1 114 114 THR HA H 137 4.000 4.000 4.090 -0.090 18329
1554 1 2 . 1 1 114 114 THR C C 137 176.800 176.800 176.751 0.049 18329
1555 1 2 . 1 1 114 114 THR CA C 137 67.600 67.600 67.033 0.567 18329
1556 1 2 . 1 1 114 114 THR CB C 137 69.200 69.200 68.523 0.677 18329
1557 1 2 . 1 1 114 114 THR H H 137 7.950 7.950 8.518 -0.568 18329
1558 1 2 . 1 1 115 115 VAL N N 138 119.080 119.080 121.085 -2.005 18329
1559 1 2 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.727 0.093 18329
1560 1 2 . 1 1 115 115 VAL C C 138 176.900 176.900 178.280 -1.380 18329
1561 1 2 . 1 1 115 115 VAL CA C 138 66.800 66.800 66.555 0.245 18329
1562 1 2 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.285 1.215 18329
1563 1 2 . 1 1 115 115 VAL H H 138 7.320 7.320 7.692 -0.372 18329
1564 1 2 . 1 1 116 116 SER N N 139 116.630 116.630 116.722 -0.092 18329
1565 1 2 . 1 1 116 116 SER HA H 139 4.680 4.680 4.489 0.191 18329
1566 1 2 . 1 1 116 116 SER C C 139 179.000 179.000 176.939 2.061 18329
1567 1 2 . 1 1 116 116 SER CA C 139 61.400 61.400 61.895 -0.495 18329
1568 1 2 . 1 1 116 116 SER CB C 139 62.800 62.800 63.026 -0.226 18329
1569 1 2 . 1 1 116 116 SER H H 139 8.990 8.990 9.044 -0.054 18329
1570 1 2 . 1 1 117 117 ASP N N 140 124.220 124.220 121.625 2.595 18329
1571 1 2 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.464 -0.104 18329
1572 1 2 . 1 1 117 117 ASP C C 140 179.900 179.900 177.184 2.716 18329
1573 1 2 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.706 0.594 18329
1574 1 2 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.446 -0.946 18329
1575 1 2 . 1 1 117 117 ASP H H 140 9.480 9.480 8.599 0.881 18329
1576 1 2 . 1 1 118 118 ALA N N 141 121.420 121.420 120.315 1.105 18329
1577 1 2 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.107 0.173 18329
1578 1 2 . 1 1 118 118 ALA C C 141 179.800 179.800 178.739 1.061 18329
1579 1 2 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.323 0.077 18329
1580 1 2 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.925 0.075 18329
1581 1 2 . 1 1 118 118 ALA H H 141 7.340 7.340 7.695 -0.355 18329
1582 1 2 . 1 1 119 119 ALA N N 142 121.680 121.680 119.858 1.822 18329
1583 1 2 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.080 0.050 18329
1584 1 2 . 1 1 119 119 ALA C C 142 178.800 178.800 178.468 0.332 18329
1585 1 2 . 1 1 119 119 ALA CA C 142 53.200 53.200 53.835 -0.635 18329
1586 1 2 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.731 -0.431 18329
1587 1 2 . 1 1 119 119 ALA H H 142 7.890 7.890 7.511 0.379 18329
1588 1 2 . 1 1 120 120 GLU N N 143 117.690 117.690 118.996 -1.306 18329
1589 1 2 . 1 1 120 120 GLU HA H 143 3.940 3.940 3.984 -0.044 18329
1590 1 2 . 1 1 120 120 GLU C C 143 178.100 178.100 176.896 1.204 18329
1591 1 2 . 1 1 120 120 GLU CA C 143 58.700 58.700 57.873 0.827 18329
1592 1 2 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.491 0.009 18329
1593 1 2 . 1 1 120 120 GLU H H 143 7.500 7.500 7.440 0.060 18329
1594 1 2 . 1 1 121 121 GLU N N 144 115.680 115.680 118.644 -2.964 18329
1595 1 2 . 1 1 121 121 GLU HA H 144 4.160 4.160 3.968 0.192 18329
1596 1 2 . 1 1 121 121 GLU C C 144 176.100 176.100 176.177 -0.077 18329
1597 1 2 . 1 1 121 121 GLU CA C 144 56.900 56.900 58.836 -1.936 18329
1598 1 2 . 1 1 121 121 GLU CB C 144 31.100 31.100 29.594 1.506 18329
1599 1 2 . 1 1 121 121 GLU H H 144 6.970 6.970 8.585 -1.615 18329
1600 1 2 . 1 1 122 122 ASN N N 145 117.750 117.750 118.207 -0.457 18329
1601 1 2 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.026 -0.036 18329
1602 1 2 . 1 1 122 122 ASN C C 145 185.300 185.300 172.762 12.538 18329
1603 1 2 . 1 1 122 122 ASN CA C 145 50.200 50.200 50.441 -0.241 18329
1604 1 2 . 1 1 122 122 ASN CB C 145 41.100 41.100 38.970 2.130 18329
1605 1 2 . 1 1 122 122 ASN H H 145 7.670 7.670 8.529 -0.859 18329
1606 1 2 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.665 -0.035 18329
1607 1 2 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.084 -1.084 18329
1608 1 2 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.654 -0.354 18329
1609 1 2 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.440 -0.000 18329
1610 1 2 . 1 1 124 124 PRO CA C 147 62.900 62.900 62.525 0.375 18329
1611 1 2 . 1 1 124 124 PRO CB C 147 28.400 28.400 30.287 -1.887 18329
1612 1 2 . 1 1 125 125 THR N N 148 106.090 106.090 112.404 -6.314 18329
1613 1 2 . 1 1 125 125 THR HA H 148 4.530 4.530 4.250 0.280 18329
1614 1 2 . 1 1 125 125 THR C C 148 174.300 174.300 174.005 0.295 18329
1615 1 2 . 1 1 125 125 THR CA C 148 61.200 61.200 62.108 -0.908 18329
1616 1 2 . 1 1 125 125 THR CB C 148 68.600 68.600 68.602 -0.002 18329
1617 1 2 . 1 1 125 125 THR H H 148 7.800 7.800 8.143 -0.343 18329
1618 1 2 . 1 1 126 126 THR N N 149 108.650 108.650 114.850 -6.200 18329
1619 1 2 . 1 1 126 126 THR HA H 149 4.170 4.170 4.529 -0.359 18329
1620 1 2 . 1 1 126 126 THR C C 149 173.100 173.100 174.042 -0.942 18329
1621 1 2 . 1 1 126 126 THR CA C 149 58.800 58.800 60.696 -1.896 18329
1622 1 2 . 1 1 126 126 THR CB C 149 73.100 73.100 71.958 1.142 18329
1623 1 2 . 1 1 126 126 THR H H 149 7.350 7.350 7.095 0.255 18329
1624 1 2 . 1 1 127 127 ALA N N 150 123.270 123.270 124.485 -1.215 18329
1625 1 2 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.513 -0.493 18329
1626 1 2 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.459 -0.459 18329
1627 1 2 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.789 -0.089 18329
1628 1 2 . 1 1 127 127 ALA H H 150 7.750 7.750 8.934 -1.184 18329
1629 1 2 . 1 1 128 128 GLN N N 151 114.920 114.920 118.132 -3.212 18329
1630 1 2 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.043 -0.293 18329
1631 1 2 . 1 1 128 128 GLN C C 151 178.400 178.400 178.197 0.203 18329
1632 1 2 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.165 0.635 18329
1633 1 2 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.357 -1.157 18329
1634 1 2 . 1 1 128 128 GLN H H 151 8.300 8.300 8.589 -0.289 18329
1635 1 2 . 1 1 129 129 GLY N N 152 107.280 107.280 107.989 -0.709 18329
1636 1 2 . 1 1 129 129 GLY C C 152 174.900 174.900 176.433 -1.533 18329
1637 1 2 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.868 0.332 18329
1638 1 2 . 1 1 129 129 GLY H H 152 7.920 7.920 7.963 -0.043 18329
1639 1 2 . 1 1 130 130 VAL N N 153 119.440 119.440 122.590 -3.150 18329
1640 1 2 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.692 -0.222 18329
1641 1 2 . 1 1 130 130 VAL C C 153 177.700 177.700 177.252 0.448 18329
1642 1 2 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.441 2.359 18329
1643 1 2 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.111 0.589 18329
1644 1 2 . 1 1 130 130 VAL H H 153 7.390 7.390 7.706 -0.316 18329
1645 1 2 . 1 1 131 131 LEU N N 154 118.990 118.990 120.590 -1.600 18329
1646 1 2 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.847 0.063 18329
1647 1 2 . 1 1 131 131 LEU C C 154 180.400 180.400 178.237 2.163 18329
1648 1 2 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.308 -0.008 18329
1649 1 2 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.548 -0.548 18329
1650 1 2 . 1 1 131 131 LEU H H 154 8.640 8.640 7.487 1.153 18329
1651 1 2 . 1 1 132 132 GLU N N 155 120.980 120.980 119.450 1.530 18329
1652 1 2 . 1 1 132 132 GLU HA H 155 4.120 4.120 3.939 0.181 18329
1653 1 2 . 1 1 132 132 GLU C C 155 179.400 179.400 179.150 0.250 18329
1654 1 2 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.532 -0.632 18329
1655 1 2 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.394 -0.194 18329
1656 1 2 . 1 1 132 132 GLU H H 155 8.000 8.000 7.641 0.359 18329
1657 1 2 . 1 1 133 133 ILE N N 156 121.830 121.830 119.768 2.062 18329
1658 1 2 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.712 -0.132 18329
1659 1 2 . 1 1 133 133 ILE C C 156 178.000 178.000 178.270 -0.270 18329
1660 1 2 . 1 1 133 133 ILE CA C 156 65.500 65.500 63.631 1.869 18329
1661 1 2 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.244 3.356 18329
1662 1 2 . 1 1 133 133 ILE H H 156 8.040 8.040 7.340 0.700 18329
1663 1 2 . 1 1 134 134 ALA N N 157 121.470 121.470 121.955 -0.485 18329
1664 1 2 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.883 0.017 18329
1665 1 2 . 1 1 134 134 ALA C C 157 178.800 178.800 179.639 -0.839 18329
1666 1 2 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.545 -0.245 18329
1667 1 2 . 1 1 134 134 ALA CB C 157 18.100 18.100 17.951 0.149 18329
1668 1 2 . 1 1 134 134 ALA H H 157 8.950 8.950 8.150 0.800 18329
1669 1 2 . 1 1 135 135 LYS N N 158 118.470 118.470 118.225 0.245 18329
1670 1 2 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.971 -0.061 18329
1671 1 2 . 1 1 135 135 LYS C C 158 179.300 179.300 178.684 0.616 18329
1672 1 2 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.296 0.204 18329
1673 1 2 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.375 -0.975 18329
1674 1 2 . 1 1 135 135 LYS H H 158 8.000 8.000 8.122 -0.122 18329
1675 1 2 . 1 1 136 136 LYS N N 159 118.000 118.000 120.094 -2.094 18329
1676 1 2 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.256 -0.206 18329
1677 1 2 . 1 1 136 136 LYS C C 159 180.200 180.200 179.284 0.916 18329
1678 1 2 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.121 0.379 18329
1679 1 2 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.311 -1.411 18329
1680 1 2 . 1 1 136 136 LYS H H 159 7.530 7.530 8.265 -0.735 18329
1681 1 2 . 1 1 137 137 MET N N 160 120.990 120.990 118.397 2.593 18329
1682 1 2 . 1 1 137 137 MET HA H 160 3.800 3.800 4.162 -0.362 18329
1683 1 2 . 1 1 137 137 MET C C 160 177.400 177.400 178.095 -0.695 18329
1684 1 2 . 1 1 137 137 MET CA C 160 60.600 60.600 59.799 0.801 18329
1685 1 2 . 1 1 137 137 MET CB C 160 31.800 31.800 32.500 -0.700 18329
1686 1 2 . 1 1 137 137 MET H H 160 8.660 8.660 8.420 0.240 18329
1687 1 2 . 1 1 138 138 ARG N N 161 119.480 119.480 119.638 -0.158 18329
1688 1 2 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.944 -0.144 18329
1689 1 2 . 1 1 138 138 ARG C C 161 177.900 177.900 178.607 -0.707 18329
1690 1 2 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.960 0.640 18329
1691 1 2 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.239 -0.439 18329
1692 1 2 . 1 1 138 138 ARG H H 161 9.280 9.280 7.939 1.341 18329
1693 1 2 . 1 1 139 139 GLU N N 162 118.700 118.700 118.483 0.217 18329
1694 1 2 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.091 -0.091 18329
1695 1 2 . 1 1 139 139 GLU C C 162 179.100 179.100 178.798 0.302 18329
1696 1 2 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.095 0.705 18329
1697 1 2 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.426 0.074 18329
1698 1 2 . 1 1 139 139 GLU H H 162 8.430 8.430 7.800 0.630 18329
1699 1 2 . 1 1 140 140 LYS N N 163 119.310 119.310 119.734 -0.424 18329
1700 1 2 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.240 -0.030 18329
1701 1 2 . 1 1 140 140 LYS C C 163 177.900 177.900 179.070 -1.170 18329
1702 1 2 . 1 1 140 140 LYS CA C 163 58.900 58.900 57.632 1.268 18329
1703 1 2 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.628 -1.528 18329
1704 1 2 . 1 1 140 140 LYS H H 163 7.440 7.440 7.515 -0.075 18329
1705 1 2 . 1 1 141 141 LEU N N 164 117.630 117.630 119.023 -1.393 18329
1706 1 2 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.060 -0.170 18329
1707 1 2 . 1 1 141 141 LEU C C 164 178.700 178.700 178.652 0.048 18329
1708 1 2 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.911 0.089 18329
1709 1 2 . 1 1 141 141 LEU CB C 164 41.500 41.500 42.046 -0.546 18329
1710 1 2 . 1 1 141 141 LEU H H 164 8.180 8.180 8.445 -0.265 18329
1711 1 2 . 1 1 142 142 GLN N N 165 117.710 117.710 118.061 -0.351 18329
1712 1 2 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.998 0.312 18329
1713 1 2 . 1 1 142 142 GLN C C 165 179.200 179.200 177.709 1.491 18329
1714 1 2 . 1 1 142 142 GLN CA C 165 58.500 58.500 58.598 -0.098 18329
1715 1 2 . 1 1 142 142 GLN CB C 165 27.500 27.500 27.642 -0.142 18329
1716 1 2 . 1 1 142 142 GLN H H 165 8.730 8.730 8.132 0.598 18329
1717 1 2 . 1 1 143 143 ARG N N 166 121.410 121.410 119.344 2.066 18329
1718 1 2 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.067 0.123 18329
1719 1 2 . 1 1 143 143 ARG C C 166 179.700 179.700 177.979 1.721 18329
1720 1 2 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.584 0.216 18329
1721 1 2 . 1 1 143 143 ARG CB C 166 30.200 30.200 30.061 0.139 18329
1722 1 2 . 1 1 143 143 ARG H H 166 8.050 8.050 7.478 0.572 18329
1723 1 2 . 1 1 144 144 VAL N N 167 120.950 120.950 118.413 2.537 18329
1724 1 2 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.761 -0.001 18329
1725 1 2 . 1 1 144 144 VAL C C 167 179.200 179.200 177.957 1.243 18329
1726 1 2 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.150 0.250 18329
1727 1 2 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.248 0.851 18329
1728 1 2 . 1 1 144 144 VAL H H 167 8.190 8.190 7.374 0.816 18329
1729 1 2 . 1 1 145 145 HIS N N 168 123.520 123.520 118.701 4.819 18329
1730 1 2 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.493 -0.593 18329
1731 1 2 . 1 1 145 145 HIS C C 168 177.100 177.100 177.779 -0.679 18329
1732 1 2 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.000 2.300 18329
1733 1 2 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.267 -0.367 18329
1734 1 2 . 1 1 145 145 HIS H H 168 9.240 9.240 7.797 1.443 18329
1735 1 2 . 1 1 146 146 THR N N 169 115.020 115.020 117.495 -2.475 18329
1736 1 2 . 1 1 146 146 THR HA H 169 3.860 3.860 4.089 -0.229 18329
1737 1 2 . 1 1 146 146 THR C C 169 175.700 175.700 175.861 -0.161 18329
1738 1 2 . 1 1 146 146 THR CA C 169 67.200 67.200 67.167 0.033 18329
1739 1 2 . 1 1 146 146 THR CB C 169 69.300 69.300 69.057 0.243 18329
1740 1 2 . 1 1 146 146 THR H H 169 8.750 8.750 8.587 0.163 18329
1741 1 2 . 1 1 147 147 LYS N N 170 120.300 120.300 121.442 -1.142 18329
1742 1 2 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.943 0.057 18329
1743 1 2 . 1 1 147 147 LYS C C 170 179.300 179.300 178.633 0.667 18329
1744 1 2 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.786 -0.686 18329
1745 1 2 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.445 -0.645 18329
1746 1 2 . 1 1 147 147 LYS H H 170 8.020 8.020 8.037 -0.017 18329
1747 1 2 . 1 1 148 148 ASN N N 171 117.600 117.600 117.205 0.395 18329
1748 1 2 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.400 -0.080 18329
1749 1 2 . 1 1 148 148 ASN C C 171 175.400 175.400 177.658 -2.258 18329
1750 1 2 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.891 1.809 18329
1751 1 2 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.555 1.145 18329
1752 1 2 . 1 1 148 148 ASN H H 171 7.810 7.810 7.713 0.097 18329
1753 1 2 . 1 1 149 149 TYR N N 172 121.560 121.560 121.035 0.525 18329
1754 1 2 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.203 -0.313 18329
1755 1 2 . 1 1 149 149 TYR C C 172 176.900 176.900 177.326 -0.426 18329
1756 1 2 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.834 -0.334 18329
1757 1 2 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.840 0.080 18329
1758 1 2 . 1 1 149 149 TYR H H 172 9.020 9.020 7.547 1.473 18329
1759 1 2 . 1 1 150 150 CYS N N 173 116.050 116.050 118.585 -2.535 18329
1760 1 2 . 1 1 150 150 CYS C C 173 177.100 177.100 176.620 0.480 18329
1761 1 2 . 1 1 150 150 CYS CA C 173 58.400 58.400 61.284 -2.884 18329
1762 1 2 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.100 12.500 18329
1763 1 2 . 1 1 150 150 CYS H H 173 8.810 8.810 8.109 0.701 18329
1764 1 2 . 1 1 151 151 THR N N 174 117.190 117.190 116.213 0.977 18329
1765 1 2 . 1 1 151 151 THR HA H 174 3.880 3.880 3.978 -0.098 18329
1766 1 2 . 1 1 151 151 THR C C 174 176.000 176.000 176.737 -0.737 18329
1767 1 2 . 1 1 151 151 THR CA C 174 66.900 66.900 65.883 1.017 18329
1768 1 2 . 1 1 151 151 THR CB C 174 68.500 68.500 68.528 -0.029 18329
1769 1 2 . 1 1 151 151 THR H H 174 7.720 7.720 8.206 -0.486 18329
1770 1 2 . 1 1 152 152 LEU N N 175 123.110 123.110 122.022 1.088 18329
1771 1 2 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.124 -0.314 18329
1772 1 2 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.493 0.507 18329
1773 1 2 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.264 0.236 18329
1774 1 2 . 1 1 152 152 LEU H H 175 7.870 7.870 7.591 0.279 18329
1775 1 2 . 1 1 153 153 LYS N N 176 117.270 117.270 119.213 -1.943 18329
1776 1 2 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.798 -0.098 18329
1777 1 2 . 1 1 153 153 LYS C C 176 179.100 179.100 177.960 1.140 18329
1778 1 2 . 1 1 153 153 LYS CA C 176 56.700 56.700 59.291 -2.591 18329
1779 1 2 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.998 -2.098 18329
1780 1 2 . 1 1 153 153 LYS H H 176 7.900 7.900 7.559 0.341 18329
1781 1 2 . 1 1 154 154 LYS N N 177 119.290 119.290 118.988 0.302 18329
1782 1 2 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.100 0.160 18329
1783 1 2 . 1 1 154 154 LYS C C 177 178.100 178.100 178.388 -0.288 18329
1784 1 2 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.124 -1.324 18329
1785 1 2 . 1 1 154 154 LYS CB C 177 31.800 31.800 32.052 -0.252 18329
1786 1 2 . 1 1 154 154 LYS H H 177 7.540 7.540 7.412 0.128 18329
1787 1 2 . 1 1 155 155 LYS N N 178 118.910 118.910 117.249 1.661 18329
1788 1 2 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.027 0.023 18329
1789 1 2 . 1 1 155 155 LYS C C 178 178.100 178.100 179.217 -1.117 18329
1790 1 2 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.872 -0.872 18329
1791 1 2 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.081 0.119 18329
1792 1 2 . 1 1 155 155 LYS H H 178 7.630 7.630 7.783 -0.153 18329
1793 1 2 . 1 1 156 156 GLU N N 179 117.950 117.950 116.965 0.985 18329
1794 1 2 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.106 0.004 18329
1795 1 2 . 1 1 156 156 GLU C C 179 176.700 176.700 177.010 -0.310 18329
1796 1 2 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.156 -0.656 18329
1797 1 2 . 1 1 156 156 GLU CB C 179 29.600 29.600 30.176 -0.576 18329
1798 1 2 . 1 1 156 156 GLU H H 179 7.560 7.560 7.841 -0.281 18329
1799 1 2 . 1 1 157 157 ASN N N 180 116.590 116.590 115.917 0.673 18329
1800 1 2 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.894 -0.174 18329
1801 1 2 . 1 1 157 157 ASN C C 180 175.000 175.000 174.944 0.056 18329
1802 1 2 . 1 1 157 157 ASN CA C 180 52.700 52.700 52.081 0.619 18329
1803 1 2 . 1 1 157 157 ASN CB C 180 38.800 38.800 39.218 -0.418 18329
1804 1 2 . 1 1 157 157 ASN H H 180 7.820 7.820 7.609 0.211 18329
1805 1 2 . 1 1 158 158 SER HA H 181 4.450 4.450 4.230 0.220 18329
1806 1 2 . 1 1 158 158 SER CA C 181 60.400 60.400 60.649 -0.249 18329
1807 1 2 . 1 1 158 158 SER CB C 181 63.500 63.500 63.072 0.428 18329
1808 1 2 . 1 1 158 158 SER H H 181 8.030 8.030 8.745 -0.715 18329
1809 1 2 . 1 1 159 159 THR N N 182 112.800 112.800 115.149 -2.349 18329
1810 1 2 . 1 1 159 159 THR HA H 182 4.380 4.380 4.115 0.265 18329
1811 1 2 . 1 1 159 159 THR C C 182 174.300 174.300 174.763 -0.463 18329
1812 1 2 . 1 1 159 159 THR CA C 182 61.800 61.800 62.436 -0.636 18329
1813 1 2 . 1 1 159 159 THR CB C 182 69.100 69.100 67.938 1.162 18329
1814 1 2 . 1 1 159 159 THR H H 182 8.070 8.070 7.761 0.309 18329
1815 1 2 . 1 1 160 160 PHE N N 183 123.120 123.120 124.809 -1.689 18329
1816 1 2 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.367 0.073 18329
1817 1 2 . 1 1 160 160 PHE C C 183 175.100 175.100 175.381 -0.281 18329
1818 1 2 . 1 1 160 160 PHE CA C 183 58.900 58.900 59.050 -0.150 18329
1819 1 2 . 1 1 160 160 PHE CB C 183 40.000 40.000 38.351 1.649 18329
1820 1 2 . 1 1 160 160 PHE H H 183 7.900 7.900 7.647 0.253 18329
1821 1 2 . 1 1 161 161 THR N N 184 119.330 119.330 113.806 5.524 18329
1822 1 2 . 1 1 161 161 THR HA H 184 4.190 4.190 3.751 0.439 18329
1823 1 2 . 1 1 161 161 THR CA C 184 60.700 60.700 63.209 -2.509 18329
1824 1 2 . 1 1 161 161 THR CB C 184 70.700 70.700 68.642 2.058 18329
1825 1 2 . 1 1 161 161 THR H H 184 7.810 7.810 5.774 2.036 18329
1826 1 2 . 1 1 162 162 ASP N N 185 123.190 123.190 122.028 1.162 18329
1827 1 2 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.356 0.054 18329
1828 1 2 . 1 1 162 162 ASP C C 185 176.900 176.900 175.078 1.822 18329
1829 1 2 . 1 1 162 162 ASP CA C 185 53.900 53.900 55.383 -1.483 18329
1830 1 2 . 1 1 162 162 ASP CB C 185 44.000 44.000 40.418 3.582 18329
1831 1 2 . 1 1 162 162 ASP H H 185 8.000 8.000 8.570 -0.570 18329
1832 1 2 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.341 0.139 18329
1833 1 2 . 1 1 163 163 GLU CA C 186 58.800 58.800 56.596 2.204 18329
1834 1 2 . 1 1 163 163 GLU CB C 186 28.100 28.100 30.347 -2.247 18329
1835 1 2 . 1 1 166 166 LYS N N 189 118.150 118.150 119.321 -1.171 18329
1836 1 2 . 1 1 166 166 LYS HA H 189 4.220 4.220 3.911 0.309 18329
1837 1 2 . 1 1 166 166 LYS C C 189 177.500 177.500 176.198 1.302 18329
1838 1 2 . 1 1 166 166 LYS CA C 189 58.000 58.000 58.803 -0.803 18329
1839 1 2 . 1 1 166 166 LYS CB C 189 32.600 32.600 31.804 0.796 18329
1840 1 2 . 1 1 166 166 LYS H H 189 8.890 8.890 8.429 0.461 18329
1841 1 2 . 1 1 167 167 ASN N N 190 116.210 116.210 116.707 -0.497 18329
1842 1 2 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.755 0.205 18329
1843 1 2 . 1 1 167 167 ASN C C 190 174.900 174.900 174.148 0.752 18329
1844 1 2 . 1 1 167 167 ASN CA C 190 52.900 52.900 53.708 -0.807 18329
1845 1 2 . 1 1 167 167 ASN CB C 190 38.400 38.400 39.643 -1.243 18329
1846 1 2 . 1 1 167 167 ASN H H 190 8.030 8.030 8.593 -0.563 18329
1847 1 3 . 1 1 2 2 ALA N N 25 125.000 125.000 126.738 -1.738 18329
1848 1 3 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.664 -0.294 18329
1849 1 3 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.501 -0.201 18329
1850 1 3 . 1 1 2 2 ALA CB C 25 19.700 19.700 20.036 -0.336 18329
1851 1 3 . 1 1 2 2 ALA H H 25 8.690 8.690 8.322 0.368 18329
1852 1 3 . 1 1 3 3 GLY N N 26 106.920 106.920 105.968 0.952 18329
1853 1 3 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.414 -1.414 18329
1854 1 3 . 1 1 3 3 GLY H H 26 7.940 7.940 8.211 -0.271 18329
1855 1 3 . 1 1 4 4 LEU N N 27 119.140 119.140 121.462 -2.322 18329
1856 1 3 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.119 0.291 18329
1857 1 3 . 1 1 4 4 LEU C C 27 177.100 177.100 176.156 0.944 18329
1858 1 3 . 1 1 4 4 LEU CA C 27 54.400 54.400 56.640 -2.240 18329
1859 1 3 . 1 1 4 4 LEU CB C 27 42.100 42.100 42.145 -0.045 18329
1860 1 3 . 1 1 4 4 LEU H H 27 8.210 8.210 7.987 0.223 18329
1861 1 3 . 1 1 5 5 THR N N 28 112.940 112.940 115.119 -2.179 18329
1862 1 3 . 1 1 5 5 THR HA H 28 4.650 4.650 4.421 0.229 18329
1863 1 3 . 1 1 5 5 THR C C 28 175.500 175.500 174.478 1.022 18329
1864 1 3 . 1 1 5 5 THR CA C 28 60.100 60.100 62.070 -1.970 18329
1865 1 3 . 1 1 5 5 THR CB C 28 72.600 72.600 69.146 3.454 18329
1866 1 3 . 1 1 5 5 THR H H 28 9.220 9.220 8.709 0.511 18329
1867 1 3 . 1 1 6 6 GLY N N 29 108.230 108.230 109.064 -0.834 18329
1868 1 3 . 1 1 6 6 GLY C C 29 174.800 174.800 174.330 0.470 18329
1869 1 3 . 1 1 6 6 GLY CA C 29 46.000 46.000 44.743 1.257 18329
1870 1 3 . 1 1 6 6 GLY H H 29 8.520 8.520 8.118 0.402 18329
1871 1 3 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.020 0.020 18329
1872 1 3 . 1 1 7 7 ALA CA C 30 54.800 54.800 53.670 1.130 18329
1873 1 3 . 1 1 7 7 ALA CB C 30 18.200 18.200 17.082 1.118 18329
1874 1 3 . 1 1 8 8 THR N N 31 116.970 116.970 113.998 2.972 18329
1875 1 3 . 1 1 8 8 THR HA H 31 3.740 3.740 3.918 -0.178 18329
1876 1 3 . 1 1 8 8 THR C C 31 175.300 175.300 175.853 -0.553 18329
1877 1 3 . 1 1 8 8 THR CA C 31 67.000 67.000 66.188 0.812 18329
1878 1 3 . 1 1 8 8 THR CB C 31 68.700 68.700 68.370 0.330 18329
1879 1 3 . 1 1 8 8 THR H H 31 8.110 8.110 8.188 -0.078 18329
1880 1 3 . 1 1 9 9 LYS N N 32 120.540 120.540 119.712 0.828 18329
1881 1 3 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.066 -0.476 18329
1882 1 3 . 1 1 9 9 LYS C C 32 176.900 176.900 178.551 -1.651 18329
1883 1 3 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.062 0.738 18329
1884 1 3 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.838 0.562 18329
1885 1 3 . 1 1 9 9 LYS H H 32 6.860 6.860 8.213 -1.353 18329
1886 1 3 . 1 1 10 10 ILE N N 33 115.940 115.940 119.653 -3.713 18329
1887 1 3 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.873 -0.163 18329
1888 1 3 . 1 1 10 10 ILE C C 33 179.000 179.000 178.122 0.878 18329
1889 1 3 . 1 1 10 10 ILE CA C 33 64.000 64.000 63.899 0.101 18329
1890 1 3 . 1 1 10 10 ILE CB C 33 38.000 38.000 36.886 1.114 18329
1891 1 3 . 1 1 10 10 ILE H H 33 7.380 7.380 8.782 -1.402 18329
1892 1 3 . 1 1 11 11 ARG N N 34 118.350 118.350 120.403 -2.053 18329
1893 1 3 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.087 -0.047 18329
1894 1 3 . 1 1 11 11 ARG C C 34 180.000 180.000 178.935 1.065 18329
1895 1 3 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.625 -0.225 18329
1896 1 3 . 1 1 11 11 ARG CB C 34 30.300 30.300 29.974 0.326 18329
1897 1 3 . 1 1 11 11 ARG H H 34 8.250 8.250 7.552 0.698 18329
1898 1 3 . 1 1 12 12 LEU N N 35 117.420 117.420 119.173 -1.753 18329
1899 1 3 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.201 -0.031 18329
1900 1 3 . 1 1 12 12 LEU C C 35 179.000 179.000 179.414 -0.414 18329
1901 1 3 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.284 0.716 18329
1902 1 3 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.756 -0.956 18329
1903 1 3 . 1 1 12 12 LEU H H 35 8.340 8.340 7.596 0.744 18329
1904 1 3 . 1 1 13 13 GLU N N 36 117.890 117.890 120.136 -2.246 18329
1905 1 3 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.888 0.132 18329
1906 1 3 . 1 1 13 13 GLU C C 36 180.100 180.100 178.849 1.251 18329
1907 1 3 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.960 0.240 18329
1908 1 3 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.660 -1.360 18329
1909 1 3 . 1 1 13 13 GLU H H 36 8.610 8.610 8.588 0.022 18329
1910 1 3 . 1 1 14 14 ARG N N 37 121.100 121.100 118.061 3.039 18329
1911 1 3 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.045 0.195 18329
1912 1 3 . 1 1 14 14 ARG C C 37 178.100 178.100 179.021 -0.921 18329
1913 1 3 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.512 -1.012 18329
1914 1 3 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.457 -0.257 18329
1915 1 3 . 1 1 14 14 ARG H H 37 7.980 7.980 8.062 -0.082 18329
1916 1 3 . 1 1 15 15 SER N N 38 115.420 115.420 113.977 1.443 18329
1917 1 3 . 1 1 15 15 SER HA H 38 4.380 4.380 4.663 -0.283 18329
1918 1 3 . 1 1 15 15 SER C C 38 177.300 177.300 175.702 1.598 18329
1919 1 3 . 1 1 15 15 SER CA C 38 62.200 62.200 60.574 1.627 18329
1920 1 3 . 1 1 15 15 SER CB C 38 63.200 63.200 63.270 -0.070 18329
1921 1 3 . 1 1 15 15 SER H H 38 8.230 8.230 8.034 0.196 18329
1922 1 3 . 1 1 16 16 ALA N N 39 123.970 123.970 124.847 -0.877 18329
1923 1 3 . 1 1 16 16 ALA HA H 39 3.630 3.630 4.211 -0.581 18329
1924 1 3 . 1 1 16 16 ALA C C 39 179.500 179.500 179.609 -0.109 18329
1925 1 3 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.515 0.185 18329
1926 1 3 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.544 -0.544 18329
1927 1 3 . 1 1 16 16 ALA H H 39 8.280 8.280 8.054 0.226 18329
1928 1 3 . 1 1 17 17 LYS N N 40 121.690 121.690 119.791 1.899 18329
1929 1 3 . 1 1 17 17 LYS HA H 40 4.090 4.090 3.965 0.125 18329
1930 1 3 . 1 1 17 17 LYS C C 40 178.000 178.000 178.076 -0.076 18329
1931 1 3 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.599 -1.199 18329
1932 1 3 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.278 -0.478 18329
1933 1 3 . 1 1 17 17 LYS H H 40 7.930 7.930 7.843 0.087 18329
1934 1 3 . 1 1 18 18 ASP N N 41 118.730 118.730 119.008 -0.278 18329
1935 1 3 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.367 -0.007 18329
1936 1 3 . 1 1 18 18 ASP C C 41 179.900 179.900 178.774 1.126 18329
1937 1 3 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.983 0.717 18329
1938 1 3 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.006 -0.406 18329
1939 1 3 . 1 1 18 18 ASP H H 41 8.320 8.320 7.756 0.564 18329
1940 1 3 . 1 1 19 19 ILE N N 42 118.180 118.180 119.560 -1.380 18329
1941 1 3 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.697 -0.007 18329
1942 1 3 . 1 1 19 19 ILE C C 42 177.400 177.400 177.757 -0.357 18329
1943 1 3 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.427 -0.227 18329
1944 1 3 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.661 0.239 18329
1945 1 3 . 1 1 19 19 ILE H H 42 7.420 7.420 8.131 -0.711 18329
1946 1 3 . 1 1 20 20 THR N N 43 113.360 113.360 113.306 0.054 18329
1947 1 3 . 1 1 20 20 THR HA H 43 3.770 3.770 4.055 -0.285 18329
1948 1 3 . 1 1 20 20 THR C C 43 177.800 177.800 176.400 1.400 18329
1949 1 3 . 1 1 20 20 THR CA C 43 66.400 66.400 65.663 0.737 18329
1950 1 3 . 1 1 20 20 THR CB C 43 67.400 67.400 68.179 -0.779 18329
1951 1 3 . 1 1 20 20 THR H H 43 7.610 7.610 7.810 -0.200 18329
1952 1 3 . 1 1 21 21 ASP N N 44 123.650 123.650 122.661 0.989 18329
1953 1 3 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.392 0.018 18329
1954 1 3 . 1 1 21 21 ASP C C 44 179.200 179.200 178.325 0.875 18329
1955 1 3 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.300 -0.100 18329
1956 1 3 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.543 -0.943 18329
1957 1 3 . 1 1 21 21 ASP H H 44 9.260 9.260 8.214 1.046 18329
1958 1 3 . 1 1 22 22 GLU N N 45 123.560 123.560 118.797 4.763 18329
1959 1 3 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.139 0.231 18329
1960 1 3 . 1 1 22 22 GLU C C 45 178.500 178.500 179.292 -0.792 18329
1961 1 3 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.947 -0.747 18329
1962 1 3 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.750 -0.550 18329
1963 1 3 . 1 1 22 22 GLU H H 45 7.750 7.750 7.884 -0.134 18329
1964 1 3 . 1 1 23 23 ILE N N 46 119.940 119.940 115.782 4.158 18329
1965 1 3 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.880 -0.260 18329
1966 1 3 . 1 1 23 23 ILE C C 46 177.600 177.600 177.721 -0.121 18329
1967 1 3 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.352 1.248 18329
1968 1 3 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.712 -0.712 18329
1969 1 3 . 1 1 23 23 ILE H H 46 8.360 8.360 7.303 1.057 18329
1970 1 3 . 1 1 24 24 ASP N N 47 120.730 120.730 120.943 -0.213 18329
1971 1 3 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.341 0.059 18329
1972 1 3 . 1 1 24 24 ASP C C 47 178.900 178.900 177.792 1.108 18329
1973 1 3 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.027 0.473 18329
1974 1 3 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.670 -0.770 18329
1975 1 3 . 1 1 24 24 ASP H H 47 8.280 8.280 8.580 -0.300 18329
1976 1 3 . 1 1 25 25 ALA N N 48 123.870 123.870 121.171 2.699 18329
1977 1 3 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.079 0.041 18329
1978 1 3 . 1 1 25 25 ALA C C 48 180.400 180.400 179.398 1.002 18329
1979 1 3 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.963 0.537 18329
1980 1 3 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.487 -0.687 18329
1981 1 3 . 1 1 25 25 ALA H H 48 7.880 7.880 7.175 0.705 18329
1982 1 3 . 1 1 26 26 ILE N N 49 121.970 121.970 119.019 2.951 18329
1983 1 3 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.579 0.151 18329
1984 1 3 . 1 1 26 26 ILE C C 49 178.400 178.400 178.097 0.303 18329
1985 1 3 . 1 1 26 26 ILE CA C 49 65.900 65.900 65.068 0.832 18329
1986 1 3 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.639 -0.139 18329
1987 1 3 . 1 1 26 26 ILE H H 49 8.710 8.710 7.286 1.424 18329
1988 1 3 . 1 1 27 27 LYS N N 50 119.820 119.820 118.854 0.966 18329
1989 1 3 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.579 0.301 18329
1990 1 3 . 1 1 27 27 LYS C C 50 179.900 179.900 178.711 1.189 18329
1991 1 3 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.584 0.816 18329
1992 1 3 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.738 0.163 18329
1993 1 3 . 1 1 27 27 LYS H H 50 8.540 8.540 7.572 0.968 18329
1994 1 3 . 1 1 28 28 LYS N N 51 121.960 121.960 120.287 1.673 18329
1995 1 3 . 1 1 28 28 LYS HA H 51 4.090 4.090 3.915 0.175 18329
1996 1 3 . 1 1 28 28 LYS C C 51 179.200 179.200 178.893 0.307 18329
1997 1 3 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.549 -0.249 18329
1998 1 3 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.334 -0.934 18329
1999 1 3 . 1 1 28 28 LYS H H 51 8.070 8.070 7.580 0.490 18329
2000 1 3 . 1 1 29 29 ASP N N 52 121.710 121.710 118.957 2.753 18329
2001 1 3 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.516 -0.046 18329
2002 1 3 . 1 1 29 29 ASP C C 52 178.500 178.500 177.668 0.832 18329
2003 1 3 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.237 0.763 18329
2004 1 3 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.690 0.310 18329
2005 1 3 . 1 1 29 29 ASP H H 52 8.340 8.340 8.180 0.160 18329
2006 1 3 . 1 1 30 30 ALA N N 53 121.990 121.990 121.986 0.004 18329
2007 1 3 . 1 1 30 30 ALA HA H 53 3.340 3.340 3.987 -0.647 18329
2008 1 3 . 1 1 30 30 ALA C C 53 179.500 179.500 178.629 0.871 18329
2009 1 3 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.557 0.543 18329
2010 1 3 . 1 1 30 30 ALA CB C 53 18.100 18.100 19.320 -1.220 18329
2011 1 3 . 1 1 30 30 ALA H H 53 8.800 8.800 8.118 0.682 18329
2012 1 3 . 1 1 31 31 ALA N N 54 119.970 119.970 121.683 -1.713 18329
2013 1 3 . 1 1 31 31 ALA HA H 54 4.150 4.150 3.981 0.169 18329
2014 1 3 . 1 1 31 31 ALA C C 54 181.600 181.600 177.952 3.648 18329
2015 1 3 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.083 0.617 18329
2016 1 3 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.790 -0.990 18329
2017 1 3 . 1 1 31 31 ALA H H 54 7.730 7.730 8.037 -0.307 18329
2018 1 3 . 1 1 32 32 LEU N N 55 119.660 119.660 118.979 0.681 18329
2019 1 3 . 1 1 32 32 LEU HA H 55 4.140 4.140 3.978 0.162 18329
2020 1 3 . 1 1 32 32 LEU C C 55 179.100 179.100 176.270 2.830 18329
2021 1 3 . 1 1 32 32 LEU CA C 55 57.000 57.000 54.896 2.104 18329
2022 1 3 . 1 1 32 32 LEU CB C 55 41.900 41.900 40.432 1.468 18329
2023 1 3 . 1 1 32 32 LEU H H 55 7.660 7.660 7.706 -0.046 18329
2024 1 3 . 1 1 33 33 LYS N N 56 117.160 117.160 116.572 0.588 18329
2025 1 3 . 1 1 33 33 LYS HA H 56 4.210 4.210 3.889 0.321 18329
2026 1 3 . 1 1 33 33 LYS C C 56 176.600 176.600 175.495 1.105 18329
2027 1 3 . 1 1 33 33 LYS CA C 56 56.100 56.100 56.970 -0.870 18329
2028 1 3 . 1 1 33 33 LYS CB C 56 33.200 33.200 30.247 2.953 18329
2029 1 3 . 1 1 33 33 LYS H H 56 7.610 7.610 8.426 -0.816 18329
2030 1 3 . 1 1 34 34 GLY N N 57 108.680 108.680 107.567 1.113 18329
2031 1 3 . 1 1 34 34 GLY C C 57 174.400 174.400 173.709 0.691 18329
2032 1 3 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.413 0.787 18329
2033 1 3 . 1 1 34 34 GLY H H 57 7.710 7.710 8.045 -0.335 18329
2034 1 3 . 1 1 35 35 VAL N N 58 121.000 121.000 122.875 -1.875 18329
2035 1 3 . 1 1 35 35 VAL HA H 58 3.900 3.900 3.620 0.280 18329
2036 1 3 . 1 1 35 35 VAL C C 58 174.200 174.200 176.686 -2.486 18329
2037 1 3 . 1 1 35 35 VAL CA C 58 61.500 61.500 63.130 -1.630 18329
2038 1 3 . 1 1 35 35 VAL CB C 58 32.800 32.800 31.841 0.959 18329
2039 1 3 . 1 1 35 35 VAL H H 58 7.990 7.990 7.687 0.303 18329
2040 1 3 . 1 1 36 36 ASN N N 59 124.960 124.960 125.162 -0.202 18329
2041 1 3 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.524 0.146 18329
2042 1 3 . 1 1 36 36 ASN C C 59 175.700 175.700 175.892 -0.192 18329
2043 1 3 . 1 1 36 36 ASN CA C 59 51.600 51.600 54.357 -2.757 18329
2044 1 3 . 1 1 36 36 ASN CB C 59 39.100 39.100 38.450 0.650 18329
2045 1 3 . 1 1 36 36 ASN H H 59 8.460 8.460 8.558 -0.098 18329
2046 1 3 . 1 1 37 37 PHE N N 60 124.460 124.460 118.780 5.680 18329
2047 1 3 . 1 1 37 37 PHE HA H 60 4.140 4.140 3.981 0.159 18329
2048 1 3 . 1 1 37 37 PHE C C 60 177.000 177.000 174.974 2.026 18329
2049 1 3 . 1 1 37 37 PHE CA C 60 60.400 60.400 60.291 0.109 18329
2050 1 3 . 1 1 37 37 PHE CB C 60 39.200 39.200 38.935 0.265 18329
2051 1 3 . 1 1 37 37 PHE H H 60 8.780 8.780 7.792 0.988 18329
2052 1 3 . 1 1 38 38 ASP N N 61 119.270 119.270 117.485 1.785 18329
2053 1 3 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.230 0.260 18329
2054 1 3 . 1 1 38 38 ASP C C 61 177.000 177.000 174.430 2.570 18329
2055 1 3 . 1 1 38 38 ASP CA C 61 55.500 55.500 55.442 0.058 18329
2056 1 3 . 1 1 38 38 ASP CB C 61 40.000 40.000 39.755 0.244 18329
2057 1 3 . 1 1 38 38 ASP H H 61 8.400 8.400 8.216 0.184 18329
2058 1 3 . 1 1 39 39 ALA N N 62 122.020 122.020 120.515 1.505 18329
2059 1 3 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.370 -0.170 18329
2060 1 3 . 1 1 39 39 ALA C C 62 178.300 178.300 175.641 2.659 18329
2061 1 3 . 1 1 39 39 ALA CA C 62 52.900 52.900 51.601 1.299 18329
2062 1 3 . 1 1 39 39 ALA CB C 62 18.500 18.500 19.621 -1.121 18329
2063 1 3 . 1 1 39 39 ALA H H 62 7.740 7.740 7.266 0.474 18329
2064 1 3 . 1 1 40 40 PHE N N 63 116.940 116.940 119.845 -2.905 18329
2065 1 3 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.755 -0.375 18329
2066 1 3 . 1 1 40 40 PHE C C 63 176.100 176.100 176.180 -0.080 18329
2067 1 3 . 1 1 40 40 PHE CA C 63 58.300 58.300 56.962 1.338 18329
2068 1 3 . 1 1 40 40 PHE CB C 63 38.800 38.800 39.695 -0.895 18329
2069 1 3 . 1 1 40 40 PHE H H 63 7.730 7.730 8.334 -0.604 18329
2070 1 3 . 1 1 41 41 LYS N N 64 119.840 119.840 120.592 -0.752 18329
2071 1 3 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.124 0.096 18329
2072 1 3 . 1 1 41 41 LYS C C 64 176.100 176.100 176.452 -0.352 18329
2073 1 3 . 1 1 41 41 LYS CA C 64 56.600 56.600 57.891 -1.291 18329
2074 1 3 . 1 1 41 41 LYS CB C 64 32.900 32.900 32.118 0.782 18329
2075 1 3 . 1 1 41 41 LYS H H 64 7.650 7.650 7.881 -0.231 18329
2076 1 3 . 1 1 42 42 ASP N N 65 120.770 120.770 119.586 1.184 18329
2077 1 3 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.706 -0.136 18329
2078 1 3 . 1 1 42 42 ASP C C 65 176.100 176.100 176.183 -0.083 18329
2079 1 3 . 1 1 42 42 ASP CA C 65 54.200 54.200 53.844 0.356 18329
2080 1 3 . 1 1 42 42 ASP CB C 65 40.900 40.900 41.342 -0.442 18329
2081 1 3 . 1 1 42 42 ASP H H 65 8.030 8.030 8.099 -0.069 18329
2082 1 3 . 1 1 43 43 LYS N N 66 122.070 122.070 121.565 0.505 18329
2083 1 3 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.265 0.015 18329
2084 1 3 . 1 1 43 43 LYS C C 66 176.800 176.800 176.828 -0.028 18329
2085 1 3 . 1 1 43 43 LYS CA C 66 56.500 56.500 56.599 -0.098 18329
2086 1 3 . 1 1 43 43 LYS CB C 66 32.800 32.800 33.112 -0.312 18329
2087 1 3 . 1 1 43 43 LYS H H 66 8.180 8.180 8.336 -0.156 18329
2088 1 3 . 1 1 44 44 LYS N N 67 122.170 122.170 122.467 -0.297 18329
2089 1 3 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.373 -0.023 18329
2090 1 3 . 1 1 44 44 LYS C C 67 177.000 177.000 176.465 0.535 18329
2091 1 3 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.678 -0.079 18329
2092 1 3 . 1 1 44 44 LYS CB C 67 32.800 32.800 33.446 -0.646 18329
2093 1 3 . 1 1 44 44 LYS H H 67 8.460 8.460 8.362 0.098 18329
2094 1 3 . 1 1 45 45 THR N N 68 114.390 114.390 114.945 -0.555 18329
2095 1 3 . 1 1 45 45 THR HA H 68 4.330 4.330 4.527 -0.197 18329
2096 1 3 . 1 1 45 45 THR C C 68 175.200 175.200 174.646 0.554 18329
2097 1 3 . 1 1 45 45 THR CA C 68 62.000 62.000 61.028 0.972 18329
2098 1 3 . 1 1 45 45 THR CB C 68 69.900 69.900 70.746 -0.846 18329
2099 1 3 . 1 1 45 45 THR H H 68 8.120 8.120 8.304 -0.184 18329
2100 1 3 . 1 1 46 46 GLY N N 69 111.200 111.200 115.152 -3.952 18329
2101 1 3 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.748 -0.548 18329
2102 1 3 . 1 1 46 46 GLY H H 69 8.450 8.450 8.645 -0.195 18329
2103 1 3 . 1 1 47 47 SER CA C 70 58.400 58.400 57.306 1.094 18329
2104 1 3 . 1 1 47 47 SER CB C 70 64.000 64.000 64.341 -0.341 18329
2105 1 3 . 1 1 48 48 GLY N N 71 111.200 111.200 110.053 1.147 18329
2106 1 3 . 1 1 48 48 GLY CA C 71 45.000 45.000 46.130 -1.130 18329
2107 1 3 . 1 1 48 48 GLY H H 71 8.580 8.580 8.542 0.038 18329
2108 1 3 . 1 1 49 49 VAL N N 72 118.910 118.910 116.873 2.037 18329
2109 1 3 . 1 1 49 49 VAL HA H 72 4.130 4.130 3.805 0.325 18329
2110 1 3 . 1 1 49 49 VAL C C 72 176.100 176.100 176.224 -0.124 18329
2111 1 3 . 1 1 49 49 VAL CA C 72 62.100 62.100 62.219 -0.119 18329
2112 1 3 . 1 1 49 49 VAL CB C 72 32.500 32.500 32.135 0.365 18329
2113 1 3 . 1 1 49 49 VAL H H 72 7.860 7.860 7.653 0.207 18329
2114 1 3 . 1 1 50 50 SER N N 73 118.500 118.500 116.593 1.907 18329
2115 1 3 . 1 1 50 50 SER C C 73 176.100 176.100 174.649 1.451 18329
2116 1 3 . 1 1 50 50 SER CA C 73 58.300 58.300 60.270 -1.970 18329
2117 1 3 . 1 1 50 50 SER CB C 73 63.800 63.800 62.623 1.177 18329
2118 1 3 . 1 1 50 50 SER H H 73 8.300 8.300 8.469 -0.169 18329
2119 1 3 . 1 1 51 51 GLU N N 74 122.560 122.560 125.170 -2.610 18329
2120 1 3 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.094 0.176 18329
2121 1 3 . 1 1 51 51 GLU CA C 74 55.700 55.700 56.003 -0.303 18329
2122 1 3 . 1 1 51 51 GLU CB C 74 30.500 30.500 29.171 1.329 18329
2123 1 3 . 1 1 51 51 GLU H H 74 8.360 8.360 8.145 0.215 18329
2124 1 3 . 1 1 52 52 ASN N N 75 122.830 122.830 123.822 -0.992 18329
2125 1 3 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.557 0.263 18329
2126 1 3 . 1 1 52 52 ASN C C 75 174.800 174.800 174.747 0.053 18329
2127 1 3 . 1 1 52 52 ASN CA C 75 51.400 51.400 52.704 -1.304 18329
2128 1 3 . 1 1 52 52 ASN CB C 75 39.200 39.200 38.178 1.022 18329
2129 1 3 . 1 1 52 52 ASN H H 75 8.450 8.450 8.105 0.345 18329
2130 1 3 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.213 -0.033 18329
2131 1 3 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.477 0.723 18329
2132 1 3 . 1 1 53 53 PRO CB C 76 32.000 32.000 31.517 0.483 18329
2133 1 3 . 1 1 54 54 PHE N N 77 118.060 118.060 117.307 0.753 18329
2134 1 3 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.316 -0.046 18329
2135 1 3 . 1 1 54 54 PHE C C 77 177.500 177.500 177.868 -0.368 18329
2136 1 3 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.943 -0.443 18329
2137 1 3 . 1 1 54 54 PHE CB C 77 39.400 39.400 38.747 0.653 18329
2138 1 3 . 1 1 54 54 PHE H H 77 8.430 8.430 8.027 0.403 18329
2139 1 3 . 1 1 55 55 ILE N N 78 119.350 119.350 118.538 0.812 18329
2140 1 3 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.880 -0.380 18329
2141 1 3 . 1 1 55 55 ILE C C 78 177.400 177.400 177.841 -0.441 18329
2142 1 3 . 1 1 55 55 ILE CA C 78 63.500 63.500 64.832 -1.331 18329
2143 1 3 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.822 -0.822 18329
2144 1 3 . 1 1 55 55 ILE H H 78 7.540 7.540 8.030 -0.490 18329
2145 1 3 . 1 1 56 56 LEU N N 79 118.450 118.450 119.752 -1.302 18329
2146 1 3 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.003 0.147 18329
2147 1 3 . 1 1 56 56 LEU C C 79 179.200 179.200 179.262 -0.062 18329
2148 1 3 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.069 -0.270 18329
2149 1 3 . 1 1 56 56 LEU CB C 79 41.100 41.100 40.705 0.395 18329
2150 1 3 . 1 1 56 56 LEU H H 79 7.260 7.260 7.511 -0.251 18329
2151 1 3 . 1 1 57 57 GLU N N 80 117.980 117.980 117.732 0.248 18329
2152 1 3 . 1 1 57 57 GLU HA H 80 3.650 3.650 4.015 -0.365 18329
2153 1 3 . 1 1 57 57 GLU C C 80 178.700 178.700 178.982 -0.282 18329
2154 1 3 . 1 1 57 57 GLU CA C 80 59.300 59.300 59.120 0.180 18329
2155 1 3 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.373 0.127 18329
2156 1 3 . 1 1 57 57 GLU H H 80 7.890 7.890 8.232 -0.342 18329
2157 1 3 . 1 1 58 58 ALA N N 81 122.040 122.040 120.840 1.200 18329
2158 1 3 . 1 1 58 58 ALA HA H 81 3.800 3.800 4.293 -0.493 18329
2159 1 3 . 1 1 58 58 ALA C C 81 179.500 179.500 178.833 0.667 18329
2160 1 3 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.287 0.913 18329
2161 1 3 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.628 0.172 18329
2162 1 3 . 1 1 58 58 ALA H H 81 8.400 8.400 7.815 0.585 18329
2163 1 3 . 1 1 59 59 LYS N N 82 116.000 116.000 119.523 -3.523 18329
2164 1 3 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.097 -0.247 18329
2165 1 3 . 1 1 59 59 LYS C C 82 180.300 180.300 178.596 1.704 18329
2166 1 3 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.534 1.566 18329
2167 1 3 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.647 -0.447 18329
2168 1 3 . 1 1 59 59 LYS H H 82 8.000 8.000 7.474 0.526 18329
2169 1 3 . 1 1 60 60 VAL N N 83 122.920 122.920 115.739 7.181 18329
2170 1 3 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.663 -0.333 18329
2171 1 3 . 1 1 60 60 VAL C C 83 178.300 178.300 178.157 0.143 18329
2172 1 3 . 1 1 60 60 VAL CA C 83 67.900 67.900 64.508 3.392 18329
2173 1 3 . 1 1 60 60 VAL CB C 83 31.200 31.200 30.846 0.354 18329
2174 1 3 . 1 1 60 60 VAL H H 83 8.110 8.110 7.354 0.756 18329
2175 1 3 . 1 1 61 61 ARG N N 84 121.770 121.770 120.070 1.700 18329
2176 1 3 . 1 1 61 61 ARG C C 84 179.500 179.500 178.388 1.112 18329
2177 1 3 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.178 0.022 18329
2178 1 3 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.561 1.239 18329
2179 1 3 . 1 1 61 61 ARG H H 84 8.710 8.710 7.612 1.098 18329
2180 1 3 . 1 1 62 62 ALA N N 85 119.450 119.450 120.888 -1.438 18329
2181 1 3 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.115 -0.225 18329
2182 1 3 . 1 1 62 62 ALA C C 85 179.500 179.500 179.127 0.373 18329
2183 1 3 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.173 -0.173 18329
2184 1 3 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.494 0.506 18329
2185 1 3 . 1 1 62 62 ALA H H 85 8.700 8.700 7.821 0.879 18329
2186 1 3 . 1 1 63 63 THR N N 86 106.650 106.650 109.629 -2.979 18329
2187 1 3 . 1 1 63 63 THR HA H 86 3.970 3.970 4.190 -0.220 18329
2188 1 3 . 1 1 63 63 THR C C 86 177.700 177.700 176.818 0.882 18329
2189 1 3 . 1 1 63 63 THR CA C 86 66.000 66.000 65.437 0.563 18329
2190 1 3 . 1 1 63 63 THR CB C 86 68.200 68.200 68.887 -0.687 18329
2191 1 3 . 1 1 63 63 THR H H 86 8.150 8.150 7.632 0.518 18329
2192 1 3 . 1 1 64 64 THR N N 87 120.430 120.430 120.064 0.366 18329
2193 1 3 . 1 1 64 64 THR HA H 87 4.050 4.050 4.102 -0.052 18329
2194 1 3 . 1 1 64 64 THR C C 87 176.800 176.800 176.411 0.389 18329
2195 1 3 . 1 1 64 64 THR CA C 87 67.300 67.300 67.386 -0.086 18329
2196 1 3 . 1 1 64 64 THR CB C 87 68.600 68.600 68.594 0.006 18329
2197 1 3 . 1 1 64 64 THR H H 87 7.920 7.920 7.995 -0.075 18329
2198 1 3 . 1 1 65 65 VAL N N 88 119.230 119.230 120.340 -1.110 18329
2199 1 3 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.702 0.278 18329
2200 1 3 . 1 1 65 65 VAL C C 88 178.500 178.500 177.400 1.100 18329
2201 1 3 . 1 1 65 65 VAL CA C 88 65.600 65.600 66.357 -0.757 18329
2202 1 3 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.504 0.196 18329
2203 1 3 . 1 1 65 65 VAL H H 88 7.380 7.380 7.565 -0.185 18329
2204 1 3 . 1 1 66 66 ALA N N 89 124.260 124.260 121.439 2.821 18329
2205 1 3 . 1 1 66 66 ALA HA H 89 4.250 4.250 4.016 0.234 18329
2206 1 3 . 1 1 66 66 ALA C C 89 179.900 179.900 179.055 0.845 18329
2207 1 3 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.051 -0.151 18329
2208 1 3 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.111 1.389 18329
2209 1 3 . 1 1 66 66 ALA H H 89 8.390 8.390 7.522 0.868 18329
2210 1 3 . 1 1 67 67 GLU N N 90 120.180 120.180 117.835 2.345 18329
2211 1 3 . 1 1 67 67 GLU HA H 90 3.720 3.720 4.019 -0.299 18329
2212 1 3 . 1 1 67 67 GLU C C 90 177.600 177.600 178.817 -1.217 18329
2213 1 3 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.527 0.373 18329
2214 1 3 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.494 -1.194 18329
2215 1 3 . 1 1 67 67 GLU H H 90 8.520 8.520 8.337 0.183 18329
2216 1 3 . 1 1 68 68 LYS N N 91 116.340 116.340 118.311 -1.971 18329
2217 1 3 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.034 -0.074 18329
2218 1 3 . 1 1 68 68 LYS C C 91 179.200 179.200 178.793 0.407 18329
2219 1 3 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.862 0.938 18329
2220 1 3 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.291 -0.291 18329
2221 1 3 . 1 1 68 68 LYS H H 91 7.210 7.210 7.516 -0.306 18329
2222 1 3 . 1 1 69 69 PHE N N 92 120.990 120.990 120.904 0.086 18329
2223 1 3 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.151 0.359 18329
2224 1 3 . 1 1 69 69 PHE C C 92 175.100 175.100 177.126 -2.026 18329
2225 1 3 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.514 -1.714 18329
2226 1 3 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.086 0.114 18329
2227 1 3 . 1 1 69 69 PHE H H 92 7.180 7.180 7.792 -0.612 18329
2228 1 3 . 1 1 70 70 VAL N N 93 120.330 120.330 117.055 3.275 18329
2229 1 3 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.471 -0.381 18329
2230 1 3 . 1 1 70 70 VAL C C 93 177.500 177.500 177.699 -0.199 18329
2231 1 3 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.210 0.690 18329
2232 1 3 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.367 0.033 18329
2233 1 3 . 1 1 70 70 VAL H H 93 7.930 7.930 7.562 0.368 18329
2234 1 3 . 1 1 71 71 ILE N N 94 120.410 120.410 119.870 0.540 18329
2235 1 3 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.699 0.131 18329
2236 1 3 . 1 1 71 71 ILE C C 94 177.700 177.700 177.800 -0.100 18329
2237 1 3 . 1 1 71 71 ILE CA C 94 65.000 65.000 64.995 0.005 18329
2238 1 3 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.544 -0.244 18329
2239 1 3 . 1 1 71 71 ILE H H 94 8.180 8.180 7.608 0.572 18329
2240 1 3 . 1 1 72 72 ALA N N 95 122.440 122.440 122.486 -0.046 18329
2241 1 3 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.976 -0.016 18329
2242 1 3 . 1 1 72 72 ALA C C 95 179.600 179.600 179.447 0.153 18329
2243 1 3 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.184 0.716 18329
2244 1 3 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.792 -0.592 18329
2245 1 3 . 1 1 72 72 ALA H H 95 7.340 7.340 7.641 -0.301 18329
2246 1 3 . 1 1 73 73 ILE N N 96 119.330 119.330 119.181 0.149 18329
2247 1 3 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.618 -0.178 18329
2248 1 3 . 1 1 73 73 ILE C C 96 177.400 177.400 177.871 -0.471 18329
2249 1 3 . 1 1 73 73 ILE CA C 96 62.800 62.800 62.959 -0.159 18329
2250 1 3 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.218 -1.819 18329
2251 1 3 . 1 1 73 73 ILE H H 96 7.820 7.820 7.007 0.813 18329
2252 1 3 . 1 1 74 74 GLU N N 97 118.440 118.440 121.441 -3.001 18329
2253 1 3 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.818 -0.128 18329
2254 1 3 . 1 1 74 74 GLU C C 97 180.500 180.500 179.022 1.478 18329
2255 1 3 . 1 1 74 74 GLU CA C 97 59.700 59.700 60.218 -0.518 18329
2256 1 3 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.556 0.144 18329
2257 1 3 . 1 1 74 74 GLU H H 97 8.380 8.380 8.077 0.303 18329
2258 1 3 . 1 1 75 75 GLU N N 98 120.470 120.470 118.206 2.264 18329
2259 1 3 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.059 -0.119 18329
2260 1 3 . 1 1 75 75 GLU C C 98 180.600 180.600 178.979 1.621 18329
2261 1 3 . 1 1 75 75 GLU CA C 98 59.700 59.700 58.921 0.779 18329
2262 1 3 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.664 0.536 18329
2263 1 3 . 1 1 75 75 GLU H H 98 8.800 8.800 7.788 1.012 18329
2264 1 3 . 1 1 76 76 GLU N N 99 119.230 119.230 120.424 -1.194 18329
2265 1 3 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.049 0.091 18329
2266 1 3 . 1 1 76 76 GLU C C 99 178.900 178.900 178.628 0.272 18329
2267 1 3 . 1 1 76 76 GLU CA C 99 58.600 58.600 59.076 -0.476 18329
2268 1 3 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.284 0.016 18329
2269 1 3 . 1 1 76 76 GLU H H 99 8.840 8.840 8.165 0.675 18329
2270 1 3 . 1 1 77 77 ALA N N 100 121.950 121.950 120.643 1.307 18329
2271 1 3 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.209 -0.209 18329
2272 1 3 . 1 1 77 77 ALA C C 100 179.000 179.000 179.739 -0.739 18329
2273 1 3 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.418 0.882 18329
2274 1 3 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.465 -1.665 18329
2275 1 3 . 1 1 77 77 ALA H H 100 9.400 9.400 8.344 1.056 18329
2276 1 3 . 1 1 78 78 THR N N 101 111.820 111.820 113.748 -1.928 18329
2277 1 3 . 1 1 78 78 THR HA H 101 3.750 3.750 3.978 -0.228 18329
2278 1 3 . 1 1 78 78 THR CA C 101 67.500 67.500 66.114 1.386 18329
2279 1 3 . 1 1 78 78 THR CB C 101 68.600 68.600 68.553 0.047 18329
2280 1 3 . 1 1 78 78 THR H H 101 7.770 7.770 7.546 0.224 18329
2281 1 3 . 1 1 79 79 LYS N N 102 122.940 122.940 119.465 3.475 18329
2282 1 3 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.113 -0.023 18329
2283 1 3 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.431 0.769 18329
2284 1 3 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.572 -0.072 18329
2285 1 3 . 1 1 79 79 LYS H H 102 7.870 7.870 7.470 0.400 18329
2286 1 3 . 1 1 80 80 LEU N N 103 117.690 117.690 117.232 0.458 18329
2287 1 3 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.348 0.142 18329
2288 1 3 . 1 1 80 80 LEU C C 103 178.140 178.140 177.039 1.101 18329
2289 1 3 . 1 1 80 80 LEU CA C 103 54.000 54.000 55.189 -1.189 18329
2290 1 3 . 1 1 80 80 LEU CB C 103 43.100 43.100 41.585 1.515 18329
2291 1 3 . 1 1 80 80 LEU H H 103 7.550 7.550 7.801 -0.251 18329
2292 1 3 . 1 1 81 81 LYS N N 104 122.210 122.210 116.505 5.705 18329
2293 1 3 . 1 1 81 81 LYS HA H 104 3.930 3.930 3.919 0.011 18329
2294 1 3 . 1 1 81 81 LYS C C 104 178.000 178.000 177.003 0.997 18329
2295 1 3 . 1 1 81 81 LYS CA C 104 61.300 61.300 57.748 3.552 18329
2296 1 3 . 1 1 81 81 LYS CB C 104 32.800 32.800 30.576 2.224 18329
2297 1 3 . 1 1 81 81 LYS H H 104 7.500 7.500 7.603 -0.103 18329
2298 1 3 . 1 1 82 82 GLU N N 105 114.920 114.920 120.494 -5.574 18329
2299 1 3 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.108 0.452 18329
2300 1 3 . 1 1 82 82 GLU C C 105 177.900 177.900 176.955 0.945 18329
2301 1 3 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.078 0.582 18329
2302 1 3 . 1 1 82 82 GLU CB C 105 30.400 30.400 29.665 0.735 18329
2303 1 3 . 1 1 82 82 GLU H H 105 8.780 8.780 8.376 0.404 18329
2304 1 3 . 1 1 83 83 THR N N 106 107.260 107.260 113.145 -5.885 18329
2305 1 3 . 1 1 83 83 THR HA H 106 4.550 4.550 4.038 0.512 18329
2306 1 3 . 1 1 83 83 THR C C 106 176.300 176.300 174.088 2.212 18329
2307 1 3 . 1 1 83 83 THR CA C 106 61.900 61.900 62.522 -0.621 18329
2308 1 3 . 1 1 83 83 THR CB C 106 70.400 70.400 68.529 1.871 18329
2309 1 3 . 1 1 83 83 THR H H 106 7.570 7.570 8.351 -0.781 18329
2310 1 3 . 1 1 84 84 GLY N N 107 112.110 112.110 107.296 4.814 18329
2311 1 3 . 1 1 84 84 GLY C C 107 172.800 172.800 173.466 -0.666 18329
2312 1 3 . 1 1 84 84 GLY CA C 107 45.400 45.400 44.337 1.063 18329
2313 1 3 . 1 1 84 84 GLY H H 107 9.000 9.000 7.855 1.145 18329
2314 1 3 . 1 1 85 85 SER N N 108 119.030 119.030 115.641 3.389 18329
2315 1 3 . 1 1 85 85 SER CA C 108 56.300 56.300 57.522 -1.222 18329
2316 1 3 . 1 1 85 85 SER CB C 108 66.300 66.300 65.462 0.838 18329
2317 1 3 . 1 1 85 85 SER H H 108 8.950 8.950 8.210 0.740 18329
2318 1 3 . 1 1 86 86 SER HA H 109 4.480 4.480 4.437 0.043 18329
2319 1 3 . 1 1 86 86 SER C C 109 177.000 177.000 176.860 0.140 18329
2320 1 3 . 1 1 86 86 SER CA C 109 61.600 61.600 60.729 0.871 18329
2321 1 3 . 1 1 86 86 SER CB C 109 62.900 62.900 63.095 -0.195 18329
2322 1 3 . 1 1 87 87 GLY N N 110 108.100 108.100 109.425 -1.325 18329
2323 1 3 . 1 1 87 87 GLY C C 110 177.100 177.100 176.439 0.661 18329
2324 1 3 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.975 -0.775 18329
2325 1 3 . 1 1 87 87 GLY H H 110 8.480 8.480 8.493 -0.013 18329
2326 1 3 . 1 1 88 88 GLU N N 111 123.040 123.040 122.398 0.642 18329
2327 1 3 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.067 -0.377 18329
2328 1 3 . 1 1 88 88 GLU C C 111 177.700 177.700 178.907 -1.207 18329
2329 1 3 . 1 1 88 88 GLU CA C 111 59.500 59.500 59.011 0.489 18329
2330 1 3 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.021 -0.321 18329
2331 1 3 . 1 1 88 88 GLU H H 111 7.560 7.560 7.550 0.010 18329
2332 1 3 . 1 1 89 89 PHE N N 112 118.270 118.270 119.297 -1.027 18329
2333 1 3 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.305 0.115 18329
2334 1 3 . 1 1 89 89 PHE C C 112 178.600 178.600 177.789 0.811 18329
2335 1 3 . 1 1 89 89 PHE CA C 112 61.100 61.100 61.284 -0.184 18329
2336 1 3 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.760 -0.860 18329
2337 1 3 . 1 1 89 89 PHE H H 112 7.200 7.200 7.862 -0.662 18329
2338 1 3 . 1 1 90 90 SER N N 113 115.980 115.980 115.255 0.725 18329
2339 1 3 . 1 1 90 90 SER HA H 113 4.290 4.290 4.135 0.155 18329
2340 1 3 . 1 1 90 90 SER C C 113 178.600 178.600 176.489 2.111 18329
2341 1 3 . 1 1 90 90 SER CA C 113 62.700 62.700 62.080 0.621 18329
2342 1 3 . 1 1 90 90 SER CB C 113 62.800 62.800 62.901 -0.101 18329
2343 1 3 . 1 1 90 90 SER H H 113 8.830 8.830 8.385 0.445 18329
2344 1 3 . 1 1 91 91 ALA N N 114 123.130 123.130 121.907 1.223 18329
2345 1 3 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.249 0.131 18329
2346 1 3 . 1 1 91 91 ALA C C 114 181.300 181.300 179.583 1.717 18329
2347 1 3 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.611 0.089 18329
2348 1 3 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.354 0.046 18329
2349 1 3 . 1 1 91 91 ALA H H 114 7.580 7.580 7.626 -0.046 18329
2350 1 3 . 1 1 92 92 MET N N 115 118.700 118.700 119.342 -0.642 18329
2351 1 3 . 1 1 92 92 MET HA H 115 3.980 3.980 4.325 -0.345 18329
2352 1 3 . 1 1 92 92 MET C C 115 178.000 178.000 177.687 0.313 18329
2353 1 3 . 1 1 92 92 MET CA C 115 61.000 61.000 57.676 3.324 18329
2354 1 3 . 1 1 92 92 MET CB C 115 31.400 31.400 32.699 -1.299 18329
2355 1 3 . 1 1 92 92 MET H H 115 7.880 7.880 7.821 0.059 18329
2356 1 3 . 1 1 93 93 TYR N N 116 119.200 119.200 120.107 -0.907 18329
2357 1 3 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.199 0.081 18329
2358 1 3 . 1 1 93 93 TYR C C 116 176.300 176.300 177.525 -1.225 18329
2359 1 3 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.836 0.264 18329
2360 1 3 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.592 -0.291 18329
2361 1 3 . 1 1 93 93 TYR H H 116 7.870 7.870 8.460 -0.590 18329
2362 1 3 . 1 1 94 94 ASP N N 117 120.210 120.210 119.803 0.407 18329
2363 1 3 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.491 -0.301 18329
2364 1 3 . 1 1 94 94 ASP C C 117 179.000 179.000 178.582 0.418 18329
2365 1 3 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.161 0.539 18329
2366 1 3 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.754 -0.754 18329
2367 1 3 . 1 1 94 94 ASP H H 117 8.720 8.720 7.976 0.744 18329
2368 1 3 . 1 1 95 95 LEU N N 118 118.420 118.420 120.465 -2.045 18329
2369 1 3 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.050 0.160 18329
2370 1 3 . 1 1 95 95 LEU C C 118 178.600 178.600 178.192 0.408 18329
2371 1 3 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.609 0.091 18329
2372 1 3 . 1 1 95 95 LEU CB C 118 43.100 43.100 42.064 1.036 18329
2373 1 3 . 1 1 95 95 LEU H H 118 7.510 7.510 7.187 0.323 18329
2374 1 3 . 1 1 96 96 MET N N 119 118.470 118.470 118.947 -0.477 18329
2375 1 3 . 1 1 96 96 MET HA H 119 3.990 3.990 3.843 0.147 18329
2376 1 3 . 1 1 96 96 MET C C 119 177.500 177.500 177.944 -0.444 18329
2377 1 3 . 1 1 96 96 MET CA C 119 60.500 60.500 57.836 2.664 18329
2378 1 3 . 1 1 96 96 MET CB C 119 33.900 33.900 32.010 1.890 18329
2379 1 3 . 1 1 96 96 MET H H 119 7.820 7.820 7.656 0.164 18329
2380 1 3 . 1 1 97 97 PHE N N 120 119.580 119.580 118.496 1.084 18329
2381 1 3 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.014 -0.204 18329
2382 1 3 . 1 1 97 97 PHE C C 120 178.800 178.800 176.892 1.908 18329
2383 1 3 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.996 -0.196 18329
2384 1 3 . 1 1 97 97 PHE CB C 120 39.200 39.200 38.986 0.214 18329
2385 1 3 . 1 1 97 97 PHE H H 120 8.940 8.940 7.702 1.238 18329
2386 1 3 . 1 1 98 98 GLU N N 121 119.940 119.940 118.574 1.366 18329
2387 1 3 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.049 -0.169 18329
2388 1 3 . 1 1 98 98 GLU C C 121 180.800 180.800 179.173 1.627 18329
2389 1 3 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.391 0.409 18329
2390 1 3 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.520 -0.320 18329
2391 1 3 . 1 1 98 98 GLU H H 121 8.690 8.690 7.836 0.854 18329
2392 1 3 . 1 1 99 99 VAL N N 122 115.350 115.350 116.085 -0.735 18329
2393 1 3 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.723 0.017 18329
2394 1 3 . 1 1 99 99 VAL C C 122 176.500 176.500 177.519 -1.019 18329
2395 1 3 . 1 1 99 99 VAL CA C 122 64.500 64.500 65.176 -0.676 18329
2396 1 3 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.192 0.108 18329
2397 1 3 . 1 1 99 99 VAL H H 122 8.210 8.210 7.604 0.606 18329
2398 1 3 . 1 1 100 100 SER N N 123 115.450 115.450 114.527 0.923 18329
2399 1 3 . 1 1 100 100 SER HA H 123 4.270 4.270 4.000 0.270 18329
2400 1 3 . 1 1 100 100 SER C C 123 174.700 174.700 175.803 -1.103 18329
2401 1 3 . 1 1 100 100 SER CA C 123 62.000 62.000 61.000 1.000 18329
2402 1 3 . 1 1 100 100 SER H H 123 7.520 7.520 8.052 -0.532 18329
2403 1 3 . 1 1 101 101 LYS N N 124 120.310 120.310 120.798 -0.488 18329
2404 1 3 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.140 -0.170 18329
2405 1 3 . 1 1 101 101 LYS C C 124 176.600 176.600 176.524 0.076 18329
2406 1 3 . 1 1 101 101 LYS CA C 124 61.100 61.100 60.103 0.997 18329
2407 1 3 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.140 -1.640 18329
2408 1 3 . 1 1 101 101 LYS H H 124 6.930 6.930 7.204 -0.274 18329
2409 1 3 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.129 0.131 18329
2410 1 3 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.653 -0.453 18329
2411 1 3 . 1 1 102 102 PRO CB C 125 30.600 30.600 30.934 -0.334 18329
2412 1 3 . 1 1 103 103 LEU N N 126 116.020 116.020 114.196 1.824 18329
2413 1 3 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.046 -0.166 18329
2414 1 3 . 1 1 103 103 LEU C C 126 177.900 177.900 179.603 -1.703 18329
2415 1 3 . 1 1 103 103 LEU CA C 126 57.700 57.700 56.495 1.204 18329
2416 1 3 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.334 0.466 18329
2417 1 3 . 1 1 103 103 LEU H H 126 6.520 6.520 7.391 -0.871 18329
2418 1 3 . 1 1 104 104 GLN N N 127 120.500 120.500 120.007 0.493 18329
2419 1 3 . 1 1 104 104 GLN C C 127 180.600 180.600 178.088 2.512 18329
2420 1 3 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.955 -0.655 18329
2421 1 3 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.526 0.474 18329
2422 1 3 . 1 1 104 104 GLN H H 127 8.160 8.160 8.651 -0.491 18329
2423 1 3 . 1 1 105 105 LYS N N 128 120.000 120.000 116.762 3.238 18329
2424 1 3 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.056 -0.006 18329
2425 1 3 . 1 1 105 105 LYS C C 128 177.100 177.100 177.180 -0.080 18329
2426 1 3 . 1 1 105 105 LYS CA C 128 58.500 58.500 57.637 0.863 18329
2427 1 3 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.039 -0.639 18329
2428 1 3 . 1 1 105 105 LYS H H 128 7.810 7.810 7.706 0.104 18329
2429 1 3 . 1 1 106 106 LEU N N 129 118.530 118.530 117.948 0.582 18329
2430 1 3 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.318 -0.348 18329
2431 1 3 . 1 1 106 106 LEU C C 129 175.200 175.200 175.731 -0.531 18329
2432 1 3 . 1 1 106 106 LEU CA C 129 54.500 54.500 53.611 0.888 18329
2433 1 3 . 1 1 106 106 LEU CB C 129 42.400 42.400 42.760 -0.360 18329
2434 1 3 . 1 1 106 106 LEU H H 129 7.220 7.220 7.069 0.151 18329
2435 1 3 . 1 1 107 107 GLY N N 130 101.490 101.490 108.115 -6.625 18329
2436 1 3 . 1 1 107 107 GLY C C 130 174.800 174.800 173.942 0.858 18329
2437 1 3 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.424 0.676 18329
2438 1 3 . 1 1 107 107 GLY H H 130 7.560 7.560 7.563 -0.003 18329
2439 1 3 . 1 1 108 108 ILE N N 131 121.340 121.340 115.154 6.186 18329
2440 1 3 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.581 0.569 18329
2441 1 3 . 1 1 108 108 ILE C C 131 174.300 174.300 175.778 -1.478 18329
2442 1 3 . 1 1 108 108 ILE CA C 131 60.400 60.400 62.598 -2.198 18329
2443 1 3 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.044 -1.845 18329
2444 1 3 . 1 1 108 108 ILE H H 131 7.290 7.290 8.230 -0.940 18329
2445 1 3 . 1 1 109 109 GLN N N 132 125.650 125.650 119.685 5.965 18329
2446 1 3 . 1 1 109 109 GLN HA H 132 4.010 4.010 3.885 0.125 18329
2447 1 3 . 1 1 109 109 GLN C C 132 176.800 176.800 176.120 0.680 18329
2448 1 3 . 1 1 109 109 GLN CA C 132 57.600 57.600 57.608 -0.008 18329
2449 1 3 . 1 1 109 109 GLN CB C 132 29.000 29.000 29.033 -0.033 18329
2450 1 3 . 1 1 109 109 GLN H H 132 8.080 8.080 8.050 0.030 18329
2451 1 3 . 1 1 110 110 GLU N N 133 114.890 114.890 114.824 0.066 18329
2452 1 3 . 1 1 110 110 GLU HA H 133 4.150 4.150 3.850 0.300 18329
2453 1 3 . 1 1 110 110 GLU C C 133 177.100 177.100 177.942 -0.842 18329
2454 1 3 . 1 1 110 110 GLU CA C 133 57.100 57.100 58.166 -1.066 18329
2455 1 3 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.757 -1.457 18329
2456 1 3 . 1 1 110 110 GLU H H 133 9.270 9.270 8.621 0.649 18329
2457 1 3 . 1 1 111 111 MET N N 134 121.210 121.210 117.024 4.186 18329
2458 1 3 . 1 1 111 111 MET HA H 134 4.350 4.350 4.124 0.226 18329
2459 1 3 . 1 1 111 111 MET C C 134 177.500 177.500 178.435 -0.935 18329
2460 1 3 . 1 1 111 111 MET CA C 134 57.900 57.900 58.865 -0.965 18329
2461 1 3 . 1 1 111 111 MET CB C 134 33.300 33.300 31.851 1.449 18329
2462 1 3 . 1 1 111 111 MET H H 134 7.620 7.620 8.212 -0.592 18329
2463 1 3 . 1 1 112 112 THR N N 135 113.170 113.170 109.491 3.679 18329
2464 1 3 . 1 1 112 112 THR HA H 135 3.920 3.920 4.102 -0.182 18329
2465 1 3 . 1 1 112 112 THR C C 135 176.400 176.400 176.755 -0.355 18329
2466 1 3 . 1 1 112 112 THR CA C 135 65.900 65.900 65.018 0.882 18329
2467 1 3 . 1 1 112 112 THR CB C 135 68.200 68.200 68.416 -0.216 18329
2468 1 3 . 1 1 112 112 THR H H 135 8.320 8.320 8.569 -0.249 18329
2469 1 3 . 1 1 113 113 LYS N N 136 123.440 123.440 123.095 0.345 18329
2470 1 3 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.173 -0.243 18329
2471 1 3 . 1 1 113 113 LYS C C 136 177.600 177.600 178.219 -0.619 18329
2472 1 3 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.364 -1.065 18329
2473 1 3 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.112 -0.112 18329
2474 1 3 . 1 1 113 113 LYS H H 136 8.060 8.060 7.622 0.438 18329
2475 1 3 . 1 1 114 114 THR N N 137 114.590 114.590 117.144 -2.554 18329
2476 1 3 . 1 1 114 114 THR HA H 137 4.000 4.000 3.946 0.054 18329
2477 1 3 . 1 1 114 114 THR C C 137 176.800 176.800 176.710 0.090 18329
2478 1 3 . 1 1 114 114 THR CA C 137 67.600 67.600 66.945 0.655 18329
2479 1 3 . 1 1 114 114 THR CB C 137 69.200 69.200 68.799 0.401 18329
2480 1 3 . 1 1 114 114 THR H H 137 7.950 7.950 8.136 -0.186 18329
2481 1 3 . 1 1 115 115 VAL N N 138 119.080 119.080 120.230 -1.150 18329
2482 1 3 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.741 0.079 18329
2483 1 3 . 1 1 115 115 VAL C C 138 176.900 176.900 177.167 -0.267 18329
2484 1 3 . 1 1 115 115 VAL CA C 138 66.800 66.800 65.777 1.023 18329
2485 1 3 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.779 0.721 18329
2486 1 3 . 1 1 115 115 VAL H H 138 7.320 7.320 7.549 -0.229 18329
2487 1 3 . 1 1 116 116 SER N N 139 116.630 116.630 115.958 0.672 18329
2488 1 3 . 1 1 116 116 SER HA H 139 4.680 4.680 4.257 0.423 18329
2489 1 3 . 1 1 116 116 SER C C 139 179.000 179.000 176.450 2.550 18329
2490 1 3 . 1 1 116 116 SER CA C 139 61.400 61.400 61.180 0.220 18329
2491 1 3 . 1 1 116 116 SER CB C 139 62.800 62.800 62.782 0.018 18329
2492 1 3 . 1 1 116 116 SER H H 139 8.990 8.990 7.800 1.190 18329
2493 1 3 . 1 1 117 117 ASP N N 140 124.220 124.220 121.426 2.794 18329
2494 1 3 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.383 -0.023 18329
2495 1 3 . 1 1 117 117 ASP C C 140 179.900 179.900 178.178 1.722 18329
2496 1 3 . 1 1 117 117 ASP CA C 140 57.300 57.300 57.094 0.206 18329
2497 1 3 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.846 -1.347 18329
2498 1 3 . 1 1 117 117 ASP H H 140 9.480 9.480 7.840 1.640 18329
2499 1 3 . 1 1 118 118 ALA N N 141 121.420 121.420 122.598 -1.178 18329
2500 1 3 . 1 1 118 118 ALA HA H 141 4.280 4.280 3.982 0.298 18329
2501 1 3 . 1 1 118 118 ALA C C 141 179.800 179.800 178.943 0.857 18329
2502 1 3 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.995 -0.595 18329
2503 1 3 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.457 0.543 18329
2504 1 3 . 1 1 118 118 ALA H H 141 7.340 7.340 7.470 -0.130 18329
2505 1 3 . 1 1 119 119 ALA N N 142 121.680 121.680 119.527 2.153 18329
2506 1 3 . 1 1 119 119 ALA HA H 142 4.130 4.130 3.939 0.191 18329
2507 1 3 . 1 1 119 119 ALA C C 142 178.800 178.800 178.943 -0.143 18329
2508 1 3 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.245 -1.045 18329
2509 1 3 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.616 -0.316 18329
2510 1 3 . 1 1 119 119 ALA H H 142 7.890 7.890 7.649 0.241 18329
2511 1 3 . 1 1 120 120 GLU N N 143 117.690 117.690 117.367 0.323 18329
2512 1 3 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.298 -0.358 18329
2513 1 3 . 1 1 120 120 GLU C C 143 178.100 178.100 175.488 2.612 18329
2514 1 3 . 1 1 120 120 GLU CA C 143 58.700 58.700 56.946 1.754 18329
2515 1 3 . 1 1 120 120 GLU CB C 143 29.500 29.500 28.389 1.111 18329
2516 1 3 . 1 1 120 120 GLU H H 143 7.500 7.500 7.861 -0.361 18329
2517 1 3 . 1 1 121 121 GLU N N 144 115.680 115.680 120.626 -4.946 18329
2518 1 3 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.337 -0.177 18329
2519 1 3 . 1 1 121 121 GLU C C 144 176.100 176.100 174.973 1.127 18329
2520 1 3 . 1 1 121 121 GLU CA C 144 56.900 56.900 56.937 -0.037 18329
2521 1 3 . 1 1 121 121 GLU CB C 144 31.100 31.100 31.554 -0.454 18329
2522 1 3 . 1 1 121 121 GLU H H 144 6.970 6.970 8.226 -1.256 18329
2523 1 3 . 1 1 122 122 ASN N N 145 117.750 117.750 117.724 0.026 18329
2524 1 3 . 1 1 122 122 ASN HA H 145 4.990 4.990 4.913 0.077 18329
2525 1 3 . 1 1 122 122 ASN C C 145 185.300 185.300 172.292 13.008 18329
2526 1 3 . 1 1 122 122 ASN CA C 145 50.200 50.200 52.154 -1.954 18329
2527 1 3 . 1 1 122 122 ASN CB C 145 41.100 41.100 37.595 3.505 18329
2528 1 3 . 1 1 122 122 ASN H H 145 7.670 7.670 7.753 -0.083 18329
2529 1 3 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.399 0.231 18329
2530 1 3 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.688 -1.688 18329
2531 1 3 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.474 -0.174 18329
2532 1 3 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.253 0.187 18329
2533 1 3 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.218 -0.318 18329
2534 1 3 . 1 1 124 124 PRO CB C 147 28.400 28.400 30.079 -1.679 18329
2535 1 3 . 1 1 125 125 THR N N 148 106.090 106.090 110.672 -4.582 18329
2536 1 3 . 1 1 125 125 THR HA H 148 4.530 4.530 4.044 0.486 18329
2537 1 3 . 1 1 125 125 THR C C 148 174.300 174.300 174.237 0.063 18329
2538 1 3 . 1 1 125 125 THR CA C 148 61.200 61.200 63.517 -2.317 18329
2539 1 3 . 1 1 125 125 THR CB C 148 68.600 68.600 68.537 0.063 18329
2540 1 3 . 1 1 125 125 THR H H 148 7.800 7.800 8.343 -0.543 18329
2541 1 3 . 1 1 126 126 THR N N 149 108.650 108.650 107.960 0.690 18329
2542 1 3 . 1 1 126 126 THR HA H 149 4.170 4.170 4.440 -0.270 18329
2543 1 3 . 1 1 126 126 THR C C 149 173.100 173.100 173.701 -0.601 18329
2544 1 3 . 1 1 126 126 THR CA C 149 58.800 58.800 58.794 0.006 18329
2545 1 3 . 1 1 126 126 THR CB C 149 73.100 73.100 72.122 0.978 18329
2546 1 3 . 1 1 126 126 THR H H 149 7.350 7.350 6.956 0.394 18329
2547 1 3 . 1 1 127 127 ALA N N 150 123.270 123.270 122.468 0.802 18329
2548 1 3 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.300 -0.280 18329
2549 1 3 . 1 1 127 127 ALA CA C 150 55.000 55.000 54.511 0.489 18329
2550 1 3 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.720 -0.020 18329
2551 1 3 . 1 1 127 127 ALA H H 150 7.750 7.750 8.726 -0.976 18329
2552 1 3 . 1 1 128 128 GLN N N 151 114.920 114.920 116.545 -1.625 18329
2553 1 3 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.002 -0.252 18329
2554 1 3 . 1 1 128 128 GLN C C 151 178.400 178.400 178.142 0.258 18329
2555 1 3 . 1 1 128 128 GLN CA C 151 58.800 58.800 57.836 0.964 18329
2556 1 3 . 1 1 128 128 GLN CB C 151 27.200 27.200 27.979 -0.779 18329
2557 1 3 . 1 1 128 128 GLN H H 151 8.300 8.300 8.521 -0.221 18329
2558 1 3 . 1 1 129 129 GLY N N 152 107.280 107.280 107.166 0.114 18329
2559 1 3 . 1 1 129 129 GLY C C 152 174.900 174.900 175.723 -0.823 18329
2560 1 3 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.608 0.592 18329
2561 1 3 . 1 1 129 129 GLY H H 152 7.920 7.920 7.644 0.276 18329
2562 1 3 . 1 1 130 130 VAL N N 153 119.440 119.440 121.162 -1.722 18329
2563 1 3 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.718 -0.248 18329
2564 1 3 . 1 1 130 130 VAL C C 153 177.700 177.700 177.199 0.501 18329
2565 1 3 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.282 2.518 18329
2566 1 3 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.203 0.497 18329
2567 1 3 . 1 1 130 130 VAL H H 153 7.390 7.390 7.125 0.265 18329
2568 1 3 . 1 1 131 131 LEU N N 154 118.990 118.990 119.161 -0.171 18329
2569 1 3 . 1 1 131 131 LEU HA H 154 3.910 3.910 4.022 -0.112 18329
2570 1 3 . 1 1 131 131 LEU C C 154 180.400 180.400 179.073 1.327 18329
2571 1 3 . 1 1 131 131 LEU CA C 154 58.300 58.300 57.792 0.507 18329
2572 1 3 . 1 1 131 131 LEU CB C 154 41.000 41.000 40.499 0.501 18329
2573 1 3 . 1 1 131 131 LEU H H 154 8.640 8.640 7.399 1.241 18329
2574 1 3 . 1 1 132 132 GLU N N 155 120.980 120.980 119.724 1.256 18329
2575 1 3 . 1 1 132 132 GLU HA H 155 4.120 4.120 4.079 0.041 18329
2576 1 3 . 1 1 132 132 GLU C C 155 179.400 179.400 178.950 0.450 18329
2577 1 3 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.428 -0.528 18329
2578 1 3 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.236 -0.036 18329
2579 1 3 . 1 1 132 132 GLU H H 155 8.000 8.000 7.629 0.371 18329
2580 1 3 . 1 1 133 133 ILE N N 156 121.830 121.830 119.388 2.442 18329
2581 1 3 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.848 -0.268 18329
2582 1 3 . 1 1 133 133 ILE C C 156 178.000 178.000 177.769 0.231 18329
2583 1 3 . 1 1 133 133 ILE CA C 156 65.500 65.500 63.608 1.892 18329
2584 1 3 . 1 1 133 133 ILE CB C 156 39.600 39.600 37.925 1.675 18329
2585 1 3 . 1 1 133 133 ILE H H 156 8.040 8.040 7.194 0.846 18329
2586 1 3 . 1 1 134 134 ALA N N 157 121.470 121.470 122.552 -1.082 18329
2587 1 3 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.902 -0.002 18329
2588 1 3 . 1 1 134 134 ALA C C 157 178.800 178.800 179.252 -0.452 18329
2589 1 3 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.640 -0.340 18329
2590 1 3 . 1 1 134 134 ALA CB C 157 18.100 18.100 17.902 0.198 18329
2591 1 3 . 1 1 134 134 ALA H H 157 8.950 8.950 8.529 0.421 18329
2592 1 3 . 1 1 135 135 LYS N N 158 118.470 118.470 118.210 0.260 18329
2593 1 3 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.891 0.019 18329
2594 1 3 . 1 1 135 135 LYS C C 158 179.300 179.300 178.795 0.505 18329
2595 1 3 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.933 -0.433 18329
2596 1 3 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.326 -0.926 18329
2597 1 3 . 1 1 135 135 LYS H H 158 8.000 8.000 7.966 0.034 18329
2598 1 3 . 1 1 136 136 LYS N N 159 118.000 118.000 118.436 -0.436 18329
2599 1 3 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.080 -0.030 18329
2600 1 3 . 1 1 136 136 LYS C C 159 180.200 180.200 179.588 0.612 18329
2601 1 3 . 1 1 136 136 LYS CA C 159 59.500 59.500 58.839 0.661 18329
2602 1 3 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.007 -1.107 18329
2603 1 3 . 1 1 136 136 LYS H H 159 7.530 7.530 7.444 0.086 18329
2604 1 3 . 1 1 137 137 MET N N 160 120.990 120.990 119.416 1.574 18329
2605 1 3 . 1 1 137 137 MET HA H 160 3.800 3.800 4.203 -0.403 18329
2606 1 3 . 1 1 137 137 MET C C 160 177.400 177.400 178.628 -1.228 18329
2607 1 3 . 1 1 137 137 MET CA C 160 60.600 60.600 59.459 1.141 18329
2608 1 3 . 1 1 137 137 MET CB C 160 31.800 31.800 32.654 -0.854 18329
2609 1 3 . 1 1 137 137 MET H H 160 8.660 8.660 8.214 0.446 18329
2610 1 3 . 1 1 138 138 ARG N N 161 119.480 119.480 119.598 -0.118 18329
2611 1 3 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.873 -0.073 18329
2612 1 3 . 1 1 138 138 ARG C C 161 177.900 177.900 178.324 -0.424 18329
2613 1 3 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.940 0.660 18329
2614 1 3 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.350 -0.550 18329
2615 1 3 . 1 1 138 138 ARG H H 161 9.280 9.280 8.768 0.512 18329
2616 1 3 . 1 1 139 139 GLU N N 162 118.700 118.700 119.884 -1.184 18329
2617 1 3 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.047 -0.047 18329
2618 1 3 . 1 1 139 139 GLU C C 162 179.100 179.100 178.758 0.342 18329
2619 1 3 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.388 0.412 18329
2620 1 3 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.275 0.225 18329
2621 1 3 . 1 1 139 139 GLU H H 162 8.430 8.430 8.404 0.026 18329
2622 1 3 . 1 1 140 140 LYS N N 163 119.310 119.310 119.401 -0.091 18329
2623 1 3 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.087 0.123 18329
2624 1 3 . 1 1 140 140 LYS C C 163 177.900 177.900 179.281 -1.381 18329
