data_18995
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18995
_Entry.PDB_ID 2M49
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 18995
_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 20 20 ARG C C 20 177.097 177.097 175.288 1.809 18995
2 1 1 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.770 4.330 18995
3 1 1 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.996 0.004 18995
4 1 1 . 1 1 21 21 GLU N N 21 116.519 116.519 119.599 -3.080 18995
5 1 1 . 1 1 21 21 GLU C C 21 175.055 175.055 175.072 -0.017 18995
6 1 1 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.653 0.947 18995
7 1 1 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.786 0.914 18995
8 1 1 . 1 1 21 21 GLU H H 21 9.468 9.468 9.135 0.333 18995
9 1 1 . 1 1 22 22 GLY N N 22 122.197 122.197 107.852 14.345 18995
10 1 1 . 1 1 22 22 GLY C C 22 180.081 180.081 173.551 6.530 18995
11 1 1 . 1 1 22 22 GLY H H 22 10.096 10.096 9.277 0.819 18995
12 1 1 . 1 1 23 23 ASP N N 23 113.764 113.764 125.846 -12.082 18995
13 1 1 . 1 1 23 23 ASP C C 23 178.957 178.957 175.222 3.735 18995
14 1 1 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.439 2.061 18995
15 1 1 . 1 1 23 23 ASP H H 23 8.115 8.115 9.297 -1.182 18995
16 1 1 . 1 1 24 24 LYS N N 24 131.954 131.954 127.695 4.259 18995
17 1 1 . 1 1 24 24 LYS C C 24 176.539 176.539 175.393 1.146 18995
18 1 1 . 1 1 24 24 LYS CA C 24 58.200 58.200 54.975 3.225 18995
19 1 1 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.287 -1.587 18995
20 1 1 . 1 1 24 24 LYS H H 24 9.484 9.484 8.984 0.500 18995
21 1 1 . 1 1 25 25 HIS N N 25 119.313 119.313 128.538 -9.225 18995
22 1 1 . 1 1 25 25 HIS C C 25 172.815 172.815 174.936 -2.121 18995
23 1 1 . 1 1 25 25 HIS CA C 25 55.500 55.500 55.435 0.065 18995
24 1 1 . 1 1 25 25 HIS CB C 25 30.800 30.800 31.992 -1.192 18995
25 1 1 . 1 1 25 25 HIS H H 25 9.589 9.589 8.836 0.753 18995
26 1 1 . 1 1 26 26 LYS N N 26 115.394 115.394 126.261 -10.867 18995
27 1 1 . 1 1 26 26 LYS C C 26 174.608 174.608 175.522 -0.914 18995
28 1 1 . 1 1 26 26 LYS CA C 26 55.400 55.400 56.949 -1.548 18995
29 1 1 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.143 6.957 18995
30 1 1 . 1 1 26 26 LYS H H 26 7.095 7.095 8.121 -1.026 18995
31 1 1 . 1 1 27 27 LEU N N 27 126.263 126.263 120.195 6.068 18995
32 1 1 . 1 1 27 27 LEU C C 27 175.637 175.637 176.379 -0.742 18995
33 1 1 . 1 1 27 27 LEU CA C 27 52.800 52.800 54.143 -1.343 18995
34 1 1 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.544 1.156 18995
35 1 1 . 1 1 27 27 LEU H H 27 9.595 9.595 7.105 2.490 18995
36 1 1 . 1 1 28 28 LYS N N 28 124.436 124.436 124.525 -0.089 18995
37 1 1 . 1 1 28 28 LYS C C 28 177.395 177.395 176.274 1.121 18995
38 1 1 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.563 -1.363 18995
39 1 1 . 1 1 28 28 LYS H H 28 9.711 9.711 8.755 0.956 18995
40 1 1 . 1 1 29 29 LYS N N 29 121.980 121.980 119.403 2.577 18995
41 1 1 . 1 1 29 29 LYS C C 29 177.400 177.400 174.770 2.630 18995
42 1 1 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.863 6.837 18995
43 1 1 . 1 1 29 29 LYS H H 29 9.084 9.084 7.571 1.513 18995
44 1 1 . 1 1 30 30 SER N N 30 111.519 111.519 113.193 -1.674 18995
45 1 1 . 1 1 30 30 SER C C 30 176.950 176.950 173.232 3.718 18995
46 1 1 . 1 1 30 30 SER CA C 30 61.100 61.100 56.794 4.306 18995
47 1 1 . 1 1 30 30 SER CB C 30 61.300 61.300 65.585 -4.285 18995
48 1 1 . 1 1 30 30 SER H H 30 8.267 8.267 7.148 1.119 18995
49 1 1 . 1 1 31 31 GLU N N 31 123.792 123.792 120.347 3.445 18995
50 1 1 . 1 1 31 31 GLU C C 31 179.463 179.463 176.895 2.568 18995
51 1 1 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.605 4.495 18995
52 1 1 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.370 -2.170 18995
53 1 1 . 1 1 31 31 GLU H H 31 6.603 6.603 9.618 -3.015 18995
54 1 1 . 1 1 32 32 LEU N N 32 121.954 121.954 124.893 -2.939 18995
55 1 1 . 1 1 32 32 LEU C C 32 176.995 176.995 175.632 1.363 18995
56 1 1 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.380 2.520 18995
57 1 1 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.156 0.144 18995
58 1 1 . 1 1 32 32 LEU H H 32 8.936 8.936 9.007 -0.071 18995
59 1 1 . 1 1 33 33 LYS N N 33 118.576 118.576 128.478 -9.902 18995
60 1 1 . 1 1 33 33 LYS C C 33 176.714 176.714 175.141 1.573 18995
61 1 1 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.824 5.676 18995
62 1 1 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.947 -2.047 18995
63 1 1 . 1 1 33 33 LYS H H 33 8.390 8.390 9.248 -0.858 18995
64 1 1 . 1 1 34 34 GLU N N 34 116.152 116.152 127.889 -11.737 18995
65 1 1 . 1 1 34 34 GLU C C 34 177.689 177.689 175.390 2.299 18995
66 1 1 . 1 1 34 34 GLU CA C 34 59.400 59.400 56.023 3.377 18995
67 1 1 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.993 -1.593 18995
68 1 1 . 1 1 34 34 GLU H H 34 7.326 7.326 8.072 -0.746 18995
69 1 1 . 1 1 35 35 LEU N N 35 123.632 123.632 127.562 -3.930 18995
70 1 1 . 1 1 35 35 LEU C C 35 178.845 178.845 176.276 2.569 18995
71 1 1 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.275 7.525 18995
72 1 1 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.622 -1.622 18995
73 1 1 . 1 1 35 35 LEU H H 35 7.978 7.978 8.932 -0.954 18995
74 1 1 . 1 1 36 36 ILE C C 36 178.328 178.328 176.087 2.241 18995
75 1 1 . 1 1 36 36 ILE CA C 36 66.300 66.300 63.241 3.059 18995
76 1 1 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.270 0.430 18995
77 1 1 . 1 1 37 37 ASN N N 37 118.242 118.242 112.897 5.345 18995
78 1 1 . 1 1 37 37 ASN C C 37 177.052 177.052 176.796 0.256 18995
79 1 1 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.356 1.444 18995
80 1 1 . 1 1 37 37 ASN CB C 37 37.500 37.500 37.889 -0.389 18995
81 1 1 . 1 1 37 37 ASN H H 37 8.336 8.336 8.496 -0.160 18995
82 1 1 . 1 1 38 38 ASN N N 38 114.845 114.845 118.871 -4.026 18995
83 1 1 . 1 1 38 38 ASN C C 38 176.578 176.578 174.630 1.948 18995
84 1 1 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.743 2.457 18995
85 1 1 . 1 1 38 38 ASN H H 38 8.213 8.213 8.085 0.128 18995
86 1 1 . 1 1 39 39 GLU N N 39 113.797 113.797 120.780 -6.983 18995