2625 1 3 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.672 0.228 18329
2626 1 3 . 1 1 140 140 LYS CB C 163 31.100 31.100 31.975 -0.875 18329
2627 1 3 . 1 1 140 140 LYS H H 163 7.440 7.440 7.667 -0.227 18329
2628 1 3 . 1 1 141 141 LEU N N 164 117.630 117.630 119.168 -1.538 18329
2629 1 3 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.005 -0.115 18329
2630 1 3 . 1 1 141 141 LEU C C 164 178.700 178.700 179.301 -0.601 18329
2631 1 3 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.808 0.192 18329
2632 1 3 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.902 -0.402 18329
2633 1 3 . 1 1 141 141 LEU H H 164 8.180 8.180 7.598 0.582 18329
2634 1 3 . 1 1 142 142 GLN N N 165 117.710 117.710 117.814 -0.104 18329
2635 1 3 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.996 0.314 18329
2636 1 3 . 1 1 142 142 GLN C C 165 179.200 179.200 178.529 0.671 18329
2637 1 3 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.153 -0.653 18329
2638 1 3 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.620 -1.120 18329
2639 1 3 . 1 1 142 142 GLN H H 165 8.730 8.730 8.331 0.399 18329
2640 1 3 . 1 1 143 143 ARG N N 166 121.410 121.410 121.138 0.272 18329
2641 1 3 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.073 0.117 18329
2642 1 3 . 1 1 143 143 ARG C C 166 179.700 179.700 178.477 1.223 18329
2643 1 3 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.982 -0.182 18329
2644 1 3 . 1 1 143 143 ARG CB C 166 30.200 30.200 30.312 -0.112 18329
2645 1 3 . 1 1 143 143 ARG H H 166 8.050 8.050 8.285 -0.235 18329
2646 1 3 . 1 1 144 144 VAL N N 167 120.950 120.950 118.886 2.064 18329
2647 1 3 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.789 -0.029 18329
2648 1 3 . 1 1 144 144 VAL C C 167 179.200 179.200 177.237 1.963 18329
2649 1 3 . 1 1 144 144 VAL CA C 167 66.400 66.400 65.567 0.833 18329
2650 1 3 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.889 0.211 18329
2651 1 3 . 1 1 144 144 VAL H H 167 8.190 8.190 7.691 0.499 18329
2652 1 3 . 1 1 145 145 HIS N N 168 123.520 123.520 119.393 4.127 18329
2653 1 3 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.482 -0.583 18329
2654 1 3 . 1 1 145 145 HIS C C 168 177.100 177.100 177.459 -0.359 18329
2655 1 3 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.529 1.772 18329
2656 1 3 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.104 -0.204 18329
2657 1 3 . 1 1 145 145 HIS H H 168 9.240 9.240 7.957 1.283 18329
2658 1 3 . 1 1 146 146 THR N N 169 115.020 115.020 116.266 -1.246 18329
2659 1 3 . 1 1 146 146 THR HA H 169 3.860 3.860 4.202 -0.342 18329
2660 1 3 . 1 1 146 146 THR C C 169 175.700 175.700 176.447 -0.747 18329
2661 1 3 . 1 1 146 146 THR CA C 169 67.200 67.200 67.033 0.167 18329
2662 1 3 . 1 1 146 146 THR CB C 169 69.300 69.300 68.694 0.606 18329
2663 1 3 . 1 1 146 146 THR H H 169 8.750 8.750 8.606 0.144 18329
2664 1 3 . 1 1 147 147 LYS N N 170 120.300 120.300 121.561 -1.261 18329
2665 1 3 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.919 0.081 18329
2666 1 3 . 1 1 147 147 LYS C C 170 179.300 179.300 178.519 0.781 18329
2667 1 3 . 1 1 147 147 LYS CA C 170 59.100 59.100 60.243 -1.143 18329
2668 1 3 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.287 -0.487 18329
2669 1 3 . 1 1 147 147 LYS H H 170 8.020 8.020 7.986 0.034 18329
2670 1 3 . 1 1 148 148 ASN N N 171 117.600 117.600 117.569 0.031 18329
2671 1 3 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.482 -0.162 18329
2672 1 3 . 1 1 148 148 ASN C C 171 175.400 175.400 178.042 -2.642 18329
2673 1 3 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.915 1.785 18329
2674 1 3 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.425 1.275 18329
2675 1 3 . 1 1 148 148 ASN H H 171 7.810 7.810 7.663 0.147 18329
2676 1 3 . 1 1 149 149 TYR N N 172 121.560 121.560 121.735 -0.175 18329
2677 1 3 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.275 -0.385 18329
2678 1 3 . 1 1 149 149 TYR C C 172 176.900 176.900 177.377 -0.477 18329
2679 1 3 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.722 -0.222 18329
2680 1 3 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.546 0.374 18329
2681 1 3 . 1 1 149 149 TYR H H 172 9.020 9.020 8.254 0.766 18329
2682 1 3 . 1 1 150 150 CYS N N 173 116.050 116.050 118.379 -2.329 18329
2683 1 3 . 1 1 150 150 CYS C C 173 177.100 177.100 176.640 0.460 18329
2684 1 3 . 1 1 150 150 CYS CA C 173 58.400 58.400 60.491 -2.091 18329
2685 1 3 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.278 12.322 18329
2686 1 3 . 1 1 150 150 CYS H H 173 8.810 8.810 8.329 0.482 18329
2687 1 3 . 1 1 151 151 THR N N 174 117.190 117.190 115.719 1.471 18329
2688 1 3 . 1 1 151 151 THR HA H 174 3.880 3.880 4.074 -0.194 18329
2689 1 3 . 1 1 151 151 THR C C 174 176.000 176.000 175.882 0.118 18329
2690 1 3 . 1 1 151 151 THR CA C 174 66.900 66.900 65.686 1.214 18329
2691 1 3 . 1 1 151 151 THR CB C 174 68.500 68.500 68.307 0.193 18329
2692 1 3 . 1 1 151 151 THR H H 174 7.720 7.720 7.667 0.053 18329
2693 1 3 . 1 1 152 152 LEU N N 175 123.110 123.110 121.505 1.605 18329
2694 1 3 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.097 -0.287 18329
2695 1 3 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.140 0.860 18329
2696 1 3 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.830 -0.330 18329
2697 1 3 . 1 1 152 152 LEU H H 175 7.870 7.870 7.422 0.448 18329
2698 1 3 . 1 1 153 153 LYS N N 176 117.270 117.270 118.999 -1.729 18329
2699 1 3 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.976 -0.276 18329
2700 1 3 . 1 1 153 153 LYS C C 176 179.100 179.100 178.092 1.008 18329
2701 1 3 . 1 1 153 153 LYS CA C 176 56.700 56.700 58.579 -1.879 18329
2702 1 3 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.772 -1.872 18329
2703 1 3 . 1 1 153 153 LYS H H 176 7.900 7.900 7.398 0.502 18329
2704 1 3 . 1 1 154 154 LYS N N 177 119.290 119.290 120.053 -0.763 18329
2705 1 3 . 1 1 154 154 LYS HA H 177 4.260 4.260 3.993 0.267 18329
2706 1 3 . 1 1 154 154 LYS C C 177 178.100 178.100 177.999 0.101 18329
2707 1 3 . 1 1 154 154 LYS CA C 177 57.800 57.800 58.929 -1.129 18329
2708 1 3 . 1 1 154 154 LYS CB C 177 31.800 31.800 31.185 0.615 18329
2709 1 3 . 1 1 154 154 LYS H H 177 7.540 7.540 8.172 -0.632 18329
2710 1 3 . 1 1 155 155 LYS N N 178 118.910 118.910 119.233 -0.323 18329
2711 1 3 . 1 1 155 155 LYS HA H 178 4.050 4.050 3.945 0.105 18329
2712 1 3 . 1 1 155 155 LYS C C 178 178.100 178.100 178.363 -0.263 18329
2713 1 3 . 1 1 155 155 LYS CA C 178 58.000 58.000 59.212 -1.212 18329
2714 1 3 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.092 0.108 18329
2715 1 3 . 1 1 155 155 LYS H H 178 7.630 7.630 7.507 0.123 18329
2716 1 3 . 1 1 156 156 GLU N N 179 117.950 117.950 118.618 -0.668 18329
2717 1 3 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.046 0.064 18329
2718 1 3 . 1 1 156 156 GLU C C 179 176.700 176.700 177.965 -1.265 18329
2719 1 3 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.886 -1.386 18329
2720 1 3 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.814 -0.214 18329
2721 1 3 . 1 1 156 156 GLU H H 179 7.560 7.560 8.353 -0.793 18329
2722 1 3 . 1 1 157 157 ASN N N 180 116.590 116.590 117.646 -1.056 18329
2723 1 3 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.946 -0.226 18329
2724 1 3 . 1 1 157 157 ASN C C 180 175.000 175.000 175.278 -0.278 18329
2725 1 3 . 1 1 157 157 ASN CA C 180 52.700 52.700 52.311 0.389 18329
2726 1 3 . 1 1 157 157 ASN CB C 180 38.800 38.800 38.030 0.770 18329
2727 1 3 . 1 1 157 157 ASN H H 180 7.820 7.820 7.982 -0.162 18329
2728 1 3 . 1 1 158 158 SER HA H 181 4.450 4.450 4.378 0.072 18329
2729 1 3 . 1 1 158 158 SER CA C 181 60.400 60.400 60.693 -0.293 18329
2730 1 3 . 1 1 158 158 SER CB C 181 63.500 63.500 63.105 0.395 18329
2731 1 3 . 1 1 158 158 SER H H 181 8.030 8.030 7.884 0.146 18329
2732 1 3 . 1 1 159 159 THR N N 182 112.800 112.800 117.361 -4.561 18329
2733 1 3 . 1 1 159 159 THR HA H 182 4.380 4.380 4.127 0.253 18329
2734 1 3 . 1 1 159 159 THR C C 182 174.300 174.300 174.737 -0.437 18329
2735 1 3 . 1 1 159 159 THR CA C 182 61.800 61.800 64.588 -2.788 18329
2736 1 3 . 1 1 159 159 THR CB C 182 69.100 69.100 69.000 0.100 18329
2737 1 3 . 1 1 159 159 THR H H 182 8.070 8.070 8.013 0.057 18329
2738 1 3 . 1 1 160 160 PHE N N 183 123.120 123.120 122.470 0.650 18329
2739 1 3 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.614 -0.174 18329
2740 1 3 . 1 1 160 160 PHE C C 183 175.100 175.100 174.267 0.833 18329
2741 1 3 . 1 1 160 160 PHE CA C 183 58.900 58.900 56.956 1.944 18329
2742 1 3 . 1 1 160 160 PHE CB C 183 40.000 40.000 40.554 -0.554 18329
2743 1 3 . 1 1 160 160 PHE H H 183 7.900 7.900 7.599 0.301 18329
2744 1 3 . 1 1 161 161 THR N N 184 119.330 119.330 123.646 -4.316 18329
2745 1 3 . 1 1 161 161 THR HA H 184 4.190 4.190 4.198 -0.008 18329
2746 1 3 . 1 1 161 161 THR CA C 184 60.700 60.700 63.530 -2.830 18329
2747 1 3 . 1 1 161 161 THR CB C 184 70.700 70.700 69.000 1.700 18329
2748 1 3 . 1 1 161 161 THR H H 184 7.810 7.810 8.127 -0.317 18329
2749 1 3 . 1 1 162 162 ASP N N 185 123.190 123.190 126.067 -2.877 18329
2750 1 3 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.345 0.065 18329
2751 1 3 . 1 1 162 162 ASP C C 185 176.900 176.900 174.616 2.284 18329
2752 1 3 . 1 1 162 162 ASP CA C 185 53.900 53.900 55.436 -1.536 18329
2753 1 3 . 1 1 162 162 ASP CB C 185 44.000 44.000 41.461 2.539 18329
2754 1 3 . 1 1 162 162 ASP H H 185 8.000 8.000 8.659 -0.659 18329
2755 1 3 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.486 -0.006 18329
2756 1 3 . 1 1 163 163 GLU CA C 186 58.800 58.800 55.438 3.362 18329
2757 1 3 . 1 1 163 163 GLU CB C 186 28.100 28.100 31.292 -3.192 18329
2758 1 3 . 1 1 166 166 LYS N N 189 118.150 118.150 119.348 -1.198 18329
2759 1 3 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.005 0.215 18329
2760 1 3 . 1 1 166 166 LYS C C 189 177.500 177.500 175.815 1.685 18329
2761 1 3 . 1 1 166 166 LYS CA C 189 58.000 58.000 56.614 1.386 18329
2762 1 3 . 1 1 166 166 LYS CB C 189 32.600 32.600 32.604 -0.004 18329
2763 1 3 . 1 1 166 166 LYS H H 189 8.890 8.890 7.759 1.131 18329
2764 1 3 . 1 1 167 167 ASN N N 190 116.210 116.210 119.883 -3.673 18329
2765 1 3 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.486 0.474 18329
2766 1 3 . 1 1 167 167 ASN C C 190 174.900 174.900 175.039 -0.139 18329
2767 1 3 . 1 1 167 167 ASN CA C 190 52.900 52.900 55.147 -2.247 18329
2768 1 3 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.393 0.007 18329
2769 1 3 . 1 1 167 167 ASN H H 190 8.030 8.030 8.776 -0.746 18329
2770 1 4 . 1 1 2 2 ALA N N 25 125.000 125.000 128.715 -3.715 18329
2771 1 4 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.468 -0.098 18329
2772 1 4 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.705 -0.404 18329
2773 1 4 . 1 1 2 2 ALA CB C 25 19.700 19.700 19.634 0.066 18329
2774 1 4 . 1 1 2 2 ALA H H 25 8.690 8.690 8.417 0.273 18329
2775 1 4 . 1 1 3 3 GLY N N 26 106.920 106.920 110.069 -3.149 18329
2776 1 4 . 1 1 3 3 GLY CA C 26 44.000 44.000 46.276 -2.276 18329
2777 1 4 . 1 1 3 3 GLY H H 26 7.940 7.940 8.660 -0.720 18329
2778 1 4 . 1 1 4 4 LEU N N 27 119.140 119.140 122.053 -2.913 18329
2779 1 4 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.012 0.398 18329
2780 1 4 . 1 1 4 4 LEU C C 27 177.100 177.100 175.243 1.857 18329
2781 1 4 . 1 1 4 4 LEU CA C 27 54.400 54.400 56.091 -1.691 18329
2782 1 4 . 1 1 4 4 LEU CB C 27 42.100 42.100 41.106 0.994 18329
2783 1 4 . 1 1 4 4 LEU H H 27 8.210 8.210 8.259 -0.049 18329
2784 1 4 . 1 1 5 5 THR N N 28 112.940 112.940 119.252 -6.312 18329
2785 1 4 . 1 1 5 5 THR HA H 28 4.650 4.650 4.431 0.219 18329
2786 1 4 . 1 1 5 5 THR C C 28 175.500 175.500 173.581 1.919 18329
2787 1 4 . 1 1 5 5 THR CA C 28 60.100 60.100 61.658 -1.558 18329
2788 1 4 . 1 1 5 5 THR CB C 28 72.600 72.600 69.683 2.917 18329
2789 1 4 . 1 1 5 5 THR H H 28 9.220 9.220 8.063 1.157 18329
2790 1 4 . 1 1 6 6 GLY N N 29 108.230 108.230 110.544 -2.314 18329
2791 1 4 . 1 1 6 6 GLY C C 29 174.800 174.800 174.752 0.048 18329
2792 1 4 . 1 1 6 6 GLY CA C 29 46.000 46.000 45.133 0.867 18329
2793 1 4 . 1 1 6 6 GLY H H 29 8.520 8.520 8.463 0.057 18329
2794 1 4 . 1 1 7 7 ALA HA H 30 4.040 4.040 3.848 0.192 18329
2795 1 4 . 1 1 7 7 ALA CA C 30 54.800 54.800 54.022 0.778 18329
2796 1 4 . 1 1 7 7 ALA CB C 30 18.200 18.200 17.182 1.018 18329
2797 1 4 . 1 1 8 8 THR N N 31 116.970 116.970 113.816 3.154 18329
2798 1 4 . 1 1 8 8 THR HA H 31 3.740 3.740 3.896 -0.156 18329
2799 1 4 . 1 1 8 8 THR C C 31 175.300 175.300 175.909 -0.609 18329
2800 1 4 . 1 1 8 8 THR CA C 31 67.000 67.000 66.223 0.777 18329
2801 1 4 . 1 1 8 8 THR CB C 31 68.700 68.700 68.777 -0.077 18329
2802 1 4 . 1 1 8 8 THR H H 31 8.110 8.110 8.034 0.076 18329
2803 1 4 . 1 1 9 9 LYS N N 32 120.540 120.540 121.822 -1.282 18329
2804 1 4 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.104 -0.514 18329
2805 1 4 . 1 1 9 9 LYS C C 32 176.900 176.900 178.904 -2.004 18329
2806 1 4 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.423 0.377 18329
2807 1 4 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.865 0.535 18329
2808 1 4 . 1 1 9 9 LYS H H 32 6.860 6.860 8.356 -1.496 18329
2809 1 4 . 1 1 10 10 ILE N N 33 115.940 115.940 118.248 -2.308 18329
2810 1 4 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.753 -0.043 18329
2811 1 4 . 1 1 10 10 ILE C C 33 179.000 179.000 178.166 0.834 18329
2812 1 4 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.116 -0.116 18329
2813 1 4 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.430 0.570 18329
2814 1 4 . 1 1 10 10 ILE H H 33 7.380 7.380 7.967 -0.587 18329
2815 1 4 . 1 1 11 11 ARG N N 34 118.350 118.350 121.049 -2.699 18329
2816 1 4 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.095 -0.055 18329
2817 1 4 . 1 1 11 11 ARG C C 34 180.000 180.000 178.665 1.335 18329
2818 1 4 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.817 -0.417 18329
2819 1 4 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.180 0.120 18329
2820 1 4 . 1 1 11 11 ARG H H 34 8.250 8.250 7.625 0.625 18329
2821 1 4 . 1 1 12 12 LEU N N 35 117.420 117.420 119.708 -2.288 18329
2822 1 4 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.282 -0.112 18329
2823 1 4 . 1 1 12 12 LEU C C 35 179.000 179.000 179.708 -0.708 18329
2824 1 4 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.684 0.316 18329
2825 1 4 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.844 -1.044 18329
2826 1 4 . 1 1 12 12 LEU H H 35 8.340 8.340 8.257 0.083 18329
2827 1 4 . 1 1 13 13 GLU N N 36 117.890 117.890 119.539 -1.649 18329
2828 1 4 . 1 1 13 13 GLU HA H 36 4.020 4.020 4.085 -0.065 18329
2829 1 4 . 1 1 13 13 GLU C C 36 180.100 180.100 179.447 0.653 18329
2830 1 4 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.600 0.600 18329
2831 1 4 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.107 -0.807 18329
2832 1 4 . 1 1 13 13 GLU H H 36 8.610 8.610 7.907 0.703 18329
2833 1 4 . 1 1 14 14 ARG N N 37 121.100 121.100 118.544 2.556 18329
2834 1 4 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.107 0.133 18329
2835 1 4 . 1 1 14 14 ARG C C 37 178.100 178.100 178.984 -0.884 18329
2836 1 4 . 1 1 14 14 ARG CA C 37 58.500 58.500 58.580 -0.079 18329
2837 1 4 . 1 1 14 14 ARG CB C 37 30.200 30.200 29.915 0.285 18329
2838 1 4 . 1 1 14 14 ARG H H 37 7.980 7.980 8.070 -0.090 18329
2839 1 4 . 1 1 15 15 SER N N 38 115.420 115.420 115.072 0.348 18329
2840 1 4 . 1 1 15 15 SER HA H 38 4.380 4.380 4.515 -0.135 18329
2841 1 4 . 1 1 15 15 SER C C 38 177.300 177.300 176.207 1.093 18329
2842 1 4 . 1 1 15 15 SER CA C 38 62.200 62.200 60.999 1.201 18329
2843 1 4 . 1 1 15 15 SER CB C 38 63.200 63.200 62.709 0.491 18329
2844 1 4 . 1 1 15 15 SER H H 38 8.230 8.230 8.325 -0.095 18329
2845 1 4 . 1 1 16 16 ALA N N 39 123.970 123.970 124.654 -0.684 18329
2846 1 4 . 1 1 16 16 ALA HA H 39 3.630 3.630 3.968 -0.338 18329
2847 1 4 . 1 1 16 16 ALA C C 39 179.500 179.500 179.929 -0.429 18329
2848 1 4 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.375 0.325 18329
2849 1 4 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.345 -0.345 18329
2850 1 4 . 1 1 16 16 ALA H H 39 8.280 8.280 8.169 0.111 18329
2851 1 4 . 1 1 17 17 LYS N N 40 121.690 121.690 119.582 2.108 18329
2852 1 4 . 1 1 17 17 LYS HA H 40 4.090 4.090 4.033 0.057 18329
2853 1 4 . 1 1 17 17 LYS C C 40 178.000 178.000 177.974 0.026 18329
2854 1 4 . 1 1 17 17 LYS CA C 40 58.400 58.400 58.919 -0.519 18329
2855 1 4 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.154 -0.354 18329
2856 1 4 . 1 1 17 17 LYS H H 40 7.930 7.930 8.302 -0.372 18329
2857 1 4 . 1 1 18 18 ASP N N 41 118.730 118.730 118.942 -0.212 18329
2858 1 4 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.485 -0.125 18329
2859 1 4 . 1 1 18 18 ASP C C 41 179.900 179.900 178.408 1.492 18329
2860 1 4 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.780 0.920 18329
2861 1 4 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.445 -0.845 18329
2862 1 4 . 1 1 18 18 ASP H H 41 8.320 8.320 7.639 0.681 18329
2863 1 4 . 1 1 19 19 ILE N N 42 118.180 118.180 119.834 -1.654 18329
2864 1 4 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.711 -0.021 18329
2865 1 4 . 1 1 19 19 ILE C C 42 177.400 177.400 177.824 -0.424 18329
2866 1 4 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.398 -0.198 18329
2867 1 4 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.786 0.114 18329
2868 1 4 . 1 1 19 19 ILE H H 42 7.420 7.420 7.612 -0.192 18329
2869 1 4 . 1 1 20 20 THR N N 43 113.360 113.360 112.398 0.962 18329
2870 1 4 . 1 1 20 20 THR HA H 43 3.770 3.770 4.037 -0.267 18329
2871 1 4 . 1 1 20 20 THR C C 43 177.800 177.800 176.279 1.521 18329
2872 1 4 . 1 1 20 20 THR CA C 43 66.400 66.400 65.910 0.490 18329
2873 1 4 . 1 1 20 20 THR CB C 43 67.400 67.400 68.368 -0.968 18329
2874 1 4 . 1 1 20 20 THR H H 43 7.610 7.610 7.607 0.003 18329
2875 1 4 . 1 1 21 21 ASP N N 44 123.650 123.650 122.316 1.334 18329
2876 1 4 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.330 0.080 18329
2877 1 4 . 1 1 21 21 ASP C C 44 179.200 179.200 178.220 0.980 18329
2878 1 4 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.652 -0.452 18329
2879 1 4 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.910 -1.310 18329
2880 1 4 . 1 1 21 21 ASP H H 44 9.260 9.260 7.942 1.318 18329
2881 1 4 . 1 1 22 22 GLU N N 45 123.560 123.560 119.676 3.884 18329
2882 1 4 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.152 0.218 18329
2883 1 4 . 1 1 22 22 GLU C C 45 178.500 178.500 179.092 -0.592 18329
2884 1 4 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.940 -0.740 18329
2885 1 4 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.642 -0.442 18329
2886 1 4 . 1 1 22 22 GLU H H 45 7.750 7.750 7.906 -0.156 18329
2887 1 4 . 1 1 23 23 ILE N N 46 119.940 119.940 114.602 5.338 18329
2888 1 4 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.871 -0.251 18329
2889 1 4 . 1 1 23 23 ILE C C 46 177.600 177.600 177.997 -0.397 18329
2890 1 4 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.087 1.513 18329
2891 1 4 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.602 -0.603 18329
2892 1 4 . 1 1 23 23 ILE H H 46 8.360 8.360 7.352 1.008 18329
2893 1 4 . 1 1 24 24 ASP N N 47 120.730 120.730 122.097 -1.367 18329
2894 1 4 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.361 0.039 18329
2895 1 4 . 1 1 24 24 ASP C C 47 178.900 178.900 177.643 1.257 18329
2896 1 4 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.008 0.492 18329
2897 1 4 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.493 -0.593 18329
2898 1 4 . 1 1 24 24 ASP H H 47 8.280 8.280 8.404 -0.124 18329
2899 1 4 . 1 1 25 25 ALA N N 48 123.870 123.870 120.853 3.017 18329
2900 1 4 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.009 0.111 18329
2901 1 4 . 1 1 25 25 ALA C C 48 180.400 180.400 179.490 0.910 18329
2902 1 4 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.790 0.710 18329
2903 1 4 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.493 -0.693 18329
2904 1 4 . 1 1 25 25 ALA H H 48 7.880 7.880 7.442 0.438 18329
2905 1 4 . 1 1 26 26 ILE N N 49 121.970 121.970 118.084 3.886 18329
2906 1 4 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.661 0.069 18329
2907 1 4 . 1 1 26 26 ILE C C 49 178.400 178.400 177.881 0.519 18329
2908 1 4 . 1 1 26 26 ILE CA C 49 65.900 65.900 65.101 0.799 18329
2909 1 4 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.715 -0.215 18329
2910 1 4 . 1 1 26 26 ILE H H 49 8.710 8.710 7.621 1.089 18329
2911 1 4 . 1 1 27 27 LYS N N 50 119.820 119.820 120.069 -0.249 18329
2912 1 4 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.562 0.318 18329
2913 1 4 . 1 1 27 27 LYS C C 50 179.900 179.900 179.082 0.818 18329
2914 1 4 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.722 0.678 18329
2915 1 4 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.836 0.064 18329
2916 1 4 . 1 1 27 27 LYS H H 50 8.540 8.540 7.869 0.671 18329
2917 1 4 . 1 1 28 28 LYS N N 51 121.960 121.960 118.096 3.864 18329
2918 1 4 . 1 1 28 28 LYS HA H 51 4.090 4.090 4.024 0.066 18329
2919 1 4 . 1 1 28 28 LYS C C 51 179.200 179.200 179.043 0.157 18329
2920 1 4 . 1 1 28 28 LYS CA C 51 59.300 59.300 58.539 0.761 18329
2921 1 4 . 1 1 28 28 LYS CB C 51 31.400 31.400 31.852 -0.452 18329
2922 1 4 . 1 1 28 28 LYS H H 51 8.070 8.070 7.373 0.697 18329
2923 1 4 . 1 1 29 29 ASP N N 52 121.710 121.710 119.600 2.110 18329
2924 1 4 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.421 0.049 18329
2925 1 4 . 1 1 29 29 ASP C C 52 178.500 178.500 178.196 0.304 18329
2926 1 4 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.986 0.014 18329
2927 1 4 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.935 0.065 18329
2928 1 4 . 1 1 29 29 ASP H H 52 8.340 8.340 7.870 0.470 18329
2929 1 4 . 1 1 30 30 ALA N N 53 121.990 121.990 121.198 0.792 18329
2930 1 4 . 1 1 30 30 ALA HA H 53 3.340 3.340 3.698 -0.358 18329
2931 1 4 . 1 1 30 30 ALA C C 53 179.500 179.500 179.120 0.380 18329
2932 1 4 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.843 0.257 18329
2933 1 4 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.152 -0.052 18329
2934 1 4 . 1 1 30 30 ALA H H 53 8.800 8.800 8.335 0.465 18329
2935 1 4 . 1 1 31 31 ALA N N 54 119.970 119.970 120.076 -0.106 18329
2936 1 4 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.068 0.082 18329
2937 1 4 . 1 1 31 31 ALA C C 54 181.600 181.600 179.174 2.426 18329
2938 1 4 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.342 0.358 18329
2939 1 4 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.040 -0.240 18329
2940 1 4 . 1 1 31 31 ALA H H 54 7.730 7.730 7.456 0.274 18329
2941 1 4 . 1 1 32 32 LEU N N 55 119.660 119.660 117.615 2.045 18329
2942 1 4 . 1 1 32 32 LEU HA H 55 4.140 4.140 3.961 0.179 18329
2943 1 4 . 1 1 32 32 LEU C C 55 179.100 179.100 178.590 0.510 18329
2944 1 4 . 1 1 32 32 LEU CA C 55 57.000 57.000 57.024 -0.024 18329
2945 1 4 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.760 0.140 18329
2946 1 4 . 1 1 32 32 LEU H H 55 7.660 7.660 7.440 0.220 18329
2947 1 4 . 1 1 33 33 LYS N N 56 117.160 117.160 117.350 -0.190 18329
2948 1 4 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.289 -0.079 18329
2949 1 4 . 1 1 33 33 LYS C C 56 176.600 176.600 177.158 -0.558 18329
2950 1 4 . 1 1 33 33 LYS CA C 56 56.100 56.100 56.229 -0.129 18329
2951 1 4 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.308 -0.108 18329
2952 1 4 . 1 1 33 33 LYS H H 56 7.610 7.610 7.502 0.108 18329
2953 1 4 . 1 1 34 34 GLY N N 57 108.680 108.680 108.027 0.653 18329
2954 1 4 . 1 1 34 34 GLY C C 57 174.400 174.400 174.630 -0.230 18329
2955 1 4 . 1 1 34 34 GLY CA C 57 46.200 46.200 44.828 1.372 18329
2956 1 4 . 1 1 34 34 GLY H H 57 7.710 7.710 8.444 -0.734 18329
2957 1 4 . 1 1 35 35 VAL N N 58 121.000 121.000 121.607 -0.607 18329
2958 1 4 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.010 -0.110 18329
2959 1 4 . 1 1 35 35 VAL C C 58 174.200 174.200 175.498 -1.298 18329
2960 1 4 . 1 1 35 35 VAL CA C 58 61.500 61.500 60.739 0.761 18329
2961 1 4 . 1 1 35 35 VAL CB C 58 32.800 32.800 29.045 3.755 18329
2962 1 4 . 1 1 35 35 VAL H H 58 7.990 7.990 7.917 0.073 18329
2963 1 4 . 1 1 36 36 ASN N N 59 124.960 124.960 119.476 5.484 18329
2964 1 4 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.364 0.306 18329
2965 1 4 . 1 1 36 36 ASN C C 59 175.700 175.700 173.827 1.873 18329
2966 1 4 . 1 1 36 36 ASN CA C 59 51.600 51.600 55.103 -3.503 18329
2967 1 4 . 1 1 36 36 ASN CB C 59 39.100 39.100 38.436 0.664 18329
2968 1 4 . 1 1 36 36 ASN H H 59 8.460 8.460 7.894 0.566 18329
2969 1 4 . 1 1 37 37 PHE N N 60 124.460 124.460 116.323 8.137 18329
2970 1 4 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.465 -0.325 18329
2971 1 4 . 1 1 37 37 PHE C C 60 177.000 177.000 174.080 2.920 18329
2972 1 4 . 1 1 37 37 PHE CA C 60 60.400 60.400 59.220 1.180 18329
2973 1 4 . 1 1 37 37 PHE CB C 60 39.200 39.200 39.924 -0.724 18329
2974 1 4 . 1 1 37 37 PHE H H 60 8.780 8.780 8.289 0.491 18329
2975 1 4 . 1 1 38 38 ASP N N 61 119.270 119.270 121.126 -1.856 18329
2976 1 4 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.684 -0.194 18329
2977 1 4 . 1 1 38 38 ASP C C 61 177.000 177.000 176.107 0.893 18329
2978 1 4 . 1 1 38 38 ASP CA C 61 55.500 55.500 54.672 0.828 18329
2979 1 4 . 1 1 38 38 ASP CB C 61 40.000 40.000 41.075 -1.075 18329
2980 1 4 . 1 1 38 38 ASP H H 61 8.400 8.400 8.443 -0.043 18329
2981 1 4 . 1 1 39 39 ALA N N 62 122.020 122.020 123.075 -1.055 18329
2982 1 4 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.242 -0.042 18329
2983 1 4 . 1 1 39 39 ALA C C 62 178.300 178.300 176.364 1.936 18329
2984 1 4 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.209 0.692 18329
2985 1 4 . 1 1 39 39 ALA CB C 62 18.500 18.500 16.899 1.601 18329
2986 1 4 . 1 1 39 39 ALA H H 62 7.740 7.740 7.748 -0.008 18329
2987 1 4 . 1 1 40 40 PHE N N 63 116.940 116.940 120.560 -3.620 18329
2988 1 4 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.492 -0.112 18329
2989 1 4 . 1 1 40 40 PHE C C 63 176.100 176.100 176.087 0.013 18329
2990 1 4 . 1 1 40 40 PHE CA C 63 58.300 58.300 57.853 0.447 18329
2991 1 4 . 1 1 40 40 PHE CB C 63 38.800 38.800 39.483 -0.683 18329
2992 1 4 . 1 1 40 40 PHE H H 63 7.730 7.730 8.542 -0.812 18329
2993 1 4 . 1 1 41 41 LYS N N 64 119.840 119.840 124.729 -4.889 18329
2994 1 4 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.320 -0.100 18329
2995 1 4 . 1 1 41 41 LYS C C 64 176.100 176.100 176.465 -0.365 18329
2996 1 4 . 1 1 41 41 LYS CA C 64 56.600 56.600 56.123 0.477 18329
2997 1 4 . 1 1 41 41 LYS CB C 64 32.900 32.900 32.782 0.118 18329
2998 1 4 . 1 1 41 41 LYS H H 64 7.650 7.650 8.737 -1.087 18329
2999 1 4 . 1 1 42 42 ASP N N 65 120.770 120.770 119.418 1.352 18329
3000 1 4 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.247 0.323 18329
3001 1 4 . 1 1 42 42 ASP C C 65 176.100 176.100 175.848 0.252 18329
3002 1 4 . 1 1 42 42 ASP CA C 65 54.200 54.200 56.484 -2.284 18329
3003 1 4 . 1 1 42 42 ASP CB C 65 40.900 40.900 40.426 0.474 18329
3004 1 4 . 1 1 42 42 ASP H H 65 8.030 8.030 8.366 -0.336 18329
3005 1 4 . 1 1 43 43 LYS N N 66 122.070 122.070 122.622 -0.552 18329
3006 1 4 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.216 0.064 18329
3007 1 4 . 1 1 43 43 LYS C C 66 176.800 176.800 176.941 -0.141 18329
3008 1 4 . 1 1 43 43 LYS CA C 66 56.500 56.500 56.937 -0.437 18329
3009 1 4 . 1 1 43 43 LYS CB C 66 32.800 32.800 32.438 0.361 18329
3010 1 4 . 1 1 43 43 LYS H H 66 8.180 8.180 8.241 -0.061 18329
3011 1 4 . 1 1 44 44 LYS N N 67 122.170 122.170 123.052 -0.882 18329
3012 1 4 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.259 0.091 18329
3013 1 4 . 1 1 44 44 LYS C C 67 177.000 177.000 175.890 1.110 18329
3014 1 4 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.325 0.275 18329
3015 1 4 . 1 1 44 44 LYS CB C 67 32.800 32.800 32.502 0.298 18329
3016 1 4 . 1 1 44 44 LYS H H 67 8.460 8.460 8.424 0.036 18329
3017 1 4 . 1 1 45 45 THR N N 68 114.390 114.390 114.697 -0.307 18329
3018 1 4 . 1 1 45 45 THR HA H 68 4.330 4.330 4.039 0.291 18329
3019 1 4 . 1 1 45 45 THR C C 68 175.200 175.200 174.364 0.836 18329
3020 1 4 . 1 1 45 45 THR CA C 68 62.000 62.000 62.888 -0.888 18329
3021 1 4 . 1 1 45 45 THR CB C 68 69.900 69.900 68.485 1.415 18329
3022 1 4 . 1 1 45 45 THR H H 68 8.120 8.120 7.687 0.433 18329
3023 1 4 . 1 1 46 46 GLY N N 69 111.200 111.200 114.559 -3.359 18329
3024 1 4 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.155 0.045 18329
3025 1 4 . 1 1 46 46 GLY H H 69 8.450 8.450 8.345 0.105 18329
3026 1 4 . 1 1 47 47 SER CA C 70 58.400 58.400 57.479 0.921 18329
3027 1 4 . 1 1 47 47 SER CB C 70 64.000 64.000 64.091 -0.091 18329
3028 1 4 . 1 1 48 48 GLY N N 71 111.200 111.200 108.599 2.601 18329
3029 1 4 . 1 1 48 48 GLY CA C 71 45.000 45.000 45.485 -0.485 18329
3030 1 4 . 1 1 48 48 GLY H H 71 8.580 8.580 8.536 0.044 18329
3031 1 4 . 1 1 49 49 VAL N N 72 118.910 118.910 117.184 1.726 18329
3032 1 4 . 1 1 49 49 VAL HA H 72 4.130 4.130 3.529 0.601 18329
3033 1 4 . 1 1 49 49 VAL C C 72 176.100 176.100 177.018 -0.918 18329
3034 1 4 . 1 1 49 49 VAL CA C 72 62.100 62.100 65.576 -3.476 18329
3035 1 4 . 1 1 49 49 VAL CB C 72 32.500 32.500 30.983 1.517 18329
3036 1 4 . 1 1 49 49 VAL H H 72 7.860 7.860 8.507 -0.647 18329
3037 1 4 . 1 1 50 50 SER N N 73 118.500 118.500 116.632 1.868 18329
3038 1 4 . 1 1 50 50 SER C C 73 176.100 176.100 175.686 0.414 18329
3039 1 4 . 1 1 50 50 SER CA C 73 58.300 58.300 60.547 -2.247 18329
3040 1 4 . 1 1 50 50 SER CB C 73 63.800 63.800 63.337 0.463 18329
3041 1 4 . 1 1 50 50 SER H H 73 8.300 8.300 8.424 -0.124 18329
3042 1 4 . 1 1 51 51 GLU N N 74 122.560 122.560 119.511 3.049 18329
3043 1 4 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.371 -0.101 18329
3044 1 4 . 1 1 51 51 GLU CA C 74 55.700 55.700 57.024 -1.324 18329
3045 1 4 . 1 1 51 51 GLU CB C 74 30.500 30.500 31.318 -0.818 18329
3046 1 4 . 1 1 51 51 GLU H H 74 8.360 8.360 7.719 0.641 18329
3047 1 4 . 1 1 52 52 ASN N N 75 122.830 122.830 114.117 8.713 18329
3048 1 4 . 1 1 52 52 ASN HA H 75 4.820 4.820 5.009 -0.189 18329
3049 1 4 . 1 1 52 52 ASN C C 75 174.800 174.800 173.022 1.778 18329
3050 1 4 . 1 1 52 52 ASN CA C 75 51.400 51.400 52.763 -1.363 18329
3051 1 4 . 1 1 52 52 ASN CB C 75 39.200 39.200 40.670 -1.470 18329
3052 1 4 . 1 1 52 52 ASN H H 75 8.450 8.450 7.889 0.561 18329
3053 1 4 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.547 -0.367 18329
3054 1 4 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.299 0.901 18329
3055 1 4 . 1 1 53 53 PRO CB C 76 32.000 32.000 32.107 -0.107 18329
3056 1 4 . 1 1 54 54 PHE N N 77 118.060 118.060 120.546 -2.486 18329
3057 1 4 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.222 0.048 18329
3058 1 4 . 1 1 54 54 PHE C C 77 177.500 177.500 177.004 0.496 18329
3059 1 4 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.638 -0.138 18329
3060 1 4 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.257 0.143 18329
3061 1 4 . 1 1 54 54 PHE H H 77 8.430 8.430 8.127 0.303 18329
3062 1 4 . 1 1 55 55 ILE N N 78 119.350 119.350 118.314 1.036 18329
3063 1 4 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.803 -0.303 18329
3064 1 4 . 1 1 55 55 ILE C C 78 177.400 177.400 177.540 -0.140 18329
3065 1 4 . 1 1 55 55 ILE CA C 78 63.500 63.500 64.216 -0.716 18329
3066 1 4 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.633 -0.633 18329
3067 1 4 . 1 1 55 55 ILE H H 78 7.540 7.540 8.062 -0.522 18329
3068 1 4 . 1 1 56 56 LEU N N 79 118.450 118.450 119.936 -1.486 18329
3069 1 4 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.038 0.112 18329
3070 1 4 . 1 1 56 56 LEU C C 79 179.200 179.200 178.841 0.359 18329
3071 1 4 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.141 -0.341 18329
3072 1 4 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.435 -0.335 18329
3073 1 4 . 1 1 56 56 LEU H H 79 7.260 7.260 7.502 -0.242 18329
3074 1 4 . 1 1 57 57 GLU N N 80 117.980 117.980 118.153 -0.173 18329
3075 1 4 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.908 -0.258 18329
3076 1 4 . 1 1 57 57 GLU C C 80 178.700 178.700 178.809 -0.109 18329
3077 1 4 . 1 1 57 57 GLU CA C 80 59.300 59.300 59.005 0.295 18329
3078 1 4 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.207 0.293 18329
3079 1 4 . 1 1 57 57 GLU H H 80 7.890 7.890 7.928 -0.038 18329
3080 1 4 . 1 1 58 58 ALA N N 81 122.040 122.040 121.504 0.536 18329
3081 1 4 . 1 1 58 58 ALA HA H 81 3.800 3.800 3.980 -0.180 18329
3082 1 4 . 1 1 58 58 ALA C C 81 179.500 179.500 179.039 0.461 18329
3083 1 4 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.887 0.313 18329
3084 1 4 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.229 0.571 18329
3085 1 4 . 1 1 58 58 ALA H H 81 8.400 8.400 7.817 0.583 18329
3086 1 4 . 1 1 59 59 LYS N N 82 116.000 116.000 118.485 -2.485 18329
3087 1 4 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.079 -0.229 18329
3088 1 4 . 1 1 59 59 LYS C C 82 180.300 180.300 178.531 1.769 18329
3089 1 4 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.205 1.895 18329
3090 1 4 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.317 -0.117 18329
3091 1 4 . 1 1 59 59 LYS H H 82 8.000 8.000 7.478 0.522 18329
3092 1 4 . 1 1 60 60 VAL N N 83 122.920 122.920 118.680 4.240 18329
3093 1 4 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.683 -0.353 18329
3094 1 4 . 1 1 60 60 VAL C C 83 178.300 178.300 178.276 0.024 18329
3095 1 4 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.942 1.958 18329
3096 1 4 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.240 -0.040 18329
3097 1 4 . 1 1 60 60 VAL H H 83 8.110 8.110 7.154 0.956 18329
3098 1 4 . 1 1 61 61 ARG N N 84 121.770 121.770 120.496 1.274 18329
3099 1 4 . 1 1 61 61 ARG C C 84 179.500 179.500 178.517 0.983 18329
3100 1 4 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.355 -0.155 18329
3101 1 4 . 1 1 61 61 ARG CB C 84 30.800 30.800 30.055 0.745 18329
3102 1 4 . 1 1 61 61 ARG H H 84 8.710 8.710 7.495 1.215 18329
3103 1 4 . 1 1 62 62 ALA N N 85 119.450 119.450 120.492 -1.042 18329
3104 1 4 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.070 -0.180 18329
3105 1 4 . 1 1 62 62 ALA C C 85 179.500 179.500 178.970 0.530 18329
3106 1 4 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.219 -0.219 18329
3107 1 4 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.569 0.431 18329
3108 1 4 . 1 1 62 62 ALA H H 85 8.700 8.700 7.854 0.846 18329
3109 1 4 . 1 1 63 63 THR N N 86 106.650 106.650 110.142 -3.492 18329
3110 1 4 . 1 1 63 63 THR HA H 86 3.970 3.970 4.064 -0.094 18329
3111 1 4 . 1 1 63 63 THR C C 86 177.700 177.700 176.652 1.048 18329
3112 1 4 . 1 1 63 63 THR CA C 86 66.000 66.000 65.428 0.572 18329
3113 1 4 . 1 1 63 63 THR CB C 86 68.200 68.200 68.561 -0.361 18329
3114 1 4 . 1 1 63 63 THR H H 86 8.150 8.150 7.760 0.390 18329
3115 1 4 . 1 1 64 64 THR N N 87 120.430 120.430 119.345 1.085 18329
3116 1 4 . 1 1 64 64 THR HA H 87 4.050 4.050 4.210 -0.160 18329
3117 1 4 . 1 1 64 64 THR C C 87 176.800 176.800 176.357 0.443 18329
3118 1 4 . 1 1 64 64 THR CA C 87 67.300 67.300 67.051 0.249 18329
3119 1 4 . 1 1 64 64 THR CB C 87 68.600 68.600 68.606 -0.006 18329
3120 1 4 . 1 1 64 64 THR H H 87 7.920 7.920 7.697 0.223 18329
3121 1 4 . 1 1 65 65 VAL N N 88 119.230 119.230 121.021 -1.791 18329
3122 1 4 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.822 0.158 18329
3123 1 4 . 1 1 65 65 VAL C C 88 178.500 178.500 177.436 1.064 18329
3124 1 4 . 1 1 65 65 VAL CA C 88 65.600 65.600 65.848 -0.248 18329
3125 1 4 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.195 0.505 18329
3126 1 4 . 1 1 65 65 VAL H H 88 7.380 7.380 7.471 -0.091 18329
3127 1 4 . 1 1 66 66 ALA N N 89 124.260 124.260 121.712 2.548 18329
3128 1 4 . 1 1 66 66 ALA HA H 89 4.250 4.250 4.001 0.249 18329
3129 1 4 . 1 1 66 66 ALA C C 89 179.900 179.900 179.439 0.461 18329
3130 1 4 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.510 -0.610 18329
3131 1 4 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.123 1.377 18329
3132 1 4 . 1 1 66 66 ALA H H 89 8.390 8.390 7.947 0.443 18329
3133 1 4 . 1 1 67 67 GLU N N 90 120.180 120.180 117.485 2.695 18329
3134 1 4 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.908 -0.188 18329
3135 1 4 . 1 1 67 67 GLU C C 90 177.600 177.600 178.692 -1.092 18329
3136 1 4 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.231 0.669 18329
3137 1 4 . 1 1 67 67 GLU CB C 90 28.300 28.300 28.984 -0.684 18329
3138 1 4 . 1 1 67 67 GLU H H 90 8.520 8.520 8.121 0.399 18329
3139 1 4 . 1 1 68 68 LYS N N 91 116.340 116.340 119.557 -3.217 18329
3140 1 4 . 1 1 68 68 LYS HA H 91 3.960 3.960 3.993 -0.033 18329
3141 1 4 . 1 1 68 68 LYS C C 91 179.200 179.200 179.114 0.086 18329
3142 1 4 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.908 0.892 18329
3143 1 4 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.189 -0.189 18329
3144 1 4 . 1 1 68 68 LYS H H 91 7.210 7.210 7.315 -0.105 18329
3145 1 4 . 1 1 69 69 PHE N N 92 120.990 120.990 120.100 0.890 18329
3146 1 4 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.190 0.320 18329
3147 1 4 . 1 1 69 69 PHE C C 92 175.100 175.100 176.884 -1.784 18329
3148 1 4 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.387 -1.587 18329
3149 1 4 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.198 0.002 18329
3150 1 4 . 1 1 69 69 PHE H H 92 7.180 7.180 7.894 -0.714 18329
3151 1 4 . 1 1 70 70 VAL N N 93 120.330 120.330 118.551 1.779 18329
3152 1 4 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.582 -0.492 18329
3153 1 4 . 1 1 70 70 VAL C C 93 177.500 177.500 177.896 -0.396 18329
3154 1 4 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.245 0.655 18329
3155 1 4 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.211 0.189 18329
3156 1 4 . 1 1 70 70 VAL H H 93 7.930 7.930 7.261 0.669 18329
3157 1 4 . 1 1 71 71 ILE N N 94 120.410 120.410 118.731 1.679 18329
3158 1 4 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.649 0.181 18329
3159 1 4 . 1 1 71 71 ILE C C 94 177.700 177.700 178.008 -0.308 18329
3160 1 4 . 1 1 71 71 ILE CA C 94 65.000 65.000 65.026 -0.026 18329
3161 1 4 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.136 0.164 18329
3162 1 4 . 1 1 71 71 ILE H H 94 8.180 8.180 7.444 0.736 18329
3163 1 4 . 1 1 72 72 ALA N N 95 122.440 122.440 122.130 0.310 18329
3164 1 4 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.956 0.004 18329
3165 1 4 . 1 1 72 72 ALA C C 95 179.600 179.600 179.434 0.166 18329
3166 1 4 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.086 0.814 18329
3167 1 4 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.701 -0.501 18329
3168 1 4 . 1 1 72 72 ALA H H 95 7.340 7.340 7.390 -0.050 18329
3169 1 4 . 1 1 73 73 ILE N N 96 119.330 119.330 119.069 0.261 18329
3170 1 4 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.580 -0.140 18329
3171 1 4 . 1 1 73 73 ILE C C 96 177.400 177.400 177.905 -0.505 18329
3172 1 4 . 1 1 73 73 ILE CA C 96 62.800 62.800 63.114 -0.314 18329
3173 1 4 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.353 -1.953 18329
3174 1 4 . 1 1 73 73 ILE H H 96 7.820 7.820 7.376 0.444 18329
3175 1 4 . 1 1 74 74 GLU N N 97 118.440 118.440 120.807 -2.367 18329
3176 1 4 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.808 -0.118 18329
3177 1 4 . 1 1 74 74 GLU C C 97 180.500 180.500 178.675 1.825 18329
3178 1 4 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.783 -0.083 18329
3179 1 4 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.504 0.196 18329
3180 1 4 . 1 1 74 74 GLU H H 97 8.380 8.380 7.703 0.677 18329
3181 1 4 . 1 1 75 75 GLU N N 98 120.470 120.470 120.233 0.237 18329
3182 1 4 . 1 1 75 75 GLU HA H 98 3.940 3.940 3.996 -0.056 18329
3183 1 4 . 1 1 75 75 GLU C C 98 180.600 180.600 178.997 1.603 18329
3184 1 4 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.137 0.563 18329
3185 1 4 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.319 0.881 18329
3186 1 4 . 1 1 75 75 GLU H H 98 8.800 8.800 7.987 0.813 18329
3187 1 4 . 1 1 76 76 GLU N N 99 119.230 119.230 118.596 0.634 18329
3188 1 4 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.006 0.134 18329
3189 1 4 . 1 1 76 76 GLU C C 99 178.900 178.900 179.066 -0.166 18329
3190 1 4 . 1 1 76 76 GLU CA C 99 58.600 58.600 59.026 -0.426 18329
3191 1 4 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.188 0.112 18329
3192 1 4 . 1 1 76 76 GLU H H 99 8.840 8.840 8.129 0.711 18329
3193 1 4 . 1 1 77 77 ALA N N 100 121.950 121.950 121.690 0.260 18329
3194 1 4 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.196 -0.196 18329
3195 1 4 . 1 1 77 77 ALA C C 100 179.000 179.000 179.628 -0.628 18329
3196 1 4 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.053 1.247 18329
3197 1 4 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.296 -1.496 18329
3198 1 4 . 1 1 77 77 ALA H H 100 9.400 9.400 7.756 1.644 18329
3199 1 4 . 1 1 78 78 THR N N 101 111.820 111.820 114.969 -3.149 18329
3200 1 4 . 1 1 78 78 THR HA H 101 3.750 3.750 3.972 -0.222 18329
3201 1 4 . 1 1 78 78 THR CA C 101 67.500 67.500 66.265 1.235 18329
3202 1 4 . 1 1 78 78 THR CB C 101 68.600 68.600 68.734 -0.134 18329
3203 1 4 . 1 1 78 78 THR H H 101 7.770 7.770 7.804 -0.034 18329
3204 1 4 . 1 1 79 79 LYS N N 102 122.940 122.940 120.425 2.515 18329
3205 1 4 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.198 -0.108 18329
3206 1 4 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.443 0.757 18329
3207 1 4 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.417 0.083 18329
3208 1 4 . 1 1 79 79 LYS H H 102 7.870 7.870 7.861 0.009 18329
3209 1 4 . 1 1 80 80 LEU N N 103 117.690 117.690 118.158 -0.468 18329
3210 1 4 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.430 0.060 18329
3211 1 4 . 1 1 80 80 LEU C C 103 178.140 178.140 176.295 1.845 18329
3212 1 4 . 1 1 80 80 LEU CA C 103 54.000 54.000 53.773 0.227 18329
3213 1 4 . 1 1 80 80 LEU CB C 103 43.100 43.100 42.721 0.379 18329
3214 1 4 . 1 1 80 80 LEU H H 103 7.550 7.550 7.757 -0.207 18329
3215 1 4 . 1 1 81 81 LYS N N 104 122.210 122.210 120.505 1.705 18329
3216 1 4 . 1 1 81 81 LYS HA H 104 3.930 3.930 4.191 -0.261 18329
3217 1 4 . 1 1 81 81 LYS C C 104 178.000 178.000 176.416 1.584 18329
3218 1 4 . 1 1 81 81 LYS CA C 104 61.300 61.300 57.792 3.508 18329
3219 1 4 . 1 1 81 81 LYS CB C 104 32.800 32.800 31.495 1.305 18329
3220 1 4 . 1 1 81 81 LYS H H 104 7.500 7.500 7.402 0.098 18329
3221 1 4 . 1 1 82 82 GLU N N 105 114.920 114.920 123.500 -8.580 18329
3222 1 4 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.372 0.188 18329
3223 1 4 . 1 1 82 82 GLU C C 105 177.900 177.900 177.435 0.465 18329
3224 1 4 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.632 0.028 18329
3225 1 4 . 1 1 82 82 GLU CB C 105 30.400 30.400 30.309 0.091 18329
3226 1 4 . 1 1 82 82 GLU H H 105 8.780 8.780 8.785 -0.005 18329
3227 1 4 . 1 1 83 83 THR N N 106 107.260 107.260 113.671 -6.411 18329
3228 1 4 . 1 1 83 83 THR HA H 106 4.550 4.550 4.205 0.345 18329
3229 1 4 . 1 1 83 83 THR C C 106 176.300 176.300 176.237 0.063 18329
3230 1 4 . 1 1 83 83 THR CA C 106 61.900 61.900 63.119 -1.219 18329
3231 1 4 . 1 1 83 83 THR CB C 106 70.400 70.400 69.330 1.070 18329
3232 1 4 . 1 1 83 83 THR H H 106 7.570 7.570 8.015 -0.445 18329
3233 1 4 . 1 1 84 84 GLY N N 107 112.110 112.110 110.225 1.885 18329
3234 1 4 . 1 1 84 84 GLY C C 107 172.800 172.800 173.346 -0.546 18329
3235 1 4 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.199 0.201 18329
3236 1 4 . 1 1 84 84 GLY H H 107 9.000 9.000 7.681 1.319 18329
3237 1 4 . 1 1 85 85 SER N N 108 119.030 119.030 114.829 4.201 18329
3238 1 4 . 1 1 85 85 SER CA C 108 56.300 56.300 58.243 -1.943 18329
3239 1 4 . 1 1 85 85 SER CB C 108 66.300 66.300 63.382 2.918 18329
3240 1 4 . 1 1 85 85 SER H H 108 8.950 8.950 8.714 0.236 18329
3241 1 4 . 1 1 86 86 SER HA H 109 4.480 4.480 4.797 -0.317 18329
3242 1 4 . 1 1 86 86 SER C C 109 177.000 177.000 176.388 0.612 18329
3243 1 4 . 1 1 86 86 SER CA C 109 61.600 61.600 58.852 2.748 18329
3244 1 4 . 1 1 86 86 SER CB C 109 62.900 62.900 63.273 -0.373 18329
3245 1 4 . 1 1 87 87 GLY N N 110 108.100 108.100 111.049 -2.949 18329
3246 1 4 . 1 1 87 87 GLY C C 110 177.100 177.100 175.738 1.362 18329
3247 1 4 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.618 -0.418 18329
3248 1 4 . 1 1 87 87 GLY H H 110 8.480 8.480 8.761 -0.281 18329
3249 1 4 . 1 1 88 88 GLU N N 111 123.040 123.040 121.883 1.157 18329
3250 1 4 . 1 1 88 88 GLU HA H 111 3.690 3.690 3.996 -0.306 18329
3251 1 4 . 1 1 88 88 GLU C C 111 177.700 177.700 178.919 -1.219 18329
3252 1 4 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.645 0.855 18329
3253 1 4 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.477 -0.777 18329
3254 1 4 . 1 1 88 88 GLU H H 111 7.560 7.560 7.862 -0.302 18329
3255 1 4 . 1 1 89 89 PHE N N 112 118.270 118.270 119.070 -0.800 18329
3256 1 4 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.338 0.082 18329
3257 1 4 . 1 1 89 89 PHE C C 112 178.600 178.600 178.180 0.420 18329
3258 1 4 . 1 1 89 89 PHE CA C 112 61.100 61.100 61.284 -0.184 18329
3259 1 4 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.852 -0.952 18329
3260 1 4 . 1 1 89 89 PHE H H 112 7.200 7.200 7.565 -0.365 18329
3261 1 4 . 1 1 90 90 SER N N 113 115.980 115.980 115.504 0.476 18329
3262 1 4 . 1 1 90 90 SER HA H 113 4.290 4.290 4.145 0.145 18329
3263 1 4 . 1 1 90 90 SER C C 113 178.600 178.600 176.009 2.591 18329
3264 1 4 . 1 1 90 90 SER CA C 113 62.700 62.700 62.354 0.346 18329
3265 1 4 . 1 1 90 90 SER CB C 113 62.800 62.800 62.534 0.266 18329
3266 1 4 . 1 1 90 90 SER H H 113 8.830 8.830 8.180 0.650 18329
3267 1 4 . 1 1 91 91 ALA N N 114 123.130 123.130 123.675 -0.545 18329
3268 1 4 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.165 0.215 18329
3269 1 4 . 1 1 91 91 ALA C C 114 181.300 181.300 179.584 1.716 18329
3270 1 4 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.853 -0.153 18329
3271 1 4 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.324 0.076 18329
3272 1 4 . 1 1 91 91 ALA H H 114 7.580 7.580 7.576 0.004 18329
3273 1 4 . 1 1 92 92 MET N N 115 118.700 118.700 117.032 1.668 18329
3274 1 4 . 1 1 92 92 MET HA H 115 3.980 3.980 4.242 -0.262 18329
3275 1 4 . 1 1 92 92 MET C C 115 178.000 178.000 178.801 -0.801 18329
3276 1 4 . 1 1 92 92 MET CA C 115 61.000 61.000 57.386 3.614 18329
3277 1 4 . 1 1 92 92 MET CB C 115 31.400 31.400 31.716 -0.316 18329
3278 1 4 . 1 1 92 92 MET H H 115 7.880 7.880 8.281 -0.401 18329
3279 1 4 . 1 1 93 93 TYR N N 116 119.200 119.200 118.429 0.771 18329
3280 1 4 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.288 -0.008 18329
3281 1 4 . 1 1 93 93 TYR C C 116 176.300 176.300 178.176 -1.876 18329
3282 1 4 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.777 0.323 18329
3283 1 4 . 1 1 93 93 TYR CB C 116 38.300 38.300 37.464 0.836 18329
3284 1 4 . 1 1 93 93 TYR H H 116 7.870 7.870 7.849 0.021 18329
3285 1 4 . 1 1 94 94 ASP N N 117 120.210 120.210 120.115 0.095 18329
3286 1 4 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.400 -0.210 18329
3287 1 4 . 1 1 94 94 ASP C C 117 179.000 179.000 178.602 0.398 18329
3288 1 4 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.615 0.085 18329
3289 1 4 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.889 -0.889 18329
3290 1 4 . 1 1 94 94 ASP H H 117 8.720 8.720 7.764 0.956 18329
3291 1 4 . 1 1 95 95 LEU N N 118 118.420 118.420 119.574 -1.154 18329
3292 1 4 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.127 0.083 18329
3293 1 4 . 1 1 95 95 LEU C C 118 178.600 178.600 179.074 -0.474 18329
3294 1 4 . 1 1 95 95 LEU CA C 118 57.700 57.700 58.213 -0.513 18329
3295 1 4 . 1 1 95 95 LEU CB C 118 43.100 43.100 41.185 1.915 18329
3296 1 4 . 1 1 95 95 LEU H H 118 7.510 7.510 7.661 -0.151 18329
3297 1 4 . 1 1 96 96 MET N N 119 118.470 118.470 119.691 -1.221 18329
3298 1 4 . 1 1 96 96 MET HA H 119 3.990 3.990 4.158 -0.168 18329
3299 1 4 . 1 1 96 96 MET C C 119 177.500 177.500 178.648 -1.148 18329
3300 1 4 . 1 1 96 96 MET CA C 119 60.500 60.500 58.155 2.345 18329
3301 1 4 . 1 1 96 96 MET CB C 119 33.900 33.900 31.589 2.311 18329
3302 1 4 . 1 1 96 96 MET H H 119 7.820 7.820 7.568 0.252 18329
3303 1 4 . 1 1 97 97 PHE N N 120 119.580 119.580 118.669 0.911 18329
3304 1 4 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.188 -0.378 18329
3305 1 4 . 1 1 97 97 PHE C C 120 178.800 178.800 178.446 0.354 18329
3306 1 4 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.693 0.107 18329
3307 1 4 . 1 1 97 97 PHE CB C 120 39.200 39.200 38.278 0.923 18329
3308 1 4 . 1 1 97 97 PHE H H 120 8.940 8.940 8.410 0.530 18329
3309 1 4 . 1 1 98 98 GLU N N 121 119.940 119.940 119.748 0.192 18329
3310 1 4 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.103 -0.223 18329
3311 1 4 . 1 1 98 98 GLU C C 121 180.800 180.800 179.589 1.211 18329
3312 1 4 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.575 0.225 18329
3313 1 4 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.502 -0.302 18329
3314 1 4 . 1 1 98 98 GLU H H 121 8.690 8.690 8.582 0.108 18329
3315 1 4 . 1 1 99 99 VAL N N 122 115.350 115.350 118.735 -3.385 18329
3316 1 4 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.703 0.037 18329
3317 1 4 . 1 1 99 99 VAL C C 122 176.500 176.500 177.253 -0.753 18329
3318 1 4 . 1 1 99 99 VAL CA C 122 64.500 64.500 65.376 -0.876 18329
3319 1 4 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.660 -0.360 18329
3320 1 4 . 1 1 99 99 VAL H H 122 8.210 8.210 8.417 -0.207 18329
3321 1 4 . 1 1 100 100 SER N N 123 115.450 115.450 116.254 -0.804 18329
3322 1 4 . 1 1 100 100 SER HA H 123 4.270 4.270 4.187 0.083 18329
3323 1 4 . 1 1 100 100 SER C C 123 174.700 174.700 176.552 -1.852 18329
3324 1 4 . 1 1 100 100 SER CA C 123 62.000 62.000 61.453 0.547 18329
3325 1 4 . 1 1 100 100 SER H H 123 7.520 7.520 8.181 -0.661 18329
3326 1 4 . 1 1 101 101 LYS N N 124 120.310 120.310 121.903 -1.593 18329
3327 1 4 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.204 -0.234 18329
3328 1 4 . 1 1 101 101 LYS C C 124 176.600 176.600 176.264 0.336 18329
3329 1 4 . 1 1 101 101 LYS CA C 124 61.100 61.100 61.203 -0.103 18329
3330 1 4 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.080 -1.580 18329
3331 1 4 . 1 1 101 101 LYS H H 124 6.930 6.930 7.684 -0.754 18329
3332 1 4 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.310 -0.050 18329
3333 1 4 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.798 -0.598 18329
3334 1 4 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.447 -0.847 18329
3335 1 4 . 1 1 103 103 LEU N N 126 116.020 116.020 118.904 -2.884 18329
3336 1 4 . 1 1 103 103 LEU HA H 126 3.880 3.880 3.947 -0.067 18329
3337 1 4 . 1 1 103 103 LEU C C 126 177.900 177.900 179.267 -1.367 18329
3338 1 4 . 1 1 103 103 LEU CA C 126 57.700 57.700 58.474 -0.774 18329
3339 1 4 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.254 0.546 18329
3340 1 4 . 1 1 103 103 LEU H H 126 6.520 6.520 7.637 -1.117 18329
3341 1 4 . 1 1 104 104 GLN N N 127 120.500 120.500 119.689 0.811 18329
3342 1 4 . 1 1 104 104 GLN C C 127 180.600 180.600 177.647 2.953 18329
3343 1 4 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.372 -0.072 18329
3344 1 4 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.631 0.369 18329
3345 1 4 . 1 1 104 104 GLN H H 127 8.160 8.160 8.229 -0.069 18329
3346 1 4 . 1 1 105 105 LYS N N 128 120.000 120.000 118.577 1.423 18329
3347 1 4 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.010 0.040 18329
3348 1 4 . 1 1 105 105 LYS C C 128 177.100 177.100 177.763 -0.663 18329
3349 1 4 . 1 1 105 105 LYS CA C 128 58.500 58.500 58.703 -0.203 18329
3350 1 4 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.395 -0.995 18329
3351 1 4 . 1 1 105 105 LYS H H 128 7.810 7.810 7.970 -0.160 18329
3352 1 4 . 1 1 106 106 LEU N N 129 118.530 118.530 116.210 2.320 18329
3353 1 4 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.246 -0.276 18329
3354 1 4 . 1 1 106 106 LEU C C 129 175.200 175.200 176.664 -1.464 18329
3355 1 4 . 1 1 106 106 LEU CA C 129 54.500 54.500 56.159 -1.659 18329
3356 1 4 . 1 1 106 106 LEU CB C 129 42.400 42.400 43.395 -0.995 18329
3357 1 4 . 1 1 106 106 LEU H H 129 7.220 7.220 7.528 -0.308 18329
3358 1 4 . 1 1 107 107 GLY N N 130 101.490 101.490 103.191 -1.701 18329
3359 1 4 . 1 1 107 107 GLY C C 130 174.800 174.800 172.574 2.226 18329
3360 1 4 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.650 0.450 18329
3361 1 4 . 1 1 107 107 GLY H H 130 7.560 7.560 8.039 -0.479 18329
3362 1 4 . 1 1 108 108 ILE N N 131 121.340 121.340 119.023 2.317 18329
3363 1 4 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.641 0.509 18329
3364 1 4 . 1 1 108 108 ILE C C 131 174.300 174.300 174.998 -0.698 18329
3365 1 4 . 1 1 108 108 ILE CA C 131 60.400 60.400 63.544 -3.144 18329
3366 1 4 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.532 -2.332 18329
3367 1 4 . 1 1 108 108 ILE H H 131 7.290 7.290 8.103 -0.813 18329
3368 1 4 . 1 1 109 109 GLN N N 132 125.650 125.650 119.880 5.770 18329
3369 1 4 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.115 -0.105 18329
3370 1 4 . 1 1 109 109 GLN C C 132 176.800 176.800 174.145 2.655 18329
3371 1 4 . 1 1 109 109 GLN CA C 132 57.600 57.600 56.466 1.134 18329
3372 1 4 . 1 1 109 109 GLN CB C 132 29.000 29.000 27.212 1.788 18329
3373 1 4 . 1 1 109 109 GLN H H 132 8.080 8.080 8.581 -0.501 18329
3374 1 4 . 1 1 110 110 GLU N N 133 114.890 114.890 117.622 -2.732 18329
3375 1 4 . 1 1 110 110 GLU HA H 133 4.150 4.150 4.334 -0.184 18329
3376 1 4 . 1 1 110 110 GLU C C 133 177.100 177.100 177.125 -0.025 18329
3377 1 4 . 1 1 110 110 GLU CA C 133 57.100 57.100 57.130 -0.030 18329
3378 1 4 . 1 1 110 110 GLU CB C 133 27.300 27.300 29.887 -2.587 18329
3379 1 4 . 1 1 110 110 GLU H H 133 9.270 9.270 8.524 0.746 18329
3380 1 4 . 1 1 111 111 MET N N 134 121.210 121.210 119.287 1.923 18329
3381 1 4 . 1 1 111 111 MET HA H 134 4.350 4.350 4.082 0.268 18329
3382 1 4 . 1 1 111 111 MET C C 134 177.500 177.500 178.428 -0.928 18329
3383 1 4 . 1 1 111 111 MET CA C 134 57.900 57.900 59.493 -1.593 18329
3384 1 4 . 1 1 111 111 MET CB C 134 33.300 33.300 32.018 1.282 18329
3385 1 4 . 1 1 111 111 MET H H 134 7.620 7.620 8.423 -0.803 18329
3386 1 4 . 1 1 112 112 THR N N 135 113.170 113.170 113.056 0.114 18329
3387 1 4 . 1 1 112 112 THR HA H 135 3.920 3.920 3.591 0.329 18329
3388 1 4 . 1 1 112 112 THR C C 135 176.400 176.400 176.347 0.053 18329
3389 1 4 . 1 1 112 112 THR CA C 135 65.900 65.900 66.434 -0.534 18329
3390 1 4 . 1 1 112 112 THR CB C 135 68.200 68.200 68.032 0.168 18329
3391 1 4 . 1 1 112 112 THR H H 135 8.320 8.320 8.250 0.070 18329
3392 1 4 . 1 1 113 113 LYS N N 136 123.440 123.440 121.847 1.593 18329
3393 1 4 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.212 -0.282 18329
3394 1 4 . 1 1 113 113 LYS C C 136 177.600 177.600 178.680 -1.080 18329
3395 1 4 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.439 -1.139 18329
3396 1 4 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.453 -0.453 18329
3397 1 4 . 1 1 113 113 LYS H H 136 8.060 8.060 7.181 0.879 18329
3398 1 4 . 1 1 114 114 THR N N 137 114.590 114.590 115.842 -1.252 18329
3399 1 4 . 1 1 114 114 THR HA H 137 4.000 4.000 4.112 -0.112 18329
3400 1 4 . 1 1 114 114 THR C C 137 176.800 176.800 176.886 -0.086 18329
3401 1 4 . 1 1 114 114 THR CA C 137 67.600 67.600 66.104 1.496 18329
3402 1 4 . 1 1 114 114 THR CB C 137 69.200 69.200 68.513 0.687 18329
3403 1 4 . 1 1 114 114 THR H H 137 7.950 7.950 8.384 -0.434 18329
3404 1 4 . 1 1 115 115 VAL N N 138 119.080 119.080 119.885 -0.805 18329
3405 1 4 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.656 0.164 18329
3406 1 4 . 1 1 115 115 VAL C C 138 176.900 176.900 177.493 -0.593 18329
3407 1 4 . 1 1 115 115 VAL CA C 138 66.800 66.800 66.526 0.274 18329
3408 1 4 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.679 0.821 18329
3409 1 4 . 1 1 115 115 VAL H H 138 7.320 7.320 8.108 -0.788 18329
3410 1 4 . 1 1 116 116 SER N N 139 116.630 116.630 114.789 1.841 18329
3411 1 4 . 1 1 116 116 SER HA H 139 4.680 4.680 4.272 0.408 18329
3412 1 4 . 1 1 116 116 SER C C 139 179.000 179.000 176.809 2.191 18329
3413 1 4 . 1 1 116 116 SER CA C 139 61.400 61.400 61.460 -0.060 18329
3414 1 4 . 1 1 116 116 SER CB C 139 62.800 62.800 63.090 -0.290 18329
3415 1 4 . 1 1 116 116 SER H H 139 8.990 8.990 7.724 1.266 18329
3416 1 4 . 1 1 117 117 ASP N N 140 124.220 124.220 122.454 1.766 18329
3417 1 4 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.528 -0.168 18329
3418 1 4 . 1 1 117 117 ASP C C 140 179.900 179.900 178.697 1.203 18329
3419 1 4 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.530 0.770 18329
3420 1 4 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.442 -0.942 18329
3421 1 4 . 1 1 117 117 ASP H H 140 9.480 9.480 8.239 1.241 18329
3422 1 4 . 1 1 118 118 ALA N N 141 121.420 121.420 121.809 -0.389 18329
3423 1 4 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.180 0.100 18329
3424 1 4 . 1 1 118 118 ALA C C 141 179.800 179.800 178.611 1.189 18329
3425 1 4 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.656 -0.256 18329
3426 1 4 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.401 0.599 18329
3427 1 4 . 1 1 118 118 ALA H H 141 7.340 7.340 7.920 -0.580 18329
3428 1 4 . 1 1 119 119 ALA N N 142 121.680 121.680 118.925 2.755 18329
3429 1 4 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.064 0.066 18329
3430 1 4 . 1 1 119 119 ALA C C 142 178.800 178.800 178.728 0.072 18329
3431 1 4 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.011 -0.811 18329
3432 1 4 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.693 -0.393 18329
3433 1 4 . 1 1 119 119 ALA H H 142 7.890 7.890 7.428 0.462 18329
3434 1 4 . 1 1 120 120 GLU N N 143 117.690 117.690 119.238 -1.548 18329
3435 1 4 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.026 -0.086 18329
3436 1 4 . 1 1 120 120 GLU C C 143 178.100 178.100 177.433 0.667 18329
3437 1 4 . 1 1 120 120 GLU CA C 143 58.700 58.700 57.446 1.254 18329
3438 1 4 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.056 0.444 18329
3439 1 4 . 1 1 120 120 GLU H H 143 7.500 7.500 7.581 -0.081 18329
3440 1 4 . 1 1 121 121 GLU N N 144 115.680 115.680 117.507 -1.827 18329
3441 1 4 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.005 0.155 18329
3442 1 4 . 1 1 121 121 GLU C C 144 176.100 176.100 176.648 -0.548 18329
3443 1 4 . 1 1 121 121 GLU CA C 144 56.900 56.900 59.001 -2.101 18329
3444 1 4 . 1 1 121 121 GLU CB C 144 31.100 31.100 29.308 1.792 18329
3445 1 4 . 1 1 121 121 GLU H H 144 6.970 6.970 8.722 -1.752 18329
3446 1 4 . 1 1 122 122 ASN N N 145 117.750 117.750 118.594 -0.844 18329
3447 1 4 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.047 -0.057 18329
3448 1 4 . 1 1 122 122 ASN C C 145 185.300 185.300 172.603 12.697 18329
3449 1 4 . 1 1 122 122 ASN CA C 145 50.200 50.200 50.498 -0.298 18329
3450 1 4 . 1 1 122 122 ASN CB C 145 41.100 41.100 39.388 1.712 18329
3451 1 4 . 1 1 122 122 ASN H H 145 7.670 7.670 8.354 -0.684 18329
3452 1 4 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.632 -0.002 18329
3453 1 4 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.287 -1.287 18329
3454 1 4 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.499 -0.199 18329
3455 1 4 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.185 0.255 18329
3456 1 4 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.706 -0.806 18329
3457 1 4 . 1 1 124 124 PRO CB C 147 28.400 28.400 31.127 -2.727 18329
3458 1 4 . 1 1 125 125 THR N N 148 106.090 106.090 116.757 -10.667 18329
3459 1 4 . 1 1 125 125 THR HA H 148 4.530 4.530 4.419 0.111 18329
3460 1 4 . 1 1 125 125 THR C C 148 174.300 174.300 174.086 0.214 18329
3461 1 4 . 1 1 125 125 THR CA C 148 61.200 61.200 62.259 -1.059 18329
3462 1 4 . 1 1 125 125 THR CB C 148 68.600 68.600 69.277 -0.677 18329
3463 1 4 . 1 1 125 125 THR H H 148 7.800 7.800 8.073 -0.273 18329
3464 1 4 . 1 1 126 126 THR N N 149 108.650 108.650 111.309 -2.659 18329
3465 1 4 . 1 1 126 126 THR HA H 149 4.170 4.170 4.433 -0.263 18329
3466 1 4 . 1 1 126 126 THR C C 149 173.100 173.100 173.293 -0.193 18329
3467 1 4 . 1 1 126 126 THR CA C 149 58.800 58.800 59.596 -0.796 18329
3468 1 4 . 1 1 126 126 THR CB C 149 73.100 73.100 71.024 2.076 18329
3469 1 4 . 1 1 126 126 THR H H 149 7.350 7.350 7.122 0.228 18329
3470 1 4 . 1 1 127 127 ALA N N 150 123.270 123.270 123.310 -0.040 18329
3471 1 4 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.613 -0.593 18329
3472 1 4 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.141 -0.141 18329
3473 1 4 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.433 0.268 18329
3474 1 4 . 1 1 127 127 ALA H H 150 7.750 7.750 8.561 -0.811 18329
3475 1 4 . 1 1 128 128 GLN N N 151 114.920 114.920 118.155 -3.235 18329
3476 1 4 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.050 -0.300 18329
3477 1 4 . 1 1 128 128 GLN C C 151 178.400 178.400 178.159 0.241 18329
3478 1 4 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.571 0.229 18329
3479 1 4 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.388 -1.188 18329
3480 1 4 . 1 1 128 128 GLN H H 151 8.300 8.300 8.410 -0.110 18329
3481 1 4 . 1 1 129 129 GLY N N 152 107.280 107.280 107.585 -0.305 18329
3482 1 4 . 1 1 129 129 GLY C C 152 174.900 174.900 176.323 -1.423 18329
3483 1 4 . 1 1 129 129 GLY CA C 152 47.200 47.200 47.100 0.100 18329
3484 1 4 . 1 1 129 129 GLY H H 152 7.920 7.920 7.723 0.197 18329
3485 1 4 . 1 1 130 130 VAL N N 153 119.440 119.440 121.587 -2.147 18329
3486 1 4 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.826 -0.356 18329
3487 1 4 . 1 1 130 130 VAL C C 153 177.700 177.700 177.884 -0.184 18329
3488 1 4 . 1 1 130 130 VAL CA C 153 67.800 67.800 64.976 2.824 18329
3489 1 4 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.793 -0.093 18329
3490 1 4 . 1 1 130 130 VAL H H 153 7.390 7.390 7.452 -0.062 18329
3491 1 4 . 1 1 131 131 LEU N N 154 118.990 118.990 120.352 -1.362 18329
3492 1 4 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.891 0.019 18329
3493 1 4 . 1 1 131 131 LEU C C 154 180.400 180.400 178.291 2.109 18329
3494 1 4 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.056 0.243 18329
3495 1 4 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.616 -0.616 18329
3496 1 4 . 1 1 131 131 LEU H H 154 8.640 8.640 7.357 1.283 18329
3497 1 4 . 1 1 132 132 GLU N N 155 120.980 120.980 119.146 1.834 18329
3498 1 4 . 1 1 132 132 GLU HA H 155 4.120 4.120 3.994 0.126 18329
3499 1 4 . 1 1 132 132 GLU C C 155 179.400 179.400 179.244 0.156 18329
3500 1 4 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.584 -0.684 18329
3501 1 4 . 1 1 132 132 GLU CB C 155 29.200 29.200 28.938 0.262 18329
3502 1 4 . 1 1 132 132 GLU H H 155 8.000 8.000 7.758 0.242 18329
3503 1 4 . 1 1 133 133 ILE N N 156 121.830 121.830 119.450 2.380 18329
3504 1 4 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.774 -0.194 18329
3505 1 4 . 1 1 133 133 ILE C C 156 178.000 178.000 178.116 -0.116 18329
3506 1 4 . 1 1 133 133 ILE CA C 156 65.500 65.500 63.176 2.324 18329
3507 1 4 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.285 3.315 18329
3508 1 4 . 1 1 133 133 ILE H H 156 8.040 8.040 7.348 0.692 18329
3509 1 4 . 1 1 134 134 ALA N N 157 121.470 121.470 123.337 -1.867 18329
3510 1 4 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.921 -0.021 18329
3511 1 4 . 1 1 134 134 ALA C C 157 178.800 178.800 179.631 -0.831 18329
3512 1 4 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.211 0.089 18329
3513 1 4 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.115 -0.015 18329
3514 1 4 . 1 1 134 134 ALA H H 157 8.950 8.950 8.016 0.934 18329
3515 1 4 . 1 1 135 135 LYS N N 158 118.470 118.470 118.251 0.219 18329
3516 1 4 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.956 -0.046 18329
3517 1 4 . 1 1 135 135 LYS C C 158 179.300 179.300 178.963 0.337 18329
3518 1 4 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.297 0.203 18329
3519 1 4 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.422 -1.022 18329
3520 1 4 . 1 1 135 135 LYS H H 158 8.000 8.000 8.003 -0.003 18329
3521 1 4 . 1 1 136 136 LYS N N 159 118.000 118.000 118.886 -0.886 18329
3522 1 4 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.306 -0.256 18329
3523 1 4 . 1 1 136 136 LYS C C 159 180.200 180.200 179.536 0.664 18329
3524 1 4 . 1 1 136 136 LYS CA C 159 59.500 59.500 58.810 0.690 18329
3525 1 4 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.107 -1.207 18329
3526 1 4 . 1 1 136 136 LYS H H 159 7.530 7.530 8.103 -0.573 18329
3527 1 4 . 1 1 137 137 MET N N 160 120.990 120.990 119.561 1.429 18329
3528 1 4 . 1 1 137 137 MET HA H 160 3.800 3.800 4.076 -0.276 18329
3529 1 4 . 1 1 137 137 MET C C 160 177.400 177.400 178.159 -0.759 18329
3530 1 4 . 1 1 137 137 MET CA C 160 60.600 60.600 60.054 0.546 18329
3531 1 4 . 1 1 137 137 MET CB C 160 31.800 31.800 32.564 -0.764 18329
3532 1 4 . 1 1 137 137 MET H H 160 8.660 8.660 8.480 0.180 18329
3533 1 4 . 1 1 138 138 ARG N N 161 119.480 119.480 119.143 0.337 18329
3534 1 4 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.924 -0.124 18329
3535 1 4 . 1 1 138 138 ARG C C 161 177.900 177.900 178.543 -0.643 18329
3536 1 4 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.720 0.880 18329
3537 1 4 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.251 -0.451 18329
3538 1 4 . 1 1 138 138 ARG H H 161 9.280 9.280 7.981 1.300 18329
3539 1 4 . 1 1 139 139 GLU N N 162 118.700 118.700 119.096 -0.396 18329
3540 1 4 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.028 -0.028 18329
3541 1 4 . 1 1 139 139 GLU C C 162 179.100 179.100 178.677 0.423 18329
3542 1 4 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.252 0.548 18329
3543 1 4 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.533 -0.033 18329
3544 1 4 . 1 1 139 139 GLU H H 162 8.430 8.430 7.971 0.459 18329
3545 1 4 . 1 1 140 140 LYS N N 163 119.310 119.310 120.318 -1.008 18329
3546 1 4 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.102 0.108 18329
3547 1 4 . 1 1 140 140 LYS C C 163 177.900 177.900 179.167 -1.267 18329
3548 1 4 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.667 0.233 18329
3549 1 4 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.290 -1.190 18329
3550 1 4 . 1 1 140 140 LYS H H 163 7.440 7.440 7.867 -0.427 18329
3551 1 4 . 1 1 141 141 LEU N N 164 117.630 117.630 119.167 -1.537 18329
3552 1 4 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.028 -0.138 18329
3553 1 4 . 1 1 141 141 LEU C C 164 178.700 178.700 178.422 0.278 18329
3554 1 4 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.446 0.554 18329
3555 1 4 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.820 -0.320 18329
3556 1 4 . 1 1 141 141 LEU H H 164 8.180 8.180 7.873 0.307 18329
3557 1 4 . 1 1 142 142 GLN N N 165 117.710 117.710 119.155 -1.445 18329
3558 1 4 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.938 0.372 18329
3559 1 4 . 1 1 142 142 GLN C C 165 179.200 179.200 178.603 0.597 18329
3560 1 4 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.547 -1.047 18329
3561 1 4 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.586 -1.086 18329
3562 1 4 . 1 1 142 142 GLN H H 165 8.730 8.730 7.810 0.920 18329
3563 1 4 . 1 1 143 143 ARG N N 166 121.410 121.410 119.118 2.292 18329
3564 1 4 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.102 0.088 18329
3565 1 4 . 1 1 143 143 ARG C C 166 179.700 179.700 178.775 0.925 18329
3566 1 4 . 1 1 143 143 ARG CA C 166 59.800 59.800 58.960 0.840 18329
3567 1 4 . 1 1 143 143 ARG CB C 166 30.200 30.200 29.931 0.269 18329
3568 1 4 . 1 1 143 143 ARG H H 166 8.050 8.050 7.884 0.166 18329
3569 1 4 . 1 1 144 144 VAL N N 167 120.950 120.950 120.490 0.460 18329
3570 1 4 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.635 0.125 18329
3571 1 4 . 1 1 144 144 VAL C C 167 179.200 179.200 177.829 1.371 18329
3572 1 4 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.690 -0.290 18329
3573 1 4 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.588 0.512 18329
3574 1 4 . 1 1 144 144 VAL H H 167 8.190 8.190 7.524 0.666 18329
3575 1 4 . 1 1 145 145 HIS N N 168 123.520 123.520 118.539 4.981 18329
3576 1 4 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.494 -0.594 18329
3577 1 4 . 1 1 145 145 HIS C C 168 177.100 177.100 177.462 -0.362 18329
3578 1 4 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.368 1.932 18329
3579 1 4 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.183 -0.283 18329
3580 1 4 . 1 1 145 145 HIS H H 168 9.240 9.240 8.002 1.238 18329
3581 1 4 . 1 1 146 146 THR N N 169 115.020 115.020 117.594 -2.574 18329
3582 1 4 . 1 1 146 146 THR HA H 169 3.860 3.860 4.236 -0.376 18329
3583 1 4 . 1 1 146 146 THR C C 169 175.700 175.700 176.335 -0.635 18329
3584 1 4 . 1 1 146 146 THR CA C 169 67.200 67.200 67.050 0.150 18329
3585 1 4 . 1 1 146 146 THR CB C 169 69.300 69.300 68.720 0.580 18329
3586 1 4 . 1 1 146 146 THR H H 169 8.750 8.750 8.603 0.147 18329
3587 1 4 . 1 1 147 147 LYS N N 170 120.300 120.300 121.816 -1.516 18329
3588 1 4 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.999 0.001 18329
3589 1 4 . 1 1 147 147 LYS C C 170 179.300 179.300 178.912 0.388 18329
3590 1 4 . 1 1 147 147 LYS CA C 170 59.100 59.100 60.077 -0.977 18329
3591 1 4 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.212 -0.412 18329
3592 1 4 . 1 1 147 147 LYS H H 170 8.020 8.020 8.157 -0.137 18329
3593 1 4 . 1 1 148 148 ASN N N 171 117.600 117.600 117.999 -0.399 18329
3594 1 4 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.485 -0.165 18329
3595 1 4 . 1 1 148 148 ASN C C 171 175.400 175.400 177.553 -2.153 18329
3596 1 4 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.750 1.950 18329
3597 1 4 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.337 1.363 18329
3598 1 4 . 1 1 148 148 ASN H H 171 7.810 7.810 7.697 0.113 18329
3599 1 4 . 1 1 149 149 TYR N N 172 121.560 121.560 121.348 0.212 18329
3600 1 4 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.225 -0.335 18329
3601 1 4 . 1 1 149 149 TYR C C 172 176.900 176.900 177.488 -0.588 18329
3602 1 4 . 1 1 149 149 TYR CA C 172 61.500 61.500 62.062 -0.562 18329
3603 1 4 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.741 0.179 18329
3604 1 4 . 1 1 149 149 TYR H H 172 9.020 9.020 7.733 1.287 18329
3605 1 4 . 1 1 150 150 CYS N N 173 116.050 116.050 118.230 -2.180 18329
3606 1 4 . 1 1 150 150 CYS C C 173 177.100 177.100 176.453 0.647 18329
3607 1 4 . 1 1 150 150 CYS CA C 173 58.400 58.400 60.972 -2.572 18329
3608 1 4 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.194 12.406 18329
3609 1 4 . 1 1 150 150 CYS H H 173 8.810 8.810 8.609 0.201 18329
3610 1 4 . 1 1 151 151 THR N N 174 117.190 117.190 114.335 2.855 18329
3611 1 4 . 1 1 151 151 THR HA H 174 3.880 3.880 4.011 -0.131 18329
3612 1 4 . 1 1 151 151 THR C C 174 176.000 176.000 176.722 -0.722 18329
3613 1 4 . 1 1 151 151 THR CA C 174 66.900 66.900 65.237 1.663 18329
3614 1 4 . 1 1 151 151 THR CB C 174 68.500 68.500 68.324 0.176 18329
3615 1 4 . 1 1 151 151 THR H H 174 7.720 7.720 8.083 -0.363 18329
3616 1 4 . 1 1 152 152 LEU N N 175 123.110 123.110 123.311 -0.201 18329
3617 1 4 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.103 -0.293 18329
3618 1 4 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.312 0.688 18329
3619 1 4 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.600 -0.100 18329
3620 1 4 . 1 1 152 152 LEU H H 175 7.870 7.870 7.661 0.209 18329
3621 1 4 . 1 1 153 153 LYS N N 176 117.270 117.270 118.136 -0.866 18329
3622 1 4 . 1 1 153 153 LYS HA H 176 3.700 3.700 4.066 -0.366 18329
3623 1 4 . 1 1 153 153 LYS C C 176 179.100 179.100 177.403 1.697 18329
3624 1 4 . 1 1 153 153 LYS CA C 176 56.700 56.700 57.452 -0.752 18329
3625 1 4 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.294 -1.394 18329
3626 1 4 . 1 1 153 153 LYS H H 176 7.900 7.900 7.540 0.360 18329
3627 1 4 . 1 1 154 154 LYS N N 177 119.290 119.290 118.079 1.211 18329
3628 1 4 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.044 0.216 18329
3629 1 4 . 1 1 154 154 LYS C C 177 178.100 178.100 178.393 -0.293 18329
3630 1 4 . 1 1 154 154 LYS CA C 177 57.800 57.800 58.863 -1.063 18329
3631 1 4 . 1 1 154 154 LYS CB C 177 31.800 31.800 31.714 0.086 18329
3632 1 4 . 1 1 154 154 LYS H H 177 7.540 7.540 7.655 -0.115 18329
3633 1 4 . 1 1 155 155 LYS N N 178 118.910 118.910 119.168 -0.258 18329
3634 1 4 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.145 -0.095 18329
3635 1 4 . 1 1 155 155 LYS C C 178 178.100 178.100 178.865 -0.765 18329
3636 1 4 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.494 -0.494 18329
3637 1 4 . 1 1 155 155 LYS CB C 178 32.200 32.200 31.932 0.268 18329
3638 1 4 . 1 1 155 155 LYS H H 178 7.630 7.630 7.596 0.034 18329
3639 1 4 . 1 1 156 156 GLU N N 179 117.950 117.950 118.873 -0.923 18329
3640 1 4 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.170 -0.060 18329
3641 1 4 . 1 1 156 156 GLU C C 179 176.700 176.700 178.692 -1.992 18329
3642 1 4 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.546 -1.046 18329
3643 1 4 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.385 0.215 18329
3644 1 4 . 1 1 156 156 GLU H H 179 7.560 7.560 7.757 -0.197 18329
3645 1 4 . 1 1 157 157 ASN N N 180 116.590 116.590 115.744 0.846 18329
3646 1 4 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.625 0.095 18329
3647 1 4 . 1 1 157 157 ASN C C 180 175.000 175.000 176.769 -1.769 18329
3648 1 4 . 1 1 157 157 ASN CA C 180 52.700 52.700 54.497 -1.797 18329
3649 1 4 . 1 1 157 157 ASN CB C 180 38.800 38.800 38.943 -0.143 18329
3650 1 4 . 1 1 157 157 ASN H H 180 7.820 7.820 7.851 -0.031 18329
3651 1 4 . 1 1 158 158 SER HA H 181 4.450 4.450 4.138 0.312 18329
3652 1 4 . 1 1 158 158 SER CA C 181 60.400 60.400 60.192 0.208 18329
3653 1 4 . 1 1 158 158 SER CB C 181 63.500 63.500 61.658 1.842 18329
3654 1 4 . 1 1 158 158 SER H H 181 8.030 8.030 8.340 -0.310 18329
3655 1 4 . 1 1 159 159 THR N N 182 112.800 112.800 113.430 -0.630 18329
3656 1 4 . 1 1 159 159 THR HA H 182 4.380 4.380 4.520 -0.140 18329
3657 1 4 . 1 1 159 159 THR C C 182 174.300 174.300 174.202 0.098 18329
3658 1 4 . 1 1 159 159 THR CA C 182 61.800 61.800 61.801 -0.001 18329
3659 1 4 . 1 1 159 159 THR CB C 182 69.100 69.100 70.015 -0.915 18329
3660 1 4 . 1 1 159 159 THR H H 182 8.070 8.070 8.171 -0.101 18329
3661 1 4 . 1 1 160 160 PHE N N 183 123.120 123.120 113.547 9.573 18329
3662 1 4 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.848 -0.408 18329
3663 1 4 . 1 1 160 160 PHE C C 183 175.100 175.100 174.982 0.118 18329
3664 1 4 . 1 1 160 160 PHE CA C 183 58.900 58.900 57.901 0.999 18329
3665 1 4 . 1 1 160 160 PHE CB C 183 40.000 40.000 39.156 0.844 18329
3666 1 4 . 1 1 160 160 PHE H H 183 7.900 7.900 7.777 0.123 18329
3667 1 4 . 1 1 161 161 THR N N 184 119.330 119.330 114.938 4.392 18329
3668 1 4 . 1 1 161 161 THR HA H 184 4.190 4.190 4.206 -0.016 18329
3669 1 4 . 1 1 161 161 THR CA C 184 60.700 60.700 61.909 -1.209 18329
3670 1 4 . 1 1 161 161 THR CB C 184 70.700 70.700 69.957 0.743 18329
3671 1 4 . 1 1 161 161 THR H H 184 7.810 7.810 5.991 1.819 18329
3672 1 4 . 1 1 162 162 ASP N N 185 123.190 123.190 121.037 2.153 18329
3673 1 4 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.332 0.078 18329
3674 1 4 . 1 1 162 162 ASP C C 185 176.900 176.900 174.674 2.226 18329
3675 1 4 . 1 1 162 162 ASP CA C 185 53.900 53.900 55.432 -1.532 18329
3676 1 4 . 1 1 162 162 ASP CB C 185 44.000 44.000 40.619 3.381 18329
3677 1 4 . 1 1 162 162 ASP H H 185 8.000 8.000 8.651 -0.651 18329
3678 1 4 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.466 0.014 18329
3679 1 4 . 1 1 163 163 GLU CA C 186 58.800 58.800 56.176 2.624 18329
3680 1 4 . 1 1 163 163 GLU CB C 186 28.100 28.100 31.826 -3.726 18329
3681 1 4 . 1 1 166 166 LYS N N 189 118.150 118.150 119.748 -1.598 18329
3682 1 4 . 1 1 166 166 LYS HA H 189 4.220 4.220 3.885 0.335 18329
3683 1 4 . 1 1 166 166 LYS C C 189 177.500 177.500 174.757 2.743 18329
3684 1 4 . 1 1 166 166 LYS CA C 189 58.000 58.000 57.128 0.872 18329
3685 1 4 . 1 1 166 166 LYS CB C 189 32.600 32.600 30.837 1.763 18329
3686 1 4 . 1 1 166 166 LYS H H 189 8.890 8.890 8.531 0.359 18329
3687 1 4 . 1 1 167 167 ASN N N 190 116.210 116.210 118.874 -2.664 18329
3688 1 4 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.686 0.274 18329
3689 1 4 . 1 1 167 167 ASN C C 190 174.900 174.900 174.017 0.883 18329
3690 1 4 . 1 1 167 167 ASN CA C 190 52.900 52.900 52.633 0.267 18329
3691 1 4 . 1 1 167 167 ASN CB C 190 38.400 38.400 39.088 -0.688 18329
3692 1 4 . 1 1 167 167 ASN H H 190 8.030 8.030 8.058 -0.028 18329
3693 1 5 . 1 1 2 2 ALA N N 25 125.000 125.000 124.928 0.072 18329
3694 1 5 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.402 -0.032 18329
3695 1 5 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.853 -0.553 18329
3696 1 5 . 1 1 2 2 ALA CB C 25 19.700 19.700 19.892 -0.192 18329
3697 1 5 . 1 1 2 2 ALA H H 25 8.690 8.690 8.275 0.415 18329
3698 1 5 . 1 1 3 3 GLY N N 26 106.920 106.920 108.156 -1.236 18329
3699 1 5 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.296 -1.296 18329
3700 1 5 . 1 1 3 3 GLY H H 26 7.940 7.940 8.094 -0.154 18329
3701 1 5 . 1 1 4 4 LEU N N 27 119.140 119.140 123.945 -4.805 18329
3702 1 5 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.286 0.124 18329
3703 1 5 . 1 1 4 4 LEU C C 27 177.100 177.100 176.518 0.582 18329
3704 1 5 . 1 1 4 4 LEU CA C 27 54.400 54.400 56.515 -2.115 18329
3705 1 5 . 1 1 4 4 LEU CB C 27 42.100 42.100 42.498 -0.398 18329
3706 1 5 . 1 1 4 4 LEU H H 27 8.210 8.210 8.059 0.151 18329
3707 1 5 . 1 1 5 5 THR N N 28 112.940 112.940 108.709 4.231 18329
3708 1 5 . 1 1 5 5 THR HA H 28 4.650 4.650 4.054 0.596 18329
3709 1 5 . 1 1 5 5 THR C C 28 175.500 175.500 174.726 0.774 18329
3710 1 5 . 1 1 5 5 THR CA C 28 60.100 60.100 62.187 -2.087 18329
3711 1 5 . 1 1 5 5 THR CB C 28 72.600 72.600 67.182 5.418 18329
3712 1 5 . 1 1 5 5 THR H H 28 9.220 9.220 7.821 1.399 18329
3713 1 5 . 1 1 6 6 GLY N N 29 108.230 108.230 109.651 -1.421 18329
3714 1 5 . 1 1 6 6 GLY C C 29 174.800 174.800 175.564 -0.764 18329
3715 1 5 . 1 1 6 6 GLY CA C 29 46.000 46.000 44.660 1.340 18329
3716 1 5 . 1 1 6 6 GLY H H 29 8.520 8.520 8.391 0.129 18329
3717 1 5 . 1 1 7 7 ALA HA H 30 4.040 4.040 3.899 0.141 18329
3718 1 5 . 1 1 7 7 ALA CA C 30 54.800 54.800 54.399 0.401 18329
3719 1 5 . 1 1 7 7 ALA CB C 30 18.200 18.200 17.561 0.638 18329
3720 1 5 . 1 1 8 8 THR N N 31 116.970 116.970 117.941 -0.971 18329
3721 1 5 . 1 1 8 8 THR HA H 31 3.740 3.740 3.907 -0.167 18329
3722 1 5 . 1 1 8 8 THR C C 31 175.300 175.300 176.426 -1.126 18329
3723 1 5 . 1 1 8 8 THR CA C 31 67.000 67.000 66.659 0.341 18329
3724 1 5 . 1 1 8 8 THR CB C 31 68.700 68.700 68.451 0.249 18329
3725 1 5 . 1 1 8 8 THR H H 31 8.110 8.110 8.164 -0.054 18329
3726 1 5 . 1 1 9 9 LYS N N 32 120.540 120.540 121.513 -0.973 18329
3727 1 5 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.008 -0.418 18329
3728 1 5 . 1 1 9 9 LYS C C 32 176.900 176.900 178.415 -1.515 18329
3729 1 5 . 1 1 9 9 LYS CA C 32 59.800 59.800 58.694 1.106 18329
3730 1 5 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.774 0.626 18329
3731 1 5 . 1 1 9 9 LYS H H 32 6.860 6.860 7.658 -0.798 18329
3732 1 5 . 1 1 10 10 ILE N N 33 115.940 115.940 119.683 -3.743 18329
3733 1 5 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.656 0.054 18329
3734 1 5 . 1 1 10 10 ILE C C 33 179.000 179.000 178.121 0.879 18329
3735 1 5 . 1 1 10 10 ILE CA C 33 64.000 64.000 65.883 -1.883 18329
3736 1 5 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.649 0.351 18329
3737 1 5 . 1 1 10 10 ILE H H 33 7.380 7.380 8.451 -1.071 18329
3738 1 5 . 1 1 11 11 ARG N N 34 118.350 118.350 119.054 -0.704 18329
3739 1 5 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.054 -0.014 18329
3740 1 5 . 1 1 11 11 ARG C C 34 180.000 180.000 179.240 0.760 18329
3741 1 5 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.388 0.012 18329
3742 1 5 . 1 1 11 11 ARG CB C 34 30.300 30.300 29.923 0.377 18329
3743 1 5 . 1 1 11 11 ARG H H 34 8.250 8.250 7.712 0.538 18329
3744 1 5 . 1 1 12 12 LEU N N 35 117.420 117.420 120.552 -3.132 18329
3745 1 5 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.184 -0.014 18329
3746 1 5 . 1 1 12 12 LEU C C 35 179.000 179.000 179.043 -0.043 18329
3747 1 5 . 1 1 12 12 LEU CA C 35 58.000 58.000 58.109 -0.109 18329
3748 1 5 . 1 1 12 12 LEU CB C 35 40.800 40.800 40.974 -0.174 18329
3749 1 5 . 1 1 12 12 LEU H H 35 8.340 8.340 7.639 0.701 18329
3750 1 5 . 1 1 13 13 GLU N N 36 117.890 117.890 119.773 -1.883 18329
3751 1 5 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.989 0.031 18329
3752 1 5 . 1 1 13 13 GLU C C 36 180.100 180.100 179.016 1.084 18329
3753 1 5 . 1 1 13 13 GLU CA C 36 60.200 60.200 60.005 0.195 18329
3754 1 5 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.667 -1.367 18329
3755 1 5 . 1 1 13 13 GLU H H 36 8.610 8.610 8.890 -0.280 18329
3756 1 5 . 1 1 14 14 ARG N N 37 121.100 121.100 119.563 1.537 18329
3757 1 5 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.058 0.182 18329
3758 1 5 . 1 1 14 14 ARG C C 37 178.100 178.100 178.708 -0.608 18329
3759 1 5 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.524 -1.024 18329
3760 1 5 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.312 -0.112 18329
3761 1 5 . 1 1 14 14 ARG H H 37 7.980 7.980 8.662 -0.682 18329
3762 1 5 . 1 1 15 15 SER N N 38 115.420 115.420 114.136 1.284 18329
3763 1 5 . 1 1 15 15 SER HA H 38 4.380 4.380 4.358 0.022 18329
3764 1 5 . 1 1 15 15 SER C C 38 177.300 177.300 176.068 1.232 18329
3765 1 5 . 1 1 15 15 SER CA C 38 62.200 62.200 60.975 1.224 18329
3766 1 5 . 1 1 15 15 SER CB C 38 63.200 63.200 63.164 0.036 18329
3767 1 5 . 1 1 15 15 SER H H 38 8.230 8.230 8.370 -0.140 18329
3768 1 5 . 1 1 16 16 ALA N N 39 123.970 123.970 124.184 -0.214 18329
3769 1 5 . 1 1 16 16 ALA HA H 39 3.630 3.630 3.838 -0.208 18329
3770 1 5 . 1 1 16 16 ALA C C 39 179.500 179.500 180.108 -0.608 18329
3771 1 5 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.925 -0.225 18329
3772 1 5 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.469 -0.469 18329
3773 1 5 . 1 1 16 16 ALA H H 39 8.280 8.280 8.434 -0.154 18329
3774 1 5 . 1 1 17 17 LYS N N 40 121.690 121.690 118.300 3.390 18329
3775 1 5 . 1 1 17 17 LYS HA H 40 4.090 4.090 4.015 0.075 18329
3776 1 5 . 1 1 17 17 LYS C C 40 178.000 178.000 178.288 -0.288 18329
3777 1 5 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.008 -0.608 18329
3778 1 5 . 1 1 17 17 LYS CB C 40 31.800 31.800 31.666 0.134 18329
3779 1 5 . 1 1 17 17 LYS H H 40 7.930 7.930 8.304 -0.374 18329
3780 1 5 . 1 1 18 18 ASP N N 41 118.730 118.730 119.557 -0.827 18329
3781 1 5 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.495 -0.135 18329
3782 1 5 . 1 1 18 18 ASP C C 41 179.900 179.900 178.648 1.252 18329
3783 1 5 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.660 1.040 18329
3784 1 5 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.288 -0.689 18329
3785 1 5 . 1 1 18 18 ASP H H 41 8.320 8.320 7.693 0.627 18329
3786 1 5 . 1 1 19 19 ILE N N 42 118.180 118.180 120.234 -2.054 18329
3787 1 5 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.655 0.035 18329
3788 1 5 . 1 1 19 19 ILE C C 42 177.400 177.400 177.821 -0.421 18329
3789 1 5 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.396 -0.196 18329
3790 1 5 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.675 0.225 18329
3791 1 5 . 1 1 19 19 ILE H H 42 7.420 7.420 7.977 -0.557 18329
3792 1 5 . 1 1 20 20 THR N N 43 113.360 113.360 113.046 0.314 18329
3793 1 5 . 1 1 20 20 THR HA H 43 3.770 3.770 4.055 -0.285 18329
3794 1 5 . 1 1 20 20 THR C C 43 177.800 177.800 176.491 1.309 18329
3795 1 5 . 1 1 20 20 THR CA C 43 66.400 66.400 65.660 0.740 18329
3796 1 5 . 1 1 20 20 THR CB C 43 67.400 67.400 68.183 -0.783 18329
3797 1 5 . 1 1 20 20 THR H H 43 7.610 7.610 7.568 0.042 18329
3798 1 5 . 1 1 21 21 ASP N N 44 123.650 123.650 122.402 1.248 18329
3799 1 5 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.385 0.025 18329
3800 1 5 . 1 1 21 21 ASP C C 44 179.200 179.200 178.381 0.819 18329
3801 1 5 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.482 -0.282 18329
3802 1 5 . 1 1 21 21 ASP CB C 44 39.600 39.600 39.916 -0.316 18329
3803 1 5 . 1 1 21 21 ASP H H 44 9.260 9.260 8.131 1.129 18329
3804 1 5 . 1 1 22 22 GLU N N 45 123.560 123.560 119.888 3.672 18329
3805 1 5 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.173 0.197 18329
3806 1 5 . 1 1 22 22 GLU C C 45 178.500 178.500 179.092 -0.592 18329
3807 1 5 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.860 -0.660 18329
3808 1 5 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.811 -0.611 18329
3809 1 5 . 1 1 22 22 GLU H H 45 7.750 7.750 7.800 -0.050 18329
3810 1 5 . 1 1 23 23 ILE N N 46 119.940 119.940 114.759 5.181 18329
3811 1 5 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.754 -0.134 18329
3812 1 5 . 1 1 23 23 ILE C C 46 177.600 177.600 177.837 -0.237 18329
3813 1 5 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.227 1.373 18329
3814 1 5 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.391 -0.391 18329
3815 1 5 . 1 1 23 23 ILE H H 46 8.360 8.360 7.340 1.020 18329
3816 1 5 . 1 1 24 24 ASP N N 47 120.730 120.730 120.687 0.043 18329
3817 1 5 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.343 0.057 18329
3818 1 5 . 1 1 24 24 ASP C C 47 178.900 178.900 178.296 0.604 18329
3819 1 5 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.068 0.432 18329
3820 1 5 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.858 -0.958 18329
3821 1 5 . 1 1 24 24 ASP H H 47 8.280 8.280 8.347 -0.067 18329
3822 1 5 . 1 1 25 25 ALA N N 48 123.870 123.870 121.715 2.155 18329
3823 1 5 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.086 0.034 18329
3824 1 5 . 1 1 25 25 ALA C C 48 180.400 180.400 179.342 1.058 18329
3825 1 5 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.667 0.833 18329
3826 1 5 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.158 -0.358 18329
3827 1 5 . 1 1 25 25 ALA H H 48 7.880 7.880 7.563 0.317 18329
3828 1 5 . 1 1 26 26 ILE N N 49 121.970 121.970 118.015 3.955 18329
3829 1 5 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.991 -0.261 18329
3830 1 5 . 1 1 26 26 ILE C C 49 178.400 178.400 178.221 0.179 18329
3831 1 5 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.771 1.129 18329
3832 1 5 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.754 -0.254 18329
3833 1 5 . 1 1 26 26 ILE H H 49 8.710 8.710 7.403 1.307 18329
3834 1 5 . 1 1 27 27 LYS N N 50 119.820 119.820 118.487 1.333 18329
3835 1 5 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.864 0.016 18329
3836 1 5 . 1 1 27 27 LYS C C 50 179.900 179.900 178.659 1.241 18329
3837 1 5 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.712 0.689 18329
3838 1 5 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.762 0.138 18329
3839 1 5 . 1 1 27 27 LYS H H 50 8.540 8.540 7.789 0.751 18329
3840 1 5 . 1 1 28 28 LYS N N 51 121.960 121.960 119.936 2.024 18329
3841 1 5 . 1 1 28 28 LYS HA H 51 4.090 4.090 4.011 0.079 18329
3842 1 5 . 1 1 28 28 LYS C C 51 179.200 179.200 179.140 0.060 18329
3843 1 5 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.240 0.059 18329
3844 1 5 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.349 -0.949 18329
3845 1 5 . 1 1 28 28 LYS H H 51 8.070 8.070 7.484 0.586 18329
3846 1 5 . 1 1 29 29 ASP N N 52 121.710 121.710 118.066 3.644 18329
3847 1 5 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.474 -0.004 18329
3848 1 5 . 1 1 29 29 ASP C C 52 178.500 178.500 177.779 0.721 18329
3849 1 5 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.449 0.551 18329
3850 1 5 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.254 0.746 18329
3851 1 5 . 1 1 29 29 ASP H H 52 8.340 8.340 7.916 0.424 18329
3852 1 5 . 1 1 30 30 ALA N N 53 121.990 121.990 121.546 0.444 18329
3853 1 5 . 1 1 30 30 ALA HA H 53 3.340 3.340 3.959 -0.619 18329
3854 1 5 . 1 1 30 30 ALA C C 53 179.500 179.500 179.465 0.035 18329
3855 1 5 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.279 0.821 18329
3856 1 5 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.414 -0.314 18329
3857 1 5 . 1 1 30 30 ALA H H 53 8.800 8.800 7.703 1.097 18329
3858 1 5 . 1 1 31 31 ALA N N 54 119.970 119.970 120.781 -0.811 18329
3859 1 5 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.067 0.083 18329
3860 1 5 . 1 1 31 31 ALA C C 54 181.600 181.600 178.591 3.009 18329
3861 1 5 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.224 0.476 18329
3862 1 5 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.230 -0.430 18329
3863 1 5 . 1 1 31 31 ALA H H 54 7.730 7.730 7.432 0.298 18329
3864 1 5 . 1 1 32 32 LEU N N 55 119.660 119.660 117.162 2.498 18329
3865 1 5 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.044 0.096 18329
3866 1 5 . 1 1 32 32 LEU C C 55 179.100 179.100 177.485 1.615 18329
3867 1 5 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.437 0.563 18329
3868 1 5 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.918 -0.018 18329
3869 1 5 . 1 1 32 32 LEU H H 55 7.660 7.660 7.248 0.412 18329
3870 1 5 . 1 1 33 33 LYS N N 56 117.160 117.160 117.092 0.068 18329
3871 1 5 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.461 -0.251 18329
3872 1 5 . 1 1 33 33 LYS C C 56 176.600 176.600 176.630 -0.030 18329
3873 1 5 . 1 1 33 33 LYS CA C 56 56.100 56.100 54.544 1.556 18329
3874 1 5 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.258 -0.058 18329
3875 1 5 . 1 1 33 33 LYS H H 56 7.610 7.610 7.400 0.210 18329
3876 1 5 . 1 1 34 34 GLY N N 57 108.680 108.680 111.253 -2.573 18329
3877 1 5 . 1 1 34 34 GLY C C 57 174.400 174.400 173.943 0.457 18329
3878 1 5 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.140 1.060 18329
3879 1 5 . 1 1 34 34 GLY H H 57 7.710 7.710 8.580 -0.870 18329
3880 1 5 . 1 1 35 35 VAL N N 58 121.000 121.000 122.903 -1.903 18329
3881 1 5 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.279 -0.379 18329
3882 1 5 . 1 1 35 35 VAL C C 58 174.200 174.200 175.474 -1.274 18329
3883 1 5 . 1 1 35 35 VAL CA C 58 61.500 61.500 60.579 0.921 18329
3884 1 5 . 1 1 35 35 VAL CB C 58 32.800 32.800 33.283 -0.483 18329
3885 1 5 . 1 1 35 35 VAL H H 58 7.990 7.990 7.885 0.105 18329
3886 1 5 . 1 1 36 36 ASN N N 59 124.960 124.960 126.742 -1.782 18329
3887 1 5 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.653 0.017 18329
3888 1 5 . 1 1 36 36 ASN C C 59 175.700 175.700 175.279 0.421 18329
3889 1 5 . 1 1 36 36 ASN CA C 59 51.600 51.600 53.646 -2.046 18329
3890 1 5 . 1 1 36 36 ASN CB C 59 39.100 39.100 38.446 0.654 18329
3891 1 5 . 1 1 36 36 ASN H H 59 8.460 8.460 8.707 -0.247 18329
3892 1 5 . 1 1 37 37 PHE N N 60 124.460 124.460 124.662 -0.202 18329
3893 1 5 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.142 -0.002 18329
3894 1 5 . 1 1 37 37 PHE C C 60 177.000 177.000 176.021 0.979 18329
3895 1 5 . 1 1 37 37 PHE CA C 60 60.400 60.400 60.667 -0.267 18329
3896 1 5 . 1 1 37 37 PHE CB C 60 39.200 39.200 39.616 -0.416 18329
3897 1 5 . 1 1 37 37 PHE H H 60 8.780 8.780 8.324 0.456 18329
3898 1 5 . 1 1 38 38 ASP N N 61 119.270 119.270 118.784 0.486 18329
3899 1 5 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.475 0.015 18329
3900 1 5 . 1 1 38 38 ASP C C 61 177.000 177.000 177.676 -0.676 18329
3901 1 5 . 1 1 38 38 ASP CA C 61 55.500 55.500 54.637 0.863 18329
3902 1 5 . 1 1 38 38 ASP CB C 61 40.000 40.000 41.067 -1.067 18329
3903 1 5 . 1 1 38 38 ASP H H 61 8.400 8.400 7.953 0.447 18329
3904 1 5 . 1 1 39 39 ALA N N 62 122.020 122.020 119.621 2.399 18329
3905 1 5 . 1 1 39 39 ALA HA H 62 4.200 4.200 3.988 0.212 18329
3906 1 5 . 1 1 39 39 ALA C C 62 178.300 178.300 177.390 0.910 18329
3907 1 5 . 1 1 39 39 ALA CA C 62 52.900 52.900 53.902 -1.002 18329
3908 1 5 . 1 1 39 39 ALA CB C 62 18.500 18.500 17.595 0.905 18329
3909 1 5 . 1 1 39 39 ALA H H 62 7.740 7.740 8.568 -0.828 18329
3910 1 5 . 1 1 40 40 PHE N N 63 116.940 116.940 121.852 -4.912 18329
3911 1 5 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.396 -0.016 18329
3912 1 5 . 1 1 40 40 PHE C C 63 176.100 176.100 174.849 1.251 18329
3913 1 5 . 1 1 40 40 PHE CA C 63 58.300 58.300 59.308 -1.008 18329
3914 1 5 . 1 1 40 40 PHE CB C 63 38.800 38.800 39.782 -0.982 18329
3915 1 5 . 1 1 40 40 PHE H H 63 7.730 7.730 8.161 -0.431 18329
3916 1 5 . 1 1 41 41 LYS N N 64 119.840 119.840 125.522 -5.682 18329
3917 1 5 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.191 0.029 18329
3918 1 5 . 1 1 41 41 LYS C C 64 176.100 176.100 174.782 1.318 18329
3919 1 5 . 1 1 41 41 LYS CA C 64 56.600 56.600 56.334 0.265 18329
3920 1 5 . 1 1 41 41 LYS CB C 64 32.900 32.900 33.904 -1.004 18329
3921 1 5 . 1 1 41 41 LYS H H 64 7.650 7.650 7.436 0.214 18329
3922 1 5 . 1 1 42 42 ASP N N 65 120.770 120.770 117.798 2.972 18329
3923 1 5 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.344 0.226 18329
3924 1 5 . 1 1 42 42 ASP C C 65 176.100 176.100 174.979 1.121 18329
3925 1 5 . 1 1 42 42 ASP CA C 65 54.200 54.200 54.670 -0.470 18329
3926 1 5 . 1 1 42 42 ASP CB C 65 40.900 40.900 41.534 -0.634 18329
3927 1 5 . 1 1 42 42 ASP H H 65 8.030 8.030 8.158 -0.128 18329
3928 1 5 . 1 1 43 43 LYS N N 66 122.070 122.070 121.582 0.488 18329
3929 1 5 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.137 0.143 18329
3930 1 5 . 1 1 43 43 LYS C C 66 176.800 176.800 176.291 0.509 18329
3931 1 5 . 1 1 43 43 LYS CA C 66 56.500 56.500 57.348 -0.848 18329
3932 1 5 . 1 1 43 43 LYS CB C 66 32.800 32.800 31.588 1.212 18329
3933 1 5 . 1 1 43 43 LYS H H 66 8.180 8.180 8.218 -0.038 18329
3934 1 5 . 1 1 44 44 LYS N N 67 122.170 122.170 124.263 -2.093 18329
3935 1 5 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.479 -0.129 18329
3936 1 5 . 1 1 44 44 LYS C C 67 177.000 177.000 177.143 -0.143 18329
3937 1 5 . 1 1 44 44 LYS CA C 67 56.600 56.600 55.326 1.274 18329
3938 1 5 . 1 1 44 44 LYS CB C 67 32.800 32.800 34.644 -1.844 18329
3939 1 5 . 1 1 44 44 LYS H H 67 8.460 8.460 7.956 0.504 18329
3940 1 5 . 1 1 45 45 THR N N 68 114.390 114.390 116.781 -2.391 18329
3941 1 5 . 1 1 45 45 THR HA H 68 4.330 4.330 4.150 0.180 18329
3942 1 5 . 1 1 45 45 THR C C 68 175.200 175.200 175.293 -0.093 18329
3943 1 5 . 1 1 45 45 THR CA C 68 62.000 62.000 63.888 -1.888 18329
3944 1 5 . 1 1 45 45 THR CB C 68 69.900 69.900 68.969 0.931 18329
3945 1 5 . 1 1 45 45 THR H H 68 8.120 8.120 8.643 -0.523 18329
3946 1 5 . 1 1 46 46 GLY N N 69 111.200 111.200 109.332 1.868 18329
3947 1 5 . 1 1 46 46 GLY CA C 69 45.200 45.200 44.623 0.577 18329
3948 1 5 . 1 1 46 46 GLY H H 69 8.450 8.450 7.978 0.472 18329
3949 1 5 . 1 1 47 47 SER CA C 70 58.400 58.400 59.046 -0.646 18329
3950 1 5 . 1 1 47 47 SER CB C 70 64.000 64.000 63.087 0.913 18329
3951 1 5 . 1 1 48 48 GLY N N 71 111.200 111.200 107.808 3.392 18329
3952 1 5 . 1 1 48 48 GLY CA C 71 45.000 45.000 45.748 -0.748 18329
3953 1 5 . 1 1 48 48 GLY H H 71 8.580 8.580 8.608 -0.028 18329
3954 1 5 . 1 1 49 49 VAL N N 72 118.910 118.910 120.416 -1.506 18329
3955 1 5 . 1 1 49 49 VAL HA H 72 4.130 4.130 4.099 0.031 18329
3956 1 5 . 1 1 49 49 VAL C C 72 176.100 176.100 175.405 0.695 18329
3957 1 5 . 1 1 49 49 VAL CA C 72 62.100 62.100 62.222 -0.122 18329
3958 1 5 . 1 1 49 49 VAL CB C 72 32.500 32.500 32.160 0.341 18329
3959 1 5 . 1 1 49 49 VAL H H 72 7.860 7.860 7.625 0.235 18329
3960 1 5 . 1 1 50 50 SER N N 73 118.500 118.500 119.259 -0.759 18329
3961 1 5 . 1 1 50 50 SER C C 73 176.100 176.100 173.132 2.968 18329
3962 1 5 . 1 1 50 50 SER CA C 73 58.300 58.300 59.254 -0.954 18329
3963 1 5 . 1 1 50 50 SER CB C 73 63.800 63.800 63.657 0.143 18329
3964 1 5 . 1 1 50 50 SER H H 73 8.300 8.300 8.168 0.132 18329
3965 1 5 . 1 1 51 51 GLU N N 74 122.560 122.560 118.914 3.646 18329
3966 1 5 . 1 1 51 51 GLU HA H 74 4.270 4.270 3.942 0.328 18329
3967 1 5 . 1 1 51 51 GLU CA C 74 55.700 55.700 57.215 -1.515 18329
3968 1 5 . 1 1 51 51 GLU CB C 74 30.500 30.500 29.115 1.385 18329
3969 1 5 . 1 1 51 51 GLU H H 74 8.360 8.360 8.546 -0.186 18329
3970 1 5 . 1 1 52 52 ASN N N 75 122.830 122.830 120.879 1.951 18329
3971 1 5 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.473 0.347 18329
3972 1 5 . 1 1 52 52 ASN C C 75 174.800 174.800 175.313 -0.513 18329
3973 1 5 . 1 1 52 52 ASN CA C 75 51.400 51.400 53.672 -2.272 18329
3974 1 5 . 1 1 52 52 ASN CB C 75 39.200 39.200 38.780 0.420 18329
3975 1 5 . 1 1 52 52 ASN H H 75 8.450 8.450 8.472 -0.022 18329
3976 1 5 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.379 -0.199 18329
3977 1 5 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.051 1.149 18329
3978 1 5 . 1 1 53 53 PRO CB C 76 32.000 32.000 31.808 0.192 18329
3979 1 5 . 1 1 54 54 PHE N N 77 118.060 118.060 120.369 -2.309 18329
3980 1 5 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.179 0.091 18329
3981 1 5 . 1 1 54 54 PHE C C 77 177.500 177.500 177.039 0.461 18329
3982 1 5 . 1 1 54 54 PHE CA C 77 61.500 61.500 62.107 -0.607 18329
3983 1 5 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.318 0.082 18329
3984 1 5 . 1 1 54 54 PHE H H 77 8.430 8.430 8.011 0.419 18329
3985 1 5 . 1 1 55 55 ILE N N 78 119.350 119.350 118.360 0.990 18329
3986 1 5 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.402 0.098 18329
3987 1 5 . 1 1 55 55 ILE C C 78 177.400 177.400 177.199 0.201 18329
3988 1 5 . 1 1 55 55 ILE CA C 78 63.500 63.500 64.482 -0.982 18329
3989 1 5 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.287 -0.287 18329
3990 1 5 . 1 1 55 55 ILE H H 78 7.540 7.540 7.427 0.113 18329
3991 1 5 . 1 1 56 56 LEU N N 79 118.450 118.450 119.603 -1.153 18329
3992 1 5 . 1 1 56 56 LEU HA H 79 4.150 4.150 3.680 0.470 18329
3993 1 5 . 1 1 56 56 LEU C C 79 179.200 179.200 179.056 0.144 18329
3994 1 5 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.395 -0.595 18329
3995 1 5 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.234 -0.134 18329
3996 1 5 . 1 1 56 56 LEU H H 79 7.260 7.260 7.729 -0.469 18329
3997 1 5 . 1 1 57 57 GLU N N 80 117.980 117.980 117.275 0.705 18329
3998 1 5 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.828 -0.178 18329
3999 1 5 . 1 1 57 57 GLU C C 80 178.700 178.700 178.802 -0.102 18329
4000 1 5 . 1 1 57 57 GLU CA C 80 59.300 59.300 58.921 0.379 18329
4001 1 5 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.336 0.164 18329
4002 1 5 . 1 1 57 57 GLU H H 80 7.890 7.890 7.849 0.041 18329
4003 1 5 . 1 1 58 58 ALA N N 81 122.040 122.040 122.433 -0.393 18329
4004 1 5 . 1 1 58 58 ALA HA H 81 3.800 3.800 3.893 -0.093 18329
4005 1 5 . 1 1 58 58 ALA C C 81 179.500 179.500 178.991 0.509 18329
4006 1 5 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.780 0.420 18329
4007 1 5 . 1 1 58 58 ALA CB C 81 18.800 18.800 17.940 0.860 18329
4008 1 5 . 1 1 58 58 ALA H H 81 8.400 8.400 7.484 0.916 18329
4009 1 5 . 1 1 59 59 LYS N N 82 116.000 116.000 117.870 -1.870 18329
4010 1 5 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.010 -0.160 18329
4011 1 5 . 1 1 59 59 LYS C C 82 180.300 180.300 178.631 1.669 18329
4012 1 5 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.232 1.868 18329
4013 1 5 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.471 -0.271 18329
4014 1 5 . 1 1 59 59 LYS H H 82 8.000 8.000 7.845 0.155 18329
4015 1 5 . 1 1 60 60 VAL N N 83 122.920 122.920 118.132 4.788 18329
4016 1 5 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.709 -0.379 18329
4017 1 5 . 1 1 60 60 VAL C C 83 178.300 178.300 178.659 -0.359 18329
4018 1 5 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.891 2.009 18329
4019 1 5 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.588 -0.388 18329
4020 1 5 . 1 1 60 60 VAL H H 83 8.110 8.110 7.394 0.716 18329
4021 1 5 . 1 1 61 61 ARG N N 84 121.770 121.770 120.030 1.740 18329
4022 1 5 . 1 1 61 61 ARG C C 84 179.500 179.500 178.276 1.224 18329
4023 1 5 . 1 1 61 61 ARG CA C 84 59.200 59.200 58.393 0.807 18329
4024 1 5 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.022 1.778 18329
4025 1 5 . 1 1 61 61 ARG H H 84 8.710 8.710 7.627 1.083 18329
4026 1 5 . 1 1 62 62 ALA N N 85 119.450 119.450 121.315 -1.865 18329
4027 1 5 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.173 -0.283 18329
4028 1 5 . 1 1 62 62 ALA C C 85 179.500 179.500 178.884 0.616 18329
4029 1 5 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.391 -0.391 18329
4030 1 5 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.409 0.591 18329
4031 1 5 . 1 1 62 62 ALA H H 85 8.700 8.700 7.458 1.242 18329
4032 1 5 . 1 1 63 63 THR N N 86 106.650 106.650 109.476 -2.826 18329
4033 1 5 . 1 1 63 63 THR HA H 86 3.970 3.970 4.084 -0.114 18329
4034 1 5 . 1 1 63 63 THR C C 86 177.700 177.700 176.585 1.115 18329
4035 1 5 . 1 1 63 63 THR CA C 86 66.000 66.000 65.260 0.740 18329
4036 1 5 . 1 1 63 63 THR CB C 86 68.200 68.200 68.514 -0.314 18329
4037 1 5 . 1 1 63 63 THR H H 86 8.150 8.150 7.726 0.424 18329
4038 1 5 . 1 1 64 64 THR N N 87 120.430 120.430 119.502 0.928 18329
4039 1 5 . 1 1 64 64 THR HA H 87 4.050 4.050 4.113 -0.063 18329
4040 1 5 . 1 1 64 64 THR C C 87 176.800 176.800 176.281 0.519 18329
4041 1 5 . 1 1 64 64 THR CA C 87 67.300 67.300 67.336 -0.036 18329
4042 1 5 . 1 1 64 64 THR CB C 87 68.600 68.600 68.505 0.095 18329
4043 1 5 . 1 1 64 64 THR H H 87 7.920 7.920 7.485 0.435 18329
4044 1 5 . 1 1 65 65 VAL N N 88 119.230 119.230 120.640 -1.410 18329
4045 1 5 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.740 0.240 18329
4046 1 5 . 1 1 65 65 VAL C C 88 178.500 178.500 177.609 0.891 18329
4047 1 5 . 1 1 65 65 VAL CA C 88 65.600 65.600 66.068 -0.468 18329
4048 1 5 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.273 0.427 18329
4049 1 5 . 1 1 65 65 VAL H H 88 7.380 7.380 7.405 -0.025 18329
4050 1 5 . 1 1 66 66 ALA N N 89 124.260 124.260 121.437 2.823 18329
4051 1 5 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.919 0.331 18329
4052 1 5 . 1 1 66 66 ALA C C 89 179.900 179.900 179.373 0.527 18329
4053 1 5 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.427 -0.527 18329
4054 1 5 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.167 1.333 18329
4055 1 5 . 1 1 66 66 ALA H H 89 8.390 8.390 7.622 0.768 18329
4056 1 5 . 1 1 67 67 GLU N N 90 120.180 120.180 117.947 2.233 18329
4057 1 5 . 1 1 67 67 GLU HA H 90 3.720 3.720 4.052 -0.332 18329
4058 1 5 . 1 1 67 67 GLU C C 90 177.600 177.600 179.222 -1.622 18329
4059 1 5 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.570 0.330 18329
4060 1 5 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.323 -1.023 18329
4061 1 5 . 1 1 67 67 GLU H H 90 8.520 8.520 8.065 0.455 18329
4062 1 5 . 1 1 68 68 LYS N N 91 116.340 116.340 118.382 -2.042 18329
4063 1 5 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.130 -0.170 18329
4064 1 5 . 1 1 68 68 LYS C C 91 179.200 179.200 179.018 0.182 18329
4065 1 5 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.263 1.537 18329
4066 1 5 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.161 -0.161 18329
4067 1 5 . 1 1 68 68 LYS H H 91 7.210 7.210 7.691 -0.481 18329
4068 1 5 . 1 1 69 69 PHE N N 92 120.990 120.990 121.131 -0.141 18329
4069 1 5 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.354 0.156 18329
4070 1 5 . 1 1 69 69 PHE C C 92 175.100 175.100 177.949 -2.849 18329
4071 1 5 . 1 1 69 69 PHE CA C 92 59.800 59.800 60.606 -0.806 18329
4072 1 5 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.540 -0.340 18329
4073 1 5 . 1 1 69 69 PHE H H 92 7.180 7.180 7.875 -0.695 18329
4074 1 5 . 1 1 70 70 VAL N N 93 120.330 120.330 118.162 2.168 18329
4075 1 5 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.493 -0.403 18329
4076 1 5 . 1 1 70 70 VAL C C 93 177.500 177.500 177.893 -0.393 18329
4077 1 5 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.047 0.853 18329
4078 1 5 . 1 1 70 70 VAL CB C 93 31.400 31.400 30.382 1.018 18329
4079 1 5 . 1 1 70 70 VAL H H 93 7.930 7.930 7.759 0.171 18329
4080 1 5 . 1 1 71 71 ILE N N 94 120.410 120.410 120.093 0.317 18329
4081 1 5 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.921 -0.091 18329
4082 1 5 . 1 1 71 71 ILE C C 94 177.700 177.700 177.822 -0.122 18329
4083 1 5 . 1 1 71 71 ILE CA C 94 65.000 65.000 64.704 0.296 18329
4084 1 5 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.167 0.133 18329
4085 1 5 . 1 1 71 71 ILE H H 94 8.180 8.180 7.473 0.707 18329
4086 1 5 . 1 1 72 72 ALA N N 95 122.440 122.440 122.352 0.088 18329
4087 1 5 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.910 0.050 18329
4088 1 5 . 1 1 72 72 ALA C C 95 179.600 179.600 179.283 0.317 18329
4089 1 5 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.173 0.727 18329
4090 1 5 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.657 -0.457 18329
4091 1 5 . 1 1 72 72 ALA H H 95 7.340 7.340 7.940 -0.600 18329
4092 1 5 . 1 1 73 73 ILE N N 96 119.330 119.330 118.670 0.660 18329
4093 1 5 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.672 -0.232 18329
4094 1 5 . 1 1 73 73 ILE C C 96 177.400 177.400 177.980 -0.580 18329
4095 1 5 . 1 1 73 73 ILE CA C 96 62.800 62.800 63.889 -1.089 18329
4096 1 5 . 1 1 73 73 ILE CB C 96 34.400 34.400 37.556 -3.156 18329
4097 1 5 . 1 1 73 73 ILE H H 96 7.820 7.820 7.378 0.442 18329
4098 1 5 . 1 1 74 74 GLU N N 97 118.440 118.440 119.498 -1.058 18329
4099 1 5 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.864 -0.174 18329
4100 1 5 . 1 1 74 74 GLU C C 97 180.500 180.500 178.963 1.537 18329
4101 1 5 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.775 -0.075 18329
4102 1 5 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.209 0.491 18329
4103 1 5 . 1 1 74 74 GLU H H 97 8.380 8.380 7.623 0.757 18329
4104 1 5 . 1 1 75 75 GLU N N 98 120.470 120.470 119.552 0.918 18329
4105 1 5 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.094 -0.154 18329
4106 1 5 . 1 1 75 75 GLU C C 98 180.600 180.600 178.905 1.695 18329
4107 1 5 . 1 1 75 75 GLU CA C 98 59.700 59.700 58.776 0.923 18329
4108 1 5 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.570 0.630 18329
4109 1 5 . 1 1 75 75 GLU H H 98 8.800 8.800 7.825 0.975 18329
4110 1 5 . 1 1 76 76 GLU N N 99 119.230 119.230 119.649 -0.419 18329
4111 1 5 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.067 0.073 18329
4112 1 5 . 1 1 76 76 GLU C C 99 178.900 178.900 178.988 -0.088 18329
4113 1 5 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.712 -0.112 18329
4114 1 5 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.565 -0.265 18329
4115 1 5 . 1 1 76 76 GLU H H 99 8.840 8.840 8.405 0.435 18329
4116 1 5 . 1 1 77 77 ALA N N 100 121.950 121.950 121.223 0.727 18329
4117 1 5 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.116 -0.116 18329
4118 1 5 . 1 1 77 77 ALA C C 100 179.000 179.000 179.228 -0.228 18329
4119 1 5 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.424 0.876 18329
4120 1 5 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.215 -1.415 18329
4121 1 5 . 1 1 77 77 ALA H H 100 9.400 9.400 8.459 0.941 18329
4122 1 5 . 1 1 78 78 THR N N 101 111.820 111.820 114.288 -2.468 18329
4123 1 5 . 1 1 78 78 THR HA H 101 3.750 3.750 4.077 -0.327 18329
4124 1 5 . 1 1 78 78 THR CA C 101 67.500 67.500 65.714 1.786 18329
4125 1 5 . 1 1 78 78 THR CB C 101 68.600 68.600 68.495 0.105 18329
4126 1 5 . 1 1 78 78 THR H H 101 7.770 7.770 7.484 0.286 18329
4127 1 5 . 1 1 79 79 LYS N N 102 122.940 122.940 120.127 2.813 18329
4128 1 5 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.124 -0.034 18329
4129 1 5 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.683 0.517 18329
4130 1 5 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.328 0.172 18329
4131 1 5 . 1 1 79 79 LYS H H 102 7.870 7.870 7.645 0.225 18329
4132 1 5 . 1 1 80 80 LEU N N 103 117.690 117.690 118.830 -1.140 18329
4133 1 5 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.164 0.326 18329
4134 1 5 . 1 1 80 80 LEU C C 103 178.140 178.140 177.219 0.921 18329
4135 1 5 . 1 1 80 80 LEU CA C 103 54.000 54.000 54.940 -0.940 18329
4136 1 5 . 1 1 80 80 LEU CB C 103 43.100 43.100 41.930 1.170 18329
4137 1 5 . 1 1 80 80 LEU H H 103 7.550 7.550 7.899 -0.349 18329
4138 1 5 . 1 1 81 81 LYS N N 104 122.210 122.210 118.572 3.638 18329
4139 1 5 . 1 1 81 81 LYS HA H 104 3.930 3.930 3.963 -0.033 18329
4140 1 5 . 1 1 81 81 LYS C C 104 178.000 178.000 177.139 0.861 18329
4141 1 5 . 1 1 81 81 LYS CA C 104 61.300 61.300 58.232 3.068 18329
4142 1 5 . 1 1 81 81 LYS CB C 104 32.800 32.800 31.552 1.248 18329
4143 1 5 . 1 1 81 81 LYS H H 104 7.500 7.500 7.653 -0.153 18329
4144 1 5 . 1 1 82 82 GLU N N 105 114.920 114.920 121.256 -6.336 18329
4145 1 5 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.325 0.235 18329
4146 1 5 . 1 1 82 82 GLU C C 105 177.900 177.900 176.170 1.730 18329
4147 1 5 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.635 0.025 18329
4148 1 5 . 1 1 82 82 GLU CB C 105 30.400 30.400 27.375 3.025 18329
4149 1 5 . 1 1 82 82 GLU H H 105 8.780 8.780 8.547 0.233 18329
4150 1 5 . 1 1 83 83 THR N N 106 107.260 107.260 115.161 -7.901 18329
4151 1 5 . 1 1 83 83 THR HA H 106 4.550 4.550 4.458 0.092 18329
4152 1 5 . 1 1 83 83 THR C C 106 176.300 176.300 174.382 1.918 18329
4153 1 5 . 1 1 83 83 THR CA C 106 61.900 61.900 62.316 -0.415 18329
4154 1 5 . 1 1 83 83 THR CB C 106 70.400 70.400 69.483 0.917 18329
4155 1 5 . 1 1 83 83 THR H H 106 7.570 7.570 8.376 -0.806 18329
4156 1 5 . 1 1 84 84 GLY N N 107 112.110 112.110 109.765 2.345 18329
4157 1 5 . 1 1 84 84 GLY C C 107 172.800 172.800 174.368 -1.568 18329
4158 1 5 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.626 -0.225 18329
4159 1 5 . 1 1 84 84 GLY H H 107 9.000 9.000 8.262 0.738 18329
4160 1 5 . 1 1 85 85 SER N N 108 119.030 119.030 113.738 5.292 18329
4161 1 5 . 1 1 85 85 SER CA C 108 56.300 56.300 58.774 -2.474 18329
4162 1 5 . 1 1 85 85 SER CB C 108 66.300 66.300 62.797 3.503 18329
4163 1 5 . 1 1 85 85 SER H H 108 8.950 8.950 8.355 0.595 18329
4164 1 5 . 1 1 86 86 SER HA H 109 4.480 4.480 4.958 -0.478 18329
4165 1 5 . 1 1 86 86 SER C C 109 177.000 177.000 176.234 0.766 18329
4166 1 5 . 1 1 86 86 SER CA C 109 61.600 61.600 59.540 2.060 18329
4167 1 5 . 1 1 86 86 SER CB C 109 62.900 62.900 63.602 -0.702 18329
4168 1 5 . 1 1 87 87 GLY N N 110 108.100 108.100 109.962 -1.862 18329
4169 1 5 . 1 1 87 87 GLY C C 110 177.100 177.100 175.894 1.206 18329
4170 1 5 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.521 -0.321 18329
4171 1 5 . 1 1 87 87 GLY H H 110 8.480 8.480 8.434 0.046 18329
4172 1 5 . 1 1 88 88 GLU N N 111 123.040 123.040 122.236 0.804 18329
4173 1 5 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.057 -0.367 18329
4174 1 5 . 1 1 88 88 GLU C C 111 177.700 177.700 178.419 -0.719 18329
4175 1 5 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.995 0.505 18329
4176 1 5 . 1 1 88 88 GLU CB C 111 28.700 28.700 28.803 -0.103 18329
4177 1 5 . 1 1 88 88 GLU H H 111 7.560 7.560 8.846 -1.286 18329
4178 1 5 . 1 1 89 89 PHE N N 112 118.270 118.270 119.582 -1.312 18329
4179 1 5 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.233 0.187 18329
4180 1 5 . 1 1 89 89 PHE C C 112 178.600 178.600 177.870 0.730 18329
4181 1 5 . 1 1 89 89 PHE CA C 112 61.100 61.100 61.099 0.001 18329
4182 1 5 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.660 -0.760 18329
4183 1 5 . 1 1 89 89 PHE H H 112 7.200 7.200 7.717 -0.517 18329
4184 1 5 . 1 1 90 90 SER N N 113 115.980 115.980 116.335 -0.355 18329
4185 1 5 . 1 1 90 90 SER HA H 113 4.290 4.290 4.103 0.187 18329
4186 1 5 . 1 1 90 90 SER C C 113 178.600 178.600 175.821 2.779 18329
4187 1 5 . 1 1 90 90 SER CA C 113 62.700 62.700 62.106 0.594 18329
4188 1 5 . 1 1 90 90 SER CB C 113 62.800 62.800 62.975 -0.175 18329
4189 1 5 . 1 1 90 90 SER H H 113 8.830 8.830 8.512 0.318 18329
4190 1 5 . 1 1 91 91 ALA N N 114 123.130 123.130 123.969 -0.839 18329
4191 1 5 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.299 0.081 18329
4192 1 5 . 1 1 91 91 ALA C C 114 181.300 181.300 179.453 1.847 18329
4193 1 5 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.767 -0.067 18329
4194 1 5 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.351 0.049 18329
4195 1 5 . 1 1 91 91 ALA H H 114 7.580 7.580 8.168 -0.588 18329
4196 1 5 . 1 1 92 92 MET N N 115 118.700 118.700 118.551 0.149 18329
4197 1 5 . 1 1 92 92 MET HA H 115 3.980 3.980 4.221 -0.241 18329
4198 1 5 . 1 1 92 92 MET C C 115 178.000 178.000 177.889 0.111 18329
4199 1 5 . 1 1 92 92 MET CA C 115 61.000 61.000 58.492 2.508 18329
4200 1 5 . 1 1 92 92 MET CB C 115 31.400 31.400 32.998 -1.598 18329
4201 1 5 . 1 1 92 92 MET H H 115 7.880 7.880 8.171 -0.291 18329
4202 1 5 . 1 1 93 93 TYR N N 116 119.200 119.200 120.666 -1.466 18329
4203 1 5 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.178 0.102 18329
4204 1 5 . 1 1 93 93 TYR C C 116 176.300 176.300 177.409 -1.109 18329
4205 1 5 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.455 0.645 18329
4206 1 5 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.492 -0.192 18329
4207 1 5 . 1 1 93 93 TYR H H 116 7.870 7.870 7.889 -0.019 18329
4208 1 5 . 1 1 94 94 ASP N N 117 120.210 120.210 119.603 0.607 18329
4209 1 5 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.517 -0.327 18329
4210 1 5 . 1 1 94 94 ASP C C 117 179.000 179.000 178.659 0.341 18329
4211 1 5 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.625 0.075 18329
4212 1 5 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.172 -0.172 18329
4213 1 5 . 1 1 94 94 ASP H H 117 8.720 8.720 8.542 0.178 18329
4214 1 5 . 1 1 95 95 LEU N N 118 118.420 118.420 120.173 -1.753 18329
4215 1 5 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.139 0.071 18329
4216 1 5 . 1 1 95 95 LEU C C 118 178.600 178.600 179.228 -0.628 18329
4217 1 5 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.385 0.315 18329
4218 1 5 . 1 1 95 95 LEU CB C 118 43.100 43.100 42.003 1.097 18329
4219 1 5 . 1 1 95 95 LEU H H 118 7.510 7.510 7.528 -0.018 18329
4220 1 5 . 1 1 96 96 MET N N 119 118.470 118.470 119.023 -0.553 18329
4221 1 5 . 1 1 96 96 MET HA H 119 3.990 3.990 4.103 -0.113 18329
4222 1 5 . 1 1 96 96 MET C C 119 177.500 177.500 178.210 -0.710 18329
4223 1 5 . 1 1 96 96 MET CA C 119 60.500 60.500 57.705 2.795 18329
4224 1 5 . 1 1 96 96 MET CB C 119 33.900 33.900 31.313 2.587 18329
4225 1 5 . 1 1 96 96 MET H H 119 7.820 7.820 7.524 0.296 18329
4226 1 5 . 1 1 97 97 PHE N N 120 119.580 119.580 120.046 -0.466 18329
4227 1 5 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.180 -0.370 18329
4228 1 5 . 1 1 97 97 PHE C C 120 178.800 178.800 177.688 1.112 18329
4229 1 5 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.428 0.371 18329
4230 1 5 . 1 1 97 97 PHE CB C 120 39.200 39.200 39.095 0.105 18329
4231 1 5 . 1 1 97 97 PHE H H 120 8.940 8.940 7.637 1.303 18329
4232 1 5 . 1 1 98 98 GLU N N 121 119.940 119.940 119.489 0.451 18329
4233 1 5 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.010 -0.130 18329
4234 1 5 . 1 1 98 98 GLU C C 121 180.800 180.800 178.304 2.496 18329
4235 1 5 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.353 0.447 18329
4236 1 5 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.688 -0.488 18329
4237 1 5 . 1 1 98 98 GLU H H 121 8.690 8.690 8.410 0.280 18329
4238 1 5 . 1 1 99 99 VAL N N 122 115.350 115.350 116.742 -1.392 18329
4239 1 5 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.739 0.001 18329
4240 1 5 . 1 1 99 99 VAL C C 122 176.500 176.500 176.978 -0.478 18329
4241 1 5 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.757 -0.257 18329
4242 1 5 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.913 -0.613 18329
4243 1 5 . 1 1 99 99 VAL H H 122 8.210 8.210 7.920 0.290 18329
4244 1 5 . 1 1 100 100 SER N N 123 115.450 115.450 114.859 0.591 18329
4245 1 5 . 1 1 100 100 SER HA H 123 4.270 4.270 4.096 0.174 18329
4246 1 5 . 1 1 100 100 SER C C 123 174.700 174.700 176.099 -1.399 18329
4247 1 5 . 1 1 100 100 SER CA C 123 62.000 62.000 61.133 0.867 18329
4248 1 5 . 1 1 100 100 SER H H 123 7.520 7.520 7.152 0.368 18329
4249 1 5 . 1 1 101 101 LYS N N 124 120.310 120.310 121.941 -1.631 18329
4250 1 5 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.099 -0.129 18329
4251 1 5 . 1 1 101 101 LYS C C 124 176.600 176.600 177.490 -0.890 18329
4252 1 5 . 1 1 101 101 LYS CA C 124 61.100 61.100 59.369 1.731 18329
4253 1 5 . 1 1 101 101 LYS CB C 124 28.500 28.500 29.927 -1.427 18329
4254 1 5 . 1 1 101 101 LYS H H 124 6.930 6.930 7.410 -0.480 18329
4255 1 5 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.174 0.086 18329
4256 1 5 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.694 -0.494 18329
4257 1 5 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.284 -0.684 18329
4258 1 5 . 1 1 103 103 LEU N N 126 116.020 116.020 116.398 -0.378 18329
4259 1 5 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.018 -0.138 18329
4260 1 5 . 1 1 103 103 LEU C C 126 177.900 177.900 178.815 -0.915 18329
4261 1 5 . 1 1 103 103 LEU CA C 126 57.700 57.700 57.017 0.683 18329
4262 1 5 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.196 0.604 18329
4263 1 5 . 1 1 103 103 LEU H H 126 6.520 6.520 7.496 -0.976 18329
4264 1 5 . 1 1 104 104 GLN N N 127 120.500 120.500 119.937 0.563 18329
4265 1 5 . 1 1 104 104 GLN C C 127 180.600 180.600 177.763 2.837 18329
4266 1 5 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.598 -0.298 18329
4267 1 5 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.282 0.718 18329
4268 1 5 . 1 1 104 104 GLN H H 127 8.160 8.160 8.066 0.094 18329
4269 1 5 . 1 1 105 105 LYS N N 128 120.000 120.000 116.272 3.728 18329
4270 1 5 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.169 -0.119 18329
4271 1 5 . 1 1 105 105 LYS C C 128 177.100 177.100 177.662 -0.562 18329
4272 1 5 . 1 1 105 105 LYS CA C 128 58.500 58.500 57.324 1.176 18329
4273 1 5 . 1 1 105 105 LYS CB C 128 31.400 31.400 31.941 -0.541 18329
4274 1 5 . 1 1 105 105 LYS H H 128 7.810 7.810 7.855 -0.045 18329
4275 1 5 . 1 1 106 106 LEU N N 129 118.530 118.530 117.027 1.503 18329
4276 1 5 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.733 -0.763 18329
4277 1 5 . 1 1 106 106 LEU C C 129 175.200 175.200 176.999 -1.799 18329
4278 1 5 . 1 1 106 106 LEU CA C 129 54.500 54.500 55.385 -0.884 18329
4279 1 5 . 1 1 106 106 LEU CB C 129 42.400 42.400 44.394 -1.994 18329
4280 1 5 . 1 1 106 106 LEU H H 129 7.220 7.220 7.473 -0.253 18329
4281 1 5 . 1 1 107 107 GLY N N 130 101.490 101.490 105.456 -3.966 18329
4282 1 5 . 1 1 107 107 GLY C C 130 174.800 174.800 173.057 1.743 18329
4283 1 5 . 1 1 107 107 GLY CA C 130 45.100 45.100 45.354 -0.254 18329
4284 1 5 . 1 1 107 107 GLY H H 130 7.560 7.560 8.181 -0.621 18329
4285 1 5 . 1 1 108 108 ILE N N 131 121.340 121.340 122.762 -1.422 18329
4286 1 5 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.660 0.490 18329
4287 1 5 . 1 1 108 108 ILE C C 131 174.300 174.300 174.475 -0.175 18329
4288 1 5 . 1 1 108 108 ILE CA C 131 60.400 60.400 61.936 -1.536 18329
4289 1 5 . 1 1 108 108 ILE CB C 131 35.200 35.200 36.385 -1.185 18329
4290 1 5 . 1 1 108 108 ILE H H 131 7.290 7.290 8.406 -1.116 18329
4291 1 5 . 1 1 109 109 GLN N N 132 125.650 125.650 127.454 -1.804 18329
4292 1 5 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.357 -0.347 18329
4293 1 5 . 1 1 109 109 GLN C C 132 176.800 176.800 175.903 0.897 18329
4294 1 5 . 1 1 109 109 GLN CA C 132 57.600 57.600 55.529 2.071 18329
4295 1 5 . 1 1 109 109 GLN CB C 132 29.000 29.000 31.047 -2.047 18329
4296 1 5 . 1 1 109 109 GLN H H 132 8.080 8.080 8.166 -0.086 18329
4297 1 5 . 1 1 110 110 GLU N N 133 114.890 114.890 119.844 -4.954 18329
4298 1 5 . 1 1 110 110 GLU HA H 133 4.150 4.150 3.998 0.152 18329
4299 1 5 . 1 1 110 110 GLU C C 133 177.100 177.100 176.192 0.908 18329
4300 1 5 . 1 1 110 110 GLU CA C 133 57.100 57.100 57.517 -0.417 18329
4301 1 5 . 1 1 110 110 GLU CB C 133 27.300 27.300 27.765 -0.465 18329
4302 1 5 . 1 1 110 110 GLU H H 133 9.270 9.270 8.858 0.412 18329
4303 1 5 . 1 1 111 111 MET N N 134 121.210 121.210 119.874 1.336 18329
4304 1 5 . 1 1 111 111 MET HA H 134 4.350 4.350 4.183 0.167 18329
4305 1 5 . 1 1 111 111 MET C C 134 177.500 177.500 177.246 0.254 18329
4306 1 5 . 1 1 111 111 MET CA C 134 57.900 57.900 58.467 -0.567 18329
4307 1 5 . 1 1 111 111 MET CB C 134 33.300 33.300 32.220 1.080 18329
4308 1 5 . 1 1 111 111 MET H H 134 7.620 7.620 8.457 -0.837 18329
4309 1 5 . 1 1 112 112 THR N N 135 113.170 113.170 115.703 -2.533 18329
4310 1 5 . 1 1 112 112 THR HA H 135 3.920 3.920 4.044 -0.124 18329
4311 1 5 . 1 1 112 112 THR C C 135 176.400 176.400 176.273 0.127 18329
4312 1 5 . 1 1 112 112 THR CA C 135 65.900 65.900 66.372 -0.472 18329
4313 1 5 . 1 1 112 112 THR CB C 135 68.200 68.200 68.602 -0.402 18329
4314 1 5 . 1 1 112 112 THR H H 135 8.320 8.320 8.023 0.297 18329
4315 1 5 . 1 1 113 113 LYS N N 136 123.440 123.440 121.612 1.828 18329
4316 1 5 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.045 -0.115 18329
4317 1 5 . 1 1 113 113 LYS C C 136 177.600 177.600 179.262 -1.662 18329
4318 1 5 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.523 -1.224 18329
4319 1 5 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.395 -0.396 18329
4320 1 5 . 1 1 113 113 LYS H H 136 8.060 8.060 8.297 -0.237 18329
4321 1 5 . 1 1 114 114 THR N N 137 114.590 114.590 116.021 -1.431 18329
4322 1 5 . 1 1 114 114 THR HA H 137 4.000 4.000 3.965 0.035 18329
4323 1 5 . 1 1 114 114 THR C C 137 176.800 176.800 176.345 0.455 18329
4324 1 5 . 1 1 114 114 THR CA C 137 67.600 67.600 67.099 0.501 18329
4325 1 5 . 1 1 114 114 THR CB C 137 69.200 69.200 68.840 0.360 18329
4326 1 5 . 1 1 114 114 THR H H 137 7.950 7.950 7.849 0.101 18329
4327 1 5 . 1 1 115 115 VAL N N 138 119.080 119.080 120.233 -1.153 18329
4328 1 5 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.813 0.007 18329
4329 1 5 . 1 1 115 115 VAL C C 138 176.900 176.900 177.248 -0.348 18329
4330 1 5 . 1 1 115 115 VAL CA C 138 66.800 66.800 65.348 1.452 18329
4331 1 5 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.945 0.555 18329
4332 1 5 . 1 1 115 115 VAL H H 138 7.320 7.320 7.569 -0.249 18329
4333 1 5 . 1 1 116 116 SER N N 139 116.630 116.630 115.008 1.622 18329
4334 1 5 . 1 1 116 116 SER HA H 139 4.680 4.680 4.428 0.252 18329
4335 1 5 . 1 1 116 116 SER C C 139 179.000 179.000 177.125 1.875 18329
4336 1 5 . 1 1 116 116 SER CA C 139 61.400 61.400 61.072 0.329 18329
4337 1 5 . 1 1 116 116 SER CB C 139 62.800 62.800 63.345 -0.545 18329
4338 1 5 . 1 1 116 116 SER H H 139 8.990 8.990 8.334 0.656 18329
4339 1 5 . 1 1 117 117 ASP N N 140 124.220 124.220 122.960 1.260 18329
4340 1 5 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.469 -0.109 18329
4341 1 5 . 1 1 117 117 ASP C C 140 179.900 179.900 177.448 2.452 18329
4342 1 5 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.265 1.035 18329
4343 1 5 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.670 -1.171 18329
4344 1 5 . 1 1 117 117 ASP H H 140 9.480 9.480 8.610 0.870 18329
4345 1 5 . 1 1 118 118 ALA N N 141 121.420 121.420 120.699 0.721 18329
4346 1 5 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.222 0.058 18329
4347 1 5 . 1 1 118 118 ALA C C 141 179.800 179.800 179.112 0.688 18329
4348 1 5 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.468 -0.068 18329
4349 1 5 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.409 0.591 18329
4350 1 5 . 1 1 118 118 ALA H H 141 7.340 7.340 7.512 -0.172 18329
4351 1 5 . 1 1 119 119 ALA N N 142 121.680 121.680 119.736 1.944 18329
4352 1 5 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.083 0.047 18329
4353 1 5 . 1 1 119 119 ALA C C 142 178.800 178.800 179.108 -0.308 18329
4354 1 5 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.379 -1.179 18329
4355 1 5 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.498 -0.198 18329
4356 1 5 . 1 1 119 119 ALA H H 142 7.890 7.890 7.504 0.386 18329
4357 1 5 . 1 1 120 120 GLU N N 143 117.690 117.690 117.410 0.280 18329
4358 1 5 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.043 -0.103 18329
4359 1 5 . 1 1 120 120 GLU C C 143 178.100 178.100 178.660 -0.560 18329
4360 1 5 . 1 1 120 120 GLU CA C 143 58.700 58.700 58.733 -0.033 18329
4361 1 5 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.197 0.303 18329
4362 1 5 . 1 1 120 120 GLU H H 143 7.500 7.500 7.781 -0.281 18329
4363 1 5 . 1 1 121 121 GLU N N 144 115.680 115.680 117.993 -2.313 18329
4364 1 5 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.146 0.014 18329
4365 1 5 . 1 1 121 121 GLU C C 144 176.100 176.100 176.973 -0.873 18329
4366 1 5 . 1 1 121 121 GLU CA C 144 56.900 56.900 58.270 -1.370 18329
4367 1 5 . 1 1 121 121 GLU CB C 144 31.100 31.100 30.117 0.983 18329
4368 1 5 . 1 1 121 121 GLU H H 144 6.970 6.970 7.614 -0.644 18329
4369 1 5 . 1 1 122 122 ASN N N 145 117.750 117.750 116.001 1.749 18329
4370 1 5 . 1 1 122 122 ASN HA H 145 4.990 4.990 4.979 0.011 18329
4371 1 5 . 1 1 122 122 ASN C C 145 185.300 185.300 172.750 12.550 18329
4372 1 5 . 1 1 122 122 ASN CA C 145 50.200 50.200 50.931 -0.731 18329
4373 1 5 . 1 1 122 122 ASN CB C 145 41.100 41.100 39.319 1.781 18329
4374 1 5 . 1 1 122 122 ASN H H 145 7.670 7.670 7.567 0.103 18329
4375 1 5 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.519 0.111 18329
4376 1 5 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.143 -1.143 18329
4377 1 5 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.184 0.116 18329
4378 1 5 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.244 0.196 18329
4379 1 5 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.802 -0.902 18329
4380 1 5 . 1 1 124 124 PRO CB C 147 28.400 28.400 31.883 -3.483 18329
4381 1 5 . 1 1 125 125 THR N N 148 106.090 106.090 114.357 -8.267 18329
4382 1 5 . 1 1 125 125 THR HA H 148 4.530 4.530 4.463 0.067 18329
4383 1 5 . 1 1 125 125 THR C C 148 174.300 174.300 173.630 0.670 18329
4384 1 5 . 1 1 125 125 THR CA C 148 61.200 61.200 60.748 0.452 18329
4385 1 5 . 1 1 125 125 THR CB C 148 68.600 68.600 69.492 -0.892 18329
4386 1 5 . 1 1 125 125 THR H H 148 7.800 7.800 8.062 -0.262 18329
4387 1 5 . 1 1 126 126 THR N N 149 108.650 108.650 111.945 -3.295 18329
4388 1 5 . 1 1 126 126 THR HA H 149 4.170 4.170 4.118 0.052 18329
4389 1 5 . 1 1 126 126 THR C C 149 173.100 173.100 173.005 0.095 18329
4390 1 5 . 1 1 126 126 THR CA C 149 58.800 58.800 60.150 -1.350 18329
4391 1 5 . 1 1 126 126 THR CB C 149 73.100 73.100 70.041 3.058 18329
4392 1 5 . 1 1 126 126 THR H H 149 7.350 7.350 7.122 0.228 18329
4393 1 5 . 1 1 127 127 ALA N N 150 123.270 123.270 123.465 -0.195 18329
4394 1 5 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.629 -0.609 18329
4395 1 5 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.096 -0.096 18329
4396 1 5 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.690 0.010 18329
4397 1 5 . 1 1 127 127 ALA H H 150 7.750 7.750 8.603 -0.853 18329
4398 1 5 . 1 1 128 128 GLN N N 151 114.920 114.920 118.672 -3.752 18329
4399 1 5 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.066 -0.316 18329
4400 1 5 . 1 1 128 128 GLN C C 151 178.400 178.400 178.011 0.389 18329
4401 1 5 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.763 0.037 18329
4402 1 5 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.333 -1.133 18329
4403 1 5 . 1 1 128 128 GLN H H 151 8.300 8.300 7.944 0.356 18329
4404 1 5 . 1 1 129 129 GLY N N 152 107.280 107.280 107.004 0.276 18329
4405 1 5 . 1 1 129 129 GLY C C 152 174.900 174.900 176.260 -1.360 18329
4406 1 5 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.815 0.385 18329
4407 1 5 . 1 1 129 129 GLY H H 152 7.920 7.920 8.123 -0.203 18329
4408 1 5 . 1 1 130 130 VAL N N 153 119.440 119.440 122.649 -3.209 18329
4409 1 5 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.559 -0.089 18329
4410 1 5 . 1 1 130 130 VAL C C 153 177.700 177.700 177.647 0.053 18329
4411 1 5 . 1 1 130 130 VAL CA C 153 67.800 67.800 66.274 1.526 18329
4412 1 5 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.839 -0.139 18329
4413 1 5 . 1 1 130 130 VAL H H 153 7.390 7.390 7.633 -0.243 18329
4414 1 5 . 1 1 131 131 LEU N N 154 118.990 118.990 118.963 0.027 18329
4415 1 5 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.853 0.057 18329
4416 1 5 . 1 1 131 131 LEU C C 154 180.400 180.400 178.699 1.701 18329
4417 1 5 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.167 0.133 18329
4418 1 5 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.409 -0.409 18329
4419 1 5 . 1 1 131 131 LEU H H 154 8.640 8.640 8.302 0.338 18329
4420 1 5 . 1 1 132 132 GLU N N 155 120.980 120.980 119.465 1.515 18329
4421 1 5 . 1 1 132 132 GLU HA H 155 4.120 4.120 4.046 0.074 18329
4422 1 5 . 1 1 132 132 GLU C C 155 179.400 179.400 178.732 0.668 18329
4423 1 5 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.402 -0.502 18329
4424 1 5 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.069 0.131 18329
4425 1 5 . 1 1 132 132 GLU H H 155 8.000 8.000 7.478 0.522 18329
4426 1 5 . 1 1 133 133 ILE N N 156 121.830 121.830 120.426 1.404 18329
4427 1 5 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.747 -0.167 18329
4428 1 5 . 1 1 133 133 ILE C C 156 178.000 178.000 177.725 0.275 18329
4429 1 5 . 1 1 133 133 ILE CA C 156 65.500 65.500 63.951 1.549 18329
4430 1 5 . 1 1 133 133 ILE CB C 156 39.600 39.600 37.531 2.069 18329
4431 1 5 . 1 1 133 133 ILE H H 156 8.040 8.040 7.385 0.655 18329
4432 1 5 . 1 1 134 134 ALA N N 157 121.470 121.470 122.078 -0.608 18329
4433 1 5 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.837 0.063 18329
4434 1 5 . 1 1 134 134 ALA C C 157 178.800 178.800 179.338 -0.538 18329
4435 1 5 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.656 -0.356 18329
4436 1 5 . 1 1 134 134 ALA CB C 157 18.100 18.100 17.844 0.256 18329
4437 1 5 . 1 1 134 134 ALA H H 157 8.950 8.950 8.417 0.533 18329
4438 1 5 . 1 1 135 135 LYS N N 158 118.470 118.470 118.663 -0.193 18329
4439 1 5 . 1 1 135 135 LYS HA H 158 3.910 3.910 4.034 -0.124 18329
4440 1 5 . 1 1 135 135 LYS C C 158 179.300 179.300 179.056 0.244 18329
4441 1 5 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.352 0.148 18329
4442 1 5 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.397 -0.997 18329
4443 1 5 . 1 1 135 135 LYS H H 158 8.000 8.000 7.738 0.262 18329
4444 1 5 . 1 1 136 136 LYS N N 159 118.000 118.000 119.185 -1.185 18329
4445 1 5 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.099 -0.049 18329
4446 1 5 . 1 1 136 136 LYS C C 159 180.200 180.200 179.506 0.694 18329
4447 1 5 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.264 0.236 18329
4448 1 5 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.319 -1.419 18329
4449 1 5 . 1 1 136 136 LYS H H 159 7.530 7.530 7.562 -0.032 18329
4450 1 5 . 1 1 137 137 MET N N 160 120.990 120.990 119.035 1.955 18329
4451 1 5 . 1 1 137 137 MET HA H 160 3.800 3.800 4.111 -0.311 18329
4452 1 5 . 1 1 137 137 MET C C 160 177.400 177.400 178.073 -0.673 18329
4453 1 5 . 1 1 137 137 MET CA C 160 60.600 60.600 59.770 0.830 18329
4454 1 5 . 1 1 137 137 MET CB C 160 31.800 31.800 32.458 -0.658 18329
4455 1 5 . 1 1 137 137 MET H H 160 8.660 8.660 8.434 0.226 18329
4456 1 5 . 1 1 138 138 ARG N N 161 119.480 119.480 120.160 -0.680 18329
4457 1 5 . 1 1 138 138 ARG HA H 161 3.800 3.800 4.197 -0.397 18329
4458 1 5 . 1 1 138 138 ARG C C 161 177.900 177.900 178.562 -0.662 18329
4459 1 5 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.365 1.235 18329
4460 1 5 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.274 -0.474 18329
4461 1 5 . 1 1 138 138 ARG H H 161 9.280 9.280 8.134 1.146 18329
4462 1 5 . 1 1 139 139 GLU N N 162 118.700 118.700 119.924 -1.224 18329
4463 1 5 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.255 -0.255 18329
4464 1 5 . 1 1 139 139 GLU C C 162 179.100 179.100 178.747 0.353 18329
4465 1 5 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.272 0.528 18329
4466 1 5 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.601 -0.101 18329
4467 1 5 . 1 1 139 139 GLU H H 162 8.430 8.430 8.373 0.057 18329
4468 1 5 . 1 1 140 140 LYS N N 163 119.310 119.310 119.338 -0.028 18329
4469 1 5 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.105 0.105 18329
4470 1 5 . 1 1 140 140 LYS C C 163 177.900 177.900 179.230 -1.330 18329
4471 1 5 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.560 0.340 18329
4472 1 5 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.217 -1.117 18329
4473 1 5 . 1 1 140 140 LYS H H 163 7.440 7.440 7.774 -0.334 18329
4474 1 5 . 1 1 141 141 LEU N N 164 117.630 117.630 119.155 -1.525 18329
4475 1 5 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.020 -0.130 18329
4476 1 5 . 1 1 141 141 LEU C C 164 178.700 178.700 178.914 -0.214 18329
4477 1 5 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.743 0.257 18329
4478 1 5 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.827 -0.327 18329
4479 1 5 . 1 1 141 141 LEU H H 164 8.180 8.180 7.703 0.477 18329
4480 1 5 . 1 1 142 142 GLN N N 165 117.710 117.710 117.952 -0.242 18329
4481 1 5 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.963 0.347 18329
4482 1 5 . 1 1 142 142 GLN C C 165 179.200 179.200 178.494 0.706 18329
4483 1 5 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.603 -1.103 18329
4484 1 5 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.488 -0.988 18329
4485 1 5 . 1 1 142 142 GLN H H 165 8.730 8.730 7.843 0.887 18329
4486 1 5 . 1 1 143 143 ARG N N 166 121.410 121.410 119.846 1.564 18329
4487 1 5 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.112 0.078 18329
4488 1 5 . 1 1 143 143 ARG C C 166 179.700 179.700 178.890 0.810 18329
4489 1 5 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.252 0.548 18329
4490 1 5 . 1 1 143 143 ARG CB C 166 30.200 30.200 29.917 0.283 18329
4491 1 5 . 1 1 143 143 ARG H H 166 8.050 8.050 7.599 0.451 18329
4492 1 5 . 1 1 144 144 VAL N N 167 120.950 120.950 120.074 0.876 18329
4493 1 5 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.669 0.091 18329
4494 1 5 . 1 1 144 144 VAL C C 167 179.200 179.200 177.886 1.314 18329
4495 1 5 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.617 -0.216 18329
4496 1 5 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.584 0.516 18329
4497 1 5 . 1 1 144 144 VAL H H 167 8.190 8.190 7.516 0.674 18329
4498 1 5 . 1 1 145 145 HIS N N 168 123.520 123.520 118.770 4.750 18329
4499 1 5 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.512 -0.612 18329
4500 1 5 . 1 1 145 145 HIS C C 168 177.100 177.100 177.417 -0.317 18329
4501 1 5 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.431 1.869 18329
4502 1 5 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.255 -0.355 18329
4503 1 5 . 1 1 145 145 HIS H H 168 9.240 9.240 7.842 1.398 18329
4504 1 5 . 1 1 146 146 THR N N 169 115.020 115.020 117.154 -2.134 18329
4505 1 5 . 1 1 146 146 THR HA H 169 3.860 3.860 4.198 -0.338 18329
4506 1 5 . 1 1 146 146 THR C C 169 175.700 175.700 176.406 -0.706 18329
4507 1 5 . 1 1 146 146 THR CA C 169 67.200 67.200 67.087 0.113 18329
4508 1 5 . 1 1 146 146 THR CB C 169 69.300 69.300 68.499 0.801 18329
4509 1 5 . 1 1 146 146 THR H H 169 8.750 8.750 8.795 -0.045 18329
4510 1 5 . 1 1 147 147 LYS N N 170 120.300 120.300 120.028 0.272 18329
4511 1 5 . 1 1 147 147 LYS HA H 170 4.000 4.000 4.017 -0.017 18329
4512 1 5 . 1 1 147 147 LYS C C 170 179.300 179.300 178.921 0.379 18329
4513 1 5 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.495 -0.395 18329
4514 1 5 . 1 1 147 147 LYS CB C 170 31.800 31.800 31.851 -0.051 18329
4515 1 5 . 1 1 147 147 LYS H H 170 8.020 8.020 8.219 -0.199 18329
4516 1 5 . 1 1 148 148 ASN N N 171 117.600 117.600 117.972 -0.372 18329
4517 1 5 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.497 -0.177 18329
4518 1 5 . 1 1 148 148 ASN C C 171 175.400 175.400 177.275 -1.875 18329
4519 1 5 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.517 2.183 18329
4520 1 5 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.283 1.417 18329
4521 1 5 . 1 1 148 148 ASN H H 171 7.810 7.810 7.662 0.148 18329
4522 1 5 . 1 1 149 149 TYR N N 172 121.560 121.560 122.081 -0.521 18329
4523 1 5 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.130 -0.240 18329
4524 1 5 . 1 1 149 149 TYR C C 172 176.900 176.900 178.044 -1.144 18329
4525 1 5 . 1 1 149 149 TYR CA C 172 61.500 61.500 62.541 -1.041 18329
4526 1 5 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.678 0.242 18329
4527 1 5 . 1 1 149 149 TYR H H 172 9.020 9.020 7.839 1.181 18329
4528 1 5 . 1 1 150 150 CYS N N 173 116.050 116.050 117.121 -1.071 18329
4529 1 5 . 1 1 150 150 CYS C C 173 177.100 177.100 177.195 -0.095 18329
4530 1 5 . 1 1 150 150 CYS CA C 173 58.400 58.400 62.657 -4.257 18329
4531 1 5 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.290 12.310 18329
4532 1 5 . 1 1 150 150 CYS H H 173 8.810 8.810 8.322 0.488 18329
4533 1 5 . 1 1 151 151 THR N N 174 117.190 117.190 116.863 0.327 18329
4534 1 5 . 1 1 151 151 THR HA H 174 3.880 3.880 4.043 -0.163 18329
4535 1 5 . 1 1 151 151 THR C C 174 176.000 176.000 176.802 -0.802 18329
4536 1 5 . 1 1 151 151 THR CA C 174 66.900 66.900 66.635 0.266 18329
4537 1 5 . 1 1 151 151 THR CB C 174 68.500 68.500 68.529 -0.029 18329
4538 1 5 . 1 1 151 151 THR H H 174 7.720 7.720 8.234 -0.514 18329
4539 1 5 . 1 1 152 152 LEU N N 175 123.110 123.110 121.721 1.389 18329
4540 1 5 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.064 -0.254 18329
4541 1 5 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.716 0.284 18329
4542 1 5 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.971 -0.471 18329
4543 1 5 . 1 1 152 152 LEU H H 175 7.870 7.870 8.195 -0.325 18329
4544 1 5 . 1 1 153 153 LYS N N 176 117.270 117.270 117.487 -0.217 18329
4545 1 5 . 1 1 153 153 LYS HA H 176 3.700 3.700 4.026 -0.326 18329
4546 1 5 . 1 1 153 153 LYS C C 176 179.100 179.100 177.548 1.552 18329
4547 1 5 . 1 1 153 153 LYS CA C 176 56.700 56.700 57.354 -0.654 18329
4548 1 5 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.498 -1.598 18329
4549 1 5 . 1 1 153 153 LYS H H 176 7.900 7.900 7.606 0.294 18329
4550 1 5 . 1 1 154 154 LYS N N 177 119.290 119.290 118.462 0.828 18329
4551 1 5 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.024 0.236 18329
4552 1 5 . 1 1 154 154 LYS C C 177 178.100 178.100 178.269 -0.169 18329
4553 1 5 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.297 -1.497 18329
4554 1 5 . 1 1 154 154 LYS CB C 177 31.800 31.800 31.644 0.156 18329
4555 1 5 . 1 1 154 154 LYS H H 177 7.540 7.540 7.691 -0.151 18329
4556 1 5 . 1 1 155 155 LYS N N 178 118.910 118.910 119.890 -0.980 18329
4557 1 5 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.067 -0.017 18329
4558 1 5 . 1 1 155 155 LYS C C 178 178.100 178.100 177.625 0.475 18329
4559 1 5 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.871 -0.871 18329
4560 1 5 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.333 -0.133 18329
4561 1 5 . 1 1 155 155 LYS H H 178 7.630 7.630 7.486 0.144 18329
4562 1 5 . 1 1 156 156 GLU N N 179 117.950 117.950 116.771 1.179 18329
4563 1 5 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.167 -0.057 18329
4564 1 5 . 1 1 156 156 GLU C C 179 176.700 176.700 178.902 -2.202 18329
4565 1 5 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.586 -1.086 18329
4566 1 5 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.825 -0.225 18329
4567 1 5 . 1 1 156 156 GLU H H 179 7.560 7.560 8.338 -0.778 18329
4568 1 5 . 1 1 157 157 ASN N N 180 116.590 116.590 115.697 0.893 18329
4569 1 5 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.535 0.185 18329
4570 1 5 . 1 1 157 157 ASN C C 180 175.000 175.000 175.605 -0.605 18329
4571 1 5 . 1 1 157 157 ASN CA C 180 52.700 52.700 54.559 -1.859 18329
4572 1 5 . 1 1 157 157 ASN CB C 180 38.800 38.800 39.042 -0.242 18329
4573 1 5 . 1 1 157 157 ASN H H 180 7.820 7.820 8.213 -0.393 18329
4574 1 5 . 1 1 158 158 SER HA H 181 4.450 4.450 4.140 0.310 18329
4575 1 5 . 1 1 158 158 SER CA C 181 60.400 60.400 60.176 0.224 18329
4576 1 5 . 1 1 158 158 SER CB C 181 63.500 63.500 62.021 1.479 18329
4577 1 5 . 1 1 158 158 SER H H 181 8.030 8.030 8.309 -0.279 18329
4578 1 5 . 1 1 159 159 THR N N 182 112.800 112.800 112.129 0.671 18329
4579 1 5 . 1 1 159 159 THR HA H 182 4.380 4.380 3.969 0.411 18329
4580 1 5 . 1 1 159 159 THR C C 182 174.300 174.300 173.971 0.329 18329
4581 1 5 . 1 1 159 159 THR CA C 182 61.800 61.800 63.445 -1.645 18329
4582 1 5 . 1 1 159 159 THR CB C 182 69.100 69.100 68.615 0.485 18329
4583 1 5 . 1 1 159 159 THR H H 182 8.070 8.070 8.243 -0.173 18329
4584 1 5 . 1 1 160 160 PHE N N 183 123.120 123.120 119.087 4.033 18329
4585 1 5 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.879 -0.439 18329
4586 1 5 . 1 1 160 160 PHE C C 183 175.100 175.100 175.939 -0.839 18329
4587 1 5 . 1 1 160 160 PHE CA C 183 58.900 58.900 56.153 2.747 18329
4588 1 5 . 1 1 160 160 PHE CB C 183 40.000 40.000 41.188 -1.188 18329
4589 1 5 . 1 1 160 160 PHE H H 183 7.900 7.900 7.510 0.390 18329
4590 1 5 . 1 1 161 161 THR N N 184 119.330 119.330 110.748 8.582 18329
4591 1 5 . 1 1 161 161 THR HA H 184 4.190 4.190 4.097 0.093 18329
4592 1 5 . 1 1 161 161 THR CA C 184 60.700 60.700 63.137 -2.437 18329
4593 1 5 . 1 1 161 161 THR CB C 184 70.700 70.700 68.382 2.318 18329
4594 1 5 . 1 1 161 161 THR H H 184 7.810 7.810 8.690 -0.880 18329
4595 1 5 . 1 1 162 162 ASP N N 185 123.190 123.190 118.155 5.035 18329
4596 1 5 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.670 -0.260 18329
4597 1 5 . 1 1 162 162 ASP C C 185 176.900 176.900 175.564 1.336 18329
4598 1 5 . 1 1 162 162 ASP CA C 185 53.900 53.900 53.556 0.344 18329
4599 1 5 . 1 1 162 162 ASP CB C 185 44.000 44.000 41.720 2.280 18329
4600 1 5 . 1 1 162 162 ASP H H 185 8.000 8.000 8.445 -0.445 18329
4601 1 5 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.192 0.288 18329
4602 1 5 . 1 1 163 163 GLU CA C 186 58.800 58.800 56.906 1.894 18329
4603 1 5 . 1 1 163 163 GLU CB C 186 28.100 28.100 30.194 -2.094 18329
4604 1 5 . 1 1 166 166 LYS N N 189 118.150 118.150 121.787 -3.637 18329
4605 1 5 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.088 0.132 18329
4606 1 5 . 1 1 166 166 LYS C C 189 177.500 177.500 176.882 0.618 18329
4607 1 5 . 1 1 166 166 LYS CA C 189 58.000 58.000 58.330 -0.330 18329
4608 1 5 . 1 1 166 166 LYS CB C 189 32.600 32.600 32.705 -0.105 18329
4609 1 5 . 1 1 166 166 LYS H H 189 8.890 8.890 8.020 0.870 18329
4610 1 5 . 1 1 167 167 ASN N N 190 116.210 116.210 118.868 -2.658 18329
4611 1 5 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.659 0.301 18329
4612 1 5 . 1 1 167 167 ASN C C 190 174.900 174.900 175.093 -0.193 18329
4613 1 5 . 1 1 167 167 ASN CA C 190 52.900 52.900 52.915 -0.015 18329
4614 1 5 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.853 -0.453 18329
4615 1 5 . 1 1 167 167 ASN H H 190 8.030 8.030 8.394 -0.364 18329
4616 1 6 . 1 1 2 2 ALA N N 25 125.000 125.000 126.010 -1.010 18329
4617 1 6 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.533 -0.163 18329
4618 1 6 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.326 -0.026 18329
4619 1 6 . 1 1 2 2 ALA CB C 25 19.700 19.700 19.613 0.087 18329
4620 1 6 . 1 1 2 2 ALA H H 25 8.690 8.690 8.225 0.465 18329
4621 1 6 . 1 1 3 3 GLY N N 26 106.920 106.920 107.562 -0.642 18329
4622 1 6 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.538 -1.538 18329
4623 1 6 . 1 1 3 3 GLY H H 26 7.940 7.940 7.822 0.118 18329
4624 1 6 . 1 1 4 4 LEU N N 27 119.140 119.140 121.226 -2.086 18329
4625 1 6 . 1 1 4 4 LEU HA H 27 4.410 4.410 3.891 0.519 18329
4626 1 6 . 1 1 4 4 LEU C C 27 177.100 177.100 176.808 0.292 18329
4627 1 6 . 1 1 4 4 LEU CA C 27 54.400 54.400 54.754 -0.354 18329
4628 1 6 . 1 1 4 4 LEU CB C 27 42.100 42.100 40.592 1.508 18329
4629 1 6 . 1 1 4 4 LEU H H 27 8.210 8.210 8.380 -0.170 18329
4630 1 6 . 1 1 5 5 THR N N 28 112.940 112.940 109.458 3.482 18329
4631 1 6 . 1 1 5 5 THR HA H 28 4.650 4.650 4.130 0.520 18329
4632 1 6 . 1 1 5 5 THR C C 28 175.500 175.500 175.290 0.210 18329
4633 1 6 . 1 1 5 5 THR CA C 28 60.100 60.100 62.569 -2.469 18329
4634 1 6 . 1 1 5 5 THR CB C 28 72.600 72.600 69.452 3.148 18329
4635 1 6 . 1 1 5 5 THR H H 28 9.220 9.220 7.392 1.828 18329
4636 1 6 . 1 1 6 6 GLY N N 29 108.230 108.230 107.184 1.046 18329
4637 1 6 . 1 1 6 6 GLY C C 29 174.800 174.800 175.610 -0.810 18329
4638 1 6 . 1 1 6 6 GLY CA C 29 46.000 46.000 44.110 1.890 18329
4639 1 6 . 1 1 6 6 GLY H H 29 8.520 8.520 8.259 0.261 18329
4640 1 6 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.093 -0.053 18329
4641 1 6 . 1 1 7 7 ALA CA C 30 54.800 54.800 54.264 0.536 18329
4642 1 6 . 1 1 7 7 ALA CB C 30 18.200 18.200 18.863 -0.663 18329
4643 1 6 . 1 1 8 8 THR N N 31 116.970 116.970 113.572 3.398 18329
4644 1 6 . 1 1 8 8 THR HA H 31 3.740 3.740 3.922 -0.182 18329
4645 1 6 . 1 1 8 8 THR C C 31 175.300 175.300 176.191 -0.891 18329
4646 1 6 . 1 1 8 8 THR CA C 31 67.000 67.000 65.718 1.282 18329
4647 1 6 . 1 1 8 8 THR CB C 31 68.700 68.700 68.422 0.278 18329
4648 1 6 . 1 1 8 8 THR H H 31 8.110 8.110 8.001 0.109 18329
4649 1 6 . 1 1 9 9 LYS N N 32 120.540 120.540 122.105 -1.565 18329
4650 1 6 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.098 -0.508 18329
4651 1 6 . 1 1 9 9 LYS C C 32 176.900 176.900 178.430 -1.530 18329
4652 1 6 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.457 0.343 18329
4653 1 6 . 1 1 9 9 LYS CB C 32 32.400 32.400 32.124 0.276 18329
4654 1 6 . 1 1 9 9 LYS H H 32 6.860 6.860 7.877 -1.017 18329
4655 1 6 . 1 1 10 10 ILE N N 33 115.940 115.940 119.559 -3.619 18329
4656 1 6 . 1 1 10 10 ILE HA H 33 3.710 3.710 4.076 -0.366 18329
4657 1 6 . 1 1 10 10 ILE C C 33 179.000 179.000 178.486 0.514 18329
4658 1 6 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.317 -0.317 18329
4659 1 6 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.651 0.349 18329
4660 1 6 . 1 1 10 10 ILE H H 33 7.380 7.380 7.444 -0.064 18329
4661 1 6 . 1 1 11 11 ARG N N 34 118.350 118.350 119.770 -1.420 18329
4662 1 6 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.096 -0.056 18329
4663 1 6 . 1 1 11 11 ARG C C 34 180.000 180.000 178.988 1.012 18329
4664 1 6 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.315 0.085 18329
4665 1 6 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.174 0.126 18329
4666 1 6 . 1 1 11 11 ARG H H 34 8.250 8.250 7.581 0.669 18329
4667 1 6 . 1 1 12 12 LEU N N 35 117.420 117.420 121.305 -3.885 18329
4668 1 6 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.176 -0.006 18329
4669 1 6 . 1 1 12 12 LEU C C 35 179.000 179.000 178.580 0.420 18329
4670 1 6 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.983 0.017 18329
4671 1 6 . 1 1 12 12 LEU CB C 35 40.800 40.800 42.086 -1.286 18329
4672 1 6 . 1 1 12 12 LEU H H 35 8.340 8.340 7.908 0.432 18329
4673 1 6 . 1 1 13 13 GLU N N 36 117.890 117.890 117.924 -0.034 18329
4674 1 6 . 1 1 13 13 GLU HA H 36 4.020 4.020 4.049 -0.029 18329
4675 1 6 . 1 1 13 13 GLU C C 36 180.100 180.100 178.933 1.167 18329
4676 1 6 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.049 1.151 18329
4677 1 6 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.209 -0.909 18329
4678 1 6 . 1 1 13 13 GLU H H 36 8.610 8.610 8.559 0.051 18329
4679 1 6 . 1 1 14 14 ARG N N 37 121.100 121.100 120.710 0.390 18329
4680 1 6 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.016 0.224 18329
4681 1 6 . 1 1 14 14 ARG C C 37 178.100 178.100 178.710 -0.610 18329
4682 1 6 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.515 -1.015 18329
4683 1 6 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.395 -0.195 18329
4684 1 6 . 1 1 14 14 ARG H H 37 7.980 7.980 8.544 -0.564 18329
4685 1 6 . 1 1 15 15 SER N N 38 115.420 115.420 114.212 1.208 18329
4686 1 6 . 1 1 15 15 SER HA H 38 4.380 4.380 4.482 -0.102 18329
4687 1 6 . 1 1 15 15 SER C C 38 177.300 177.300 175.393 1.907 18329
4688 1 6 . 1 1 15 15 SER CA C 38 62.200 62.200 60.800 1.400 18329
4689 1 6 . 1 1 15 15 SER CB C 38 63.200 63.200 63.140 0.060 18329
4690 1 6 . 1 1 15 15 SER H H 38 8.230 8.230 8.040 0.190 18329
4691 1 6 . 1 1 16 16 ALA N N 39 123.970 123.970 122.804 1.166 18329
4692 1 6 . 1 1 16 16 ALA HA H 39 3.630 3.630 4.123 -0.493 18329
4693 1 6 . 1 1 16 16 ALA C C 39 179.500 179.500 179.358 0.142 18329
4694 1 6 . 1 1 16 16 ALA CA C 39 54.700 54.700 53.825 0.875 18329
4695 1 6 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.663 -0.663 18329
4696 1 6 . 1 1 16 16 ALA H H 39 8.280 8.280 7.280 1.000 18329
4697 1 6 . 1 1 17 17 LYS N N 40 121.690 121.690 120.057 1.633 18329
4698 1 6 . 1 1 17 17 LYS HA H 40 4.090 4.090 3.972 0.118 18329
4699 1 6 . 1 1 17 17 LYS C C 40 178.000 178.000 177.826 0.174 18329
4700 1 6 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.466 -1.066 18329
4701 1 6 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.390 -0.590 18329
4702 1 6 . 1 1 17 17 LYS H H 40 7.930 7.930 8.095 -0.165 18329
4703 1 6 . 1 1 18 18 ASP N N 41 118.730 118.730 117.757 0.973 18329
4704 1 6 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.454 -0.094 18329
4705 1 6 . 1 1 18 18 ASP C C 41 179.900 179.900 178.318 1.582 18329
4706 1 6 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.558 1.142 18329
4707 1 6 . 1 1 18 18 ASP CB C 41 39.600 39.600 39.656 -0.056 18329
4708 1 6 . 1 1 18 18 ASP H H 41 8.320 8.320 7.843 0.477 18329
4709 1 6 . 1 1 19 19 ILE N N 42 118.180 118.180 120.325 -2.145 18329
4710 1 6 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.700 -0.010 18329
4711 1 6 . 1 1 19 19 ILE C C 42 177.400 177.400 177.811 -0.411 18329
4712 1 6 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.126 0.074 18329
4713 1 6 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.673 0.227 18329
4714 1 6 . 1 1 19 19 ILE H H 42 7.420 7.420 7.477 -0.057 18329
4715 1 6 . 1 1 20 20 THR N N 43 113.360 113.360 112.818 0.542 18329
4716 1 6 . 1 1 20 20 THR HA H 43 3.770 3.770 4.013 -0.243 18329
4717 1 6 . 1 1 20 20 THR C C 43 177.800 177.800 176.290 1.510 18329
4718 1 6 . 1 1 20 20 THR CA C 43 66.400 66.400 65.649 0.751 18329
4719 1 6 . 1 1 20 20 THR CB C 43 67.400 67.400 68.138 -0.738 18329
4720 1 6 . 1 1 20 20 THR H H 43 7.610 7.610 7.619 -0.009 18329
4721 1 6 . 1 1 21 21 ASP N N 44 123.650 123.650 122.003 1.647 18329
4722 1 6 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.374 0.036 18329
4723 1 6 . 1 1 21 21 ASP C C 44 179.200 179.200 178.334 0.866 18329
4724 1 6 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.312 -0.112 18329
4725 1 6 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.726 -1.126 18329
4726 1 6 . 1 1 21 21 ASP H H 44 9.260 9.260 7.770 1.490 18329
4727 1 6 . 1 1 22 22 GLU N N 45 123.560 123.560 118.858 4.702 18329
4728 1 6 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.121 0.249 18329
4729 1 6 . 1 1 22 22 GLU C C 45 178.500 178.500 179.371 -0.871 18329
4730 1 6 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.858 -0.659 18329
4731 1 6 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.755 -0.555 18329
4732 1 6 . 1 1 22 22 GLU H H 45 7.750 7.750 8.037 -0.287 18329
4733 1 6 . 1 1 23 23 ILE N N 46 119.940 119.940 115.005 4.935 18329
4734 1 6 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.729 -0.109 18329
4735 1 6 . 1 1 23 23 ILE C C 46 177.600 177.600 177.327 0.273 18329
4736 1 6 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.397 1.202 18329
4737 1 6 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.348 -0.348 18329
4738 1 6 . 1 1 23 23 ILE H H 46 8.360 8.360 7.359 1.001 18329
4739 1 6 . 1 1 24 24 ASP N N 47 120.730 120.730 120.796 -0.066 18329
4740 1 6 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.274 0.126 18329
4741 1 6 . 1 1 24 24 ASP C C 47 178.900 178.900 177.751 1.149 18329
4742 1 6 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.363 0.137 18329
4743 1 6 . 1 1 24 24 ASP CB C 47 39.900 39.900 41.089 -1.189 18329
4744 1 6 . 1 1 24 24 ASP H H 47 8.280 8.280 8.142 0.138 18329
4745 1 6 . 1 1 25 25 ALA N N 48 123.870 123.870 121.466 2.404 18329
4746 1 6 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.085 0.035 18329
4747 1 6 . 1 1 25 25 ALA C C 48 180.400 180.400 179.712 0.688 18329
4748 1 6 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.665 0.835 18329
4749 1 6 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.291 -0.491 18329
4750 1 6 . 1 1 25 25 ALA H H 48 7.880 7.880 7.505 0.375 18329
4751 1 6 . 1 1 26 26 ILE N N 49 121.970 121.970 118.261 3.709 18329
4752 1 6 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.618 0.112 18329
4753 1 6 . 1 1 26 26 ILE C C 49 178.400 178.400 177.424 0.976 18329
4754 1 6 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.936 0.964 18329
4755 1 6 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.739 -0.239 18329
4756 1 6 . 1 1 26 26 ILE H H 49 8.710 8.710 7.246 1.464 18329
4757 1 6 . 1 1 27 27 LYS N N 50 119.820 119.820 118.729 1.091 18329
4758 1 6 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.445 0.435 18329
4759 1 6 . 1 1 27 27 LYS C C 50 179.900 179.900 178.464 1.436 18329
4760 1 6 . 1 1 27 27 LYS CA C 50 60.400 60.400 58.734 1.666 18329
4761 1 6 . 1 1 27 27 LYS CB C 50 31.900 31.900 30.686 1.214 18329
4762 1 6 . 1 1 27 27 LYS H H 50 8.540 8.540 8.005 0.535 18329
4763 1 6 . 1 1 28 28 LYS N N 51 121.960 121.960 118.799 3.161 18329
4764 1 6 . 1 1 28 28 LYS HA H 51 4.090 4.090 3.912 0.178 18329
4765 1 6 . 1 1 28 28 LYS C C 51 179.200 179.200 178.689 0.511 18329
4766 1 6 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.372 -0.072 18329
4767 1 6 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.104 -0.704 18329
4768 1 6 . 1 1 28 28 LYS H H 51 8.070 8.070 7.358 0.712 18329
4769 1 6 . 1 1 29 29 ASP N N 52 121.710 121.710 119.148 2.562 18329