87 1 1 . 1 1 39 39 GLU C C 39 177.689 177.689 174.456 3.233 18995
88 1 1 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.540 -1.340 18995
89 1 1 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.236 0.064 18995
90 1 1 . 1 1 39 39 GLU H H 39 8.522 8.522 8.497 0.025 18995
91 1 1 . 1 1 40 40 LEU N N 40 119.982 119.982 121.478 -1.496 18995
92 1 1 . 1 1 40 40 LEU C C 40 177.212 177.212 175.620 1.592 18995
93 1 1 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.365 0.735 18995
94 1 1 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.355 -1.655 18995
95 1 1 . 1 1 40 40 LEU H H 40 7.552 7.552 8.537 -0.985 18995
96 1 1 . 1 1 41 41 SER N N 41 114.635 114.635 120.474 -5.839 18995
97 1 1 . 1 1 41 41 SER C C 41 175.688 175.688 172.653 3.035 18995
98 1 1 . 1 1 41 41 SER CA C 41 60.800 60.800 56.956 3.844 18995
99 1 1 . 1 1 41 41 SER CB C 41 64.100 64.100 67.248 -3.148 18995
100 1 1 . 1 1 41 41 SER H H 41 7.592 7.592 9.103 -1.511 18995
101 1 1 . 1 1 42 42 HIS N N 42 122.397 122.397 115.879 6.518 18995
102 1 1 . 1 1 42 42 HIS C C 42 175.523 175.523 172.715 2.808 18995
103 1 1 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.249 3.451 18995
104 1 1 . 1 1 42 42 HIS H H 42 10.406 10.406 8.423 1.983 18995
105 1 1 . 1 1 43 43 PHE N N 43 117.618 117.618 122.671 -5.053 18995
106 1 1 . 1 1 43 43 PHE C C 43 177.431 177.431 175.838 1.593 18995
107 1 1 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.605 3.195 18995
108 1 1 . 1 1 43 43 PHE H H 43 7.785 7.785 8.392 -0.607 18995
109 1 1 . 1 1 44 44 LEU N N 44 120.185 120.185 126.664 -6.479 18995
110 1 1 . 1 1 44 44 LEU C C 44 175.829 175.829 176.555 -0.726 18995
111 1 1 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.537 -2.737 18995
112 1 1 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.612 2.388 18995
113 1 1 . 1 1 44 44 LEU H H 44 8.533 8.533 8.822 -0.289 18995
114 1 1 . 1 1 45 45 GLU N N 45 121.499 121.499 121.034 0.465 18995
115 1 1 . 1 1 45 45 GLU C C 45 175.060 175.060 177.422 -2.362 18995
116 1 1 . 1 1 45 45 GLU CA C 45 56.600 56.600 57.059 -0.460 18995
117 1 1 . 1 1 45 45 GLU CB C 45 30.600 30.600 28.525 2.075 18995
118 1 1 . 1 1 45 45 GLU H H 45 8.130 8.130 8.610 -0.480 18995
119 1 1 . 1 1 46 46 GLU N N 46 122.480 122.480 124.959 -2.479 18995
120 1 1 . 1 1 46 46 GLU C C 46 176.861 176.861 176.118 0.743 18995
121 1 1 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.655 -0.855 18995
122 1 1 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.029 1.671 18995
123 1 1 . 1 1 46 46 GLU H H 46 8.123 8.123 8.388 -0.265 18995
124 1 1 . 1 1 47 47 ILE N N 47 127.680 127.680 119.033 8.647 18995
125 1 1 . 1 1 47 47 ILE C C 47 175.931 175.931 175.940 -0.009 18995
126 1 1 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.370 0.730 18995
127 1 1 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.858 0.742 18995
128 1 1 . 1 1 47 47 ILE H H 47 9.897 9.897 7.696 2.201 18995
129 1 1 . 1 1 48 48 LYS N N 48 126.846 126.846 123.548 3.298 18995
130 1 1 . 1 1 48 48 LYS C C 48 175.896 175.896 175.561 0.335 18995
131 1 1 . 1 1 48 48 LYS CA C 48 56.600 56.600 53.855 2.745 18995
132 1 1 . 1 1 48 48 LYS CB C 48 34.700 34.700 33.670 1.030 18995
133 1 1 . 1 1 48 48 LYS H H 48 9.077 9.077 7.481 1.596 18995
134 1 1 . 1 1 49 49 GLU C C 49 179.470 179.470 174.754 4.716 18995
135 1 1 . 1 1 49 49 GLU CA C 49 55.600 55.600 56.469 -0.869 18995
136 1 1 . 1 1 49 49 GLU CB C 49 31.800 31.800 28.158 3.642 18995
137 1 1 . 1 1 50 50 GLN N N 50 125.850 125.850 117.686 8.164 18995
138 1 1 . 1 1 50 50 GLN C C 50 176.883 176.883 175.573 1.310 18995
139 1 1 . 1 1 50 50 GLN CA C 50 58.500 58.500 55.979 2.521 18995
140 1 1 . 1 1 50 50 GLN CB C 50 28.400 28.400 30.719 -2.319 18995
141 1 1 . 1 1 50 50 GLN H H 50 9.041 9.041 8.067 0.974 18995
142 1 1 . 1 1 51 51 GLU N N 51 117.404 117.404 113.726 3.678 18995
143 1 1 . 1 1 51 51 GLU C C 51 178.262 178.262 175.435 2.827 18995
144 1 1 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.848 3.852 18995
145 1 1 . 1 1 51 51 GLU CB C 51 29.300 29.300 30.103 -0.803 18995
146 1 1 . 1 1 51 51 GLU H H 51 9.352 9.352 7.311 2.041 18995
147 1 1 . 1 1 52 52 VAL N N 52 118.888 118.888 122.806 -3.918 18995
148 1 1 . 1 1 52 52 VAL C C 52 177.677 177.677 174.538 3.139 18995
149 1 1 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.576 4.524 18995
150 1 1 . 1 1 52 52 VAL CB C 52 31.700 31.700 30.468 1.232 18995
151 1 1 . 1 1 52 52 VAL H H 52 7.247 7.247 7.809 -0.562 18995
152 1 1 . 1 1 53 53 VAL N N 53 119.906 119.906 123.598 -3.692 18995
153 1 1 . 1 1 53 53 VAL C C 53 176.742 176.742 174.606 2.136 18995
154 1 1 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.768 5.432 18995
155 1 1 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.915 -3.315 18995
156 1 1 . 1 1 53 53 VAL H H 53 7.264 7.264 9.059 -1.795 18995
157 1 1 . 1 1 54 54 ASP N N 54 121.483 121.483 121.221 0.262 18995
158 1 1 . 1 1 54 54 ASP C C 54 178.291 178.291 174.346 3.945 18995
159 1 1 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.255 5.945 18995
160 1 1 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.480 -4.480 18995
161 1 1 . 1 1 54 54 ASP H H 54 8.524 8.524 9.124 -0.600 18995
162 1 1 . 1 1 55 55 LYS N N 55 120.875 120.875 127.920 -7.045 18995
163 1 1 . 1 1 55 55 LYS C C 55 179.054 179.054 176.234 2.820 18995
164 1 1 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.765 3.135 18995
165 1 1 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.140 0.060 18995
166 1 1 . 1 1 55 55 LYS H H 55 7.580 7.580 8.877 -1.297 18995
167 1 1 . 1 1 56 56 VAL N N 56 121.960 121.960 123.670 -1.710 18995
168 1 1 . 1 1 56 56 VAL C C 56 178.221 178.221 175.331 2.890 18995
169 1 1 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.496 5.504 18995
170 1 1 . 1 1 56 56 VAL CB C 56 31.700 31.700 32.972 -1.272 18995
171 1 1 . 1 1 56 56 VAL H H 56 8.279 8.279 8.423 -0.144 18995
172 1 1 . 1 1 57 57 MET N N 57 118.815 118.815 126.773 -7.958 18995
173 1 1 . 1 1 57 57 MET C C 57 176.888 176.888 175.449 1.439 18995
174 1 1 . 1 1 57 57 MET CA C 57 57.900 57.900 54.678 3.222 18995