4770 1 6 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.470 0.000 18329
4771 1 6 . 1 1 29 29 ASP C C 52 178.500 178.500 177.942 0.558 18329
4772 1 6 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.866 0.134 18329
4773 1 6 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.770 0.230 18329
4774 1 6 . 1 1 29 29 ASP H H 52 8.340 8.340 7.512 0.828 18329
4775 1 6 . 1 1 30 30 ALA N N 53 121.990 121.990 121.116 0.874 18329
4776 1 6 . 1 1 30 30 ALA HA H 53 3.340 3.340 4.248 -0.908 18329
4777 1 6 . 1 1 30 30 ALA C C 53 179.500 179.500 179.101 0.399 18329
4778 1 6 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.748 0.352 18329
4779 1 6 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.792 -0.692 18329
4780 1 6 . 1 1 30 30 ALA H H 53 8.800 8.800 7.760 1.040 18329
4781 1 6 . 1 1 31 31 ALA N N 54 119.970 119.970 119.657 0.313 18329
4782 1 6 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.108 0.042 18329
4783 1 6 . 1 1 31 31 ALA C C 54 181.600 181.600 179.355 2.245 18329
4784 1 6 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.057 0.643 18329
4785 1 6 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.778 -0.978 18329
4786 1 6 . 1 1 31 31 ALA H H 54 7.730 7.730 7.422 0.308 18329
4787 1 6 . 1 1 32 32 LEU N N 55 119.660 119.660 117.291 2.369 18329
4788 1 6 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.019 0.121 18329
4789 1 6 . 1 1 32 32 LEU C C 55 179.100 179.100 178.228 0.872 18329
4790 1 6 . 1 1 32 32 LEU CA C 55 57.000 57.000 57.034 -0.034 18329
4791 1 6 . 1 1 32 32 LEU CB C 55 41.900 41.900 42.258 -0.358 18329
4792 1 6 . 1 1 32 32 LEU H H 55 7.660 7.660 7.589 0.071 18329
4793 1 6 . 1 1 33 33 LYS N N 56 117.160 117.160 111.273 5.887 18329
4794 1 6 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.361 -0.151 18329
4795 1 6 . 1 1 33 33 LYS C C 56 176.600 176.600 176.990 -0.390 18329
4796 1 6 . 1 1 33 33 LYS CA C 56 56.100 56.100 56.502 -0.403 18329
4797 1 6 . 1 1 33 33 LYS CB C 56 33.200 33.200 32.811 0.389 18329
4798 1 6 . 1 1 33 33 LYS H H 56 7.610 7.610 7.526 0.084 18329
4799 1 6 . 1 1 34 34 GLY N N 57 108.680 108.680 111.320 -2.640 18329
4800 1 6 . 1 1 34 34 GLY C C 57 174.400 174.400 173.925 0.475 18329
4801 1 6 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.211 0.989 18329
4802 1 6 . 1 1 34 34 GLY H H 57 7.710 7.710 7.710 -0.000 18329
4803 1 6 . 1 1 35 35 VAL N N 58 121.000 121.000 120.350 0.650 18329
4804 1 6 . 1 1 35 35 VAL HA H 58 3.900 3.900 3.577 0.323 18329
4805 1 6 . 1 1 35 35 VAL C C 58 174.200 174.200 174.820 -0.620 18329
4806 1 6 . 1 1 35 35 VAL CA C 58 61.500 61.500 63.530 -2.030 18329
4807 1 6 . 1 1 35 35 VAL CB C 58 32.800 32.800 32.181 0.619 18329
4808 1 6 . 1 1 35 35 VAL H H 58 7.990 7.990 8.145 -0.155 18329
4809 1 6 . 1 1 36 36 ASN N N 59 124.960 124.960 119.548 5.412 18329
4810 1 6 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.688 -0.018 18329
4811 1 6 . 1 1 36 36 ASN C C 59 175.700 175.700 175.111 0.589 18329
4812 1 6 . 1 1 36 36 ASN CA C 59 51.600 51.600 53.250 -1.650 18329
4813 1 6 . 1 1 36 36 ASN CB C 59 39.100 39.100 39.081 0.019 18329
4814 1 6 . 1 1 36 36 ASN H H 59 8.460 8.460 8.336 0.124 18329
4815 1 6 . 1 1 37 37 PHE N N 60 124.460 124.460 122.010 2.450 18329
4816 1 6 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.442 -0.302 18329
4817 1 6 . 1 1 37 37 PHE C C 60 177.000 177.000 176.344 0.656 18329
4818 1 6 . 1 1 37 37 PHE CA C 60 60.400 60.400 59.009 1.391 18329
4819 1 6 . 1 1 37 37 PHE CB C 60 39.200 39.200 40.719 -1.519 18329
4820 1 6 . 1 1 37 37 PHE H H 60 8.780 8.780 8.260 0.520 18329
4821 1 6 . 1 1 38 38 ASP N N 61 119.270 119.270 119.113 0.157 18329
4822 1 6 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.072 0.418 18329
4823 1 6 . 1 1 38 38 ASP C C 61 177.000 177.000 176.086 0.914 18329
4824 1 6 . 1 1 38 38 ASP CA C 61 55.500 55.500 55.570 -0.070 18329
4825 1 6 . 1 1 38 38 ASP CB C 61 40.000 40.000 40.490 -0.491 18329
4826 1 6 . 1 1 38 38 ASP H H 61 8.400 8.400 7.276 1.124 18329
4827 1 6 . 1 1 39 39 ALA N N 62 122.020 122.020 123.583 -1.563 18329
4828 1 6 . 1 1 39 39 ALA HA H 62 4.200 4.200 3.988 0.212 18329
4829 1 6 . 1 1 39 39 ALA C C 62 178.300 178.300 176.922 1.378 18329
4830 1 6 . 1 1 39 39 ALA CA C 62 52.900 52.900 53.325 -0.425 18329
4831 1 6 . 1 1 39 39 ALA CB C 62 18.500 18.500 17.761 0.739 18329
4832 1 6 . 1 1 39 39 ALA H H 62 7.740 7.740 8.304 -0.564 18329
4833 1 6 . 1 1 40 40 PHE N N 63 116.940 116.940 118.606 -1.666 18329
4834 1 6 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.214 0.166 18329
4835 1 6 . 1 1 40 40 PHE C C 63 176.100 176.100 174.928 1.172 18329
4836 1 6 . 1 1 40 40 PHE CA C 63 58.300 58.300 58.275 0.025 18329
4837 1 6 . 1 1 40 40 PHE CB C 63 38.800 38.800 38.808 -0.008 18329
4838 1 6 . 1 1 40 40 PHE H H 63 7.730 7.730 8.255 -0.525 18329
4839 1 6 . 1 1 41 41 LYS N N 64 119.840 119.840 124.195 -4.355 18329
4840 1 6 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.571 -0.351 18329
4841 1 6 . 1 1 41 41 LYS C C 64 176.100 176.100 176.313 -0.213 18329
4842 1 6 . 1 1 41 41 LYS CA C 64 56.600 56.600 55.968 0.632 18329
4843 1 6 . 1 1 41 41 LYS CB C 64 32.900 32.900 33.510 -0.610 18329
4844 1 6 . 1 1 41 41 LYS H H 64 7.650 7.650 7.613 0.037 18329
4845 1 6 . 1 1 42 42 ASP N N 65 120.770 120.770 119.192 1.578 18329
4846 1 6 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.571 -0.001 18329
4847 1 6 . 1 1 42 42 ASP C C 65 176.100 176.100 176.463 -0.363 18329
4848 1 6 . 1 1 42 42 ASP CA C 65 54.200 54.200 56.068 -1.868 18329
4849 1 6 . 1 1 42 42 ASP CB C 65 40.900 40.900 41.020 -0.120 18329
4850 1 6 . 1 1 42 42 ASP H H 65 8.030 8.030 8.414 -0.384 18329
4851 1 6 . 1 1 43 43 LYS N N 66 122.070 122.070 118.789 3.281 18329
4852 1 6 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.131 0.149 18329
4853 1 6 . 1 1 43 43 LYS C C 66 176.800 176.800 176.917 -0.117 18329
4854 1 6 . 1 1 43 43 LYS CA C 66 56.500 56.500 57.202 -0.702 18329
4855 1 6 . 1 1 43 43 LYS CB C 66 32.800 32.800 32.730 0.070 18329
4856 1 6 . 1 1 43 43 LYS H H 66 8.180 8.180 7.953 0.227 18329
4857 1 6 . 1 1 44 44 LYS N N 67 122.170 122.170 118.793 3.377 18329
4858 1 6 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.112 0.238 18329
4859 1 6 . 1 1 44 44 LYS C C 67 177.000 177.000 176.145 0.855 18329
4860 1 6 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.979 -0.379 18329
4861 1 6 . 1 1 44 44 LYS CB C 67 32.800 32.800 31.963 0.837 18329
4862 1 6 . 1 1 44 44 LYS H H 67 8.460 8.460 7.802 0.658 18329
4863 1 6 . 1 1 45 45 THR N N 68 114.390 114.390 117.250 -2.860 18329
4864 1 6 . 1 1 45 45 THR HA H 68 4.330 4.330 4.544 -0.214 18329
4865 1 6 . 1 1 45 45 THR C C 68 175.200 175.200 175.573 -0.373 18329
4866 1 6 . 1 1 45 45 THR CA C 68 62.000 62.000 62.536 -0.536 18329
4867 1 6 . 1 1 45 45 THR CB C 68 69.900 69.900 69.249 0.651 18329
4868 1 6 . 1 1 45 45 THR H H 68 8.120 8.120 8.187 -0.067 18329
4869 1 6 . 1 1 46 46 GLY N N 69 111.200 111.200 110.922 0.278 18329
4870 1 6 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.340 -0.140 18329
4871 1 6 . 1 1 46 46 GLY H H 69 8.450 8.450 7.669 0.781 18329
4872 1 6 . 1 1 47 47 SER CA C 70 58.400 58.400 58.337 0.063 18329
4873 1 6 . 1 1 47 47 SER CB C 70 64.000 64.000 63.612 0.388 18329
4874 1 6 . 1 1 48 48 GLY N N 71 111.200 111.200 112.477 -1.277 18329
4875 1 6 . 1 1 48 48 GLY CA C 71 45.000 45.000 46.306 -1.306 18329
4876 1 6 . 1 1 48 48 GLY H H 71 8.580 8.580 8.923 -0.343 18329
4877 1 6 . 1 1 49 49 VAL N N 72 118.910 118.910 119.980 -1.070 18329
4878 1 6 . 1 1 49 49 VAL HA H 72 4.130 4.130 4.518 -0.388 18329
4879 1 6 . 1 1 49 49 VAL C C 72 176.100 176.100 174.070 2.030 18329
4880 1 6 . 1 1 49 49 VAL CA C 72 62.100 62.100 59.759 2.341 18329
4881 1 6 . 1 1 49 49 VAL CB C 72 32.500 32.500 31.618 0.882 18329
4882 1 6 . 1 1 49 49 VAL H H 72 7.860 7.860 7.868 -0.008 18329
4883 1 6 . 1 1 50 50 SER N N 73 118.500 118.500 122.992 -4.492 18329
4884 1 6 . 1 1 50 50 SER C C 73 176.100 176.100 174.636 1.464 18329
4885 1 6 . 1 1 50 50 SER CA C 73 58.300 58.300 57.901 0.399 18329
4886 1 6 . 1 1 50 50 SER CB C 73 63.800 63.800 63.737 0.062 18329
4887 1 6 . 1 1 50 50 SER H H 73 8.300 8.300 8.577 -0.277 18329
4888 1 6 . 1 1 51 51 GLU N N 74 122.560 122.560 124.335 -1.775 18329
4889 1 6 . 1 1 51 51 GLU HA H 74 4.270 4.270 3.906 0.364 18329
4890 1 6 . 1 1 51 51 GLU CA C 74 55.700 55.700 58.976 -3.276 18329
4891 1 6 . 1 1 51 51 GLU CB C 74 30.500 30.500 28.460 2.040 18329
4892 1 6 . 1 1 51 51 GLU H H 74 8.360 8.360 9.013 -0.653 18329
4893 1 6 . 1 1 52 52 ASN N N 75 122.830 122.830 119.986 2.844 18329
4894 1 6 . 1 1 52 52 ASN HA H 75 4.820 4.820 5.156 -0.336 18329
4895 1 6 . 1 1 52 52 ASN C C 75 174.800 174.800 173.764 1.036 18329
4896 1 6 . 1 1 52 52 ASN CA C 75 51.400 51.400 50.912 0.488 18329
4897 1 6 . 1 1 52 52 ASN CB C 75 39.200 39.200 39.051 0.149 18329
4898 1 6 . 1 1 52 52 ASN H H 75 8.450 8.450 8.176 0.274 18329
4899 1 6 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.734 -0.554 18329
4900 1 6 . 1 1 53 53 PRO CA C 76 65.200 65.200 63.935 1.265 18329
4901 1 6 . 1 1 53 53 PRO CB C 76 32.000 32.000 32.241 -0.241 18329
4902 1 6 . 1 1 54 54 PHE N N 77 118.060 118.060 120.429 -2.369 18329
4903 1 6 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.295 -0.025 18329
4904 1 6 . 1 1 54 54 PHE C C 77 177.500 177.500 177.358 0.142 18329
4905 1 6 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.396 0.104 18329
4906 1 6 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.318 0.082 18329
4907 1 6 . 1 1 54 54 PHE H H 77 8.430 8.430 8.012 0.418 18329
4908 1 6 . 1 1 55 55 ILE N N 78 119.350 119.350 118.906 0.444 18329
4909 1 6 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.905 -0.405 18329
4910 1 6 . 1 1 55 55 ILE C C 78 177.400 177.400 176.886 0.514 18329
4911 1 6 . 1 1 55 55 ILE CA C 78 63.500 63.500 63.489 0.011 18329
4912 1 6 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.972 -0.972 18329
4913 1 6 . 1 1 55 55 ILE H H 78 7.540 7.540 7.761 -0.221 18329
4914 1 6 . 1 1 56 56 LEU N N 79 118.450 118.450 120.165 -1.715 18329
4915 1 6 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.164 -0.014 18329
4916 1 6 . 1 1 56 56 LEU C C 79 179.200 179.200 178.711 0.489 18329
4917 1 6 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.095 -0.295 18329
4918 1 6 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.724 -0.624 18329
4919 1 6 . 1 1 56 56 LEU H H 79 7.260 7.260 7.575 -0.315 18329
4920 1 6 . 1 1 57 57 GLU N N 80 117.980 117.980 118.159 -0.179 18329
4921 1 6 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.843 -0.193 18329
4922 1 6 . 1 1 57 57 GLU C C 80 178.700 178.700 178.473 0.227 18329
4923 1 6 . 1 1 57 57 GLU CA C 80 59.300 59.300 58.864 0.436 18329
4924 1 6 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.175 0.325 18329
4925 1 6 . 1 1 57 57 GLU H H 80 7.890 7.890 7.697 0.193 18329
4926 1 6 . 1 1 58 58 ALA N N 81 122.040 122.040 122.024 0.016 18329
4927 1 6 . 1 1 58 58 ALA HA H 81 3.800 3.800 4.032 -0.232 18329
4928 1 6 . 1 1 58 58 ALA C C 81 179.500 179.500 179.186 0.314 18329
4929 1 6 . 1 1 58 58 ALA CA C 81 55.200 55.200 55.288 -0.088 18329
4930 1 6 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.270 0.530 18329
4931 1 6 . 1 1 58 58 ALA H H 81 8.400 8.400 7.575 0.825 18329
4932 1 6 . 1 1 59 59 LYS N N 82 116.000 116.000 118.402 -2.402 18329
4933 1 6 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.075 -0.225 18329
4934 1 6 . 1 1 59 59 LYS C C 82 180.300 180.300 178.553 1.747 18329
4935 1 6 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.322 1.778 18329
4936 1 6 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.145 0.055 18329
4937 1 6 . 1 1 59 59 LYS H H 82 8.000 8.000 7.850 0.150 18329
4938 1 6 . 1 1 60 60 VAL N N 83 122.920 122.920 116.850 6.070 18329
4939 1 6 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.809 -0.479 18329
4940 1 6 . 1 1 60 60 VAL C C 83 178.300 178.300 178.546 -0.246 18329
4941 1 6 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.681 2.219 18329
4942 1 6 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.375 -0.174 18329
4943 1 6 . 1 1 60 60 VAL H H 83 8.110 8.110 7.136 0.974 18329
4944 1 6 . 1 1 61 61 ARG N N 84 121.770 121.770 119.468 2.302 18329
4945 1 6 . 1 1 61 61 ARG C C 84 179.500 179.500 178.539 0.961 18329
4946 1 6 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.074 0.126 18329
4947 1 6 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.995 0.805 18329
4948 1 6 . 1 1 61 61 ARG H H 84 8.710 8.710 7.498 1.212 18329
4949 1 6 . 1 1 62 62 ALA N N 85 119.450 119.450 121.343 -1.893 18329
4950 1 6 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.062 -0.172 18329
4951 1 6 . 1 1 62 62 ALA C C 85 179.500 179.500 178.931 0.569 18329
4952 1 6 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.564 -0.564 18329
4953 1 6 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.397 0.603 18329
4954 1 6 . 1 1 62 62 ALA H H 85 8.700 8.700 8.132 0.568 18329
4955 1 6 . 1 1 63 63 THR N N 86 106.650 106.650 109.526 -2.876 18329
4956 1 6 . 1 1 63 63 THR HA H 86 3.970 3.970 4.072 -0.102 18329
4957 1 6 . 1 1 63 63 THR C C 86 177.700 177.700 176.563 1.137 18329
4958 1 6 . 1 1 63 63 THR CA C 86 66.000 66.000 65.158 0.842 18329
4959 1 6 . 1 1 63 63 THR CB C 86 68.200 68.200 68.659 -0.459 18329
4960 1 6 . 1 1 63 63 THR H H 86 8.150 8.150 7.642 0.508 18329
4961 1 6 . 1 1 64 64 THR N N 87 120.430 120.430 119.890 0.540 18329
4962 1 6 . 1 1 64 64 THR HA H 87 4.050 4.050 3.989 0.061 18329
4963 1 6 . 1 1 64 64 THR C C 87 176.800 176.800 176.285 0.515 18329
4964 1 6 . 1 1 64 64 THR CA C 87 67.300 67.300 66.762 0.538 18329
4965 1 6 . 1 1 64 64 THR CB C 87 68.600 68.600 68.812 -0.212 18329
4966 1 6 . 1 1 64 64 THR H H 87 7.920 7.920 7.455 0.465 18329
4967 1 6 . 1 1 65 65 VAL N N 88 119.230 119.230 120.148 -0.918 18329
4968 1 6 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.765 0.215 18329
4969 1 6 . 1 1 65 65 VAL C C 88 178.500 178.500 177.805 0.695 18329
4970 1 6 . 1 1 65 65 VAL CA C 88 65.600 65.600 65.904 -0.304 18329
4971 1 6 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.189 0.511 18329
4972 1 6 . 1 1 65 65 VAL H H 88 7.380 7.380 7.528 -0.148 18329
4973 1 6 . 1 1 66 66 ALA N N 89 124.260 124.260 121.742 2.518 18329
4974 1 6 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.990 0.260 18329
4975 1 6 . 1 1 66 66 ALA C C 89 179.900 179.900 179.008 0.892 18329
4976 1 6 . 1 1 66 66 ALA CA C 89 54.900 54.900 54.929 -0.029 18329
4977 1 6 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.265 1.235 18329
4978 1 6 . 1 1 66 66 ALA H H 89 8.390 8.390 7.515 0.875 18329
4979 1 6 . 1 1 67 67 GLU N N 90 120.180 120.180 118.509 1.671 18329
4980 1 6 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.991 -0.271 18329
4981 1 6 . 1 1 67 67 GLU C C 90 177.600 177.600 178.598 -0.998 18329
4982 1 6 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.867 0.033 18329
4983 1 6 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.418 -1.118 18329
4984 1 6 . 1 1 67 67 GLU H H 90 8.520 8.520 8.383 0.137 18329
4985 1 6 . 1 1 68 68 LYS N N 91 116.340 116.340 117.863 -1.523 18329
4986 1 6 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.003 -0.043 18329
4987 1 6 . 1 1 68 68 LYS C C 91 179.200 179.200 179.112 0.088 18329
4988 1 6 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.938 0.862 18329
4989 1 6 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.250 -0.250 18329
4990 1 6 . 1 1 68 68 LYS H H 91 7.210 7.210 7.634 -0.424 18329
4991 1 6 . 1 1 69 69 PHE N N 92 120.990 120.990 120.574 0.416 18329
4992 1 6 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.243 0.267 18329
4993 1 6 . 1 1 69 69 PHE C C 92 175.100 175.100 176.840 -1.740 18329
4994 1 6 . 1 1 69 69 PHE CA C 92 59.800 59.800 60.957 -1.157 18329
4995 1 6 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.318 -0.118 18329
4996 1 6 . 1 1 69 69 PHE H H 92 7.180 7.180 7.672 -0.492 18329
4997 1 6 . 1 1 70 70 VAL N N 93 120.330 120.330 119.434 0.896 18329
4998 1 6 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.613 -0.523 18329
4999 1 6 . 1 1 70 70 VAL C C 93 177.500 177.500 178.385 -0.885 18329
5000 1 6 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.785 0.115 18329
5001 1 6 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.326 0.074 18329
5002 1 6 . 1 1 70 70 VAL H H 93 7.930 7.930 7.839 0.091 18329
5003 1 6 . 1 1 71 71 ILE N N 94 120.410 120.410 114.744 5.666 18329
5004 1 6 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.756 0.074 18329
5005 1 6 . 1 1 71 71 ILE C C 94 177.700 177.700 177.425 0.275 18329
5006 1 6 . 1 1 71 71 ILE CA C 94 65.000 65.000 64.408 0.592 18329
5007 1 6 . 1 1 71 71 ILE CB C 94 37.300 37.300 36.561 0.739 18329
5008 1 6 . 1 1 71 71 ILE H H 94 8.180 8.180 7.656 0.524 18329
5009 1 6 . 1 1 72 72 ALA N N 95 122.440 122.440 123.214 -0.774 18329
5010 1 6 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.850 0.110 18329
5011 1 6 . 1 1 72 72 ALA C C 95 179.600 179.600 179.321 0.279 18329
5012 1 6 . 1 1 72 72 ALA CA C 95 55.900 55.900 54.984 0.916 18329
5013 1 6 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.883 -0.683 18329
5014 1 6 . 1 1 72 72 ALA H H 95 7.340 7.340 7.374 -0.034 18329
5015 1 6 . 1 1 73 73 ILE N N 96 119.330 119.330 119.450 -0.120 18329
5016 1 6 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.602 -0.162 18329
5017 1 6 . 1 1 73 73 ILE C C 96 177.400 177.400 177.740 -0.340 18329
5018 1 6 . 1 1 73 73 ILE CA C 96 62.800 62.800 64.275 -1.475 18329
5019 1 6 . 1 1 73 73 ILE CB C 96 34.400 34.400 37.399 -2.999 18329
5020 1 6 . 1 1 73 73 ILE H H 96 7.820 7.820 7.560 0.260 18329
5021 1 6 . 1 1 74 74 GLU N N 97 118.440 118.440 120.954 -2.514 18329
5022 1 6 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.823 -0.133 18329
5023 1 6 . 1 1 74 74 GLU C C 97 180.500 180.500 178.995 1.505 18329
5024 1 6 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.940 -0.240 18329
5025 1 6 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.494 0.206 18329
5026 1 6 . 1 1 74 74 GLU H H 97 8.380 8.380 7.586 0.794 18329
5027 1 6 . 1 1 75 75 GLU N N 98 120.470 120.470 117.955 2.515 18329
5028 1 6 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.070 -0.130 18329
5029 1 6 . 1 1 75 75 GLU C C 98 180.600 180.600 179.189 1.411 18329
5030 1 6 . 1 1 75 75 GLU CA C 98 59.700 59.700 58.841 0.859 18329
5031 1 6 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.324 0.876 18329
5032 1 6 . 1 1 75 75 GLU H H 98 8.800 8.800 8.280 0.520 18329
5033 1 6 . 1 1 76 76 GLU N N 99 119.230 119.230 120.165 -0.935 18329
5034 1 6 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.074 0.066 18329
5035 1 6 . 1 1 76 76 GLU C C 99 178.900 178.900 178.764 0.136 18329
5036 1 6 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.991 -0.391 18329
5037 1 6 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.307 -0.007 18329
5038 1 6 . 1 1 76 76 GLU H H 99 8.840 8.840 8.433 0.407 18329
5039 1 6 . 1 1 77 77 ALA N N 100 121.950 121.950 120.989 0.961 18329
5040 1 6 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.200 -0.200 18329
5041 1 6 . 1 1 77 77 ALA C C 100 179.000 179.000 179.332 -0.332 18329
5042 1 6 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.201 1.099 18329
5043 1 6 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.547 -1.748 18329
5044 1 6 . 1 1 77 77 ALA H H 100 9.400 9.400 8.350 1.050 18329
5045 1 6 . 1 1 78 78 THR N N 101 111.820 111.820 114.115 -2.295 18329
5046 1 6 . 1 1 78 78 THR HA H 101 3.750 3.750 3.963 -0.213 18329
5047 1 6 . 1 1 78 78 THR CA C 101 67.500 67.500 65.813 1.687 18329
5048 1 6 . 1 1 78 78 THR CB C 101 68.600 68.600 68.684 -0.084 18329
5049 1 6 . 1 1 78 78 THR H H 101 7.770 7.770 7.556 0.214 18329
5050 1 6 . 1 1 79 79 LYS N N 102 122.940 122.940 118.978 3.962 18329
5051 1 6 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.106 -0.016 18329
5052 1 6 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.531 0.669 18329
5053 1 6 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.435 0.065 18329
5054 1 6 . 1 1 79 79 LYS H H 102 7.870 7.870 7.662 0.208 18329
5055 1 6 . 1 1 80 80 LEU N N 103 117.690 117.690 118.419 -0.729 18329
5056 1 6 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.440 0.050 18329
5057 1 6 . 1 1 80 80 LEU C C 103 178.140 178.140 178.937 -0.797 18329
5058 1 6 . 1 1 80 80 LEU CA C 103 54.000 54.000 56.109 -2.109 18329
5059 1 6 . 1 1 80 80 LEU CB C 103 43.100 43.100 41.769 1.331 18329
5060 1 6 . 1 1 80 80 LEU H H 103 7.550 7.550 7.370 0.180 18329
5061 1 6 . 1 1 81 81 LYS N N 104 122.210 122.210 115.085 7.125 18329
5062 1 6 . 1 1 81 81 LYS HA H 104 3.930 3.930 3.933 -0.003 18329
5063 1 6 . 1 1 81 81 LYS C C 104 178.000 178.000 176.028 1.972 18329
5064 1 6 . 1 1 81 81 LYS CA C 104 61.300 61.300 58.258 3.042 18329
5065 1 6 . 1 1 81 81 LYS CB C 104 32.800 32.800 31.404 1.397 18329
5066 1 6 . 1 1 81 81 LYS H H 104 7.500 7.500 8.206 -0.706 18329
5067 1 6 . 1 1 82 82 GLU N N 105 114.920 114.920 118.929 -4.009 18329
5068 1 6 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.293 0.267 18329
5069 1 6 . 1 1 82 82 GLU C C 105 177.900 177.900 177.554 0.346 18329
5070 1 6 . 1 1 82 82 GLU CA C 105 57.660 57.660 56.378 1.282 18329
5071 1 6 . 1 1 82 82 GLU CB C 105 30.400 30.400 30.068 0.332 18329
5072 1 6 . 1 1 82 82 GLU H H 105 8.780 8.780 7.938 0.842 18329
5073 1 6 . 1 1 83 83 THR N N 106 107.260 107.260 112.725 -5.465 18329
5074 1 6 . 1 1 83 83 THR HA H 106 4.550 4.550 4.028 0.522 18329
5075 1 6 . 1 1 83 83 THR C C 106 176.300 176.300 175.599 0.701 18329
5076 1 6 . 1 1 83 83 THR CA C 106 61.900 61.900 64.763 -2.863 18329
5077 1 6 . 1 1 83 83 THR CB C 106 70.400 70.400 69.061 1.339 18329
5078 1 6 . 1 1 83 83 THR H H 106 7.570 7.570 8.404 -0.834 18329
5079 1 6 . 1 1 84 84 GLY N N 107 112.110 112.110 109.029 3.081 18329
5080 1 6 . 1 1 84 84 GLY C C 107 172.800 172.800 175.376 -2.576 18329
5081 1 6 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.175 0.225 18329
5082 1 6 . 1 1 84 84 GLY H H 107 9.000 9.000 8.043 0.957 18329
5083 1 6 . 1 1 85 85 SER N N 108 119.030 119.030 116.966 2.064 18329
5084 1 6 . 1 1 85 85 SER CA C 108 56.300 56.300 59.190 -2.890 18329
5085 1 6 . 1 1 85 85 SER CB C 108 66.300 66.300 63.332 2.968 18329
5086 1 6 . 1 1 85 85 SER H H 108 8.950 8.950 8.707 0.243 18329
5087 1 6 . 1 1 86 86 SER HA H 109 4.480 4.480 4.262 0.218 18329
5088 1 6 . 1 1 86 86 SER C C 109 177.000 177.000 175.929 1.071 18329
5089 1 6 . 1 1 86 86 SER CA C 109 61.600 61.600 61.527 0.073 18329
5090 1 6 . 1 1 86 86 SER CB C 109 62.900 62.900 61.242 1.658 18329
5091 1 6 . 1 1 87 87 GLY N N 110 108.100 108.100 107.883 0.217 18329
5092 1 6 . 1 1 87 87 GLY C C 110 177.100 177.100 175.342 1.758 18329
5093 1 6 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.444 -0.244 18329
5094 1 6 . 1 1 87 87 GLY H H 110 8.480 8.480 8.378 0.102 18329
5095 1 6 . 1 1 88 88 GLU N N 111 123.040 123.040 120.991 2.049 18329
5096 1 6 . 1 1 88 88 GLU HA H 111 3.690 3.690 3.996 -0.306 18329
5097 1 6 . 1 1 88 88 GLU C C 111 177.700 177.700 178.706 -1.006 18329
5098 1 6 . 1 1 88 88 GLU CA C 111 59.500 59.500 59.022 0.478 18329
5099 1 6 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.379 -0.679 18329
5100 1 6 . 1 1 88 88 GLU H H 111 7.560 7.560 8.652 -1.092 18329
5101 1 6 . 1 1 89 89 PHE N N 112 118.270 118.270 116.266 2.004 18329
5102 1 6 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.406 0.014 18329
5103 1 6 . 1 1 89 89 PHE C C 112 178.600 178.600 178.049 0.551 18329
5104 1 6 . 1 1 89 89 PHE CA C 112 61.100 61.100 60.813 0.287 18329
5105 1 6 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.774 -0.874 18329
5106 1 6 . 1 1 89 89 PHE H H 112 7.200 7.200 7.465 -0.265 18329
5107 1 6 . 1 1 90 90 SER N N 113 115.980 115.980 115.557 0.423 18329
5108 1 6 . 1 1 90 90 SER HA H 113 4.290 4.290 4.171 0.119 18329
5109 1 6 . 1 1 90 90 SER C C 113 178.600 178.600 176.322 2.278 18329
5110 1 6 . 1 1 90 90 SER CA C 113 62.700 62.700 61.732 0.968 18329
5111 1 6 . 1 1 90 90 SER CB C 113 62.800 62.800 62.551 0.249 18329
5112 1 6 . 1 1 90 90 SER H H 113 8.830 8.830 7.794 1.036 18329
5113 1 6 . 1 1 91 91 ALA N N 114 123.130 123.130 124.078 -0.948 18329
5114 1 6 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.218 0.162 18329
5115 1 6 . 1 1 91 91 ALA C C 114 181.300 181.300 179.288 2.012 18329
5116 1 6 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.507 0.193 18329
5117 1 6 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.364 0.036 18329
5118 1 6 . 1 1 91 91 ALA H H 114 7.580 7.580 7.586 -0.006 18329
5119 1 6 . 1 1 92 92 MET N N 115 118.700 118.700 117.971 0.729 18329
5120 1 6 . 1 1 92 92 MET HA H 115 3.980 3.980 4.231 -0.251 18329
5121 1 6 . 1 1 92 92 MET C C 115 178.000 178.000 178.189 -0.189 18329
5122 1 6 . 1 1 92 92 MET CA C 115 61.000 61.000 59.105 1.895 18329
5123 1 6 . 1 1 92 92 MET CB C 115 31.400 31.400 32.812 -1.412 18329
5124 1 6 . 1 1 92 92 MET H H 115 7.880 7.880 7.817 0.063 18329
5125 1 6 . 1 1 93 93 TYR N N 116 119.200 119.200 120.832 -1.632 18329
5126 1 6 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.081 0.199 18329
5127 1 6 . 1 1 93 93 TYR C C 116 176.300 176.300 177.394 -1.094 18329
5128 1 6 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.849 0.251 18329
5129 1 6 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.307 -0.007 18329
5130 1 6 . 1 1 93 93 TYR H H 116 7.870 7.870 7.960 -0.090 18329
5131 1 6 . 1 1 94 94 ASP N N 117 120.210 120.210 119.074 1.136 18329
5132 1 6 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.471 -0.281 18329
5133 1 6 . 1 1 94 94 ASP C C 117 179.000 179.000 178.563 0.437 18329
5134 1 6 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.325 0.375 18329
5135 1 6 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.401 -0.401 18329
5136 1 6 . 1 1 94 94 ASP H H 117 8.720 8.720 7.981 0.739 18329
5137 1 6 . 1 1 95 95 LEU N N 118 118.420 118.420 121.446 -3.026 18329
5138 1 6 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.032 0.178 18329
5139 1 6 . 1 1 95 95 LEU C C 118 178.600 178.600 178.425 0.175 18329
5140 1 6 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.419 0.281 18329
5141 1 6 . 1 1 95 95 LEU CB C 118 43.100 43.100 42.126 0.974 18329
5142 1 6 . 1 1 95 95 LEU H H 118 7.510 7.510 7.823 -0.313 18329
5143 1 6 . 1 1 96 96 MET N N 119 118.470 118.470 118.946 -0.476 18329
5144 1 6 . 1 1 96 96 MET HA H 119 3.990 3.990 4.002 -0.012 18329
5145 1 6 . 1 1 96 96 MET C C 119 177.500 177.500 178.213 -0.713 18329
5146 1 6 . 1 1 96 96 MET CA C 119 60.500 60.500 58.110 2.390 18329
5147 1 6 . 1 1 96 96 MET CB C 119 33.900 33.900 31.638 2.262 18329
5148 1 6 . 1 1 96 96 MET H H 119 7.820 7.820 7.743 0.077 18329
5149 1 6 . 1 1 97 97 PHE N N 120 119.580 119.580 119.392 0.188 18329
5150 1 6 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.107 -0.297 18329
5151 1 6 . 1 1 97 97 PHE C C 120 178.800 178.800 177.724 1.076 18329
5152 1 6 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.192 0.608 18329
5153 1 6 . 1 1 97 97 PHE CB C 120 39.200 39.200 38.794 0.406 18329
5154 1 6 . 1 1 97 97 PHE H H 120 8.940 8.940 7.661 1.279 18329
5155 1 6 . 1 1 98 98 GLU N N 121 119.940 119.940 118.252 1.688 18329
5156 1 6 . 1 1 98 98 GLU HA H 121 3.880 3.880 3.890 -0.010 18329
5157 1 6 . 1 1 98 98 GLU C C 121 180.800 180.800 179.494 1.306 18329
5158 1 6 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.374 0.426 18329
5159 1 6 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.327 -0.127 18329
5160 1 6 . 1 1 98 98 GLU H H 121 8.690 8.690 7.839 0.851 18329
5161 1 6 . 1 1 99 99 VAL N N 122 115.350 115.350 113.832 1.518 18329
5162 1 6 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.705 0.035 18329
5163 1 6 . 1 1 99 99 VAL C C 122 176.500 176.500 176.929 -0.429 18329
5164 1 6 . 1 1 99 99 VAL CA C 122 64.500 64.500 65.058 -0.559 18329
5165 1 6 . 1 1 99 99 VAL CB C 122 31.300 31.300 30.997 0.303 18329
5166 1 6 . 1 1 99 99 VAL H H 122 8.210 8.210 7.737 0.473 18329
5167 1 6 . 1 1 100 100 SER N N 123 115.450 115.450 115.617 -0.167 18329
5168 1 6 . 1 1 100 100 SER HA H 123 4.270 4.270 4.148 0.122 18329
5169 1 6 . 1 1 100 100 SER C C 123 174.700 174.700 175.994 -1.294 18329
5170 1 6 . 1 1 100 100 SER CA C 123 62.000 62.000 60.789 1.211 18329
5171 1 6 . 1 1 100 100 SER H H 123 7.520 7.520 7.300 0.220 18329
5172 1 6 . 1 1 101 101 LYS N N 124 120.310 120.310 121.682 -1.372 18329
5173 1 6 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.027 -0.057 18329
5174 1 6 . 1 1 101 101 LYS C C 124 176.600 176.600 176.795 -0.195 18329
5175 1 6 . 1 1 101 101 LYS CA C 124 61.100 61.100 60.293 0.807 18329
5176 1 6 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.148 -1.648 18329
5177 1 6 . 1 1 101 101 LYS H H 124 6.930 6.930 7.139 -0.209 18329
5178 1 6 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.212 0.048 18329
5179 1 6 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.339 -0.139 18329
5180 1 6 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.240 -0.640 18329
5181 1 6 . 1 1 103 103 LEU N N 126 116.020 116.020 117.613 -1.593 18329
5182 1 6 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.056 -0.176 18329
5183 1 6 . 1 1 103 103 LEU C C 126 177.900 177.900 178.603 -0.703 18329
5184 1 6 . 1 1 103 103 LEU CA C 126 57.700 57.700 56.502 1.198 18329
5185 1 6 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.413 0.387 18329
5186 1 6 . 1 1 103 103 LEU H H 126 6.520 6.520 7.359 -0.839 18329
5187 1 6 . 1 1 104 104 GLN N N 127 120.500 120.500 118.978 1.522 18329
5188 1 6 . 1 1 104 104 GLN C C 127 180.600 180.600 177.450 3.150 18329
5189 1 6 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.340 -0.040 18329
5190 1 6 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.716 0.284 18329
5191 1 6 . 1 1 104 104 GLN H H 127 8.160 8.160 7.502 0.658 18329
5192 1 6 . 1 1 105 105 LYS N N 128 120.000 120.000 117.864 2.136 18329
5193 1 6 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.054 -0.004 18329
5194 1 6 . 1 1 105 105 LYS C C 128 177.100 177.100 178.150 -1.050 18329
5195 1 6 . 1 1 105 105 LYS CA C 128 58.500 58.500 58.359 0.141 18329
5196 1 6 . 1 1 105 105 LYS CB C 128 31.400 31.400 31.883 -0.483 18329
5197 1 6 . 1 1 105 105 LYS H H 128 7.810 7.810 7.866 -0.056 18329
5198 1 6 . 1 1 106 106 LEU N N 129 118.530 118.530 117.467 1.063 18329
5199 1 6 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.135 -0.165 18329
5200 1 6 . 1 1 106 106 LEU C C 129 175.200 175.200 177.803 -2.603 18329
5201 1 6 . 1 1 106 106 LEU CA C 129 54.500 54.500 56.871 -2.371 18329
5202 1 6 . 1 1 106 106 LEU CB C 129 42.400 42.400 42.370 0.030 18329
5203 1 6 . 1 1 106 106 LEU H H 129 7.220 7.220 7.307 -0.087 18329
5204 1 6 . 1 1 107 107 GLY N N 130 101.490 101.490 101.549 -0.059 18329
5205 1 6 . 1 1 107 107 GLY C C 130 174.800 174.800 173.491 1.309 18329
5206 1 6 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.509 0.591 18329
5207 1 6 . 1 1 107 107 GLY H H 130 7.560 7.560 8.039 -0.479 18329
5208 1 6 . 1 1 108 108 ILE N N 131 121.340 121.340 122.919 -1.579 18329
5209 1 6 . 1 1 108 108 ILE HA H 131 4.150 4.150 4.221 -0.071 18329
5210 1 6 . 1 1 108 108 ILE C C 131 174.300 174.300 174.350 -0.050 18329
5211 1 6 . 1 1 108 108 ILE CA C 131 60.400 60.400 60.949 -0.549 18329
5212 1 6 . 1 1 108 108 ILE CB C 131 35.200 35.200 38.144 -2.943 18329
5213 1 6 . 1 1 108 108 ILE H H 131 7.290 7.290 7.231 0.059 18329
5214 1 6 . 1 1 109 109 GLN N N 132 125.650 125.650 126.251 -0.601 18329
5215 1 6 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.657 -0.647 18329
5216 1 6 . 1 1 109 109 GLN C C 132 176.800 176.800 175.648 1.152 18329
5217 1 6 . 1 1 109 109 GLN CA C 132 57.600 57.600 54.541 3.059 18329
5218 1 6 . 1 1 109 109 GLN CB C 132 29.000 29.000 31.882 -2.882 18329
5219 1 6 . 1 1 109 109 GLN H H 132 8.080 8.080 8.513 -0.433 18329
5220 1 6 . 1 1 110 110 GLU N N 133 114.890 114.890 115.795 -0.905 18329
5221 1 6 . 1 1 110 110 GLU HA H 133 4.150 4.150 3.901 0.249 18329
5222 1 6 . 1 1 110 110 GLU C C 133 177.100 177.100 177.907 -0.807 18329
5223 1 6 . 1 1 110 110 GLU CA C 133 57.100 57.100 58.370 -1.270 18329
5224 1 6 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.847 -1.547 18329
5225 1 6 . 1 1 110 110 GLU H H 133 9.270 9.270 8.808 0.462 18329
5226 1 6 . 1 1 111 111 MET N N 134 121.210 121.210 117.734 3.476 18329
5227 1 6 . 1 1 111 111 MET HA H 134 4.350 4.350 4.241 0.109 18329
5228 1 6 . 1 1 111 111 MET C C 134 177.500 177.500 177.704 -0.204 18329
5229 1 6 . 1 1 111 111 MET CA C 134 57.900 57.900 59.013 -1.113 18329
5230 1 6 . 1 1 111 111 MET CB C 134 33.300 33.300 31.895 1.405 18329
5231 1 6 . 1 1 111 111 MET H H 134 7.620 7.620 8.233 -0.613 18329
5232 1 6 . 1 1 112 112 THR N N 135 113.170 113.170 112.108 1.062 18329
5233 1 6 . 1 1 112 112 THR HA H 135 3.920 3.920 4.101 -0.181 18329
5234 1 6 . 1 1 112 112 THR C C 135 176.400 176.400 176.279 0.121 18329
5235 1 6 . 1 1 112 112 THR CA C 135 65.900 65.900 66.023 -0.123 18329
5236 1 6 . 1 1 112 112 THR CB C 135 68.200 68.200 67.853 0.347 18329
5237 1 6 . 1 1 112 112 THR H H 135 8.320 8.320 8.137 0.183 18329
5238 1 6 . 1 1 113 113 LYS N N 136 123.440 123.440 121.940 1.500 18329
5239 1 6 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.133 -0.203 18329
5240 1 6 . 1 1 113 113 LYS C C 136 177.600 177.600 179.656 -2.056 18329
5241 1 6 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.215 -0.915 18329
5242 1 6 . 1 1 113 113 LYS CB C 136 32.000 32.000 31.197 0.803 18329
5243 1 6 . 1 1 113 113 LYS H H 136 8.060 8.060 8.079 -0.019 18329
5244 1 6 . 1 1 114 114 THR N N 137 114.590 114.590 117.365 -2.775 18329
5245 1 6 . 1 1 114 114 THR HA H 137 4.000 4.000 3.976 0.024 18329
5246 1 6 . 1 1 114 114 THR C C 137 176.800 176.800 176.613 0.187 18329
5247 1 6 . 1 1 114 114 THR CA C 137 67.600 67.600 66.748 0.852 18329
5248 1 6 . 1 1 114 114 THR CB C 137 69.200 69.200 68.757 0.442 18329
5249 1 6 . 1 1 114 114 THR H H 137 7.950 7.950 7.840 0.110 18329
5250 1 6 . 1 1 115 115 VAL N N 138 119.080 119.080 120.776 -1.696 18329
5251 1 6 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.749 0.071 18329
5252 1 6 . 1 1 115 115 VAL C C 138 176.900 176.900 177.585 -0.685 18329
5253 1 6 . 1 1 115 115 VAL CA C 138 66.800 66.800 65.584 1.216 18329
5254 1 6 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.863 0.637 18329
5255 1 6 . 1 1 115 115 VAL H H 138 7.320 7.320 7.896 -0.576 18329
5256 1 6 . 1 1 116 116 SER N N 139 116.630 116.630 115.080 1.550 18329
5257 1 6 . 1 1 116 116 SER HA H 139 4.680 4.680 4.458 0.222 18329
5258 1 6 . 1 1 116 116 SER C C 139 179.000 179.000 177.090 1.910 18329
5259 1 6 . 1 1 116 116 SER CA C 139 61.400 61.400 61.372 0.028 18329
5260 1 6 . 1 1 116 116 SER CB C 139 62.800 62.800 63.041 -0.241 18329
5261 1 6 . 1 1 116 116 SER H H 139 8.990 8.990 8.514 0.476 18329
5262 1 6 . 1 1 117 117 ASP N N 140 124.220 124.220 123.395 0.825 18329
5263 1 6 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.441 -0.081 18329
5264 1 6 . 1 1 117 117 ASP C C 140 179.900 179.900 177.980 1.920 18329
5265 1 6 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.986 0.313 18329
5266 1 6 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.796 -1.296 18329
5267 1 6 . 1 1 117 117 ASP H H 140 9.480 9.480 8.659 0.820 18329
5268 1 6 . 1 1 118 118 ALA N N 141 121.420 121.420 121.933 -0.513 18329
5269 1 6 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.054 0.226 18329
5270 1 6 . 1 1 118 118 ALA C C 141 179.800 179.800 178.534 1.266 18329
5271 1 6 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.511 -0.111 18329
5272 1 6 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.386 0.614 18329
5273 1 6 . 1 1 118 118 ALA H H 141 7.340 7.340 7.548 -0.208 18329
5274 1 6 . 1 1 119 119 ALA N N 142 121.680 121.680 119.568 2.112 18329
5275 1 6 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.102 0.028 18329
5276 1 6 . 1 1 119 119 ALA C C 142 178.800 178.800 178.404 0.396 18329
5277 1 6 . 1 1 119 119 ALA CA C 142 53.200 53.200 53.771 -0.571 18329
5278 1 6 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.872 -0.572 18329
5279 1 6 . 1 1 119 119 ALA H H 142 7.890 7.890 7.420 0.470 18329
5280 1 6 . 1 1 120 120 GLU N N 143 117.690 117.690 117.900 -0.210 18329
5281 1 6 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.293 -0.353 18329
5282 1 6 . 1 1 120 120 GLU C C 143 178.100 178.100 176.035 2.065 18329
5283 1 6 . 1 1 120 120 GLU CA C 143 58.700 58.700 57.087 1.613 18329
5284 1 6 . 1 1 120 120 GLU CB C 143 29.500 29.500 27.700 1.800 18329
5285 1 6 . 1 1 120 120 GLU H H 143 7.500 7.500 7.647 -0.147 18329
5286 1 6 . 1 1 121 121 GLU N N 144 115.680 115.680 119.340 -3.660 18329
5287 1 6 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.356 -0.196 18329
5288 1 6 . 1 1 121 121 GLU C C 144 176.100 176.100 175.364 0.736 18329
5289 1 6 . 1 1 121 121 GLU CA C 144 56.900 56.900 57.415 -0.515 18329
5290 1 6 . 1 1 121 121 GLU CB C 144 31.100 31.100 31.267 -0.167 18329
5291 1 6 . 1 1 121 121 GLU H H 144 6.970 6.970 8.325 -1.355 18329
5292 1 6 . 1 1 122 122 ASN N N 145 117.750 117.750 119.295 -1.545 18329
5293 1 6 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.095 -0.105 18329
5294 1 6 . 1 1 122 122 ASN C C 145 185.300 185.300 172.563 12.737 18329
5295 1 6 . 1 1 122 122 ASN CA C 145 50.200 50.200 50.976 -0.776 18329
5296 1 6 . 1 1 122 122 ASN CB C 145 41.100 41.100 39.049 2.051 18329
5297 1 6 . 1 1 122 122 ASN H H 145 7.670 7.670 7.859 -0.189 18329
5298 1 6 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.393 0.237 18329
5299 1 6 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.575 -1.575 18329
5300 1 6 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.472 -0.172 18329
5301 1 6 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.232 0.208 18329
5302 1 6 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.510 -0.610 18329
5303 1 6 . 1 1 124 124 PRO CB C 147 28.400 28.400 31.546 -3.146 18329
5304 1 6 . 1 1 125 125 THR N N 148 106.090 106.090 111.860 -5.770 18329
5305 1 6 . 1 1 125 125 THR HA H 148 4.530 4.530 4.062 0.468 18329
5306 1 6 . 1 1 125 125 THR C C 148 174.300 174.300 174.397 -0.097 18329
5307 1 6 . 1 1 125 125 THR CA C 148 61.200 61.200 64.400 -3.200 18329
5308 1 6 . 1 1 125 125 THR CB C 148 68.600 68.600 68.507 0.093 18329
5309 1 6 . 1 1 125 125 THR H H 148 7.800 7.800 8.025 -0.225 18329
5310 1 6 . 1 1 126 126 THR N N 149 108.650 108.650 109.108 -0.458 18329
5311 1 6 . 1 1 126 126 THR HA H 149 4.170 4.170 4.677 -0.507 18329
5312 1 6 . 1 1 126 126 THR C C 149 173.100 173.100 173.598 -0.498 18329
5313 1 6 . 1 1 126 126 THR CA C 149 58.800 58.800 58.577 0.223 18329
5314 1 6 . 1 1 126 126 THR CB C 149 73.100 73.100 72.122 0.978 18329
5315 1 6 . 1 1 126 126 THR H H 149 7.350 7.350 6.993 0.357 18329
5316 1 6 . 1 1 127 127 ALA N N 150 123.270 123.270 122.852 0.418 18329
5317 1 6 . 1 1 127 127 ALA HA H 150 3.020 3.020 2.833 0.187 18329
5318 1 6 . 1 1 127 127 ALA CA C 150 55.000 55.000 54.581 0.419 18329
5319 1 6 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.674 0.026 18329
5320 1 6 . 1 1 127 127 ALA H H 150 7.750 7.750 8.671 -0.921 18329
5321 1 6 . 1 1 128 128 GLN N N 151 114.920 114.920 117.805 -2.885 18329
5322 1 6 . 1 1 128 128 GLN HA H 151 3.750 3.750 3.957 -0.207 18329
5323 1 6 . 1 1 128 128 GLN C C 151 178.400 178.400 178.542 -0.142 18329
5324 1 6 . 1 1 128 128 GLN CA C 151 58.800 58.800 57.903 0.897 18329
5325 1 6 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.441 -1.240 18329
5326 1 6 . 1 1 128 128 GLN H H 151 8.300 8.300 8.559 -0.259 18329
5327 1 6 . 1 1 129 129 GLY N N 152 107.280 107.280 106.857 0.423 18329
5328 1 6 . 1 1 129 129 GLY C C 152 174.900 174.900 175.545 -0.645 18329
5329 1 6 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.919 0.281 18329
5330 1 6 . 1 1 129 129 GLY H H 152 7.920 7.920 7.705 0.215 18329
5331 1 6 . 1 1 130 130 VAL N N 153 119.440 119.440 122.684 -3.244 18329
5332 1 6 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.667 -0.197 18329
5333 1 6 . 1 1 130 130 VAL C C 153 177.700 177.700 177.453 0.247 18329
5334 1 6 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.698 2.102 18329
5335 1 6 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.598 0.103 18329
5336 1 6 . 1 1 130 130 VAL H H 153 7.390 7.390 7.071 0.319 18329
5337 1 6 . 1 1 131 131 LEU N N 154 118.990 118.990 118.439 0.551 18329
5338 1 6 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.762 0.148 18329
5339 1 6 . 1 1 131 131 LEU C C 154 180.400 180.400 178.928 1.472 18329
5340 1 6 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.200 0.100 18329
5341 1 6 . 1 1 131 131 LEU CB C 154 41.000 41.000 40.800 0.200 18329
5342 1 6 . 1 1 131 131 LEU H H 154 8.640 8.640 7.548 1.092 18329
5343 1 6 . 1 1 132 132 GLU N N 155 120.980 120.980 119.099 1.881 18329
5344 1 6 . 1 1 132 132 GLU HA H 155 4.120 4.120 3.980 0.140 18329
5345 1 6 . 1 1 132 132 GLU C C 155 179.400 179.400 179.157 0.243 18329
5346 1 6 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.230 -0.330 18329
5347 1 6 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.392 -0.192 18329
5348 1 6 . 1 1 132 132 GLU H H 155 8.000 8.000 7.480 0.520 18329
5349 1 6 . 1 1 133 133 ILE N N 156 121.830 121.830 119.563 2.267 18329
5350 1 6 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.747 -0.167 18329
5351 1 6 . 1 1 133 133 ILE C C 156 178.000 178.000 178.373 -0.373 18329
5352 1 6 . 1 1 133 133 ILE CA C 156 65.500 65.500 63.379 2.121 18329
5353 1 6 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.329 3.271 18329
5354 1 6 . 1 1 133 133 ILE H H 156 8.040 8.040 7.343 0.697 18329
5355 1 6 . 1 1 134 134 ALA N N 157 121.470 121.470 122.765 -1.295 18329
5356 1 6 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.866 0.034 18329
5357 1 6 . 1 1 134 134 ALA C C 157 178.800 178.800 179.276 -0.476 18329
5358 1 6 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.601 -0.301 18329
5359 1 6 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.075 0.025 18329
5360 1 6 . 1 1 134 134 ALA H H 157 8.950 8.950 8.697 0.253 18329
5361 1 6 . 1 1 135 135 LYS N N 158 118.470 118.470 118.354 0.116 18329
5362 1 6 . 1 1 135 135 LYS HA H 158 3.910 3.910 4.036 -0.126 18329
5363 1 6 . 1 1 135 135 LYS C C 158 179.300 179.300 179.175 0.125 18329
5364 1 6 . 1 1 135 135 LYS CA C 158 59.500 59.500 58.963 0.537 18329
5365 1 6 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.304 -0.904 18329
5366 1 6 . 1 1 135 135 LYS H H 158 8.000 8.000 7.928 0.072 18329
5367 1 6 . 1 1 136 136 LYS N N 159 118.000 118.000 119.627 -1.627 18329
5368 1 6 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.074 -0.024 18329
5369 1 6 . 1 1 136 136 LYS C C 159 180.200 180.200 179.203 0.997 18329
5370 1 6 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.314 0.186 18329
5371 1 6 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.342 -1.442 18329
5372 1 6 . 1 1 136 136 LYS H H 159 7.530 7.530 7.939 -0.409 18329
5373 1 6 . 1 1 137 137 MET N N 160 120.990 120.990 119.285 1.705 18329
5374 1 6 . 1 1 137 137 MET HA H 160 3.800 3.800 4.105 -0.305 18329
5375 1 6 . 1 1 137 137 MET C C 160 177.400 177.400 178.085 -0.685 18329
5376 1 6 . 1 1 137 137 MET CA C 160 60.600 60.600 59.784 0.816 18329
5377 1 6 . 1 1 137 137 MET CB C 160 31.800 31.800 32.394 -0.594 18329
5378 1 6 . 1 1 137 137 MET H H 160 8.660 8.660 8.354 0.306 18329
5379 1 6 . 1 1 138 138 ARG N N 161 119.480 119.480 118.745 0.735 18329
5380 1 6 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.904 -0.104 18329
5381 1 6 . 1 1 138 138 ARG C C 161 177.900 177.900 178.403 -0.503 18329
5382 1 6 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.709 0.891 18329
5383 1 6 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.198 -0.398 18329
5384 1 6 . 1 1 138 138 ARG H H 161 9.280 9.280 8.066 1.214 18329
5385 1 6 . 1 1 139 139 GLU N N 162 118.700 118.700 119.954 -1.254 18329
5386 1 6 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.058 -0.058 18329
5387 1 6 . 1 1 139 139 GLU C C 162 179.100 179.100 178.747 0.353 18329
5388 1 6 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.401 0.399 18329
5389 1 6 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.331 0.169 18329
5390 1 6 . 1 1 139 139 GLU H H 162 8.430 8.430 7.734 0.696 18329
5391 1 6 . 1 1 140 140 LYS N N 163 119.310 119.310 119.440 -0.130 18329
5392 1 6 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.073 0.137 18329
5393 1 6 . 1 1 140 140 LYS C C 163 177.900 177.900 179.290 -1.390 18329
5394 1 6 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.773 0.127 18329
5395 1 6 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.215 -1.115 18329
5396 1 6 . 1 1 140 140 LYS H H 163 7.440 7.440 7.724 -0.284 18329
5397 1 6 . 1 1 141 141 LEU N N 164 117.630 117.630 120.333 -2.703 18329
5398 1 6 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.109 -0.220 18329
5399 1 6 . 1 1 141 141 LEU C C 164 178.700 178.700 178.658 0.042 18329
5400 1 6 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.725 0.275 18329
5401 1 6 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.907 -0.407 18329
5402 1 6 . 1 1 141 141 LEU H H 164 8.180 8.180 7.981 0.199 18329
5403 1 6 . 1 1 142 142 GLN N N 165 117.710 117.710 117.471 0.239 18329
5404 1 6 . 1 1 142 142 GLN HA H 165 4.310 4.310 4.037 0.273 18329
5405 1 6 . 1 1 142 142 GLN C C 165 179.200 179.200 178.569 0.631 18329
5406 1 6 . 1 1 142 142 GLN CA C 165 58.500 58.500 58.513 -0.013 18329
5407 1 6 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.238 -0.738 18329
5408 1 6 . 1 1 142 142 GLN H H 165 8.730 8.730 7.988 0.742 18329
5409 1 6 . 1 1 143 143 ARG N N 166 121.410 121.410 120.431 0.979 18329
5410 1 6 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.109 0.081 18329
5411 1 6 . 1 1 143 143 ARG C C 166 179.700 179.700 178.545 1.155 18329
5412 1 6 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.830 -0.030 18329
5413 1 6 . 1 1 143 143 ARG CB C 166 30.200 30.200 30.150 0.050 18329
5414 1 6 . 1 1 143 143 ARG H H 166 8.050 8.050 7.691 0.359 18329
5415 1 6 . 1 1 144 144 VAL N N 167 120.950 120.950 117.646 3.304 18329
5416 1 6 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.749 0.011 18329
5417 1 6 . 1 1 144 144 VAL C C 167 179.200 179.200 178.036 1.164 18329
5418 1 6 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.469 -0.069 18329
5419 1 6 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.445 0.654 18329
5420 1 6 . 1 1 144 144 VAL H H 167 8.190 8.190 7.357 0.833 18329
5421 1 6 . 1 1 145 145 HIS N N 168 123.520 123.520 118.309 5.211 18329
5422 1 6 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.385 -0.485 18329
5423 1 6 . 1 1 145 145 HIS C C 168 177.100 177.100 177.871 -0.771 18329
5424 1 6 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.666 1.634 18329
5425 1 6 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.380 -0.480 18329
5426 1 6 . 1 1 145 145 HIS H H 168 9.240 9.240 7.646 1.594 18329
5427 1 6 . 1 1 146 146 THR N N 169 115.020 115.020 116.918 -1.898 18329
5428 1 6 . 1 1 146 146 THR HA H 169 3.860 3.860 4.138 -0.278 18329
5429 1 6 . 1 1 146 146 THR C C 169 175.700 175.700 176.439 -0.739 18329
5430 1 6 . 1 1 146 146 THR CA C 169 67.200 67.200 67.261 -0.062 18329
5431 1 6 . 1 1 146 146 THR CB C 169 69.300 69.300 68.570 0.730 18329
5432 1 6 . 1 1 146 146 THR H H 169 8.750 8.750 8.659 0.091 18329
5433 1 6 . 1 1 147 147 LYS N N 170 120.300 120.300 121.330 -1.030 18329
5434 1 6 . 1 1 147 147 LYS HA H 170 4.000 4.000 4.041 -0.041 18329
5435 1 6 . 1 1 147 147 LYS C C 170 179.300 179.300 179.097 0.203 18329
5436 1 6 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.564 -0.464 18329
5437 1 6 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.007 -0.207 18329
5438 1 6 . 1 1 147 147 LYS H H 170 8.020 8.020 8.142 -0.122 18329
5439 1 6 . 1 1 148 148 ASN N N 171 117.600 117.600 118.301 -0.701 18329
5440 1 6 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.526 -0.206 18329
5441 1 6 . 1 1 148 148 ASN C C 171 175.400 175.400 177.723 -2.323 18329
5442 1 6 . 1 1 148 148 ASN CA C 171 57.700 57.700 56.270 1.430 18329
5443 1 6 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.500 1.200 18329
5444 1 6 . 1 1 148 148 ASN H H 171 7.810 7.810 7.705 0.105 18329
5445 1 6 . 1 1 149 149 TYR N N 172 121.560 121.560 121.600 -0.040 18329
5446 1 6 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.136 -0.246 18329
5447 1 6 . 1 1 149 149 TYR C C 172 176.900 176.900 177.457 -0.557 18329
5448 1 6 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.972 -0.472 18329
5449 1 6 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.661 0.259 18329
5450 1 6 . 1 1 149 149 TYR H H 172 9.020 9.020 7.869 1.151 18329
5451 1 6 . 1 1 150 150 CYS N N 173 116.050 116.050 118.156 -2.106 18329
5452 1 6 . 1 1 150 150 CYS C C 173 177.100 177.100 176.557 0.543 18329
5453 1 6 . 1 1 150 150 CYS CA C 173 58.400 58.400 60.536 -2.136 18329
5454 1 6 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.291 12.309 18329
5455 1 6 . 1 1 150 150 CYS H H 173 8.810 8.810 8.423 0.387 18329
5456 1 6 . 1 1 151 151 THR N N 174 117.190 117.190 114.005 3.185 18329
5457 1 6 . 1 1 151 151 THR HA H 174 3.880 3.880 4.022 -0.142 18329
5458 1 6 . 1 1 151 151 THR C C 174 176.000 176.000 176.884 -0.884 18329
5459 1 6 . 1 1 151 151 THR CA C 174 66.900 66.900 65.652 1.248 18329
5460 1 6 . 1 1 151 151 THR CB C 174 68.500 68.500 68.663 -0.163 18329
5461 1 6 . 1 1 151 151 THR H H 174 7.720 7.720 7.925 -0.205 18329
5462 1 6 . 1 1 152 152 LEU N N 175 123.110 123.110 123.092 0.018 18329
5463 1 6 . 1 1 152 152 LEU HA H 175 3.810 3.810 3.961 -0.151 18329
5464 1 6 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.638 0.362 18329
5465 1 6 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.628 -0.128 18329
5466 1 6 . 1 1 152 152 LEU H H 175 7.870 7.870 7.737 0.133 18329
5467 1 6 . 1 1 153 153 LYS N N 176 117.270 117.270 117.470 -0.200 18329
5468 1 6 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.887 -0.187 18329
5469 1 6 . 1 1 153 153 LYS C C 176 179.100 179.100 178.035 1.065 18329
5470 1 6 . 1 1 153 153 LYS CA C 176 56.700 56.700 57.840 -1.140 18329
5471 1 6 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.288 -1.388 18329
5472 1 6 . 1 1 153 153 LYS H H 176 7.900 7.900 7.431 0.469 18329
5473 1 6 . 1 1 154 154 LYS N N 177 119.290 119.290 120.870 -1.580 18329
5474 1 6 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.112 0.148 18329
5475 1 6 . 1 1 154 154 LYS C C 177 178.100 178.100 178.469 -0.369 18329
5476 1 6 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.712 -1.912 18329
5477 1 6 . 1 1 154 154 LYS CB C 177 31.800 31.800 32.250 -0.450 18329
5478 1 6 . 1 1 154 154 LYS H H 177 7.540 7.540 7.660 -0.120 18329
5479 1 6 . 1 1 155 155 LYS N N 178 118.910 118.910 117.980 0.930 18329
5480 1 6 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.000 0.050 18329
5481 1 6 . 1 1 155 155 LYS C C 178 178.100 178.100 178.125 -0.025 18329
5482 1 6 . 1 1 155 155 LYS CA C 178 58.000 58.000 59.040 -1.040 18329
5483 1 6 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.311 -0.111 18329
5484 1 6 . 1 1 155 155 LYS H H 178 7.630 7.630 7.576 0.054 18329
5485 1 6 . 1 1 156 156 GLU N N 179 117.950 117.950 117.184 0.766 18329
5486 1 6 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.091 0.019 18329
5487 1 6 . 1 1 156 156 GLU C C 179 176.700 176.700 178.473 -1.773 18329
5488 1 6 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.342 -0.842 18329
5489 1 6 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.656 -0.056 18329
5490 1 6 . 1 1 156 156 GLU H H 179 7.560 7.560 7.879 -0.319 18329
5491 1 6 . 1 1 157 157 ASN N N 180 116.590 116.590 116.658 -0.068 18329
5492 1 6 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.328 0.392 18329
5493 1 6 . 1 1 157 157 ASN C C 180 175.000 175.000 177.026 -2.026 18329
5494 1 6 . 1 1 157 157 ASN CA C 180 52.700 52.700 55.603 -2.903 18329
5495 1 6 . 1 1 157 157 ASN CB C 180 38.800 38.800 38.997 -0.197 18329
5496 1 6 . 1 1 157 157 ASN H H 180 7.820 7.820 7.838 -0.018 18329
5497 1 6 . 1 1 158 158 SER HA H 181 4.450 4.450 3.994 0.457 18329
5498 1 6 . 1 1 158 158 SER CA C 181 60.400 60.400 61.030 -0.630 18329
5499 1 6 . 1 1 158 158 SER CB C 181 63.500 63.500 61.852 1.648 18329
5500 1 6 . 1 1 158 158 SER H H 181 8.030 8.030 7.890 0.140 18329
5501 1 6 . 1 1 159 159 THR N N 182 112.800 112.800 114.164 -1.364 18329
5502 1 6 . 1 1 159 159 THR HA H 182 4.380 4.380 4.101 0.279 18329
5503 1 6 . 1 1 159 159 THR C C 182 174.300 174.300 175.559 -1.259 18329
5504 1 6 . 1 1 159 159 THR CA C 182 61.800 61.800 64.753 -2.953 18329
5505 1 6 . 1 1 159 159 THR CB C 182 69.100 69.100 69.268 -0.168 18329
5506 1 6 . 1 1 159 159 THR H H 182 8.070 8.070 8.233 -0.163 18329
5507 1 6 . 1 1 160 160 PHE N N 183 123.120 123.120 118.236 4.884 18329
5508 1 6 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.521 -0.081 18329
5509 1 6 . 1 1 160 160 PHE C C 183 175.100 175.100 173.731 1.369 18329
5510 1 6 . 1 1 160 160 PHE CA C 183 58.900 58.900 58.845 0.055 18329
5511 1 6 . 1 1 160 160 PHE CB C 183 40.000 40.000 39.963 0.037 18329
5512 1 6 . 1 1 160 160 PHE H H 183 7.900 7.900 7.660 0.240 18329
5513 1 6 . 1 1 161 161 THR N N 184 119.330 119.330 113.779 5.551 18329
5514 1 6 . 1 1 161 161 THR HA H 184 4.190 4.190 4.027 0.163 18329
5515 1 6 . 1 1 161 161 THR CA C 184 60.700 60.700 62.875 -2.175 18329
5516 1 6 . 1 1 161 161 THR CB C 184 70.700 70.700 68.837 1.863 18329
5517 1 6 . 1 1 161 161 THR H H 184 7.810 7.810 8.066 -0.256 18329
5518 1 6 . 1 1 162 162 ASP N N 185 123.190 123.190 122.597 0.593 18329
5519 1 6 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.538 -0.128 18329
5520 1 6 . 1 1 162 162 ASP C C 185 176.900 176.900 176.148 0.752 18329
5521 1 6 . 1 1 162 162 ASP CA C 185 53.900 53.900 53.355 0.545 18329
5522 1 6 . 1 1 162 162 ASP CB C 185 44.000 44.000 41.092 2.908 18329
5523 1 6 . 1 1 162 162 ASP H H 185 8.000 8.000 8.365 -0.365 18329
5524 1 6 . 1 1 163 163 GLU HA H 186 4.480 4.480 3.949 0.531 18329
5525 1 6 . 1 1 163 163 GLU CA C 186 58.800 58.800 58.088 0.712 18329
5526 1 6 . 1 1 163 163 GLU CB C 186 28.100 28.100 29.957 -1.857 18329
5527 1 6 . 1 1 166 166 LYS N N 189 118.150 118.150 118.511 -0.361 18329
5528 1 6 . 1 1 166 166 LYS HA H 189 4.220 4.220 3.998 0.222 18329
5529 1 6 . 1 1 166 166 LYS C C 189 177.500 177.500 174.621 2.879 18329
5530 1 6 . 1 1 166 166 LYS CA C 189 58.000 58.000 56.042 1.958 18329
5531 1 6 . 1 1 166 166 LYS CB C 189 32.600 32.600 31.420 1.180 18329
5532 1 6 . 1 1 166 166 LYS H H 189 8.890 8.890 8.111 0.779 18329
5533 1 6 . 1 1 167 167 ASN N N 190 116.210 116.210 120.166 -3.956 18329
5534 1 6 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.340 0.620 18329
5535 1 6 . 1 1 167 167 ASN C C 190 174.900 174.900 175.100 -0.200 18329
5536 1 6 . 1 1 167 167 ASN CA C 190 52.900 52.900 54.448 -1.548 18329
5537 1 6 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.188 0.212 18329
5538 1 6 . 1 1 167 167 ASN H H 190 8.030 8.030 8.428 -0.398 18329
5539 1 7 . 1 1 2 2 ALA N N 25 125.000 125.000 127.679 -2.679 18329
5540 1 7 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.656 -0.286 18329
5541 1 7 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.775 -0.475 18329
5542 1 7 . 1 1 2 2 ALA CB C 25 19.700 19.700 18.229 1.471 18329
5543 1 7 . 1 1 2 2 ALA H H 25 8.690 8.690 8.664 0.026 18329
5544 1 7 . 1 1 3 3 GLY N N 26 106.920 106.920 109.521 -2.601 18329
5545 1 7 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.629 -1.629 18329
5546 1 7 . 1 1 3 3 GLY H H 26 7.940 7.940 8.265 -0.325 18329
5547 1 7 . 1 1 4 4 LEU N N 27 119.140 119.140 117.919 1.221 18329
5548 1 7 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.049 0.361 18329
5549 1 7 . 1 1 4 4 LEU C C 27 177.100 177.100 176.379 0.721 18329
5550 1 7 . 1 1 4 4 LEU CA C 27 54.400 54.400 56.217 -1.817 18329
5551 1 7 . 1 1 4 4 LEU CB C 27 42.100 42.100 42.082 0.018 18329
5552 1 7 . 1 1 4 4 LEU H H 27 8.210 8.210 8.041 0.169 18329
5553 1 7 . 1 1 5 5 THR N N 28 112.940 112.940 110.618 2.322 18329
5554 1 7 . 1 1 5 5 THR HA H 28 4.650 4.650 4.338 0.312 18329
5555 1 7 . 1 1 5 5 THR C C 28 175.500 175.500 173.872 1.628 18329
5556 1 7 . 1 1 5 5 THR CA C 28 60.100 60.100 62.019 -1.919 18329
5557 1 7 . 1 1 5 5 THR CB C 28 72.600 72.600 68.804 3.796 18329
5558 1 7 . 1 1 5 5 THR H H 28 9.220 9.220 7.952 1.268 18329
5559 1 7 . 1 1 6 6 GLY N N 29 108.230 108.230 109.546 -1.316 18329
5560 1 7 . 1 1 6 6 GLY C C 29 174.800 174.800 174.114 0.686 18329
5561 1 7 . 1 1 6 6 GLY CA C 29 46.000 46.000 45.481 0.519 18329
5562 1 7 . 1 1 6 6 GLY H H 29 8.520 8.520 8.818 -0.298 18329
5563 1 7 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.599 -0.559 18329
5564 1 7 . 1 1 7 7 ALA CA C 30 54.800 54.800 53.189 1.611 18329
5565 1 7 . 1 1 7 7 ALA CB C 30 18.200 18.200 19.092 -0.892 18329
5566 1 7 . 1 1 8 8 THR N N 31 116.970 116.970 116.058 0.912 18329
5567 1 7 . 1 1 8 8 THR HA H 31 3.740 3.740 3.988 -0.248 18329
5568 1 7 . 1 1 8 8 THR C C 31 175.300 175.300 176.060 -0.760 18329
5569 1 7 . 1 1 8 8 THR CA C 31 67.000 67.000 67.137 -0.137 18329
5570 1 7 . 1 1 8 8 THR CB C 31 68.700 68.700 68.790 -0.090 18329
5571 1 7 . 1 1 8 8 THR H H 31 8.110 8.110 8.346 -0.236 18329
5572 1 7 . 1 1 9 9 LYS N N 32 120.540 120.540 121.990 -1.450 18329
5573 1 7 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.230 -0.640 18329
5574 1 7 . 1 1 9 9 LYS C C 32 176.900 176.900 178.742 -1.842 18329
5575 1 7 . 1 1 9 9 LYS CA C 32 59.800 59.800 58.794 1.006 18329
5576 1 7 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.916 0.484 18329
5577 1 7 . 1 1 9 9 LYS H H 32 6.860 6.860 8.230 -1.370 18329
5578 1 7 . 1 1 10 10 ILE N N 33 115.940 115.940 118.028 -2.088 18329
5579 1 7 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.745 -0.035 18329
5580 1 7 . 1 1 10 10 ILE C C 33 179.000 179.000 178.177 0.823 18329
5581 1 7 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.299 -0.299 18329
5582 1 7 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.489 0.511 18329
5583 1 7 . 1 1 10 10 ILE H H 33 7.380 7.380 8.046 -0.666 18329
5584 1 7 . 1 1 11 11 ARG N N 34 118.350 118.350 120.955 -2.605 18329
5585 1 7 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.074 -0.034 18329
5586 1 7 . 1 1 11 11 ARG C C 34 180.000 180.000 178.592 1.408 18329
5587 1 7 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.744 -0.344 18329
5588 1 7 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.179 0.121 18329
5589 1 7 . 1 1 11 11 ARG H H 34 8.250 8.250 7.585 0.665 18329
5590 1 7 . 1 1 12 12 LEU N N 35 117.420 117.420 119.581 -2.161 18329
5591 1 7 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.110 0.060 18329
5592 1 7 . 1 1 12 12 LEU C C 35 179.000 179.000 179.301 -0.301 18329
5593 1 7 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.845 0.155 18329
5594 1 7 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.891 -1.091 18329
5595 1 7 . 1 1 12 12 LEU H H 35 8.340 8.340 7.976 0.364 18329
5596 1 7 . 1 1 13 13 GLU N N 36 117.890 117.890 119.362 -1.472 18329
5597 1 7 . 1 1 13 13 GLU HA H 36 4.020 4.020 4.141 -0.121 18329
5598 1 7 . 1 1 13 13 GLU C C 36 180.100 180.100 178.701 1.399 18329
5599 1 7 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.200 1.000 18329
5600 1 7 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.415 -1.115 18329
5601 1 7 . 1 1 13 13 GLU H H 36 8.610 8.610 8.071 0.539 18329
5602 1 7 . 1 1 14 14 ARG N N 37 121.100 121.100 120.105 0.995 18329
5603 1 7 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.041 0.199 18329
5604 1 7 . 1 1 14 14 ARG C C 37 178.100 178.100 178.694 -0.594 18329
5605 1 7 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.710 -1.210 18329
5606 1 7 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.287 -0.087 18329
5607 1 7 . 1 1 14 14 ARG H H 37 7.980 7.980 8.275 -0.295 18329
5608 1 7 . 1 1 15 15 SER N N 38 115.420 115.420 114.387 1.033 18329
5609 1 7 . 1 1 15 15 SER HA H 38 4.380 4.380 4.501 -0.121 18329
5610 1 7 . 1 1 15 15 SER C C 38 177.300 177.300 175.866 1.434 18329
5611 1 7 . 1 1 15 15 SER CA C 38 62.200 62.200 61.011 1.189 18329
5612 1 7 . 1 1 15 15 SER CB C 38 63.200 63.200 63.505 -0.305 18329
5613 1 7 . 1 1 15 15 SER H H 38 8.230 8.230 8.240 -0.010 18329
5614 1 7 . 1 1 16 16 ALA N N 39 123.970 123.970 123.903 0.067 18329
5615 1 7 . 1 1 16 16 ALA HA H 39 3.630 3.630 3.712 -0.082 18329
5616 1 7 . 1 1 16 16 ALA C C 39 179.500 179.500 178.615 0.885 18329
5617 1 7 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.379 0.321 18329
5618 1 7 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.332 -0.332 18329
5619 1 7 . 1 1 16 16 ALA H H 39 8.280 8.280 7.635 0.645 18329
5620 1 7 . 1 1 17 17 LYS N N 40 121.690 121.690 118.696 2.994 18329
5621 1 7 . 1 1 17 17 LYS HA H 40 4.090 4.090 4.008 0.082 18329
5622 1 7 . 1 1 17 17 LYS C C 40 178.000 178.000 178.083 -0.083 18329
5623 1 7 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.132 -0.731 18329
5624 1 7 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.390 -0.590 18329
5625 1 7 . 1 1 17 17 LYS H H 40 7.930 7.930 8.111 -0.181 18329
5626 1 7 . 1 1 18 18 ASP N N 41 118.730 118.730 119.143 -0.413 18329
5627 1 7 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.451 -0.091 18329
5628 1 7 . 1 1 18 18 ASP C C 41 179.900 179.900 178.547 1.353 18329
5629 1 7 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.841 0.859 18329
5630 1 7 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.188 -0.588 18329
5631 1 7 . 1 1 18 18 ASP H H 41 8.320 8.320 7.780 0.540 18329
5632 1 7 . 1 1 19 19 ILE N N 42 118.180 118.180 119.193 -1.013 18329
5633 1 7 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.709 -0.019 18329
5634 1 7 . 1 1 19 19 ILE C C 42 177.400 177.400 177.631 -0.231 18329
5635 1 7 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.675 -0.475 18329
5636 1 7 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.632 0.268 18329
5637 1 7 . 1 1 19 19 ILE H H 42 7.420 7.420 7.369 0.051 18329
5638 1 7 . 1 1 20 20 THR N N 43 113.360 113.360 110.770 2.590 18329
5639 1 7 . 1 1 20 20 THR HA H 43 3.770 3.770 3.945 -0.175 18329
5640 1 7 . 1 1 20 20 THR C C 43 177.800 177.800 176.193 1.607 18329
5641 1 7 . 1 1 20 20 THR CA C 43 66.400 66.400 65.548 0.852 18329
5642 1 7 . 1 1 20 20 THR CB C 43 67.400 67.400 68.418 -1.018 18329
5643 1 7 . 1 1 20 20 THR H H 43 7.610 7.610 7.479 0.131 18329
5644 1 7 . 1 1 21 21 ASP N N 44 123.650 123.650 121.782 1.868 18329
5645 1 7 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.359 0.051 18329
5646 1 7 . 1 1 21 21 ASP C C 44 179.200 179.200 178.209 0.991 18329
5647 1 7 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.207 -0.007 18329
5648 1 7 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.600 -1.000 18329
5649 1 7 . 1 1 21 21 ASP H H 44 9.260 9.260 7.867 1.393 18329
5650 1 7 . 1 1 22 22 GLU N N 45 123.560 123.560 119.720 3.840 18329
5651 1 7 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.117 0.253 18329
5652 1 7 . 1 1 22 22 GLU C C 45 178.500 178.500 179.181 -0.681 18329
5653 1 7 . 1 1 22 22 GLU CA C 45 58.200 58.200 59.023 -0.823 18329
5654 1 7 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.775 -0.575 18329
5655 1 7 . 1 1 22 22 GLU H H 45 7.750 7.750 7.947 -0.197 18329
5656 1 7 . 1 1 23 23 ILE N N 46 119.940 119.940 114.162 5.778 18329
5657 1 7 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.834 -0.214 18329
5658 1 7 . 1 1 23 23 ILE C C 46 177.600 177.600 177.647 -0.047 18329
5659 1 7 . 1 1 23 23 ILE CA C 46 65.600 65.600 63.846 1.754 18329
5660 1 7 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.498 -0.498 18329
5661 1 7 . 1 1 23 23 ILE H H 46 8.360 8.360 7.312 1.048 18329
5662 1 7 . 1 1 24 24 ASP N N 47 120.730 120.730 121.436 -0.706 18329
5663 1 7 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.267 0.133 18329
5664 1 7 . 1 1 24 24 ASP C C 47 178.900 178.900 177.942 0.958 18329
5665 1 7 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.409 0.091 18329
5666 1 7 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.902 -1.002 18329
5667 1 7 . 1 1 24 24 ASP H H 47 8.280 8.280 8.110 0.170 18329
5668 1 7 . 1 1 25 25 ALA N N 48 123.870 123.870 121.066 2.804 18329
5669 1 7 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.051 0.069 18329
5670 1 7 . 1 1 25 25 ALA C C 48 180.400 180.400 179.595 0.805 18329
5671 1 7 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.803 0.697 18329
5672 1 7 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.264 -0.464 18329
5673 1 7 . 1 1 25 25 ALA H H 48 7.880 7.880 7.613 0.267 18329
5674 1 7 . 1 1 26 26 ILE N N 49 121.970 121.970 118.216 3.754 18329
5675 1 7 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.590 0.140 18329
5676 1 7 . 1 1 26 26 ILE C C 49 178.400 178.400 177.820 0.580 18329
5677 1 7 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.931 0.969 18329
5678 1 7 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.511 -0.011 18329
5679 1 7 . 1 1 26 26 ILE H H 49 8.710 8.710 7.463 1.247 18329
5680 1 7 . 1 1 27 27 LYS N N 50 119.820 119.820 119.942 -0.122 18329
5681 1 7 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.712 0.168 18329
5682 1 7 . 1 1 27 27 LYS C C 50 179.900 179.900 179.311 0.589 18329
5683 1 7 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.189 1.211 18329
5684 1 7 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.608 0.292 18329
5685 1 7 . 1 1 27 27 LYS H H 50 8.540 8.540 7.750 0.790 18329
5686 1 7 . 1 1 28 28 LYS N N 51 121.960 121.960 118.555 3.405 18329
5687 1 7 . 1 1 28 28 LYS HA H 51 4.090 4.090 4.050 0.040 18329
5688 1 7 . 1 1 28 28 LYS C C 51 179.200 179.200 179.036 0.164 18329
5689 1 7 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.046 0.254 18329
5690 1 7 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.035 -0.635 18329
5691 1 7 . 1 1 28 28 LYS H H 51 8.070 8.070 7.379 0.691 18329
5692 1 7 . 1 1 29 29 ASP N N 52 121.710 121.710 119.475 2.235 18329
5693 1 7 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.486 -0.016 18329
5694 1 7 . 1 1 29 29 ASP C C 52 178.500 178.500 178.885 -0.385 18329
5695 1 7 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.750 0.250 18329
5696 1 7 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.837 0.162 18329
5697 1 7 . 1 1 29 29 ASP H H 52 8.340 8.340 7.788 0.552 18329
5698 1 7 . 1 1 30 30 ALA N N 53 121.990 121.990 121.717 0.273 18329
5699 1 7 . 1 1 30 30 ALA HA H 53 3.340 3.340 4.180 -0.840 18329
5700 1 7 . 1 1 30 30 ALA C C 53 179.500 179.500 179.043 0.457 18329
5701 1 7 . 1 1 30 30 ALA CA C 53 55.100 55.100 55.041 0.059 18329
5702 1 7 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.421 -0.321 18329
5703 1 7 . 1 1 30 30 ALA H H 53 8.800 8.800 8.470 0.330 18329
5704 1 7 . 1 1 31 31 ALA N N 54 119.970 119.970 119.882 0.088 18329
5705 1 7 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.096 0.054 18329
5706 1 7 . 1 1 31 31 ALA C C 54 181.600 181.600 179.126 2.474 18329
5707 1 7 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.334 0.366 18329
5708 1 7 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.326 -0.526 18329
5709 1 7 . 1 1 31 31 ALA H H 54 7.730 7.730 7.301 0.429 18329
5710 1 7 . 1 1 32 32 LEU N N 55 119.660 119.660 117.597 2.063 18329
5711 1 7 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.064 0.076 18329
5712 1 7 . 1 1 32 32 LEU C C 55 179.100 179.100 177.294 1.806 18329
5713 1 7 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.824 0.176 18329
5714 1 7 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.937 -0.037 18329
5715 1 7 . 1 1 32 32 LEU H H 55 7.660 7.660 7.419 0.241 18329
5716 1 7 . 1 1 33 33 LYS N N 56 117.160 117.160 118.021 -0.861 18329
5717 1 7 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.386 -0.176 18329
5718 1 7 . 1 1 33 33 LYS C C 56 176.600 176.600 176.659 -0.059 18329
5719 1 7 . 1 1 33 33 LYS CA C 56 56.100 56.100 55.297 0.803 18329
5720 1 7 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.254 -0.054 18329
5721 1 7 . 1 1 33 33 LYS H H 56 7.610 7.610 7.209 0.401 18329
5722 1 7 . 1 1 34 34 GLY N N 57 108.680 108.680 112.133 -3.453 18329
5723 1 7 . 1 1 34 34 GLY C C 57 174.400 174.400 173.885 0.515 18329
5724 1 7 . 1 1 34 34 GLY CA C 57 46.200 46.200 44.949 1.251 18329
5725 1 7 . 1 1 34 34 GLY H H 57 7.710 7.710 8.610 -0.900 18329
5726 1 7 . 1 1 35 35 VAL N N 58 121.000 121.000 121.680 -0.680 18329
5727 1 7 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.048 -0.148 18329
5728 1 7 . 1 1 35 35 VAL C C 58 174.200 174.200 176.167 -1.967 18329
5729 1 7 . 1 1 35 35 VAL CA C 58 61.500 61.500 61.497 0.003 18329
5730 1 7 . 1 1 35 35 VAL CB C 58 32.800 32.800 33.386 -0.587 18329
5731 1 7 . 1 1 35 35 VAL H H 58 7.990 7.990 7.697 0.293 18329
5732 1 7 . 1 1 36 36 ASN N N 59 124.960 124.960 125.851 -0.891 18329
5733 1 7 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.721 -0.051 18329
5734 1 7 . 1 1 36 36 ASN C C 59 175.700 175.700 175.873 -0.173 18329
5735 1 7 . 1 1 36 36 ASN CA C 59 51.600 51.600 53.214 -1.614 18329
5736 1 7 . 1 1 36 36 ASN CB C 59 39.100 39.100 36.854 2.246 18329
5737 1 7 . 1 1 36 36 ASN H H 59 8.460 8.460 8.928 -0.468 18329
5738 1 7 . 1 1 37 37 PHE N N 60 124.460 124.460 124.010 0.450 18329
5739 1 7 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.093 0.047 18329
5740 1 7 . 1 1 37 37 PHE C C 60 177.000 177.000 175.002 1.998 18329
5741 1 7 . 1 1 37 37 PHE CA C 60 60.400 60.400 60.771 -0.371 18329
5742 1 7 . 1 1 37 37 PHE CB C 60 39.200 39.200 39.653 -0.453 18329
5743 1 7 . 1 1 37 37 PHE H H 60 8.780 8.780 8.395 0.385 18329
5744 1 7 . 1 1 38 38 ASP N N 61 119.270 119.270 116.180 3.090 18329
5745 1 7 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.654 -0.164 18329
5746 1 7 . 1 1 38 38 ASP C C 61 177.000 177.000 175.840 1.160 18329
5747 1 7 . 1 1 38 38 ASP CA C 61 55.500 55.500 54.277 1.223 18329
5748 1 7 . 1 1 38 38 ASP CB C 61 40.000 40.000 40.490 -0.490 18329
5749 1 7 . 1 1 38 38 ASP H H 61 8.400 8.400 8.522 -0.122 18329
5750 1 7 . 1 1 39 39 ALA N N 62 122.020 122.020 122.326 -0.306 18329
5751 1 7 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.101 0.099 18329
5752 1 7 . 1 1 39 39 ALA C C 62 178.300 178.300 175.541 2.759 18329
5753 1 7 . 1 1 39 39 ALA CA C 62 52.900 52.900 53.081 -0.181 18329
5754 1 7 . 1 1 39 39 ALA CB C 62 18.500 18.500 19.100 -0.600 18329
5755 1 7 . 1 1 39 39 ALA H H 62 7.740 7.740 7.165 0.575 18329
5756 1 7 . 1 1 40 40 PHE N N 63 116.940 116.940 119.904 -2.964 18329
5757 1 7 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.473 -0.093 18329
5758 1 7 . 1 1 40 40 PHE C C 63 176.100 176.100 174.260 1.840 18329
5759 1 7 . 1 1 40 40 PHE CA C 63 58.300 58.300 57.704 0.596 18329
5760 1 7 . 1 1 40 40 PHE CB C 63 38.800 38.800 41.654 -2.854 18329
5761 1 7 . 1 1 40 40 PHE H H 63 7.730 7.730 8.148 -0.418 18329
5762 1 7 . 1 1 41 41 LYS N N 64 119.840 119.840 124.428 -4.588 18329
5763 1 7 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.426 -0.206 18329
5764 1 7 . 1 1 41 41 LYS C C 64 176.100 176.100 176.395 -0.295 18329
5765 1 7 . 1 1 41 41 LYS CA C 64 56.600 56.600 56.111 0.488 18329
5766 1 7 . 1 1 41 41 LYS CB C 64 32.900 32.900 33.274 -0.374 18329
5767 1 7 . 1 1 41 41 LYS H H 64 7.650 7.650 8.158 -0.508 18329
5768 1 7 . 1 1 42 42 ASP N N 65 120.770 120.770 120.938 -0.168 18329
5769 1 7 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.410 0.160 18329
5770 1 7 . 1 1 42 42 ASP C C 65 176.100 176.100 175.692 0.408 18329
5771 1 7 . 1 1 42 42 ASP CA C 65 54.200 54.200 55.547 -1.347 18329
5772 1 7 . 1 1 42 42 ASP CB C 65 40.900 40.900 41.167 -0.267 18329
5773 1 7 . 1 1 42 42 ASP H H 65 8.030 8.030 8.528 -0.498 18329
5774 1 7 . 1 1 43 43 LYS N N 66 122.070 122.070 116.843 5.227 18329
5775 1 7 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.366 -0.086 18329
5776 1 7 . 1 1 43 43 LYS C C 66 176.800 176.800 175.294 1.506 18329
5777 1 7 . 1 1 43 43 LYS CA C 66 56.500 56.500 55.538 0.962 18329
5778 1 7 . 1 1 43 43 LYS CB C 66 32.800 32.800 34.407 -1.607 18329
5779 1 7 . 1 1 43 43 LYS H H 66 8.180 8.180 7.540 0.640 18329
5780 1 7 . 1 1 44 44 LYS N N 67 122.170 122.170 124.354 -2.184 18329
5781 1 7 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.563 -0.213 18329
5782 1 7 . 1 1 44 44 LYS C C 67 177.000 177.000 175.957 1.043 18329
5783 1 7 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.178 0.422 18329
5784 1 7 . 1 1 44 44 LYS CB C 67 32.800 32.800 32.002 0.798 18329
5785 1 7 . 1 1 44 44 LYS H H 67 8.460 8.460 8.589 -0.129 18329
5786 1 7 . 1 1 45 45 THR N N 68 114.390 114.390 115.346 -0.956 18329
5787 1 7 . 1 1 45 45 THR HA H 68 4.330 4.330 4.668 -0.338 18329
5788 1 7 . 1 1 45 45 THR C C 68 175.200 175.200 174.385 0.815 18329
5789 1 7 . 1 1 45 45 THR CA C 68 62.000 62.000 60.949 1.052 18329
5790 1 7 . 1 1 45 45 THR CB C 68 69.900 69.900 70.568 -0.668 18329
5791 1 7 . 1 1 45 45 THR H H 68 8.120 8.120 8.317 -0.197 18329
5792 1 7 . 1 1 46 46 GLY N N 69 111.200 111.200 112.838 -1.638 18329
5793 1 7 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.098 0.102 18329
5794 1 7 . 1 1 46 46 GLY H H 69 8.450 8.450 8.583 -0.133 18329
5795 1 7 . 1 1 47 47 SER CA C 70 58.400 58.400 57.123 1.277 18329
5796 1 7 . 1 1 47 47 SER CB C 70 64.000 64.000 64.296 -0.296 18329
5797 1 7 . 1 1 48 48 GLY N N 71 111.200 111.200 108.565 2.635 18329
5798 1 7 . 1 1 48 48 GLY CA C 71 45.000 45.000 46.675 -1.675 18329
5799 1 7 . 1 1 48 48 GLY H H 71 8.580 8.580 8.659 -0.079 18329
5800 1 7 . 1 1 49 49 VAL N N 72 118.910 118.910 120.861 -1.951 18329
5801 1 7 . 1 1 49 49 VAL HA H 72 4.130 4.130 3.883 0.247 18329
5802 1 7 . 1 1 49 49 VAL C C 72 176.100 176.100 176.664 -0.564 18329
5803 1 7 . 1 1 49 49 VAL CA C 72 62.100 62.100 63.692 -1.592 18329
5804 1 7 . 1 1 49 49 VAL CB C 72 32.500 32.500 31.853 0.647 18329
5805 1 7 . 1 1 49 49 VAL H H 72 7.860 7.860 7.399 0.461 18329
5806 1 7 . 1 1 50 50 SER N N 73 118.500 118.500 113.891 4.609 18329
5807 1 7 . 1 1 50 50 SER C C 73 176.100 176.100 174.995 1.105 18329
5808 1 7 . 1 1 50 50 SER CA C 73 58.300 58.300 60.906 -2.606 18329
5809 1 7 . 1 1 50 50 SER CB C 73 63.800 63.800 61.845 1.955 18329
5810 1 7 . 1 1 50 50 SER H H 73 8.300 8.300 8.597 -0.297 18329
5811 1 7 . 1 1 51 51 GLU N N 74 122.560 122.560 121.554 1.006 18329
5812 1 7 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.637 -0.367 18329
5813 1 7 . 1 1 51 51 GLU CA C 74 55.700 55.700 55.504 0.196 18329
5814 1 7 . 1 1 51 51 GLU CB C 74 30.500 30.500 30.836 -0.336 18329
5815 1 7 . 1 1 51 51 GLU H H 74 8.360 8.360 8.646 -0.286 18329
5816 1 7 . 1 1 52 52 ASN N N 75 122.830 122.830 115.836 6.994 18329
5817 1 7 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.584 0.236 18329
5818 1 7 . 1 1 52 52 ASN C C 75 174.800 174.800 173.497 1.303 18329
5819 1 7 . 1 1 52 52 ASN CA C 75 51.400 51.400 53.437 -2.037 18329
5820 1 7 . 1 1 52 52 ASN CB C 75 39.200 39.200 36.817 2.383 18329
5821 1 7 . 1 1 52 52 ASN H H 75 8.450 8.450 7.338 1.112 18329
5822 1 7 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.442 -0.262 18329
5823 1 7 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.190 1.010 18329
5824 1 7 . 1 1 53 53 PRO CB C 76 32.000 32.000 32.009 -0.009 18329
5825 1 7 . 1 1 54 54 PHE N N 77 118.060 118.060 120.071 -2.011 18329
5826 1 7 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.334 -0.064 18329
5827 1 7 . 1 1 54 54 PHE C C 77 177.500 177.500 176.636 0.864 18329
5828 1 7 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.219 0.281 18329
5829 1 7 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.454 -0.054 18329
5830 1 7 . 1 1 54 54 PHE H H 77 8.430 8.430 7.869 0.561 18329
5831 1 7 . 1 1 55 55 ILE N N 78 119.350 119.350 119.121 0.229 18329
5832 1 7 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.779 -0.279 18329
5833 1 7 . 1 1 55 55 ILE C C 78 177.400 177.400 176.894 0.506 18329
5834 1 7 . 1 1 55 55 ILE CA C 78 63.500 63.500 63.470 0.030 18329
5835 1 7 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.834 -0.834 18329
5836 1 7 . 1 1 55 55 ILE H H 78 7.540 7.540 7.881 -0.341 18329
5837 1 7 . 1 1 56 56 LEU N N 79 118.450 118.450 118.355 0.095 18329
5838 1 7 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.020 0.130 18329
5839 1 7 . 1 1 56 56 LEU C C 79 179.200 179.200 179.186 0.014 18329
5840 1 7 . 1 1 56 56 LEU CA C 79 57.800 57.800 57.576 0.224 18329
5841 1 7 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.784 -0.684 18329
5842 1 7 . 1 1 56 56 LEU H H 79 7.260 7.260 7.425 -0.165 18329
5843 1 7 . 1 1 57 57 GLU N N 80 117.980 117.980 118.630 -0.650 18329
5844 1 7 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.966 -0.316 18329
5845 1 7 . 1 1 57 57 GLU C C 80 178.700 178.700 178.807 -0.107 18329
5846 1 7 . 1 1 57 57 GLU CA C 80 59.300 59.300 58.871 0.429 18329
5847 1 7 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.074 0.426 18329
5848 1 7 . 1 1 57 57 GLU H H 80 7.890 7.890 7.710 0.180 18329
5849 1 7 . 1 1 58 58 ALA N N 81 122.040 122.040 122.635 -0.595 18329
5850 1 7 . 1 1 58 58 ALA HA H 81 3.800 3.800 4.006 -0.206 18329
5851 1 7 . 1 1 58 58 ALA C C 81 179.500 179.500 178.744 0.756 18329
5852 1 7 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.785 0.415 18329
5853 1 7 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.174 0.626 18329
5854 1 7 . 1 1 58 58 ALA H H 81 8.400 8.400 7.580 0.820 18329
5855 1 7 . 1 1 59 59 LYS N N 82 116.000 116.000 117.758 -1.758 18329
5856 1 7 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.069 -0.219 18329
5857 1 7 . 1 1 59 59 LYS C C 82 180.300 180.300 178.612 1.688 18329
5858 1 7 . 1 1 59 59 LYS CA C 82 61.100 61.100 58.819 2.281 18329
5859 1 7 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.236 -0.036 18329
5860 1 7 . 1 1 59 59 LYS H H 82 8.000 8.000 7.530 0.470 18329
5861 1 7 . 1 1 60 60 VAL N N 83 122.920 122.920 119.960 2.960 18329
5862 1 7 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.635 -0.305 18329
5863 1 7 . 1 1 60 60 VAL C C 83 178.300 178.300 178.194 0.106 18329
5864 1 7 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.885 2.015 18329
5865 1 7 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.660 -0.460 18329
5866 1 7 . 1 1 60 60 VAL H H 83 8.110 8.110 7.910 0.200 18329
5867 1 7 . 1 1 61 61 ARG N N 84 121.770 121.770 119.302 2.468 18329
5868 1 7 . 1 1 61 61 ARG C C 84 179.500 179.500 178.554 0.946 18329
5869 1 7 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.363 -0.163 18329
5870 1 7 . 1 1 61 61 ARG CB C 84 30.800 30.800 30.038 0.762 18329
5871 1 7 . 1 1 61 61 ARG H H 84 8.710 8.710 7.419 1.291 18329
5872 1 7 . 1 1 62 62 ALA N N 85 119.450 119.450 120.737 -1.287 18329
5873 1 7 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.251 -0.361 18329
5874 1 7 . 1 1 62 62 ALA C C 85 179.500 179.500 179.069 0.431 18329
5875 1 7 . 1 1 62 62 ALA CA C 85 55.000 55.000 54.877 0.123 18329
5876 1 7 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.618 0.382 18329
5877 1 7 . 1 1 62 62 ALA H H 85 8.700 8.700 7.637 1.063 18329
5878 1 7 . 1 1 63 63 THR N N 86 106.650 106.650 110.366 -3.716 18329
5879 1 7 . 1 1 63 63 THR HA H 86 3.970 3.970 4.235 -0.265 18329
5880 1 7 . 1 1 63 63 THR C C 86 177.700 177.700 176.790 0.910 18329
5881 1 7 . 1 1 63 63 THR CA C 86 66.000 66.000 65.529 0.471 18329
5882 1 7 . 1 1 63 63 THR CB C 86 68.200 68.200 68.367 -0.167 18329
5883 1 7 . 1 1 63 63 THR H H 86 8.150 8.150 7.850 0.300 18329
5884 1 7 . 1 1 64 64 THR N N 87 120.430 120.430 120.680 -0.250 18329
5885 1 7 . 1 1 64 64 THR HA H 87 4.050 4.050 4.084 -0.034 18329
5886 1 7 . 1 1 64 64 THR C C 87 176.800 176.800 176.091 0.709 18329
5887 1 7 . 1 1 64 64 THR CA C 87 67.300 67.300 67.676 -0.376 18329
5888 1 7 . 1 1 64 64 THR CB C 87 68.600 68.600 68.375 0.225 18329
5889 1 7 . 1 1 64 64 THR H H 87 7.920 7.920 7.610 0.310 18329
5890 1 7 . 1 1 65 65 VAL N N 88 119.230 119.230 120.400 -1.170 18329
5891 1 7 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.867 0.113 18329
5892 1 7 . 1 1 65 65 VAL C C 88 178.500 178.500 176.749 1.751 18329
5893 1 7 . 1 1 65 65 VAL CA C 88 65.600 65.600 64.885 0.715 18329
5894 1 7 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.522 0.178 18329
5895 1 7 . 1 1 65 65 VAL H H 88 7.380 7.380 7.350 0.030 18329
5896 1 7 . 1 1 66 66 ALA N N 89 124.260 124.260 121.618 2.642 18329
5897 1 7 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.922 0.328 18329
5898 1 7 . 1 1 66 66 ALA C C 89 179.900 179.900 179.128 0.772 18329
5899 1 7 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.673 -0.773 18329
5900 1 7 . 1 1 66 66 ALA CB C 89 19.500 19.500 17.964 1.536 18329
5901 1 7 . 1 1 66 66 ALA H H 89 8.390 8.390 7.729 0.661 18329
5902 1 7 . 1 1 67 67 GLU N N 90 120.180 120.180 117.715 2.465 18329
5903 1 7 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.994 -0.274 18329
5904 1 7 . 1 1 67 67 GLU C C 90 177.600 177.600 178.838 -1.238 18329
5905 1 7 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.409 0.491 18329
5906 1 7 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.003 -0.703 18329
5907 1 7 . 1 1 67 67 GLU H H 90 8.520 8.520 7.955 0.565 18329
5908 1 7 . 1 1 68 68 LYS N N 91 116.340 116.340 119.614 -3.274 18329
5909 1 7 . 1 1 68 68 LYS HA H 91 3.960 3.960 3.989 -0.029 18329
5910 1 7 . 1 1 68 68 LYS C C 91 179.200 179.200 179.143 0.057 18329
5911 1 7 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.936 0.864 18329
5912 1 7 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.177 -0.177 18329
5913 1 7 . 1 1 68 68 LYS H H 91 7.210 7.210 7.372 -0.162 18329
5914 1 7 . 1 1 69 69 PHE N N 92 120.990 120.990 120.580 0.410 18329
5915 1 7 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.147 0.363 18329
5916 1 7 . 1 1 69 69 PHE C C 92 175.100 175.100 177.193 -2.093 18329
5917 1 7 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.362 -1.562 18329
5918 1 7 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.269 -0.069 18329
5919 1 7 . 1 1 69 69 PHE H H 92 7.180 7.180 8.041 -0.861 18329
5920 1 7 . 1 1 70 70 VAL N N 93 120.330 120.330 119.307 1.023 18329
5921 1 7 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.522 -0.432 18329
5922 1 7 . 1 1 70 70 VAL C C 93 177.500 177.500 177.870 -0.370 18329
5923 1 7 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.716 0.184 18329
5924 1 7 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.691 -0.291 18329
5925 1 7 . 1 1 70 70 VAL H H 93 7.930 7.930 7.546 0.384 18329
5926 1 7 . 1 1 71 71 ILE N N 94 120.410 120.410 119.258 1.152 18329
5927 1 7 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.531 0.299 18329
5928 1 7 . 1 1 71 71 ILE C C 94 177.700 177.700 177.468 0.232 18329
5929 1 7 . 1 1 71 71 ILE CA C 94 65.000 65.000 65.149 -0.149 18329
5930 1 7 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.236 0.064 18329
5931 1 7 . 1 1 71 71 ILE H H 94 8.180 8.180 7.496 0.684 18329
5932 1 7 . 1 1 72 72 ALA N N 95 122.440 122.440 122.000 0.440 18329
5933 1 7 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.911 0.049 18329
5934 1 7 . 1 1 72 72 ALA C C 95 179.600 179.600 179.507 0.093 18329
5935 1 7 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.002 0.898 18329
5936 1 7 . 1 1 72 72 ALA CB C 95 17.200 17.200 18.018 -0.818 18329
5937 1 7 . 1 1 72 72 ALA H H 95 7.340 7.340 7.554 -0.214 18329
5938 1 7 . 1 1 73 73 ILE N N 96 119.330 119.330 117.917 1.413 18329
5939 1 7 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.667 -0.227 18329
5940 1 7 . 1 1 73 73 ILE C C 96 177.400 177.400 178.046 -0.646 18329
5941 1 7 . 1 1 73 73 ILE CA C 96 62.800 62.800 63.557 -0.757 18329
5942 1 7 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.769 -2.369 18329
5943 1 7 . 1 1 73 73 ILE H H 96 7.820 7.820 7.633 0.187 18329
5944 1 7 . 1 1 74 74 GLU N N 97 118.440 118.440 121.366 -2.926 18329
5945 1 7 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.863 -0.173 18329
5946 1 7 . 1 1 74 74 GLU C C 97 180.500 180.500 178.636 1.864 18329
5947 1 7 . 1 1 74 74 GLU CA C 97 59.700 59.700 60.112 -0.412 18329
5948 1 7 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.276 0.424 18329
5949 1 7 . 1 1 74 74 GLU H H 97 8.380 8.380 7.701 0.679 18329
5950 1 7 . 1 1 75 75 GLU N N 98 120.470 120.470 119.185 1.285 18329
5951 1 7 . 1 1 75 75 GLU HA H 98 3.940 3.940 3.996 -0.056 18329
5952 1 7 . 1 1 75 75 GLU C C 98 180.600 180.600 179.050 1.550 18329
5953 1 7 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.349 0.351 18329
5954 1 7 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.749 0.451 18329
5955 1 7 . 1 1 75 75 GLU H H 98 8.800 8.800 8.220 0.580 18329
5956 1 7 . 1 1 76 76 GLU N N 99 119.230 119.230 119.349 -0.119 18329
5957 1 7 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.122 0.018 18329
5958 1 7 . 1 1 76 76 GLU C C 99 178.900 178.900 178.485 0.415 18329
5959 1 7 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.598 0.002 18329
5960 1 7 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.372 -0.072 18329
5961 1 7 . 1 1 76 76 GLU H H 99 8.840 8.840 8.137 0.703 18329
5962 1 7 . 1 1 77 77 ALA N N 100 121.950 121.950 122.228 -0.278 18329
5963 1 7 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.182 -0.182 18329
5964 1 7 . 1 1 77 77 ALA C C 100 179.000 179.000 179.729 -0.729 18329
5965 1 7 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.414 0.886 18329
5966 1 7 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.084 -1.284 18329
5967 1 7 . 1 1 77 77 ALA H H 100 9.400 9.400 8.011 1.389 18329
5968 1 7 . 1 1 78 78 THR N N 101 111.820 111.820 113.486 -1.666 18329
5969 1 7 . 1 1 78 78 THR HA H 101 3.750 3.750 4.053 -0.303 18329
5970 1 7 . 1 1 78 78 THR CA C 101 67.500 67.500 65.543 1.956 18329
5971 1 7 . 1 1 78 78 THR CB C 101 68.600 68.600 68.573 0.027 18329
5972 1 7 . 1 1 78 78 THR H H 101 7.770 7.770 7.833 -0.063 18329
5973 1 7 . 1 1 79 79 LYS N N 102 122.940 122.940 121.126 1.814 18329
5974 1 7 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.146 -0.056 18329
5975 1 7 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.702 0.498 18329
5976 1 7 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.398 0.102 18329
5977 1 7 . 1 1 79 79 LYS H H 102 7.870 7.870 7.626 0.244 18329
5978 1 7 . 1 1 80 80 LEU N N 103 117.690 117.690 117.001 0.689 18329
5979 1 7 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.500 -0.010 18329
5980 1 7 . 1 1 80 80 LEU C C 103 178.140 178.140 176.239 1.901 18329
5981 1 7 . 1 1 80 80 LEU CA C 103 54.000 54.000 54.268 -0.268 18329
5982 1 7 . 1 1 80 80 LEU CB C 103 43.100 43.100 42.093 1.007 18329
5983 1 7 . 1 1 80 80 LEU H H 103 7.550 7.550 7.734 -0.184 18329
5984 1 7 . 1 1 81 81 LYS N N 104 122.210 122.210 121.802 0.408 18329
5985 1 7 . 1 1 81 81 LYS HA H 104 3.930 3.930 4.187 -0.257 18329
5986 1 7 . 1 1 81 81 LYS C C 104 178.000 178.000 175.775 2.225 18329
5987 1 7 . 1 1 81 81 LYS CA C 104 61.300 61.300 57.554 3.746 18329
5988 1 7 . 1 1 81 81 LYS CB C 104 32.800 32.800 31.048 1.752 18329
5989 1 7 . 1 1 81 81 LYS H H 104 7.500 7.500 7.703 -0.203 18329
5990 1 7 . 1 1 82 82 GLU N N 105 114.920 114.920 124.764 -9.844 18329
5991 1 7 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.347 0.213 18329
5992 1 7 . 1 1 82 82 GLU C C 105 177.900 177.900 175.252 2.648 18329
5993 1 7 . 1 1 82 82 GLU CA C 105 57.660 57.660 56.879 0.781 18329
5994 1 7 . 1 1 82 82 GLU CB C 105 30.400 30.400 29.505 0.895 18329
5995 1 7 . 1 1 82 82 GLU H H 105 8.780 8.780 8.671 0.109 18329
5996 1 7 . 1 1 83 83 THR N N 106 107.260 107.260 107.867 -0.607 18329
5997 1 7 . 1 1 83 83 THR HA H 106 4.550 4.550 4.060 0.490 18329
5998 1 7 . 1 1 83 83 THR C C 106 176.300 176.300 175.379 0.921 18329
5999 1 7 . 1 1 83 83 THR CA C 106 61.900 61.900 62.737 -0.837 18329
6000 1 7 . 1 1 83 83 THR CB C 106 70.400 70.400 67.863 2.537 18329
6001 1 7 . 1 1 83 83 THR H H 106 7.570 7.570 8.207 -0.637 18329
6002 1 7 . 1 1 84 84 GLY N N 107 112.110 112.110 109.876 2.234 18329
6003 1 7 . 1 1 84 84 GLY C C 107 172.800 172.800 174.020 -1.220 18329
6004 1 7 . 1 1 84 84 GLY CA C 107 45.400 45.400 46.565 -1.165 18329
6005 1 7 . 1 1 84 84 GLY H H 107 9.000 9.000 8.386 0.614 18329
6006 1 7 . 1 1 85 85 SER N N 108 119.030 119.030 111.326 7.704 18329
6007 1 7 . 1 1 85 85 SER CA C 108 56.300 56.300 57.438 -1.137 18329
6008 1 7 . 1 1 85 85 SER CB C 108 66.300 66.300 64.026 2.274 18329
6009 1 7 . 1 1 85 85 SER H H 108 8.950 8.950 7.758 1.192 18329
6010 1 7 . 1 1 86 86 SER HA H 109 4.480 4.480 5.028 -0.548 18329
6011 1 7 . 1 1 86 86 SER C C 109 177.000 177.000 176.420 0.580 18329
6012 1 7 . 1 1 86 86 SER CA C 109 61.600 61.600 58.852 2.748 18329
6013 1 7 . 1 1 86 86 SER CB C 109 62.900 62.900 63.763 -0.863 18329
6014 1 7 . 1 1 87 87 GLY N N 110 108.100 108.100 109.915 -1.815 18329
6015 1 7 . 1 1 87 87 GLY C C 110 177.100 177.100 175.577 1.523 18329
6016 1 7 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.300 -0.100 18329
6017 1 7 . 1 1 87 87 GLY H H 110 8.480 8.480 8.363 0.117 18329
6018 1 7 . 1 1 88 88 GLU N N 111 123.040 123.040 121.483 1.557 18329
6019 1 7 . 1 1 88 88 GLU HA H 111 3.690 3.690 3.949 -0.259 18329
6020 1 7 . 1 1 88 88 GLU C C 111 177.700 177.700 178.556 -0.856 18329
6021 1 7 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.521 0.979 18329
6022 1 7 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.280 -0.580 18329
6023 1 7 . 1 1 88 88 GLU H H 111 7.560 7.560 8.464 -0.904 18329
6024 1 7 . 1 1 89 89 PHE N N 112 118.270 118.270 117.206 1.064 18329
6025 1 7 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.408 0.012 18329
6026 1 7 . 1 1 89 89 PHE C C 112 178.600 178.600 178.072 0.528 18329
6027 1 7 . 1 1 89 89 PHE CA C 112 61.100 61.100 60.783 0.317 18329
6028 1 7 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.288 -0.388 18329
6029 1 7 . 1 1 89 89 PHE H H 112 7.200 7.200 7.452 -0.252 18329
6030 1 7 . 1 1 90 90 SER N N 113 115.980 115.980 115.273 0.707 18329
6031 1 7 . 1 1 90 90 SER HA H 113 4.290 4.290 4.220 0.070 18329
6032 1 7 . 1 1 90 90 SER C C 113 178.600 178.600 176.329 2.271 18329
6033 1 7 . 1 1 90 90 SER CA C 113 62.700 62.700 61.608 1.092 18329
6034 1 7 . 1 1 90 90 SER CB C 113 62.800 62.800 62.683 0.117 18329
6035 1 7 . 1 1 90 90 SER H H 113 8.830 8.830 8.048 0.782 18329
6036 1 7 . 1 1 91 91 ALA N N 114 123.130 123.130 122.445 0.685 18329
6037 1 7 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.122 0.258 18329
6038 1 7 . 1 1 91 91 ALA C C 114 181.300 181.300 179.822 1.478 18329
6039 1 7 . 1 1 91 91 ALA CA C 114 54.700 54.700 55.025 -0.325 18329
6040 1 7 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.337 0.063 18329
6041 1 7 . 1 1 91 91 ALA H H 114 7.580 7.580 7.499 0.081 18329
6042 1 7 . 1 1 92 92 MET N N 115 118.700 118.700 117.059 1.641 18329
6043 1 7 . 1 1 92 92 MET HA H 115 3.980 3.980 4.146 -0.166 18329
6044 1 7 . 1 1 92 92 MET C C 115 178.000 178.000 178.656 -0.656 18329
6045 1 7 . 1 1 92 92 MET CA C 115 61.000 61.000 58.914 2.086 18329
6046 1 7 . 1 1 92 92 MET CB C 115 31.400 31.400 32.687 -1.287 18329
6047 1 7 . 1 1 92 92 MET H H 115 7.880 7.880 7.523 0.357 18329
6048 1 7 . 1 1 93 93 TYR N N 116 119.200 119.200 120.817 -1.617 18329
6049 1 7 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.136 0.144 18329
6050 1 7 . 1 1 93 93 TYR C C 116 176.300 176.300 176.864 -0.564 18329
6051 1 7 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.429 0.671 18329
6052 1 7 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.327 -0.027 18329
6053 1 7 . 1 1 93 93 TYR H H 116 7.870 7.870 8.255 -0.385 18329
6054 1 7 . 1 1 94 94 ASP N N 117 120.210 120.210 119.484 0.726 18329
6055 1 7 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.456 -0.266 18329
6056 1 7 . 1 1 94 94 ASP C C 117 179.000 179.000 178.388 0.612 18329
6057 1 7 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.099 0.601 18329
6058 1 7 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.249 -0.249 18329
6059 1 7 . 1 1 94 94 ASP H H 117 8.720 8.720 7.795 0.925 18329
6060 1 7 . 1 1 95 95 LEU N N 118 118.420 118.420 119.679 -1.259 18329
6061 1 7 . 1 1 95 95 LEU HA H 118 4.210 4.210 3.981 0.229 18329
6062 1 7 . 1 1 95 95 LEU C C 118 178.600 178.600 179.081 -0.481 18329
6063 1 7 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.669 0.031 18329
6064 1 7 . 1 1 95 95 LEU CB C 118 43.100 43.100 41.993 1.107 18329
6065 1 7 . 1 1 95 95 LEU H H 118 7.510 7.510 7.783 -0.273 18329
6066 1 7 . 1 1 96 96 MET N N 119 118.470 118.470 118.923 -0.453 18329
6067 1 7 . 1 1 96 96 MET HA H 119 3.990 3.990 4.015 -0.025 18329
6068 1 7 . 1 1 96 96 MET C C 119 177.500 177.500 178.292 -0.792 18329
6069 1 7 . 1 1 96 96 MET CA C 119 60.500 60.500 57.652 2.848 18329
6070 1 7 . 1 1 96 96 MET CB C 119 33.900 33.900 31.349 2.551 18329
6071 1 7 . 1 1 96 96 MET H H 119 7.820 7.820 7.478 0.342 18329
6072 1 7 . 1 1 97 97 PHE N N 120 119.580 119.580 120.404 -0.824 18329
6073 1 7 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.100 -0.290 18329
6074 1 7 . 1 1 97 97 PHE C C 120 178.800 178.800 177.839 0.961 18329
6075 1 7 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.690 0.110 18329
6076 1 7 . 1 1 97 97 PHE CB C 120 39.200 39.200 38.945 0.255 18329
6077 1 7 . 1 1 97 97 PHE H H 120 8.940 8.940 7.606 1.334 18329
6078 1 7 . 1 1 98 98 GLU N N 121 119.940 119.940 119.241 0.699 18329
6079 1 7 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.132 -0.252 18329
6080 1 7 . 1 1 98 98 GLU C C 121 180.800 180.800 178.332 2.468 18329
6081 1 7 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.079 0.721 18329
6082 1 7 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.312 -0.112 18329
6083 1 7 . 1 1 98 98 GLU H H 121 8.690 8.690 8.693 -0.003 18329
6084 1 7 . 1 1 99 99 VAL N N 122 115.350 115.350 117.577 -2.227 18329
6085 1 7 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.763 -0.023 18329
6086 1 7 . 1 1 99 99 VAL C C 122 176.500 176.500 177.149 -0.649 18329
6087 1 7 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.904 -0.404 18329
6088 1 7 . 1 1 99 99 VAL CB C 122 31.300 31.300 32.070 -0.770 18329
6089 1 7 . 1 1 99 99 VAL H H 122 8.210 8.210 7.832 0.378 18329
6090 1 7 . 1 1 100 100 SER N N 123 115.450 115.450 116.079 -0.629 18329
6091 1 7 . 1 1 100 100 SER HA H 123 4.270 4.270 4.075 0.195 18329
6092 1 7 . 1 1 100 100 SER C C 123 174.700 174.700 176.510 -1.810 18329
6093 1 7 . 1 1 100 100 SER CA C 123 62.000 62.000 61.170 0.830 18329
6094 1 7 . 1 1 100 100 SER H H 123 7.520 7.520 8.100 -0.580 18329
6095 1 7 . 1 1 101 101 LYS N N 124 120.310 120.310 122.384 -2.074 18329
6096 1 7 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.203 -0.233 18329
6097 1 7 . 1 1 101 101 LYS C C 124 176.600 176.600 176.282 0.318 18329
6098 1 7 . 1 1 101 101 LYS CA C 124 61.100 61.100 59.795 1.305 18329
6099 1 7 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.240 -1.740 18329
6100 1 7 . 1 1 101 101 LYS H H 124 6.930 6.930 7.489 -0.559 18329
6101 1 7 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.228 0.032 18329
6102 1 7 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.387 -0.187 18329
6103 1 7 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.207 -0.607 18329
6104 1 7 . 1 1 103 103 LEU N N 126 116.020 116.020 117.723 -1.703 18329
6105 1 7 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.015 -0.135 18329
6106 1 7 . 1 1 103 103 LEU C C 126 177.900 177.900 178.897 -0.997 18329
6107 1 7 . 1 1 103 103 LEU CA C 126 57.700 57.700 57.234 0.466 18329
6108 1 7 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.376 0.424 18329
6109 1 7 . 1 1 103 103 LEU H H 126 6.520 6.520 7.428 -0.908 18329
6110 1 7 . 1 1 104 104 GLN N N 127 120.500 120.500 119.610 0.890 18329
6111 1 7 . 1 1 104 104 GLN C C 127 180.600 180.600 177.386 3.214 18329
6112 1 7 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.425 -0.125 18329
6113 1 7 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.362 0.638 18329
6114 1 7 . 1 1 104 104 GLN H H 127 8.160 8.160 7.595 0.565 18329
6115 1 7 . 1 1 105 105 LYS N N 128 120.000 120.000 115.924 4.076 18329
6116 1 7 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.075 -0.025 18329
6117 1 7 . 1 1 105 105 LYS C C 128 177.100 177.100 177.988 -0.888 18329
6118 1 7 . 1 1 105 105 LYS CA C 128 58.500 58.500 57.546 0.954 18329
6119 1 7 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.346 -0.946 18329
6120 1 7 . 1 1 105 105 LYS H H 128 7.810 7.810 7.617 0.193 18329
6121 1 7 . 1 1 106 106 LEU N N 129 118.530 118.530 118.447 0.083 18329
6122 1 7 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.521 -0.551 18329
6123 1 7 . 1 1 106 106 LEU C C 129 175.200 175.200 177.473 -2.273 18329
6124 1 7 . 1 1 106 106 LEU CA C 129 54.500 54.500 55.821 -1.321 18329
6125 1 7 . 1 1 106 106 LEU CB C 129 42.400 42.400 43.280 -0.880 18329
6126 1 7 . 1 1 106 106 LEU H H 129 7.220 7.220 7.473 -0.253 18329
6127 1 7 . 1 1 107 107 GLY N N 130 101.490 101.490 104.081 -2.591 18329
6128 1 7 . 1 1 107 107 GLY C C 130 174.800 174.800 172.649 2.151 18329
6129 1 7 . 1 1 107 107 GLY CA C 130 45.100 45.100 45.018 0.082 18329
6130 1 7 . 1 1 107 107 GLY H H 130 7.560 7.560 8.118 -0.558 18329
6131 1 7 . 1 1 108 108 ILE N N 131 121.340 121.340 116.489 4.851 18329
6132 1 7 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.802 0.348 18329
6133 1 7 . 1 1 108 108 ILE C C 131 174.300 174.300 174.586 -0.286 18329
6134 1 7 . 1 1 108 108 ILE CA C 131 60.400 60.400 62.923 -2.523 18329
6135 1 7 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.796 -2.596 18329
6136 1 7 . 1 1 108 108 ILE H H 131 7.290 7.290 8.306 -1.016 18329
6137 1 7 . 1 1 109 109 GLN N N 132 125.650 125.650 119.472 6.178 18329
6138 1 7 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.334 -0.324 18329
6139 1 7 . 1 1 109 109 GLN C C 132 176.800 176.800 174.818 1.982 18329
6140 1 7 . 1 1 109 109 GLN CA C 132 57.600 57.600 55.721 1.879 18329
6141 1 7 . 1 1 109 109 GLN CB C 132 29.000 29.000 31.272 -2.272 18329
6142 1 7 . 1 1 109 109 GLN H H 132 8.080 8.080 8.366 -0.286 18329
6143 1 7 . 1 1 110 110 GLU N N 133 114.890 114.890 121.451 -6.561 18329
6144 1 7 . 1 1 110 110 GLU HA H 133 4.150 4.150 3.882 0.268 18329
6145 1 7 . 1 1 110 110 GLU C C 133 177.100 177.100 176.671 0.429 18329
6146 1 7 . 1 1 110 110 GLU CA C 133 57.100 57.100 57.843 -0.743 18329
6147 1 7 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.795 -1.495 18329
6148 1 7 . 1 1 110 110 GLU H H 133 9.270 9.270 9.019 0.251 18329
6149 1 7 . 1 1 111 111 MET N N 134 121.210 121.210 117.104 4.106 18329
6150 1 7 . 1 1 111 111 MET HA H 134 4.350 4.350 4.091 0.259 18329
6151 1 7 . 1 1 111 111 MET C C 134 177.500 177.500 177.732 -0.232 18329
6152 1 7 . 1 1 111 111 MET CA C 134 57.900 57.900 58.940 -1.040 18329
6153 1 7 . 1 1 111 111 MET CB C 134 33.300 33.300 32.316 0.985 18329
6154 1 7 . 1 1 111 111 MET H H 134 7.620 7.620 8.436 -0.816 18329
6155 1 7 . 1 1 112 112 THR N N 135 113.170 113.170 115.224 -2.054 18329
6156 1 7 . 1 1 112 112 THR HA H 135 3.920 3.920 3.977 -0.057 18329
6157 1 7 . 1 1 112 112 THR C C 135 176.400 176.400 176.622 -0.222 18329
6158 1 7 . 1 1 112 112 THR CA C 135 65.900 65.900 66.536 -0.636 18329
6159 1 7 . 1 1 112 112 THR CB C 135 68.200 68.200 68.201 -0.001 18329
6160 1 7 . 1 1 112 112 THR H H 135 8.320 8.320 8.129 0.191 18329
6161 1 7 . 1 1 113 113 LYS N N 136 123.440 123.440 122.378 1.062 18329
6162 1 7 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.093 -0.163 18329
6163 1 7 . 1 1 113 113 LYS C C 136 177.600 177.600 179.419 -1.819 18329
6164 1 7 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.400 -1.100 18329
6165 1 7 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.093 -0.093 18329
6166 1 7 . 1 1 113 113 LYS H H 136 8.060 8.060 8.374 -0.314 18329
6167 1 7 . 1 1 114 114 THR N N 137 114.590 114.590 115.672 -1.082 18329
6168 1 7 . 1 1 114 114 THR HA H 137 4.000 4.000 4.011 -0.011 18329
6169 1 7 . 1 1 114 114 THR C C 137 176.800 176.800 176.246 0.554 18329
6170 1 7 . 1 1 114 114 THR CA C 137 67.600 67.600 67.420 0.180 18329
6171 1 7 . 1 1 114 114 THR CB C 137 69.200 69.200 68.743 0.457 18329
6172 1 7 . 1 1 114 114 THR H H 137 7.950 7.950 8.044 -0.094 18329
6173 1 7 . 1 1 115 115 VAL N N 138 119.080 119.080 121.083 -2.003 18329
6174 1 7 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.738 0.082 18329
6175 1 7 . 1 1 115 115 VAL C C 138 176.900 176.900 177.629 -0.729 18329
6176 1 7 . 1 1 115 115 VAL CA C 138 66.800 66.800 65.945 0.855 18329
6177 1 7 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.720 0.780 18329
6178 1 7 . 1 1 115 115 VAL H H 138 7.320 7.320 7.595 -0.275 18329
6179 1 7 . 1 1 116 116 SER N N 139 116.630 116.630 116.209 0.421 18329
6180 1 7 . 1 1 116 116 SER HA H 139 4.680 4.680 4.440 0.240 18329
6181 1 7 . 1 1 116 116 SER C C 139 179.000 179.000 176.764 2.236 18329
6182 1 7 . 1 1 116 116 SER CA C 139 61.400 61.400 61.292 0.108 18329
6183 1 7 . 1 1 116 116 SER CB C 139 62.800 62.800 62.689 0.111 18329
6184 1 7 . 1 1 116 116 SER H H 139 8.990 8.990 8.715 0.275 18329
6185 1 7 . 1 1 117 117 ASP N N 140 124.220 124.220 122.848 1.372 18329
6186 1 7 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.460 -0.100 18329
6187 1 7 . 1 1 117 117 ASP C C 140 179.900 179.900 177.670 2.230 18329
6188 1 7 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.670 0.630 18329
6189 1 7 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.655 -1.155 18329
6190 1 7 . 1 1 117 117 ASP H H 140 9.480 9.480 8.273 1.207 18329
6191 1 7 . 1 1 118 118 ALA N N 141 121.420 121.420 122.105 -0.685 18329
6192 1 7 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.099 0.181 18329
6193 1 7 . 1 1 118 118 ALA C C 141 179.800 179.800 179.040 0.760 18329
6194 1 7 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.978 -0.578 18329
6195 1 7 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.440 0.560 18329
6196 1 7 . 1 1 118 118 ALA H H 141 7.340 7.340 7.224 0.116 18329
6197 1 7 . 1 1 119 119 ALA N N 142 121.680 121.680 120.655 1.025 18329
6198 1 7 . 1 1 119 119 ALA HA H 142 4.130 4.130 3.956 0.174 18329
6199 1 7 . 1 1 119 119 ALA C C 142 178.800 178.800 178.954 -0.154 18329
6200 1 7 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.484 -1.284 18329
6201 1 7 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.091 0.209 18329
6202 1 7 . 1 1 119 119 ALA H H 142 7.890 7.890 7.767 0.123 18329
6203 1 7 . 1 1 120 120 GLU N N 143 117.690 117.690 118.506 -0.816 18329
6204 1 7 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.027 -0.087 18329
6205 1 7 . 1 1 120 120 GLU C C 143 178.100 178.100 178.306 -0.206 18329
6206 1 7 . 1 1 120 120 GLU CA C 143 58.700 58.700 58.732 -0.032 18329
6207 1 7 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.674 -0.174 18329
6208 1 7 . 1 1 120 120 GLU H H 143 7.500 7.500 7.642 -0.142 18329
6209 1 7 . 1 1 121 121 GLU N N 144 115.680 115.680 118.722 -3.042 18329
6210 1 7 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.174 -0.014 18329
6211 1 7 . 1 1 121 121 GLU C C 144 176.100 176.100 177.078 -0.978 18329
6212 1 7 . 1 1 121 121 GLU CA C 144 56.900 56.900 57.947 -1.046 18329
6213 1 7 . 1 1 121 121 GLU CB C 144 31.100 31.100 30.517 0.583 18329
6214 1 7 . 1 1 121 121 GLU H H 144 6.970 6.970 7.566 -0.596 18329
6215 1 7 . 1 1 122 122 ASN N N 145 117.750 117.750 117.093 0.657 18329
6216 1 7 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.070 -0.080 18329
6217 1 7 . 1 1 122 122 ASN C C 145 185.300 185.300 172.808 12.492 18329
6218 1 7 . 1 1 122 122 ASN CA C 145 50.200 50.200 50.819 -0.619 18329
6219 1 7 . 1 1 122 122 ASN CB C 145 41.100 41.100 39.192 1.908 18329
6220 1 7 . 1 1 122 122 ASN H H 145 7.670 7.670 7.867 -0.197 18329
6221 1 7 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.570 0.060 18329
6222 1 7 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.204 -1.204 18329
6223 1 7 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.249 0.051 18329
6224 1 7 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.285 0.155 18329
6225 1 7 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.762 -0.862 18329
6226 1 7 . 1 1 124 124 PRO CB C 147 28.400 28.400 31.871 -3.471 18329
6227 1 7 . 1 1 125 125 THR N N 148 106.090 106.090 114.981 -8.891 18329
6228 1 7 . 1 1 125 125 THR HA H 148 4.530 4.530 4.592 -0.062 18329
6229 1 7 . 1 1 125 125 THR C C 148 174.300 174.300 173.621 0.679 18329
6230 1 7 . 1 1 125 125 THR CA C 148 61.200 61.200 62.141 -0.940 18329
6231 1 7 . 1 1 125 125 THR CB C 148 68.600 68.600 70.639 -2.040 18329
6232 1 7 . 1 1 125 125 THR H H 148 7.800 7.800 8.389 -0.589 18329
6233 1 7 . 1 1 126 126 THR N N 149 108.650 108.650 114.100 -5.450 18329
6234 1 7 . 1 1 126 126 THR HA H 149 4.170 4.170 4.459 -0.289 18329
6235 1 7 . 1 1 126 126 THR C C 149 173.100 173.100 172.846 0.254 18329
6236 1 7 . 1 1 126 126 THR CA C 149 58.800 58.800 60.634 -1.834 18329
6237 1 7 . 1 1 126 126 THR CB C 149 73.100 73.100 72.425 0.675 18329
6238 1 7 . 1 1 126 126 THR H H 149 7.350 7.350 7.252 0.098 18329
6239 1 7 . 1 1 127 127 ALA N N 150 123.270 123.270 123.751 -0.481 18329
6240 1 7 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.216 -0.196 18329
6241 1 7 . 1 1 127 127 ALA CA C 150 55.000 55.000 54.977 0.023 18329
6242 1 7 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.119 0.581 18329
6243 1 7 . 1 1 127 127 ALA H H 150 7.750 7.750 8.639 -0.889 18329
6244 1 7 . 1 1 128 128 GLN N N 151 114.920 114.920 116.499 -1.579 18329
6245 1 7 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.045 -0.295 18329
6246 1 7 . 1 1 128 128 GLN C C 151 178.400 178.400 178.411 -0.011 18329
6247 1 7 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.598 0.202 18329
6248 1 7 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.316 -1.116 18329
6249 1 7 . 1 1 128 128 GLN H H 151 8.300 8.300 8.588 -0.288 18329
6250 1 7 . 1 1 129 129 GLY N N 152 107.280 107.280 108.502 -1.222 18329
6251 1 7 . 1 1 129 129 GLY C C 152 174.900 174.900 176.119 -1.219 18329
6252 1 7 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.999 0.201 18329
6253 1 7 . 1 1 129 129 GLY H H 152 7.920 7.920 7.636 0.284 18329
6254 1 7 . 1 1 130 130 VAL N N 153 119.440 119.440 122.222 -2.782 18329
6255 1 7 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.670 -0.200 18329
6256 1 7 . 1 1 130 130 VAL C C 153 177.700 177.700 177.599 0.101 18329
6257 1 7 . 1 1 130 130 VAL CA C 153 67.800 67.800 66.280 1.520 18329
6258 1 7 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.484 0.216 18329
6259 1 7 . 1 1 130 130 VAL H H 153 7.390 7.390 7.537 -0.147 18329
6260 1 7 . 1 1 131 131 LEU N N 154 118.990 118.990 120.007 -1.017 18329
6261 1 7 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.771 0.139 18329
6262 1 7 . 1 1 131 131 LEU C C 154 180.400 180.400 178.411 1.989 18329
6263 1 7 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.367 -0.068 18329
6264 1 7 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.598 -0.598 18329
6265 1 7 . 1 1 131 131 LEU H H 154 8.640 8.640 7.717 0.923 18329
6266 1 7 . 1 1 132 132 GLU N N 155 120.980 120.980 118.118 2.862 18329
6267 1 7 . 1 1 132 132 GLU HA H 155 4.120 4.120 4.047 0.073 18329
6268 1 7 . 1 1 132 132 GLU C C 155 179.400 179.400 178.973 0.427 18329
6269 1 7 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.234 -0.334 18329
6270 1 7 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.372 -0.172 18329
6271 1 7 . 1 1 132 132 GLU H H 155 8.000 8.000 7.662 0.338 18329
6272 1 7 . 1 1 133 133 ILE N N 156 121.830 121.830 120.059 1.771 18329
6273 1 7 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.879 -0.299 18329
6274 1 7 . 1 1 133 133 ILE C C 156 178.000 178.000 177.984 0.016 18329
6275 1 7 . 1 1 133 133 ILE CA C 156 65.500 65.500 61.534 3.966 18329
6276 1 7 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.687 2.913 18329
6277 1 7 . 1 1 133 133 ILE H H 156 8.040 8.040 7.889 0.151 18329
6278 1 7 . 1 1 134 134 ALA N N 157 121.470 121.470 123.508 -2.038 18329
6279 1 7 . 1 1 134 134 ALA HA H 157 3.900 3.900 4.062 -0.162 18329
6280 1 7 . 1 1 134 134 ALA C C 157 178.800 178.800 179.351 -0.551 18329
6281 1 7 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.205 0.095 18329
6282 1 7 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.279 -0.179 18329
6283 1 7 . 1 1 134 134 ALA H H 157 8.950 8.950 8.647 0.303 18329
6284 1 7 . 1 1 135 135 LYS N N 158 118.470 118.470 119.065 -0.595 18329
6285 1 7 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.972 -0.062 18329
6286 1 7 . 1 1 135 135 LYS C C 158 179.300 179.300 178.516 0.784 18329
6287 1 7 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.880 -0.380 18329
6288 1 7 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.327 -0.927 18329
6289 1 7 . 1 1 135 135 LYS H H 158 8.000 8.000 8.020 -0.020 18329
6290 1 7 . 1 1 136 136 LYS N N 159 118.000 118.000 118.934 -0.934 18329
6291 1 7 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.084 -0.034 18329
6292 1 7 . 1 1 136 136 LYS C C 159 180.200 180.200 179.317 0.883 18329
6293 1 7 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.126 0.374 18329
6294 1 7 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.311 -1.411 18329
6295 1 7 . 1 1 136 136 LYS H H 159 7.530 7.530 7.501 0.029 18329
6296 1 7 . 1 1 137 137 MET N N 160 120.990 120.990 119.494 1.496 18329
6297 1 7 . 1 1 137 137 MET HA H 160 3.800 3.800 4.158 -0.358 18329
6298 1 7 . 1 1 137 137 MET C C 160 177.400 177.400 177.877 -0.477 18329
6299 1 7 . 1 1 137 137 MET CA C 160 60.600 60.600 59.880 0.720 18329
6300 1 7 . 1 1 137 137 MET CB C 160 31.800 31.800 32.783 -0.983 18329
6301 1 7 . 1 1 137 137 MET H H 160 8.660 8.660 7.843 0.817 18329
6302 1 7 . 1 1 138 138 ARG N N 161 119.480 119.480 119.743 -0.263 18329
6303 1 7 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.977 -0.177 18329
6304 1 7 . 1 1 138 138 ARG C C 161 177.900 177.900 178.774 -0.874 18329
6305 1 7 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.771 0.829 18329
6306 1 7 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.214 -0.414 18329
6307 1 7 . 1 1 138 138 ARG H H 161 9.280 9.280 8.432 0.848 18329
6308 1 7 . 1 1 139 139 GLU N N 162 118.700 118.700 118.487 0.213 18329
6309 1 7 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.061 -0.061 18329
6310 1 7 . 1 1 139 139 GLU C C 162 179.100 179.100 178.672 0.428 18329
6311 1 7 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.328 0.472 18329
6312 1 7 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.241 0.259 18329
6313 1 7 . 1 1 139 139 GLU H H 162 8.430 8.430 8.157 0.273 18329
6314 1 7 . 1 1 140 140 LYS N N 163 119.310 119.310 120.411 -1.101 18329
6315 1 7 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.081 0.129 18329
6316 1 7 . 1 1 140 140 LYS C C 163 177.900 177.900 179.151 -1.251 18329
6317 1 7 . 1 1 140 140 LYS CA C 163 58.900 58.900 59.298 -0.398 18329
6318 1 7 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.373 -1.272 18329
6319 1 7 . 1 1 140 140 LYS H H 163 7.440 7.440 7.526 -0.086 18329
6320 1 7 . 1 1 141 141 LEU N N 164 117.630 117.630 119.153 -1.523 18329
6321 1 7 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.010 -0.120 18329
6322 1 7 . 1 1 141 141 LEU C C 164 178.700 178.700 179.052 -0.352 18329
6323 1 7 . 1 1 141 141 LEU CA C 164 58.000 58.000 58.365 -0.366 18329
6324 1 7 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.624 -0.124 18329
6325 1 7 . 1 1 141 141 LEU H H 164 8.180 8.180 7.929 0.251 18329
6326 1 7 . 1 1 142 142 GLN N N 165 117.710 117.710 118.423 -0.713 18329
6327 1 7 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.952 0.358 18329
6328 1 7 . 1 1 142 142 GLN C C 165 179.200 179.200 178.124 1.076 18329
6329 1 7 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.186 -0.686 18329
6330 1 7 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.369 -0.869 18329
6331 1 7 . 1 1 142 142 GLN H H 165 8.730 8.730 8.100 0.630 18329
6332 1 7 . 1 1 143 143 ARG N N 166 121.410 121.410 119.874 1.536 18329
6333 1 7 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.043 0.147 18329
6334 1 7 . 1 1 143 143 ARG C C 166 179.700 179.700 178.721 0.979 18329
6335 1 7 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.502 0.298 18329
6336 1 7 . 1 1 143 143 ARG CB C 166 30.200 30.200 29.989 0.211 18329
6337 1 7 . 1 1 143 143 ARG H H 166 8.050 8.050 7.716 0.334 18329
6338 1 7 . 1 1 144 144 VAL N N 167 120.950 120.950 119.443 1.507 18329
6339 1 7 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.649 0.111 18329
6340 1 7 . 1 1 144 144 VAL C C 167 179.200 179.200 177.400 1.800 18329
6341 1 7 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.849 -0.449 18329
6342 1 7 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.796 0.304 18329
6343 1 7 . 1 1 144 144 VAL H H 167 8.190 8.190 7.727 0.463 18329
6344 1 7 . 1 1 145 145 HIS N N 168 123.520 123.520 118.468 5.052 18329
6345 1 7 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.458 -0.558 18329
6346 1 7 . 1 1 145 145 HIS C C 168 177.100 177.100 177.728 -0.628 18329
6347 1 7 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.344 1.956 18329
6348 1 7 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.206 -0.306 18329
6349 1 7 . 1 1 145 145 HIS H H 168 9.240 9.240 8.349 0.891 18329
6350 1 7 . 1 1 146 146 THR N N 169 115.020 115.020 116.881 -1.861 18329
6351 1 7 . 1 1 146 146 THR HA H 169 3.860 3.860 4.268 -0.408 18329
6352 1 7 . 1 1 146 146 THR C C 169 175.700 175.700 176.599 -0.899 18329
6353 1 7 . 1 1 146 146 THR CA C 169 67.200 67.200 67.183 0.017 18329
6354 1 7 . 1 1 146 146 THR CB C 169 69.300 69.300 68.683 0.617 18329
6355 1 7 . 1 1 146 146 THR H H 169 8.750 8.750 8.565 0.185 18329
6356 1 7 . 1 1 147 147 LYS N N 170 120.300 120.300 120.709 -0.409 18329
6357 1 7 . 1 1 147 147 LYS HA H 170 4.000 4.000 4.051 -0.051 18329
6358 1 7 . 1 1 147 147 LYS C C 170 179.300 179.300 179.113 0.187 18329
6359 1 7 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.416 -0.316 18329
6360 1 7 . 1 1 147 147 LYS CB C 170 31.800 31.800 31.927 -0.127 18329
6361 1 7 . 1 1 147 147 LYS H H 170 8.020 8.020 8.166 -0.146 18329
6362 1 7 . 1 1 148 148 ASN N N 171 117.600 117.600 117.738 -0.138 18329
6363 1 7 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.475 -0.155 18329
6364 1 7 . 1 1 148 148 ASN C C 171 175.400 175.400 177.703 -2.303 18329
6365 1 7 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.639 2.061 18329
6366 1 7 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.325 1.375 18329
6367 1 7 . 1 1 148 148 ASN H H 171 7.810 7.810 7.772 0.038 18329
6368 1 7 . 1 1 149 149 TYR N N 172 121.560 121.560 121.775 -0.215 18329
6369 1 7 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.255 -0.365 18329
6370 1 7 . 1 1 149 149 TYR C C 172 176.900 176.900 177.577 -0.677 18329
6371 1 7 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.644 -0.144 18329
6372 1 7 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.717 0.203 18329
6373 1 7 . 1 1 149 149 TYR H H 172 9.020 9.020 7.812 1.208 18329
6374 1 7 . 1 1 150 150 CYS N N 173 116.050 116.050 117.326 -1.276 18329
6375 1 7 . 1 1 150 150 CYS C C 173 177.100 177.100 176.849 0.251 18329
6376 1 7 . 1 1 150 150 CYS CA C 173 58.400 58.400 61.123 -2.723 18329
6377 1 7 . 1 1 150 150 CYS CB C 173 38.600 38.600 25.833 12.767 18329
6378 1 7 . 1 1 150 150 CYS H H 173 8.810 8.810 8.659 0.151 18329
6379 1 7 . 1 1 151 151 THR N N 174 117.190 117.190 116.738 0.452 18329
6380 1 7 . 1 1 151 151 THR HA H 174 3.880 3.880 4.029 -0.149 18329
6381 1 7 . 1 1 151 151 THR C C 174 176.000 176.000 176.517 -0.517 18329
6382 1 7 . 1 1 151 151 THR CA C 174 66.900 66.900 66.435 0.465 18329
6383 1 7 . 1 1 151 151 THR CB C 174 68.500 68.500 68.317 0.183 18329
6384 1 7 . 1 1 151 151 THR H H 174 7.720 7.720 7.775 -0.055 18329
6385 1 7 . 1 1 152 152 LEU N N 175 123.110 123.110 121.507 1.603 18329
6386 1 7 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.002 -0.192 18329
6387 1 7 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.519 0.481 18329
6388 1 7 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.115 0.385 18329
6389 1 7 . 1 1 152 152 LEU H H 175 7.870 7.870 7.648 0.222 18329
6390 1 7 . 1 1 153 153 LYS N N 176 117.270 117.270 118.295 -1.025 18329
6391 1 7 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.780 -0.080 18329
6392 1 7 . 1 1 153 153 LYS C C 176 179.100 179.100 178.436 0.664 18329
6393 1 7 . 1 1 153 153 LYS CA C 176 56.700 56.700 59.578 -2.878 18329
6394 1 7 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.789 -1.889 18329
6395 1 7 . 1 1 153 153 LYS H H 176 7.900 7.900 7.470 0.430 18329
6396 1 7 . 1 1 154 154 LYS N N 177 119.290 119.290 119.405 -0.115 18329
6397 1 7 . 1 1 154 154 LYS HA H 177 4.260 4.260 3.963 0.297 18329
6398 1 7 . 1 1 154 154 LYS C C 177 178.100 178.100 177.912 0.188 18329
6399 1 7 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.659 -1.859 18329
6400 1 7 . 1 1 154 154 LYS CB C 177 31.800 31.800 32.193 -0.393 18329
6401 1 7 . 1 1 154 154 LYS H H 177 7.540 7.540 7.574 -0.034 18329
6402 1 7 . 1 1 155 155 LYS N N 178 118.910 118.910 118.173 0.737 18329
6403 1 7 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.050 0.000 18329
6404 1 7 . 1 1 155 155 LYS C C 178 178.100 178.100 179.806 -1.706 18329
6405 1 7 . 1 1 155 155 LYS CA C 178 58.000 58.000 59.173 -1.173 18329
6406 1 7 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.457 -0.257 18329
6407 1 7 . 1 1 155 155 LYS H H 178 7.630 7.630 7.777 -0.147 18329
6408 1 7 . 1 1 156 156 GLU N N 179 117.950 117.950 118.806 -0.856 18329
6409 1 7 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.131 -0.021 18329
6410 1 7 . 1 1 156 156 GLU C C 179 176.700 176.700 178.835 -2.135 18329
6411 1 7 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.453 -0.953 18329
6412 1 7 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.741 -0.141 18329
6413 1 7 . 1 1 156 156 GLU H H 179 7.560 7.560 7.762 -0.202 18329
6414 1 7 . 1 1 157 157 ASN N N 180 116.590 116.590 119.364 -2.774 18329
6415 1 7 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.864 -0.144 18329
6416 1 7 . 1 1 157 157 ASN C C 180 175.000 175.000 175.299 -0.299 18329
6417 1 7 . 1 1 157 157 ASN CA C 180 52.700 52.700 52.244 0.456 18329
6418 1 7 . 1 1 157 157 ASN CB C 180 38.800 38.800 36.784 2.016 18329
6419 1 7 . 1 1 157 157 ASN H H 180 7.820 7.820 8.560 -0.740 18329
6420 1 7 . 1 1 158 158 SER HA H 181 4.450 4.450 4.381 0.069 18329
6421 1 7 . 1 1 158 158 SER CA C 181 60.400 60.400 60.415 -0.015 18329
6422 1 7 . 1 1 158 158 SER CB C 181 63.500 63.500 63.326 0.174 18329
6423 1 7 . 1 1 158 158 SER H H 181 8.030 8.030 7.715 0.315 18329
6424 1 7 . 1 1 159 159 THR N N 182 112.800 112.800 117.528 -4.728 18329
6425 1 7 . 1 1 159 159 THR HA H 182 4.380 4.380 4.090 0.290 18329
6426 1 7 . 1 1 159 159 THR C C 182 174.300 174.300 175.091 -0.791 18329
6427 1 7 . 1 1 159 159 THR CA C 182 61.800 61.800 65.313 -3.513 18329
6428 1 7 . 1 1 159 159 THR CB C 182 69.100 69.100 69.059 0.040 18329
6429 1 7 . 1 1 159 159 THR H H 182 8.070 8.070 8.323 -0.253 18329
6430 1 7 . 1 1 160 160 PHE N N 183 123.120 123.120 120.706 2.414 18329
6431 1 7 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.528 -0.088 18329
6432 1 7 . 1 1 160 160 PHE C C 183 175.100 175.100 176.088 -0.988 18329
6433 1 7 . 1 1 160 160 PHE CA C 183 58.900 58.900 57.873 1.027 18329
6434 1 7 . 1 1 160 160 PHE CB C 183 40.000 40.000 39.956 0.044 18329
6435 1 7 . 1 1 160 160 PHE H H 183 7.900 7.900 7.759 0.141 18329
6436 1 7 . 1 1 161 161 THR N N 184 119.330 119.330 120.158 -0.828 18329
6437 1 7 . 1 1 161 161 THR HA H 184 4.190 4.190 4.160 0.030 18329
6438 1 7 . 1 1 161 161 THR CA C 184 60.700 60.700 64.588 -3.888 18329
6439 1 7 . 1 1 161 161 THR CB C 184 70.700 70.700 68.948 1.752 18329
6440 1 7 . 1 1 161 161 THR H H 184 7.810 7.810 8.601 -0.791 18329
6441 1 7 . 1 1 162 162 ASP N N 185 123.190 123.190 119.074 4.116 18329
6442 1 7 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.751 -0.341 18329
6443 1 7 . 1 1 162 162 ASP C C 185 176.900 176.900 176.131 0.769 18329
6444 1 7 . 1 1 162 162 ASP CA C 185 53.900 53.900 53.950 -0.050 18329
6445 1 7 . 1 1 162 162 ASP CB C 185 44.000 44.000 41.392 2.608 18329
6446 1 7 . 1 1 162 162 ASP H H 185 8.000 8.000 8.032 -0.032 18329
6447 1 7 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.059 0.421 18329
6448 1 7 . 1 1 163 163 GLU CA C 186 58.800 58.800 57.145 1.655 18329
6449 1 7 . 1 1 163 163 GLU CB C 186 28.100 28.100 27.728 0.372 18329
6450 1 7 . 1 1 166 166 LYS N N 189 118.150 118.150 122.441 -4.291 18329
6451 1 7 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.465 -0.245 18329
6452 1 7 . 1 1 166 166 LYS C C 189 177.500 177.500 174.146 3.354 18329
6453 1 7 . 1 1 166 166 LYS CA C 189 58.000 58.000 56.476 1.524 18329
6454 1 7 . 1 1 166 166 LYS CB C 189 32.600 32.600 34.246 -1.646 18329
6455 1 7 . 1 1 166 166 LYS H H 189 8.890 8.890 8.046 0.844 18329
6456 1 7 . 1 1 167 167 ASN N N 190 116.210 116.210 123.774 -7.564 18329
6457 1 7 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.756 0.204 18329
6458 1 7 . 1 1 167 167 ASN C C 190 174.900 174.900 175.445 -0.545 18329
6459 1 7 . 1 1 167 167 ASN CA C 190 52.900 52.900 52.960 -0.060 18329
6460 1 7 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.794 -0.394 18329
6461 1 7 . 1 1 167 167 ASN H H 190 8.030 8.030 8.731 -0.701 18329
6462 1 8 . 1 1 2 2 ALA N N 25 125.000 125.000 124.563 0.437 18329
6463 1 8 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.055 0.315 18329
6464 1 8 . 1 1 2 2 ALA CA C 25 52.300 52.300 53.132 -0.832 18329
6465 1 8 . 1 1 2 2 ALA CB C 25 19.700 19.700 18.758 0.942 18329
6466 1 8 . 1 1 2 2 ALA H H 25 8.690 8.690 7.942 0.748 18329
6467 1 8 . 1 1 3 3 GLY N N 26 106.920 106.920 105.689 1.231 18329
6468 1 8 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.449 -1.449 18329
6469 1 8 . 1 1 3 3 GLY H H 26 7.940 7.940 8.677 -0.737 18329
6470 1 8 . 1 1 4 4 LEU N N 27 119.140 119.140 120.292 -1.152 18329
6471 1 8 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.444 -0.034 18329
6472 1 8 . 1 1 4 4 LEU C C 27 177.100 177.100 176.767 0.333 18329
6473 1 8 . 1 1 4 4 LEU CA C 27 54.400 54.400 55.339 -0.939 18329
6474 1 8 . 1 1 4 4 LEU CB C 27 42.100 42.100 42.489 -0.389 18329
6475 1 8 . 1 1 4 4 LEU H H 27 8.210 8.210 7.768 0.442 18329
6476 1 8 . 1 1 5 5 THR N N 28 112.940 112.940 108.453 4.487 18329
6477 1 8 . 1 1 5 5 THR HA H 28 4.650 4.650 4.362 0.288 18329
6478 1 8 . 1 1 5 5 THR C C 28 175.500 175.500 174.258 1.242 18329
6479 1 8 . 1 1 5 5 THR CA C 28 60.100 60.100 61.987 -1.887 18329
6480 1 8 . 1 1 5 5 THR CB C 28 72.600 72.600 69.476 3.124 18329
6481 1 8 . 1 1 5 5 THR H H 28 9.220 9.220 8.407 0.813 18329
6482 1 8 . 1 1 6 6 GLY N N 29 108.230 108.230 109.958 -1.728 18329
6483 1 8 . 1 1 6 6 GLY C C 29 174.800 174.800 174.349 0.451 18329
6484 1 8 . 1 1 6 6 GLY CA C 29 46.000 46.000 44.860 1.140 18329
6485 1 8 . 1 1 6 6 GLY H H 29 8.520 8.520 7.606 0.914 18329
6486 1 8 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.306 -0.266 18329
6487 1 8 . 1 1 7 7 ALA CA C 30 54.800 54.800 54.116 0.684 18329
6488 1 8 . 1 1 7 7 ALA CB C 30 18.200 18.200 18.501 -0.301 18329
6489 1 8 . 1 1 8 8 THR N N 31 116.970 116.970 114.157 2.813 18329
6490 1 8 . 1 1 8 8 THR HA H 31 3.740 3.740 3.996 -0.256 18329
6491 1 8 . 1 1 8 8 THR C C 31 175.300 175.300 176.437 -1.137 18329
6492 1 8 . 1 1 8 8 THR CA C 31 67.000 67.000 65.737 1.264 18329
6493 1 8 . 1 1 8 8 THR CB C 31 68.700 68.700 68.073 0.626 18329
6494 1 8 . 1 1 8 8 THR H H 31 8.110 8.110 8.243 -0.133 18329
6495 1 8 . 1 1 9 9 LYS N N 32 120.540 120.540 122.639 -2.099 18329
6496 1 8 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.040 -0.450 18329
6497 1 8 . 1 1 9 9 LYS C C 32 176.900 176.900 178.792 -1.892 18329
6498 1 8 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.911 -0.112 18329
6499 1 8 . 1 1 9 9 LYS CB C 32 32.400 32.400 32.231 0.169 18329
6500 1 8 . 1 1 9 9 LYS H H 32 6.860 6.860 7.498 -0.638 18329
6501 1 8 . 1 1 10 10 ILE N N 33 115.940 115.940 118.113 -2.173 18329
6502 1 8 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.827 -0.117 18329
6503 1 8 . 1 1 10 10 ILE C C 33 179.000 179.000 178.249 0.751 18329
6504 1 8 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.741 -0.741 18329
6505 1 8 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.709 0.291 18329
6506 1 8 . 1 1 10 10 ILE H H 33 7.380 7.380 7.682 -0.302 18329
6507 1 8 . 1 1 11 11 ARG N N 34 118.350 118.350 120.898 -2.548 18329
6508 1 8 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.054 -0.014 18329
6509 1 8 . 1 1 11 11 ARG C C 34 180.000 180.000 178.673 1.327 18329
6510 1 8 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.761 -0.360 18329
6511 1 8 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.215 0.085 18329
6512 1 8 . 1 1 11 11 ARG H H 34 8.250 8.250 7.759 0.491 18329
6513 1 8 . 1 1 12 12 LEU N N 35 117.420 117.420 119.374 -1.954 18329
6514 1 8 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.145 0.025 18329
6515 1 8 . 1 1 12 12 LEU C C 35 179.000 179.000 178.876 0.124 18329
6516 1 8 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.921 0.079 18329
6517 1 8 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.948 -1.148 18329
6518 1 8 . 1 1 12 12 LEU H H 35 8.340 8.340 8.100 0.240 18329
6519 1 8 . 1 1 13 13 GLU N N 36 117.890 117.890 120.409 -2.519 18329
6520 1 8 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.911 0.109 18329
6521 1 8 . 1 1 13 13 GLU C C 36 180.100 180.100 178.873 1.227 18329
6522 1 8 . 1 1 13 13 GLU CA C 36 60.200 60.200 60.067 0.133 18329
6523 1 8 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.689 -1.389 18329
6524 1 8 . 1 1 13 13 GLU H H 36 8.610 8.610 8.504 0.106 18329
6525 1 8 . 1 1 14 14 ARG N N 37 121.100 121.100 118.643 2.457 18329
6526 1 8 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.096 0.144 18329
6527 1 8 . 1 1 14 14 ARG C C 37 178.100 178.100 179.057 -0.957 18329
6528 1 8 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.493 -0.993 18329
6529 1 8 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.398 -0.198 18329
6530 1 8 . 1 1 14 14 ARG H H 37 7.980 7.980 8.016 -0.036 18329
6531 1 8 . 1 1 15 15 SER N N 38 115.420 115.420 115.193 0.227 18329
6532 1 8 . 1 1 15 15 SER HA H 38 4.380 4.380 4.470 -0.090 18329
6533 1 8 . 1 1 15 15 SER C C 38 177.300 177.300 175.989 1.311 18329
6534 1 8 . 1 1 15 15 SER CA C 38 62.200 62.200 61.389 0.811 18329
6535 1 8 . 1 1 15 15 SER CB C 38 63.200 63.200 62.982 0.218 18329
6536 1 8 . 1 1 15 15 SER H H 38 8.230 8.230 8.145 0.085 18329
6537 1 8 . 1 1 16 16 ALA N N 39 123.970 123.970 123.382 0.588 18329
6538 1 8 . 1 1 16 16 ALA HA H 39 3.630 3.630 4.191 -0.561 18329
6539 1 8 . 1 1 16 16 ALA C C 39 179.500 179.500 179.566 -0.066 18329
6540 1 8 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.618 0.082 18329
6541 1 8 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.540 -0.540 18329
6542 1 8 . 1 1 16 16 ALA H H 39 8.280 8.280 8.251 0.029 18329
6543 1 8 . 1 1 17 17 LYS N N 40 121.690 121.690 119.622 2.068 18329
6544 1 8 . 1 1 17 17 LYS HA H 40 4.090 4.090 4.018 0.072 18329
6545 1 8 . 1 1 17 17 LYS C C 40 178.000 178.000 177.770 0.230 18329
6546 1 8 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.272 -0.872 18329
6547 1 8 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.290 -0.490 18329
6548 1 8 . 1 1 17 17 LYS H H 40 7.930 7.930 8.132 -0.202 18329
6549 1 8 . 1 1 18 18 ASP N N 41 118.730 118.730 118.231 0.499 18329
6550 1 8 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.520 -0.160 18329
6551 1 8 . 1 1 18 18 ASP C C 41 179.900 179.900 178.745 1.155 18329
6552 1 8 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.610 1.090 18329
6553 1 8 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.317 -0.717 18329
6554 1 8 . 1 1 18 18 ASP H H 41 8.320 8.320 7.818 0.502 18329
6555 1 8 . 1 1 19 19 ILE N N 42 118.180 118.180 120.089 -1.909 18329
6556 1 8 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.724 -0.034 18329
6557 1 8 . 1 1 19 19 ILE C C 42 177.400 177.400 177.823 -0.423 18329
6558 1 8 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.327 -0.127 18329
6559 1 8 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.764 0.136 18329
6560 1 8 . 1 1 19 19 ILE H H 42 7.420 7.420 7.689 -0.269 18329
6561 1 8 . 1 1 20 20 THR N N 43 113.360 113.360 112.375 0.985 18329
6562 1 8 . 1 1 20 20 THR HA H 43 3.770 3.770 4.070 -0.300 18329
6563 1 8 . 1 1 20 20 THR C C 43 177.800 177.800 176.435 1.365 18329
6564 1 8 . 1 1 20 20 THR CA C 43 66.400 66.400 65.497 0.903 18329
6565 1 8 . 1 1 20 20 THR CB C 43 67.400 67.400 68.443 -1.043 18329
6566 1 8 . 1 1 20 20 THR H H 43 7.610 7.610 7.539 0.071 18329
6567 1 8 . 1 1 21 21 ASP N N 44 123.650 123.650 121.881 1.769 18329
6568 1 8 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.412 -0.002 18329
6569 1 8 . 1 1 21 21 ASP C C 44 179.200 179.200 178.633 0.567 18329
6570 1 8 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.245 -0.045 18329
6571 1 8 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.134 -0.534 18329
6572 1 8 . 1 1 21 21 ASP H H 44 9.260 9.260 7.987 1.273 18329
6573 1 8 . 1 1 22 22 GLU N N 45 123.560 123.560 119.015 4.545 18329
6574 1 8 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.178 0.192 18329
6575 1 8 . 1 1 22 22 GLU C C 45 178.500 178.500 179.124 -0.624 18329
6576 1 8 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.786 -0.586 18329
6577 1 8 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.745 -0.545 18329
6578 1 8 . 1 1 22 22 GLU H H 45 7.750 7.750 7.823 -0.073 18329
6579 1 8 . 1 1 23 23 ILE N N 46 119.940 119.940 115.040 4.900 18329
6580 1 8 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.826 -0.206 18329
6581 1 8 . 1 1 23 23 ILE C C 46 177.600 177.600 178.163 -0.563 18329
6582 1 8 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.243 1.357 18329
6583 1 8 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.503 -0.503 18329
6584 1 8 . 1 1 23 23 ILE H H 46 8.360 8.360 7.355 1.005 18329
6585 1 8 . 1 1 24 24 ASP N N 47 120.730 120.730 121.860 -1.130 18329
6586 1 8 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.510 -0.110 18329
6587 1 8 . 1 1 24 24 ASP C C 47 178.900 178.900 178.297 0.603 18329
6588 1 8 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.078 0.422 18329
6589 1 8 . 1 1 24 24 ASP CB C 47 39.900 39.900 39.880 0.020 18329
6590 1 8 . 1 1 24 24 ASP H H 47 8.280 8.280 8.418 -0.138 18329
6591 1 8 . 1 1 25 25 ALA N N 48 123.870 123.870 122.302 1.568 18329
6592 1 8 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.108 0.012 18329
6593 1 8 . 1 1 25 25 ALA C C 48 180.400 180.400 179.354 1.046 18329
6594 1 8 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.527 0.973 18329
6595 1 8 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.125 -0.326 18329
6596 1 8 . 1 1 25 25 ALA H H 48 7.880 7.880 7.515 0.365 18329
6597 1 8 . 1 1 26 26 ILE N N 49 121.970 121.970 118.662 3.308 18329
6598 1 8 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.675 0.055 18329
6599 1 8 . 1 1 26 26 ILE C C 49 178.400 178.400 177.124 1.276 18329
6600 1 8 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.256 1.644 18329
6601 1 8 . 1 1 26 26 ILE CB C 49 37.500 37.500 38.154 -0.654 18329
6602 1 8 . 1 1 26 26 ILE H H 49 8.710 8.710 7.354 1.356 18329
6603 1 8 . 1 1 27 27 LYS N N 50 119.820 119.820 118.978 0.842 18329
6604 1 8 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.702 0.178 18329
6605 1 8 . 1 1 27 27 LYS C C 50 179.900 179.900 179.015 0.885 18329
6606 1 8 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.688 0.712 18329
6607 1 8 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.807 0.093 18329
6608 1 8 . 1 1 27 27 LYS H H 50 8.540 8.540 8.086 0.454 18329
6609 1 8 . 1 1 28 28 LYS N N 51 121.960 121.960 117.757 4.203 18329
6610 1 8 . 1 1 28 28 LYS HA H 51 4.090 4.090 4.069 0.021 18329
6611 1 8 . 1 1 28 28 LYS C C 51 179.200 179.200 178.890 0.310 18329
6612 1 8 . 1 1 28 28 LYS CA C 51 59.300 59.300 58.792 0.508 18329
6613 1 8 . 1 1 28 28 LYS CB C 51 31.400 31.400 31.928 -0.528 18329
6614 1 8 . 1 1 28 28 LYS H H 51 8.070 8.070 7.505 0.565 18329
6615 1 8 . 1 1 29 29 ASP N N 52 121.710 121.710 119.872 1.838 18329
6616 1 8 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.531 -0.061 18329
6617 1 8 . 1 1 29 29 ASP C C 52 178.500 178.500 178.702 -0.202 18329
6618 1 8 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.595 0.405 18329
6619 1 8 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.756 0.244 18329
6620 1 8 . 1 1 29 29 ASP H H 52 8.340 8.340 7.747 0.593 18329
6621 1 8 . 1 1 30 30 ALA N N 53 121.990 121.990 122.257 -0.267 18329
6622 1 8 . 1 1 30 30 ALA HA H 53 3.340 3.340 4.179 -0.839 18329
6623 1 8 . 1 1 30 30 ALA C C 53 179.500 179.500 179.687 -0.187 18329
6624 1 8 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.972 0.128 18329
6625 1 8 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.430 -0.330 18329
6626 1 8 . 1 1 30 30 ALA H H 53 8.800 8.800 8.370 0.430 18329
6627 1 8 . 1 1 31 31 ALA N N 54 119.970 119.970 120.267 -0.297 18329
6628 1 8 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.069 0.081 18329
6629 1 8 . 1 1 31 31 ALA C C 54 181.600 181.600 178.879 2.721 18329
6630 1 8 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.195 0.505 18329
6631 1 8 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.404 -0.604 18329
6632 1 8 . 1 1 31 31 ALA H H 54 7.730 7.730 7.583 0.147 18329
6633 1 8 . 1 1 32 32 LEU N N 55 119.660 119.660 117.315 2.345 18329
6634 1 8 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.088 0.052 18329
6635 1 8 . 1 1 32 32 LEU C C 55 179.100 179.100 177.419 1.681 18329
6636 1 8 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.403 0.597 18329
6637 1 8 . 1 1 32 32 LEU CB C 55 41.900 41.900 42.002 -0.102 18329
6638 1 8 . 1 1 32 32 LEU H H 55 7.660 7.660 7.511 0.149 18329
6639 1 8 . 1 1 33 33 LYS N N 56 117.160 117.160 117.627 -0.467 18329
6640 1 8 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.407 -0.197 18329
6641 1 8 . 1 1 33 33 LYS C C 56 176.600 176.600 175.940 0.660 18329
6642 1 8 . 1 1 33 33 LYS CA C 56 56.100 56.100 54.939 1.161 18329
6643 1 8 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.961 -0.761 18329
6644 1 8 . 1 1 33 33 LYS H H 56 7.610 7.610 7.309 0.301 18329
6645 1 8 . 1 1 34 34 GLY N N 57 108.680 108.680 111.920 -3.240 18329
6646 1 8 . 1 1 34 34 GLY C C 57 174.400 174.400 174.025 0.375 18329
6647 1 8 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.563 0.637 18329
6648 1 8 . 1 1 34 34 GLY H H 57 7.710 7.710 8.579 -0.869 18329
6649 1 8 . 1 1 35 35 VAL N N 58 121.000 121.000 120.538 0.462 18329
6650 1 8 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.383 -0.483 18329
6651 1 8 . 1 1 35 35 VAL C C 58 174.200 174.200 175.345 -1.145 18329
6652 1 8 . 1 1 35 35 VAL CA C 58 61.500 61.500 60.035 1.465 18329
6653 1 8 . 1 1 35 35 VAL CB C 58 32.800 32.800 34.476 -1.676 18329
6654 1 8 . 1 1 35 35 VAL H H 58 7.990 7.990 7.535 0.455 18329
6655 1 8 . 1 1 36 36 ASN N N 59 124.960 124.960 119.893 5.067 18329
6656 1 8 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.845 -0.175 18329
6657 1 8 . 1 1 36 36 ASN C C 59 175.700 175.700 174.171 1.529 18329
6658 1 8 . 1 1 36 36 ASN CA C 59 51.600 51.600 53.588 -1.988 18329
6659 1 8 . 1 1 36 36 ASN CB C 59 39.100 39.100 39.049 0.051 18329
6660 1 8 . 1 1 36 36 ASN H H 59 8.460 8.460 8.411 0.049 18329
6661 1 8 . 1 1 37 37 PHE N N 60 124.460 124.460 118.672 5.788 18329
6662 1 8 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.670 -0.530 18329
6663 1 8 . 1 1 37 37 PHE C C 60 177.000 177.000 174.819 2.181 18329
6664 1 8 . 1 1 37 37 PHE CA C 60 60.400 60.400 58.875 1.525 18329
6665 1 8 . 1 1 37 37 PHE CB C 60 39.200 39.200 40.734 -1.534 18329
6666 1 8 . 1 1 37 37 PHE H H 60 8.780 8.780 8.440 0.340 18329
6667 1 8 . 1 1 38 38 ASP N N 61 119.270 119.270 121.354 -2.084 18329
6668 1 8 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.873 -0.383 18329
6669 1 8 . 1 1 38 38 ASP C C 61 177.000 177.000 174.752 2.248 18329
6670 1 8 . 1 1 38 38 ASP CA C 61 55.500 55.500 53.574 1.926 18329
6671 1 8 . 1 1 38 38 ASP CB C 61 40.000 40.000 40.690 -0.690 18329
6672 1 8 . 1 1 38 38 ASP H H 61 8.400 8.400 8.188 0.212 18329
6673 1 8 . 1 1 39 39 ALA N N 62 122.020 122.020 128.615 -6.595 18329
6674 1 8 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.496 -0.296 18329
6675 1 8 . 1 1 39 39 ALA C C 62 178.300 178.300 176.264 2.036 18329
6676 1 8 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.044 0.856 18329
6677 1 8 . 1 1 39 39 ALA CB C 62 18.500 18.500 19.730 -1.230 18329
6678 1 8 . 1 1 39 39 ALA H H 62 7.740 7.740 7.956 -0.216 18329
6679 1 8 . 1 1 40 40 PHE N N 63 116.940 116.940 118.913 -1.973 18329
6680 1 8 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.183 0.197 18329
6681 1 8 . 1 1 40 40 PHE C C 63 176.100 176.100 174.041 2.059 18329
6682 1 8 . 1 1 40 40 PHE CA C 63 58.300 58.300 58.334 -0.034 18329
6683 1 8 . 1 1 40 40 PHE CB C 63 38.800 38.800 38.717 0.083 18329
6684 1 8 . 1 1 40 40 PHE H H 63 7.730 7.730 7.612 0.118 18329
6685 1 8 . 1 1 41 41 LYS N N 64 119.840 119.840 121.339 -1.499 18329
6686 1 8 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.524 -0.304 18329
6687 1 8 . 1 1 41 41 LYS C C 64 176.100 176.100 175.224 0.876 18329
6688 1 8 . 1 1 41 41 LYS CA C 64 56.600 56.600 55.307 1.293 18329
6689 1 8 . 1 1 41 41 LYS CB C 64 32.900 32.900 34.901 -2.001 18329
6690 1 8 . 1 1 41 41 LYS H H 64 7.650 7.650 7.693 -0.043 18329
6691 1 8 . 1 1 42 42 ASP N N 65 120.770 120.770 120.662 0.108 18329
6692 1 8 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.430 0.140 18329
6693 1 8 . 1 1 42 42 ASP C C 65 176.100 176.100 175.191 0.909 18329
6694 1 8 . 1 1 42 42 ASP CA C 65 54.200 54.200 55.071 -0.871 18329
6695 1 8 . 1 1 42 42 ASP CB C 65 40.900 40.900 40.109 0.791 18329
6696 1 8 . 1 1 42 42 ASP H H 65 8.030 8.030 8.560 -0.530 18329
6697 1 8 . 1 1 43 43 LYS N N 66 122.070 122.070 117.589 4.481 18329
6698 1 8 . 1 1 43 43 LYS HA H 66 4.280 4.280 3.982 0.298 18329
6699 1 8 . 1 1 43 43 LYS C C 66 176.800 176.800 174.920 1.880 18329
6700 1 8 . 1 1 43 43 LYS CA C 66 56.500 56.500 56.979 -0.479 18329
6701 1 8 . 1 1 43 43 LYS CB C 66 32.800 32.800 32.960 -0.160 18329
6702 1 8 . 1 1 43 43 LYS H H 66 8.180 8.180 7.815 0.365 18329
6703 1 8 . 1 1 44 44 LYS N N 67 122.170 122.170 124.755 -2.585 18329
6704 1 8 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.159 0.191 18329
6705 1 8 . 1 1 44 44 LYS C C 67 177.000 177.000 176.480 0.520 18329
6706 1 8 . 1 1 44 44 LYS CA C 67 56.600 56.600 57.268 -0.668 18329
6707 1 8 . 1 1 44 44 LYS CB C 67 32.800 32.800 32.841 -0.041 18329
6708 1 8 . 1 1 44 44 LYS H H 67 8.460 8.460 8.383 0.077 18329
6709 1 8 . 1 1 45 45 THR N N 68 114.390 114.390 120.789 -6.399 18329
6710 1 8 . 1 1 45 45 THR HA H 68 4.330 4.330 4.426 -0.096 18329
6711 1 8 . 1 1 45 45 THR C C 68 175.200 175.200 174.963 0.237 18329
6712 1 8 . 1 1 45 45 THR CA C 68 62.000 62.000 62.428 -0.428 18329
6713 1 8 . 1 1 45 45 THR CB C 68 69.900 69.900 69.459 0.441 18329
6714 1 8 . 1 1 45 45 THR H H 68 8.120 8.120 8.200 -0.080 18329
6715 1 8 . 1 1 46 46 GLY N N 69 111.200 111.200 116.319 -5.119 18329
6716 1 8 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.069 0.131 18329
6717 1 8 . 1 1 46 46 GLY H H 69 8.450 8.450 8.617 -0.167 18329
6718 1 8 . 1 1 47 47 SER CA C 70 58.400 58.400 57.060 1.340 18329
6719 1 8 . 1 1 47 47 SER CB C 70 64.000 64.000 66.225 -2.225 18329
6720 1 8 . 1 1 48 48 GLY N N 71 111.200 111.200 109.372 1.828 18329
6721 1 8 . 1 1 48 48 GLY CA C 71 45.000 45.000 46.443 -1.443 18329
6722 1 8 . 1 1 48 48 GLY H H 71 8.580 8.580 8.659 -0.079 18329
6723 1 8 . 1 1 49 49 VAL N N 72 118.910 118.910 120.842 -1.932 18329
6724 1 8 . 1 1 49 49 VAL HA H 72 4.130 4.130 3.872 0.258 18329
6725 1 8 . 1 1 49 49 VAL C C 72 176.100 176.100 175.103 0.997 18329
6726 1 8 . 1 1 49 49 VAL CA C 72 62.100 62.100 62.591 -0.491 18329
6727 1 8 . 1 1 49 49 VAL CB C 72 32.500 32.500 31.841 0.659 18329
6728 1 8 . 1 1 49 49 VAL H H 72 7.860 7.860 7.744 0.116 18329
6729 1 8 . 1 1 50 50 SER N N 73 118.500 118.500 120.577 -2.077 18329
6730 1 8 . 1 1 50 50 SER C C 73 176.100 176.100 173.589 2.511 18329
6731 1 8 . 1 1 50 50 SER CA C 73 58.300 58.300 59.731 -1.431 18329
6732 1 8 . 1 1 50 50 SER CB C 73 63.800 63.800 63.443 0.357 18329
6733 1 8 . 1 1 50 50 SER H H 73 8.300 8.300 8.527 -0.227 18329
6734 1 8 . 1 1 51 51 GLU N N 74 122.560 122.560 121.758 0.802 18329
6735 1 8 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.171 0.099 18329
6736 1 8 . 1 1 51 51 GLU CA C 74 55.700 55.700 56.712 -1.012 18329
6737 1 8 . 1 1 51 51 GLU CB C 74 30.500 30.500 29.938 0.562 18329
6738 1 8 . 1 1 51 51 GLU H H 74 8.360 8.360 8.657 -0.297 18329
6739 1 8 . 1 1 52 52 ASN N N 75 122.830 122.830 117.480 5.350 18329
6740 1 8 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.697 0.123 18329
6741 1 8 . 1 1 52 52 ASN C C 75 174.800 174.800 172.722 2.078 18329
6742 1 8 . 1 1 52 52 ASN CA C 75 51.400 51.400 53.000 -1.600 18329
6743 1 8 . 1 1 52 52 ASN CB C 75 39.200 39.200 37.486 1.714 18329
6744 1 8 . 1 1 52 52 ASN H H 75 8.450 8.450 8.255 0.195 18329
6745 1 8 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.349 -0.169 18329
6746 1 8 . 1 1 53 53 PRO CA C 76 65.200 65.200 63.706 1.494 18329
6747 1 8 . 1 1 53 53 PRO CB C 76 32.000 32.000 31.187 0.813 18329
6748 1 8 . 1 1 54 54 PHE N N 77 118.060 118.060 121.061 -3.001 18329
6749 1 8 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.284 -0.014 18329
6750 1 8 . 1 1 54 54 PHE C C 77 177.500 177.500 176.736 0.764 18329
6751 1 8 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.724 -0.224 18329
6752 1 8 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.912 -0.512 18329
6753 1 8 . 1 1 54 54 PHE H H 77 8.430 8.430 8.154 0.276 18329
6754 1 8 . 1 1 55 55 ILE N N 78 119.350 119.350 119.257 0.093 18329
6755 1 8 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.669 -0.169 18329
6756 1 8 . 1 1 55 55 ILE C C 78 177.400 177.400 176.914 0.486 18329
6757 1 8 . 1 1 55 55 ILE CA C 78 63.500 63.500 63.371 0.129 18329
6758 1 8 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.936 -0.936 18329
6759 1 8 . 1 1 55 55 ILE H H 78 7.540 7.540 7.494 0.046 18329
6760 1 8 . 1 1 56 56 LEU N N 79 118.450 118.450 118.855 -0.405 18329
6761 1 8 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.013 0.137 18329
6762 1 8 . 1 1 56 56 LEU C C 79 179.200 179.200 179.298 -0.098 18329
6763 1 8 . 1 1 56 56 LEU CA C 79 57.800 57.800 57.476 0.324 18329
6764 1 8 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.545 -0.445 18329
6765 1 8 . 1 1 56 56 LEU H H 79 7.260 7.260 7.756 -0.496 18329
6766 1 8 . 1 1 57 57 GLU N N 80 117.980 117.980 118.136 -0.156 18329
6767 1 8 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.867 -0.217 18329
6768 1 8 . 1 1 57 57 GLU C C 80 178.700 178.700 178.090 0.610 18329
6769 1 8 . 1 1 57 57 GLU CA C 80 59.300 59.300 58.812 0.487 18329
6770 1 8 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.179 0.321 18329
6771 1 8 . 1 1 57 57 GLU H H 80 7.890 7.890 7.727 0.163 18329
6772 1 8 . 1 1 58 58 ALA N N 81 122.040 122.040 121.531 0.509 18329
6773 1 8 . 1 1 58 58 ALA HA H 81 3.800 3.800 4.012 -0.212 18329
6774 1 8 . 1 1 58 58 ALA C C 81 179.500 179.500 179.108 0.392 18329
6775 1 8 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.841 0.359 18329
6776 1 8 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.268 0.532 18329
6777 1 8 . 1 1 58 58 ALA H H 81 8.400 8.400 7.488 0.912 18329
6778 1 8 . 1 1 59 59 LYS N N 82 116.000 116.000 116.836 -0.836 18329
6779 1 8 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.027 -0.177 18329
6780 1 8 . 1 1 59 59 LYS C C 82 180.300 180.300 178.043 2.257 18329
6781 1 8 . 1 1 59 59 LYS CA C 82 61.100 61.100 58.842 2.258 18329
6782 1 8 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.319 -0.118 18329
6783 1 8 . 1 1 59 59 LYS H H 82 8.000 8.000 7.443 0.557 18329
6784 1 8 . 1 1 60 60 VAL N N 83 122.920 122.920 119.206 3.714 18329
6785 1 8 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.615 -0.285 18329
6786 1 8 . 1 1 60 60 VAL C C 83 178.300 178.300 177.848 0.452 18329
6787 1 8 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.827 2.073 18329
6788 1 8 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.270 -0.070 18329
6789 1 8 . 1 1 60 60 VAL H H 83 8.110 8.110 7.281 0.829 18329
6790 1 8 . 1 1 61 61 ARG N N 84 121.770 121.770 118.700 3.070 18329
6791 1 8 . 1 1 61 61 ARG C C 84 179.500 179.500 178.570 0.930 18329
6792 1 8 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.227 -0.028 18329
6793 1 8 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.955 0.845 18329
6794 1 8 . 1 1 61 61 ARG H H 84 8.710 8.710 7.517 1.193 18329
6795 1 8 . 1 1 62 62 ALA N N 85 119.450 119.450 122.012 -2.562 18329
6796 1 8 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.074 -0.184 18329
6797 1 8 . 1 1 62 62 ALA C C 85 179.500 179.500 178.985 0.515 18329
6798 1 8 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.378 -0.378 18329
6799 1 8 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.144 0.856 18329
6800 1 8 . 1 1 62 62 ALA H H 85 8.700 8.700 7.652 1.048 18329
6801 1 8 . 1 1 63 63 THR N N 86 106.650 106.650 112.377 -5.727 18329
6802 1 8 . 1 1 63 63 THR HA H 86 3.970 3.970 4.139 -0.169 18329
6803 1 8 . 1 1 63 63 THR C C 86 177.700 177.700 176.197 1.503 18329
6804 1 8 . 1 1 63 63 THR CA C 86 66.000 66.000 65.034 0.966 18329
6805 1 8 . 1 1 63 63 THR CB C 86 68.200 68.200 68.275 -0.075 18329
6806 1 8 . 1 1 63 63 THR H H 86 8.150 8.150 7.703 0.447 18329
6807 1 8 . 1 1 64 64 THR N N 87 120.430 120.430 119.567 0.863 18329
6808 1 8 . 1 1 64 64 THR HA H 87 4.050 4.050 4.127 -0.077 18329
6809 1 8 . 1 1 64 64 THR C C 87 176.800 176.800 176.543 0.257 18329
6810 1 8 . 1 1 64 64 THR CA C 87 67.300 67.300 67.659 -0.359 18329
6811 1 8 . 1 1 64 64 THR CB C 87 68.600 68.600 68.712 -0.112 18329
6812 1 8 . 1 1 64 64 THR H H 87 7.920 7.920 7.643 0.277 18329
6813 1 8 . 1 1 65 65 VAL N N 88 119.230 119.230 120.752 -1.522 18329
6814 1 8 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.725 0.255 18329
6815 1 8 . 1 1 65 65 VAL C C 88 178.500 178.500 177.563 0.937 18329
6816 1 8 . 1 1 65 65 VAL CA C 88 65.600 65.600 66.120 -0.520 18329
6817 1 8 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.482 0.218 18329
6818 1 8 . 1 1 65 65 VAL H H 88 7.380 7.380 7.480 -0.100 18329
6819 1 8 . 1 1 66 66 ALA N N 89 124.260 124.260 121.421 2.839 18329
6820 1 8 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.969 0.281 18329
6821 1 8 . 1 1 66 66 ALA C C 89 179.900 179.900 179.176 0.724 18329
6822 1 8 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.191 -0.291 18329
6823 1 8 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.009 1.491 18329
6824 1 8 . 1 1 66 66 ALA H H 89 8.390 8.390 7.629 0.761 18329
6825 1 8 . 1 1 67 67 GLU N N 90 120.180 120.180 118.318 1.862 18329
6826 1 8 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.887 -0.167 18329
6827 1 8 . 1 1 67 67 GLU C C 90 177.600 177.600 178.779 -1.179 18329
6828 1 8 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.877 0.023 18329
6829 1 8 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.469 -1.169 18329
6830 1 8 . 1 1 67 67 GLU H H 90 8.520 8.520 8.233 0.287 18329
6831 1 8 . 1 1 68 68 LYS N N 91 116.340 116.340 118.114 -1.774 18329
6832 1 8 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.001 -0.041 18329
6833 1 8 . 1 1 68 68 LYS C C 91 179.200 179.200 178.824 0.376 18329
6834 1 8 . 1 1 68 68 LYS CA C 91 59.800 59.800 59.302 0.498 18329
6835 1 8 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.019 -0.019 18329
6836 1 8 . 1 1 68 68 LYS H H 91 7.210 7.210 7.630 -0.420 18329
6837 1 8 . 1 1 69 69 PHE N N 92 120.990 120.990 119.981 1.009 18329
6838 1 8 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.169 0.341 18329
6839 1 8 . 1 1 69 69 PHE C C 92 175.100 175.100 176.934 -1.834 18329
6840 1 8 . 1 1 69 69 PHE CA C 92 59.800 59.800 60.893 -1.093 18329
6841 1 8 . 1 1 69 69 PHE CB C 92 39.200 39.200 38.963 0.237 18329
6842 1 8 . 1 1 69 69 PHE H H 92 7.180 7.180 7.429 -0.249 18329
6843 1 8 . 1 1 70 70 VAL N N 93 120.330 120.330 119.336 0.994 18329
6844 1 8 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.456 -0.366 18329
6845 1 8 . 1 1 70 70 VAL C C 93 177.500 177.500 177.879 -0.379 18329
6846 1 8 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.827 0.073 18329
6847 1 8 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.595 -0.195 18329
6848 1 8 . 1 1 70 70 VAL H H 93 7.930 7.930 7.591 0.339 18329
6849 1 8 . 1 1 71 71 ILE N N 94 120.410 120.410 119.738 0.672 18329
6850 1 8 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.641 0.189 18329
6851 1 8 . 1 1 71 71 ILE C C 94 177.700 177.700 177.889 -0.189 18329
6852 1 8 . 1 1 71 71 ILE CA C 94 65.000 65.000 65.114 -0.114 18329
6853 1 8 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.563 -0.263 18329
6854 1 8 . 1 1 71 71 ILE H H 94 8.180 8.180 7.511 0.669 18329
6855 1 8 . 1 1 72 72 ALA N N 95 122.440 122.440 123.100 -0.660 18329
6856 1 8 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.876 0.084 18329
6857 1 8 . 1 1 72 72 ALA C C 95 179.600 179.600 179.612 -0.012 18329
6858 1 8 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.297 0.603 18329
6859 1 8 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.866 -0.666 18329
6860 1 8 . 1 1 72 72 ALA H H 95 7.340 7.340 7.573 -0.233 18329
6861 1 8 . 1 1 73 73 ILE N N 96 119.330 119.330 118.234 1.096 18329
6862 1 8 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.552 -0.112 18329
6863 1 8 . 1 1 73 73 ILE C C 96 177.400 177.400 177.891 -0.491 18329
6864 1 8 . 1 1 73 73 ILE CA C 96 62.800 62.800 63.441 -0.642 18329
6865 1 8 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.028 -1.627 18329
6866 1 8 . 1 1 73 73 ILE H H 96 7.820 7.820 7.372 0.448 18329
6867 1 8 . 1 1 74 74 GLU N N 97 118.440 118.440 121.092 -2.652 18329
6868 1 8 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.815 -0.125 18329
6869 1 8 . 1 1 74 74 GLU C C 97 180.500 180.500 179.152 1.348 18329
6870 1 8 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.705 -0.005 18329
6871 1 8 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.616 0.084 18329
6872 1 8 . 1 1 74 74 GLU H H 97 8.380 8.380 7.686 0.694 18329
6873 1 8 . 1 1 75 75 GLU N N 98 120.470 120.470 117.503 2.967 18329
6874 1 8 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.090 -0.150 18329
6875 1 8 . 1 1 75 75 GLU C C 98 180.600 180.600 179.246 1.354 18329
6876 1 8 . 1 1 75 75 GLU CA C 98 59.700 59.700 58.510 1.190 18329
6877 1 8 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.308 0.892 18329
6878 1 8 . 1 1 75 75 GLU H H 98 8.800 8.800 8.034 0.766 18329
6879 1 8 . 1 1 76 76 GLU N N 99 119.230 119.230 119.934 -0.704 18329
6880 1 8 . 1 1 76 76 GLU HA H 99 4.140 4.140 3.994 0.146 18329
6881 1 8 . 1 1 76 76 GLU C C 99 178.900 178.900 178.586 0.314 18329
6882 1 8 . 1 1 76 76 GLU CA C 99 58.600 58.600 59.069 -0.469 18329
6883 1 8 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.268 0.032 18329
6884 1 8 . 1 1 76 76 GLU H H 99 8.840 8.840 8.124 0.716 18329
6885 1 8 . 1 1 77 77 ALA N N 100 121.950 121.950 120.302 1.648 18329
6886 1 8 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.357 -0.357 18329
6887 1 8 . 1 1 77 77 ALA C C 100 179.000 179.000 179.374 -0.374 18329
6888 1 8 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.014 1.286 18329
6889 1 8 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.265 -1.465 18329
6890 1 8 . 1 1 77 77 ALA H H 100 9.400 9.400 7.791 1.609 18329
6891 1 8 . 1 1 78 78 THR N N 101 111.820 111.820 113.945 -2.125 18329
6892 1 8 . 1 1 78 78 THR HA H 101 3.750 3.750 4.013 -0.263 18329
6893 1 8 . 1 1 78 78 THR CA C 101 67.500 67.500 65.835 1.665 18329
6894 1 8 . 1 1 78 78 THR CB C 101 68.600 68.600 68.605 -0.005 18329
6895 1 8 . 1 1 78 78 THR H H 101 7.770 7.770 7.682 0.088 18329
6896 1 8 . 1 1 79 79 LYS N N 102 122.940 122.940 120.350 2.590 18329
6897 1 8 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.191 -0.101 18329
6898 1 8 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.308 0.892 18329
6899 1 8 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.350 0.150 18329
6900 1 8 . 1 1 79 79 LYS H H 102 7.870 7.870 7.688 0.182 18329
6901 1 8 . 1 1 80 80 LEU N N 103 117.690 117.690 117.826 -0.136 18329
6902 1 8 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.462 0.028 18329
6903 1 8 . 1 1 80 80 LEU C C 103 178.140 178.140 177.624 0.516 18329
6904 1 8 . 1 1 80 80 LEU CA C 103 54.000 54.000 54.743 -0.743 18329
6905 1 8 . 1 1 80 80 LEU CB C 103 43.100 43.100 42.045 1.055 18329
6906 1 8 . 1 1 80 80 LEU H H 103 7.550 7.550 7.270 0.280 18329
6907 1 8 . 1 1 81 81 LYS N N 104 122.210 122.210 118.880 3.330 18329
6908 1 8 . 1 1 81 81 LYS HA H 104 3.930 3.930 3.926 0.004 18329
6909 1 8 . 1 1 81 81 LYS C C 104 178.000 178.000 177.661 0.339 18329
6910 1 8 . 1 1 81 81 LYS CA C 104 61.300 61.300 58.880 2.420 18329
6911 1 8 . 1 1 81 81 LYS CB C 104 32.800 32.800 32.085 0.715 18329
6912 1 8 . 1 1 81 81 LYS H H 104 7.500 7.500 7.627 -0.127 18329
6913 1 8 . 1 1 82 82 GLU N N 105 114.920 114.920 117.185 -2.265 18329
6914 1 8 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.206 0.354 18329
6915 1 8 . 1 1 82 82 GLU C C 105 177.900 177.900 178.063 -0.163 18329
6916 1 8 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.004 0.656 18329
6917 1 8 . 1 1 82 82 GLU CB C 105 30.400 30.400 29.507 0.893 18329
6918 1 8 . 1 1 82 82 GLU H H 105 8.780 8.780 8.240 0.540 18329
6919 1 8 . 1 1 83 83 THR N N 106 107.260 107.260 114.152 -6.892 18329
6920 1 8 . 1 1 83 83 THR HA H 106 4.550 4.550 4.036 0.514 18329