175 1 1 . 1 1 57 57 MET CB C 57 32.900 32.900 33.132 -0.232 18995
176 1 1 . 1 1 57 57 MET H H 57 8.467 8.467 8.956 -0.489 18995
177 1 1 . 1 1 58 58 GLU N N 58 117.894 117.894 125.326 -7.432 18995
178 1 1 . 1 1 58 58 GLU C C 58 178.510 178.510 176.413 2.097 18995
179 1 1 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.077 2.323 18995
180 1 1 . 1 1 58 58 GLU CB C 58 29.800 29.800 31.034 -1.234 18995
181 1 1 . 1 1 58 58 GLU H H 58 8.073 8.073 8.864 -0.791 18995
182 1 1 . 1 1 59 59 THR N N 59 113.244 113.244 112.823 0.421 18995
183 1 1 . 1 1 59 59 THR C C 59 174.778 174.778 172.704 2.074 18995
184 1 1 . 1 1 59 59 THR CA C 59 65.600 65.600 60.038 5.561 18995
185 1 1 . 1 1 59 59 THR CB C 59 69.600 69.600 71.210 -1.610 18995
186 1 1 . 1 1 59 59 THR H H 59 7.739 7.739 7.437 0.302 18995
187 1 1 . 1 1 60 60 LEU N N 60 119.636 119.636 123.288 -3.652 18995
188 1 1 . 1 1 60 60 LEU C C 60 177.561 177.561 177.295 0.266 18995
189 1 1 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.530 -0.930 18995
190 1 1 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.104 2.196 18995
191 1 1 . 1 1 60 60 LEU H H 60 7.643 7.643 8.685 -1.042 18995
192 1 1 . 1 1 61 61 ASP N N 61 117.424 117.424 124.947 -7.523 18995
193 1 1 . 1 1 61 61 ASP C C 61 175.915 175.915 174.649 1.266 18995
194 1 1 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.855 0.745 18995
195 1 1 . 1 1 61 61 ASP H H 61 7.984 7.984 8.603 -0.619 18995
196 1 1 . 1 1 62 62 ASN N N 62 127.650 127.650 122.802 4.848 18995
197 1 1 . 1 1 62 62 ASN C C 62 175.905 175.905 174.540 1.365 18995
198 1 1 . 1 1 62 62 ASN CA C 62 54.900 54.900 53.043 1.857 18995
199 1 1 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.112 1.288 18995
200 1 1 . 1 1 62 62 ASN H H 62 9.032 9.032 8.048 0.984 18995
201 1 1 . 1 1 63 63 ASP N N 63 116.676 116.676 123.650 -6.974 18995
202 1 1 . 1 1 63 63 ASP C C 63 177.604 177.604 175.214 2.390 18995
203 1 1 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.930 2.470 18995
204 1 1 . 1 1 63 63 ASP CB C 63 40.200 40.200 44.592 -4.392 18995
205 1 1 . 1 1 63 63 ASP H H 63 8.302 8.302 9.583 -1.281 18995
206 1 1 . 1 1 64 64 GLY N N 64 109.334 109.334 112.927 -3.593 18995
207 1 1 . 1 1 64 64 GLY C C 64 174.834 174.834 174.747 0.087 18995
208 1 1 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.232 4.468 18995
209 1 1 . 1 1 64 64 GLY H H 64 7.681 7.681 9.122 -1.441 18995
210 1 1 . 1 1 65 65 ASP N N 65 120.960 120.960 128.180 -7.220 18995
211 1 1 . 1 1 65 65 ASP C C 65 177.010 177.010 174.991 2.019 18995
212 1 1 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.379 -0.579 18995
213 1 1 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.390 -0.090 18995
214 1 1 . 1 1 65 65 ASP H H 65 8.386 8.386 9.392 -1.006 18995
215 1 1 . 1 1 66 66 GLY N N 66 113.875 113.875 117.665 -3.790 18995
216 1 1 . 1 1 66 66 GLY C C 66 172.343 172.343 174.166 -1.823 18995
217 1 1 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.830 3.070 18995
218 1 1 . 1 1 66 66 GLY H H 66 10.212 10.212 9.011 1.201 18995
219 1 1 . 1 1 67 67 GLU N N 67 118.701 118.701 125.546 -6.845 18995
220 1 1 . 1 1 67 67 GLU C C 67 174.711 174.711 176.234 -1.523 18995
221 1 1 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.686 -0.486 18995
222 1 1 . 1 1 67 67 GLU H H 67 7.949 7.949 9.042 -1.093 18995
223 1 1 . 1 1 68 68 CYS N N 68 124.753 124.753 127.140 -2.387 18995
224 1 1 . 1 1 68 68 CYS C C 68 174.411 174.411 176.711 -2.300 18995
225 1 1 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.872 -5.872 18995
226 1 1 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.881 0.219 18995
227 1 1 . 1 1 68 68 CYS H H 68 9.486 9.486 8.884 0.602 18995
228 1 1 . 1 1 69 69 ASP N N 69 132.376 132.376 119.515 12.861 18995
229 1 1 . 1 1 69 69 ASP C C 69 175.307 175.307 175.280 0.027 18995
230 1 1 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.335 -1.035 18995
231 1 1 . 1 1 69 69 ASP CB C 69 40.600 40.600 39.361 1.239 18995
232 1 1 . 1 1 69 69 ASP H H 69 9.911 9.911 8.610 1.301 18995
233 1 1 . 1 1 70 70 PHE N N 70 119.131 119.131 120.212 -1.081 18995
234 1 1 . 1 1 70 70 PHE C C 70 176.482 176.482 175.363 1.119 18995
235 1 1 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.361 4.539 18995
236 1 1 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.377 -1.277 18995
237 1 1 . 1 1 70 70 PHE H H 70 9.075 9.075 8.287 0.788 18995
238 1 1 . 1 1 71 71 GLN N N 71 119.323 119.323 118.102 1.221 18995
239 1 1 . 1 1 71 71 GLN C C 71 179.517 179.517 174.055 5.462 18995
240 1 1 . 1 1 71 71 GLN CA C 71 60.100 60.100 57.049 3.051 18995
241 1 1 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.699 0.501 18995
242 1 1 . 1 1 71 71 GLN H H 71 8.047 8.047 8.369 -0.322 18995
243 1 1 . 1 1 72 72 GLU N N 72 123.228 123.228 116.210 7.018 18995
244 1 1 . 1 1 72 72 GLU C C 72 179.337 179.337 175.367 3.970 18995
245 1 1 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.037 3.863 18995
246 1 1 . 1 1 72 72 GLU CB C 72 30.300 30.300 32.634 -2.334 18995
247 1 1 . 1 1 72 72 GLU H H 72 9.061 9.061 7.301 1.760 18995
248 1 1 . 1 1 73 73 PHE N N 73 123.155 123.155 119.633 3.522 18995
249 1 1 . 1 1 73 73 PHE C C 73 176.497 176.497 175.520 0.977 18995
250 1 1 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.480 3.320 18995
251 1 1 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.844 -1.144 18995
252 1 1 . 1 1 73 73 PHE H H 73 8.863 8.863 9.419 -0.556 18995
253 1 1 . 1 1 74 74 MET N N 74 119.622 119.622 122.522 -2.900 18995
254 1 1 . 1 1 74 74 MET C C 74 178.476 178.476 174.697 3.779 18995
255 1 1 . 1 1 74 74 MET CA C 74 56.200 56.200 55.706 0.494 18995
256 1 1 . 1 1 74 74 MET CB C 74 30.400 30.400 33.603 -3.203 18995
257 1 1 . 1 1 74 74 MET H H 74 8.217 8.217 9.073 -0.856 18995
258 1 1 . 1 1 75 75 ALA N N 75 123.073 123.073 128.843 -5.770 18995
259 1 1 . 1 1 75 75 ALA C C 75 180.129 180.129 175.153 4.976 18995
260 1 1 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.271 4.929 18995
261 1 1 . 1 1 75 75 ALA H H 75 7.490 7.490 9.342 -1.852 18995