6921 1 8 . 1 1 83 83 THR C C 106 176.300 176.300 176.723 -0.423 18329
6922 1 8 . 1 1 83 83 THR CA C 106 61.900 61.900 65.350 -3.450 18329
6923 1 8 . 1 1 83 83 THR CB C 106 70.400 70.400 68.548 1.852 18329
6924 1 8 . 1 1 83 83 THR H H 106 7.570 7.570 8.420 -0.850 18329
6925 1 8 . 1 1 84 84 GLY N N 107 112.110 112.110 108.712 3.398 18329
6926 1 8 . 1 1 84 84 GLY C C 107 172.800 172.800 174.078 -1.278 18329
6927 1 8 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.378 0.022 18329
6928 1 8 . 1 1 84 84 GLY H H 107 9.000 9.000 8.536 0.464 18329
6929 1 8 . 1 1 85 85 SER N N 108 119.030 119.030 115.303 3.727 18329
6930 1 8 . 1 1 85 85 SER CA C 108 56.300 56.300 58.857 -2.557 18329
6931 1 8 . 1 1 85 85 SER CB C 108 66.300 66.300 63.551 2.749 18329
6932 1 8 . 1 1 85 85 SER H H 108 8.950 8.950 8.252 0.698 18329
6933 1 8 . 1 1 86 86 SER HA H 109 4.480 4.480 4.432 0.048 18329
6934 1 8 . 1 1 86 86 SER C C 109 177.000 177.000 176.681 0.319 18329
6935 1 8 . 1 1 86 86 SER CA C 109 61.600 61.600 61.398 0.202 18329
6936 1 8 . 1 1 86 86 SER CB C 109 62.900 62.900 63.564 -0.664 18329
6937 1 8 . 1 1 87 87 GLY N N 110 108.100 108.100 108.904 -0.804 18329
6938 1 8 . 1 1 87 87 GLY C C 110 177.100 177.100 175.779 1.321 18329
6939 1 8 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.817 -0.617 18329
6940 1 8 . 1 1 87 87 GLY H H 110 8.480 8.480 8.527 -0.047 18329
6941 1 8 . 1 1 88 88 GLU N N 111 123.040 123.040 122.209 0.831 18329
6942 1 8 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.027 -0.337 18329
6943 1 8 . 1 1 88 88 GLU C C 111 177.700 177.700 178.715 -1.015 18329
6944 1 8 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.621 0.879 18329
6945 1 8 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.206 -0.506 18329
6946 1 8 . 1 1 88 88 GLU H H 111 7.560 7.560 7.422 0.138 18329
6947 1 8 . 1 1 89 89 PHE N N 112 118.270 118.270 118.273 -0.003 18329
6948 1 8 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.381 0.039 18329
6949 1 8 . 1 1 89 89 PHE C C 112 178.600 178.600 177.733 0.867 18329
6950 1 8 . 1 1 89 89 PHE CA C 112 61.100 61.100 61.201 -0.101 18329
6951 1 8 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.815 -0.915 18329
6952 1 8 . 1 1 89 89 PHE H H 112 7.200 7.200 7.489 -0.289 18329
6953 1 8 . 1 1 90 90 SER N N 113 115.980 115.980 115.727 0.253 18329
6954 1 8 . 1 1 90 90 SER HA H 113 4.290 4.290 4.024 0.266 18329
6955 1 8 . 1 1 90 90 SER C C 113 178.600 178.600 176.461 2.139 18329
6956 1 8 . 1 1 90 90 SER CA C 113 62.700 62.700 62.093 0.607 18329
6957 1 8 . 1 1 90 90 SER CB C 113 62.800 62.800 62.413 0.388 18329
6958 1 8 . 1 1 90 90 SER H H 113 8.830 8.830 8.621 0.209 18329
6959 1 8 . 1 1 91 91 ALA N N 114 123.130 123.130 122.544 0.586 18329
6960 1 8 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.285 0.095 18329
6961 1 8 . 1 1 91 91 ALA C C 114 181.300 181.300 179.257 2.043 18329
6962 1 8 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.287 0.413 18329
6963 1 8 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.549 -0.149 18329
6964 1 8 . 1 1 91 91 ALA H H 114 7.580 7.580 7.552 0.028 18329
6965 1 8 . 1 1 92 92 MET N N 115 118.700 118.700 118.221 0.479 18329
6966 1 8 . 1 1 92 92 MET HA H 115 3.980 3.980 4.351 -0.371 18329
6967 1 8 . 1 1 92 92 MET C C 115 178.000 178.000 178.881 -0.881 18329
6968 1 8 . 1 1 92 92 MET CA C 115 61.000 61.000 57.722 3.278 18329
6969 1 8 . 1 1 92 92 MET CB C 115 31.400 31.400 32.054 -0.655 18329
6970 1 8 . 1 1 92 92 MET H H 115 7.880 7.880 8.128 -0.248 18329
6971 1 8 . 1 1 93 93 TYR N N 116 119.200 119.200 119.385 -0.185 18329
6972 1 8 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.259 0.021 18329
6973 1 8 . 1 1 93 93 TYR C C 116 176.300 176.300 178.454 -2.154 18329
6974 1 8 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.212 0.888 18329
6975 1 8 . 1 1 93 93 TYR CB C 116 38.300 38.300 37.747 0.553 18329
6976 1 8 . 1 1 93 93 TYR H H 116 7.870 7.870 9.057 -1.187 18329
6977 1 8 . 1 1 94 94 ASP N N 117 120.210 120.210 119.282 0.928 18329
6978 1 8 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.541 -0.351 18329
6979 1 8 . 1 1 94 94 ASP C C 117 179.000 179.000 178.900 0.100 18329
6980 1 8 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.239 0.461 18329
6981 1 8 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.666 -0.666 18329
6982 1 8 . 1 1 94 94 ASP H H 117 8.720 8.720 7.921 0.799 18329
6983 1 8 . 1 1 95 95 LEU N N 118 118.420 118.420 121.058 -2.638 18329
6984 1 8 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.160 0.050 18329
6985 1 8 . 1 1 95 95 LEU C C 118 178.600 178.600 178.745 -0.145 18329
6986 1 8 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.900 -0.200 18329
6987 1 8 . 1 1 95 95 LEU CB C 118 43.100 43.100 41.517 1.583 18329
6988 1 8 . 1 1 95 95 LEU H H 118 7.510 7.510 7.490 0.020 18329
6989 1 8 . 1 1 96 96 MET N N 119 118.470 118.470 119.110 -0.640 18329
6990 1 8 . 1 1 96 96 MET HA H 119 3.990 3.990 4.003 -0.013 18329
6991 1 8 . 1 1 96 96 MET C C 119 177.500 177.500 178.764 -1.264 18329
6992 1 8 . 1 1 96 96 MET CA C 119 60.500 60.500 58.433 2.067 18329
6993 1 8 . 1 1 96 96 MET CB C 119 33.900 33.900 31.374 2.526 18329
6994 1 8 . 1 1 96 96 MET H H 119 7.820 7.820 8.078 -0.258 18329
6995 1 8 . 1 1 97 97 PHE N N 120 119.580 119.580 117.521 2.059 18329
6996 1 8 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.106 -0.296 18329
6997 1 8 . 1 1 97 97 PHE C C 120 178.800 178.800 177.813 0.987 18329
6998 1 8 . 1 1 97 97 PHE CA C 120 61.800 61.800 62.051 -0.251 18329
6999 1 8 . 1 1 97 97 PHE CB C 120 39.200 39.200 38.326 0.874 18329
7000 1 8 . 1 1 97 97 PHE H H 120 8.940 8.940 7.836 1.104 18329
7001 1 8 . 1 1 98 98 GLU N N 121 119.940 119.940 119.369 0.571 18329
7002 1 8 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.034 -0.154 18329
7003 1 8 . 1 1 98 98 GLU C C 121 180.800 180.800 178.372 2.428 18329
7004 1 8 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.273 0.527 18329
7005 1 8 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.585 -0.386 18329
7006 1 8 . 1 1 98 98 GLU H H 121 8.690 8.690 7.906 0.784 18329
7007 1 8 . 1 1 99 99 VAL N N 122 115.350 115.350 117.559 -2.209 18329
7008 1 8 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.791 -0.051 18329
7009 1 8 . 1 1 99 99 VAL C C 122 176.500 176.500 176.981 -0.481 18329
7010 1 8 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.152 0.348 18329
7011 1 8 . 1 1 99 99 VAL CB C 122 31.300 31.300 32.165 -0.865 18329
7012 1 8 . 1 1 99 99 VAL H H 122 8.210 8.210 7.891 0.319 18329
7013 1 8 . 1 1 100 100 SER N N 123 115.450 115.450 114.875 0.575 18329
7014 1 8 . 1 1 100 100 SER HA H 123 4.270 4.270 4.115 0.155 18329
7015 1 8 . 1 1 100 100 SER C C 123 174.700 174.700 176.208 -1.508 18329
7016 1 8 . 1 1 100 100 SER CA C 123 62.000 62.000 60.826 1.174 18329
7017 1 8 . 1 1 100 100 SER H H 123 7.520 7.520 7.734 -0.214 18329
7018 1 8 . 1 1 101 101 LYS N N 124 120.310 120.310 122.194 -1.884 18329
7019 1 8 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.243 -0.273 18329
7020 1 8 . 1 1 101 101 LYS C C 124 176.600 176.600 176.633 -0.033 18329
7021 1 8 . 1 1 101 101 LYS CA C 124 61.100 61.100 59.672 1.428 18329
7022 1 8 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.501 -2.001 18329
7023 1 8 . 1 1 101 101 LYS H H 124 6.930 6.930 7.863 -0.933 18329
7024 1 8 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.280 -0.020 18329
7025 1 8 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.266 -0.066 18329
7026 1 8 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.068 -0.468 18329
7027 1 8 . 1 1 103 103 LEU N N 126 116.020 116.020 118.349 -2.329 18329
7028 1 8 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.093 -0.213 18329
7029 1 8 . 1 1 103 103 LEU C C 126 177.900 177.900 179.317 -1.417 18329
7030 1 8 . 1 1 103 103 LEU CA C 126 57.700 57.700 57.487 0.213 18329
7031 1 8 . 1 1 103 103 LEU CB C 126 41.800 41.800 40.945 0.855 18329
7032 1 8 . 1 1 103 103 LEU H H 126 6.520 6.520 7.533 -1.013 18329
7033 1 8 . 1 1 104 104 GLN N N 127 120.500 120.500 118.639 1.861 18329
7034 1 8 . 1 1 104 104 GLN C C 127 180.600 180.600 178.561 2.039 18329
7035 1 8 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.710 -0.410 18329
7036 1 8 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.314 0.686 18329
7037 1 8 . 1 1 104 104 GLN H H 127 8.160 8.160 7.820 0.340 18329
7038 1 8 . 1 1 105 105 LYS N N 128 120.000 120.000 117.319 2.681 18329
7039 1 8 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.197 -0.147 18329
7040 1 8 . 1 1 105 105 LYS C C 128 177.100 177.100 177.282 -0.182 18329
7041 1 8 . 1 1 105 105 LYS CA C 128 58.500 58.500 57.446 1.054 18329
7042 1 8 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.146 -0.746 18329
7043 1 8 . 1 1 105 105 LYS H H 128 7.810 7.810 7.672 0.138 18329
7044 1 8 . 1 1 106 106 LEU N N 129 118.530 118.530 114.849 3.681 18329
7045 1 8 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.338 -0.368 18329
7046 1 8 . 1 1 106 106 LEU C C 129 175.200 175.200 176.706 -1.506 18329
7047 1 8 . 1 1 106 106 LEU CA C 129 54.500 54.500 54.108 0.392 18329
7048 1 8 . 1 1 106 106 LEU CB C 129 42.400 42.400 43.222 -0.822 18329
7049 1 8 . 1 1 106 106 LEU H H 129 7.220 7.220 7.627 -0.407 18329
7050 1 8 . 1 1 107 107 GLY N N 130 101.490 101.490 107.544 -6.054 18329
7051 1 8 . 1 1 107 107 GLY C C 130 174.800 174.800 173.844 0.956 18329
7052 1 8 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.656 0.444 18329
7053 1 8 . 1 1 107 107 GLY H H 130 7.560 7.560 7.754 -0.194 18329
7054 1 8 . 1 1 108 108 ILE N N 131 121.340 121.340 122.566 -1.226 18329
7055 1 8 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.648 0.502 18329
7056 1 8 . 1 1 108 108 ILE C C 131 174.300 174.300 175.138 -0.838 18329
7057 1 8 . 1 1 108 108 ILE CA C 131 60.400 60.400 62.374 -1.974 18329
7058 1 8 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.105 -1.905 18329
7059 1 8 . 1 1 108 108 ILE H H 131 7.290 7.290 8.149 -0.859 18329
7060 1 8 . 1 1 109 109 GLN N N 132 125.650 125.650 124.472 1.178 18329
7061 1 8 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.385 -0.375 18329
7062 1 8 . 1 1 109 109 GLN C C 132 176.800 176.800 176.186 0.614 18329
7063 1 8 . 1 1 109 109 GLN CA C 132 57.600 57.600 54.519 3.081 18329
7064 1 8 . 1 1 109 109 GLN CB C 132 29.000 29.000 30.946 -1.946 18329
7065 1 8 . 1 1 109 109 GLN H H 132 8.080 8.080 7.877 0.203 18329
7066 1 8 . 1 1 110 110 GLU N N 133 114.890 114.890 117.889 -2.999 18329
7067 1 8 . 1 1 110 110 GLU HA H 133 4.150 4.150 4.005 0.145 18329
7068 1 8 . 1 1 110 110 GLU C C 133 177.100 177.100 177.390 -0.290 18329
7069 1 8 . 1 1 110 110 GLU CA C 133 57.100 57.100 58.061 -0.961 18329
7070 1 8 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.629 -1.329 18329
7071 1 8 . 1 1 110 110 GLU H H 133 9.270 9.270 8.921 0.349 18329
7072 1 8 . 1 1 111 111 MET N N 134 121.210 121.210 118.406 2.804 18329
7073 1 8 . 1 1 111 111 MET HA H 134 4.350 4.350 4.097 0.253 18329
7074 1 8 . 1 1 111 111 MET C C 134 177.500 177.500 178.566 -1.066 18329
7075 1 8 . 1 1 111 111 MET CA C 134 57.900 57.900 59.615 -1.715 18329
7076 1 8 . 1 1 111 111 MET CB C 134 33.300 33.300 32.110 1.190 18329
7077 1 8 . 1 1 111 111 MET H H 134 7.620 7.620 8.235 -0.615 18329
7078 1 8 . 1 1 112 112 THR N N 135 113.170 113.170 109.727 3.443 18329
7079 1 8 . 1 1 112 112 THR HA H 135 3.920 3.920 3.788 0.132 18329
7080 1 8 . 1 1 112 112 THR C C 135 176.400 176.400 176.561 -0.161 18329
7081 1 8 . 1 1 112 112 THR CA C 135 65.900 65.900 65.245 0.656 18329
7082 1 8 . 1 1 112 112 THR CB C 135 68.200 68.200 68.481 -0.281 18329
7083 1 8 . 1 1 112 112 THR H H 135 8.320 8.320 8.515 -0.196 18329
7084 1 8 . 1 1 113 113 LYS N N 136 123.440 123.440 121.300 2.140 18329
7085 1 8 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.374 -0.444 18329
7086 1 8 . 1 1 113 113 LYS C C 136 177.600 177.600 179.000 -1.400 18329
7087 1 8 . 1 1 113 113 LYS CA C 136 58.300 58.300 58.517 -0.218 18329
7088 1 8 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.128 -0.128 18329
7089 1 8 . 1 1 113 113 LYS H H 136 8.060 8.060 8.098 -0.038 18329
7090 1 8 . 1 1 114 114 THR N N 137 114.590 114.590 115.488 -0.898 18329
7091 1 8 . 1 1 114 114 THR HA H 137 4.000 4.000 3.999 0.001 18329
7092 1 8 . 1 1 114 114 THR C C 137 176.800 176.800 176.998 -0.198 18329
7093 1 8 . 1 1 114 114 THR CA C 137 67.600 67.600 66.185 1.415 18329
7094 1 8 . 1 1 114 114 THR CB C 137 69.200 69.200 68.327 0.873 18329
7095 1 8 . 1 1 114 114 THR H H 137 7.950 7.950 7.952 -0.002 18329
7096 1 8 . 1 1 115 115 VAL N N 138 119.080 119.080 121.266 -2.186 18329
7097 1 8 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.850 -0.030 18329
7098 1 8 . 1 1 115 115 VAL C C 138 176.900 176.900 178.163 -1.263 18329
7099 1 8 . 1 1 115 115 VAL CA C 138 66.800 66.800 66.715 0.085 18329
7100 1 8 . 1 1 115 115 VAL CB C 138 32.500 32.500 30.516 1.984 18329
7101 1 8 . 1 1 115 115 VAL H H 138 7.320 7.320 7.864 -0.544 18329
7102 1 8 . 1 1 116 116 SER N N 139 116.630 116.630 115.622 1.008 18329
7103 1 8 . 1 1 116 116 SER HA H 139 4.680 4.680 4.363 0.317 18329
7104 1 8 . 1 1 116 116 SER C C 139 179.000 179.000 176.820 2.180 18329
7105 1 8 . 1 1 116 116 SER CA C 139 61.400 61.400 62.131 -0.731 18329
7106 1 8 . 1 1 116 116 SER CB C 139 62.800 62.800 62.964 -0.164 18329
7107 1 8 . 1 1 116 116 SER H H 139 8.990 8.990 7.896 1.094 18329
7108 1 8 . 1 1 117 117 ASP N N 140 124.220 124.220 121.584 2.636 18329
7109 1 8 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.443 -0.083 18329
7110 1 8 . 1 1 117 117 ASP C C 140 179.900 179.900 178.436 1.464 18329
7111 1 8 . 1 1 117 117 ASP CA C 140 57.300 57.300 57.123 0.177 18329
7112 1 8 . 1 1 117 117 ASP CB C 140 39.500 39.500 41.076 -1.576 18329
7113 1 8 . 1 1 117 117 ASP H H 140 9.480 9.480 8.664 0.816 18329
7114 1 8 . 1 1 118 118 ALA N N 141 121.420 121.420 123.000 -1.580 18329
7115 1 8 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.082 0.198 18329
7116 1 8 . 1 1 118 118 ALA C C 141 179.800 179.800 178.859 0.941 18329
7117 1 8 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.875 -0.475 18329
7118 1 8 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.677 0.323 18329
7119 1 8 . 1 1 118 118 ALA H H 141 7.340 7.340 7.764 -0.424 18329
7120 1 8 . 1 1 119 119 ALA N N 142 121.680 121.680 119.277 2.403 18329
7121 1 8 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.062 0.068 18329
7122 1 8 . 1 1 119 119 ALA C C 142 178.800 178.800 178.751 0.049 18329
7123 1 8 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.430 -1.230 18329
7124 1 8 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.821 -0.521 18329
7125 1 8 . 1 1 119 119 ALA H H 142 7.890 7.890 7.891 -0.001 18329
7126 1 8 . 1 1 120 120 GLU N N 143 117.690 117.690 117.832 -0.142 18329
7127 1 8 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.330 -0.390 18329
7128 1 8 . 1 1 120 120 GLU C C 143 178.100 178.100 175.490 2.610 18329
7129 1 8 . 1 1 120 120 GLU CA C 143 58.700 58.700 56.891 1.809 18329
7130 1 8 . 1 1 120 120 GLU CB C 143 29.500 29.500 28.504 0.996 18329
7131 1 8 . 1 1 120 120 GLU H H 143 7.500 7.500 7.774 -0.274 18329
7132 1 8 . 1 1 121 121 GLU N N 144 115.680 115.680 122.774 -7.094 18329
7133 1 8 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.349 -0.189 18329
7134 1 8 . 1 1 121 121 GLU C C 144 176.100 176.100 175.252 0.848 18329
7135 1 8 . 1 1 121 121 GLU CA C 144 56.900 56.900 57.201 -0.301 18329
7136 1 8 . 1 1 121 121 GLU CB C 144 31.100 31.100 31.161 -0.061 18329
7137 1 8 . 1 1 121 121 GLU H H 144 6.970 6.970 8.071 -1.101 18329
7138 1 8 . 1 1 122 122 ASN N N 145 117.750 117.750 119.075 -1.325 18329
7139 1 8 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.111 -0.121 18329
7140 1 8 . 1 1 122 122 ASN C C 145 185.300 185.300 172.720 12.580 18329
7141 1 8 . 1 1 122 122 ASN CA C 145 50.200 50.200 51.579 -1.379 18329
7142 1 8 . 1 1 122 122 ASN CB C 145 41.100 41.100 38.068 3.032 18329
7143 1 8 . 1 1 122 122 ASN H H 145 7.670 7.670 7.892 -0.222 18329
7144 1 8 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.391 0.239 18329
7145 1 8 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.574 -1.574 18329
7146 1 8 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.356 -0.056 18329
7147 1 8 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.241 0.199 18329
7148 1 8 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.436 -0.536 18329
7149 1 8 . 1 1 124 124 PRO CB C 147 28.400 28.400 30.558 -2.158 18329
7150 1 8 . 1 1 125 125 THR N N 148 106.090 106.090 110.856 -4.766 18329
7151 1 8 . 1 1 125 125 THR HA H 148 4.530 4.530 4.206 0.324 18329
7152 1 8 . 1 1 125 125 THR C C 148 174.300 174.300 174.097 0.203 18329
7153 1 8 . 1 1 125 125 THR CA C 148 61.200 61.200 62.847 -1.647 18329
7154 1 8 . 1 1 125 125 THR CB C 148 68.600 68.600 68.670 -0.070 18329
7155 1 8 . 1 1 125 125 THR H H 148 7.800 7.800 8.279 -0.479 18329
7156 1 8 . 1 1 126 126 THR N N 149 108.650 108.650 112.656 -4.006 18329
7157 1 8 . 1 1 126 126 THR HA H 149 4.170 4.170 4.549 -0.379 18329
7158 1 8 . 1 1 126 126 THR C C 149 173.100 173.100 173.490 -0.390 18329
7159 1 8 . 1 1 126 126 THR CA C 149 58.800 58.800 60.292 -1.492 18329
7160 1 8 . 1 1 126 126 THR CB C 149 73.100 73.100 71.193 1.907 18329
7161 1 8 . 1 1 126 126 THR H H 149 7.350 7.350 7.015 0.335 18329
7162 1 8 . 1 1 127 127 ALA N N 150 123.270 123.270 126.793 -3.523 18329
7163 1 8 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.843 -0.823 18329
7164 1 8 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.177 -0.177 18329
7165 1 8 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.971 -0.271 18329
7166 1 8 . 1 1 127 127 ALA H H 150 7.750 7.750 9.089 -1.339 18329
7167 1 8 . 1 1 128 128 GLN N N 151 114.920 114.920 118.262 -3.342 18329
7168 1 8 . 1 1 128 128 GLN HA H 151 3.750 3.750 3.972 -0.222 18329
7169 1 8 . 1 1 128 128 GLN C C 151 178.400 178.400 178.550 -0.150 18329
7170 1 8 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.571 0.229 18329
7171 1 8 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.567 -1.367 18329
7172 1 8 . 1 1 128 128 GLN H H 151 8.300 8.300 7.838 0.462 18329
7173 1 8 . 1 1 129 129 GLY N N 152 107.280 107.280 107.816 -0.536 18329
7174 1 8 . 1 1 129 129 GLY C C 152 174.900 174.900 176.129 -1.229 18329
7175 1 8 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.629 0.571 18329
7176 1 8 . 1 1 129 129 GLY H H 152 7.920 7.920 8.014 -0.094 18329
7177 1 8 . 1 1 130 130 VAL N N 153 119.440 119.440 123.331 -3.891 18329
7178 1 8 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.602 -0.132 18329
7179 1 8 . 1 1 130 130 VAL C C 153 177.700 177.700 177.819 -0.119 18329
7180 1 8 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.679 2.121 18329
7181 1 8 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.531 0.169 18329
7182 1 8 . 1 1 130 130 VAL H H 153 7.390 7.390 7.353 0.037 18329
7183 1 8 . 1 1 131 131 LEU N N 154 118.990 118.990 118.351 0.639 18329
7184 1 8 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.855 0.055 18329
7185 1 8 . 1 1 131 131 LEU C C 154 180.400 180.400 178.778 1.622 18329
7186 1 8 . 1 1 131 131 LEU CA C 154 58.300 58.300 57.448 0.852 18329
7187 1 8 . 1 1 131 131 LEU CB C 154 41.000 41.000 40.820 0.180 18329
7188 1 8 . 1 1 131 131 LEU H H 154 8.640 8.640 7.672 0.968 18329
7189 1 8 . 1 1 132 132 GLU N N 155 120.980 120.980 118.438 2.542 18329
7190 1 8 . 1 1 132 132 GLU HA H 155 4.120 4.120 4.076 0.044 18329
7191 1 8 . 1 1 132 132 GLU C C 155 179.400 179.400 178.991 0.409 18329
7192 1 8 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.027 -0.127 18329
7193 1 8 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.186 0.014 18329
7194 1 8 . 1 1 132 132 GLU H H 155 8.000 8.000 8.291 -0.291 18329
7195 1 8 . 1 1 133 133 ILE N N 156 121.830 121.830 119.913 1.917 18329
7196 1 8 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.838 -0.258 18329
7197 1 8 . 1 1 133 133 ILE C C 156 178.000 178.000 177.995 0.005 18329
7198 1 8 . 1 1 133 133 ILE CA C 156 65.500 65.500 61.537 3.963 18329
7199 1 8 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.464 3.136 18329
7200 1 8 . 1 1 133 133 ILE H H 156 8.040 8.040 7.946 0.094 18329
7201 1 8 . 1 1 134 134 ALA N N 157 121.470 121.470 123.451 -1.981 18329
7202 1 8 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.881 0.019 18329
7203 1 8 . 1 1 134 134 ALA C C 157 178.800 178.800 179.520 -0.720 18329
7204 1 8 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.236 0.064 18329
7205 1 8 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.069 0.031 18329
7206 1 8 . 1 1 134 134 ALA H H 157 8.950 8.950 7.903 1.047 18329
7207 1 8 . 1 1 135 135 LYS N N 158 118.470 118.470 118.639 -0.169 18329
7208 1 8 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.874 0.036 18329
7209 1 8 . 1 1 135 135 LYS C C 158 179.300 179.300 179.190 0.110 18329
7210 1 8 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.760 -0.260 18329
7211 1 8 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.161 -0.761 18329
7212 1 8 . 1 1 135 135 LYS H H 158 8.000 8.000 7.582 0.418 18329
7213 1 8 . 1 1 136 136 LYS N N 159 118.000 118.000 118.287 -0.287 18329
7214 1 8 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.076 -0.026 18329
7215 1 8 . 1 1 136 136 LYS C C 159 180.200 180.200 179.602 0.598 18329
7216 1 8 . 1 1 136 136 LYS CA C 159 59.500 59.500 58.649 0.851 18329
7217 1 8 . 1 1 136 136 LYS CB C 159 30.900 30.900 31.893 -0.993 18329
7218 1 8 . 1 1 136 136 LYS H H 159 7.530 7.530 7.489 0.041 18329
7219 1 8 . 1 1 137 137 MET N N 160 120.990 120.990 119.529 1.461 18329
7220 1 8 . 1 1 137 137 MET HA H 160 3.800 3.800 4.051 -0.251 18329
7221 1 8 . 1 1 137 137 MET C C 160 177.400 177.400 178.434 -1.034 18329
7222 1 8 . 1 1 137 137 MET CA C 160 60.600 60.600 59.833 0.767 18329
7223 1 8 . 1 1 137 137 MET CB C 160 31.800 31.800 32.693 -0.893 18329
7224 1 8 . 1 1 137 137 MET H H 160 8.660 8.660 8.188 0.472 18329
7225 1 8 . 1 1 138 138 ARG N N 161 119.480 119.480 119.099 0.381 18329
7226 1 8 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.897 -0.097 18329
7227 1 8 . 1 1 138 138 ARG C C 161 177.900 177.900 178.357 -0.457 18329
7228 1 8 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.629 0.971 18329
7229 1 8 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.316 -0.516 18329
7230 1 8 . 1 1 138 138 ARG H H 161 9.280 9.280 8.577 0.703 18329
7231 1 8 . 1 1 139 139 GLU N N 162 118.700 118.700 119.128 -0.428 18329
7232 1 8 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.028 -0.028 18329
7233 1 8 . 1 1 139 139 GLU C C 162 179.100 179.100 178.448 0.652 18329
7234 1 8 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.229 0.571 18329
7235 1 8 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.556 -0.056 18329
7236 1 8 . 1 1 139 139 GLU H H 162 8.430 8.430 8.797 -0.367 18329
7237 1 8 . 1 1 140 140 LYS N N 163 119.310 119.310 120.221 -0.911 18329
7238 1 8 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.095 0.115 18329
7239 1 8 . 1 1 140 140 LYS C C 163 177.900 177.900 178.984 -1.084 18329
7240 1 8 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.495 0.405 18329
7241 1 8 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.077 -0.977 18329
7242 1 8 . 1 1 140 140 LYS H H 163 7.440 7.440 7.586 -0.146 18329
7243 1 8 . 1 1 141 141 LEU N N 164 117.630 117.630 119.679 -2.049 18329
7244 1 8 . 1 1 141 141 LEU HA H 164 3.890 3.890 3.915 -0.025 18329
7245 1 8 . 1 1 141 141 LEU C C 164 178.700 178.700 178.774 -0.074 18329
7246 1 8 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.852 0.148 18329
7247 1 8 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.710 -0.210 18329
7248 1 8 . 1 1 141 141 LEU H H 164 8.180 8.180 7.720 0.460 18329
7249 1 8 . 1 1 142 142 GLN N N 165 117.710 117.710 118.746 -1.036 18329
7250 1 8 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.888 0.422 18329
7251 1 8 . 1 1 142 142 GLN C C 165 179.200 179.200 178.212 0.988 18329
7252 1 8 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.533 -1.033 18329
7253 1 8 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.535 -1.035 18329
7254 1 8 . 1 1 142 142 GLN H H 165 8.730 8.730 8.033 0.697 18329
7255 1 8 . 1 1 143 143 ARG N N 166 121.410 121.410 118.973 2.437 18329
7256 1 8 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.008 0.182 18329
7257 1 8 . 1 1 143 143 ARG C C 166 179.700 179.700 179.007 0.693 18329
7258 1 8 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.355 0.445 18329
7259 1 8 . 1 1 143 143 ARG CB C 166 30.200 30.200 30.127 0.073 18329
7260 1 8 . 1 1 143 143 ARG H H 166 8.050 8.050 7.671 0.379 18329
7261 1 8 . 1 1 144 144 VAL N N 167 120.950 120.950 120.784 0.166 18329
7262 1 8 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.616 0.144 18329
7263 1 8 . 1 1 144 144 VAL C C 167 179.200 179.200 177.928 1.272 18329
7264 1 8 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.852 -0.452 18329
7265 1 8 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.628 0.472 18329
7266 1 8 . 1 1 144 144 VAL H H 167 8.190 8.190 7.621 0.569 18329
7267 1 8 . 1 1 145 145 HIS N N 168 123.520 123.520 118.206 5.314 18329
7268 1 8 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.410 -0.510 18329
7269 1 8 . 1 1 145 145 HIS C C 168 177.100 177.100 177.650 -0.550 18329
7270 1 8 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.347 1.953 18329
7271 1 8 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.384 -0.484 18329
7272 1 8 . 1 1 145 145 HIS H H 168 9.240 9.240 8.106 1.134 18329
7273 1 8 . 1 1 146 146 THR N N 169 115.020 115.020 117.638 -2.618 18329
7274 1 8 . 1 1 146 146 THR HA H 169 3.860 3.860 4.172 -0.312 18329
7275 1 8 . 1 1 146 146 THR C C 169 175.700 175.700 176.097 -0.397 18329
7276 1 8 . 1 1 146 146 THR CA C 169 67.200 67.200 67.097 0.103 18329
7277 1 8 . 1 1 146 146 THR CB C 169 69.300 69.300 68.914 0.386 18329
7278 1 8 . 1 1 146 146 THR H H 169 8.750 8.750 8.738 0.012 18329
7279 1 8 . 1 1 147 147 LYS N N 170 120.300 120.300 121.215 -0.915 18329
7280 1 8 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.988 0.012 18329
7281 1 8 . 1 1 147 147 LYS C C 170 179.300 179.300 178.640 0.660 18329
7282 1 8 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.683 -0.583 18329
7283 1 8 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.491 -0.691 18329
7284 1 8 . 1 1 147 147 LYS H H 170 8.020 8.020 8.240 -0.220 18329
7285 1 8 . 1 1 148 148 ASN N N 171 117.600 117.600 116.781 0.819 18329
7286 1 8 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.468 -0.148 18329
7287 1 8 . 1 1 148 148 ASN C C 171 175.400 175.400 177.389 -1.989 18329
7288 1 8 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.909 1.791 18329
7289 1 8 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.698 1.002 18329
7290 1 8 . 1 1 148 148 ASN H H 171 7.810 7.810 7.655 0.155 18329
7291 1 8 . 1 1 149 149 TYR N N 172 121.560 121.560 120.525 1.035 18329
7292 1 8 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.273 -0.383 18329
7293 1 8 . 1 1 149 149 TYR C C 172 176.900 176.900 177.533 -0.633 18329
7294 1 8 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.700 -0.200 18329
7295 1 8 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.787 0.133 18329
7296 1 8 . 1 1 149 149 TYR H H 172 9.020 9.020 7.705 1.315 18329
7297 1 8 . 1 1 150 150 CYS N N 173 116.050 116.050 116.555 -0.505 18329
7298 1 8 . 1 1 150 150 CYS C C 173 177.100 177.100 176.449 0.651 18329
7299 1 8 . 1 1 150 150 CYS CA C 173 58.400 58.400 60.400 -2.000 18329
7300 1 8 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.343 12.258 18329
7301 1 8 . 1 1 150 150 CYS H H 173 8.810 8.810 7.810 1.000 18329
7302 1 8 . 1 1 151 151 THR N N 174 117.190 117.190 115.018 2.172 18329
7303 1 8 . 1 1 151 151 THR HA H 174 3.880 3.880 4.060 -0.180 18329
7304 1 8 . 1 1 151 151 THR C C 174 176.000 176.000 176.573 -0.573 18329
7305 1 8 . 1 1 151 151 THR CA C 174 66.900 66.900 65.286 1.614 18329
7306 1 8 . 1 1 151 151 THR CB C 174 68.500 68.500 68.276 0.224 18329
7307 1 8 . 1 1 151 151 THR H H 174 7.720 7.720 7.622 0.098 18329
7308 1 8 . 1 1 152 152 LEU N N 175 123.110 123.110 121.738 1.372 18329
7309 1 8 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.006 -0.196 18329
7310 1 8 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.498 0.501 18329
7311 1 8 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.249 0.251 18329
7312 1 8 . 1 1 152 152 LEU H H 175 7.870 7.870 7.477 0.393 18329
7313 1 8 . 1 1 153 153 LYS N N 176 117.270 117.270 116.850 0.420 18329
7314 1 8 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.945 -0.245 18329
7315 1 8 . 1 1 153 153 LYS C C 176 179.100 179.100 177.916 1.184 18329
7316 1 8 . 1 1 153 153 LYS CA C 176 56.700 56.700 57.587 -0.887 18329
7317 1 8 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.222 -1.322 18329
7318 1 8 . 1 1 153 153 LYS H H 176 7.900 7.900 7.590 0.309 18329
7319 1 8 . 1 1 154 154 LYS N N 177 119.290 119.290 119.979 -0.689 18329
7320 1 8 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.006 0.254 18329
7321 1 8 . 1 1 154 154 LYS C C 177 178.100 178.100 177.908 0.192 18329
7322 1 8 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.250 -1.450 18329
7323 1 8 . 1 1 154 154 LYS CB C 177 31.800 31.800 32.243 -0.443 18329
7324 1 8 . 1 1 154 154 LYS H H 177 7.540 7.540 7.643 -0.103 18329
7325 1 8 . 1 1 155 155 LYS N N 178 118.910 118.910 116.508 2.402 18329
7326 1 8 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.091 -0.041 18329
7327 1 8 . 1 1 155 155 LYS C C 178 178.100 178.100 178.572 -0.472 18329
7328 1 8 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.844 -0.845 18329
7329 1 8 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.315 -0.115 18329
7330 1 8 . 1 1 155 155 LYS H H 178 7.630 7.630 7.645 -0.015 18329
7331 1 8 . 1 1 156 156 GLU N N 179 117.950 117.950 118.344 -0.394 18329
7332 1 8 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.138 -0.028 18329
7333 1 8 . 1 1 156 156 GLU C C 179 176.700 176.700 177.458 -0.758 18329
7334 1 8 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.647 -1.147 18329
7335 1 8 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.777 -0.177 18329
7336 1 8 . 1 1 156 156 GLU H H 179 7.560 7.560 8.057 -0.497 18329
7337 1 8 . 1 1 157 157 ASN N N 180 116.590 116.590 115.180 1.410 18329
7338 1 8 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.776 -0.056 18329
7339 1 8 . 1 1 157 157 ASN C C 180 175.000 175.000 175.659 -0.659 18329
7340 1 8 . 1 1 157 157 ASN CA C 180 52.700 52.700 54.190 -1.490 18329
7341 1 8 . 1 1 157 157 ASN CB C 180 38.800 38.800 39.498 -0.699 18329
7342 1 8 . 1 1 157 157 ASN H H 180 7.820 7.820 7.877 -0.057 18329
7343 1 8 . 1 1 158 158 SER HA H 181 4.450 4.450 4.440 0.010 18329
7344 1 8 . 1 1 158 158 SER CA C 181 60.400 60.400 58.958 1.442 18329
7345 1 8 . 1 1 158 158 SER CB C 181 63.500 63.500 63.728 -0.228 18329
7346 1 8 . 1 1 158 158 SER H H 181 8.030 8.030 8.248 -0.218 18329
7347 1 8 . 1 1 159 159 THR N N 182 112.800 112.800 116.565 -3.765 18329
7348 1 8 . 1 1 159 159 THR HA H 182 4.380 4.380 4.628 -0.248 18329
7349 1 8 . 1 1 159 159 THR C C 182 174.300 174.300 173.028 1.272 18329
7350 1 8 . 1 1 159 159 THR CA C 182 61.800 61.800 62.720 -0.920 18329
7351 1 8 . 1 1 159 159 THR CB C 182 69.100 69.100 69.515 -0.415 18329
7352 1 8 . 1 1 159 159 THR H H 182 8.070 8.070 7.841 0.229 18329
7353 1 8 . 1 1 160 160 PHE N N 183 123.120 123.120 125.070 -1.950 18329
7354 1 8 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.942 -0.502 18329
7355 1 8 . 1 1 160 160 PHE C C 183 175.100 175.100 174.948 0.152 18329
7356 1 8 . 1 1 160 160 PHE CA C 183 58.900 58.900 57.381 1.519 18329
7357 1 8 . 1 1 160 160 PHE CB C 183 40.000 40.000 41.479 -1.479 18329
7358 1 8 . 1 1 160 160 PHE H H 183 7.900 7.900 8.098 -0.198 18329
7359 1 8 . 1 1 161 161 THR N N 184 119.330 119.330 115.558 3.772 18329
7360 1 8 . 1 1 161 161 THR HA H 184 4.190 4.190 4.540 -0.350 18329
7361 1 8 . 1 1 161 161 THR CA C 184 60.700 60.700 62.031 -1.331 18329
7362 1 8 . 1 1 161 161 THR CB C 184 70.700 70.700 69.331 1.369 18329
7363 1 8 . 1 1 161 161 THR H H 184 7.810 7.810 8.281 -0.471 18329
7364 1 8 . 1 1 162 162 ASP N N 185 123.190 123.190 119.274 3.916 18329
7365 1 8 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.759 -0.349 18329
7366 1 8 . 1 1 162 162 ASP C C 185 176.900 176.900 175.132 1.768 18329
7367 1 8 . 1 1 162 162 ASP CA C 185 53.900 53.900 53.715 0.185 18329
7368 1 8 . 1 1 162 162 ASP CB C 185 44.000 44.000 41.001 2.999 18329
7369 1 8 . 1 1 162 162 ASP H H 185 8.000 8.000 8.302 -0.302 18329
7370 1 8 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.476 0.004 18329
7371 1 8 . 1 1 163 163 GLU CA C 186 58.800 58.800 55.536 3.264 18329
7372 1 8 . 1 1 163 163 GLU CB C 186 28.100 28.100 31.034 -2.934 18329
7373 1 8 . 1 1 166 166 LYS N N 189 118.150 118.150 118.435 -0.285 18329
7374 1 8 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.175 0.045 18329
7375 1 8 . 1 1 166 166 LYS C C 189 177.500 177.500 177.168 0.332 18329
7376 1 8 . 1 1 166 166 LYS CA C 189 58.000 58.000 57.454 0.546 18329
7377 1 8 . 1 1 166 166 LYS CB C 189 32.600 32.600 31.817 0.783 18329
7378 1 8 . 1 1 166 166 LYS H H 189 8.890 8.890 8.012 0.878 18329
7379 1 8 . 1 1 167 167 ASN N N 190 116.210 116.210 119.938 -3.728 18329
7380 1 8 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.535 0.425 18329
7381 1 8 . 1 1 167 167 ASN C C 190 174.900 174.900 174.929 -0.029 18329
7382 1 8 . 1 1 167 167 ASN CA C 190 52.900 52.900 53.344 -0.444 18329
7383 1 8 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.047 0.353 18329
7384 1 8 . 1 1 167 167 ASN H H 190 8.030 8.030 8.173 -0.143 18329
7385 1 9 . 1 1 2 2 ALA N N 25 125.000 125.000 127.974 -2.974 18329
7386 1 9 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.061 0.309 18329
7387 1 9 . 1 1 2 2 ALA CA C 25 52.300 52.300 53.751 -1.451 18329
7388 1 9 . 1 1 2 2 ALA CB C 25 19.700 19.700 18.423 1.277 18329
7389 1 9 . 1 1 2 2 ALA H H 25 8.690 8.690 8.489 0.201 18329
7390 1 9 . 1 1 3 3 GLY N N 26 106.920 106.920 107.077 -0.157 18329
7391 1 9 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.014 -1.014 18329
7392 1 9 . 1 1 3 3 GLY H H 26 7.940 7.940 8.567 -0.627 18329
7393 1 9 . 1 1 4 4 LEU N N 27 119.140 119.140 122.371 -3.231 18329
7394 1 9 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.515 -0.105 18329
7395 1 9 . 1 1 4 4 LEU C C 27 177.100 177.100 177.140 -0.040 18329
7396 1 9 . 1 1 4 4 LEU CA C 27 54.400 54.400 53.827 0.573 18329
7397 1 9 . 1 1 4 4 LEU CB C 27 42.100 42.100 42.697 -0.597 18329
7398 1 9 . 1 1 4 4 LEU H H 27 8.210 8.210 7.703 0.507 18329
7399 1 9 . 1 1 5 5 THR N N 28 112.940 112.940 117.235 -4.295 18329
7400 1 9 . 1 1 5 5 THR HA H 28 4.650 4.650 4.236 0.414 18329
7401 1 9 . 1 1 5 5 THR C C 28 175.500 175.500 175.116 0.384 18329
7402 1 9 . 1 1 5 5 THR CA C 28 60.100 60.100 62.495 -2.396 18329
7403 1 9 . 1 1 5 5 THR CB C 28 72.600 72.600 68.566 4.034 18329
7404 1 9 . 1 1 5 5 THR H H 28 9.220 9.220 8.478 0.742 18329
7405 1 9 . 1 1 6 6 GLY N N 29 108.230 108.230 114.154 -5.924 18329
7406 1 9 . 1 1 6 6 GLY C C 29 174.800 174.800 173.895 0.905 18329
7407 1 9 . 1 1 6 6 GLY CA C 29 46.000 46.000 45.869 0.131 18329
7408 1 9 . 1 1 6 6 GLY H H 29 8.520 8.520 8.160 0.360 18329
7409 1 9 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.263 -0.223 18329
7410 1 9 . 1 1 7 7 ALA CA C 30 54.800 54.800 52.460 2.340 18329
7411 1 9 . 1 1 7 7 ALA CB C 30 18.200 18.200 19.107 -0.907 18329
7412 1 9 . 1 1 8 8 THR N N 31 116.970 116.970 118.141 -1.171 18329
7413 1 9 . 1 1 8 8 THR HA H 31 3.740 3.740 3.824 -0.084 18329
7414 1 9 . 1 1 8 8 THR C C 31 175.300 175.300 176.105 -0.805 18329
7415 1 9 . 1 1 8 8 THR CA C 31 67.000 67.000 67.540 -0.540 18329
7416 1 9 . 1 1 8 8 THR CB C 31 68.700 68.700 68.616 0.084 18329
7417 1 9 . 1 1 8 8 THR H H 31 8.110 8.110 7.997 0.113 18329
7418 1 9 . 1 1 9 9 LYS N N 32 120.540 120.540 120.091 0.449 18329
7419 1 9 . 1 1 9 9 LYS HA H 32 3.590 3.590 3.993 -0.403 18329
7420 1 9 . 1 1 9 9 LYS C C 32 176.900 176.900 178.167 -1.267 18329
7421 1 9 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.158 0.642 18329
7422 1 9 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.459 0.941 18329
7423 1 9 . 1 1 9 9 LYS H H 32 6.860 6.860 8.101 -1.241 18329
7424 1 9 . 1 1 10 10 ILE N N 33 115.940 115.940 120.451 -4.511 18329
7425 1 9 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.771 -0.061 18329
7426 1 9 . 1 1 10 10 ILE C C 33 179.000 179.000 178.190 0.810 18329
7427 1 9 . 1 1 10 10 ILE CA C 33 64.000 64.000 65.314 -1.314 18329
7428 1 9 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.740 0.260 18329
7429 1 9 . 1 1 10 10 ILE H H 33 7.380 7.380 8.779 -1.399 18329
7430 1 9 . 1 1 11 11 ARG N N 34 118.350 118.350 119.917 -1.567 18329
7431 1 9 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.059 -0.019 18329
7432 1 9 . 1 1 11 11 ARG C C 34 180.000 180.000 178.562 1.438 18329
7433 1 9 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.038 0.362 18329
7434 1 9 . 1 1 11 11 ARG CB C 34 30.300 30.300 29.623 0.677 18329
7435 1 9 . 1 1 11 11 ARG H H 34 8.250 8.250 7.556 0.694 18329
7436 1 9 . 1 1 12 12 LEU N N 35 117.420 117.420 120.094 -2.674 18329
7437 1 9 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.056 0.114 18329
7438 1 9 . 1 1 12 12 LEU C C 35 179.000 179.000 179.086 -0.086 18329
7439 1 9 . 1 1 12 12 LEU CA C 35 58.000 58.000 58.803 -0.803 18329
7440 1 9 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.558 -0.758 18329
7441 1 9 . 1 1 12 12 LEU H H 35 8.340 8.340 7.728 0.612 18329
7442 1 9 . 1 1 13 13 GLU N N 36 117.890 117.890 119.761 -1.871 18329
7443 1 9 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.941 0.079 18329
7444 1 9 . 1 1 13 13 GLU C C 36 180.100 180.100 179.143 0.957 18329
7445 1 9 . 1 1 13 13 GLU CA C 36 60.200 60.200 60.048 0.152 18329
7446 1 9 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.568 -1.268 18329
7447 1 9 . 1 1 13 13 GLU H H 36 8.610 8.610 8.888 -0.278 18329
7448 1 9 . 1 1 14 14 ARG N N 37 121.100 121.100 118.131 2.969 18329
7449 1 9 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.114 0.126 18329
7450 1 9 . 1 1 14 14 ARG C C 37 178.100 178.100 179.146 -1.046 18329
7451 1 9 . 1 1 14 14 ARG CA C 37 58.500 58.500 58.617 -0.117 18329
7452 1 9 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.015 0.185 18329
7453 1 9 . 1 1 14 14 ARG H H 37 7.980 7.980 8.308 -0.328 18329
7454 1 9 . 1 1 15 15 SER N N 38 115.420 115.420 116.235 -0.815 18329
7455 1 9 . 1 1 15 15 SER HA H 38 4.380 4.380 4.565 -0.185 18329
7456 1 9 . 1 1 15 15 SER C C 38 177.300 177.300 176.378 0.922 18329
7457 1 9 . 1 1 15 15 SER CA C 38 62.200 62.200 61.357 0.843 18329
7458 1 9 . 1 1 15 15 SER CB C 38 63.200 63.200 63.086 0.114 18329
7459 1 9 . 1 1 15 15 SER H H 38 8.230 8.230 8.763 -0.533 18329
7460 1 9 . 1 1 16 16 ALA N N 39 123.970 123.970 124.222 -0.252 18329
7461 1 9 . 1 1 16 16 ALA HA H 39 3.630 3.630 3.890 -0.260 18329
7462 1 9 . 1 1 16 16 ALA C C 39 179.500 179.500 179.781 -0.281 18329
7463 1 9 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.841 -0.141 18329
7464 1 9 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.282 -0.281 18329
7465 1 9 . 1 1 16 16 ALA H H 39 8.280 8.280 8.657 -0.377 18329
7466 1 9 . 1 1 17 17 LYS N N 40 121.690 121.690 119.292 2.398 18329
7467 1 9 . 1 1 17 17 LYS HA H 40 4.090 4.090 3.927 0.163 18329
7468 1 9 . 1 1 17 17 LYS C C 40 178.000 178.000 178.424 -0.424 18329
7469 1 9 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.776 -1.377 18329
7470 1 9 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.106 -0.306 18329
7471 1 9 . 1 1 17 17 LYS H H 40 7.930 7.930 7.855 0.075 18329
7472 1 9 . 1 1 18 18 ASP N N 41 118.730 118.730 119.144 -0.414 18329
7473 1 9 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.384 -0.024 18329
7474 1 9 . 1 1 18 18 ASP C C 41 179.900 179.900 178.783 1.117 18329
7475 1 9 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.907 0.792 18329
7476 1 9 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.109 -0.509 18329
7477 1 9 . 1 1 18 18 ASP H H 41 8.320 8.320 7.811 0.509 18329
7478 1 9 . 1 1 19 19 ILE N N 42 118.180 118.180 119.775 -1.595 18329
7479 1 9 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.728 -0.038 18329
7480 1 9 . 1 1 19 19 ILE C C 42 177.400 177.400 177.656 -0.256 18329
7481 1 9 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.554 -0.354 18329
7482 1 9 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.540 0.360 18329
7483 1 9 . 1 1 19 19 ILE H H 42 7.420 7.420 8.087 -0.667 18329
7484 1 9 . 1 1 20 20 THR N N 43 113.360 113.360 112.146 1.214 18329
7485 1 9 . 1 1 20 20 THR HA H 43 3.770 3.770 4.010 -0.240 18329
7486 1 9 . 1 1 20 20 THR C C 43 177.800 177.800 176.531 1.269 18329
7487 1 9 . 1 1 20 20 THR CA C 43 66.400 66.400 65.219 1.181 18329
7488 1 9 . 1 1 20 20 THR CB C 43 67.400 67.400 68.076 -0.676 18329
7489 1 9 . 1 1 20 20 THR H H 43 7.610 7.610 7.446 0.164 18329
7490 1 9 . 1 1 21 21 ASP N N 44 123.650 123.650 122.221 1.429 18329
7491 1 9 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.372 0.038 18329
7492 1 9 . 1 1 21 21 ASP C C 44 179.200 179.200 178.109 1.091 18329
7493 1 9 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.547 -0.347 18329
7494 1 9 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.615 -1.015 18329
7495 1 9 . 1 1 21 21 ASP H H 44 9.260 9.260 8.666 0.594 18329
7496 1 9 . 1 1 22 22 GLU N N 45 123.560 123.560 118.611 4.949 18329
7497 1 9 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.119 0.251 18329
7498 1 9 . 1 1 22 22 GLU C C 45 178.500 178.500 179.321 -0.821 18329
7499 1 9 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.873 -0.673 18329
7500 1 9 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.717 -0.517 18329
7501 1 9 . 1 1 22 22 GLU H H 45 7.750 7.750 7.682 0.068 18329
7502 1 9 . 1 1 23 23 ILE N N 46 119.940 119.940 115.346 4.594 18329
7503 1 9 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.780 -0.160 18329
7504 1 9 . 1 1 23 23 ILE C C 46 177.600 177.600 177.563 0.037 18329
7505 1 9 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.237 1.363 18329
7506 1 9 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.465 -0.465 18329
7507 1 9 . 1 1 23 23 ILE H H 46 8.360 8.360 7.214 1.146 18329
7508 1 9 . 1 1 24 24 ASP N N 47 120.730 120.730 121.576 -0.846 18329
7509 1 9 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.327 0.073 18329
7510 1 9 . 1 1 24 24 ASP C C 47 178.900 178.900 178.214 0.686 18329
7511 1 9 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.451 0.049 18329
7512 1 9 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.048 -0.148 18329
7513 1 9 . 1 1 24 24 ASP H H 47 8.280 8.280 8.244 0.036 18329
7514 1 9 . 1 1 25 25 ALA N N 48 123.870 123.870 121.195 2.675 18329
7515 1 9 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.025 0.095 18329
7516 1 9 . 1 1 25 25 ALA C C 48 180.400 180.400 179.242 1.158 18329
7517 1 9 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.895 0.605 18329
7518 1 9 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.370 -0.570 18329
7519 1 9 . 1 1 25 25 ALA H H 48 7.880 7.880 7.485 0.395 18329
7520 1 9 . 1 1 26 26 ILE N N 49 121.970 121.970 117.744 4.226 18329
7521 1 9 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.713 0.017 18329
7522 1 9 . 1 1 26 26 ILE C C 49 178.400 178.400 177.859 0.541 18329
7523 1 9 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.943 0.957 18329
7524 1 9 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.686 -0.186 18329
7525 1 9 . 1 1 26 26 ILE H H 49 8.710 8.710 7.518 1.192 18329
7526 1 9 . 1 1 27 27 LYS N N 50 119.820 119.820 120.110 -0.290 18329
7527 1 9 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.367 0.513 18329
7528 1 9 . 1 1 27 27 LYS C C 50 179.900 179.900 178.985 0.915 18329
7529 1 9 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.491 0.909 18329
7530 1 9 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.828 0.072 18329
7531 1 9 . 1 1 27 27 LYS H H 50 8.540 8.540 7.630 0.910 18329
7532 1 9 . 1 1 28 28 LYS N N 51 121.960 121.960 118.747 3.213 18329
7533 1 9 . 1 1 28 28 LYS HA H 51 4.090 4.090 3.953 0.137 18329
7534 1 9 . 1 1 28 28 LYS C C 51 179.200 179.200 179.090 0.110 18329
7535 1 9 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.249 0.051 18329
7536 1 9 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.311 -0.911 18329
7537 1 9 . 1 1 28 28 LYS H H 51 8.070 8.070 7.561 0.509 18329
7538 1 9 . 1 1 29 29 ASP N N 52 121.710 121.710 119.774 1.936 18329
7539 1 9 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.430 0.040 18329
7540 1 9 . 1 1 29 29 ASP C C 52 178.500 178.500 178.778 -0.278 18329
7541 1 9 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.791 0.209 18329
7542 1 9 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.394 0.606 18329
7543 1 9 . 1 1 29 29 ASP H H 52 8.340 8.340 7.899 0.441 18329
7544 1 9 . 1 1 30 30 ALA N N 53 121.990 121.990 121.799 0.191 18329
7545 1 9 . 1 1 30 30 ALA HA H 53 3.340 3.340 3.793 -0.453 18329
7546 1 9 . 1 1 30 30 ALA C C 53 179.500 179.500 179.363 0.137 18329
7547 1 9 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.710 0.390 18329
7548 1 9 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.080 0.020 18329
7549 1 9 . 1 1 30 30 ALA H H 53 8.800 8.800 8.359 0.441 18329
7550 1 9 . 1 1 31 31 ALA N N 54 119.970 119.970 120.229 -0.259 18329
7551 1 9 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.062 0.088 18329
7552 1 9 . 1 1 31 31 ALA C C 54 181.600 181.600 178.720 2.880 18329
7553 1 9 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.086 0.614 18329
7554 1 9 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.159 -0.359 18329
7555 1 9 . 1 1 31 31 ALA H H 54 7.730 7.730 7.242 0.488 18329
7556 1 9 . 1 1 32 32 LEU N N 55 119.660 119.660 116.796 2.864 18329
7557 1 9 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.055 0.085 18329
7558 1 9 . 1 1 32 32 LEU C C 55 179.100 179.100 177.412 1.688 18329
7559 1 9 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.251 0.749 18329
7560 1 9 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.872 0.028 18329
7561 1 9 . 1 1 32 32 LEU H H 55 7.660 7.660 7.286 0.374 18329
7562 1 9 . 1 1 33 33 LYS N N 56 117.160 117.160 117.522 -0.362 18329
7563 1 9 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.423 -0.213 18329
7564 1 9 . 1 1 33 33 LYS C C 56 176.600 176.600 175.810 0.790 18329
7565 1 9 . 1 1 33 33 LYS CA C 56 56.100 56.100 54.817 1.283 18329
7566 1 9 . 1 1 33 33 LYS CB C 56 33.200 33.200 34.630 -1.430 18329
7567 1 9 . 1 1 33 33 LYS H H 56 7.610 7.610 7.323 0.287 18329
7568 1 9 . 1 1 34 34 GLY N N 57 108.680 108.680 111.077 -2.397 18329
7569 1 9 . 1 1 34 34 GLY C C 57 174.400 174.400 174.138 0.262 18329
7570 1 9 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.583 0.617 18329
7571 1 9 . 1 1 34 34 GLY H H 57 7.710 7.710 8.552 -0.842 18329
7572 1 9 . 1 1 35 35 VAL N N 58 121.000 121.000 120.997 0.003 18329
7573 1 9 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.428 -0.528 18329
7574 1 9 . 1 1 35 35 VAL C C 58 174.200 174.200 175.544 -1.344 18329
7575 1 9 . 1 1 35 35 VAL CA C 58 61.500 61.500 59.008 2.492 18329
7576 1 9 . 1 1 35 35 VAL CB C 58 32.800 32.800 35.218 -2.418 18329
7577 1 9 . 1 1 35 35 VAL H H 58 7.990 7.990 7.653 0.337 18329
7578 1 9 . 1 1 36 36 ASN N N 59 124.960 124.960 120.478 4.482 18329
7579 1 9 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.692 -0.022 18329
7580 1 9 . 1 1 36 36 ASN C C 59 175.700 175.700 174.555 1.145 18329
7581 1 9 . 1 1 36 36 ASN CA C 59 51.600 51.600 52.431 -0.831 18329
7582 1 9 . 1 1 36 36 ASN CB C 59 39.100 39.100 37.050 2.050 18329
7583 1 9 . 1 1 36 36 ASN H H 59 8.460 8.460 8.496 -0.036 18329
7584 1 9 . 1 1 37 37 PHE N N 60 124.460 124.460 122.172 2.288 18329
7585 1 9 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.138 0.002 18329
7586 1 9 . 1 1 37 37 PHE C C 60 177.000 177.000 175.360 1.640 18329
7587 1 9 . 1 1 37 37 PHE CA C 60 60.400 60.400 60.587 -0.187 18329
7588 1 9 . 1 1 37 37 PHE CB C 60 39.200 39.200 39.727 -0.527 18329
7589 1 9 . 1 1 37 37 PHE H H 60 8.780 8.780 7.939 0.841 18329
7590 1 9 . 1 1 38 38 ASP N N 61 119.270 119.270 117.730 1.540 18329
7591 1 9 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.743 -0.253 18329
7592 1 9 . 1 1 38 38 ASP C C 61 177.000 177.000 174.664 2.336 18329
7593 1 9 . 1 1 38 38 ASP CA C 61 55.500 55.500 53.278 2.222 18329
7594 1 9 . 1 1 38 38 ASP CB C 61 40.000 40.000 38.985 1.015 18329
7595 1 9 . 1 1 38 38 ASP H H 61 8.400 8.400 8.482 -0.082 18329
7596 1 9 . 1 1 39 39 ALA N N 62 122.020 122.020 122.640 -0.620 18329
7597 1 9 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.595 -0.395 18329
7598 1 9 . 1 1 39 39 ALA C C 62 178.300 178.300 176.924 1.376 18329
7599 1 9 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.138 0.762 18329
7600 1 9 . 1 1 39 39 ALA CB C 62 18.500 18.500 19.764 -1.264 18329
7601 1 9 . 1 1 39 39 ALA H H 62 7.740 7.740 7.232 0.508 18329
7602 1 9 . 1 1 40 40 PHE N N 63 116.940 116.940 117.852 -0.912 18329
7603 1 9 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.164 0.216 18329
7604 1 9 . 1 1 40 40 PHE C C 63 176.100 176.100 175.554 0.546 18329
7605 1 9 . 1 1 40 40 PHE CA C 63 58.300 58.300 57.907 0.393 18329
7606 1 9 . 1 1 40 40 PHE CB C 63 38.800 38.800 36.299 2.501 18329
7607 1 9 . 1 1 40 40 PHE H H 63 7.730 7.730 8.029 -0.299 18329
7608 1 9 . 1 1 41 41 LYS N N 64 119.840 119.840 120.062 -0.222 18329
7609 1 9 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.175 0.045 18329
7610 1 9 . 1 1 41 41 LYS C C 64 176.100 176.100 175.630 0.470 18329
7611 1 9 . 1 1 41 41 LYS CA C 64 56.600 56.600 57.481 -0.881 18329
7612 1 9 . 1 1 41 41 LYS CB C 64 32.900 32.900 32.480 0.420 18329
7613 1 9 . 1 1 41 41 LYS H H 64 7.650 7.650 8.236 -0.586 18329
7614 1 9 . 1 1 42 42 ASP N N 65 120.770 120.770 117.546 3.224 18329
7615 1 9 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.645 -0.075 18329
7616 1 9 . 1 1 42 42 ASP C C 65 176.100 176.100 174.469 1.631 18329
7617 1 9 . 1 1 42 42 ASP CA C 65 54.200 54.200 53.263 0.937 18329
7618 1 9 . 1 1 42 42 ASP CB C 65 40.900 40.900 42.752 -1.852 18329
7619 1 9 . 1 1 42 42 ASP H H 65 8.030 8.030 7.755 0.275 18329
7620 1 9 . 1 1 43 43 LYS N N 66 122.070 122.070 121.641 0.429 18329
7621 1 9 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.337 -0.057 18329
7622 1 9 . 1 1 43 43 LYS C C 66 176.800 176.800 176.225 0.575 18329
7623 1 9 . 1 1 43 43 LYS CA C 66 56.500 56.500 56.559 -0.059 18329
7624 1 9 . 1 1 43 43 LYS CB C 66 32.800 32.800 32.948 -0.148 18329
7625 1 9 . 1 1 43 43 LYS H H 66 8.180 8.180 8.366 -0.186 18329
7626 1 9 . 1 1 44 44 LYS N N 67 122.170 122.170 123.214 -1.044 18329
7627 1 9 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.494 -0.144 18329
7628 1 9 . 1 1 44 44 LYS C C 67 177.000 177.000 176.954 0.046 18329
7629 1 9 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.158 0.442 18329
7630 1 9 . 1 1 44 44 LYS CB C 67 32.800 32.800 33.071 -0.271 18329
7631 1 9 . 1 1 44 44 LYS H H 67 8.460 8.460 8.576 -0.116 18329
7632 1 9 . 1 1 45 45 THR N N 68 114.390 114.390 112.695 1.695 18329
7633 1 9 . 1 1 45 45 THR HA H 68 4.330 4.330 4.054 0.276 18329
7634 1 9 . 1 1 45 45 THR C C 68 175.200 175.200 174.153 1.047 18329
7635 1 9 . 1 1 45 45 THR CA C 68 62.000 62.000 63.313 -1.313 18329
7636 1 9 . 1 1 45 45 THR CB C 68 69.900 69.900 68.995 0.905 18329
7637 1 9 . 1 1 45 45 THR H H 68 8.120 8.120 8.396 -0.276 18329
7638 1 9 . 1 1 46 46 GLY N N 69 111.200 111.200 106.990 4.210 18329
7639 1 9 . 1 1 46 46 GLY CA C 69 45.200 45.200 44.735 0.465 18329
7640 1 9 . 1 1 46 46 GLY H H 69 8.450 8.450 7.549 0.901 18329
7641 1 9 . 1 1 47 47 SER CA C 70 58.400 58.400 58.668 -0.268 18329
7642 1 9 . 1 1 47 47 SER CB C 70 64.000 64.000 62.825 1.175 18329
7643 1 9 . 1 1 48 48 GLY N N 71 111.200 111.200 110.930 0.270 18329
7644 1 9 . 1 1 48 48 GLY CA C 71 45.000 45.000 45.651 -0.651 18329
7645 1 9 . 1 1 48 48 GLY H H 71 8.580 8.580 8.987 -0.407 18329
7646 1 9 . 1 1 49 49 VAL N N 72 118.910 118.910 116.406 2.504 18329
7647 1 9 . 1 1 49 49 VAL HA H 72 4.130 4.130 4.246 -0.116 18329
7648 1 9 . 1 1 49 49 VAL C C 72 176.100 176.100 176.255 -0.155 18329
7649 1 9 . 1 1 49 49 VAL CA C 72 62.100 62.100 61.908 0.192 18329
7650 1 9 . 1 1 49 49 VAL CB C 72 32.500 32.500 33.556 -1.056 18329
7651 1 9 . 1 1 49 49 VAL H H 72 7.860 7.860 7.255 0.605 18329
7652 1 9 . 1 1 50 50 SER N N 73 118.500 118.500 116.397 2.103 18329
7653 1 9 . 1 1 50 50 SER C C 73 176.100 176.100 175.306 0.794 18329
7654 1 9 . 1 1 50 50 SER CA C 73 58.300 58.300 60.720 -2.420 18329
7655 1 9 . 1 1 50 50 SER CB C 73 63.800 63.800 63.561 0.239 18329
7656 1 9 . 1 1 50 50 SER H H 73 8.300 8.300 7.915 0.385 18329
7657 1 9 . 1 1 51 51 GLU N N 74 122.560 122.560 118.973 3.587 18329
7658 1 9 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.458 -0.188 18329
7659 1 9 . 1 1 51 51 GLU CA C 74 55.700 55.700 55.615 0.085 18329
7660 1 9 . 1 1 51 51 GLU CB C 74 30.500 30.500 32.125 -1.625 18329
7661 1 9 . 1 1 51 51 GLU H H 74 8.360 8.360 7.801 0.559 18329
7662 1 9 . 1 1 52 52 ASN N N 75 122.830 122.830 118.341 4.489 18329
7663 1 9 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.995 -0.175 18329
7664 1 9 . 1 1 52 52 ASN C C 75 174.800 174.800 174.495 0.305 18329
7665 1 9 . 1 1 52 52 ASN CA C 75 51.400 51.400 51.555 -0.155 18329
7666 1 9 . 1 1 52 52 ASN CB C 75 39.200 39.200 38.276 0.924 18329
7667 1 9 . 1 1 52 52 ASN H H 75 8.450 8.450 8.403 0.047 18329
7668 1 9 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.485 -0.305 18329
7669 1 9 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.132 1.068 18329
7670 1 9 . 1 1 53 53 PRO CB C 76 32.000 32.000 32.080 -0.080 18329
7671 1 9 . 1 1 54 54 PHE N N 77 118.060 118.060 120.835 -2.775 18329
7672 1 9 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.298 -0.028 18329
7673 1 9 . 1 1 54 54 PHE C C 77 177.500 177.500 177.173 0.327 18329
7674 1 9 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.866 -0.366 18329
7675 1 9 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.337 0.063 18329
7676 1 9 . 1 1 54 54 PHE H H 77 8.430 8.430 8.134 0.296 18329
7677 1 9 . 1 1 55 55 ILE N N 78 119.350 119.350 118.369 0.981 18329
7678 1 9 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.912 -0.412 18329
7679 1 9 . 1 1 55 55 ILE C C 78 177.400 177.400 177.784 -0.384 18329
7680 1 9 . 1 1 55 55 ILE CA C 78 63.500 63.500 64.408 -0.908 18329
7681 1 9 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.710 -0.710 18329
7682 1 9 . 1 1 55 55 ILE H H 78 7.540 7.540 7.902 -0.362 18329
7683 1 9 . 1 1 56 56 LEU N N 79 118.450 118.450 119.990 -1.540 18329
7684 1 9 . 1 1 56 56 LEU HA H 79 4.150 4.150 4.060 0.090 18329
7685 1 9 . 1 1 56 56 LEU C C 79 179.200 179.200 178.929 0.271 18329
7686 1 9 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.122 -0.322 18329
7687 1 9 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.389 -0.289 18329
7688 1 9 . 1 1 56 56 LEU H H 79 7.260 7.260 7.546 -0.286 18329
7689 1 9 . 1 1 57 57 GLU N N 80 117.980 117.980 118.231 -0.251 18329
7690 1 9 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.950 -0.300 18329
7691 1 9 . 1 1 57 57 GLU C C 80 178.700 178.700 178.820 -0.120 18329
7692 1 9 . 1 1 57 57 GLU CA C 80 59.300 59.300 58.941 0.359 18329
7693 1 9 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.227 0.274 18329
7694 1 9 . 1 1 57 57 GLU H H 80 7.890 7.890 8.046 -0.156 18329
7695 1 9 . 1 1 58 58 ALA N N 81 122.040 122.040 121.794 0.246 18329
7696 1 9 . 1 1 58 58 ALA HA H 81 3.800 3.800 3.959 -0.159 18329
7697 1 9 . 1 1 58 58 ALA C C 81 179.500 179.500 179.089 0.411 18329
7698 1 9 . 1 1 58 58 ALA CA C 81 55.200 55.200 55.153 0.047 18329
7699 1 9 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.300 0.500 18329
7700 1 9 . 1 1 58 58 ALA H H 81 8.400 8.400 7.871 0.529 18329
7701 1 9 . 1 1 59 59 LYS N N 82 116.000 116.000 117.700 -1.700 18329
7702 1 9 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.108 -0.258 18329
7703 1 9 . 1 1 59 59 LYS C C 82 180.300 180.300 178.427 1.873 18329
7704 1 9 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.046 2.054 18329
7705 1 9 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.173 0.027 18329
7706 1 9 . 1 1 59 59 LYS H H 82 8.000 8.000 7.569 0.431 18329
7707 1 9 . 1 1 60 60 VAL N N 83 122.920 122.920 118.394 4.526 18329
7708 1 9 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.699 -0.369 18329
7709 1 9 . 1 1 60 60 VAL C C 83 178.300 178.300 178.228 0.072 18329
7710 1 9 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.889 2.011 18329
7711 1 9 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.236 -0.036 18329
7712 1 9 . 1 1 60 60 VAL H H 83 8.110 8.110 7.198 0.912 18329
7713 1 9 . 1 1 61 61 ARG N N 84 121.770 121.770 120.626 1.144 18329
7714 1 9 . 1 1 61 61 ARG C C 84 179.500 179.500 178.362 1.138 18329
7715 1 9 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.259 -0.059 18329
7716 1 9 . 1 1 61 61 ARG CB C 84 30.800 30.800 30.022 0.778 18329
7717 1 9 . 1 1 61 61 ARG H H 84 8.710 8.710 7.462 1.248 18329
7718 1 9 . 1 1 62 62 ALA N N 85 119.450 119.450 119.050 0.400 18329
7719 1 9 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.072 -0.182 18329
7720 1 9 . 1 1 62 62 ALA C C 85 179.500 179.500 178.861 0.639 18329
7721 1 9 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.226 -0.226 18329
7722 1 9 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.331 0.669 18329
7723 1 9 . 1 1 62 62 ALA H H 85 8.700 8.700 7.780 0.920 18329
7724 1 9 . 1 1 63 63 THR N N 86 106.650 106.650 110.154 -3.504 18329
7725 1 9 . 1 1 63 63 THR HA H 86 3.970 3.970 4.168 -0.198 18329
7726 1 9 . 1 1 63 63 THR C C 86 177.700 177.700 176.491 1.209 18329
7727 1 9 . 1 1 63 63 THR CA C 86 66.000 66.000 65.734 0.266 18329
7728 1 9 . 1 1 63 63 THR CB C 86 68.200 68.200 68.169 0.030 18329
7729 1 9 . 1 1 63 63 THR H H 86 8.150 8.150 7.733 0.417 18329
7730 1 9 . 1 1 64 64 THR N N 87 120.430 120.430 119.781 0.649 18329
7731 1 9 . 1 1 64 64 THR HA H 87 4.050 4.050 4.052 -0.002 18329
7732 1 9 . 1 1 64 64 THR C C 87 176.800 176.800 176.566 0.234 18329
7733 1 9 . 1 1 64 64 THR CA C 87 67.300 67.300 67.670 -0.370 18329
7734 1 9 . 1 1 64 64 THR CB C 87 68.600 68.600 68.334 0.266 18329
7735 1 9 . 1 1 64 64 THR H H 87 7.920 7.920 7.324 0.596 18329
7736 1 9 . 1 1 65 65 VAL N N 88 119.230 119.230 118.946 0.284 18329
7737 1 9 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.855 0.125 18329
7738 1 9 . 1 1 65 65 VAL C C 88 178.500 178.500 177.429 1.071 18329
7739 1 9 . 1 1 65 65 VAL CA C 88 65.600 65.600 65.682 -0.082 18329
7740 1 9 . 1 1 65 65 VAL CB C 88 31.700 31.700 30.761 0.939 18329
7741 1 9 . 1 1 65 65 VAL H H 88 7.380 7.380 7.355 0.025 18329
7742 1 9 . 1 1 66 66 ALA N N 89 124.260 124.260 122.139 2.121 18329
7743 1 9 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.931 0.319 18329
7744 1 9 . 1 1 66 66 ALA C C 89 179.900 179.900 179.382 0.518 18329
7745 1 9 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.377 -0.477 18329
7746 1 9 . 1 1 66 66 ALA CB C 89 19.500 19.500 17.937 1.563 18329
7747 1 9 . 1 1 66 66 ALA H H 89 8.390 8.390 7.779 0.611 18329
7748 1 9 . 1 1 67 67 GLU N N 90 120.180 120.180 118.453 1.727 18329
7749 1 9 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.985 -0.265 18329
7750 1 9 . 1 1 67 67 GLU C C 90 177.600 177.600 178.960 -1.360 18329
7751 1 9 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.693 0.207 18329
7752 1 9 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.501 -1.201 18329
7753 1 9 . 1 1 67 67 GLU H H 90 8.520 8.520 8.457 0.063 18329
7754 1 9 . 1 1 68 68 LYS N N 91 116.340 116.340 118.424 -2.084 18329
7755 1 9 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.001 -0.041 18329
7756 1 9 . 1 1 68 68 LYS C C 91 179.200 179.200 179.167 0.033 18329
7757 1 9 . 1 1 68 68 LYS CA C 91 59.800 59.800 59.081 0.719 18329
7758 1 9 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.273 -0.273 18329
7759 1 9 . 1 1 68 68 LYS H H 91 7.210 7.210 7.385 -0.175 18329
7760 1 9 . 1 1 69 69 PHE N N 92 120.990 120.990 121.071 -0.081 18329
7761 1 9 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.197 0.313 18329
7762 1 9 . 1 1 69 69 PHE C C 92 175.100 175.100 177.034 -1.934 18329
7763 1 9 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.285 -1.485 18329
7764 1 9 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.358 -0.158 18329
7765 1 9 . 1 1 69 69 PHE H H 92 7.180 7.180 7.831 -0.651 18329
7766 1 9 . 1 1 70 70 VAL N N 93 120.330 120.330 118.333 1.997 18329
7767 1 9 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.491 -0.401 18329
7768 1 9 . 1 1 70 70 VAL C C 93 177.500 177.500 178.007 -0.507 18329
7769 1 9 . 1 1 70 70 VAL CA C 93 66.900 66.900 65.985 0.915 18329
7770 1 9 . 1 1 70 70 VAL CB C 93 31.400 31.400 30.649 0.751 18329
7771 1 9 . 1 1 70 70 VAL H H 93 7.930 7.930 7.911 0.019 18329
7772 1 9 . 1 1 71 71 ILE N N 94 120.410 120.410 119.758 0.652 18329
7773 1 9 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.728 0.102 18329
7774 1 9 . 1 1 71 71 ILE C C 94 177.700 177.700 178.647 -0.947 18329
7775 1 9 . 1 1 71 71 ILE CA C 94 65.000 65.000 64.498 0.502 18329
7776 1 9 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.323 -0.023 18329
7777 1 9 . 1 1 71 71 ILE H H 94 8.180 8.180 7.636 0.544 18329
7778 1 9 . 1 1 72 72 ALA N N 95 122.440 122.440 123.154 -0.714 18329
7779 1 9 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.945 0.015 18329
7780 1 9 . 1 1 72 72 ALA C C 95 179.600 179.600 179.376 0.224 18329
7781 1 9 . 1 1 72 72 ALA CA C 95 55.900 55.900 54.934 0.967 18329
7782 1 9 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.596 -0.396 18329
7783 1 9 . 1 1 72 72 ALA H H 95 7.340 7.340 7.464 -0.124 18329
7784 1 9 . 1 1 73 73 ILE N N 96 119.330 119.330 117.023 2.307 18329
7785 1 9 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.553 -0.113 18329
7786 1 9 . 1 1 73 73 ILE C C 96 177.400 177.400 177.753 -0.353 18329
7787 1 9 . 1 1 73 73 ILE CA C 96 62.800 62.800 62.995 -0.195 18329
7788 1 9 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.178 -1.778 18329
7789 1 9 . 1 1 73 73 ILE H H 96 7.820 7.820 7.366 0.454 18329
7790 1 9 . 1 1 74 74 GLU N N 97 118.440 118.440 118.889 -0.449 18329
7791 1 9 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.875 -0.185 18329
7792 1 9 . 1 1 74 74 GLU C C 97 180.500 180.500 178.817 1.683 18329
7793 1 9 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.681 0.019 18329
7794 1 9 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.204 0.496 18329
7795 1 9 . 1 1 74 74 GLU H H 97 8.380 8.380 7.748 0.632 18329
7796 1 9 . 1 1 75 75 GLU N N 98 120.470 120.470 118.902 1.568 18329
7797 1 9 . 1 1 75 75 GLU HA H 98 3.940 3.940 3.995 -0.055 18329
7798 1 9 . 1 1 75 75 GLU C C 98 180.600 180.600 178.919 1.681 18329
7799 1 9 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.321 0.380 18329
7800 1 9 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.389 0.811 18329
7801 1 9 . 1 1 75 75 GLU H H 98 8.800 8.800 7.437 1.363 18329
7802 1 9 . 1 1 76 76 GLU N N 99 119.230 119.230 118.790 0.440 18329
7803 1 9 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.047 0.093 18329
7804 1 9 . 1 1 76 76 GLU C C 99 178.900 178.900 178.800 0.100 18329
7805 1 9 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.789 -0.189 18329
7806 1 9 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.052 0.248 18329
7807 1 9 . 1 1 76 76 GLU H H 99 8.840 8.840 7.635 1.205 18329
7808 1 9 . 1 1 77 77 ALA N N 100 121.950 121.950 122.242 -0.292 18329
7809 1 9 . 1 1 77 77 ALA HA H 100 4.000 4.000 3.959 0.041 18329
7810 1 9 . 1 1 77 77 ALA C C 100 179.000 179.000 179.489 -0.489 18329
7811 1 9 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.255 1.045 18329
7812 1 9 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.062 -1.262 18329
7813 1 9 . 1 1 77 77 ALA H H 100 9.400 9.400 7.748 1.652 18329
7814 1 9 . 1 1 78 78 THR N N 101 111.820 111.820 113.718 -1.898 18329
7815 1 9 . 1 1 78 78 THR HA H 101 3.750 3.750 4.035 -0.285 18329
7816 1 9 . 1 1 78 78 THR CA C 101 67.500 67.500 65.692 1.808 18329
7817 1 9 . 1 1 78 78 THR CB C 101 68.600 68.600 68.637 -0.037 18329
7818 1 9 . 1 1 78 78 THR H H 101 7.770 7.770 7.576 0.194 18329
7819 1 9 . 1 1 79 79 LYS N N 102 122.940 122.940 121.987 0.953 18329
7820 1 9 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.150 -0.060 18329
7821 1 9 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.166 1.034 18329
7822 1 9 . 1 1 79 79 LYS CB C 102 32.500 32.500 31.958 0.542 18329
7823 1 9 . 1 1 79 79 LYS H H 102 7.870 7.870 7.544 0.326 18329
7824 1 9 . 1 1 80 80 LEU N N 103 117.690 117.690 117.546 0.144 18329
7825 1 9 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.154 0.336 18329
7826 1 9 . 1 1 80 80 LEU C C 103 178.140 178.140 176.294 1.846 18329
7827 1 9 . 1 1 80 80 LEU CA C 103 54.000 54.000 55.407 -1.407 18329
7828 1 9 . 1 1 80 80 LEU CB C 103 43.100 43.100 41.630 1.470 18329
7829 1 9 . 1 1 80 80 LEU H H 103 7.550 7.550 8.210 -0.660 18329
7830 1 9 . 1 1 81 81 LYS N N 104 122.210 122.210 119.282 2.928 18329
7831 1 9 . 1 1 81 81 LYS HA H 104 3.930 3.930 4.061 -0.131 18329
7832 1 9 . 1 1 81 81 LYS C C 104 178.000 178.000 176.139 1.861 18329
7833 1 9 . 1 1 81 81 LYS CA C 104 61.300 61.300 57.488 3.812 18329
7834 1 9 . 1 1 81 81 LYS CB C 104 32.800 32.800 32.715 0.085 18329
7835 1 9 . 1 1 81 81 LYS H H 104 7.500 7.500 7.271 0.229 18329
7836 1 9 . 1 1 82 82 GLU N N 105 114.920 114.920 118.130 -3.210 18329
7837 1 9 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.094 0.466 18329
7838 1 9 . 1 1 82 82 GLU C C 105 177.900 177.900 175.818 2.082 18329
7839 1 9 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.964 -0.304 18329
7840 1 9 . 1 1 82 82 GLU CB C 105 30.400 30.400 28.197 2.203 18329
7841 1 9 . 1 1 82 82 GLU H H 105 8.780 8.780 8.975 -0.195 18329
7842 1 9 . 1 1 83 83 THR N N 106 107.260 107.260 110.902 -3.642 18329
7843 1 9 . 1 1 83 83 THR HA H 106 4.550 4.550 4.408 0.142 18329
7844 1 9 . 1 1 83 83 THR C C 106 176.300 176.300 174.841 1.459 18329
7845 1 9 . 1 1 83 83 THR CA C 106 61.900 61.900 62.466 -0.566 18329
7846 1 9 . 1 1 83 83 THR CB C 106 70.400 70.400 68.757 1.643 18329
7847 1 9 . 1 1 83 83 THR H H 106 7.570 7.570 8.190 -0.620 18329
7848 1 9 . 1 1 84 84 GLY N N 107 112.110 112.110 110.642 1.468 18329
7849 1 9 . 1 1 84 84 GLY C C 107 172.800 172.800 173.518 -0.718 18329
7850 1 9 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.287 0.113 18329
7851 1 9 . 1 1 84 84 GLY H H 107 9.000 9.000 8.066 0.934 18329
7852 1 9 . 1 1 85 85 SER N N 108 119.030 119.030 113.271 5.759 18329
7853 1 9 . 1 1 85 85 SER CA C 108 56.300 56.300 58.941 -2.641 18329
7854 1 9 . 1 1 85 85 SER CB C 108 66.300 66.300 62.667 3.632 18329
7855 1 9 . 1 1 85 85 SER H H 108 8.950 8.950 8.247 0.703 18329
7856 1 9 . 1 1 86 86 SER HA H 109 4.480 4.480 3.947 0.533 18329
7857 1 9 . 1 1 86 86 SER C C 109 177.000 177.000 176.167 0.833 18329
7858 1 9 . 1 1 86 86 SER CA C 109 61.600 61.600 58.111 3.489 18329
7859 1 9 . 1 1 86 86 SER CB C 109 62.900 62.900 63.623 -0.723 18329
7860 1 9 . 1 1 87 87 GLY N N 110 108.100 108.100 111.059 -2.959 18329
7861 1 9 . 1 1 87 87 GLY C C 110 177.100 177.100 176.129 0.971 18329
7862 1 9 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.922 -0.722 18329
7863 1 9 . 1 1 87 87 GLY H H 110 8.480 8.480 8.102 0.378 18329
7864 1 9 . 1 1 88 88 GLU N N 111 123.040 123.040 121.030 2.010 18329
7865 1 9 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.191 -0.501 18329
7866 1 9 . 1 1 88 88 GLU C C 111 177.700 177.700 179.139 -1.439 18329
7867 1 9 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.721 0.779 18329
7868 1 9 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.177 -0.477 18329
7869 1 9 . 1 1 88 88 GLU H H 111 7.560 7.560 8.554 -0.994 18329
7870 1 9 . 1 1 89 89 PHE N N 112 118.270 118.270 118.194 0.076 18329
7871 1 9 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.342 0.078 18329
7872 1 9 . 1 1 89 89 PHE C C 112 178.600 178.600 177.821 0.779 18329
7873 1 9 . 1 1 89 89 PHE CA C 112 61.100 61.100 60.790 0.310 18329
7874 1 9 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.368 -0.468 18329
7875 1 9 . 1 1 89 89 PHE H H 112 7.200 7.200 8.368 -1.168 18329
7876 1 9 . 1 1 90 90 SER N N 113 115.980 115.980 115.415 0.565 18329
7877 1 9 . 1 1 90 90 SER HA H 113 4.290 4.290 4.212 0.078 18329
7878 1 9 . 1 1 90 90 SER C C 113 178.600 178.600 176.623 1.977 18329
7879 1 9 . 1 1 90 90 SER CA C 113 62.700 62.700 61.712 0.988 18329
7880 1 9 . 1 1 90 90 SER CB C 113 62.800 62.800 62.626 0.174 18329
7881 1 9 . 1 1 90 90 SER H H 113 8.830 8.830 8.027 0.803 18329
7882 1 9 . 1 1 91 91 ALA N N 114 123.130 123.130 123.171 -0.041 18329
7883 1 9 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.144 0.236 18329
7884 1 9 . 1 1 91 91 ALA C C 114 181.300 181.300 179.454 1.846 18329
7885 1 9 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.718 -0.018 18329
7886 1 9 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.292 0.108 18329
7887 1 9 . 1 1 91 91 ALA H H 114 7.580 7.580 7.601 -0.021 18329
7888 1 9 . 1 1 92 92 MET N N 115 118.700 118.700 118.904 -0.204 18329
7889 1 9 . 1 1 92 92 MET HA H 115 3.980 3.980 4.234 -0.254 18329
7890 1 9 . 1 1 92 92 MET C C 115 178.000 178.000 177.786 0.214 18329
7891 1 9 . 1 1 92 92 MET CA C 115 61.000 61.000 57.611 3.389 18329
7892 1 9 . 1 1 92 92 MET CB C 115 31.400 31.400 32.583 -1.183 18329
7893 1 9 . 1 1 92 92 MET H H 115 7.880 7.880 7.723 0.157 18329
7894 1 9 . 1 1 93 93 TYR N N 116 119.200 119.200 120.591 -1.391 18329
7895 1 9 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.073 0.207 18329
7896 1 9 . 1 1 93 93 TYR C C 116 176.300 176.300 177.500 -1.200 18329
7897 1 9 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.849 0.251 18329
7898 1 9 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.508 -0.208 18329
7899 1 9 . 1 1 93 93 TYR H H 116 7.870 7.870 8.762 -0.892 18329
7900 1 9 . 1 1 94 94 ASP N N 117 120.210 120.210 119.068 1.142 18329
7901 1 9 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.446 -0.256 18329
7902 1 9 . 1 1 94 94 ASP C C 117 179.000 179.000 178.307 0.693 18329
7903 1 9 . 1 1 94 94 ASP CA C 117 57.700 57.700 56.880 0.820 18329
7904 1 9 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.471 -0.471 18329
7905 1 9 . 1 1 94 94 ASP H H 117 8.720 8.720 8.484 0.236 18329
7906 1 9 . 1 1 95 95 LEU N N 118 118.420 118.420 120.199 -1.779 18329
7907 1 9 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.143 0.067 18329
7908 1 9 . 1 1 95 95 LEU C C 118 178.600 178.600 178.710 -0.110 18329
7909 1 9 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.941 -0.241 18329
7910 1 9 . 1 1 95 95 LEU CB C 118 43.100 43.100 41.411 1.689 18329
7911 1 9 . 1 1 95 95 LEU H H 118 7.510 7.510 7.308 0.202 18329
7912 1 9 . 1 1 96 96 MET N N 119 118.470 118.470 119.290 -0.820 18329
7913 1 9 . 1 1 96 96 MET HA H 119 3.990 3.990 4.150 -0.160 18329
7914 1 9 . 1 1 96 96 MET C C 119 177.500 177.500 178.418 -0.918 18329
7915 1 9 . 1 1 96 96 MET CA C 119 60.500 60.500 57.784 2.716 18329
7916 1 9 . 1 1 96 96 MET CB C 119 33.900 33.900 31.793 2.107 18329
7917 1 9 . 1 1 96 96 MET H H 119 7.820 7.820 7.858 -0.038 18329
7918 1 9 . 1 1 97 97 PHE N N 120 119.580 119.580 119.808 -0.228 18329
7919 1 9 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.020 -0.210 18329
7920 1 9 . 1 1 97 97 PHE C C 120 178.800 178.800 176.891 1.909 18329
7921 1 9 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.681 0.119 18329
7922 1 9 . 1 1 97 97 PHE CB C 120 39.200 39.200 39.271 -0.071 18329
7923 1 9 . 1 1 97 97 PHE H H 120 8.940 8.940 7.624 1.316 18329
7924 1 9 . 1 1 98 98 GLU N N 121 119.940 119.940 118.577 1.363 18329
7925 1 9 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.031 -0.151 18329
7926 1 9 . 1 1 98 98 GLU C C 121 180.800 180.800 178.869 1.931 18329
7927 1 9 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.325 0.475 18329
7928 1 9 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.476 -0.276 18329
7929 1 9 . 1 1 98 98 GLU H H 121 8.690 8.690 7.998 0.692 18329
7930 1 9 . 1 1 99 99 VAL N N 122 115.350 115.350 114.009 1.341 18329
7931 1 9 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.799 -0.059 18329
7932 1 9 . 1 1 99 99 VAL C C 122 176.500 176.500 177.539 -1.039 18329
7933 1 9 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.522 -0.022 18329
7934 1 9 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.080 0.220 18329
7935 1 9 . 1 1 99 99 VAL H H 122 8.210 8.210 7.809 0.401 18329
7936 1 9 . 1 1 100 100 SER N N 123 115.450 115.450 115.790 -0.340 18329
7937 1 9 . 1 1 100 100 SER HA H 123 4.270 4.270 4.043 0.227 18329
7938 1 9 . 1 1 100 100 SER C C 123 174.700 174.700 176.141 -1.441 18329
7939 1 9 . 1 1 100 100 SER CA C 123 62.000 62.000 60.984 1.016 18329
7940 1 9 . 1 1 100 100 SER H H 123 7.520 7.520 7.561 -0.041 18329
7941 1 9 . 1 1 101 101 LYS N N 124 120.310 120.310 121.317 -1.007 18329
7942 1 9 . 1 1 101 101 LYS HA H 124 3.970 3.970 3.978 -0.008 18329
7943 1 9 . 1 1 101 101 LYS C C 124 176.600 176.600 175.606 0.994 18329
7944 1 9 . 1 1 101 101 LYS CA C 124 61.100 61.100 61.299 -0.199 18329
7945 1 9 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.636 -2.136 18329
7946 1 9 . 1 1 101 101 LYS H H 124 6.930 6.930 7.264 -0.334 18329
7947 1 9 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.121 0.139 18329
7948 1 9 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.830 -0.630 18329
7949 1 9 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.122 -0.522 18329
7950 1 9 . 1 1 103 103 LEU N N 126 116.020 116.020 115.424 0.596 18329
7951 1 9 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.083 -0.203 18329
7952 1 9 . 1 1 103 103 LEU C C 126 177.900 177.900 178.927 -1.027 18329
7953 1 9 . 1 1 103 103 LEU CA C 126 57.700 57.700 57.717 -0.017 18329
7954 1 9 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.270 0.530 18329
7955 1 9 . 1 1 103 103 LEU H H 126 6.520 6.520 7.279 -0.759 18329
7956 1 9 . 1 1 104 104 GLN N N 127 120.500 120.500 118.832 1.668 18329
7957 1 9 . 1 1 104 104 GLN C C 127 180.600 180.600 177.862 2.738 18329
7958 1 9 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.108 0.192 18329
7959 1 9 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.395 0.605 18329
7960 1 9 . 1 1 104 104 GLN H H 127 8.160 8.160 8.008 0.152 18329
7961 1 9 . 1 1 105 105 LYS N N 128 120.000 120.000 116.240 3.760 18329
7962 1 9 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.037 0.013 18329
7963 1 9 . 1 1 105 105 LYS C C 128 177.100 177.100 177.301 -0.201 18329
7964 1 9 . 1 1 105 105 LYS CA C 128 58.500 58.500 57.991 0.509 18329
7965 1 9 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.459 -1.060 18329
7966 1 9 . 1 1 105 105 LYS H H 128 7.810 7.810 7.580 0.230 18329
7967 1 9 . 1 1 106 106 LEU N N 129 118.530 118.530 117.075 1.455 18329
7968 1 9 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.268 -0.298 18329
7969 1 9 . 1 1 106 106 LEU C C 129 175.200 175.200 176.333 -1.133 18329
7970 1 9 . 1 1 106 106 LEU CA C 129 54.500 54.500 55.629 -1.129 18329
7971 1 9 . 1 1 106 106 LEU CB C 129 42.400 42.400 43.807 -1.407 18329
7972 1 9 . 1 1 106 106 LEU H H 129 7.220 7.220 7.315 -0.095 18329
7973 1 9 . 1 1 107 107 GLY N N 130 101.490 101.490 103.154 -1.664 18329
7974 1 9 . 1 1 107 107 GLY C C 130 174.800 174.800 171.803 2.997 18329
7975 1 9 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.600 0.500 18329
7976 1 9 . 1 1 107 107 GLY H H 130 7.560 7.560 8.063 -0.503 18329
7977 1 9 . 1 1 108 108 ILE N N 131 121.340 121.340 116.910 4.430 18329
7978 1 9 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.754 0.396 18329
7979 1 9 . 1 1 108 108 ILE C C 131 174.300 174.300 174.839 -0.539 18329
7980 1 9 . 1 1 108 108 ILE CA C 131 60.400 60.400 63.105 -2.705 18329
7981 1 9 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.883 -2.683 18329
7982 1 9 . 1 1 108 108 ILE H H 131 7.290 7.290 8.238 -0.948 18329
7983 1 9 . 1 1 109 109 GLN N N 132 125.650 125.650 120.321 5.329 18329
7984 1 9 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.304 -0.294 18329
7985 1 9 . 1 1 109 109 GLN C C 132 176.800 176.800 174.767 2.033 18329
7986 1 9 . 1 1 109 109 GLN CA C 132 57.600 57.600 55.891 1.709 18329
7987 1 9 . 1 1 109 109 GLN CB C 132 29.000 29.000 31.819 -2.819 18329
7988 1 9 . 1 1 109 109 GLN H H 132 8.080 8.080 8.429 -0.349 18329
7989 1 9 . 1 1 110 110 GLU N N 133 114.890 114.890 120.675 -5.785 18329
7990 1 9 . 1 1 110 110 GLU HA H 133 4.150 4.150 3.821 0.329 18329
7991 1 9 . 1 1 110 110 GLU C C 133 177.100 177.100 176.167 0.933 18329
7992 1 9 . 1 1 110 110 GLU CA C 133 57.100 57.100 57.563 -0.463 18329
7993 1 9 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.941 -1.641 18329
7994 1 9 . 1 1 110 110 GLU H H 133 9.270 9.270 9.024 0.246 18329
7995 1 9 . 1 1 111 111 MET N N 134 121.210 121.210 117.158 4.052 18329
7996 1 9 . 1 1 111 111 MET HA H 134 4.350 4.350 4.109 0.241 18329
7997 1 9 . 1 1 111 111 MET C C 134 177.500 177.500 177.893 -0.393 18329
7998 1 9 . 1 1 111 111 MET CA C 134 57.900 57.900 59.065 -1.165 18329
7999 1 9 . 1 1 111 111 MET CB C 134 33.300 33.300 32.346 0.954 18329
8000 1 9 . 1 1 111 111 MET H H 134 7.620 7.620 8.399 -0.779 18329
8001 1 9 . 1 1 112 112 THR N N 135 113.170 113.170 109.729 3.441 18329
8002 1 9 . 1 1 112 112 THR HA H 135 3.920 3.920 4.102 -0.182 18329
8003 1 9 . 1 1 112 112 THR C C 135 176.400 176.400 176.438 -0.038 18329
8004 1 9 . 1 1 112 112 THR CA C 135 65.900 65.900 65.371 0.529 18329
8005 1 9 . 1 1 112 112 THR CB C 135 68.200 68.200 68.735 -0.535 18329
8006 1 9 . 1 1 112 112 THR H H 135 8.320 8.320 8.096 0.224 18329
8007 1 9 . 1 1 113 113 LYS N N 136 123.440 123.440 122.596 0.844 18329
8008 1 9 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.014 -0.084 18329
8009 1 9 . 1 1 113 113 LYS C C 136 177.600 177.600 178.834 -1.234 18329
8010 1 9 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.743 -1.443 18329
8011 1 9 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.040 -0.040 18329
8012 1 9 . 1 1 113 113 LYS H H 136 8.060 8.060 8.271 -0.211 18329
8013 1 9 . 1 1 114 114 THR N N 137 114.590 114.590 115.788 -1.198 18329
8014 1 9 . 1 1 114 114 THR HA H 137 4.000 4.000 4.001 -0.001 18329
8015 1 9 . 1 1 114 114 THR C C 137 176.800 176.800 176.145 0.655 18329
8016 1 9 . 1 1 114 114 THR CA C 137 67.600 67.600 67.319 0.281 18329
8017 1 9 . 1 1 114 114 THR CB C 137 69.200 69.200 68.671 0.529 18329
8018 1 9 . 1 1 114 114 THR H H 137 7.950 7.950 8.148 -0.198 18329
8019 1 9 . 1 1 115 115 VAL N N 138 119.080 119.080 121.214 -2.134 18329
8020 1 9 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.668 0.152 18329
8021 1 9 . 1 1 115 115 VAL C C 138 176.900 176.900 177.636 -0.736 18329
8022 1 9 . 1 1 115 115 VAL CA C 138 66.800 66.800 65.984 0.816 18329
8023 1 9 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.662 0.838 18329
8024 1 9 . 1 1 115 115 VAL H H 138 7.320 7.320 7.548 -0.228 18329
8025 1 9 . 1 1 116 116 SER N N 139 116.630 116.630 116.282 0.348 18329
8026 1 9 . 1 1 116 116 SER HA H 139 4.680 4.680 4.355 0.325 18329
8027 1 9 . 1 1 116 116 SER C C 139 179.000 179.000 176.391 2.609 18329
8028 1 9 . 1 1 116 116 SER CA C 139 61.400 61.400 61.965 -0.565 18329
8029 1 9 . 1 1 116 116 SER CB C 139 62.800 62.800 63.212 -0.412 18329
8030 1 9 . 1 1 116 116 SER H H 139 8.990 8.990 8.799 0.191 18329
8031 1 9 . 1 1 117 117 ASP N N 140 124.220 124.220 120.990 3.230 18329
8032 1 9 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.430 -0.070 18329
8033 1 9 . 1 1 117 117 ASP C C 140 179.900 179.900 177.607 2.293 18329
8034 1 9 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.981 0.319 18329
8035 1 9 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.975 -1.475 18329
8036 1 9 . 1 1 117 117 ASP H H 140 9.480 9.480 8.512 0.968 18329
8037 1 9 . 1 1 118 118 ALA N N 141 121.420 121.420 122.174 -0.754 18329
8038 1 9 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.113 0.167 18329
8039 1 9 . 1 1 118 118 ALA C C 141 179.800 179.800 179.282 0.518 18329
8040 1 9 . 1 1 118 118 ALA CA C 141 54.400 54.400 55.057 -0.657 18329
8041 1 9 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.368 0.632 18329
8042 1 9 . 1 1 118 118 ALA H H 141 7.340 7.340 7.200 0.140 18329
8043 1 9 . 1 1 119 119 ALA N N 142 121.680 121.680 120.092 1.588 18329
8044 1 9 . 1 1 119 119 ALA HA H 142 4.130 4.130 3.989 0.141 18329
8045 1 9 . 1 1 119 119 ALA C C 142 178.800 178.800 179.605 -0.805 18329
8046 1 9 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.669 -1.470 18329
8047 1 9 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.195 0.105 18329
8048 1 9 . 1 1 119 119 ALA H H 142 7.890 7.890 7.774 0.116 18329
8049 1 9 . 1 1 120 120 GLU N N 143 117.690 117.690 117.692 -0.002 18329
8050 1 9 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.111 -0.171 18329
8051 1 9 . 1 1 120 120 GLU C C 143 178.100 178.100 178.708 -0.608 18329
8052 1 9 . 1 1 120 120 GLU CA C 143 58.700 58.700 58.383 0.317 18329
8053 1 9 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.482 0.018 18329
8054 1 9 . 1 1 120 120 GLU H H 143 7.500 7.500 7.637 -0.137 18329
8055 1 9 . 1 1 121 121 GLU N N 144 115.680 115.680 120.477 -4.797 18329
8056 1 9 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.218 -0.058 18329
8057 1 9 . 1 1 121 121 GLU C C 144 176.100 176.100 177.421 -1.321 18329
8058 1 9 . 1 1 121 121 GLU CA C 144 56.900 56.900 58.069 -1.169 18329
8059 1 9 . 1 1 121 121 GLU CB C 144 31.100 31.100 30.364 0.736 18329
8060 1 9 . 1 1 121 121 GLU H H 144 6.970 6.970 7.919 -0.949 18329
8061 1 9 . 1 1 122 122 ASN N N 145 117.750 117.750 116.059 1.691 18329
8062 1 9 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.097 -0.107 18329
8063 1 9 . 1 1 122 122 ASN C C 145 185.300 185.300 173.302 11.998 18329
8064 1 9 . 1 1 122 122 ASN CA C 145 50.200 50.200 50.631 -0.431 18329
8065 1 9 . 1 1 122 122 ASN CB C 145 41.100 41.100 38.736 2.364 18329
8066 1 9 . 1 1 122 122 ASN H H 145 7.670 7.670 8.454 -0.784 18329
8067 1 9 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.659 -0.029 18329
8068 1 9 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.091 -1.091 18329
8069 1 9 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.019 0.281 18329
8070 1 9 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.583 -0.143 18329
8071 1 9 . 1 1 124 124 PRO CA C 147 62.900 62.900 62.751 0.149 18329
8072 1 9 . 1 1 124 124 PRO CB C 147 28.400 28.400 32.595 -4.195 18329
8073 1 9 . 1 1 125 125 THR N N 148 106.090 106.090 112.231 -6.141 18329
8074 1 9 . 1 1 125 125 THR HA H 148 4.530 4.530 4.444 0.086 18329
8075 1 9 . 1 1 125 125 THR C C 148 174.300 174.300 173.762 0.538 18329
8076 1 9 . 1 1 125 125 THR CA C 148 61.200 61.200 61.438 -0.237 18329
8077 1 9 . 1 1 125 125 THR CB C 148 68.600 68.600 69.879 -1.279 18329
8078 1 9 . 1 1 125 125 THR H H 148 7.800 7.800 8.286 -0.486 18329
8079 1 9 . 1 1 126 126 THR N N 149 108.650 108.650 115.260 -6.610 18329
8080 1 9 . 1 1 126 126 THR HA H 149 4.170 4.170 4.671 -0.501 18329
8081 1 9 . 1 1 126 126 THR C C 149 173.100 173.100 174.948 -1.848 18329
8082 1 9 . 1 1 126 126 THR CA C 149 58.800 58.800 61.146 -2.346 18329
8083 1 9 . 1 1 126 126 THR CB C 149 73.100 73.100 71.947 1.153 18329
8084 1 9 . 1 1 126 126 THR H H 149 7.350 7.350 7.626 -0.276 18329
8085 1 9 . 1 1 127 127 ALA N N 150 123.270 123.270 126.815 -3.545 18329
8086 1 9 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.955 -0.935 18329
8087 1 9 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.842 -0.841 18329
8088 1 9 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.555 0.145 18329
8089 1 9 . 1 1 127 127 ALA H H 150 7.750 7.750 9.118 -1.368 18329
8090 1 9 . 1 1 128 128 GLN N N 151 114.920 114.920 116.162 -1.242 18329
8091 1 9 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.122 -0.372 18329
8092 1 9 . 1 1 128 128 GLN C C 151 178.400 178.400 178.272 0.128 18329
8093 1 9 . 1 1 128 128 GLN CA C 151 58.800 58.800 57.954 0.846 18329
8094 1 9 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.207 -1.007 18329
8095 1 9 . 1 1 128 128 GLN H H 151 8.300 8.300 8.592 -0.292 18329
8096 1 9 . 1 1 129 129 GLY N N 152 107.280 107.280 108.493 -1.213 18329
8097 1 9 . 1 1 129 129 GLY C C 152 174.900 174.900 176.753 -1.853 18329
8098 1 9 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.867 0.333 18329
8099 1 9 . 1 1 129 129 GLY H H 152 7.920 7.920 8.220 -0.300 18329
8100 1 9 . 1 1 130 130 VAL N N 153 119.440 119.440 122.819 -3.379 18329
8101 1 9 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.730 -0.260 18329
8102 1 9 . 1 1 130 130 VAL C C 153 177.700 177.700 177.750 -0.050 18329
8103 1 9 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.987 1.813 18329
8104 1 9 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.062 0.638 18329
8105 1 9 . 1 1 130 130 VAL H H 153 7.390 7.390 8.237 -0.847 18329
8106 1 9 . 1 1 131 131 LEU N N 154 118.990 118.990 117.974 1.016 18329
8107 1 9 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.805 0.105 18329
8108 1 9 . 1 1 131 131 LEU C C 154 180.400 180.400 178.884 1.516 18329
8109 1 9 . 1 1 131 131 LEU CA C 154 58.300 58.300 57.469 0.831 18329
8110 1 9 . 1 1 131 131 LEU CB C 154 41.000 41.000 40.607 0.393 18329
8111 1 9 . 1 1 131 131 LEU H H 154 8.640 8.640 7.542 1.098 18329
8112 1 9 . 1 1 132 132 GLU N N 155 120.980 120.980 119.372 1.608 18329
8113 1 9 . 1 1 132 132 GLU HA H 155 4.120 4.120 4.037 0.083 18329
8114 1 9 . 1 1 132 132 GLU C C 155 179.400 179.400 179.152 0.248 18329
8115 1 9 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.238 -0.338 18329
8116 1 9 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.521 -0.321 18329
8117 1 9 . 1 1 132 132 GLU H H 155 8.000 8.000 7.630 0.370 18329
8118 1 9 . 1 1 133 133 ILE N N 156 121.830 121.830 119.311 2.519 18329
8119 1 9 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.905 -0.325 18329
8120 1 9 . 1 1 133 133 ILE C C 156 178.000 178.000 178.030 -0.030 18329
8121 1 9 . 1 1 133 133 ILE CA C 156 65.500 65.500 62.496 3.004 18329
8122 1 9 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.435 3.165 18329
8123 1 9 . 1 1 133 133 ILE H H 156 8.040 8.040 8.589 -0.549 18329
8124 1 9 . 1 1 134 134 ALA N N 157 121.470 121.470 123.607 -2.137 18329
8125 1 9 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.979 -0.079 18329
8126 1 9 . 1 1 134 134 ALA C C 157 178.800 178.800 179.426 -0.626 18329
8127 1 9 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.230 0.070 18329
8128 1 9 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.101 -0.001 18329
8129 1 9 . 1 1 134 134 ALA H H 157 8.950 8.950 7.651 1.299 18329
8130 1 9 . 1 1 135 135 LYS N N 158 118.470 118.470 118.699 -0.229 18329
8131 1 9 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.952 -0.042 18329
8132 1 9 . 1 1 135 135 LYS C C 158 179.300 179.300 178.704 0.596 18329
8133 1 9 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.666 -0.166 18329
8134 1 9 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.307 -0.907 18329
8135 1 9 . 1 1 135 135 LYS H H 158 8.000 8.000 7.854 0.146 18329
8136 1 9 . 1 1 136 136 LYS N N 159 118.000 118.000 119.043 -1.043 18329
8137 1 9 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.110 -0.060 18329
8138 1 9 . 1 1 136 136 LYS C C 159 180.200 180.200 179.129 1.071 18329
8139 1 9 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.010 0.490 18329
8140 1 9 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.424 -1.524 18329
8141 1 9 . 1 1 136 136 LYS H H 159 7.530 7.530 7.459 0.071 18329
8142 1 9 . 1 1 137 137 MET N N 160 120.990 120.990 119.722 1.268 18329
8143 1 9 . 1 1 137 137 MET HA H 160 3.800 3.800 4.062 -0.262 18329
8144 1 9 . 1 1 137 137 MET C C 160 177.400 177.400 178.244 -0.844 18329
8145 1 9 . 1 1 137 137 MET CA C 160 60.600 60.600 60.049 0.551 18329
8146 1 9 . 1 1 137 137 MET CB C 160 31.800 31.800 32.704 -0.904 18329
8147 1 9 . 1 1 137 137 MET H H 160 8.660 8.660 8.198 0.462 18329
8148 1 9 . 1 1 138 138 ARG N N 161 119.480 119.480 117.814 1.666 18329
8149 1 9 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.968 -0.168 18329
8150 1 9 . 1 1 138 138 ARG C C 161 177.900 177.900 178.513 -0.613 18329
8151 1 9 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.444 1.156 18329
8152 1 9 . 1 1 138 138 ARG CB C 161 29.800 29.800 29.782 0.018 18329
8153 1 9 . 1 1 138 138 ARG H H 161 9.280 9.280 8.268 1.012 18329
8154 1 9 . 1 1 139 139 GLU N N 162 118.700 118.700 120.292 -1.592 18329
8155 1 9 . 1 1 139 139 GLU HA H 162 4.000 4.000 3.974 0.026 18329
8156 1 9 . 1 1 139 139 GLU C C 162 179.100 179.100 178.280 0.820 18329
8157 1 9 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.467 0.333 18329
8158 1 9 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.458 0.042 18329
8159 1 9 . 1 1 139 139 GLU H H 162 8.430 8.430 7.733 0.697 18329
8160 1 9 . 1 1 140 140 LYS N N 163 119.310 119.310 119.863 -0.553 18329
8161 1 9 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.068 0.142 18329
8162 1 9 . 1 1 140 140 LYS C C 163 177.900 177.900 179.148 -1.248 18329
8163 1 9 . 1 1 140 140 LYS CA C 163 58.900 58.900 59.362 -0.462 18329
8164 1 9 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.424 -1.324 18329
8165 1 9 . 1 1 140 140 LYS H H 163 7.440 7.440 7.434 0.006 18329
8166 1 9 . 1 1 141 141 LEU N N 164 117.630 117.630 119.283 -1.653 18329
8167 1 9 . 1 1 141 141 LEU HA H 164 3.890 3.890 3.979 -0.089 18329
8168 1 9 . 1 1 141 141 LEU C C 164 178.700 178.700 178.913 -0.213 18329
8169 1 9 . 1 1 141 141 LEU CA C 164 58.000 58.000 58.163 -0.163 18329
8170 1 9 . 1 1 141 141 LEU CB C 164 41.500 41.500 40.887 0.613 18329
8171 1 9 . 1 1 141 141 LEU H H 164 8.180 8.180 7.673 0.507 18329
8172 1 9 . 1 1 142 142 GLN N N 165 117.710 117.710 118.119 -0.409 18329
8173 1 9 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.929 0.381 18329
8174 1 9 . 1 1 142 142 GLN C C 165 179.200 179.200 178.504 0.696 18329
8175 1 9 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.349 -0.848 18329
8176 1 9 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.621 -1.121 18329
8177 1 9 . 1 1 142 142 GLN H H 165 8.730 8.730 8.168 0.562 18329
8178 1 9 . 1 1 143 143 ARG N N 166 121.410 121.410 119.256 2.154 18329
8179 1 9 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.130 0.060 18329
8180 1 9 . 1 1 143 143 ARG C C 166 179.700 179.700 179.048 0.652 18329
8181 1 9 . 1 1 143 143 ARG CA C 166 59.800 59.800 58.714 1.087 18329
8182 1 9 . 1 1 143 143 ARG CB C 166 30.200 30.200 29.919 0.281 18329
8183 1 9 . 1 1 143 143 ARG H H 166 8.050 8.050 7.913 0.137 18329
8184 1 9 . 1 1 144 144 VAL N N 167 120.950 120.950 120.389 0.561 18329
8185 1 9 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.596 0.164 18329
8186 1 9 . 1 1 144 144 VAL C C 167 179.200 179.200 177.610 1.590 18329
8187 1 9 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.978 -0.578 18329
8188 1 9 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.696 0.404 18329
8189 1 9 . 1 1 144 144 VAL H H 167 8.190 8.190 7.806 0.384 18329
8190 1 9 . 1 1 145 145 HIS N N 168 123.520 123.520 118.655 4.865 18329
8191 1 9 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.513 -0.613 18329
8192 1 9 . 1 1 145 145 HIS C C 168 177.100 177.100 177.697 -0.597 18329
8193 1 9 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.247 2.053 18329
8194 1 9 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.308 -0.408 18329
8195 1 9 . 1 1 145 145 HIS H H 168 9.240 9.240 8.117 1.123 18329
8196 1 9 . 1 1 146 146 THR N N 169 115.020 115.020 116.660 -1.640 18329
8197 1 9 . 1 1 146 146 THR HA H 169 3.860 3.860 4.138 -0.278 18329
8198 1 9 . 1 1 146 146 THR C C 169 175.700 175.700 176.485 -0.785 18329
8199 1 9 . 1 1 146 146 THR CA C 169 67.200 67.200 66.945 0.255 18329
8200 1 9 . 1 1 146 146 THR CB C 169 69.300 69.300 68.960 0.340 18329
8201 1 9 . 1 1 146 146 THR H H 169 8.750 8.750 8.670 0.080 18329
8202 1 9 . 1 1 147 147 LYS N N 170 120.300 120.300 120.400 -0.100 18329
8203 1 9 . 1 1 147 147 LYS HA H 170 4.000 4.000 4.061 -0.061 18329
8204 1 9 . 1 1 147 147 LYS C C 170 179.300 179.300 178.803 0.497 18329
8205 1 9 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.586 -0.486 18329
8206 1 9 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.140 -0.340 18329
8207 1 9 . 1 1 147 147 LYS H H 170 8.020 8.020 8.209 -0.189 18329
8208 1 9 . 1 1 148 148 ASN N N 171 117.600 117.600 118.352 -0.752 18329
8209 1 9 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.511 -0.191 18329
8210 1 9 . 1 1 148 148 ASN C C 171 175.400 175.400 177.707 -2.307 18329
8211 1 9 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.813 1.887 18329
8212 1 9 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.680 1.020 18329
8213 1 9 . 1 1 148 148 ASN H H 171 7.810 7.810 7.666 0.144 18329
8214 1 9 . 1 1 149 149 TYR N N 172 121.560 121.560 121.265 0.295 18329
8215 1 9 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.070 -0.180 18329
8216 1 9 . 1 1 149 149 TYR C C 172 176.900 176.900 177.230 -0.330 18329
8217 1 9 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.989 -0.489 18329
8218 1 9 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.560 0.359 18329
8219 1 9 . 1 1 149 149 TYR H H 172 9.020 9.020 7.719 1.301 18329
8220 1 9 . 1 1 150 150 CYS N N 173 116.050 116.050 117.967 -1.917 18329
8221 1 9 . 1 1 150 150 CYS C C 173 177.100 177.100 176.596 0.504 18329
8222 1 9 . 1 1 150 150 CYS CA C 173 58.400 58.400 61.449 -3.049 18329
8223 1 9 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.489 12.111 18329
8224 1 9 . 1 1 150 150 CYS H H 173 8.810 8.810 8.093 0.717 18329
8225 1 9 . 1 1 151 151 THR N N 174 117.190 117.190 115.464 1.726 18329
8226 1 9 . 1 1 151 151 THR HA H 174 3.880 3.880 3.890 -0.010 18329
8227 1 9 . 1 1 151 151 THR C C 174 176.000 176.000 177.199 -1.199 18329
8228 1 9 . 1 1 151 151 THR CA C 174 66.900 66.900 65.690 1.210 18329
8229 1 9 . 1 1 151 151 THR CB C 174 68.500 68.500 68.524 -0.024 18329
8230 1 9 . 1 1 151 151 THR H H 174 7.720 7.720 8.027 -0.307 18329
8231 1 9 . 1 1 152 152 LEU N N 175 123.110 123.110 121.881 1.229 18329
8232 1 9 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.070 -0.260 18329
8233 1 9 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.129 0.871 18329
8234 1 9 . 1 1 152 152 LEU CB C 175 41.500 41.500 40.834 0.666 18329
8235 1 9 . 1 1 152 152 LEU H H 175 7.870 7.870 7.943 -0.073 18329
8236 1 9 . 1 1 153 153 LYS N N 176 117.270 117.270 118.349 -1.079 18329
8237 1 9 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.728 -0.028 18329
8238 1 9 . 1 1 153 153 LYS C C 176 179.100 179.100 178.163 0.937 18329
8239 1 9 . 1 1 153 153 LYS CA C 176 56.700 56.700 58.742 -2.042 18329
8240 1 9 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.515 -1.615 18329
8241 1 9 . 1 1 153 153 LYS H H 176 7.900 7.900 7.363 0.537 18329
8242 1 9 . 1 1 154 154 LYS N N 177 119.290 119.290 118.829 0.461 18329
8243 1 9 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.044 0.216 18329
8244 1 9 . 1 1 154 154 LYS C C 177 178.100 178.100 178.686 -0.586 18329
8245 1 9 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.342 -1.542 18329
8246 1 9 . 1 1 154 154 LYS CB C 177 31.800 31.800 32.387 -0.587 18329
8247 1 9 . 1 1 154 154 LYS H H 177 7.540 7.540 7.593 -0.053 18329
8248 1 9 . 1 1 155 155 LYS N N 178 118.910 118.910 117.984 0.926 18329
8249 1 9 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.110 -0.060 18329
8250 1 9 . 1 1 155 155 LYS C C 178 178.100 178.100 178.925 -0.825 18329
8251 1 9 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.522 -0.522 18329
8252 1 9 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.417 -0.217 18329
8253 1 9 . 1 1 155 155 LYS H H 178 7.630 7.630 7.806 -0.176 18329
8254 1 9 . 1 1 156 156 GLU N N 179 117.950 117.950 118.621 -0.671 18329
8255 1 9 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.074 0.036 18329
8256 1 9 . 1 1 156 156 GLU C C 179 176.700 176.700 177.865 -1.165 18329
8257 1 9 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.834 -1.334 18329
8258 1 9 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.866 -0.266 18329
8259 1 9 . 1 1 156 156 GLU H H 179 7.560 7.560 7.713 -0.153 18329
8260 1 9 . 1 1 157 157 ASN N N 180 116.590 116.590 113.314 3.276 18329
8261 1 9 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.810 -0.090 18329
8262 1 9 . 1 1 157 157 ASN C C 180 175.000 175.000 175.461 -0.461 18329
8263 1 9 . 1 1 157 157 ASN CA C 180 52.700 52.700 53.153 -0.453 18329
8264 1 9 . 1 1 157 157 ASN CB C 180 38.800 38.800 40.514 -1.714 18329
8265 1 9 . 1 1 157 157 ASN H H 180 7.820 7.820 7.662 0.158 18329
8266 1 9 . 1 1 158 158 SER HA H 181 4.450 4.450 4.135 0.315 18329
8267 1 9 . 1 1 158 158 SER CA C 181 60.400 60.400 60.147 0.253 18329
8268 1 9 . 1 1 158 158 SER CB C 181 63.500 63.500 61.932 1.568 18329
8269 1 9 . 1 1 158 158 SER H H 181 8.030 8.030 7.992 0.038 18329
8270 1 9 . 1 1 159 159 THR N N 182 112.800 112.800 113.717 -0.917 18329
8271 1 9 . 1 1 159 159 THR HA H 182 4.380 4.380 4.494 -0.114 18329
8272 1 9 . 1 1 159 159 THR C C 182 174.300 174.300 173.831 0.469 18329
8273 1 9 . 1 1 159 159 THR CA C 182 61.800 61.800 63.005 -1.205 18329
8274 1 9 . 1 1 159 159 THR CB C 182 69.100 69.100 68.014 1.086 18329
8275 1 9 . 1 1 159 159 THR H H 182 8.070 8.070 7.599 0.471 18329
8276 1 9 . 1 1 160 160 PHE N N 183 123.120 123.120 126.719 -3.599 18329
8277 1 9 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.723 -0.283 18329
8278 1 9 . 1 1 160 160 PHE C C 183 175.100 175.100 175.232 -0.132 18329
8279 1 9 . 1 1 160 160 PHE CA C 183 58.900 58.900 59.597 -0.697 18329
8280 1 9 . 1 1 160 160 PHE CB C 183 40.000 40.000 40.094 -0.094 18329
8281 1 9 . 1 1 160 160 PHE H H 183 7.900 7.900 8.190 -0.290 18329
8282 1 9 . 1 1 161 161 THR N N 184 119.330 119.330 117.874 1.456 18329
8283 1 9 . 1 1 161 161 THR HA H 184 4.190 4.190 4.014 0.176 18329
8284 1 9 . 1 1 161 161 THR CA C 184 60.700 60.700 64.207 -3.506 18329
8285 1 9 . 1 1 161 161 THR CB C 184 70.700 70.700 68.847 1.853 18329
8286 1 9 . 1 1 161 161 THR H H 184 7.810 7.810 7.772 0.038 18329
8287 1 9 . 1 1 162 162 ASP N N 185 123.190 123.190 119.382 3.808 18329
8288 1 9 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.450 -0.040 18329
8289 1 9 . 1 1 162 162 ASP C C 185 176.900 176.900 176.478 0.422 18329
8290 1 9 . 1 1 162 162 ASP CA C 185 53.900 53.900 55.913 -2.013 18329
8291 1 9 . 1 1 162 162 ASP CB C 185 44.000 44.000 40.557 3.443 18329
8292 1 9 . 1 1 162 162 ASP H H 185 8.000 8.000 8.392 -0.392 18329
8293 1 9 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.156 0.324 18329
8294 1 9 . 1 1 163 163 GLU CA C 186 58.800 58.800 55.690 3.110 18329
8295 1 9 . 1 1 163 163 GLU CB C 186 28.100 28.100 29.928 -1.828 18329
8296 1 9 . 1 1 166 166 LYS N N 189 118.150 118.150 121.767 -3.617 18329
8297 1 9 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.124 0.096 18329
8298 1 9 . 1 1 166 166 LYS C C 189 177.500 177.500 176.636 0.864 18329
8299 1 9 . 1 1 166 166 LYS CA C 189 58.000 58.000 58.260 -0.260 18329
8300 1 9 . 1 1 166 166 LYS CB C 189 32.600 32.600 32.787 -0.187 18329
8301 1 9 . 1 1 166 166 LYS H H 189 8.890 8.890 8.449 0.441 18329
8302 1 9 . 1 1 167 167 ASN N N 190 116.210 116.210 115.677 0.533 18329
8303 1 9 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.334 0.626 18329
8304 1 9 . 1 1 167 167 ASN C C 190 174.900 174.900 174.884 0.016 18329
8305 1 9 . 1 1 167 167 ASN CA C 190 52.900 52.900 54.772 -1.872 18329
8306 1 9 . 1 1 167 167 ASN CB C 190 38.400 38.400 37.423 0.977 18329
8307 1 9 . 1 1 167 167 ASN H H 190 8.030 8.030 8.407 -0.377 18329
8308 1 10 . 1 1 2 2 ALA N N 25 125.000 125.000 124.991 0.009 18329
8309 1 10 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.259 0.111 18329
8310 1 10 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.876 -0.576 18329
8311 1 10 . 1 1 2 2 ALA CB C 25 19.700 19.700 19.119 0.581 18329
8312 1 10 . 1 1 2 2 ALA H H 25 8.690 8.690 8.104 0.586 18329
8313 1 10 . 1 1 3 3 GLY N N 26 106.920 106.920 106.266 0.654 18329
8314 1 10 . 1 1 3 3 GLY CA C 26 44.000 44.000 44.194 -0.194 18329
8315 1 10 . 1 1 3 3 GLY H H 26 7.940 7.940 7.810 0.130 18329
8316 1 10 . 1 1 4 4 LEU N N 27 119.140 119.140 119.376 -0.236 18329
8317 1 10 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.824 -0.414 18329
8318 1 10 . 1 1 4 4 LEU C C 27 177.100 177.100 177.397 -0.297 18329
8319 1 10 . 1 1 4 4 LEU CA C 27 54.400 54.400 55.592 -1.192 18329
8320 1 10 . 1 1 4 4 LEU CB C 27 42.100 42.100 43.048 -0.948 18329
8321 1 10 . 1 1 4 4 LEU H H 27 8.210 8.210 8.244 -0.034 18329
8322 1 10 . 1 1 5 5 THR N N 28 112.940 112.940 113.495 -0.555 18329
8323 1 10 . 1 1 5 5 THR HA H 28 4.650 4.650 4.414 0.236 18329
8324 1 10 . 1 1 5 5 THR C C 28 175.500 175.500 173.906 1.594 18329
8325 1 10 . 1 1 5 5 THR CA C 28 60.100 60.100 61.897 -1.797 18329
8326 1 10 . 1 1 5 5 THR CB C 28 72.600 72.600 71.010 1.590 18329
8327 1 10 . 1 1 5 5 THR H H 28 9.220 9.220 8.135 1.085 18329
8328 1 10 . 1 1 6 6 GLY N N 29 108.230 108.230 108.898 -0.668 18329
8329 1 10 . 1 1 6 6 GLY C C 29 174.800 174.800 174.588 0.212 18329
8330 1 10 . 1 1 6 6 GLY CA C 29 46.000 46.000 45.447 0.553 18329
8331 1 10 . 1 1 6 6 GLY H H 29 8.520 8.520 8.466 0.054 18329
8332 1 10 . 1 1 7 7 ALA HA H 30 4.040 4.040 3.936 0.104 18329
8333 1 10 . 1 1 7 7 ALA CA C 30 54.800 54.800 53.712 1.088 18329
8334 1 10 . 1 1 7 7 ALA CB C 30 18.200 18.200 17.866 0.334 18329
8335 1 10 . 1 1 8 8 THR N N 31 116.970 116.970 114.202 2.768 18329
8336 1 10 . 1 1 8 8 THR HA H 31 3.740 3.740 3.982 -0.242 18329
8337 1 10 . 1 1 8 8 THR C C 31 175.300 175.300 176.123 -0.823 18329
8338 1 10 . 1 1 8 8 THR CA C 31 67.000 67.000 66.675 0.325 18329
8339 1 10 . 1 1 8 8 THR CB C 31 68.700 68.700 68.646 0.054 18329
8340 1 10 . 1 1 8 8 THR H H 31 8.110 8.110 7.970 0.140 18329
8341 1 10 . 1 1 9 9 LYS N N 32 120.540 120.540 121.178 -0.638 18329
8342 1 10 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.044 -0.454 18329
8343 1 10 . 1 1 9 9 LYS C C 32 176.900 176.900 178.604 -1.704 18329
8344 1 10 . 1 1 9 9 LYS CA C 32 59.800 59.800 60.054 -0.254 18329
8345 1 10 . 1 1 9 9 LYS CB C 32 32.400 32.400 32.048 0.352 18329
8346 1 10 . 1 1 9 9 LYS H H 32 6.860 6.860 8.290 -1.430 18329
8347 1 10 . 1 1 10 10 ILE N N 33 115.940 115.940 118.512 -2.572 18329
8348 1 10 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.921 -0.211 18329
8349 1 10 . 1 1 10 10 ILE C C 33 179.000 179.000 178.352 0.648 18329
8350 1 10 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.660 -0.660 18329
8351 1 10 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.616 0.384 18329
8352 1 10 . 1 1 10 10 ILE H H 33 7.380 7.380 8.052 -0.672 18329
8353 1 10 . 1 1 11 11 ARG N N 34 118.350 118.350 119.422 -1.072 18329
8354 1 10 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.011 0.029 18329
8355 1 10 . 1 1 11 11 ARG C C 34 180.000 180.000 179.148 0.852 18329
8356 1 10 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.837 -0.437 18329
8357 1 10 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.043 0.257 18329
8358 1 10 . 1 1 11 11 ARG H H 34 8.250 8.250 7.926 0.324 18329
8359 1 10 . 1 1 12 12 LEU N N 35 117.420 117.420 119.476 -2.056 18329
8360 1 10 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.155 0.015 18329
8361 1 10 . 1 1 12 12 LEU C C 35 179.000 179.000 179.243 -0.243 18329
8362 1 10 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.780 0.220 18329
8363 1 10 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.617 -0.818 18329
8364 1 10 . 1 1 12 12 LEU H H 35 8.340 8.340 7.689 0.651 18329
8365 1 10 . 1 1 13 13 GLU N N 36 117.890 117.890 119.799 -1.909 18329
8366 1 10 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.899 0.121 18329
8367 1 10 . 1 1 13 13 GLU C C 36 180.100 180.100 179.000 1.100 18329
8368 1 10 . 1 1 13 13 GLU CA C 36 60.200 60.200 60.083 0.117 18329
8369 1 10 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.510 -1.210 18329
8370 1 10 . 1 1 13 13 GLU H H 36 8.610 8.610 7.999 0.611 18329
8371 1 10 . 1 1 14 14 ARG N N 37 121.100 121.100 118.478 2.622 18329
8372 1 10 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.113 0.127 18329
8373 1 10 . 1 1 14 14 ARG C C 37 178.100 178.100 178.429 -0.329 18329
8374 1 10 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.199 -0.699 18329
8375 1 10 . 1 1 14 14 ARG CB C 37 30.200 30.200 29.927 0.273 18329
8376 1 10 . 1 1 14 14 ARG H H 37 7.980 7.980 8.270 -0.290 18329
8377 1 10 . 1 1 15 15 SER N N 38 115.420 115.420 116.161 -0.741 18329
8378 1 10 . 1 1 15 15 SER HA H 38 4.380 4.380 4.457 -0.077 18329
8379 1 10 . 1 1 15 15 SER C C 38 177.300 177.300 176.346 0.954 18329
8380 1 10 . 1 1 15 15 SER CA C 38 62.200 62.200 61.038 1.162 18329
8381 1 10 . 1 1 15 15 SER CB C 38 63.200 63.200 63.262 -0.062 18329
8382 1 10 . 1 1 15 15 SER H H 38 8.230 8.230 8.448 -0.218 18329
8383 1 10 . 1 1 16 16 ALA N N 39 123.970 123.970 123.291 0.679 18329
8384 1 10 . 1 1 16 16 ALA HA H 39 3.630 3.630 3.913 -0.283 18329
8385 1 10 . 1 1 16 16 ALA C C 39 179.500 179.500 178.913 0.587 18329
8386 1 10 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.492 0.208 18329
8387 1 10 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.348 -0.348 18329
8388 1 10 . 1 1 16 16 ALA H H 39 8.280 8.280 8.156 0.124 18329
8389 1 10 . 1 1 17 17 LYS N N 40 121.690 121.690 118.967 2.723 18329
8390 1 10 . 1 1 17 17 LYS HA H 40 4.090 4.090 4.021 0.069 18329
8391 1 10 . 1 1 17 17 LYS C C 40 178.000 178.000 178.135 -0.135 18329
8392 1 10 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.160 -0.760 18329
8393 1 10 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.387 -0.587 18329
8394 1 10 . 1 1 17 17 LYS H H 40 7.930 7.930 7.892 0.038 18329
8395 1 10 . 1 1 18 18 ASP N N 41 118.730 118.730 118.782 -0.052 18329
8396 1 10 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.483 -0.123 18329
8397 1 10 . 1 1 18 18 ASP C C 41 179.900 179.900 178.621 1.279 18329
8398 1 10 . 1 1 18 18 ASP CA C 41 57.700 57.700 57.067 0.633 18329
8399 1 10 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.404 -0.804 18329
8400 1 10 . 1 1 18 18 ASP H H 41 8.320 8.320 7.861 0.459 18329
8401 1 10 . 1 1 19 19 ILE N N 42 118.180 118.180 119.440 -1.260 18329
8402 1 10 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.697 -0.007 18329
8403 1 10 . 1 1 19 19 ILE C C 42 177.400 177.400 177.828 -0.428 18329
8404 1 10 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.190 0.010 18329
8405 1 10 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.677 0.223 18329
8406 1 10 . 1 1 19 19 ILE H H 42 7.420 7.420 7.194 0.226 18329
8407 1 10 . 1 1 20 20 THR N N 43 113.360 113.360 112.300 1.060 18329
8408 1 10 . 1 1 20 20 THR HA H 43 3.770 3.770 3.988 -0.218 18329
8409 1 10 . 1 1 20 20 THR C C 43 177.800 177.800 176.684 1.116 18329
8410 1 10 . 1 1 20 20 THR CA C 43 66.400 66.400 65.948 0.452 18329
8411 1 10 . 1 1 20 20 THR CB C 43 67.400 67.400 68.415 -1.015 18329
8412 1 10 . 1 1 20 20 THR H H 43 7.610 7.610 7.594 0.016 18329
8413 1 10 . 1 1 21 21 ASP N N 44 123.650 123.650 121.729 1.921 18329
8414 1 10 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.423 -0.013 18329
8415 1 10 . 1 1 21 21 ASP C C 44 179.200 179.200 178.497 0.703 18329
8416 1 10 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.178 0.022 18329
8417 1 10 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.314 -0.714 18329
8418 1 10 . 1 1 21 21 ASP H H 44 9.260 9.260 7.913 1.347 18329
8419 1 10 . 1 1 22 22 GLU N N 45 123.560 123.560 119.056 4.504 18329
8420 1 10 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.196 0.174 18329
8421 1 10 . 1 1 22 22 GLU C C 45 178.500 178.500 179.457 -0.957 18329
8422 1 10 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.712 -0.512 18329
8423 1 10 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.815 -0.615 18329
8424 1 10 . 1 1 22 22 GLU H H 45 7.750 7.750 8.004 -0.254 18329
8425 1 10 . 1 1 23 23 ILE N N 46 119.940 119.940 115.727 4.213 18329
8426 1 10 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.760 -0.140 18329
8427 1 10 . 1 1 23 23 ILE C C 46 177.600 177.600 177.913 -0.313 18329
8428 1 10 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.280 1.320 18329
8429 1 10 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.050 -0.050 18329
8430 1 10 . 1 1 23 23 ILE H H 46 8.360 8.360 7.467 0.893 18329
8431 1 10 . 1 1 24 24 ASP N N 47 120.730 120.730 121.681 -0.951 18329
8432 1 10 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.308 0.092 18329
8433 1 10 . 1 1 24 24 ASP C C 47 178.900 178.900 177.591 1.309 18329
8434 1 10 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.389 0.111 18329
8435 1 10 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.693 -0.793 18329
8436 1 10 . 1 1 24 24 ASP H H 47 8.280 8.280 7.963 0.317 18329
8437 1 10 . 1 1 25 25 ALA N N 48 123.870 123.870 120.734 3.136 18329
8438 1 10 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.021 0.099 18329
8439 1 10 . 1 1 25 25 ALA C C 48 180.400 180.400 179.254 1.146 18329
8440 1 10 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.614 0.886 18329
8441 1 10 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.310 -0.510 18329
8442 1 10 . 1 1 25 25 ALA H H 48 7.880 7.880 7.549 0.331 18329
8443 1 10 . 1 1 26 26 ILE N N 49 121.970 121.970 118.473 3.497 18329
8444 1 10 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.613 0.117 18329
8445 1 10 . 1 1 26 26 ILE C C 49 178.400 178.400 177.505 0.895 18329
8446 1 10 . 1 1 26 26 ILE CA C 49 65.900 65.900 65.214 0.686 18329
8447 1 10 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.796 -0.296 18329
8448 1 10 . 1 1 26 26 ILE H H 49 8.710 8.710 7.566 1.144 18329
8449 1 10 . 1 1 27 27 LYS N N 50 119.820 119.820 118.466 1.354 18329
8450 1 10 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.497 0.383 18329
8451 1 10 . 1 1 27 27 LYS C C 50 179.900 179.900 178.577 1.323 18329
8452 1 10 . 1 1 27 27 LYS CA C 50 60.400 60.400 58.653 1.747 18329
8453 1 10 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.418 0.482 18329
8454 1 10 . 1 1 27 27 LYS H H 50 8.540 8.540 7.602 0.938 18329
8455 1 10 . 1 1 28 28 LYS N N 51 121.960 121.960 120.155 1.805 18329
8456 1 10 . 1 1 28 28 LYS HA H 51 4.090 4.090 3.953 0.137 18329
8457 1 10 . 1 1 28 28 LYS C C 51 179.200 179.200 178.775 0.425 18329
8458 1 10 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.344 -0.044 18329
8459 1 10 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.384 -0.984 18329
8460 1 10 . 1 1 28 28 LYS H H 51 8.070 8.070 7.273 0.797 18329
8461 1 10 . 1 1 29 29 ASP N N 52 121.710 121.710 119.096 2.614 18329
8462 1 10 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.489 -0.019 18329
8463 1 10 . 1 1 29 29 ASP C C 52 178.500 178.500 178.870 -0.370 18329
8464 1 10 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.747 0.253 18329
8465 1 10 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.450 0.550 18329
8466 1 10 . 1 1 29 29 ASP H H 52 8.340 8.340 8.082 0.258 18329
8467 1 10 . 1 1 30 30 ALA N N 53 121.990 121.990 121.672 0.318 18329
8468 1 10 . 1 1 30 30 ALA HA H 53 3.340 3.340 4.042 -0.702 18329
8469 1 10 . 1 1 30 30 ALA C C 53 179.500 179.500 179.104 0.396 18329
8470 1 10 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.570 0.530 18329
8471 1 10 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.166 -0.066 18329
8472 1 10 . 1 1 30 30 ALA H H 53 8.800 8.800 7.926 0.874 18329
8473 1 10 . 1 1 31 31 ALA N N 54 119.970 119.970 120.720 -0.750 18329
8474 1 10 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.056 0.094 18329
8475 1 10 . 1 1 31 31 ALA C C 54 181.600 181.600 178.736 2.864 18329
8476 1 10 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.107 0.593 18329
8477 1 10 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.264 -0.464 18329
8478 1 10 . 1 1 31 31 ALA H H 54 7.730 7.730 7.320 0.410 18329
8479 1 10 . 1 1 32 32 LEU N N 55 119.660 119.660 117.167 2.493 18329
8480 1 10 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.074 0.066 18329
8481 1 10 . 1 1 32 32 LEU C C 55 179.100 179.100 177.414 1.686 18329
8482 1 10 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.350 0.650 18329
8483 1 10 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.918 -0.018 18329
8484 1 10 . 1 1 32 32 LEU H H 55 7.660 7.660 7.332 0.328 18329
8485 1 10 . 1 1 33 33 LYS N N 56 117.160 117.160 117.255 -0.095 18329
8486 1 10 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.449 -0.239 18329
8487 1 10 . 1 1 33 33 LYS C C 56 176.600 176.600 176.223 0.377 18329
8488 1 10 . 1 1 33 33 LYS CA C 56 56.100 56.100 54.487 1.613 18329
8489 1 10 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.522 -0.322 18329
8490 1 10 . 1 1 33 33 LYS H H 56 7.610 7.610 7.352 0.258 18329
8491 1 10 . 1 1 34 34 GLY N N 57 108.680 108.680 110.803 -2.123 18329
8492 1 10 . 1 1 34 34 GLY C C 57 174.400 174.400 173.838 0.562 18329
8493 1 10 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.270 0.930 18329
8494 1 10 . 1 1 34 34 GLY H H 57 7.710 7.710 8.481 -0.771 18329
8495 1 10 . 1 1 35 35 VAL N N 58 121.000 121.000 124.281 -3.281 18329
8496 1 10 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.129 -0.229 18329
8497 1 10 . 1 1 35 35 VAL C C 58 174.200 174.200 175.371 -1.171 18329
8498 1 10 . 1 1 35 35 VAL CA C 58 61.500 61.500 60.737 0.763 18329
8499 1 10 . 1 1 35 35 VAL CB C 58 32.800 32.800 35.256 -2.456 18329
8500 1 10 . 1 1 35 35 VAL H H 58 7.990 7.990 7.493 0.497 18329
8501 1 10 . 1 1 36 36 ASN N N 59 124.960 124.960 124.265 0.695 18329
8502 1 10 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.597 0.073 18329
8503 1 10 . 1 1 36 36 ASN C C 59 175.700 175.700 174.495 1.205 18329
8504 1 10 . 1 1 36 36 ASN CA C 59 51.600 51.600 53.324 -1.724 18329
8505 1 10 . 1 1 36 36 ASN CB C 59 39.100 39.100 36.793 2.307 18329
8506 1 10 . 1 1 36 36 ASN H H 59 8.460 8.460 8.622 -0.162 18329
8507 1 10 . 1 1 37 37 PHE N N 60 124.460 124.460 121.709 2.751 18329
8508 1 10 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.208 -0.068 18329
8509 1 10 . 1 1 37 37 PHE C C 60 177.000 177.000 175.566 1.434 18329
8510 1 10 . 1 1 37 37 PHE CA C 60 60.400 60.400 60.658 -0.258 18329
8511 1 10 . 1 1 37 37 PHE CB C 60 39.200 39.200 39.673 -0.473 18329
8512 1 10 . 1 1 37 37 PHE H H 60 8.780 8.780 7.928 0.852 18329
8513 1 10 . 1 1 38 38 ASP N N 61 119.270 119.270 118.622 0.648 18329
8514 1 10 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.663 -0.173 18329
8515 1 10 . 1 1 38 38 ASP C C 61 177.000 177.000 174.750 2.250 18329
8516 1 10 . 1 1 38 38 ASP CA C 61 55.500 55.500 53.614 1.885 18329
8517 1 10 . 1 1 38 38 ASP CB C 61 40.000 40.000 40.145 -0.145 18329
8518 1 10 . 1 1 38 38 ASP H H 61 8.400 8.400 8.229 0.171 18329
8519 1 10 . 1 1 39 39 ALA N N 62 122.020 122.020 126.364 -4.344 18329
8520 1 10 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.396 -0.196 18329
8521 1 10 . 1 1 39 39 ALA C C 62 178.300 178.300 176.944 1.356 18329
8522 1 10 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.283 0.617 18329
8523 1 10 . 1 1 39 39 ALA CB C 62 18.500 18.500 19.921 -1.421 18329
8524 1 10 . 1 1 39 39 ALA H H 62 7.740 7.740 7.661 0.079 18329
8525 1 10 . 1 1 40 40 PHE N N 63 116.940 116.940 120.014 -3.074 18329
8526 1 10 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.163 0.217 18329
8527 1 10 . 1 1 40 40 PHE C C 63 176.100 176.100 176.874 -0.774 18329
8528 1 10 . 1 1 40 40 PHE CA C 63 58.300 58.300 58.415 -0.115 18329
8529 1 10 . 1 1 40 40 PHE CB C 63 38.800 38.800 38.130 0.670 18329
8530 1 10 . 1 1 40 40 PHE H H 63 7.730 7.730 7.720 0.010 18329
8531 1 10 . 1 1 41 41 LYS N N 64 119.840 119.840 123.977 -4.137 18329
8532 1 10 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.159 0.061 18329
8533 1 10 . 1 1 41 41 LYS C C 64 176.100 176.100 176.324 -0.224 18329
8534 1 10 . 1 1 41 41 LYS CA C 64 56.600 56.600 58.017 -1.417 18329
8535 1 10 . 1 1 41 41 LYS CB C 64 32.900 32.900 33.505 -0.605 18329
8536 1 10 . 1 1 41 41 LYS H H 64 7.650 7.650 8.230 -0.580 18329
8537 1 10 . 1 1 42 42 ASP N N 65 120.770 120.770 115.342 5.428 18329
8538 1 10 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.698 -0.128 18329
8539 1 10 . 1 1 42 42 ASP C C 65 176.100 176.100 175.082 1.018 18329
8540 1 10 . 1 1 42 42 ASP CA C 65 54.200 54.200 53.932 0.268 18329
8541 1 10 . 1 1 42 42 ASP CB C 65 40.900 40.900 41.806 -0.906 18329
8542 1 10 . 1 1 42 42 ASP H H 65 8.030 8.030 8.425 -0.395 18329
8543 1 10 . 1 1 43 43 LYS N N 66 122.070 122.070 122.804 -0.734 18329
8544 1 10 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.363 -0.083 18329
8545 1 10 . 1 1 43 43 LYS C C 66 176.800 176.800 177.145 -0.345 18329
8546 1 10 . 1 1 43 43 LYS CA C 66 56.500 56.500 56.485 0.015 18329
8547 1 10 . 1 1 43 43 LYS CB C 66 32.800 32.800 32.762 0.038 18329
8548 1 10 . 1 1 43 43 LYS H H 66 8.180 8.180 8.321 -0.141 18329
8549 1 10 . 1 1 44 44 LYS N N 67 122.170 122.170 122.029 0.141 18329
8550 1 10 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.449 -0.099 18329
8551 1 10 . 1 1 44 44 LYS C C 67 177.000 177.000 176.707 0.293 18329
8552 1 10 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.286 0.314 18329
8553 1 10 . 1 1 44 44 LYS CB C 67 32.800 32.800 33.047 -0.248 18329
8554 1 10 . 1 1 44 44 LYS H H 67 8.460 8.460 8.406 0.054 18329
8555 1 10 . 1 1 45 45 THR N N 68 114.390 114.390 114.590 -0.200 18329
8556 1 10 . 1 1 45 45 THR HA H 68 4.330 4.330 4.110 0.220 18329
8557 1 10 . 1 1 45 45 THR C C 68 175.200 175.200 173.950 1.250 18329
8558 1 10 . 1 1 45 45 THR CA C 68 62.000 62.000 62.146 -0.146 18329
8559 1 10 . 1 1 45 45 THR CB C 68 69.900 69.900 68.724 1.176 18329
8560 1 10 . 1 1 45 45 THR H H 68 8.120 8.120 7.669 0.451 18329
8561 1 10 . 1 1 46 46 GLY N N 69 111.200 111.200 113.007 -1.807 18329
8562 1 10 . 1 1 46 46 GLY CA C 69 45.200 45.200 44.570 0.630 18329
8563 1 10 . 1 1 46 46 GLY H H 69 8.450 8.450 8.237 0.213 18329
8564 1 10 . 1 1 47 47 SER CA C 70 58.400 58.400 58.028 0.372 18329
8565 1 10 . 1 1 47 47 SER CB C 70 64.000 64.000 63.996 0.004 18329
8566 1 10 . 1 1 48 48 GLY N N 71 111.200 111.200 111.302 -0.102 18329
8567 1 10 . 1 1 48 48 GLY CA C 71 45.000 45.000 45.900 -0.900 18329
8568 1 10 . 1 1 48 48 GLY H H 71 8.580 8.580 8.646 -0.066 18329
8569 1 10 . 1 1 49 49 VAL N N 72 118.910 118.910 117.116 1.794 18329
8570 1 10 . 1 1 49 49 VAL HA H 72 4.130 4.130 4.601 -0.471 18329
8571 1 10 . 1 1 49 49 VAL C C 72 176.100 176.100 174.701 1.399 18329
8572 1 10 . 1 1 49 49 VAL CA C 72 62.100 62.100 61.358 0.742 18329
8573 1 10 . 1 1 49 49 VAL CB C 72 32.500 32.500 33.150 -0.650 18329
8574 1 10 . 1 1 49 49 VAL H H 72 7.860 7.860 7.765 0.095 18329
8575 1 10 . 1 1 50 50 SER N N 73 118.500 118.500 121.768 -3.268 18329
8576 1 10 . 1 1 50 50 SER C C 73 176.100 176.100 174.943 1.157 18329
8577 1 10 . 1 1 50 50 SER CA C 73 58.300 58.300 59.284 -0.984 18329
8578 1 10 . 1 1 50 50 SER CB C 73 63.800 63.800 63.650 0.150 18329
8579 1 10 . 1 1 50 50 SER H H 73 8.300 8.300 8.786 -0.486 18329
8580 1 10 . 1 1 51 51 GLU N N 74 122.560 122.560 122.514 0.046 18329
8581 1 10 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.390 -0.120 18329
8582 1 10 . 1 1 51 51 GLU CA C 74 55.700 55.700 57.045 -1.345 18329
8583 1 10 . 1 1 51 51 GLU CB C 74 30.500 30.500 30.588 -0.088 18329
8584 1 10 . 1 1 51 51 GLU H H 74 8.360 8.360 8.638 -0.278 18329
8585 1 10 . 1 1 52 52 ASN N N 75 122.830 122.830 113.595 9.235 18329
8586 1 10 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.794 0.026 18329
8587 1 10 . 1 1 52 52 ASN C C 75 174.800 174.800 173.241 1.559 18329
8588 1 10 . 1 1 52 52 ASN CA C 75 51.400 51.400 52.285 -0.885 18329
8589 1 10 . 1 1 52 52 ASN CB C 75 39.200 39.200 36.709 2.491 18329
8590 1 10 . 1 1 52 52 ASN H H 75 8.450 8.450 7.815 0.635 18329
8591 1 10 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.224 -0.044 18329
8592 1 10 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.885 0.315 18329
8593 1 10 . 1 1 53 53 PRO CB C 76 32.000 32.000 31.917 0.083 18329
8594 1 10 . 1 1 54 54 PHE N N 77 118.060 118.060 118.283 -0.223 18329
8595 1 10 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.248 0.022 18329
8596 1 10 . 1 1 54 54 PHE C C 77 177.500 177.500 177.634 -0.134 18329
8597 1 10 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.895 -0.395 18329
8598 1 10 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.230 0.170 18329
8599 1 10 . 1 1 54 54 PHE H H 77 8.430 8.430 8.102 0.328 18329
8600 1 10 . 1 1 55 55 ILE N N 78 119.350 119.350 119.252 0.098 18329
8601 1 10 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.697 -0.197 18329
8602 1 10 . 1 1 55 55 ILE C C 78 177.400 177.400 177.732 -0.332 18329
8603 1 10 . 1 1 55 55 ILE CA C 78 63.500 63.500 65.314 -1.814 18329
8604 1 10 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.824 -0.824 18329
8605 1 10 . 1 1 55 55 ILE H H 78 7.540 7.540 8.002 -0.462 18329
8606 1 10 . 1 1 56 56 LEU N N 79 118.450 118.450 120.034 -1.584 18329
8607 1 10 . 1 1 56 56 LEU HA H 79 4.150 4.150 3.833 0.317 18329
8608 1 10 . 1 1 56 56 LEU C C 79 179.200 179.200 179.265 -0.065 18329
8609 1 10 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.093 -0.293 18329
8610 1 10 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.232 -0.132 18329
8611 1 10 . 1 1 56 56 LEU H H 79 7.260 7.260 7.586 -0.326 18329
8612 1 10 . 1 1 57 57 GLU N N 80 117.980 117.980 117.406 0.574 18329
8613 1 10 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.935 -0.285 18329
8614 1 10 . 1 1 57 57 GLU C C 80 178.700 178.700 178.983 -0.283 18329
8615 1 10 . 1 1 57 57 GLU CA C 80 59.300 59.300 59.016 0.284 18329
8616 1 10 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.447 0.053 18329
8617 1 10 . 1 1 57 57 GLU H H 80 7.890 7.890 8.156 -0.266 18329
8618 1 10 . 1 1 58 58 ALA N N 81 122.040 122.040 122.393 -0.353 18329
8619 1 10 . 1 1 58 58 ALA HA H 81 3.800 3.800 3.998 -0.198 18329
8620 1 10 . 1 1 58 58 ALA C C 81 179.500 179.500 179.083 0.417 18329
8621 1 10 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.863 0.337 18329
8622 1 10 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.209 0.591 18329
8623 1 10 . 1 1 58 58 ALA H H 81 8.400 8.400 7.714 0.686 18329
8624 1 10 . 1 1 59 59 LYS N N 82 116.000 116.000 118.055 -2.055 18329
8625 1 10 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.062 -0.212 18329
8626 1 10 . 1 1 59 59 LYS C C 82 180.300 180.300 178.762 1.538 18329
8627 1 10 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.090 2.010 18329
8628 1 10 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.425 -0.225 18329
8629 1 10 . 1 1 59 59 LYS H H 82 8.000 8.000 8.210 -0.210 18329
8630 1 10 . 1 1 60 60 VAL N N 83 122.920 122.920 118.191 4.729 18329
8631 1 10 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.715 -0.385 18329
8632 1 10 . 1 1 60 60 VAL C C 83 178.300 178.300 178.078 0.222 18329
8633 1 10 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.570 2.330 18329
8634 1 10 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.744 -0.544 18329
8635 1 10 . 1 1 60 60 VAL H H 83 8.110 8.110 7.446 0.664 18329
8636 1 10 . 1 1 61 61 ARG N N 84 121.770 121.770 119.831 1.939 18329
8637 1 10 . 1 1 61 61 ARG C C 84 179.500 179.500 178.558 0.942 18329
8638 1 10 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.255 -0.055 18329
8639 1 10 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.866 0.934 18329
8640 1 10 . 1 1 61 61 ARG H H 84 8.710 8.710 7.508 1.202 18329
8641 1 10 . 1 1 62 62 ALA N N 85 119.450 119.450 121.062 -1.612 18329
8642 1 10 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.108 -0.218 18329
8643 1 10 . 1 1 62 62 ALA C C 85 179.500 179.500 178.798 0.702 18329
8644 1 10 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.211 -0.211 18329
8645 1 10 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.584 0.416 18329
8646 1 10 . 1 1 62 62 ALA H H 85 8.700 8.700 7.799 0.901 18329
8647 1 10 . 1 1 63 63 THR N N 86 106.650 106.650 110.585 -3.935 18329
8648 1 10 . 1 1 63 63 THR HA H 86 3.970 3.970 4.032 -0.062 18329
8649 1 10 . 1 1 63 63 THR C C 86 177.700 177.700 176.890 0.810 18329
8650 1 10 . 1 1 63 63 THR CA C 86 66.000 66.000 65.850 0.150 18329
8651 1 10 . 1 1 63 63 THR CB C 86 68.200 68.200 68.559 -0.359 18329
8652 1 10 . 1 1 63 63 THR H H 86 8.150 8.150 7.744 0.406 18329
8653 1 10 . 1 1 64 64 THR N N 87 120.430 120.430 119.835 0.595 18329
8654 1 10 . 1 1 64 64 THR HA H 87 4.050 4.050 4.059 -0.009 18329
8655 1 10 . 1 1 64 64 THR C C 87 176.800 176.800 176.357 0.443 18329
8656 1 10 . 1 1 64 64 THR CA C 87 67.300 67.300 67.692 -0.392 18329
8657 1 10 . 1 1 64 64 THR CB C 87 68.600 68.600 68.391 0.209 18329
8658 1 10 . 1 1 64 64 THR H H 87 7.920 7.920 7.499 0.421 18329
8659 1 10 . 1 1 65 65 VAL N N 88 119.230 119.230 120.766 -1.536 18329
8660 1 10 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.698 0.282 18329
8661 1 10 . 1 1 65 65 VAL C C 88 178.500 178.500 177.500 1.000 18329
8662 1 10 . 1 1 65 65 VAL CA C 88 65.600 65.600 66.455 -0.855 18329
8663 1 10 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.493 0.207 18329
8664 1 10 . 1 1 65 65 VAL H H 88 7.380 7.380 7.351 0.029 18329
8665 1 10 . 1 1 66 66 ALA N N 89 124.260 124.260 121.584 2.676 18329
8666 1 10 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.898 0.352 18329
8667 1 10 . 1 1 66 66 ALA C C 89 179.900 179.900 179.178 0.722 18329
8668 1 10 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.614 -0.713 18329
8669 1 10 . 1 1 66 66 ALA CB C 89 19.500 19.500 17.946 1.554 18329
8670 1 10 . 1 1 66 66 ALA H H 89 8.390 8.390 7.727 0.663 18329
8671 1 10 . 1 1 67 67 GLU N N 90 120.180 120.180 118.641 1.539 18329
8672 1 10 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.946 -0.226 18329
8673 1 10 . 1 1 67 67 GLU C C 90 177.600 177.600 178.808 -1.208 18329
8674 1 10 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.406 0.494 18329
8675 1 10 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.344 -1.044 18329
8676 1 10 . 1 1 67 67 GLU H H 90 8.520 8.520 8.303 0.217 18329
8677 1 10 . 1 1 68 68 LYS N N 91 116.340 116.340 118.147 -1.807 18329
8678 1 10 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.022 -0.062 18329
8679 1 10 . 1 1 68 68 LYS C C 91 179.200 179.200 179.126 0.074 18329
8680 1 10 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.657 1.143 18329
8681 1 10 . 1 1 68 68 LYS CB C 91 32.000 32.000 31.994 0.006 18329
8682 1 10 . 1 1 68 68 LYS H H 91 7.210 7.210 7.443 -0.233 18329
8683 1 10 . 1 1 69 69 PHE N N 92 120.990 120.990 119.941 1.049 18329
8684 1 10 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.238 0.272 18329
8685 1 10 . 1 1 69 69 PHE C C 92 175.100 175.100 177.380 -2.280 18329
8686 1 10 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.076 -1.276 18329
8687 1 10 . 1 1 69 69 PHE CB C 92 39.200 39.200 38.917 0.283 18329
8688 1 10 . 1 1 69 69 PHE H H 92 7.180 7.180 7.874 -0.694 18329
8689 1 10 . 1 1 70 70 VAL N N 93 120.330 120.330 118.837 1.493 18329
8690 1 10 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.509 -0.419 18329
8691 1 10 . 1 1 70 70 VAL C C 93 177.500 177.500 177.608 -0.108 18329
8692 1 10 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.835 0.065 18329
8693 1 10 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.283 0.117 18329
8694 1 10 . 1 1 70 70 VAL H H 93 7.930 7.930 7.519 0.411 18329
8695 1 10 . 1 1 71 71 ILE N N 94 120.410 120.410 118.899 1.511 18329
8696 1 10 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.574 0.256 18329
8697 1 10 . 1 1 71 71 ILE C C 94 177.700 177.700 177.283 0.417 18329
8698 1 10 . 1 1 71 71 ILE CA C 94 65.000 65.000 64.937 0.063 18329
8699 1 10 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.050 0.250 18329
8700 1 10 . 1 1 71 71 ILE H H 94 8.180 8.180 7.191 0.989 18329
8701 1 10 . 1 1 72 72 ALA N N 95 122.440 122.440 122.559 -0.119 18329
8702 1 10 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.932 0.028 18329
8703 1 10 . 1 1 72 72 ALA C C 95 179.600 179.600 179.554 0.046 18329
8704 1 10 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.004 0.896 18329
8705 1 10 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.892 -0.692 18329
8706 1 10 . 1 1 72 72 ALA H H 95 7.340 7.340 7.426 -0.086 18329
8707 1 10 . 1 1 73 73 ILE N N 96 119.330 119.330 120.259 -0.929 18329
8708 1 10 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.663 -0.223 18329
8709 1 10 . 1 1 73 73 ILE C C 96 177.400 177.400 177.935 -0.535 18329
8710 1 10 . 1 1 73 73 ILE CA C 96 62.800 62.800 64.009 -1.209 18329
8711 1 10 . 1 1 73 73 ILE CB C 96 34.400 34.400 37.278 -2.878 18329
8712 1 10 . 1 1 73 73 ILE H H 96 7.820 7.820 7.282 0.538 18329
8713 1 10 . 1 1 74 74 GLU N N 97 118.440 118.440 120.600 -2.160 18329
8714 1 10 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.878 -0.188 18329
8715 1 10 . 1 1 74 74 GLU C C 97 180.500 180.500 178.780 1.720 18329
8716 1 10 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.688 0.012 18329
8717 1 10 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.349 0.351 18329
8718 1 10 . 1 1 74 74 GLU H H 97 8.380 8.380 7.620 0.760 18329
8719 1 10 . 1 1 75 75 GLU N N 98 120.470 120.470 119.928 0.542 18329
8720 1 10 . 1 1 75 75 GLU HA H 98 3.940 3.940 3.997 -0.057 18329
8721 1 10 . 1 1 75 75 GLU C C 98 180.600 180.600 179.038 1.562 18329
8722 1 10 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.450 0.250 18329
8723 1 10 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.670 0.530 18329
8724 1 10 . 1 1 75 75 GLU H H 98 8.800 8.800 8.539 0.261 18329
8725 1 10 . 1 1 76 76 GLU N N 99 119.230 119.230 118.681 0.549 18329
8726 1 10 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.058 0.082 18329
8727 1 10 . 1 1 76 76 GLU C C 99 178.900 178.900 179.006 -0.106 18329
8728 1 10 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.797 -0.197 18329
8729 1 10 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.266 0.034 18329
8730 1 10 . 1 1 76 76 GLU H H 99 8.840 8.840 8.464 0.376 18329
8731 1 10 . 1 1 77 77 ALA N N 100 121.950 121.950 122.203 -0.253 18329
8732 1 10 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.191 -0.191 18329
8733 1 10 . 1 1 77 77 ALA C C 100 179.000 179.000 179.792 -0.792 18329
8734 1 10 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.313 0.987 18329
8735 1 10 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.204 -1.405 18329
8736 1 10 . 1 1 77 77 ALA H H 100 9.400 9.400 8.240 1.160 18329
8737 1 10 . 1 1 78 78 THR N N 101 111.820 111.820 114.353 -2.533 18329
8738 1 10 . 1 1 78 78 THR HA H 101 3.750 3.750 4.039 -0.289 18329
8739 1 10 . 1 1 78 78 THR CA C 101 67.500 67.500 66.362 1.138 18329
8740 1 10 . 1 1 78 78 THR CB C 101 68.600 68.600 68.531 0.069 18329
8741 1 10 . 1 1 78 78 THR H H 101 7.770 7.770 7.730 0.040 18329
8742 1 10 . 1 1 79 79 LYS N N 102 122.940 122.940 121.479 1.461 18329
8743 1 10 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.184 -0.094 18329
8744 1 10 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.605 0.595 18329
8745 1 10 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.213 0.287 18329
8746 1 10 . 1 1 79 79 LYS H H 102 7.870 7.870 7.645 0.225 18329
8747 1 10 . 1 1 80 80 LEU N N 103 117.690 117.690 118.812 -1.122 18329
8748 1 10 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.331 0.159 18329
8749 1 10 . 1 1 80 80 LEU C C 103 178.140 178.140 176.385 1.755 18329
8750 1 10 . 1 1 80 80 LEU CA C 103 54.000 54.000 54.907 -0.908 18329
8751 1 10 . 1 1 80 80 LEU CB C 103 43.100 43.100 42.511 0.589 18329
8752 1 10 . 1 1 80 80 LEU H H 103 7.550 7.550 7.892 -0.342 18329
8753 1 10 . 1 1 81 81 LYS N N 104 122.210 122.210 120.167 2.043 18329
8754 1 10 . 1 1 81 81 LYS HA H 104 3.930 3.930 4.216 -0.286 18329
8755 1 10 . 1 1 81 81 LYS C C 104 178.000 178.000 176.476 1.524 18329
8756 1 10 . 1 1 81 81 LYS CA C 104 61.300 61.300 57.598 3.702 18329
8757 1 10 . 1 1 81 81 LYS CB C 104 32.800 32.800 31.491 1.310 18329
8758 1 10 . 1 1 81 81 LYS H H 104 7.500 7.500 7.532 -0.032 18329
8759 1 10 . 1 1 82 82 GLU N N 105 114.920 114.920 122.730 -7.810 18329
8760 1 10 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.445 0.115 18329
8761 1 10 . 1 1 82 82 GLU C C 105 177.900 177.900 177.512 0.388 18329
8762 1 10 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.700 -0.040 18329
8763 1 10 . 1 1 82 82 GLU CB C 105 30.400 30.400 30.938 -0.538 18329
8764 1 10 . 1 1 82 82 GLU H H 105 8.780 8.780 8.875 -0.095 18329
8765 1 10 . 1 1 83 83 THR N N 106 107.260 107.260 113.644 -6.384 18329
8766 1 10 . 1 1 83 83 THR HA H 106 4.550 4.550 4.374 0.176 18329
8767 1 10 . 1 1 83 83 THR C C 106 176.300 176.300 175.854 0.446 18329
8768 1 10 . 1 1 83 83 THR CA C 106 61.900 61.900 62.133 -0.233 18329
8769 1 10 . 1 1 83 83 THR CB C 106 70.400 70.400 69.941 0.459 18329
8770 1 10 . 1 1 83 83 THR H H 106 7.570 7.570 8.264 -0.694 18329
8771 1 10 . 1 1 84 84 GLY N N 107 112.110 112.110 112.056 0.054 18329
8772 1 10 . 1 1 84 84 GLY C C 107 172.800 172.800 175.130 -2.330 18329
8773 1 10 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.636 -0.236 18329
8774 1 10 . 1 1 84 84 GLY H H 107 9.000 9.000 8.553 0.447 18329
8775 1 10 . 1 1 85 85 SER N N 108 119.030 119.030 114.647 4.383 18329
8776 1 10 . 1 1 85 85 SER CA C 108 56.300 56.300 59.698 -3.398 18329
8777 1 10 . 1 1 85 85 SER CB C 108 66.300 66.300 63.853 2.447 18329
8778 1 10 . 1 1 85 85 SER H H 108 8.950 8.950 8.336 0.614 18329
8779 1 10 . 1 1 86 86 SER HA H 109 4.480 4.480 4.741 -0.261 18329
8780 1 10 . 1 1 86 86 SER C C 109 177.000 177.000 176.652 0.348 18329
8781 1 10 . 1 1 86 86 SER CA C 109 61.600 61.600 58.913 2.687 18329
8782 1 10 . 1 1 86 86 SER CB C 109 62.900 62.900 63.300 -0.400 18329
8783 1 10 . 1 1 87 87 GLY N N 110 108.100 108.100 110.884 -2.784 18329
8784 1 10 . 1 1 87 87 GLY C C 110 177.100 177.100 175.734 1.366 18329
8785 1 10 . 1 1 87 87 GLY CA C 110 46.200 46.200 47.103 -0.903 18329
8786 1 10 . 1 1 87 87 GLY H H 110 8.480 8.480 8.491 -0.011 18329
8787 1 10 . 1 1 88 88 GLU N N 111 123.040 123.040 122.395 0.645 18329
8788 1 10 . 1 1 88 88 GLU HA H 111 3.690 3.690 3.942 -0.252 18329
8789 1 10 . 1 1 88 88 GLU C C 111 177.700 177.700 178.503 -0.803 18329
8790 1 10 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.833 0.667 18329
8791 1 10 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.115 -0.415 18329
8792 1 10 . 1 1 88 88 GLU H H 111 7.560 7.560 7.700 -0.140 18329
8793 1 10 . 1 1 89 89 PHE N N 112 118.270 118.270 117.629 0.641 18329
8794 1 10 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.367 0.053 18329
8795 1 10 . 1 1 89 89 PHE C C 112 178.600 178.600 178.067 0.533 18329
8796 1 10 . 1 1 89 89 PHE CA C 112 61.100 61.100 60.716 0.384 18329
8797 1 10 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.602 -0.702 18329
8798 1 10 . 1 1 89 89 PHE H H 112 7.200 7.200 7.338 -0.138 18329
8799 1 10 . 1 1 90 90 SER N N 113 115.980 115.980 115.470 0.510 18329
8800 1 10 . 1 1 90 90 SER HA H 113 4.290 4.290 4.145 0.145 18329
8801 1 10 . 1 1 90 90 SER C C 113 178.600 178.600 176.588 2.012 18329
8802 1 10 . 1 1 90 90 SER CA C 113 62.700 62.700 61.619 1.081 18329
8803 1 10 . 1 1 90 90 SER CB C 113 62.800 62.800 63.028 -0.228 18329
8804 1 10 . 1 1 90 90 SER H H 113 8.830 8.830 7.720 1.110 18329
8805 1 10 . 1 1 91 91 ALA N N 114 123.130 123.130 122.959 0.171 18329
8806 1 10 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.101 0.279 18329
8807 1 10 . 1 1 91 91 ALA C C 114 181.300 181.300 179.357 1.943 18329
8808 1 10 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.962 -0.262 18329
8809 1 10 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.259 0.141 18329
8810 1 10 . 1 1 91 91 ALA H H 114 7.580 7.580 7.758 -0.178 18329
8811 1 10 . 1 1 92 92 MET N N 115 118.700 118.700 118.915 -0.215 18329
8812 1 10 . 1 1 92 92 MET HA H 115 3.980 3.980 4.229 -0.249 18329
8813 1 10 . 1 1 92 92 MET C C 115 178.000 178.000 177.779 0.221 18329
8814 1 10 . 1 1 92 92 MET CA C 115 61.000 61.000 57.866 3.134 18329
8815 1 10 . 1 1 92 92 MET CB C 115 31.400 31.400 32.533 -1.133 18329
8816 1 10 . 1 1 92 92 MET H H 115 7.880 7.880 7.662 0.218 18329
8817 1 10 . 1 1 93 93 TYR N N 116 119.200 119.200 119.916 -0.716 18329
8818 1 10 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.104 0.176 18329
8819 1 10 . 1 1 93 93 TYR C C 116 176.300 176.300 177.362 -1.062 18329
8820 1 10 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.605 0.495 18329
8821 1 10 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.255 0.045 18329
8822 1 10 . 1 1 93 93 TYR H H 116 7.870 7.870 7.913 -0.043 18329
8823 1 10 . 1 1 94 94 ASP N N 117 120.210 120.210 119.572 0.638 18329
8824 1 10 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.493 -0.303 18329
8825 1 10 . 1 1 94 94 ASP C C 117 179.000 179.000 178.574 0.426 18329
8826 1 10 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.145 0.555 18329
8827 1 10 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.541 -0.541 18329
8828 1 10 . 1 1 94 94 ASP H H 117 8.720 8.720 7.756 0.964 18329
8829 1 10 . 1 1 95 95 LEU N N 118 118.420 118.420 120.077 -1.657 18329
8830 1 10 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.118 0.092 18329
8831 1 10 . 1 1 95 95 LEU C C 118 178.600 178.600 179.122 -0.522 18329
8832 1 10 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.964 -0.264 18329
8833 1 10 . 1 1 95 95 LEU CB C 118 43.100 43.100 41.703 1.397 18329
8834 1 10 . 1 1 95 95 LEU H H 118 7.510 7.510 7.823 -0.313 18329
8835 1 10 . 1 1 96 96 MET N N 119 118.470 118.470 118.414 0.056 18329
8836 1 10 . 1 1 96 96 MET HA H 119 3.990 3.990 4.158 -0.168 18329
8837 1 10 . 1 1 96 96 MET C C 119 177.500 177.500 178.099 -0.599 18329
8838 1 10 . 1 1 96 96 MET CA C 119 60.500 60.500 57.738 2.762 18329
8839 1 10 . 1 1 96 96 MET CB C 119 33.900 33.900 32.060 1.839 18329
8840 1 10 . 1 1 96 96 MET H H 119 7.820 7.820 7.646 0.174 18329
8841 1 10 . 1 1 97 97 PHE N N 120 119.580 119.580 120.408 -0.828 18329
8842 1 10 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.113 -0.303 18329
8843 1 10 . 1 1 97 97 PHE C C 120 178.800 178.800 177.145 1.655 18329
8844 1 10 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.250 0.550 18329
8845 1 10 . 1 1 97 97 PHE CB C 120 39.200 39.200 39.387 -0.187 18329
8846 1 10 . 1 1 97 97 PHE H H 120 8.940 8.940 7.699 1.241 18329
8847 1 10 . 1 1 98 98 GLU N N 121 119.940 119.940 119.034 0.906 18329
8848 1 10 . 1 1 98 98 GLU HA H 121 3.880 3.880 3.984 -0.104 18329
8849 1 10 . 1 1 98 98 GLU C C 121 180.800 180.800 179.443 1.357 18329
8850 1 10 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.289 0.511 18329
8851 1 10 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.667 -0.467 18329
8852 1 10 . 1 1 98 98 GLU H H 121 8.690 8.690 8.393 0.297 18329
8853 1 10 . 1 1 99 99 VAL N N 122 115.350 115.350 119.320 -3.970 18329
8854 1 10 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.761 -0.021 18329
8855 1 10 . 1 1 99 99 VAL C C 122 176.500 176.500 176.668 -0.168 18329
8856 1 10 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.156 0.343 18329
8857 1 10 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.214 0.086 18329
8858 1 10 . 1 1 99 99 VAL H H 122 8.210 8.210 8.142 0.068 18329
8859 1 10 . 1 1 100 100 SER N N 123 115.450 115.450 114.441 1.009 18329
8860 1 10 . 1 1 100 100 SER HA H 123 4.270 4.270 4.136 0.134 18329
8861 1 10 . 1 1 100 100 SER C C 123 174.700 174.700 176.035 -1.335 18329
8862 1 10 . 1 1 100 100 SER CA C 123 62.000 62.000 60.608 1.393 18329
8863 1 10 . 1 1 100 100 SER H H 123 7.520 7.520 7.555 -0.035 18329
8864 1 10 . 1 1 101 101 LYS N N 124 120.310 120.310 121.109 -0.799 18329
8865 1 10 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.165 -0.195 18329
8866 1 10 . 1 1 101 101 LYS C C 124 176.600 176.600 176.493 0.107 18329
8867 1 10 . 1 1 101 101 LYS CA C 124 61.100 61.100 60.081 1.019 18329
8868 1 10 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.424 -1.924 18329
8869 1 10 . 1 1 101 101 LYS H H 124 6.930 6.930 7.191 -0.261 18329
8870 1 10 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.210 0.050 18329
8871 1 10 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.379 -0.179 18329
8872 1 10 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.220 -0.620 18329
8873 1 10 . 1 1 103 103 LEU N N 126 116.020 116.020 119.319 -3.299 18329
8874 1 10 . 1 1 103 103 LEU HA H 126 3.880 3.880 3.985 -0.105 18329
8875 1 10 . 1 1 103 103 LEU C C 126 177.900 177.900 179.119 -1.219 18329
8876 1 10 . 1 1 103 103 LEU CA C 126 57.700 57.700 58.012 -0.312 18329
8877 1 10 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.065 0.735 18329
8878 1 10 . 1 1 103 103 LEU H H 126 6.520 6.520 7.551 -1.031 18329
8879 1 10 . 1 1 104 104 GLN N N 127 120.500 120.500 117.777 2.723 18329
8880 1 10 . 1 1 104 104 GLN C C 127 180.600 180.600 178.697 1.903 18329
8881 1 10 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.565 -0.265 18329
8882 1 10 . 1 1 104 104 GLN CB C 127 29.000 29.000 27.678 1.322 18329
8883 1 10 . 1 1 104 104 GLN H H 127 8.160 8.160 7.823 0.337 18329
8884 1 10 . 1 1 105 105 LYS N N 128 120.000 120.000 118.764 1.236 18329
8885 1 10 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.044 0.006 18329
8886 1 10 . 1 1 105 105 LYS C C 128 177.100 177.100 177.499 -0.399 18329
8887 1 10 . 1 1 105 105 LYS CA C 128 58.500 58.500 58.383 0.117 18329
8888 1 10 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.236 -0.836 18329
8889 1 10 . 1 1 105 105 LYS H H 128 7.810 7.810 7.591 0.219 18329
8890 1 10 . 1 1 106 106 LEU N N 129 118.530 118.530 115.357 3.173 18329
8891 1 10 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.411 -0.441 18329
8892 1 10 . 1 1 106 106 LEU C C 129 175.200 175.200 176.297 -1.097 18329
8893 1 10 . 1 1 106 106 LEU CA C 129 54.500 54.500 54.194 0.306 18329
8894 1 10 . 1 1 106 106 LEU CB C 129 42.400 42.400 42.746 -0.346 18329
8895 1 10 . 1 1 106 106 LEU H H 129 7.220 7.220 8.047 -0.827 18329
8896 1 10 . 1 1 107 107 GLY N N 130 101.490 101.490 106.439 -4.949 18329
8897 1 10 . 1 1 107 107 GLY C C 130 174.800 174.800 175.214 -0.414 18329
8898 1 10 . 1 1 107 107 GLY CA C 130 45.100 45.100 45.188 -0.088 18329
8899 1 10 . 1 1 107 107 GLY H H 130 7.560 7.560 7.438 0.122 18329
8900 1 10 . 1 1 108 108 ILE N N 131 121.340 121.340 119.704 1.636 18329
8901 1 10 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.888 0.262 18329
8902 1 10 . 1 1 108 108 ILE C C 131 174.300 174.300 175.364 -1.064 18329
8903 1 10 . 1 1 108 108 ILE CA C 131 60.400 60.400 60.699 -0.299 18329
8904 1 10 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.295 -2.095 18329
8905 1 10 . 1 1 108 108 ILE H H 131 7.290 7.290 7.272 0.018 18329
8906 1 10 . 1 1 109 109 GLN N N 132 125.650 125.650 120.085 5.565 18329
8907 1 10 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.031 -0.021 18329
8908 1 10 . 1 1 109 109 GLN C C 132 176.800 176.800 176.134 0.666 18329
8909 1 10 . 1 1 109 109 GLN CA C 132 57.600 57.600 57.757 -0.157 18329
8910 1 10 . 1 1 109 109 GLN CB C 132 29.000 29.000 28.468 0.531 18329
8911 1 10 . 1 1 109 109 GLN H H 132 8.080 8.080 7.898 0.182 18329
8912 1 10 . 1 1 110 110 GLU N N 133 114.890 114.890 122.776 -7.886 18329
8913 1 10 . 1 1 110 110 GLU HA H 133 4.150 4.150 4.190 -0.040 18329
8914 1 10 . 1 1 110 110 GLU C C 133 177.100 177.100 176.645 0.455 18329
8915 1 10 . 1 1 110 110 GLU CA C 133 57.100 57.100 57.305 -0.205 18329
8916 1 10 . 1 1 110 110 GLU CB C 133 27.300 27.300 29.665 -2.365 18329
8917 1 10 . 1 1 110 110 GLU H H 133 9.270 9.270 8.842 0.428 18329
8918 1 10 . 1 1 111 111 MET N N 134 121.210 121.210 119.890 1.320 18329
8919 1 10 . 1 1 111 111 MET HA H 134 4.350 4.350 4.269 0.081 18329
8920 1 10 . 1 1 111 111 MET C C 134 177.500 177.500 178.274 -0.774 18329
8921 1 10 . 1 1 111 111 MET CA C 134 57.900 57.900 59.295 -1.395 18329
8922 1 10 . 1 1 111 111 MET CB C 134 33.300 33.300 31.652 1.648 18329
8923 1 10 . 1 1 111 111 MET H H 134 7.620 7.620 8.299 -0.679 18329
8924 1 10 . 1 1 112 112 THR N N 135 113.170 113.170 112.613 0.557 18329
8925 1 10 . 1 1 112 112 THR HA H 135 3.920 3.920 4.045 -0.125 18329
8926 1 10 . 1 1 112 112 THR C C 135 176.400 176.400 176.705 -0.305 18329
8927 1 10 . 1 1 112 112 THR CA C 135 65.900 65.900 66.236 -0.335 18329
8928 1 10 . 1 1 112 112 THR CB C 135 68.200 68.200 67.997 0.203 18329
8929 1 10 . 1 1 112 112 THR H H 135 8.320 8.320 8.381 -0.061 18329
8930 1 10 . 1 1 113 113 LYS N N 136 123.440 123.440 121.853 1.587 18329
8931 1 10 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.208 -0.278 18329
8932 1 10 . 1 1 113 113 LYS C C 136 177.600 177.600 178.382 -0.782 18329
8933 1 10 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.640 -1.340 18329
8934 1 10 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.086 -0.086 18329
8935 1 10 . 1 1 113 113 LYS H H 136 8.060 8.060 7.775 0.285 18329
8936 1 10 . 1 1 114 114 THR N N 137 114.590 114.590 118.054 -3.464 18329
8937 1 10 . 1 1 114 114 THR HA H 137 4.000 4.000 4.050 -0.050 18329
8938 1 10 . 1 1 114 114 THR C C 137 176.800 176.800 176.629 0.171 18329
8939 1 10 . 1 1 114 114 THR CA C 137 67.600 67.600 67.263 0.337 18329
8940 1 10 . 1 1 114 114 THR CB C 137 69.200 69.200 68.572 0.628 18329
8941 1 10 . 1 1 114 114 THR H H 137 7.950 7.950 8.701 -0.751 18329
8942 1 10 . 1 1 115 115 VAL N N 138 119.080 119.080 120.479 -1.399 18329
8943 1 10 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.704 0.116 18329
8944 1 10 . 1 1 115 115 VAL C C 138 176.900 176.900 177.249 -0.349 18329
8945 1 10 . 1 1 115 115 VAL CA C 138 66.800 66.800 66.108 0.693 18329
8946 1 10 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.655 0.845 18329
8947 1 10 . 1 1 115 115 VAL H H 138 7.320 7.320 8.522 -1.202 18329
8948 1 10 . 1 1 116 116 SER N N 139 116.630 116.630 115.289 1.341 18329
8949 1 10 . 1 1 116 116 SER HA H 139 4.680 4.680 4.390 0.290 18329
8950 1 10 . 1 1 116 116 SER C C 139 179.000 179.000 176.597 2.403 18329
8951 1 10 . 1 1 116 116 SER CA C 139 61.400 61.400 61.422 -0.022 18329
8952 1 10 . 1 1 116 116 SER CB C 139 62.800 62.800 62.863 -0.063 18329
8953 1 10 . 1 1 116 116 SER H H 139 8.990 8.990 7.722 1.268 18329
8954 1 10 . 1 1 117 117 ASP N N 140 124.220 124.220 121.786 2.434 18329
8955 1 10 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.459 -0.099 18329
8956 1 10 . 1 1 117 117 ASP C C 140 179.900 179.900 178.240 1.660 18329
8957 1 10 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.977 0.323 18329
8958 1 10 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.505 -1.005 18329
8959 1 10 . 1 1 117 117 ASP H H 140 9.480 9.480 8.476 1.004 18329
8960 1 10 . 1 1 118 118 ALA N N 141 121.420 121.420 121.265 0.155 18329
8961 1 10 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.235 0.045 18329
8962 1 10 . 1 1 118 118 ALA C C 141 179.800 179.800 179.156 0.644 18329
8963 1 10 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.824 -0.424 18329
8964 1 10 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.448 0.552 18329
8965 1 10 . 1 1 118 118 ALA H H 141 7.340 7.340 7.858 -0.518 18329
8966 1 10 . 1 1 119 119 ALA N N 142 121.680 121.680 121.006 0.674 18329
8967 1 10 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.116 0.014 18329
8968 1 10 . 1 1 119 119 ALA C C 142 178.800 178.800 179.250 -0.450 18329
8969 1 10 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.456 -1.256 18329
8970 1 10 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.368 -0.068 18329
8971 1 10 . 1 1 119 119 ALA H H 142 7.890 7.890 7.495 0.395 18329
8972 1 10 . 1 1 120 120 GLU N N 143 117.690 117.690 117.688 0.002 18329
8973 1 10 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.079 -0.139 18329
8974 1 10 . 1 1 120 120 GLU C C 143 178.100 178.100 178.491 -0.391 18329
8975 1 10 . 1 1 120 120 GLU CA C 143 58.700 58.700 58.483 0.217 18329
8976 1 10 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.743 -0.243 18329
8977 1 10 . 1 1 120 120 GLU H H 143 7.500 7.500 7.932 -0.432 18329
8978 1 10 . 1 1 121 121 GLU N N 144 115.680 115.680 118.888 -3.208 18329
8979 1 10 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.228 -0.068 18329
8980 1 10 . 1 1 121 121 GLU C C 144 176.100 176.100 176.734 -0.634 18329
8981 1 10 . 1 1 121 121 GLU CA C 144 56.900 56.900 57.783 -0.883 18329
8982 1 10 . 1 1 121 121 GLU CB C 144 31.100 31.100 30.561 0.539 18329
8983 1 10 . 1 1 121 121 GLU H H 144 6.970 6.970 7.744 -0.774 18329
8984 1 10 . 1 1 122 122 ASN N N 145 117.750 117.750 116.750 1.000 18329
8985 1 10 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.132 -0.142 18329
8986 1 10 . 1 1 122 122 ASN C C 145 185.300 185.300 173.004 12.296 18329
8987 1 10 . 1 1 122 122 ASN CA C 145 50.200 50.200 51.005 -0.805 18329
8988 1 10 . 1 1 122 122 ASN CB C 145 41.100 41.100 40.836 0.264 18329
8989 1 10 . 1 1 122 122 ASN H H 145 7.670 7.670 8.211 -0.541 18329
8990 1 10 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.669 -0.039 18329
8991 1 10 . 1 1 123 123 PRO CA C 146 61.000 61.000 61.784 -0.784 18329
8992 1 10 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.166 0.134 18329
8993 1 10 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.205 0.235 18329
8994 1 10 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.801 -0.901 18329
8995 1 10 . 1 1 124 124 PRO CB C 147 28.400 28.400 30.948 -2.548 18329
8996 1 10 . 1 1 125 125 THR N N 148 106.090 106.090 115.885 -9.795 18329
8997 1 10 . 1 1 125 125 THR HA H 148 4.530 4.530 4.527 0.003 18329
8998 1 10 . 1 1 125 125 THR C C 148 174.300 174.300 174.106 0.194 18329
8999 1 10 . 1 1 125 125 THR CA C 148 61.200 61.200 62.457 -1.257 18329
9000 1 10 . 1 1 125 125 THR CB C 148 68.600 68.600 70.491 -1.891 18329
9001 1 10 . 1 1 125 125 THR H H 148 7.800 7.800 8.226 -0.426 18329
9002 1 10 . 1 1 126 126 THR N N 149 108.650 108.650 114.874 -6.224 18329
9003 1 10 . 1 1 126 126 THR HA H 149 4.170 4.170 4.562 -0.392 18329
9004 1 10 . 1 1 126 126 THR C C 149 173.100 173.100 173.399 -0.299 18329
9005 1 10 . 1 1 126 126 THR CA C 149 58.800 58.800 59.965 -1.165 18329
9006 1 10 . 1 1 126 126 THR CB C 149 73.100 73.100 72.317 0.783 18329
9007 1 10 . 1 1 126 126 THR H H 149 7.350 7.350 7.228 0.122 18329
9008 1 10 . 1 1 127 127 ALA N N 150 123.270 123.270 123.912 -0.642 18329
9009 1 10 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.065 -0.045 18329
9010 1 10 . 1 1 127 127 ALA CA C 150 55.000 55.000 54.691 0.309 18329
9011 1 10 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.453 0.247 18329
9012 1 10 . 1 1 127 127 ALA H H 150 7.750 7.750 8.350 -0.600 18329
9013 1 10 . 1 1 128 128 GLN N N 151 114.920 114.920 117.263 -2.343 18329
9014 1 10 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.031 -0.281 18329
9015 1 10 . 1 1 128 128 GLN C C 151 178.400 178.400 178.159 0.241 18329
9016 1 10 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.415 0.385 18329
9017 1 10 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.176 -0.976 18329
9018 1 10 . 1 1 128 128 GLN H H 151 8.300 8.300 8.680 -0.380 18329
9019 1 10 . 1 1 129 129 GLY N N 152 107.280 107.280 106.713 0.567 18329
9020 1 10 . 1 1 129 129 GLY C C 152 174.900 174.900 175.922 -1.022 18329
9021 1 10 . 1 1 129 129 GLY CA C 152 47.200 47.200 47.145 0.055 18329
9022 1 10 . 1 1 129 129 GLY H H 152 7.920 7.920 8.290 -0.370 18329
9023 1 10 . 1 1 130 130 VAL N N 153 119.440 119.440 122.748 -3.308 18329
9024 1 10 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.724 -0.254 18329
9025 1 10 . 1 1 130 130 VAL C C 153 177.700 177.700 177.646 0.054 18329
9026 1 10 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.777 2.023 18329
9027 1 10 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.599 0.101 18329
9028 1 10 . 1 1 130 130 VAL H H 153 7.390 7.390 7.155 0.235 18329
9029 1 10 . 1 1 131 131 LEU N N 154 118.990 118.990 120.485 -1.495 18329
9030 1 10 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.816 0.094 18329
9031 1 10 . 1 1 131 131 LEU C C 154 180.400 180.400 178.871 1.529 18329
9032 1 10 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.971 -0.671 18329
9033 1 10 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.255 -0.255 18329
9034 1 10 . 1 1 131 131 LEU H H 154 8.640 8.640 7.513 1.127 18329
9035 1 10 . 1 1 132 132 GLU N N 155 120.980 120.980 119.363 1.617 18329
9036 1 10 . 1 1 132 132 GLU HA H 155 4.120 4.120 3.963 0.157 18329
9037 1 10 . 1 1 132 132 GLU C C 155 179.400 179.400 179.208 0.192 18329
9038 1 10 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.841 -0.941 18329
9039 1 10 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.238 -0.038 18329
9040 1 10 . 1 1 132 132 GLU H H 155 8.000 8.000 7.719 0.281 18329
9041 1 10 . 1 1 133 133 ILE N N 156 121.830 121.830 119.832 1.998 18329
9042 1 10 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.871 -0.291 18329
9043 1 10 . 1 1 133 133 ILE C C 156 178.000 178.000 178.255 -0.255 18329
9044 1 10 . 1 1 133 133 ILE CA C 156 65.500 65.500 62.954 2.546 18329
9045 1 10 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.488 3.112 18329
9046 1 10 . 1 1 133 133 ILE H H 156 8.040 8.040 7.222 0.818 18329
9047 1 10 . 1 1 134 134 ALA N N 157 121.470 121.470 123.827 -2.357 18329
9048 1 10 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.945 -0.045 18329
9049 1 10 . 1 1 134 134 ALA C C 157 178.800 178.800 179.805 -1.005 18329
9050 1 10 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.400 -0.100 18329
9051 1 10 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.222 -0.122 18329