262 1 1 . 1 1 76 76 PHE N N 76 122.171 122.171 123.251 -1.080 18995
263 1 1 . 1 1 76 76 PHE C C 76 176.365 176.365 174.929 1.436 18995
264 1 1 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.502 2.298 18995
265 1 1 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.521 -3.921 18995
266 1 1 . 1 1 76 76 PHE H H 76 7.676 7.676 8.182 -0.506 18995
267 1 1 . 1 1 77 77 VAL N N 77 119.765 119.765 123.715 -3.950 18995
268 1 1 . 1 1 77 77 VAL C C 77 179.175 179.175 177.736 1.439 18995
269 1 1 . 1 1 77 77 VAL CA C 77 66.800 66.800 59.933 6.867 18995
270 1 1 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.480 -1.280 18995
271 1 1 . 1 1 77 77 VAL H H 77 8.498 8.498 8.572 -0.074 18995
272 1 1 . 1 1 78 78 ALA N N 78 123.880 123.880 122.441 1.439 18995
273 1 1 . 1 1 78 78 ALA C C 78 178.630 178.630 177.305 1.325 18995
274 1 1 . 1 1 78 78 ALA CA C 78 56.100 56.100 54.980 1.120 18995
275 1 1 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.550 -0.250 18995
276 1 1 . 1 1 78 78 ALA H H 78 8.193 8.193 8.797 -0.604 18995
277 1 1 . 1 1 79 79 MET N N 79 120.537 120.537 113.793 6.744 18995
278 1 1 . 1 1 79 79 MET C C 79 178.430 178.430 176.805 1.625 18995
279 1 1 . 1 1 79 79 MET CA C 79 59.500 59.500 54.820 4.680 18995
280 1 1 . 1 1 79 79 MET CB C 79 32.800 32.800 31.963 0.837 18995
281 1 1 . 1 1 79 79 MET H H 79 7.883 7.883 7.747 0.136 18995
282 1 1 . 1 1 80 80 VAL N N 80 120.374 120.374 118.566 1.808 18995
283 1 1 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.620 4.580 18995
284 1 1 . 1 1 80 80 VAL H H 80 8.299 8.299 7.590 0.709 18995
285 1 1 . 1 1 82 82 THR C C 82 175.144 175.144 172.309 2.835 18995
286 1 1 . 1 1 82 82 THR CA C 82 65.800 65.800 61.068 4.732 18995
287 1 1 . 1 1 83 83 ALA N N 83 123.244 123.244 122.960 0.284 18995
288 1 1 . 1 1 83 83 ALA C C 83 178.574 178.574 175.262 3.312 18995
289 1 1 . 1 1 83 83 ALA CA C 83 53.900 53.900 49.684 4.216 18995
290 1 1 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.962 -2.962 18995
291 1 1 . 1 1 83 83 ALA H H 83 7.587 7.587 8.522 -0.935 18995
292 1 1 . 1 1 84 84 CYS N N 84 116.910 116.910 117.487 -0.577 18995
293 1 1 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.014 2.786 18995
294 1 1 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.170 -1.270 18995
295 1 1 . 1 1 84 84 CYS H H 84 7.788 7.788 8.499 -0.711 18995
296 1 1 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.631 0.969 18995
297 1 1 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.286 -0.886 18995
298 1 1 . 1 1 87 87 PHE N N 87 118.550 118.550 119.559 -1.009 18995
299 1 1 . 1 1 87 87 PHE C C 87 175.597 175.597 174.332 1.265 18995
300 1 1 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.211 1.889 18995
301 1 1 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.951 -1.551 18995
302 1 1 . 1 1 87 87 PHE H H 87 7.838 7.838 7.619 0.219 18995
303 1 1 . 1 1 88 88 PHE N N 88 118.438 118.438 125.648 -7.210 18995
304 1 1 . 1 1 88 88 PHE C C 88 175.241 175.241 175.715 -0.474 18995
305 1 1 . 1 1 88 88 PHE CA C 88 58.200 58.200 58.328 -0.128 18995
306 1 1 . 1 1 88 88 PHE CB C 88 39.700 39.700 36.994 2.706 18995
307 1 1 . 1 1 88 88 PHE H H 88 7.718 7.718 8.556 -0.838 18995
308 1 1 . 1 1 89 89 GLU N N 89 121.366 121.366 126.412 -5.046 18995
309 1 1 . 1 1 89 89 GLU C C 89 175.437 175.437 176.985 -1.548 18995
310 1 1 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.051 2.549 18995
311 1 1 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.574 -1.274 18995
312 1 1 . 1 1 89 89 GLU H H 89 7.959 7.959 7.893 0.066 18995
313 1 1 . 1 1 90 90 HIS N N 90 120.349 120.349 117.217 3.132 18995
314 1 1 . 1 1 90 90 HIS C C 90 173.652 173.652 176.124 -2.472 18995
315 1 1 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.200 -2.400 18995
316 1 1 . 1 1 90 90 HIS CB C 90 30.100 30.100 28.892 1.208 18995
317 1 1 . 1 1 90 90 HIS H H 90 8.116 8.116 8.712 -0.596 18995
318 1 1 . 1 1 91 91 GLU N N 91 127.965 127.965 118.575 9.390 18995
319 1 1 . 1 1 91 91 GLU H H 91 8.235 8.235 7.637 0.598 18995
320 1 2 . 1 1 20 20 ARG C C 20 177.097 177.097 174.964 2.133 18995
321 1 2 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.652 4.448 18995
322 1 2 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.870 0.130 18995
323 1 2 . 1 1 21 21 GLU N N 21 116.519 116.519 121.136 -4.617 18995
324 1 2 . 1 1 21 21 GLU C C 21 175.055 175.055 175.534 -0.479 18995
325 1 2 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.895 0.705 18995
326 1 2 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.466 1.234 18995
327 1 2 . 1 1 21 21 GLU H H 21 9.468 9.468 9.229 0.239 18995
328 1 2 . 1 1 22 22 GLY N N 22 122.197 122.197 110.050 12.147 18995
329 1 2 . 1 1 22 22 GLY C C 22 180.081 180.081 173.875 6.206 18995
330 1 2 . 1 1 22 22 GLY H H 22 10.096 10.096 9.207 0.889 18995
331 1 2 . 1 1 23 23 ASP N N 23 113.764 113.764 125.835 -12.071 18995
332 1 2 . 1 1 23 23 ASP C C 23 178.957 178.957 175.292 3.665 18995
333 1 2 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.202 2.298 18995
334 1 2 . 1 1 23 23 ASP H H 23 8.115 8.115 9.294 -1.179 18995
335 1 2 . 1 1 24 24 LYS N N 24 131.954 131.954 127.683 4.271 18995
336 1 2 . 1 1 24 24 LYS C C 24 176.539 176.539 175.658 0.881 18995
337 1 2 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.453 2.747 18995
338 1 2 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.017 -1.317 18995
339 1 2 . 1 1 24 24 LYS H H 24 9.484 9.484 8.983 0.501 18995
340 1 2 . 1 1 25 25 HIS N N 25 119.313 119.313 128.983 -9.670 18995
341 1 2 . 1 1 25 25 HIS C C 25 172.815 172.815 174.947 -2.132 18995
342 1 2 . 1 1 25 25 HIS CA C 25 55.500 55.500 55.497 0.003 18995
343 1 2 . 1 1 25 25 HIS CB C 25 30.800 30.800 31.820 -1.020 18995
344 1 2 . 1 1 25 25 HIS H H 25 9.589 9.589 8.965 0.624 18995
345 1 2 . 1 1 26 26 LYS N N 26 115.394 115.394 126.629 -11.235 18995
346 1 2 . 1 1 26 26 LYS C C 26 174.608 174.608 175.657 -1.049 18995
347 1 2 . 1 1 26 26 LYS CA C 26 55.400 55.400 57.641 -2.241 18995
348 1 2 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.231 6.869 18995
349 1 2 . 1 1 26 26 LYS H H 26 7.095 7.095 8.352 -1.257 18995
350 1 2 . 1 1 27 27 LEU N N 27 126.263 126.263 119.756 6.507 18995
351 1 2 . 1 1 27 27 LEU C C 27 175.637 175.637 176.032 -0.395 18995
352 1 2 . 1 1 27 27 LEU CA C 27 52.800 52.800 54.083 -1.283 18995
353 1 2 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.358 1.342 18995
354 1 2 . 1 1 27 27 LEU H H 27 9.595 9.595 7.102 2.493 18995
355 1 2 . 1 1 28 28 LYS N N 28 124.436 124.436 124.402 0.034 18995
356 1 2 . 1 1 28 28 LYS C C 28 177.395 177.395 176.190 1.205 18995
357 1 2 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.377 -1.177 18995
358 1 2 . 1 1 28 28 LYS H H 28 9.711 9.711 8.537 1.174 18995
359 1 2 . 1 1 29 29 LYS N N 29 121.980 121.980 118.974 3.006 18995
360 1 2 . 1 1 29 29 LYS C C 29 177.400 177.400 174.956 2.444 18995
361 1 2 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.957 6.743 18995
362 1 2 . 1 1 29 29 LYS H H 29 9.084 9.084 7.449 1.635 18995
363 1 2 . 1 1 30 30 SER N N 30 111.519 111.519 113.317 -1.798 18995
364 1 2 . 1 1 30 30 SER C C 30 176.950 176.950 173.292 3.658 18995
365 1 2 . 1 1 30 30 SER CA C 30 61.100 61.100 57.029 4.071 18995
366 1 2 . 1 1 30 30 SER CB C 30 61.300 61.300 65.262 -3.962 18995
367 1 2 . 1 1 30 30 SER H H 30 8.267 8.267 7.175 1.092 18995
368 1 2 . 1 1 31 31 GLU N N 31 123.792 123.792 120.000 3.792 18995
369 1 2 . 1 1 31 31 GLU C C 31 179.463 179.463 176.890 2.573 18995
370 1 2 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.240 4.859 18995
371 1 2 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.110 -1.910 18995
372 1 2 . 1 1 31 31 GLU H H 31 6.603 6.603 9.474 -2.871 18995
373 1 2 . 1 1 32 32 LEU N N 32 121.954 121.954 124.671 -2.717 18995
374 1 2 . 1 1 32 32 LEU C C 32 176.995 176.995 175.783 1.212 18995
375 1 2 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.370 2.530 18995
376 1 2 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.153 0.147 18995
377 1 2 . 1 1 32 32 LEU H H 32 8.936 8.936 8.873 0.063 18995
378 1 2 . 1 1 33 33 LYS N N 33 118.576 118.576 128.729 -10.153 18995
379 1 2 . 1 1 33 33 LYS C C 33 176.714 176.714 175.129 1.585 18995
380 1 2 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.851 5.649 18995
381 1 2 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.135 -1.235 18995
382 1 2 . 1 1 33 33 LYS H H 33 8.390 8.390 9.287 -0.896 18995
383 1 2 . 1 1 34 34 GLU N N 34 116.152 116.152 128.355 -12.203 18995
384 1 2 . 1 1 34 34 GLU C C 34 177.689 177.689 175.429 2.260 18995
385 1 2 . 1 1 34 34 GLU CA C 34 59.400 59.400 55.991 3.409 18995
386 1 2 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.708 -1.308 18995
387 1 2 . 1 1 34 34 GLU H H 34 7.326 7.326 8.132 -0.806 18995
388 1 2 . 1 1 35 35 LEU N N 35 123.632 123.632 127.580 -3.948 18995
389 1 2 . 1 1 35 35 LEU C C 35 178.845 178.845 176.477 2.368 18995
390 1 2 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.510 7.290 18995
391 1 2 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.322 -1.321 18995
392 1 2 . 1 1 35 35 LEU H H 35 7.978 7.978 9.051 -1.073 18995
393 1 2 . 1 1 36 36 ILE C C 36 178.328 178.328 175.808 2.520 18995
394 1 2 . 1 1 36 36 ILE CA C 36 66.300 66.300 62.974 3.326 18995
395 1 2 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.296 0.404 18995
396 1 2 . 1 1 37 37 ASN N N 37 118.242 118.242 112.346 5.896 18995
397 1 2 . 1 1 37 37 ASN C C 37 177.052 177.052 176.655 0.397 18995
398 1 2 . 1 1 37 37 ASN CA C 37 54.800 54.800 52.930 1.870 18995
399 1 2 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.088 -0.588 18995
400 1 2 . 1 1 37 37 ASN H H 37 8.336 8.336 8.381 -0.045 18995
401 1 2 . 1 1 38 38 ASN N N 38 114.845 114.845 119.347 -4.502 18995
402 1 2 . 1 1 38 38 ASN C C 38 176.578 176.578 174.630 1.948 18995
403 1 2 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.834 2.366 18995
404 1 2 . 1 1 38 38 ASN H H 38 8.213 8.213 8.178 0.035 18995
405 1 2 . 1 1 39 39 GLU N N 39 113.797 113.797 121.032 -7.235 18995
406 1 2 . 1 1 39 39 GLU C C 39 177.689 177.689 174.431 3.258 18995
407 1 2 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.891 -1.691 18995
408 1 2 . 1 1 39 39 GLU CB C 39 31.300 31.300 30.823 0.477 18995
409 1 2 . 1 1 39 39 GLU H H 39 8.522 8.522 7.851 0.671 18995
410 1 2 . 1 1 40 40 LEU N N 40 119.982 119.982 123.374 -3.392 18995
411 1 2 . 1 1 40 40 LEU C C 40 177.212 177.212 175.423 1.789 18995
412 1 2 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.527 0.573 18995
413 1 2 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.148 -1.448 18995
414 1 2 . 1 1 40 40 LEU H H 40 7.552 7.552 8.458 -0.906 18995
415 1 2 . 1 1 41 41 SER N N 41 114.635 114.635 120.413 -5.778 18995
416 1 2 . 1 1 41 41 SER C C 41 175.688 175.688 172.392 3.296 18995
417 1 2 . 1 1 41 41 SER CA C 41 60.800 60.800 56.491 4.309 18995
418 1 2 . 1 1 41 41 SER CB C 41 64.100 64.100 65.780 -1.680 18995
419 1 2 . 1 1 41 41 SER H H 41 7.592 7.592 8.943 -1.351 18995
420 1 2 . 1 1 42 42 HIS N N 42 122.397 122.397 115.418 6.979 18995
421 1 2 . 1 1 42 42 HIS C C 42 175.523 175.523 172.855 2.668 18995
422 1 2 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.064 3.636 18995
423 1 2 . 1 1 42 42 HIS H H 42 10.406 10.406 8.237 2.169 18995
424 1 2 . 1 1 43 43 PHE N N 43 117.618 117.618 120.639 -3.021 18995
425 1 2 . 1 1 43 43 PHE C C 43 177.431 177.431 175.128 2.303 18995
426 1 2 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.988 2.812 18995
427 1 2 . 1 1 43 43 PHE H H 43 7.785 7.785 8.395 -0.610 18995
428 1 2 . 1 1 44 44 LEU N N 44 120.185 120.185 124.747 -4.562 18995
429 1 2 . 1 1 44 44 LEU C C 44 175.829 175.829 176.433 -0.604 18995
430 1 2 . 1 1 44 44 LEU CA C 44 53.800 53.800 55.535 -1.735 18995
431 1 2 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.588 2.412 18995
432 1 2 . 1 1 44 44 LEU H H 44 8.533 8.533 8.627 -0.094 18995
433 1 2 . 1 1 45 45 GLU N N 45 121.499 121.499 118.901 2.598 18995
434 1 2 . 1 1 45 45 GLU C C 45 175.060 175.060 177.465 -2.405 18995
435 1 2 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.728 -0.129 18995
436 1 2 . 1 1 45 45 GLU CB C 45 30.600 30.600 28.735 1.865 18995