9052 1 10 . 1 1 134 134 ALA H H 157 8.950 8.950 8.717 0.233 18329
9053 1 10 . 1 1 135 135 LYS N N 158 118.470 118.470 118.185 0.285 18329
9054 1 10 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.948 -0.038 18329
9055 1 10 . 1 1 135 135 LYS C C 158 179.300 179.300 178.908 0.392 18329
9056 1 10 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.734 -0.234 18329
9057 1 10 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.368 -0.968 18329
9058 1 10 . 1 1 135 135 LYS H H 158 8.000 8.000 8.118 -0.118 18329
9059 1 10 . 1 1 136 136 LYS N N 159 118.000 118.000 120.225 -2.225 18329
9060 1 10 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.073 -0.023 18329
9061 1 10 . 1 1 136 136 LYS C C 159 180.200 180.200 179.322 0.878 18329
9062 1 10 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.293 0.207 18329
9063 1 10 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.304 -1.404 18329
9064 1 10 . 1 1 136 136 LYS H H 159 7.530 7.530 7.969 -0.439 18329
9065 1 10 . 1 1 137 137 MET N N 160 120.990 120.990 119.490 1.500 18329
9066 1 10 . 1 1 137 137 MET HA H 160 3.800 3.800 4.126 -0.326 18329
9067 1 10 . 1 1 137 137 MET C C 160 177.400 177.400 178.096 -0.696 18329
9068 1 10 . 1 1 137 137 MET CA C 160 60.600 60.600 60.044 0.556 18329
9069 1 10 . 1 1 137 137 MET CB C 160 31.800 31.800 32.789 -0.989 18329
9070 1 10 . 1 1 137 137 MET H H 160 8.660 8.660 8.521 0.139 18329
9071 1 10 . 1 1 138 138 ARG N N 161 119.480 119.480 119.091 0.389 18329
9072 1 10 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.926 -0.126 18329
9073 1 10 . 1 1 138 138 ARG C C 161 177.900 177.900 178.311 -0.411 18329
9074 1 10 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.739 0.861 18329
9075 1 10 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.280 -0.480 18329
9076 1 10 . 1 1 138 138 ARG H H 161 9.280 9.280 8.320 0.960 18329
9077 1 10 . 1 1 139 139 GLU N N 162 118.700 118.700 119.438 -0.738 18329
9078 1 10 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.046 -0.046 18329
9079 1 10 . 1 1 139 139 GLU C C 162 179.100 179.100 178.564 0.536 18329
9080 1 10 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.440 0.360 18329
9081 1 10 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.577 -0.077 18329
9082 1 10 . 1 1 139 139 GLU H H 162 8.430 8.430 8.363 0.067 18329
9083 1 10 . 1 1 140 140 LYS N N 163 119.310 119.310 119.230 0.080 18329
9084 1 10 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.110 0.100 18329
9085 1 10 . 1 1 140 140 LYS C C 163 177.900 177.900 179.294 -1.394 18329
9086 1 10 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.830 0.070 18329
9087 1 10 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.481 -1.381 18329
9088 1 10 . 1 1 140 140 LYS H H 163 7.440 7.440 7.773 -0.333 18329
9089 1 10 . 1 1 141 141 LEU N N 164 117.630 117.630 119.264 -1.634 18329
9090 1 10 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.068 -0.178 18329
9091 1 10 . 1 1 141 141 LEU C C 164 178.700 178.700 178.834 -0.134 18329
9092 1 10 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.239 0.761 18329
9093 1 10 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.935 -0.435 18329
9094 1 10 . 1 1 141 141 LEU H H 164 8.180 8.180 7.927 0.253 18329
9095 1 10 . 1 1 142 142 GLN N N 165 117.710 117.710 118.792 -1.082 18329
9096 1 10 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.993 0.317 18329
9097 1 10 . 1 1 142 142 GLN C C 165 179.200 179.200 177.811 1.389 18329
9098 1 10 . 1 1 142 142 GLN CA C 165 58.500 58.500 58.940 -0.440 18329
9099 1 10 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.199 -0.699 18329
9100 1 10 . 1 1 142 142 GLN H H 165 8.730 8.730 7.813 0.917 18329
9101 1 10 . 1 1 143 143 ARG N N 166 121.410 121.410 119.178 2.232 18329
9102 1 10 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.143 0.047 18329
9103 1 10 . 1 1 143 143 ARG C C 166 179.700 179.700 178.404 1.296 18329
9104 1 10 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.297 0.503 18329
9105 1 10 . 1 1 143 143 ARG CB C 166 30.200 30.200 29.365 0.835 18329
9106 1 10 . 1 1 143 143 ARG H H 166 8.050 8.050 7.805 0.245 18329
9107 1 10 . 1 1 144 144 VAL N N 167 120.950 120.950 119.303 1.647 18329
9108 1 10 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.772 -0.012 18329
9109 1 10 . 1 1 144 144 VAL C C 167 179.200 179.200 177.947 1.253 18329
9110 1 10 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.723 -0.323 18329
9111 1 10 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.132 0.968 18329
9112 1 10 . 1 1 144 144 VAL H H 167 8.190 8.190 7.377 0.813 18329
9113 1 10 . 1 1 145 145 HIS N N 168 123.520 123.520 118.850 4.670 18329
9114 1 10 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.468 -0.568 18329
9115 1 10 . 1 1 145 145 HIS C C 168 177.100 177.100 177.846 -0.746 18329
9116 1 10 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.342 1.958 18329
9117 1 10 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.186 -0.286 18329
9118 1 10 . 1 1 145 145 HIS H H 168 9.240 9.240 7.673 1.567 18329
9119 1 10 . 1 1 146 146 THR N N 169 115.020 115.020 117.141 -2.121 18329
9120 1 10 . 1 1 146 146 THR HA H 169 3.860 3.860 4.197 -0.337 18329
9121 1 10 . 1 1 146 146 THR C C 169 175.700 175.700 176.079 -0.379 18329
9122 1 10 . 1 1 146 146 THR CA C 169 67.200 67.200 66.805 0.395 18329
9123 1 10 . 1 1 146 146 THR CB C 169 69.300 69.300 69.019 0.281 18329
9124 1 10 . 1 1 146 146 THR H H 169 8.750 8.750 8.483 0.267 18329
9125 1 10 . 1 1 147 147 LYS N N 170 120.300 120.300 121.768 -1.468 18329
9126 1 10 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.935 0.065 18329
9127 1 10 . 1 1 147 147 LYS C C 170 179.300 179.300 178.397 0.903 18329
9128 1 10 . 1 1 147 147 LYS CA C 170 59.100 59.100 60.150 -1.050 18329
9129 1 10 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.406 -0.606 18329
9130 1 10 . 1 1 147 147 LYS H H 170 8.020 8.020 8.369 -0.349 18329
9131 1 10 . 1 1 148 148 ASN N N 171 117.600 117.600 117.048 0.552 18329
9132 1 10 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.491 -0.171 18329
9133 1 10 . 1 1 148 148 ASN C C 171 175.400 175.400 177.375 -1.975 18329
9134 1 10 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.704 1.996 18329
9135 1 10 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.451 1.249 18329
9136 1 10 . 1 1 148 148 ASN H H 171 7.810 7.810 7.642 0.168 18329
9137 1 10 . 1 1 149 149 TYR N N 172 121.560 121.560 120.988 0.572 18329
9138 1 10 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.329 -0.439 18329
9139 1 10 . 1 1 149 149 TYR C C 172 176.900 176.900 177.638 -0.738 18329
9140 1 10 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.554 -0.054 18329
9141 1 10 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.559 0.361 18329
9142 1 10 . 1 1 149 149 TYR H H 172 9.020 9.020 7.842 1.178 18329
9143 1 10 . 1 1 150 150 CYS N N 173 116.050 116.050 118.827 -2.777 18329
9144 1 10 . 1 1 150 150 CYS C C 173 177.100 177.100 176.896 0.204 18329
9145 1 10 . 1 1 150 150 CYS CA C 173 58.400 58.400 61.312 -2.912 18329
9146 1 10 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.187 12.413 18329
9147 1 10 . 1 1 150 150 CYS H H 173 8.810 8.810 8.636 0.174 18329
9148 1 10 . 1 1 151 151 THR N N 174 117.190 117.190 115.434 1.756 18329
9149 1 10 . 1 1 151 151 THR HA H 174 3.880 3.880 4.064 -0.184 18329
9150 1 10 . 1 1 151 151 THR C C 174 176.000 176.000 175.993 0.007 18329
9151 1 10 . 1 1 151 151 THR CA C 174 66.900 66.900 65.307 1.593 18329
9152 1 10 . 1 1 151 151 THR CB C 174 68.500 68.500 68.357 0.143 18329
9153 1 10 . 1 1 151 151 THR H H 174 7.720 7.720 7.765 -0.045 18329
9154 1 10 . 1 1 152 152 LEU N N 175 123.110 123.110 122.052 1.058 18329
9155 1 10 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.220 -0.410 18329
9156 1 10 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.531 0.469 18329
9157 1 10 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.957 -0.457 18329
9158 1 10 . 1 1 152 152 LEU H H 175 7.870 7.870 7.432 0.438 18329
9159 1 10 . 1 1 153 153 LYS N N 176 117.270 117.270 118.352 -1.082 18329
9160 1 10 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.831 -0.131 18329
9161 1 10 . 1 1 153 153 LYS C C 176 179.100 179.100 178.597 0.503 18329
9162 1 10 . 1 1 153 153 LYS CA C 176 56.700 56.700 58.847 -2.147 18329
9163 1 10 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.141 -1.241 18329
9164 1 10 . 1 1 153 153 LYS H H 176 7.900 7.900 7.909 -0.009 18329
9165 1 10 . 1 1 154 154 LYS N N 177 119.290 119.290 119.897 -0.607 18329
9166 1 10 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.074 0.186 18329
9167 1 10 . 1 1 154 154 LYS C C 177 178.100 178.100 177.090 1.010 18329
9168 1 10 . 1 1 154 154 LYS CA C 177 57.800 57.800 58.382 -0.582 18329
9169 1 10 . 1 1 154 154 LYS CB C 177 31.800 31.800 31.930 -0.130 18329
9170 1 10 . 1 1 154 154 LYS H H 177 7.540 7.540 7.488 0.052 18329
9171 1 10 . 1 1 155 155 LYS N N 178 118.910 118.910 116.628 2.282 18329
9172 1 10 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.194 -0.144 18329
9173 1 10 . 1 1 155 155 LYS C C 178 178.100 178.100 178.126 -0.026 18329
9174 1 10 . 1 1 155 155 LYS CA C 178 58.000 58.000 57.762 0.238 18329
9175 1 10 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.443 -0.243 18329
9176 1 10 . 1 1 155 155 LYS H H 178 7.630 7.630 7.928 -0.298 18329
9177 1 10 . 1 1 156 156 GLU N N 179 117.950 117.950 118.860 -0.910 18329
9178 1 10 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.071 0.039 18329
9179 1 10 . 1 1 156 156 GLU C C 179 176.700 176.700 177.416 -0.716 18329
9180 1 10 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.619 -1.119 18329
9181 1 10 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.662 -0.062 18329
9182 1 10 . 1 1 156 156 GLU H H 179 7.560 7.560 7.907 -0.347 18329
9183 1 10 . 1 1 157 157 ASN N N 180 116.590 116.590 114.380 2.210 18329
9184 1 10 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.774 -0.054 18329
9185 1 10 . 1 1 157 157 ASN C C 180 175.000 175.000 175.646 -0.646 18329
9186 1 10 . 1 1 157 157 ASN CA C 180 52.700 52.700 53.403 -0.703 18329
9187 1 10 . 1 1 157 157 ASN CB C 180 38.800 38.800 39.603 -0.803 18329
9188 1 10 . 1 1 157 157 ASN H H 180 7.820 7.820 8.077 -0.257 18329
9189 1 10 . 1 1 158 158 SER HA H 181 4.450 4.450 4.514 -0.064 18329
9190 1 10 . 1 1 158 158 SER CA C 181 60.400 60.400 59.726 0.674 18329
9191 1 10 . 1 1 158 158 SER CB C 181 63.500 63.500 62.912 0.588 18329
9192 1 10 . 1 1 158 158 SER H H 181 8.030 8.030 8.110 -0.080 18329
9193 1 10 . 1 1 159 159 THR N N 182 112.800 112.800 113.491 -0.691 18329
9194 1 10 . 1 1 159 159 THR HA H 182 4.380 4.380 4.613 -0.233 18329
9195 1 10 . 1 1 159 159 THR C C 182 174.300 174.300 173.746 0.554 18329
9196 1 10 . 1 1 159 159 THR CA C 182 61.800 61.800 61.284 0.516 18329
9197 1 10 . 1 1 159 159 THR CB C 182 69.100 69.100 68.453 0.647 18329
9198 1 10 . 1 1 159 159 THR H H 182 8.070 8.070 7.994 0.076 18329
9199 1 10 . 1 1 160 160 PHE N N 183 123.120 123.120 123.061 0.059 18329
9200 1 10 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.382 0.058 18329
9201 1 10 . 1 1 160 160 PHE C C 183 175.100 175.100 176.363 -1.263 18329
9202 1 10 . 1 1 160 160 PHE CA C 183 58.900 58.900 58.575 0.325 18329
9203 1 10 . 1 1 160 160 PHE CB C 183 40.000 40.000 40.501 -0.501 18329
9204 1 10 . 1 1 160 160 PHE H H 183 7.900 7.900 7.948 -0.048 18329
9205 1 10 . 1 1 161 161 THR N N 184 119.330 119.330 122.678 -3.348 18329
9206 1 10 . 1 1 161 161 THR HA H 184 4.190 4.190 4.144 0.046 18329
9207 1 10 . 1 1 161 161 THR CA C 184 60.700 60.700 63.941 -3.241 18329
9208 1 10 . 1 1 161 161 THR CB C 184 70.700 70.700 67.689 3.011 18329
9209 1 10 . 1 1 161 161 THR H H 184 7.810 7.810 7.800 0.010 18329
9210 1 10 . 1 1 162 162 ASP N N 185 123.190 123.190 122.274 0.916 18329
9211 1 10 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.793 -0.383 18329
9212 1 10 . 1 1 162 162 ASP C C 185 176.900 176.900 174.982 1.918 18329
9213 1 10 . 1 1 162 162 ASP CA C 185 53.900 53.900 55.128 -1.228 18329
9214 1 10 . 1 1 162 162 ASP CB C 185 44.000 44.000 42.477 1.523 18329
9215 1 10 . 1 1 162 162 ASP H H 185 8.000 8.000 8.674 -0.674 18329
9216 1 10 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.260 0.220 18329
9217 1 10 . 1 1 163 163 GLU CA C 186 58.800 58.800 57.297 1.502 18329
9218 1 10 . 1 1 163 163 GLU CB C 186 28.100 28.100 29.708 -1.608 18329
9219 1 10 . 1 1 166 166 LYS N N 189 118.150 118.150 121.297 -3.147 18329
9220 1 10 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.199 0.021 18329
9221 1 10 . 1 1 166 166 LYS C C 189 177.500 177.500 176.409 1.091 18329
9222 1 10 . 1 1 166 166 LYS CA C 189 58.000 58.000 57.133 0.867 18329
9223 1 10 . 1 1 166 166 LYS CB C 189 32.600 32.600 33.115 -0.515 18329
9224 1 10 . 1 1 166 166 LYS H H 189 8.890 8.890 8.074 0.816 18329
9225 1 10 . 1 1 167 167 ASN N N 190 116.210 116.210 121.729 -5.519 18329
9226 1 10 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.682 0.278 18329
9227 1 10 . 1 1 167 167 ASN C C 190 174.900 174.900 175.100 -0.200 18329
9228 1 10 . 1 1 167 167 ASN CA C 190 52.900 52.900 53.306 -0.406 18329
9229 1 10 . 1 1 167 167 ASN CB C 190 38.400 38.400 39.131 -0.731 18329
9230 1 10 . 1 1 167 167 ASN H H 190 8.030 8.030 8.525 -0.495 18329
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 155 2.498 0.121 2.503 18329
2 1 1 "Average Difference" HA 165 0.257 0.029 0.256 18329
3 1 1 "Average Difference" C 145 1.538 -0.335 1.506 18329
4 1 1 "Average Difference" CA 164 1.157 -0.065 1.158 18329
5 1 1 "Average Difference" CB 154 1.470 -0.091 1.472 18329
6 1 1 "Average Difference" HN 156 0.547 -0.133 0.532 18329
7 1 2 "Average Difference" N 155 2.385 0.044 2.392 18329
8 1 2 "Average Difference" HA 165 0.248 0.039 0.246 18329
9 1 2 "Average Difference" C 145 1.492 -0.380 1.447 18329
10 1 2 "Average Difference" CA 164 1.060 -0.047 1.063 18329
11 1 2 "Average Difference" CB 154 1.420 -0.090 1.422 18329
12 1 2 "Average Difference" HN 156 0.634 -0.144 0.619 18329
13 1 3 "Average Difference" N 155 2.377 -0.136 2.381 18329
14 1 3 "Average Difference" HA 165 0.275 0.024 0.275 18329
15 1 3 "Average Difference" C 145 1.571 -0.437 1.514 18329
16 1 3 "Average Difference" CA 164 1.200 -0.104 1.199 18329
17 1 3 "Average Difference" CB 154 1.398 -0.109 1.398 18329
18 1 3 "Average Difference" HN 156 0.587 -0.150 0.569 18329
19 1 4 "Average Difference" N 155 2.766 -0.043 2.775 18329
20 1 4 "Average Difference" HA 165 0.249 0.046 0.246 18329
21 1 4 "Average Difference" C 145 1.555 -0.358 1.518 18329
22 1 4 "Average Difference" CA 164 1.163 -0.050 1.166 18329
23 1 4 "Average Difference" CB 154 1.483 -0.139 1.481 18329
24 1 4 "Average Difference" HN 156 0.621 -0.137 0.608 18329
25 1 5 "Average Difference" N 155 2.487 0.034 2.495 18329
26 1 5 "Average Difference" HA 165 0.248 0.044 0.245 18329
27 1 5 "Average Difference" C 145 1.507 -0.345 1.472 18329
28 1 5 "Average Difference" CA 164 1.129 -0.061 1.130 18329
29 1 5 "Average Difference" CB 154 1.493 -0.092 1.495 18329
30 1 5 "Average Difference" HN 156 0.570 -0.120 0.559 18329
31 1 6 "Average Difference" N 155 2.417 -0.274 2.409 18329
32 1 6 "Average Difference" HA 165 0.270 0.020 0.270 18329
33 1 6 "Average Difference" C 145 1.521 -0.354 1.484 18329
34 1 6 "Average Difference" CA 164 1.185 -0.064 1.187 18329
35 1 6 "Average Difference" CB 154 1.446 -0.096 1.448 18329
36 1 6 "Average Difference" HN 156 0.589 -0.202 0.555 18329
37 1 7 "Average Difference" N 155 2.651 0.053 2.659 18329
38 1 7 "Average Difference" HA 165 0.250 0.063 0.243 18329
39 1 7 "Average Difference" C 145 1.597 -0.434 1.542 18329
40 1 7 "Average Difference" CA 164 1.197 -0.074 1.198 18329
41 1 7 "Average Difference" CB 154 1.494 -0.030 1.499 18329
42 1 7 "Average Difference" HN 156 0.566 -0.142 0.550 18329
43 1 8 "Average Difference" N 155 2.614 -0.016 2.623 18329
44 1 8 "Average Difference" HA 165 0.267 0.049 0.263 18329
45 1 8 "Average Difference" C 145 1.524 -0.416 1.472 18329
46 1 8 "Average Difference" CA 164 1.165 -0.172 1.156 18329
47 1 8 "Average Difference" CB 154 1.438 -0.016 1.443 18329
48 1 8 "Average Difference" HN 156 0.557 -0.156 0.537 18329
49 1 9 "Average Difference" N 155 2.429 -0.212 2.428 18329
50 1 9 "Average Difference" HA 165 0.262 0.050 0.258 18329
51 1 9 "Average Difference" C 145 1.499 -0.384 1.453 18329
52 1 9 "Average Difference" CA 164 1.215 -0.082 1.216 18329
53 1 9 "Average Difference" CB 154 1.531 -0.080 1.534 18329
54 1 9 "Average Difference" HN 156 0.604 -0.133 0.591 18329
55 1 10 "Average Difference" N 155 2.607 0.161 2.611 18329
56 1 10 "Average Difference" HA 165 0.257 0.053 0.252 18329
57 1 10 "Average Difference" C 145 1.445 -0.355 1.405 18329
58 1 10 "Average Difference" CA 164 1.069 -0.088 1.069 18329
59 1 10 "Average Difference" CB 154 1.390 -0.004 1.394 18329
60 1 10 "Average Difference" HN 156 0.566 -0.151 0.547 18329
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 18329
_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 ALA N N 25 125.000 125.000 126.369 -1.369 18329
2 1 . 1 1 2 2 ALA HA H 25 4.370 4.370 4.362 0.008 18329
3 1 . 1 1 2 2 ALA CA C 25 52.300 52.300 52.792 -0.492 18329
4 1 . 1 1 2 2 ALA CB C 25 19.700 19.700 18.968 0.732 18329
5 1 . 1 1 2 2 ALA H H 25 8.690 8.690 8.290 0.400 18329
6 1 . 1 1 3 3 GLY N N 26 106.920 106.920 107.518 -0.598 18329
7 1 . 1 1 3 3 GLY CA C 26 44.000 44.000 45.353 -1.353 18329
8 1 . 1 1 3 3 GLY H H 26 7.940 7.940 8.202 -0.262 18329
9 1 . 1 1 4 4 LEU N N 27 119.140 119.140 121.524 -2.384 18329
10 1 . 1 1 4 4 LEU HA H 27 4.410 4.410 4.315 0.095 18329
11 1 . 1 1 4 4 LEU C C 27 177.100 177.100 176.599 0.501 18329
12 1 . 1 1 4 4 LEU CA C 27 54.400 54.400 55.362 -0.962 18329
13 1 . 1 1 4 4 LEU CB C 27 42.100 42.100 42.029 0.071 18329
14 1 . 1 1 4 4 LEU H H 27 8.210 8.210 8.106 0.104 18329
15 1 . 1 1 5 5 THR N N 28 112.940 112.940 112.476 0.464 18329
16 1 . 1 1 5 5 THR HA H 28 4.650 4.650 4.228 0.422 18329
17 1 . 1 1 5 5 THR C C 28 175.500 175.500 174.617 0.883 18329
18 1 . 1 1 5 5 THR CA C 28 60.100 60.100 62.407 -2.307 18329
19 1 . 1 1 5 5 THR CB C 28 72.600 72.600 69.079 3.521 18329
20 1 . 1 1 5 5 THR H H 28 9.220 9.220 8.042 1.178 18329
21 1 . 1 1 6 6 GLY N N 29 108.230 108.230 109.531 -1.301 18329
22 1 . 1 1 6 6 GLY C C 29 174.800 174.800 174.667 0.133 18329
23 1 . 1 1 6 6 GLY CA C 29 46.000 46.000 45.005 0.996 18329
24 1 . 1 1 6 6 GLY H H 29 8.520 8.520 8.267 0.253 18329
25 1 . 1 1 7 7 ALA HA H 30 4.040 4.040 4.117 -0.078 18329
26 1 . 1 1 7 7 ALA CA C 30 54.800 54.800 53.914 0.886 18329
27 1 . 1 1 7 7 ALA CB C 30 18.200 18.200 18.227 -0.027 18329
28 1 . 1 1 8 8 THR N N 31 116.970 116.970 115.240 1.730 18329
29 1 . 1 1 8 8 THR HA H 31 3.740 3.740 3.916 -0.176 18329
30 1 . 1 1 8 8 THR C C 31 175.300 175.300 176.238 -0.938 18329
31 1 . 1 1 8 8 THR CA C 31 67.000 67.000 66.470 0.530 18329
32 1 . 1 1 8 8 THR CB C 31 68.700 68.700 68.511 0.189 18329
33 1 . 1 1 8 8 THR H H 31 8.110 8.110 8.125 -0.015 18329
34 1 . 1 1 9 9 LYS N N 32 120.540 120.540 121.526 -0.986 18329
35 1 . 1 1 9 9 LYS HA H 32 3.590 3.590 4.072 -0.483 18329
36 1 . 1 1 9 9 LYS C C 32 176.900 176.900 178.596 -1.696 18329
37 1 . 1 1 9 9 LYS CA C 32 59.800 59.800 59.249 0.551 18329
38 1 . 1 1 9 9 LYS CB C 32 32.400 32.400 31.887 0.513 18329
39 1 . 1 1 9 9 LYS H H 32 6.860 6.860 7.917 -1.057 18329
40 1 . 1 1 10 10 ILE N N 33 115.940 115.940 118.823 -2.883 18329
41 1 . 1 1 10 10 ILE HA H 33 3.710 3.710 3.817 -0.107 18329
42 1 . 1 1 10 10 ILE C C 33 179.000 179.000 178.201 0.799 18329
43 1 . 1 1 10 10 ILE CA C 33 64.000 64.000 64.718 -0.718 18329
44 1 . 1 1 10 10 ILE CB C 33 38.000 38.000 37.544 0.456 18329
45 1 . 1 1 10 10 ILE H H 33 7.380 7.380 8.190 -0.810 18329
46 1 . 1 1 11 11 ARG N N 34 118.350 118.350 120.304 -1.954 18329
47 1 . 1 1 11 11 ARG HA H 34 4.040 4.040 4.060 -0.019 18329
48 1 . 1 1 11 11 ARG C C 34 180.000 180.000 178.842 1.158 18329
49 1 . 1 1 11 11 ARG CA C 34 59.400 59.400 59.615 -0.215 18329
50 1 . 1 1 11 11 ARG CB C 34 30.300 30.300 30.073 0.227 18329
51 1 . 1 1 11 11 ARG H H 34 8.250 8.250 7.787 0.463 18329
52 1 . 1 1 12 12 LEU N N 35 117.420 117.420 119.793 -2.373 18329
53 1 . 1 1 12 12 LEU HA H 35 4.170 4.170 4.141 0.029 18329
54 1 . 1 1 12 12 LEU C C 35 179.000 179.000 179.122 -0.122 18329
55 1 . 1 1 12 12 LEU CA C 35 58.000 58.000 57.897 0.103 18329
56 1 . 1 1 12 12 LEU CB C 35 40.800 40.800 41.727 -0.927 18329
57 1 . 1 1 12 12 LEU H H 35 8.340 8.340 7.881 0.459 18329
58 1 . 1 1 13 13 GLU N N 36 117.890 117.890 119.685 -1.795 18329
59 1 . 1 1 13 13 GLU HA H 36 4.020 4.020 3.987 0.033 18329
60 1 . 1 1 13 13 GLU C C 36 180.100 180.100 178.962 1.138 18329
61 1 . 1 1 13 13 GLU CA C 36 60.200 60.200 59.755 0.445 18329
62 1 . 1 1 13 13 GLU CB C 36 28.300 28.300 29.481 -1.181 18329
63 1 . 1 1 13 13 GLU H H 36 8.610 8.610 8.366 0.244 18329
64 1 . 1 1 14 14 ARG N N 37 121.100 121.100 119.024 2.076 18329
65 1 . 1 1 14 14 ARG HA H 37 4.240 4.240 4.072 0.168 18329
66 1 . 1 1 14 14 ARG C C 37 178.100 178.100 178.837 -0.737 18329
67 1 . 1 1 14 14 ARG CA C 37 58.500 58.500 59.316 -0.816 18329
68 1 . 1 1 14 14 ARG CB C 37 30.200 30.200 30.231 -0.031 18329
69 1 . 1 1 14 14 ARG H H 37 7.980 7.980 8.261 -0.281 18329
70 1 . 1 1 15 15 SER N N 38 115.420 115.420 114.833 0.587 18329
71 1 . 1 1 15 15 SER HA H 38 4.380 4.380 4.506 -0.126 18329
72 1 . 1 1 15 15 SER C C 38 177.300 177.300 175.953 1.347 18329
73 1 . 1 1 15 15 SER CA C 38 62.200 62.200 60.960 1.240 18329
74 1 . 1 1 15 15 SER CB C 38 63.200 63.200 63.179 0.021 18329
75 1 . 1 1 15 15 SER H H 38 8.230 8.230 8.262 -0.032 18329
76 1 . 1 1 16 16 ALA N N 39 123.970 123.970 123.876 0.094 18329
77 1 . 1 1 16 16 ALA HA H 39 3.630 3.630 4.031 -0.401 18329
78 1 . 1 1 16 16 ALA C C 39 179.500 179.500 179.510 -0.010 18329
79 1 . 1 1 16 16 ALA CA C 39 54.700 54.700 54.516 0.184 18329
80 1 . 1 1 16 16 ALA CB C 39 18.000 18.000 18.484 -0.484 18329
81 1 . 1 1 16 16 ALA H H 39 8.280 8.280 8.065 0.215 18329
82 1 . 1 1 17 17 LYS N N 40 121.690 121.690 119.355 2.335 18329
83 1 . 1 1 17 17 LYS HA H 40 4.090 4.090 3.995 0.095 18329
84 1 . 1 1 17 17 LYS C C 40 178.000 178.000 178.065 -0.065 18329
85 1 . 1 1 17 17 LYS CA C 40 58.400 58.400 59.343 -0.943 18329
86 1 . 1 1 17 17 LYS CB C 40 31.800 31.800 32.208 -0.408 18329
87 1 . 1 1 17 17 LYS H H 40 7.930 7.930 8.068 -0.138 18329
88 1 . 1 1 18 18 ASP N N 41 118.730 118.730 118.766 -0.036 18329
89 1 . 1 1 18 18 ASP HA H 41 4.360 4.360 4.457 -0.097 18329
90 1 . 1 1 18 18 ASP C C 41 179.900 179.900 178.613 1.287 18329
91 1 . 1 1 18 18 ASP CA C 41 57.700 57.700 56.799 0.901 18329
92 1 . 1 1 18 18 ASP CB C 41 39.600 39.600 40.194 -0.595 18329
93 1 . 1 1 18 18 ASP H H 41 8.320 8.320 7.759 0.561 18329
94 1 . 1 1 19 19 ILE N N 42 118.180 118.180 119.767 -1.587 18329
95 1 . 1 1 19 19 ILE HA H 42 3.690 3.690 3.712 -0.022 18329
96 1 . 1 1 19 19 ILE C C 42 177.400 177.400 177.779 -0.379 18329
97 1 . 1 1 19 19 ILE CA C 42 65.200 65.200 65.332 -0.132 18329
98 1 . 1 1 19 19 ILE CB C 42 37.900 37.900 37.609 0.291 18329
99 1 . 1 1 19 19 ILE H H 42 7.420 7.420 7.725 -0.305 18329
100 1 . 1 1 20 20 THR N N 43 113.360 113.360 112.242 1.118 18329
101 1 . 1 1 20 20 THR HA H 43 3.770 3.770 4.025 -0.255 18329
102 1 . 1 1 20 20 THR C C 43 177.800 177.800 176.418 1.382 18329
103 1 . 1 1 20 20 THR CA C 43 66.400 66.400 65.584 0.816 18329
104 1 . 1 1 20 20 THR CB C 43 67.400 67.400 68.353 -0.953 18329
105 1 . 1 1 20 20 THR H H 43 7.610 7.610 7.568 0.042 18329
106 1 . 1 1 21 21 ASP N N 44 123.650 123.650 122.069 1.581 18329
107 1 . 1 1 21 21 ASP HA H 44 4.410 4.410 4.388 0.022 18329
108 1 . 1 1 21 21 ASP C C 44 179.200 179.200 178.340 0.860 18329
109 1 . 1 1 21 21 ASP CA C 44 57.200 57.200 57.325 -0.125 18329
110 1 . 1 1 21 21 ASP CB C 44 39.600 39.600 40.464 -0.864 18329
111 1 . 1 1 21 21 ASP H H 44 9.260 9.260 8.087 1.172 18329
112 1 . 1 1 22 22 GLU N N 45 123.560 123.560 119.134 4.426 18329
113 1 . 1 1 22 22 GLU HA H 45 4.370 4.370 4.151 0.219 18329
114 1 . 1 1 22 22 GLU C C 45 178.500 178.500 179.277 -0.777 18329
115 1 . 1 1 22 22 GLU CA C 45 58.200 58.200 58.870 -0.670 18329
116 1 . 1 1 22 22 GLU CB C 45 29.200 29.200 29.748 -0.548 18329
117 1 . 1 1 22 22 GLU H H 45 7.750 7.750 7.871 -0.121 18329
118 1 . 1 1 23 23 ILE N N 46 119.940 119.940 115.151 4.790 18329
119 1 . 1 1 23 23 ILE HA H 46 3.620 3.620 3.794 -0.174 18329
120 1 . 1 1 23 23 ILE C C 46 177.600 177.600 177.709 -0.109 18329
121 1 . 1 1 23 23 ILE CA C 46 65.600 65.600 64.231 1.369 18329
122 1 . 1 1 23 23 ILE CB C 46 37.000 37.000 37.429 -0.429 18329
123 1 . 1 1 23 23 ILE H H 46 8.360 8.360 7.333 1.027 18329
124 1 . 1 1 24 24 ASP N N 47 120.730 120.730 121.356 -0.626 18329
125 1 . 1 1 24 24 ASP HA H 47 4.400 4.400 4.352 0.048 18329
126 1 . 1 1 24 24 ASP C C 47 178.900 178.900 177.998 0.902 18329
127 1 . 1 1 24 24 ASP CA C 47 57.500 57.500 57.230 0.270 18329
128 1 . 1 1 24 24 ASP CB C 47 39.900 39.900 40.493 -0.594 18329
129 1 . 1 1 24 24 ASP H H 47 8.280 8.280 8.236 0.044 18329
130 1 . 1 1 25 25 ALA N N 48 123.870 123.870 121.342 2.528 18329
131 1 . 1 1 25 25 ALA HA H 48 4.120 4.120 4.059 0.061 18329
132 1 . 1 1 25 25 ALA C C 48 180.400 180.400 179.413 0.986 18329
133 1 . 1 1 25 25 ALA CA C 48 55.500 55.500 54.760 0.741 18329
134 1 . 1 1 25 25 ALA CB C 48 17.800 17.800 18.313 -0.513 18329
135 1 . 1 1 25 25 ALA H H 48 7.880 7.880 7.499 0.381 18329
136 1 . 1 1 26 26 ILE N N 49 121.970 121.970 118.219 3.751 18329
137 1 . 1 1 26 26 ILE HA H 49 3.730 3.730 3.693 0.037 18329
138 1 . 1 1 26 26 ILE C C 49 178.400 178.400 177.794 0.606 18329
139 1 . 1 1 26 26 ILE CA C 49 65.900 65.900 64.895 1.005 18329
140 1 . 1 1 26 26 ILE CB C 49 37.500 37.500 37.743 -0.243 18329
141 1 . 1 1 26 26 ILE H H 49 8.710 8.710 7.439 1.271 18329
142 1 . 1 1 27 27 LYS N N 50 119.820 119.820 119.361 0.459 18329
143 1 . 1 1 27 27 LYS HA H 50 3.880 3.880 3.650 0.230 18329
144 1 . 1 1 27 27 LYS C C 50 179.900 179.900 178.916 0.984 18329
145 1 . 1 1 27 27 LYS CA C 50 60.400 60.400 59.393 1.007 18329
146 1 . 1 1 27 27 LYS CB C 50 31.900 31.900 31.667 0.233 18329
147 1 . 1 1 27 27 LYS H H 50 8.540 8.540 7.790 0.750 18329
148 1 . 1 1 28 28 LYS N N 51 121.960 121.960 118.943 3.017 18329
149 1 . 1 1 28 28 LYS HA H 51 4.090 4.090 3.996 0.095 18329
150 1 . 1 1 28 28 LYS C C 51 179.200 179.200 178.972 0.228 18329
151 1 . 1 1 28 28 LYS CA C 51 59.300 59.300 59.112 0.188 18329
152 1 . 1 1 28 28 LYS CB C 51 31.400 31.400 32.158 -0.758 18329
153 1 . 1 1 28 28 LYS H H 51 8.070 8.070 7.445 0.625 18329
154 1 . 1 1 29 29 ASP N N 52 121.710 121.710 119.267 2.443 18329
155 1 . 1 1 29 29 ASP HA H 52 4.470 4.470 4.478 -0.008 18329
156 1 . 1 1 29 29 ASP C C 52 178.500 178.500 178.414 0.086 18329
157 1 . 1 1 29 29 ASP CA C 52 57.000 57.000 56.699 0.301 18329
158 1 . 1 1 29 29 ASP CB C 52 41.000 41.000 40.637 0.363 18329
159 1 . 1 1 29 29 ASP H H 52 8.340 8.340 7.878 0.462 18329
160 1 . 1 1 30 30 ALA N N 53 121.990 121.990 121.666 0.324 18329
161 1 . 1 1 30 30 ALA HA H 53 3.340 3.340 4.003 -0.663 18329
162 1 . 1 1 30 30 ALA C C 53 179.500 179.500 179.216 0.284 18329
163 1 . 1 1 30 30 ALA CA C 53 55.100 55.100 54.687 0.414 18329
164 1 . 1 1 30 30 ALA CB C 53 18.100 18.100 18.405 -0.305 18329
165 1 . 1 1 30 30 ALA H H 53 8.800 8.800 8.116 0.684 18329
166 1 . 1 1 31 31 ALA N N 54 119.970 119.970 120.596 -0.626 18329
167 1 . 1 1 31 31 ALA HA H 54 4.150 4.150 4.061 0.089 18329
168 1 . 1 1 31 31 ALA C C 54 181.600 181.600 178.784 2.816 18329
169 1 . 1 1 31 31 ALA CA C 54 54.700 54.700 54.201 0.499 18329
170 1 . 1 1 31 31 ALA CB C 54 17.800 17.800 18.370 -0.570 18329
171 1 . 1 1 31 31 ALA H H 54 7.730 7.730 7.468 0.262 18329
172 1 . 1 1 32 32 LEU N N 55 119.660 119.660 117.412 2.248 18329
173 1 . 1 1 32 32 LEU HA H 55 4.140 4.140 4.038 0.102 18329
174 1 . 1 1 32 32 LEU C C 55 179.100 179.100 177.444 1.656 18329
175 1 . 1 1 32 32 LEU CA C 55 57.000 57.000 56.475 0.525 18329
176 1 . 1 1 32 32 LEU CB C 55 41.900 41.900 41.759 0.141 18329
177 1 . 1 1 32 32 LEU H H 55 7.660 7.660 7.447 0.213 18329
178 1 . 1 1 33 33 LYS N N 56 117.160 117.160 116.803 0.357 18329
179 1 . 1 1 33 33 LYS HA H 56 4.210 4.210 4.357 -0.147 18329
180 1 . 1 1 33 33 LYS C C 56 176.600 176.600 176.361 0.239 18329
181 1 . 1 1 33 33 LYS CA C 56 56.100 56.100 55.382 0.718 18329
182 1 . 1 1 33 33 LYS CB C 56 33.200 33.200 33.343 -0.143 18329
183 1 . 1 1 33 33 LYS H H 56 7.610 7.610 7.491 0.119 18329
184 1 . 1 1 34 34 GLY N N 57 108.680 108.680 110.607 -1.927 18329
185 1 . 1 1 34 34 GLY C C 57 174.400 174.400 173.983 0.417 18329
186 1 . 1 1 34 34 GLY CA C 57 46.200 46.200 45.242 0.958 18329
187 1 . 1 1 34 34 GLY H H 57 7.710 7.710 8.415 -0.705 18329
188 1 . 1 1 35 35 VAL N N 58 121.000 121.000 121.993 -0.993 18329
189 1 . 1 1 35 35 VAL HA H 58 3.900 3.900 4.105 -0.205 18329
190 1 . 1 1 35 35 VAL C C 58 174.200 174.200 175.514 -1.314 18329
191 1 . 1 1 35 35 VAL CA C 58 61.500 61.500 61.064 0.436 18329
192 1 . 1 1 35 35 VAL CB C 58 32.800 32.800 33.296 -0.496 18329
193 1 . 1 1 35 35 VAL H H 58 7.990 7.990 7.724 0.266 18329
194 1 . 1 1 36 36 ASN N N 59 124.960 124.960 123.206 1.754 18329
195 1 . 1 1 36 36 ASN HA H 59 4.670 4.670 4.649 0.021 18329
196 1 . 1 1 36 36 ASN C C 59 175.700 175.700 175.082 0.618 18329
197 1 . 1 1 36 36 ASN CA C 59 51.600 51.600 53.583 -1.983 18329
198 1 . 1 1 36 36 ASN CB C 59 39.100 39.100 38.192 0.908 18329
199 1 . 1 1 36 36 ASN H H 59 8.460 8.460 8.479 -0.019 18329
200 1 . 1 1 37 37 PHE N N 60 124.460 124.460 120.972 3.488 18329
201 1 . 1 1 37 37 PHE HA H 60 4.140 4.140 4.270 -0.130 18329
202 1 . 1 1 37 37 PHE C C 60 177.000 177.000 175.112 1.888 18329
203 1 . 1 1 37 37 PHE CA C 60 60.400 60.400 59.909 0.491 18329
204 1 . 1 1 37 37 PHE CB C 60 39.200 39.200 39.532 -0.332 18329
205 1 . 1 1 37 37 PHE H H 60 8.780 8.780 8.215 0.565 18329
206 1 . 1 1 38 38 ASP N N 61 119.270 119.270 118.702 0.568 18329
207 1 . 1 1 38 38 ASP HA H 61 4.490 4.490 4.482 0.008 18329
208 1 . 1 1 38 38 ASP C C 61 177.000 177.000 175.410 1.589 18329
209 1 . 1 1 38 38 ASP CA C 61 55.500 55.500 54.632 0.868 18329
210 1 . 1 1 38 38 ASP CB C 61 40.000 40.000 40.347 -0.347 18329
211 1 . 1 1 38 38 ASP H H 61 8.400 8.400 8.129 0.271 18329
212 1 . 1 1 39 39 ALA N N 62 122.020 122.020 122.995 -0.975 18329
213 1 . 1 1 39 39 ALA HA H 62 4.200 4.200 4.185 0.015 18329
214 1 . 1 1 39 39 ALA C C 62 178.300 178.300 176.636 1.664 18329
215 1 . 1 1 39 39 ALA CA C 62 52.900 52.900 52.546 0.354 18329
216 1 . 1 1 39 39 ALA CB C 62 18.500 18.500 18.551 -0.051 18329
217 1 . 1 1 39 39 ALA H H 62 7.740 7.740 7.823 -0.083 18329
218 1 . 1 1 40 40 PHE N N 63 116.940 116.940 119.392 -2.452 18329
219 1 . 1 1 40 40 PHE HA H 63 4.380 4.380 4.343 0.037 18329
220 1 . 1 1 40 40 PHE C C 63 176.100 176.100 175.455 0.645 18329
221 1 . 1 1 40 40 PHE CA C 63 58.300 58.300 58.096 0.203 18329
222 1 . 1 1 40 40 PHE CB C 63 38.800 38.800 39.078 -0.278 18329
223 1 . 1 1 40 40 PHE H H 63 7.730 7.730 8.029 -0.299 18329
224 1 . 1 1 41 41 LYS N N 64 119.840 119.840 122.794 -2.954 18329
225 1 . 1 1 41 41 LYS HA H 64 4.220 4.220 4.312 -0.092 18329
226 1 . 1 1 41 41 LYS C C 64 176.100 176.100 176.047 0.053 18329
227 1 . 1 1 41 41 LYS CA C 64 56.600 56.600 56.680 -0.081 18329
228 1 . 1 1 41 41 LYS CB C 64 32.900 32.900 33.227 -0.327 18329
229 1 . 1 1 41 41 LYS H H 64 7.650 7.650 8.002 -0.352 18329
230 1 . 1 1 42 42 ASP N N 65 120.770 120.770 119.092 1.678 18329
231 1 . 1 1 42 42 ASP HA H 65 4.570 4.570 4.489 0.081 18329
232 1 . 1 1 42 42 ASP C C 65 176.100 176.100 175.635 0.466 18329
233 1 . 1 1 42 42 ASP CA C 65 54.200 54.200 55.018 -0.818 18329
234 1 . 1 1 42 42 ASP CB C 65 40.900 40.900 41.186 -0.286 18329
235 1 . 1 1 42 42 ASP H H 65 8.030 8.030 8.342 -0.312 18329
236 1 . 1 1 43 43 LYS N N 66 122.070 122.070 120.580 1.490 18329
237 1 . 1 1 43 43 LYS HA H 66 4.280 4.280 4.246 0.034 18329
238 1 . 1 1 43 43 LYS C C 66 176.800 176.800 176.274 0.526 18329
239 1 . 1 1 43 43 LYS CA C 66 56.500 56.500 56.648 -0.148 18329
240 1 . 1 1 43 43 LYS CB C 66 32.800 32.800 33.045 -0.245 18329
241 1 . 1 1 43 43 LYS H H 66 8.180 8.180 8.141 0.039 18329
242 1 . 1 1 44 44 LYS N N 67 122.170 122.170 122.605 -0.435 18329
243 1 . 1 1 44 44 LYS HA H 67 4.350 4.350 4.347 0.003 18329
244 1 . 1 1 44 44 LYS C C 67 177.000 177.000 176.504 0.496 18329
245 1 . 1 1 44 44 LYS CA C 67 56.600 56.600 56.442 0.158 18329
246 1 . 1 1 44 44 LYS CB C 67 32.800 32.800 32.966 -0.166 18329
247 1 . 1 1 44 44 LYS H H 67 8.460 8.460 8.266 0.194 18329
248 1 . 1 1 45 45 THR N N 68 114.390 114.390 116.316 -1.925 18329
249 1 . 1 1 45 45 THR HA H 68 4.330 4.330 4.354 -0.024 18329
250 1 . 1 1 45 45 THR C C 68 175.200 175.200 174.714 0.486 18329
251 1 . 1 1 45 45 THR CA C 68 62.000 62.000 62.341 -0.340 18329
252 1 . 1 1 45 45 THR CB C 68 69.900 69.900 69.553 0.347 18329
253 1 . 1 1 45 45 THR H H 68 8.120 8.120 8.179 -0.059 18329
254 1 . 1 1 46 46 GLY N N 69 111.200 111.200 112.158 -0.958 18329
255 1 . 1 1 46 46 GLY CA C 69 45.200 45.200 45.029 0.171 18329
256 1 . 1 1 46 46 GLY H H 69 8.450 8.450 8.224 0.226 18329
257 1 . 1 1 47 47 SER CA C 70 58.400 58.400 58.065 0.335 18329
258 1 . 1 1 47 47 SER CB C 70 64.000 64.000 63.901 0.099 18329
259 1 . 1 1 48 48 GLY N N 71 111.200 111.200 110.209 0.991 18329
260 1 . 1 1 48 48 GLY CA C 71 45.000 45.000 46.012 -1.012 18329
261 1 . 1 1 48 48 GLY H H 71 8.580 8.580 8.682 -0.102 18329
262 1 . 1 1 49 49 VAL N N 72 118.910 118.910 119.082 -0.172 18329
263 1 . 1 1 49 49 VAL HA H 72 4.130 4.130 4.054 0.076 18329
264 1 . 1 1 49 49 VAL C C 72 176.100 176.100 175.934 0.166 18329
265 1 . 1 1 49 49 VAL CA C 72 62.100 62.100 62.533 -0.433 18329
266 1 . 1 1 49 49 VAL CB C 72 32.500 32.500 32.175 0.326 18329
267 1 . 1 1 49 49 VAL H H 72 7.860 7.860 7.755 0.105 18329
268 1 . 1 1 50 50 SER N N 73 118.500 118.500 118.589 -0.089 18329
269 1 . 1 1 50 50 SER C C 73 176.100 176.100 174.525 1.575 18329
270 1 . 1 1 50 50 SER CA C 73 58.300 58.300 59.834 -1.534 18329
271 1 . 1 1 50 50 SER CB C 73 63.800 63.800 62.963 0.837 18329
272 1 . 1 1 50 50 SER H H 73 8.300 8.300 8.481 -0.181 18329
273 1 . 1 1 51 51 GLU N N 74 122.560 122.560 122.124 0.436 18329
274 1 . 1 1 51 51 GLU HA H 74 4.270 4.270 4.270 0.000 18329
275 1 . 1 1 51 51 GLU CA C 74 55.700 55.700 56.544 -0.844 18329
276 1 . 1 1 51 51 GLU CB C 74 30.500 30.500 30.316 0.184 18329
277 1 . 1 1 51 51 GLU H H 74 8.360 8.360 8.334 0.026 18329
278 1 . 1 1 52 52 ASN N N 75 122.830 122.830 118.828 4.002 18329
279 1 . 1 1 52 52 ASN HA H 75 4.820 4.820 4.784 0.037 18329
280 1 . 1 1 52 52 ASN C C 75 174.800 174.800 174.005 0.794 18329
281 1 . 1 1 52 52 ASN CA C 75 51.400 51.400 52.465 -1.065 18329
282 1 . 1 1 52 52 ASN CB C 75 39.200 39.200 38.264 0.936 18329
283 1 . 1 1 52 52 ASN H H 75 8.450 8.450 8.106 0.344 18329
284 1 . 1 1 53 53 PRO HA H 76 4.180 4.180 4.408 -0.228 18329
285 1 . 1 1 53 53 PRO CA C 76 65.200 65.200 64.187 1.013 18329
286 1 . 1 1 53 53 PRO CB C 76 32.000 32.000 31.829 0.171 18329
287 1 . 1 1 54 54 PHE N N 77 118.060 118.060 119.925 -1.865 18329
288 1 . 1 1 54 54 PHE HA H 77 4.270 4.270 4.264 0.007 18329
289 1 . 1 1 54 54 PHE C C 77 177.500 177.500 177.141 0.359 18329
290 1 . 1 1 54 54 PHE CA C 77 61.500 61.500 61.698 -0.198 18329
291 1 . 1 1 54 54 PHE CB C 77 39.400 39.400 39.288 0.112 18329
292 1 . 1 1 54 54 PHE H H 77 8.430 8.430 8.026 0.404 18329
293 1 . 1 1 55 55 ILE N N 78 119.350 119.350 118.733 0.617 18329
294 1 . 1 1 55 55 ILE HA H 78 3.500 3.500 3.744 -0.244 18329
295 1 . 1 1 55 55 ILE C C 78 177.400 177.400 177.355 0.045 18329
296 1 . 1 1 55 55 ILE CA C 78 63.500 63.500 64.239 -0.739 18329
297 1 . 1 1 55 55 ILE CB C 78 37.000 37.000 37.739 -0.738 18329
298 1 . 1 1 55 55 ILE H H 78 7.540 7.540 7.836 -0.296 18329
299 1 . 1 1 56 56 LEU N N 79 118.450 118.450 119.734 -1.283 18329
300 1 . 1 1 56 56 LEU HA H 79 4.150 4.150 3.982 0.168 18329
301 1 . 1 1 56 56 LEU C C 79 179.200 179.200 179.105 0.095 18329
302 1 . 1 1 56 56 LEU CA C 79 57.800 57.800 58.076 -0.277 18329
303 1 . 1 1 56 56 LEU CB C 79 41.100 41.100 41.426 -0.326 18329
304 1 . 1 1 56 56 LEU H H 79 7.260 7.260 7.627 -0.367 18329
305 1 . 1 1 57 57 GLU N N 80 117.980 117.980 118.026 -0.046 18329
306 1 . 1 1 57 57 GLU HA H 80 3.650 3.650 3.900 -0.249 18329
307 1 . 1 1 57 57 GLU C C 80 178.700 178.700 178.765 -0.065 18329
308 1 . 1 1 57 57 GLU CA C 80 59.300 59.300 58.991 0.309 18329
309 1 . 1 1 57 57 GLU CB C 80 29.500 29.500 29.263 0.237 18329
310 1 . 1 1 57 57 GLU H H 80 7.890 7.890 7.954 -0.064 18329
311 1 . 1 1 58 58 ALA N N 81 122.040 122.040 121.989 0.051 18329
312 1 . 1 1 58 58 ALA HA H 81 3.800 3.800 4.007 -0.207 18329
313 1 . 1 1 58 58 ALA C C 81 179.500 179.500 178.963 0.537 18329
314 1 . 1 1 58 58 ALA CA C 81 55.200 55.200 54.845 0.355 18329
315 1 . 1 1 58 58 ALA CB C 81 18.800 18.800 18.209 0.591 18329
316 1 . 1 1 58 58 ALA H H 81 8.400 8.400 7.709 0.691 18329
317 1 . 1 1 59 59 LYS N N 82 116.000 116.000 118.055 -2.055 18329
318 1 . 1 1 59 59 LYS HA H 82 3.850 3.850 4.066 -0.216 18329
319 1 . 1 1 59 59 LYS C C 82 180.300 180.300 178.538 1.762 18329
320 1 . 1 1 59 59 LYS CA C 82 61.100 61.100 59.126 1.974 18329
321 1 . 1 1 59 59 LYS CB C 82 32.200 32.200 32.361 -0.160 18329
322 1 . 1 1 59 59 LYS H H 82 8.000 8.000 7.716 0.284 18329
323 1 . 1 1 60 60 VAL N N 83 122.920 122.920 118.321 4.599 18329
324 1 . 1 1 60 60 VAL HA H 83 3.330 3.330 3.707 -0.377 18329
325 1 . 1 1 60 60 VAL C C 83 178.300 178.300 178.231 0.069 18329
326 1 . 1 1 60 60 VAL CA C 83 67.900 67.900 65.667 2.233 18329
327 1 . 1 1 60 60 VAL CB C 83 31.200 31.200 31.462 -0.261 18329
328 1 . 1 1 60 60 VAL H H 83 8.110 8.110 7.399 0.711 18329
329 1 . 1 1 61 61 ARG N N 84 121.770 121.770 119.756 2.014 18329
330 1 . 1 1 61 61 ARG C C 84 179.500 179.500 178.483 1.017 18329
331 1 . 1 1 61 61 ARG CA C 84 59.200 59.200 59.113 0.087 18329
332 1 . 1 1 61 61 ARG CB C 84 30.800 30.800 29.774 1.026 18329
333 1 . 1 1 61 61 ARG H H 84 8.710 8.710 7.511 1.199 18329
334 1 . 1 1 62 62 ALA N N 85 119.450 119.450 120.909 -1.459 18329
335 1 . 1 1 62 62 ALA HA H 85 3.890 3.890 4.116 -0.226 18329
336 1 . 1 1 62 62 ALA C C 85 179.500 179.500 178.950 0.550 18329
337 1 . 1 1 62 62 ALA CA C 85 55.000 55.000 55.259 -0.259 18329
338 1 . 1 1 62 62 ALA CB C 85 19.000 19.000 18.463 0.537 18329
339 1 . 1 1 62 62 ALA H H 85 8.700 8.700 7.808 0.892 18329
340 1 . 1 1 63 63 THR N N 86 106.650 106.650 110.367 -3.718 18329
341 1 . 1 1 63 63 THR HA H 86 3.970 3.970 4.114 -0.144 18329
342 1 . 1 1 63 63 THR C C 86 177.700 177.700 176.652 1.048 18329
343 1 . 1 1 63 63 THR CA C 86 66.000 66.000 65.499 0.501 18329
344 1 . 1 1 63 63 THR CB C 86 68.200 68.200 68.505 -0.305 18329
345 1 . 1 1 63 63 THR H H 86 8.150 8.150 7.724 0.426 18329
346 1 . 1 1 64 64 THR N N 87 120.430 120.430 119.826 0.604 18329
347 1 . 1 1 64 64 THR HA H 87 4.050 4.050 4.074 -0.024 18329
348 1 . 1 1 64 64 THR C C 87 176.800 176.800 176.337 0.463 18329
349 1 . 1 1 64 64 THR CA C 87 67.300 67.300 67.319 -0.019 18329
350 1 . 1 1 64 64 THR CB C 87 68.600 68.600 68.538 0.062 18329
351 1 . 1 1 64 64 THR H H 87 7.920 7.920 7.618 0.302 18329
352 1 . 1 1 65 65 VAL N N 88 119.230 119.230 120.430 -1.200 18329
353 1 . 1 1 65 65 VAL HA H 88 3.980 3.980 3.777 0.203 18329
354 1 . 1 1 65 65 VAL C C 88 178.500 178.500 177.410 1.090 18329
355 1 . 1 1 65 65 VAL CA C 88 65.600 65.600 65.809 -0.209 18329
356 1 . 1 1 65 65 VAL CB C 88 31.700 31.700 31.282 0.418 18329
357 1 . 1 1 65 65 VAL H H 88 7.380 7.380 7.445 -0.065 18329
358 1 . 1 1 66 66 ALA N N 89 124.260 124.260 121.685 2.575 18329
359 1 . 1 1 66 66 ALA HA H 89 4.250 4.250 3.954 0.296 18329
360 1 . 1 1 66 66 ALA C C 89 179.900 179.900 179.232 0.668 18329
361 1 . 1 1 66 66 ALA CA C 89 54.900 54.900 55.318 -0.418 18329
362 1 . 1 1 66 66 ALA CB C 89 19.500 19.500 18.081 1.419 18329
363 1 . 1 1 66 66 ALA H H 89 8.390 8.390 7.698 0.692 18329
364 1 . 1 1 67 67 GLU N N 90 120.180 120.180 118.210 1.971 18329
365 1 . 1 1 67 67 GLU HA H 90 3.720 3.720 3.976 -0.256 18329
366 1 . 1 1 67 67 GLU C C 90 177.600 177.600 178.837 -1.237 18329
367 1 . 1 1 67 67 GLU CA C 90 59.900 59.900 59.592 0.308 18329
368 1 . 1 1 67 67 GLU CB C 90 28.300 28.300 29.328 -1.028 18329
369 1 . 1 1 67 67 GLU H H 90 8.520 8.520 8.227 0.293 18329
370 1 . 1 1 68 68 LYS N N 91 116.340 116.340 118.445 -2.105 18329
371 1 . 1 1 68 68 LYS HA H 91 3.960 3.960 4.015 -0.055 18329
372 1 . 1 1 68 68 LYS C C 91 179.200 179.200 179.013 0.187 18329
373 1 . 1 1 68 68 LYS CA C 91 59.800 59.800 58.934 0.865 18329
374 1 . 1 1 68 68 LYS CB C 91 32.000 32.000 32.158 -0.158 18329
375 1 . 1 1 68 68 LYS H H 91 7.210 7.210 7.520 -0.310 18329
376 1 . 1 1 69 69 PHE N N 92 120.990 120.990 120.264 0.726 18329
377 1 . 1 1 69 69 PHE HA H 92 4.510 4.510 4.211 0.299 18329
378 1 . 1 1 69 69 PHE C C 92 175.100 175.100 177.148 -2.048 18329
379 1 . 1 1 69 69 PHE CA C 92 59.800 59.800 61.159 -1.359 18329
380 1 . 1 1 69 69 PHE CB C 92 39.200 39.200 39.151 0.049 18329
381 1 . 1 1 69 69 PHE H H 92 7.180 7.180 7.747 -0.567 18329
382 1 . 1 1 70 70 VAL N N 93 120.330 120.330 118.768 1.562 18329
383 1 . 1 1 70 70 VAL HA H 93 3.090 3.090 3.532 -0.442 18329
384 1 . 1 1 70 70 VAL C C 93 177.500 177.500 177.874 -0.374 18329
385 1 . 1 1 70 70 VAL CA C 93 66.900 66.900 66.514 0.386 18329
386 1 . 1 1 70 70 VAL CB C 93 31.400 31.400 31.230 0.170 18329
387 1 . 1 1 70 70 VAL H H 93 7.930 7.930 7.615 0.315 18329
388 1 . 1 1 71 71 ILE N N 94 120.410 120.410 118.962 1.448 18329
389 1 . 1 1 71 71 ILE HA H 94 3.830 3.830 3.665 0.165 18329
390 1 . 1 1 71 71 ILE C C 94 177.700 177.700 177.763 -0.063 18329
391 1 . 1 1 71 71 ILE CA C 94 65.000 65.000 64.943 0.057 18329
392 1 . 1 1 71 71 ILE CB C 94 37.300 37.300 37.191 0.109 18329
393 1 . 1 1 71 71 ILE H H 94 8.180 8.180 7.485 0.695 18329
394 1 . 1 1 72 72 ALA N N 95 122.440 122.440 122.512 -0.072 18329
395 1 . 1 1 72 72 ALA HA H 95 3.960 3.960 3.917 0.043 18329
396 1 . 1 1 72 72 ALA C C 95 179.600 179.600 179.449 0.151 18329
397 1 . 1 1 72 72 ALA CA C 95 55.900 55.900 55.088 0.812 18329
398 1 . 1 1 72 72 ALA CB C 95 17.200 17.200 17.826 -0.626 18329
399 1 . 1 1 72 72 ALA H H 95 7.340 7.340 7.534 -0.194 18329
400 1 . 1 1 73 73 ILE N N 96 119.330 119.330 118.775 0.555 18329
401 1 . 1 1 73 73 ILE HA H 96 3.440 3.440 3.621 -0.181 18329
402 1 . 1 1 73 73 ILE C C 96 177.400 177.400 177.887 -0.487 18329
403 1 . 1 1 73 73 ILE CA C 96 62.800 62.800 63.579 -0.779 18329
404 1 . 1 1 73 73 ILE CB C 96 34.400 34.400 36.754 -2.354 18329
405 1 . 1 1 73 73 ILE H H 96 7.820 7.820 7.399 0.421 18329
406 1 . 1 1 74 74 GLU N N 97 118.440 118.440 120.652 -2.212 18329
407 1 . 1 1 74 74 GLU HA H 97 3.690 3.690 3.848 -0.158 18329
408 1 . 1 1 74 74 GLU C C 97 180.500 180.500 178.881 1.619 18329
409 1 . 1 1 74 74 GLU CA C 97 59.700 59.700 59.838 -0.138 18329
410 1 . 1 1 74 74 GLU CB C 97 29.700 29.700 29.386 0.314 18329
411 1 . 1 1 74 74 GLU H H 97 8.380 8.380 7.709 0.671 18329
412 1 . 1 1 75 75 GLU N N 98 120.470 120.470 118.968 1.502 18329
413 1 . 1 1 75 75 GLU HA H 98 3.940 3.940 4.038 -0.099 18329
414 1 . 1 1 75 75 GLU C C 98 180.600 180.600 179.041 1.559 18329
415 1 . 1 1 75 75 GLU CA C 98 59.700 59.700 59.064 0.636 18329
416 1 . 1 1 75 75 GLU CB C 98 30.200 30.200 29.497 0.704 18329
417 1 . 1 1 75 75 GLU H H 98 8.800 8.800 8.015 0.785 18329
418 1 . 1 1 76 76 GLU N N 99 119.230 119.230 119.410 -0.179 18329
419 1 . 1 1 76 76 GLU HA H 99 4.140 4.140 4.056 0.084 18329
420 1 . 1 1 76 76 GLU C C 99 178.900 178.900 178.793 0.107 18329
421 1 . 1 1 76 76 GLU CA C 99 58.600 58.600 58.863 -0.263 18329
422 1 . 1 1 76 76 GLU CB C 99 29.300 29.300 29.326 -0.027 18329
423 1 . 1 1 76 76 GLU H H 99 8.840 8.840 8.168 0.672 18329
424 1 . 1 1 77 77 ALA N N 100 121.950 121.950 121.501 0.449 18329
425 1 . 1 1 77 77 ALA HA H 100 4.000 4.000 4.179 -0.179 18329
426 1 . 1 1 77 77 ALA C C 100 179.000 179.000 179.534 -0.534 18329
427 1 . 1 1 77 77 ALA CA C 100 56.300 56.300 55.317 0.983 18329
428 1 . 1 1 77 77 ALA CB C 100 16.800 16.800 18.240 -1.440 18329
429 1 . 1 1 77 77 ALA H H 100 9.400 9.400 8.095 1.305 18329
430 1 . 1 1 78 78 THR N N 101 111.820 111.820 113.899 -2.079 18329
431 1 . 1 1 78 78 THR HA H 101 3.750 3.750 4.015 -0.265 18329
432 1 . 1 1 78 78 THR CA C 101 67.500 67.500 66.024 1.476 18329
433 1 . 1 1 78 78 THR CB C 101 68.600 68.600 68.581 0.019 18329
434 1 . 1 1 78 78 THR H H 101 7.770 7.770 7.653 0.118 18329
435 1 . 1 1 79 79 LYS N N 102 122.940 122.940 120.049 2.891 18329
436 1 . 1 1 79 79 LYS HA H 102 4.090 4.090 4.163 -0.073 18329
437 1 . 1 1 79 79 LYS CA C 102 59.200 59.200 58.411 0.790 18329
438 1 . 1 1 79 79 LYS CB C 102 32.500 32.500 32.319 0.181 18329
439 1 . 1 1 79 79 LYS H H 102 7.870 7.870 7.650 0.220 18329
440 1 . 1 1 80 80 LEU N N 103 117.690 117.690 118.175 -0.485 18329
441 1 . 1 1 80 80 LEU HA H 103 4.490 4.490 4.347 0.144 18329
442 1 . 1 1 80 80 LEU C C 103 178.140 178.140 177.093 1.047 18329
443 1 . 1 1 80 80 LEU CA C 103 54.000 54.000 54.988 -0.988 18329
444 1 . 1 1 80 80 LEU CB C 103 43.100 43.100 42.092 1.008 18329
445 1 . 1 1 80 80 LEU H H 103 7.550 7.550 7.778 -0.228 18329
446 1 . 1 1 81 81 LYS N N 104 122.210 122.210 118.989 3.222 18329
447 1 . 1 1 81 81 LYS HA H 104 3.930 3.930 4.024 -0.094 18329
448 1 . 1 1 81 81 LYS C C 104 178.000 178.000 176.695 1.305 18329
449 1 . 1 1 81 81 LYS CA C 104 61.300 61.300 58.170 3.130 18329
450 1 . 1 1 81 81 LYS CB C 104 32.800 32.800 31.711 1.089 18329
451 1 . 1 1 81 81 LYS H H 104 7.500 7.500 7.672 -0.172 18329
452 1 . 1 1 82 82 GLU N N 105 114.920 114.920 120.014 -5.094 18329
453 1 . 1 1 82 82 GLU HA H 105 4.560 4.560 4.253 0.307 18329
454 1 . 1 1 82 82 GLU C C 105 177.900 177.900 176.983 0.917 18329
455 1 . 1 1 82 82 GLU CA C 105 57.660 57.660 57.328 0.332 18329
456 1 . 1 1 82 82 GLU CB C 105 30.400 30.400 29.522 0.878 18329
457 1 . 1 1 82 82 GLU H H 105 8.780 8.780 8.462 0.318 18329
458 1 . 1 1 83 83 THR N N 106 107.260 107.260 112.698 -5.438 18329
459 1 . 1 1 83 83 THR HA H 106 4.550 4.550 4.152 0.398 18329
460 1 . 1 1 83 83 THR C C 106 176.300 176.300 175.295 1.005 18329
461 1 . 1 1 83 83 THR CA C 106 61.900 61.900 63.444 -1.543 18329
462 1 . 1 1 83 83 THR CB C 106 70.400 70.400 68.889 1.511 18329
463 1 . 1 1 83 83 THR H H 106 7.570 7.570 8.308 -0.738 18329
464 1 . 1 1 84 84 GLY N N 107 112.110 112.110 109.642 2.468 18329
465 1 . 1 1 84 84 GLY C C 107 172.800 172.800 173.928 -1.128 18329
466 1 . 1 1 84 84 GLY CA C 107 45.400 45.400 45.259 0.141 18329
467 1 . 1 1 84 84 GLY H H 107 9.000 9.000 8.174 0.826 18329
468 1 . 1 1 85 85 SER N N 108 119.030 119.030 114.684 4.346 18329
469 1 . 1 1 85 85 SER CA C 108 56.300 56.300 58.363 -2.063 18329
470 1 . 1 1 85 85 SER CB C 108 66.300 66.300 63.706 2.593 18329
471 1 . 1 1 85 85 SER H H 108 8.950 8.950 8.346 0.604 18329
472 1 . 1 1 86 86 SER HA H 109 4.480 4.480 4.554 -0.074 18329
473 1 . 1 1 86 86 SER C C 109 177.000 177.000 176.489 0.511 18329
474 1 . 1 1 86 86 SER CA C 109 61.600 61.600 59.956 1.645 18329
475 1 . 1 1 86 86 SER CB C 109 62.900 62.900 63.138 -0.238 18329
476 1 . 1 1 87 87 GLY N N 110 108.100 108.100 109.938 -1.838 18329
477 1 . 1 1 87 87 GLY C C 110 177.100 177.100 175.849 1.251 18329
478 1 . 1 1 87 87 GLY CA C 110 46.200 46.200 46.756 -0.556 18329
479 1 . 1 1 87 87 GLY H H 110 8.480 8.480 8.408 0.072 18329
480 1 . 1 1 88 88 GLU N N 111 123.040 123.040 121.986 1.054 18329
481 1 . 1 1 88 88 GLU HA H 111 3.690 3.690 4.036 -0.346 18329
482 1 . 1 1 88 88 GLU C C 111 177.700 177.700 178.759 -1.059 18329
483 1 . 1 1 88 88 GLU CA C 111 59.500 59.500 58.728 0.772 18329
484 1 . 1 1 88 88 GLU CB C 111 28.700 28.700 29.165 -0.465 18329
485 1 . 1 1 88 88 GLU H H 111 7.560 7.560 8.006 -0.446 18329
486 1 . 1 1 89 89 PHE N N 112 118.270 118.270 118.309 -0.039 18329
487 1 . 1 1 89 89 PHE HA H 112 4.420 4.420 4.348 0.072 18329
488 1 . 1 1 89 89 PHE C C 112 178.600 178.600 177.962 0.637 18329
489 1 . 1 1 89 89 PHE CA C 112 61.100 61.100 61.009 0.091 18329
490 1 . 1 1 89 89 PHE CB C 112 37.900 37.900 38.604 -0.704 18329
491 1 . 1 1 89 89 PHE H H 112 7.200 7.200 7.638 -0.438 18329
492 1 . 1 1 90 90 SER N N 113 115.980 115.980 115.608 0.372 18329
493 1 . 1 1 90 90 SER HA H 113 4.290 4.290 4.143 0.147 18329
494 1 . 1 1 90 90 SER C C 113 178.600 178.600 176.340 2.260 18329
495 1 . 1 1 90 90 SER CA C 113 62.700 62.700 62.007 0.693 18329
496 1 . 1 1 90 90 SER CB C 113 62.800 62.800 62.749 0.051 18329
497 1 . 1 1 90 90 SER H H 113 8.830 8.830 8.233 0.597 18329
498 1 . 1 1 91 91 ALA N N 114 123.130 123.130 123.082 0.048 18329
499 1 . 1 1 91 91 ALA HA H 114 4.380 4.380 4.197 0.183 18329
500 1 . 1 1 91 91 ALA C C 114 181.300 181.300 179.457 1.843 18329
501 1 . 1 1 91 91 ALA CA C 114 54.700 54.700 54.724 -0.024 18329
502 1 . 1 1 91 91 ALA CB C 114 18.400 18.400 18.353 0.047 18329
503 1 . 1 1 91 91 ALA H H 114 7.580 7.580 7.676 -0.096 18329
504 1 . 1 1 92 92 MET N N 115 118.700 118.700 118.337 0.363 18329
505 1 . 1 1 92 92 MET HA H 115 3.980 3.980 4.260 -0.280 18329
506 1 . 1 1 92 92 MET C C 115 178.000 178.000 178.192 -0.192 18329
507 1 . 1 1 92 92 MET CA C 115 61.000 61.000 58.004 2.996 18329
508 1 . 1 1 92 92 MET CB C 115 31.400 31.400 32.445 -1.045 18329
509 1 . 1 1 92 92 MET H H 115 7.880 7.880 7.883 -0.003 18329
510 1 . 1 1 93 93 TYR N N 116 119.200 119.200 120.258 -1.058 18329
511 1 . 1 1 93 93 TYR HA H 116 4.280 4.280 4.157 0.124 18329
512 1 . 1 1 93 93 TYR C C 116 176.300 176.300 177.519 -1.219 18329
513 1 . 1 1 93 93 TYR CA C 116 62.100 62.100 61.673 0.427 18329
514 1 . 1 1 93 93 TYR CB C 116 38.300 38.300 38.244 0.056 18329
515 1 . 1 1 93 93 TYR H H 116 7.870 7.870 8.284 -0.414 18329
516 1 . 1 1 94 94 ASP N N 117 120.210 120.210 119.585 0.624 18329
517 1 . 1 1 94 94 ASP HA H 117 4.190 4.190 4.475 -0.285 18329
518 1 . 1 1 94 94 ASP C C 117 179.000 179.000 178.559 0.441 18329
519 1 . 1 1 94 94 ASP CA C 117 57.700 57.700 57.314 0.386 18329
520 1 . 1 1 94 94 ASP CB C 117 40.000 40.000 40.492 -0.492 18329
521 1 . 1 1 94 94 ASP H H 117 8.720 8.720 8.033 0.687 18329
522 1 . 1 1 95 95 LEU N N 118 118.420 118.420 120.403 -1.983 18329
523 1 . 1 1 95 95 LEU HA H 118 4.210 4.210 4.101 0.109 18329
524 1 . 1 1 95 95 LEU C C 118 178.600 178.600 178.851 -0.251 18329
525 1 . 1 1 95 95 LEU CA C 118 57.700 57.700 57.723 -0.023 18329
526 1 . 1 1 95 95 LEU CB C 118 43.100 43.100 41.812 1.288 18329
527 1 . 1 1 95 95 LEU H H 118 7.510 7.510 7.583 -0.073 18329
528 1 . 1 1 96 96 MET N N 119 118.470 118.470 119.111 -0.641 18329
529 1 . 1 1 96 96 MET HA H 119 3.990 3.990 4.053 -0.063 18329
530 1 . 1 1 96 96 MET C C 119 177.500 177.500 178.278 -0.778 18329
531 1 . 1 1 96 96 MET CA C 119 60.500 60.500 57.885 2.615 18329
532 1 . 1 1 96 96 MET CB C 119 33.900 33.900 31.664 2.236 18329
533 1 . 1 1 96 96 MET H H 119 7.820 7.820 7.681 0.139 18329
534 1 . 1 1 97 97 PHE N N 120 119.580 119.580 119.572 0.008 18329
535 1 . 1 1 97 97 PHE HA H 120 3.810 3.810 4.088 -0.278 18329
536 1 . 1 1 97 97 PHE C C 120 178.800 178.800 177.546 1.254 18329
537 1 . 1 1 97 97 PHE CA C 120 61.800 61.800 61.643 0.156 18329
538 1 . 1 1 97 97 PHE CB C 120 39.200 39.200 38.915 0.285 18329
539 1 . 1 1 97 97 PHE H H 120 8.940 8.940 7.796 1.143 18329
540 1 . 1 1 98 98 GLU N N 121 119.940 119.940 118.837 1.103 18329
541 1 . 1 1 98 98 GLU HA H 121 3.880 3.880 4.030 -0.150 18329
542 1 . 1 1 98 98 GLU C C 121 180.800 180.800 178.848 1.952 18329
543 1 . 1 1 98 98 GLU CA C 121 59.800 59.800 59.304 0.496 18329
544 1 . 1 1 98 98 GLU CB C 121 29.200 29.200 29.501 -0.301 18329
545 1 . 1 1 98 98 GLU H H 121 8.690 8.690 8.232 0.458 18329
546 1 . 1 1 99 99 VAL N N 122 115.350 115.350 116.758 -1.408 18329
547 1 . 1 1 99 99 VAL HA H 122 3.740 3.740 3.741 -0.001 18329
548 1 . 1 1 99 99 VAL C C 122 176.500 176.500 177.120 -0.620 18329
549 1 . 1 1 99 99 VAL CA C 122 64.500 64.500 64.745 -0.245 18329
550 1 . 1 1 99 99 VAL CB C 122 31.300 31.300 31.604 -0.304 18329
551 1 . 1 1 99 99 VAL H H 122 8.210 8.210 7.884 0.326 18329
552 1 . 1 1 100 100 SER N N 123 115.450 115.450 115.428 0.022 18329
553 1 . 1 1 100 100 SER HA H 123 4.270 4.270 4.083 0.187 18329
554 1 . 1 1 100 100 SER C C 123 174.700 174.700 176.159 -1.459 18329
555 1 . 1 1 100 100 SER CA C 123 62.000 62.000 61.065 0.935 18329
556 1 . 1 1 100 100 SER H H 123 7.520 7.520 7.768 -0.248 18329
557 1 . 1 1 101 101 LYS N N 124 120.310 120.310 121.710 -1.400 18329
558 1 . 1 1 101 101 LYS HA H 124 3.970 3.970 4.124 -0.154 18329
559 1 . 1 1 101 101 LYS C C 124 176.600 176.600 176.425 0.175 18329
560 1 . 1 1 101 101 LYS CA C 124 61.100 61.100 60.217 0.883 18329
561 1 . 1 1 101 101 LYS CB C 124 28.500 28.500 30.294 -1.794 18329
562 1 . 1 1 101 101 LYS H H 124 6.930 6.930 7.407 -0.477 18329
563 1 . 1 1 102 102 PRO HA H 125 4.260 4.260 4.199 0.061 18329
564 1 . 1 1 102 102 PRO CA C 125 65.200 65.200 65.541 -0.341 18329
565 1 . 1 1 102 102 PRO CB C 125 30.600 30.600 31.193 -0.593 18329
566 1 . 1 1 103 103 LEU N N 126 116.020 116.020 117.223 -1.203 18329
567 1 . 1 1 103 103 LEU HA H 126 3.880 3.880 4.045 -0.165 18329
568 1 . 1 1 103 103 LEU C C 126 177.900 177.900 179.047 -1.147 18329
569 1 . 1 1 103 103 LEU CA C 126 57.700 57.700 57.318 0.381 18329
570 1 . 1 1 103 103 LEU CB C 126 41.800 41.800 41.152 0.648 18329
571 1 . 1 1 103 103 LEU H H 126 6.520 6.520 7.460 -0.940 18329
572 1 . 1 1 104 104 GLN N N 127 120.500 120.500 119.260 1.240 18329
573 1 . 1 1 104 104 GLN C C 127 180.600 180.600 178.012 2.588 18329
574 1 . 1 1 104 104 GLN CA C 127 58.300 58.300 58.539 -0.239 18329
575 1 . 1 1 104 104 GLN CB C 127 29.000 29.000 28.281 0.719 18329
576 1 . 1 1 104 104 GLN H H 127 8.160 8.160 7.957 0.202 18329
577 1 . 1 1 105 105 LYS N N 128 120.000 120.000 117.587 2.413 18329
578 1 . 1 1 105 105 LYS HA H 128 4.050 4.050 4.065 -0.015 18329
579 1 . 1 1 105 105 LYS C C 128 177.100 177.100 177.741 -0.641 18329
580 1 . 1 1 105 105 LYS CA C 128 58.500 58.500 58.039 0.461 18329
581 1 . 1 1 105 105 LYS CB C 128 31.400 31.400 32.177 -0.777 18329
582 1 . 1 1 105 105 LYS H H 128 7.810 7.810 7.681 0.129 18329
583 1 . 1 1 106 106 LEU N N 129 118.530 118.530 116.969 1.561 18329
584 1 . 1 1 106 106 LEU HA H 129 3.970 3.970 4.365 -0.395 18329
585 1 . 1 1 106 106 LEU C C 129 175.200 175.200 176.665 -1.465 18329
586 1 . 1 1 106 106 LEU CA C 129 54.500 54.500 55.154 -0.654 18329
587 1 . 1 1 106 106 LEU CB C 129 42.400 42.400 43.102 -0.702 18329
588 1 . 1 1 106 106 LEU H H 129 7.220 7.220 7.501 -0.281 18329
589 1 . 1 1 107 107 GLY N N 130 101.490 101.490 105.270 -3.780 18329
590 1 . 1 1 107 107 GLY C C 130 174.800 174.800 173.395 1.405 18329
591 1 . 1 1 107 107 GLY CA C 130 45.100 45.100 44.749 0.351 18329
592 1 . 1 1 107 107 GLY H H 130 7.560 7.560 7.886 -0.326 18329
593 1 . 1 1 108 108 ILE N N 131 121.340 121.340 119.649 1.691 18329
594 1 . 1 1 108 108 ILE HA H 131 4.150 4.150 3.801 0.349 18329
595 1 . 1 1 108 108 ILE C C 131 174.300 174.300 175.072 -0.772 18329
596 1 . 1 1 108 108 ILE CA C 131 60.400 60.400 62.072 -1.672 18329
597 1 . 1 1 108 108 ILE CB C 131 35.200 35.200 37.487 -2.287 18329
598 1 . 1 1 108 108 ILE H H 131 7.290 7.290 8.044 -0.754 18329
599 1 . 1 1 109 109 GLN N N 132 125.650 125.650 122.234 3.416 18329
600 1 . 1 1 109 109 GLN HA H 132 4.010 4.010 4.290 -0.280 18329
601 1 . 1 1 109 109 GLN C C 132 176.800 176.800 175.542 1.258 18329
602 1 . 1 1 109 109 GLN CA C 132 57.600 57.600 55.926 1.674 18329
603 1 . 1 1 109 109 GLN CB C 132 29.000 29.000 30.096 -1.096 18329
604 1 . 1 1 109 109 GLN H H 132 8.080 8.080 8.248 -0.168 18329
605 1 . 1 1 110 110 GLU N N 133 114.890 114.890 119.294 -4.404 18329
606 1 . 1 1 110 110 GLU HA H 133 4.150 4.150 4.070 0.080 18329
607 1 . 1 1 110 110 GLU C C 133 177.100 177.100 176.931 0.169 18329
608 1 . 1 1 110 110 GLU CA C 133 57.100 57.100 57.461 -0.361 18329
609 1 . 1 1 110 110 GLU CB C 133 27.300 27.300 28.833 -1.532 18329
610 1 . 1 1 110 110 GLU H H 133 9.270 9.270 8.773 0.497 18329
611 1 . 1 1 111 111 MET N N 134 121.210 121.210 118.949 2.262 18329
612 1 . 1 1 111 111 MET HA H 134 4.350 4.350 4.140 0.210 18329
613 1 . 1 1 111 111 MET C C 134 177.500 177.500 177.891 -0.391 18329
614 1 . 1 1 111 111 MET CA C 134 57.900 57.900 59.124 -1.224 18329
615 1 . 1 1 111 111 MET CB C 134 33.300 33.300 32.117 1.184 18329
616 1 . 1 1 111 111 MET H H 134 7.620 7.620 8.288 -0.668 18329
617 1 . 1 1 112 112 THR N N 135 113.170 113.170 112.177 0.993 18329
618 1 . 1 1 112 112 THR HA H 135 3.920 3.920 3.983 -0.063 18329
619 1 . 1 1 112 112 THR C C 135 176.400 176.400 176.459 -0.059 18329
620 1 . 1 1 112 112 THR CA C 135 65.900 65.900 65.987 -0.087 18329
621 1 . 1 1 112 112 THR CB C 135 68.200 68.200 68.277 -0.077 18329
622 1 . 1 1 112 112 THR H H 135 8.320 8.320 8.307 0.012 18329
623 1 . 1 1 113 113 LYS N N 136 123.440 123.440 121.962 1.478 18329
624 1 . 1 1 113 113 LYS HA H 136 3.930 3.930 4.169 -0.239 18329
625 1 . 1 1 113 113 LYS C C 136 177.600 177.600 178.957 -1.357 18329
626 1 . 1 1 113 113 LYS CA C 136 58.300 58.300 59.388 -1.089 18329
627 1 . 1 1 113 113 LYS CB C 136 32.000 32.000 32.061 -0.062 18329
628 1 . 1 1 113 113 LYS H H 136 8.060 8.060 7.929 0.132 18329
629 1 . 1 1 114 114 THR N N 137 114.590 114.590 116.561 -1.972 18329
630 1 . 1 1 114 114 THR HA H 137 4.000 4.000 4.024 -0.025 18329
631 1 . 1 1 114 114 THR C C 137 176.800 176.800 176.597 0.203 18329
632 1 . 1 1 114 114 THR CA C 137 67.600 67.600 66.947 0.653 18329
633 1 . 1 1 114 114 THR CB C 137 69.200 69.200 68.630 0.570 18329
634 1 . 1 1 114 114 THR H H 137 7.950 7.950 8.208 -0.258 18329
635 1 . 1 1 115 115 VAL N N 138 119.080 119.080 120.647 -1.567 18329
636 1 . 1 1 115 115 VAL HA H 138 3.820 3.820 3.743 0.077 18329
637 1 . 1 1 115 115 VAL C C 138 176.900 176.900 177.572 -0.672 18329
638 1 . 1 1 115 115 VAL CA C 138 66.800 66.800 66.044 0.756 18329
639 1 . 1 1 115 115 VAL CB C 138 32.500 32.500 31.599 0.902 18329
640 1 . 1 1 115 115 VAL H H 138 7.320 7.320 7.897 -0.577 18329
641 1 . 1 1 116 116 SER N N 139 116.630 116.630 115.481 1.149 18329
642 1 . 1 1 116 116 SER HA H 139 4.680 4.680 4.385 0.295 18329
643 1 . 1 1 116 116 SER C C 139 179.000 179.000 176.788 2.212 18329
644 1 . 1 1 116 116 SER CA C 139 61.400 61.400 61.518 -0.117 18329
645 1 . 1 1 116 116 SER CB C 139 62.800 62.800 62.983 -0.183 18329
646 1 . 1 1 116 116 SER H H 139 8.990 8.990 8.231 0.759 18329
647 1 . 1 1 117 117 ASP N N 140 124.220 124.220 122.263 1.958 18329
648 1 . 1 1 117 117 ASP HA H 140 4.360 4.360 4.461 -0.101 18329
649 1 . 1 1 117 117 ASP C C 140 179.900 179.900 177.868 2.032 18329
650 1 . 1 1 117 117 ASP CA C 140 57.300 57.300 56.792 0.508 18329
651 1 . 1 1 117 117 ASP CB C 140 39.500 39.500 40.710 -1.210 18329
652 1 . 1 1 117 117 ASP H H 140 9.480 9.480 8.447 1.033 18329
653 1 . 1 1 118 118 ALA N N 141 121.420 121.420 121.660 -0.240 18329
654 1 . 1 1 118 118 ALA HA H 141 4.280 4.280 4.132 0.148 18329
655 1 . 1 1 118 118 ALA C C 141 179.800 179.800 178.933 0.867 18329
656 1 . 1 1 118 118 ALA CA C 141 54.400 54.400 54.711 -0.311 18329
657 1 . 1 1 118 118 ALA CB C 141 19.000 19.000 18.487 0.513 18329
658 1 . 1 1 118 118 ALA H H 141 7.340 7.340 7.577 -0.237 18329
659 1 . 1 1 119 119 ALA N N 142 121.680 121.680 119.918 1.762 18329
660 1 . 1 1 119 119 ALA HA H 142 4.130 4.130 4.044 0.086 18329
661 1 . 1 1 119 119 ALA C C 142 178.800 178.800 178.961 -0.161 18329
662 1 . 1 1 119 119 ALA CA C 142 53.200 53.200 54.305 -1.105 18329
663 1 . 1 1 119 119 ALA CB C 142 18.300 18.300 18.535 -0.235 18329
664 1 . 1 1 119 119 ALA H H 142 7.890 7.890 7.614 0.276 18329
665 1 . 1 1 120 120 GLU N N 143 117.690 117.690 118.005 -0.315 18329
666 1 . 1 1 120 120 GLU HA H 143 3.940 3.940 4.126 -0.186 18329
667 1 . 1 1 120 120 GLU C C 143 178.100 178.100 177.416 0.684 18329
668 1 . 1 1 120 120 GLU CA C 143 58.700 58.700 57.931 0.769 18329
669 1 . 1 1 120 120 GLU CB C 143 29.500 29.500 29.055 0.445 18329
670 1 . 1 1 120 120 GLU H H 143 7.500 7.500 7.717 -0.217 18329
671 1 . 1 1 121 121 GLU N N 144 115.680 115.680 119.449 -3.769 18329
672 1 . 1 1 121 121 GLU HA H 144 4.160 4.160 4.195 -0.035 18329
673 1 . 1 1 121 121 GLU C C 144 176.100 176.100 176.359 -0.259 18329
674 1 . 1 1 121 121 GLU CA C 144 56.900 56.900 57.973 -1.073 18329
675 1 . 1 1 121 121 GLU CB C 144 31.100 31.100 30.482 0.618 18329
676 1 . 1 1 121 121 GLU H H 144 6.970 6.970 8.050 -1.080 18329
677 1 . 1 1 122 122 ASN N N 145 117.750 117.750 117.435 0.315 18329
678 1 . 1 1 122 122 ASN HA H 145 4.990 4.990 5.051 -0.061 18329
679 1 . 1 1 122 122 ASN C C 145 185.300 185.300 172.745 12.555 18329
680 1 . 1 1 122 122 ASN CA C 145 50.200 50.200 51.033 -0.833 18329
681 1 . 1 1 122 122 ASN CB C 145 41.100 41.100 39.098 2.002 18329
682 1 . 1 1 122 122 ASN H H 145 7.670 7.670 8.052 -0.382 18329
683 1 . 1 1 123 123 PRO HA H 146 4.630 4.630 4.536 0.094 18329
684 1 . 1 1 123 123 PRO CA C 146 61.000 61.000 62.266 -1.266 18329
685 1 . 1 1 123 123 PRO CB C 146 31.300 31.300 31.357 -0.058 18329
686 1 . 1 1 124 124 PRO HA H 147 4.440 4.440 4.287 0.153 18329
687 1 . 1 1 124 124 PRO CA C 147 62.900 62.900 63.431 -0.531 18329
688 1 . 1 1 124 124 PRO CB C 147 28.400 28.400 31.275 -2.875 18329
689 1 . 1 1 125 125 THR N N 148 106.090 106.090 113.602 -7.512 18329
690 1 . 1 1 125 125 THR HA H 148 4.530 4.530 4.347 0.183 18329
691 1 . 1 1 125 125 THR C C 148 174.300 174.300 173.932 0.368 18329
692 1 . 1 1 125 125 THR CA C 148 61.200 61.200 62.366 -1.166 18329
693 1 . 1 1 125 125 THR CB C 148 68.600 68.600 69.414 -0.815 18329
694 1 . 1 1 125 125 THR H H 148 7.800 7.800 8.186 -0.386 18329
695 1 . 1 1 126 126 THR N N 149 108.650 108.650 112.614 -3.964 18329
696 1 . 1 1 126 126 THR HA H 149 4.170 4.170 4.493 -0.323 18329
697 1 . 1 1 126 126 THR C C 149 173.100 173.100 173.586 -0.486 18329
698 1 . 1 1 126 126 THR CA C 149 58.800 58.800 60.015 -1.215 18329
699 1 . 1 1 126 126 THR CB C 149 73.100 73.100 71.680 1.420 18329
700 1 . 1 1 126 126 THR H H 149 7.350 7.350 7.158 0.192 18329
701 1 . 1 1 127 127 ALA N N 150 123.270 123.270 124.161 -0.891 18329
702 1 . 1 1 127 127 ALA HA H 150 3.020 3.020 3.461 -0.441 18329
703 1 . 1 1 127 127 ALA CA C 150 55.000 55.000 55.059 -0.059 18329
704 1 . 1 1 127 127 ALA CB C 150 18.700 18.700 18.602 0.098 18329
705 1 . 1 1 127 127 ALA H H 150 7.750 7.750 8.728 -0.978 18329
706 1 . 1 1 128 128 GLN N N 151 114.920 114.920 117.367 -2.447 18329
707 1 . 1 1 128 128 GLN HA H 151 3.750 3.750 4.024 -0.274 18329
708 1 . 1 1 128 128 GLN C C 151 178.400 178.400 178.288 0.112 18329
709 1 . 1 1 128 128 GLN CA C 151 58.800 58.800 58.294 0.506 18329
710 1 . 1 1 128 128 GLN CB C 151 27.200 27.200 28.293 -1.093 18329
711 1 . 1 1 128 128 GLN H H 151 8.300 8.300 8.445 -0.145 18329
712 1 . 1 1 129 129 GLY N N 152 107.280 107.280 107.597 -0.317 18329
713 1 . 1 1 129 129 GLY C C 152 174.900 174.900 176.076 -1.176 18329
714 1 . 1 1 129 129 GLY CA C 152 47.200 47.200 46.854 0.346 18329
715 1 . 1 1 129 129 GLY H H 152 7.920 7.920 7.883 0.037 18329
716 1 . 1 1 130 130 VAL N N 153 119.440 119.440 122.398 -2.958 18329
717 1 . 1 1 130 130 VAL HA H 153 3.470 3.470 3.680 -0.210 18329
718 1 . 1 1 130 130 VAL C C 153 177.700 177.700 177.557 0.143 18329
719 1 . 1 1 130 130 VAL CA C 153 67.800 67.800 65.707 2.093 18329
720 1 . 1 1 130 130 VAL CB C 153 31.700 31.700 31.498 0.202 18329
721 1 . 1 1 130 130 VAL H H 153 7.390 7.390 7.445 -0.055 18329
722 1 . 1 1 131 131 LEU N N 154 118.990 118.990 119.410 -0.420 18329
723 1 . 1 1 131 131 LEU HA H 154 3.910 3.910 3.851 0.059 18329
724 1 . 1 1 131 131 LEU C C 154 180.400 180.400 178.666 1.734 18329
725 1 . 1 1 131 131 LEU CA C 154 58.300 58.300 58.161 0.139 18329
726 1 . 1 1 131 131 LEU CB C 154 41.000 41.000 41.144 -0.144 18329
727 1 . 1 1 131 131 LEU H H 154 8.640 8.640 7.610 1.030 18329
728 1 . 1 1 132 132 GLU N N 155 120.980 120.980 119.206 1.774 18329
729 1 . 1 1 132 132 GLU HA H 155 4.120 4.120 4.012 0.108 18329
730 1 . 1 1 132 132 GLU C C 155 179.400 179.400 179.060 0.340 18329
731 1 . 1 1 132 132 GLU CA C 155 58.900 58.900 59.416 -0.516 18329
732 1 . 1 1 132 132 GLU CB C 155 29.200 29.200 29.268 -0.068 18329
733 1 . 1 1 132 132 GLU H H 155 8.000 8.000 7.672 0.328 18329
734 1 . 1 1 133 133 ILE N N 156 121.830 121.830 119.811 2.019 18329
735 1 . 1 1 133 133 ILE HA H 156 3.580 3.580 3.799 -0.219 18329
736 1 . 1 1 133 133 ILE C C 156 178.000 178.000 178.036 -0.036 18329
737 1 . 1 1 133 133 ILE CA C 156 65.500 65.500 63.095 2.405 18329
738 1 . 1 1 133 133 ILE CB C 156 39.600 39.600 36.808 2.792 18329
739 1 . 1 1 133 133 ILE H H 156 8.040 8.040 7.563 0.477 18329
740 1 . 1 1 134 134 ALA N N 157 121.470 121.470 122.936 -1.466 18329
741 1 . 1 1 134 134 ALA HA H 157 3.900 3.900 3.913 -0.013 18329
742 1 . 1 1 134 134 ALA C C 157 178.800 178.800 179.482 -0.682 18329
743 1 . 1 1 134 134 ALA CA C 157 55.300 55.300 55.440 -0.140 18329
744 1 . 1 1 134 134 ALA CB C 157 18.100 18.100 18.054 0.046 18329
745 1 . 1 1 134 134 ALA H H 157 8.950 8.950 8.322 0.628 18329
746 1 . 1 1 135 135 LYS N N 158 118.470 118.470 118.415 0.055 18329
747 1 . 1 1 135 135 LYS HA H 158 3.910 3.910 3.957 -0.047 18329
748 1 . 1 1 135 135 LYS C C 158 179.300 179.300 178.931 0.369 18329
749 1 . 1 1 135 135 LYS CA C 158 59.500 59.500 59.561 -0.061 18329
750 1 . 1 1 135 135 LYS CB C 158 31.400 31.400 32.322 -0.922 18329
751 1 . 1 1 135 135 LYS H H 158 8.000 8.000 7.926 0.073 18329
752 1 . 1 1 136 136 LYS N N 159 118.000 118.000 119.195 -1.196 18329
753 1 . 1 1 136 136 LYS HA H 159 4.050 4.050 4.123 -0.073 18329
754 1 . 1 1 136 136 LYS C C 159 180.200 180.200 179.395 0.805 18329
755 1 . 1 1 136 136 LYS CA C 159 59.500 59.500 59.032 0.468 18329
756 1 . 1 1 136 136 LYS CB C 159 30.900 30.900 32.214 -1.314 18329
757 1 . 1 1 136 136 LYS H H 159 7.530 7.530 7.755 -0.225 18329
758 1 . 1 1 137 137 MET N N 160 120.990 120.990 119.370 1.620 18329
759 1 . 1 1 137 137 MET HA H 160 3.800 3.800 4.130 -0.330 18329
760 1 . 1 1 137 137 MET C C 160 177.400 177.400 178.232 -0.832 18329
761 1 . 1 1 137 137 MET CA C 160 60.600 60.600 59.815 0.785 18329
762 1 . 1 1 137 137 MET CB C 160 31.800 31.800 32.638 -0.838 18329
763 1 . 1 1 137 137 MET H H 160 8.660 8.660 8.316 0.344 18329
764 1 . 1 1 138 138 ARG N N 161 119.480 119.480 119.306 0.173 18329
765 1 . 1 1 138 138 ARG HA H 161 3.800 3.800 3.968 -0.168 18329
766 1 . 1 1 138 138 ARG C C 161 177.900 177.900 178.543 -0.643 18329
767 1 . 1 1 138 138 ARG CA C 161 60.600 60.600 59.699 0.901 18329
768 1 . 1 1 138 138 ARG CB C 161 29.800 29.800 30.216 -0.416 18329
769 1 . 1 1 138 138 ARG H H 161 9.280 9.280 8.287 0.994 18329
770 1 . 1 1 139 139 GLU N N 162 118.700 118.700 119.314 -0.614 18329
771 1 . 1 1 139 139 GLU HA H 162 4.000 4.000 4.065 -0.065 18329
772 1 . 1 1 139 139 GLU C C 162 179.100 179.100 178.634 0.467 18329
773 1 . 1 1 139 139 GLU CA C 162 59.800 59.800 59.310 0.490 18329
774 1 . 1 1 139 139 GLU CB C 162 29.500 29.500 29.432 0.068 18329
775 1 . 1 1 139 139 GLU H H 162 8.430 8.430 8.162 0.269 18329
776 1 . 1 1 140 140 LYS N N 163 119.310 119.310 119.758 -0.448 18329
777 1 . 1 1 140 140 LYS HA H 163 4.210 4.210 4.107 0.103 18329
778 1 . 1 1 140 140 LYS C C 163 177.900 177.900 179.222 -1.322 18329
779 1 . 1 1 140 140 LYS CA C 163 58.900 58.900 58.725 0.175 18329
780 1 . 1 1 140 140 LYS CB C 163 31.100 31.100 32.322 -1.222 18329
781 1 . 1 1 140 140 LYS H H 163 7.440 7.440 7.646 -0.206 18329
782 1 . 1 1 141 141 LEU N N 164 117.630 117.630 119.506 -1.876 18329
783 1 . 1 1 141 141 LEU HA H 164 3.890 3.890 4.019 -0.129 18329
784 1 . 1 1 141 141 LEU C C 164 178.700 178.700 178.850 -0.150 18329
785 1 . 1 1 141 141 LEU CA C 164 58.000 58.000 57.830 0.170 18329
786 1 . 1 1 141 141 LEU CB C 164 41.500 41.500 41.750 -0.250 18329
787 1 . 1 1 141 141 LEU H H 164 8.180 8.180 7.927 0.253 18329
788 1 . 1 1 142 142 GLN N N 165 117.710 117.710 118.223 -0.513 18329
789 1 . 1 1 142 142 GLN HA H 165 4.310 4.310 3.974 0.336 18329
790 1 . 1 1 142 142 GLN C C 165 179.200 179.200 178.273 0.927 18329
791 1 . 1 1 142 142 GLN CA C 165 58.500 58.500 59.086 -0.586 18329
792 1 . 1 1 142 142 GLN CB C 165 27.500 27.500 28.382 -0.882 18329
793 1 . 1 1 142 142 GLN H H 165 8.730 8.730 8.015 0.715 18329
794 1 . 1 1 143 143 ARG N N 166 121.410 121.410 119.686 1.724 18329
795 1 . 1 1 143 143 ARG HA H 166 4.190 4.190 4.084 0.106 18329
796 1 . 1 1 143 143 ARG C C 166 179.700 179.700 178.595 1.105 18329
797 1 . 1 1 143 143 ARG CA C 166 59.800 59.800 59.341 0.459 18329
798 1 . 1 1 143 143 ARG CB C 166 30.200 30.200 29.980 0.220 18329
799 1 . 1 1 143 143 ARG H H 166 8.050 8.050 7.834 0.216 18329
800 1 . 1 1 144 144 VAL N N 167 120.950 120.950 119.107 1.843 18329
801 1 . 1 1 144 144 VAL HA H 167 3.760 3.760 3.700 0.060 18329
802 1 . 1 1 144 144 VAL C C 167 179.200 179.200 177.730 1.470 18329
803 1 . 1 1 144 144 VAL CA C 167 66.400 66.400 66.551 -0.151 18329
804 1 . 1 1 144 144 VAL CB C 167 32.100 32.100 31.502 0.598 18329
805 1 . 1 1 144 144 VAL H H 167 8.190 8.190 7.546 0.644 18329
806 1 . 1 1 145 145 HIS N N 168 123.520 123.520 118.664 4.856 18329
807 1 . 1 1 145 145 HIS HA H 168 3.900 3.900 4.467 -0.568 18329
808 1 . 1 1 145 145 HIS C C 168 177.100 177.100 177.638 -0.538 18329
809 1 . 1 1 145 145 HIS CA C 168 61.300 61.300 59.279 2.022 18329
810 1 . 1 1 145 145 HIS CB C 168 29.900 29.900 30.212 -0.312 18329
811 1 . 1 1 145 145 HIS H H 168 9.240 9.240 7.955 1.285 18329
812 1 . 1 1 146 146 THR N N 169 115.020 115.020 117.066 -2.046 18329
813 1 . 1 1 146 146 THR HA H 169 3.860 3.860 4.152 -0.291 18329
814 1 . 1 1 146 146 THR C C 169 175.700 175.700 176.332 -0.632 18329
815 1 . 1 1 146 146 THR CA C 169 67.200 67.200 67.049 0.151 18329
816 1 . 1 1 146 146 THR CB C 169 69.300 69.300 68.758 0.542 18329
817 1 . 1 1 146 146 THR H H 169 8.750 8.750 8.530 0.220 18329
818 1 . 1 1 147 147 LYS N N 170 120.300 120.300 121.147 -0.847 18329
819 1 . 1 1 147 147 LYS HA H 170 4.000 4.000 3.987 0.013 18329
820 1 . 1 1 147 147 LYS C C 170 179.300 179.300 178.794 0.506 18329
821 1 . 1 1 147 147 LYS CA C 170 59.100 59.100 59.849 -0.749 18329
822 1 . 1 1 147 147 LYS CB C 170 31.800 31.800 32.200 -0.400 18329
823 1 . 1 1 147 147 LYS H H 170 8.020 8.020 8.144 -0.124 18329
824 1 . 1 1 148 148 ASN N N 171 117.600 117.600 117.782 -0.182 18329
825 1 . 1 1 148 148 ASN HA H 171 4.320 4.320 4.490 -0.170 18329
826 1 . 1 1 148 148 ASN C C 171 175.400 175.400 177.637 -2.237 18329
827 1 . 1 1 148 148 ASN CA C 171 57.700 57.700 55.869 1.831 18329
828 1 . 1 1 148 148 ASN CB C 171 39.700 39.700 38.489 1.211 18329
829 1 . 1 1 148 148 ASN H H 171 7.810 7.810 7.689 0.121 18329
830 1 . 1 1 149 149 TYR N N 172 121.560 121.560 121.414 0.146 18329
831 1 . 1 1 149 149 TYR HA H 172 3.890 3.890 4.213 -0.324 18329
832 1 . 1 1 149 149 TYR C C 172 176.900 176.900 177.544 -0.644 18329
833 1 . 1 1 149 149 TYR CA C 172 61.500 61.500 61.897 -0.398 18329
834 1 . 1 1 149 149 TYR CB C 172 38.920 38.920 38.647 0.273 18329
835 1 . 1 1 149 149 TYR H H 172 9.020 9.020 7.850 1.170 18329
836 1 . 1 1 150 150 CYS N N 173 116.050 116.050 117.921 -1.871 18329
837 1 . 1 1 150 150 CYS C C 173 177.100 177.100 176.671 0.429 18329
838 1 . 1 1 150 150 CYS CA C 173 58.400 58.400 61.135 -2.735 18329
839 1 . 1 1 150 150 CYS CB C 173 38.600 38.600 26.240 12.360 18329
840 1 . 1 1 150 150 CYS H H 173 8.810 8.810 8.338 0.472 18329
841 1 . 1 1 151 151 THR N N 174 117.190 117.190 115.499 1.691 18329
842 1 . 1 1 151 151 THR HA H 174 3.880 3.880 4.018 -0.138 18329
843 1 . 1 1 151 151 THR C C 174 176.000 176.000 176.622 -0.622 18329
844 1 . 1 1 151 151 THR CA C 174 66.900 66.900 65.714 1.186 18329
845 1 . 1 1 151 151 THR CB C 174 68.500 68.500 68.407 0.093 18329
846 1 . 1 1 151 151 THR H H 174 7.720 7.720 7.959 -0.239 18329
847 1 . 1 1 152 152 LEU N N 175 123.110 123.110 122.076 1.034 18329
848 1 . 1 1 152 152 LEU HA H 175 3.810 3.810 4.065 -0.255 18329
849 1 . 1 1 152 152 LEU CA C 175 58.000 58.000 57.446 0.554 18329
850 1 . 1 1 152 152 LEU CB C 175 41.500 41.500 41.461 0.039 18329
851 1 . 1 1 152 152 LEU H H 175 7.870 7.870 7.690 0.181 18329
852 1 . 1 1 153 153 LYS N N 176 117.270 117.270 118.197 -0.927 18329
853 1 . 1 1 153 153 LYS HA H 176 3.700 3.700 3.891 -0.191 18329
854 1 . 1 1 153 153 LYS C C 176 179.100 179.100 177.983 1.117 18329
855 1 . 1 1 153 153 LYS CA C 176 56.700 56.700 58.382 -1.682 18329
856 1 . 1 1 153 153 LYS CB C 176 29.900 29.900 31.522 -1.622 18329
857 1 . 1 1 153 153 LYS H H 176 7.900 7.900 7.542 0.358 18329
858 1 . 1 1 154 154 LYS N N 177 119.290 119.290 119.343 -0.053 18329
859 1 . 1 1 154 154 LYS HA H 177 4.260 4.260 4.027 0.233 18329
860 1 . 1 1 154 154 LYS C C 177 178.100 178.100 178.150 -0.050 18329
861 1 . 1 1 154 154 LYS CA C 177 57.800 57.800 59.196 -1.396 18329
862 1 . 1 1 154 154 LYS CB C 177 31.800 31.800 31.932 -0.132 18329
863 1 . 1 1 154 154 LYS H H 177 7.540 7.540 7.675 -0.135 18329
864 1 . 1 1 155 155 LYS N N 178 118.910 118.910 118.179 0.732 18329
865 1 . 1 1 155 155 LYS HA H 178 4.050 4.050 4.068 -0.018 18329
866 1 . 1 1 155 155 LYS C C 178 178.100 178.100 178.563 -0.463 18329
867 1 . 1 1 155 155 LYS CA C 178 58.000 58.000 58.761 -0.762 18329
868 1 . 1 1 155 155 LYS CB C 178 32.200 32.200 32.239 -0.039 18329
869 1 . 1 1 155 155 LYS H H 178 7.630 7.630 7.685 -0.055 18329
870 1 . 1 1 156 156 GLU N N 179 117.950 117.950 118.014 -0.064 18329
871 1 . 1 1 156 156 GLU HA H 179 4.110 4.110 4.118 -0.008 18329
872 1 . 1 1 156 156 GLU C C 179 176.700 176.700 178.062 -1.362 18329
873 1 . 1 1 156 156 GLU CA C 179 57.500 57.500 58.528 -1.028 18329
874 1 . 1 1 156 156 GLU CB C 179 29.600 29.600 29.757 -0.157 18329
875 1 . 1 1 156 156 GLU H H 179 7.560 7.560 7.923 -0.363 18329
876 1 . 1 1 157 157 ASN N N 180 116.590 116.590 115.967 0.623 18329
877 1 . 1 1 157 157 ASN HA H 180 4.720 4.720 4.707 0.013 18329
878 1 . 1 1 157 157 ASN C C 180 175.000 175.000 175.794 -0.794 18329
879 1 . 1 1 157 157 ASN CA C 180 52.700 52.700 53.689 -0.989 18329
880 1 . 1 1 157 157 ASN CB C 180 38.800 38.800 38.980 -0.180 18329
881 1 . 1 1 157 157 ASN H H 180 7.820 7.820 7.965 -0.145 18329
882 1 . 1 1 158 158 SER HA H 181 4.450 4.450 4.240 0.210 18329
883 1 . 1 1 158 158 SER CA C 181 60.400 60.400 60.278 0.122 18329
884 1 . 1 1 158 158 SER CB C 181 63.500 63.500 62.561 0.939 18329
885 1 . 1 1 158 158 SER H H 181 8.030 8.030 8.204 -0.174 18329
886 1 . 1 1 159 159 THR N N 182 112.800 112.800 114.788 -1.988 18329
887 1 . 1 1 159 159 THR HA H 182 4.380 4.380 4.289 0.091 18329
888 1 . 1 1 159 159 THR C C 182 174.300 174.300 174.374 -0.074 18329
889 1 . 1 1 159 159 THR CA C 182 61.800 61.800 63.297 -1.497 18329
890 1 . 1 1 159 159 THR CB C 182 69.100 69.100 68.909 0.191 18329
891 1 . 1 1 159 159 THR H H 182 8.070 8.070 8.024 0.046 18329
892 1 . 1 1 160 160 PHE N N 183 123.120 123.120 121.372 1.748 18329
893 1 . 1 1 160 160 PHE HA H 183 4.440 4.440 4.610 -0.170 18329
894 1 . 1 1 160 160 PHE C C 183 175.100 175.100 175.297 -0.197 18329
895 1 . 1 1 160 160 PHE CA C 183 58.900 58.900 58.078 0.822 18329
896 1 . 1 1 160 160 PHE CB C 183 40.000 40.000 39.929 0.071 18329
897 1 . 1 1 160 160 PHE H H 183 7.900 7.900 7.824 0.076 18329
898 1 . 1 1 161 161 THR N N 184 119.330 119.330 116.564 2.766 18329
899 1 . 1 1 161 161 THR HA H 184 4.190 4.190 4.141 0.049 18329
900 1 . 1 1 161 161 THR CA C 184 60.700 60.700 63.192 -2.492 18329
901 1 . 1 1 161 161 THR CB C 184 70.700 70.700 68.778 1.922 18329
902 1 . 1 1 161 161 THR H H 184 7.810 7.810 7.753 0.057 18329
903 1 . 1 1 162 162 ASP N N 185 123.190 123.190 121.107 2.083 18329
904 1 . 1 1 162 162 ASP HA H 185 4.410 4.410 4.569 -0.159 18329
905 1 . 1 1 162 162 ASP C C 185 176.900 176.900 175.344 1.556 18329
906 1 . 1 1 162 162 ASP CA C 185 53.900 53.900 54.667 -0.767 18329
907 1 . 1 1 162 162 ASP CB C 185 44.000 44.000 41.280 2.720 18329
908 1 . 1 1 162 162 ASP H H 185 8.000 8.000 8.391 -0.391 18329
909 1 . 1 1 163 163 GLU HA H 186 4.480 4.480 4.296 0.184 18329
910 1 . 1 1 163 163 GLU CA C 186 58.800 58.800 56.492 2.308 18329
911 1 . 1 1 163 163 GLU CB C 186 28.100 28.100 30.266 -2.166 18329
912 1 . 1 1 166 166 LYS N N 189 118.150 118.150 120.699 -2.549 18329
913 1 . 1 1 166 166 LYS HA H 189 4.220 4.220 4.135 0.085 18329
914 1 . 1 1 166 166 LYS C C 189 177.500 177.500 175.901 1.599 18329
915 1 . 1 1 166 166 LYS CA C 189 58.000 58.000 57.257 0.743 18329
916 1 . 1 1 166 166 LYS CB C 189 32.600 32.600 32.356 0.244 18329
917 1 . 1 1 166 166 LYS H H 189 8.890 8.890 8.165 0.725 18329
918 1 . 1 1 167 167 ASN N N 190 116.210 116.210 119.675 -3.465 18329
919 1 . 1 1 167 167 ASN HA H 190 4.960 4.960 4.591 0.369 18329
920 1 . 1 1 167 167 ASN C C 190 174.900 174.900 174.899 0.001 18329
921 1 . 1 1 167 167 ASN CA C 190 52.900 52.900 53.657 -0.756 18329
922 1 . 1 1 167 167 ASN CB C 190 38.400 38.400 38.608 -0.208 18329
923 1 . 1 1 167 167 ASN H H 190 8.030 8.030 8.481 -0.451 18329
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