437 1 2 . 1 1 45 45 GLU H H 45 8.130 8.130 8.164 -0.034 18995
438 1 2 . 1 1 46 46 GLU N N 46 122.480 122.480 125.474 -2.994 18995
439 1 2 . 1 1 46 46 GLU C C 46 176.861 176.861 176.166 0.695 18995
440 1 2 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.799 -0.999 18995
441 1 2 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.262 1.438 18995
442 1 2 . 1 1 46 46 GLU H H 46 8.123 8.123 8.749 -0.626 18995
443 1 2 . 1 1 47 47 ILE N N 47 127.680 127.680 119.086 8.594 18995
444 1 2 . 1 1 47 47 ILE C C 47 175.931 175.931 175.718 0.213 18995
445 1 2 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.090 1.010 18995
446 1 2 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.956 0.644 18995
447 1 2 . 1 1 47 47 ILE H H 47 9.897 9.897 7.755 2.142 18995
448 1 2 . 1 1 48 48 LYS N N 48 126.846 126.846 124.158 2.688 18995
449 1 2 . 1 1 48 48 LYS C C 48 175.896 175.896 176.063 -0.167 18995
450 1 2 . 1 1 48 48 LYS CA C 48 56.600 56.600 54.090 2.510 18995
451 1 2 . 1 1 48 48 LYS CB C 48 34.700 34.700 33.834 0.866 18995
452 1 2 . 1 1 48 48 LYS H H 48 9.077 9.077 7.455 1.622 18995
453 1 2 . 1 1 49 49 GLU C C 49 179.470 179.470 176.775 2.695 18995
454 1 2 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.346 -1.746 18995
455 1 2 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.606 2.194 18995
456 1 2 . 1 1 50 50 GLN N N 50 125.850 125.850 119.866 5.984 18995
457 1 2 . 1 1 50 50 GLN C C 50 176.883 176.883 177.119 -0.236 18995
458 1 2 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.434 1.066 18995
459 1 2 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.385 0.015 18995
460 1 2 . 1 1 50 50 GLN H H 50 9.041 9.041 8.860 0.181 18995
461 1 2 . 1 1 51 51 GLU N N 51 117.404 117.404 112.489 4.915 18995
462 1 2 . 1 1 51 51 GLU C C 51 178.262 178.262 175.325 2.937 18995
463 1 2 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.727 3.973 18995
464 1 2 . 1 1 51 51 GLU CB C 51 29.300 29.300 29.866 -0.566 18995
465 1 2 . 1 1 51 51 GLU H H 51 9.352 9.352 7.441 1.911 18995
466 1 2 . 1 1 52 52 VAL N N 52 118.888 118.888 122.141 -3.253 18995
467 1 2 . 1 1 52 52 VAL C C 52 177.677 177.677 174.575 3.102 18995
468 1 2 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.748 4.353 18995
469 1 2 . 1 1 52 52 VAL CB C 52 31.700 31.700 31.202 0.498 18995
470 1 2 . 1 1 52 52 VAL H H 52 7.247 7.247 7.205 0.042 18995
471 1 2 . 1 1 53 53 VAL N N 53 119.906 119.906 123.472 -3.566 18995
472 1 2 . 1 1 53 53 VAL C C 53 176.742 176.742 174.663 2.079 18995
473 1 2 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.615 5.585 18995
474 1 2 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.755 -3.155 18995
475 1 2 . 1 1 53 53 VAL H H 53 7.264 7.264 8.508 -1.244 18995
476 1 2 . 1 1 54 54 ASP N N 54 121.483 121.483 120.959 0.524 18995
477 1 2 . 1 1 54 54 ASP C C 54 178.291 178.291 174.642 3.649 18995
478 1 2 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.380 5.820 18995
479 1 2 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.314 -4.314 18995
480 1 2 . 1 1 54 54 ASP H H 54 8.524 8.524 9.094 -0.570 18995
481 1 2 . 1 1 55 55 LYS N N 55 120.875 120.875 128.083 -7.208 18995
482 1 2 . 1 1 55 55 LYS C C 55 179.054 179.054 175.964 3.090 18995
483 1 2 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.479 3.421 18995
484 1 2 . 1 1 55 55 LYS CB C 55 32.200 32.200 31.835 0.365 18995
485 1 2 . 1 1 55 55 LYS H H 55 7.580 7.580 9.091 -1.511 18995
486 1 2 . 1 1 56 56 VAL N N 56 121.960 121.960 123.370 -1.410 18995
487 1 2 . 1 1 56 56 VAL C C 56 178.221 178.221 175.183 3.038 18995
488 1 2 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.376 5.624 18995
489 1 2 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.165 -1.465 18995
490 1 2 . 1 1 56 56 VAL H H 56 8.279 8.279 8.491 -0.212 18995
491 1 2 . 1 1 57 57 MET N N 57 118.815 118.815 126.828 -8.013 18995
492 1 2 . 1 1 57 57 MET C C 57 176.888 176.888 175.538 1.350 18995
493 1 2 . 1 1 57 57 MET CA C 57 57.900 57.900 54.609 3.291 18995
494 1 2 . 1 1 57 57 MET CB C 57 32.900 32.900 32.939 -0.039 18995
495 1 2 . 1 1 57 57 MET H H 57 8.467 8.467 8.992 -0.525 18995
496 1 2 . 1 1 58 58 GLU N N 58 117.894 117.894 125.990 -8.096 18995
497 1 2 . 1 1 58 58 GLU C C 58 178.510 178.510 176.589 1.921 18995
498 1 2 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.484 1.916 18995
499 1 2 . 1 1 58 58 GLU CB C 58 29.800 29.800 30.741 -0.941 18995
500 1 2 . 1 1 58 58 GLU H H 58 8.073 8.073 8.789 -0.716 18995
501 1 2 . 1 1 59 59 THR N N 59 113.244 113.244 112.511 0.733 18995
502 1 2 . 1 1 59 59 THR C C 59 174.778 174.778 172.620 2.158 18995
503 1 2 . 1 1 59 59 THR CA C 59 65.600 65.600 60.047 5.553 18995
504 1 2 . 1 1 59 59 THR CB C 59 69.600 69.600 71.433 -1.833 18995
505 1 2 . 1 1 59 59 THR H H 59 7.739 7.739 7.523 0.216 18995
506 1 2 . 1 1 60 60 LEU N N 60 119.636 119.636 123.792 -4.156 18995
507 1 2 . 1 1 60 60 LEU C C 60 177.561 177.561 177.432 0.129 18995
508 1 2 . 1 1 60 60 LEU CA C 60 55.600 55.600 57.107 -1.507 18995
509 1 2 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.350 1.950 18995
510 1 2 . 1 1 60 60 LEU H H 60 7.643 7.643 8.768 -1.125 18995
511 1 2 . 1 1 61 61 ASP N N 61 117.424 117.424 125.155 -7.731 18995
512 1 2 . 1 1 61 61 ASP C C 61 175.915 175.915 174.819 1.096 18995
513 1 2 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.889 0.711 18995
514 1 2 . 1 1 61 61 ASP H H 61 7.984 7.984 8.741 -0.757 18995
515 1 2 . 1 1 62 62 ASN N N 62 127.650 127.650 121.413 6.237 18995
516 1 2 . 1 1 62 62 ASN C C 62 175.905 175.905 174.309 1.596 18995
517 1 2 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.973 1.927 18995
518 1 2 . 1 1 62 62 ASN CB C 62 40.400 40.400 40.152 0.248 18995
519 1 2 . 1 1 62 62 ASN H H 62 9.032 9.032 8.324 0.708 18995
520 1 2 . 1 1 63 63 ASP N N 63 116.676 116.676 123.254 -6.578 18995
521 1 2 . 1 1 63 63 ASP C C 63 177.604 177.604 174.883 2.721 18995
522 1 2 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.782 2.618 18995
523 1 2 . 1 1 63 63 ASP CB C 63 40.200 40.200 45.014 -4.814 18995
524 1 2 . 1 1 63 63 ASP H H 63 8.302 8.302 9.701 -1.399 18995
525 1 2 . 1 1 64 64 GLY N N 64 109.334 109.334 110.911 -1.577 18995
526 1 2 . 1 1 64 64 GLY C C 64 174.834 174.834 174.768 0.066 18995
527 1 2 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.409 4.291 18995
528 1 2 . 1 1 64 64 GLY H H 64 7.681 7.681 9.182 -1.501 18995
529 1 2 . 1 1 65 65 ASP N N 65 120.960 120.960 127.214 -6.254 18995
530 1 2 . 1 1 65 65 ASP C C 65 177.010 177.010 174.787 2.223 18995
531 1 2 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.061 -0.261 18995
532 1 2 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.915 -0.615 18995
533 1 2 . 1 1 65 65 ASP H H 65 8.386 8.386 9.062 -0.676 18995
534 1 2 . 1 1 66 66 GLY N N 66 113.875 113.875 117.203 -3.328 18995
535 1 2 . 1 1 66 66 GLY C C 66 172.343 172.343 174.012 -1.669 18995
536 1 2 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.758 3.142 18995
537 1 2 . 1 1 66 66 GLY H H 66 10.212 10.212 8.789 1.423 18995
538 1 2 . 1 1 67 67 GLU N N 67 118.701 118.701 125.179 -6.478 18995
539 1 2 . 1 1 67 67 GLU C C 67 174.711 174.711 176.308 -1.597 18995
540 1 2 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.914 -0.714 18995
541 1 2 . 1 1 67 67 GLU H H 67 7.949 7.949 8.964 -1.015 18995
542 1 2 . 1 1 68 68 CYS N N 68 124.753 124.753 126.066 -1.313 18995
543 1 2 . 1 1 68 68 CYS C C 68 174.411 174.411 175.826 -1.415 18995
544 1 2 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.201 -5.201 18995
545 1 2 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.841 0.259 18995
546 1 2 . 1 1 68 68 CYS H H 68 9.486 9.486 8.705 0.781 18995
547 1 2 . 1 1 69 69 ASP N N 69 132.376 132.376 116.786 15.590 18995
548 1 2 . 1 1 69 69 ASP C C 69 175.307 175.307 176.448 -1.141 18995
549 1 2 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.945 -1.645 18995
550 1 2 . 1 1 69 69 ASP CB C 69 40.600 40.600 41.280 -0.680 18995
551 1 2 . 1 1 69 69 ASP H H 69 9.911 9.911 8.335 1.576 18995
552 1 2 . 1 1 70 70 PHE N N 70 119.131 119.131 120.236 -1.105 18995
553 1 2 . 1 1 70 70 PHE C C 70 176.482 176.482 175.546 0.936 18995
554 1 2 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.049 4.851 18995
555 1 2 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.476 -1.376 18995
556 1 2 . 1 1 70 70 PHE H H 70 9.075 9.075 7.219 1.856 18995
557 1 2 . 1 1 71 71 GLN N N 71 119.323 119.323 117.200 2.123 18995
558 1 2 . 1 1 71 71 GLN C C 71 179.517 179.517 174.123 5.394 18995
559 1 2 . 1 1 71 71 GLN CA C 71 60.100 60.100 57.102 2.998 18995
560 1 2 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.705 0.495 18995
561 1 2 . 1 1 71 71 GLN H H 71 8.047 8.047 8.406 -0.359 18995
562 1 2 . 1 1 72 72 GLU N N 72 123.228 123.228 115.656 7.572 18995
563 1 2 . 1 1 72 72 GLU C C 72 179.337 179.337 175.123 4.214 18995
564 1 2 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.023 3.877 18995
565 1 2 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.095 -2.795 18995
566 1 2 . 1 1 72 72 GLU H H 72 9.061 9.061 7.295 1.766 18995
567 1 2 . 1 1 73 73 PHE N N 73 123.155 123.155 118.698 4.457 18995
568 1 2 . 1 1 73 73 PHE C C 73 176.497 176.497 175.458 1.039 18995
569 1 2 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.587 3.213 18995
570 1 2 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.872 -1.172 18995
571 1 2 . 1 1 73 73 PHE H H 73 8.863 8.863 9.399 -0.536 18995
572 1 2 . 1 1 74 74 MET N N 74 119.622 119.622 122.529 -2.907 18995
573 1 2 . 1 1 74 74 MET C C 74 178.476 178.476 174.689 3.787 18995
574 1 2 . 1 1 74 74 MET CA C 74 56.200 56.200 55.562 0.638 18995
575 1 2 . 1 1 74 74 MET CB C 74 30.400 30.400 33.541 -3.141 18995
576 1 2 . 1 1 74 74 MET H H 74 8.217 8.217 9.046 -0.829 18995
577 1 2 . 1 1 75 75 ALA N N 75 123.073 123.073 129.036 -5.963 18995
578 1 2 . 1 1 75 75 ALA C C 75 180.129 180.129 175.227 4.902 18995
579 1 2 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.263 4.937 18995
580 1 2 . 1 1 75 75 ALA H H 75 7.490 7.490 9.380 -1.890 18995
581 1 2 . 1 1 76 76 PHE N N 76 122.171 122.171 123.020 -0.849 18995
582 1 2 . 1 1 76 76 PHE C C 76 176.365 176.365 175.039 1.326 18995
583 1 2 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.540 2.260 18995
584 1 2 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.562 -3.962 18995
585 1 2 . 1 1 76 76 PHE H H 76 7.676 7.676 8.254 -0.578 18995
586 1 2 . 1 1 77 77 VAL N N 77 119.765 119.765 124.020 -4.255 18995
587 1 2 . 1 1 77 77 VAL C C 77 179.175 179.175 177.544 1.631 18995
588 1 2 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.308 6.492 18995
589 1 2 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.358 -1.158 18995
590 1 2 . 1 1 77 77 VAL H H 77 8.498 8.498 8.688 -0.190 18995
591 1 2 . 1 1 78 78 ALA N N 78 123.880 123.880 123.211 0.669 18995
592 1 2 . 1 1 78 78 ALA C C 78 178.630 178.630 177.680 0.950 18995
593 1 2 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.284 0.816 18995
594 1 2 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.673 -0.373 18995
595 1 2 . 1 1 78 78 ALA H H 78 8.193 8.193 8.843 -0.650 18995
596 1 2 . 1 1 79 79 MET N N 79 120.537 120.537 114.541 5.996 18995
597 1 2 . 1 1 79 79 MET C C 79 178.430 178.430 176.795 1.635 18995
598 1 2 . 1 1 79 79 MET CA C 79 59.500 59.500 54.903 4.597 18995
599 1 2 . 1 1 79 79 MET CB C 79 32.800 32.800 32.465 0.335 18995
600 1 2 . 1 1 79 79 MET H H 79 7.883 7.883 7.867 0.016 18995
601 1 2 . 1 1 80 80 VAL N N 80 120.374 120.374 119.549 0.825 18995
602 1 2 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.565 4.635 18995
603 1 2 . 1 1 80 80 VAL H H 80 8.299 8.299 7.967 0.332 18995
604 1 2 . 1 1 82 82 THR C C 82 175.144 175.144 172.745 2.399 18995
605 1 2 . 1 1 82 82 THR CA C 82 65.800 65.800 61.309 4.490 18995
606 1 2 . 1 1 83 83 ALA N N 83 123.244 123.244 122.815 0.429 18995
607 1 2 . 1 1 83 83 ALA C C 83 178.574 178.574 175.208 3.366 18995
608 1 2 . 1 1 83 83 ALA CA C 83 53.900 53.900 50.057 3.842 18995
609 1 2 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.750 -2.750 18995
610 1 2 . 1 1 83 83 ALA H H 83 7.587 7.587 8.741 -1.154 18995
611 1 2 . 1 1 84 84 CYS N N 84 116.910 116.910 117.636 -0.726 18995
612 1 2 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.108 2.692 18995
613 1 2 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.065 -1.165 18995
614 1 2 . 1 1 84 84 CYS H H 84 7.788 7.788 8.451 -0.663 18995
615 1 2 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.861 0.739 18995
616 1 2 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.166 -0.766 18995
617 1 2 . 1 1 87 87 PHE N N 87 118.550 118.550 119.757 -1.207 18995
618 1 2 . 1 1 87 87 PHE C C 87 175.597 175.597 174.779 0.818 18995
619 1 2 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.281 1.819 18995
620 1 2 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.135 -0.735 18995
621 1 2 . 1 1 87 87 PHE H H 87 7.838 7.838 7.629 0.209 18995
622 1 2 . 1 1 88 88 PHE N N 88 118.438 118.438 126.111 -7.673 18995
623 1 2 . 1 1 88 88 PHE C C 88 175.241 175.241 175.977 -0.736 18995
624 1 2 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.990 0.210 18995
625 1 2 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.254 2.446 18995
626 1 2 . 1 1 88 88 PHE H H 88 7.718 7.718 8.532 -0.814 18995
627 1 2 . 1 1 89 89 GLU N N 89 121.366 121.366 126.320 -4.954 18995
628 1 2 . 1 1 89 89 GLU C C 89 175.437 175.437 177.110 -1.673 18995
629 1 2 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.191 2.409 18995
630 1 2 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.571 -1.271 18995
631 1 2 . 1 1 89 89 GLU H H 89 7.959 7.959 7.951 0.008 18995
632 1 2 . 1 1 90 90 HIS N N 90 120.349 120.349 116.655 3.694 18995
633 1 2 . 1 1 90 90 HIS C C 90 173.652 173.652 176.024 -2.372 18995
634 1 2 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.459 -2.659 18995
635 1 2 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.071 1.029 18995
636 1 2 . 1 1 90 90 HIS H H 90 8.116 8.116 8.733 -0.617 18995
637 1 2 . 1 1 91 91 GLU N N 91 127.965 127.965 118.639 9.326 18995
638 1 2 . 1 1 91 91 GLU H H 91 8.235 8.235 7.739 0.496 18995
639 1 3 . 1 1 20 20 ARG C C 20 177.097 177.097 175.078 2.019 18995
640 1 3 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.838 4.262 18995
641 1 3 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.788 0.212 18995
642 1 3 . 1 1 21 21 GLU N N 21 116.519 116.519 121.161 -4.642 18995
643 1 3 . 1 1 21 21 GLU C C 21 175.055 175.055 175.574 -0.519 18995
644 1 3 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.596 1.004 18995
645 1 3 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.220 1.480 18995
646 1 3 . 1 1 21 21 GLU H H 21 9.468 9.468 9.105 0.363 18995
647 1 3 . 1 1 22 22 GLY N N 22 122.197 122.197 110.545 11.652 18995
648 1 3 . 1 1 22 22 GLY C C 22 180.081 180.081 173.763 6.318 18995
649 1 3 . 1 1 22 22 GLY H H 22 10.096 10.096 9.243 0.853 18995
650 1 3 . 1 1 23 23 ASP N N 23 113.764 113.764 126.207 -12.443 18995
651 1 3 . 1 1 23 23 ASP C C 23 178.957 178.957 175.380 3.577 18995
652 1 3 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.495 2.006 18995
653 1 3 . 1 1 23 23 ASP H H 23 8.115 8.115 9.309 -1.194 18995
654 1 3 . 1 1 24 24 LYS N N 24 131.954 131.954 128.039 3.915 18995
655 1 3 . 1 1 24 24 LYS C C 24 176.539 176.539 175.329 1.210 18995
656 1 3 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.126 3.074 18995
657 1 3 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.633 -1.933 18995
658 1 3 . 1 1 24 24 LYS H H 24 9.484 9.484 9.163 0.321 18995
659 1 3 . 1 1 25 25 HIS N N 25 119.313 119.313 128.186 -8.873 18995
660 1 3 . 1 1 25 25 HIS C C 25 172.815 172.815 174.177 -1.362 18995
661 1 3 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.087 1.413 18995
662 1 3 . 1 1 25 25 HIS CB C 25 30.800 30.800 32.064 -1.264 18995
663 1 3 . 1 1 25 25 HIS H H 25 9.589 9.589 9.001 0.588 18995
664 1 3 . 1 1 26 26 LYS N N 26 115.394 115.394 127.893 -12.499 18995
665 1 3 . 1 1 26 26 LYS C C 26 174.608 174.608 174.252 0.356 18995
666 1 3 . 1 1 26 26 LYS CA C 26 55.400 55.400 55.661 -0.261 18995
667 1 3 . 1 1 26 26 LYS CB C 26 39.100 39.100 30.712 8.388 18995
668 1 3 . 1 1 26 26 LYS H H 26 7.095 7.095 8.085 -0.990 18995
669 1 3 . 1 1 27 27 LEU N N 27 126.263 126.263 121.174 5.089 18995
670 1 3 . 1 1 27 27 LEU C C 27 175.637 175.637 175.836 -0.199 18995
671 1 3 . 1 1 27 27 LEU CA C 27 52.800 52.800 54.438 -1.638 18995
672 1 3 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.129 1.571 18995
673 1 3 . 1 1 27 27 LEU H H 27 9.595 9.595 7.263 2.332 18995
674 1 3 . 1 1 28 28 LYS N N 28 124.436 124.436 121.304 3.132 18995
675 1 3 . 1 1 28 28 LYS C C 28 177.395 177.395 176.104 1.291 18995
676 1 3 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.295 -1.095 18995
677 1 3 . 1 1 28 28 LYS H H 28 9.711 9.711 8.418 1.293 18995
678 1 3 . 1 1 29 29 LYS N N 29 121.980 121.980 118.954 3.026 18995
679 1 3 . 1 1 29 29 LYS C C 29 177.400 177.400 174.624 2.776 18995
680 1 3 . 1 1 29 29 LYS CA C 29 62.700 62.700 56.013 6.687 18995
681 1 3 . 1 1 29 29 LYS H H 29 9.084 9.084 7.571 1.513 18995
682 1 3 . 1 1 30 30 SER N N 30 111.519 111.519 114.296 -2.777 18995
683 1 3 . 1 1 30 30 SER C C 30 176.950 176.950 172.611 4.339 18995
684 1 3 . 1 1 30 30 SER CA C 30 61.100 61.100 56.574 4.526 18995
685 1 3 . 1 1 30 30 SER CB C 30 61.300 61.300 67.299 -5.999 18995
686 1 3 . 1 1 30 30 SER H H 30 8.267 8.267 7.178 1.089 18995
687 1 3 . 1 1 31 31 GLU N N 31 123.792 123.792 119.991 3.801 18995
688 1 3 . 1 1 31 31 GLU C C 31 179.463 179.463 176.693 2.770 18995
689 1 3 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.242 4.858 18995
690 1 3 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.709 -2.510 18995
691 1 3 . 1 1 31 31 GLU H H 31 6.603 6.603 9.602 -2.999 18995
692 1 3 . 1 1 32 32 LEU N N 32 121.954 121.954 125.174 -3.220 18995
693 1 3 . 1 1 32 32 LEU C C 32 176.995 176.995 175.546 1.449 18995
694 1 3 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.461 2.439 18995
695 1 3 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.377 -0.077 18995
696 1 3 . 1 1 32 32 LEU H H 32 8.936 8.936 9.001 -0.065 18995
697 1 3 . 1 1 33 33 LYS N N 33 118.576 118.576 128.468 -9.892 18995
698 1 3 . 1 1 33 33 LYS C C 33 176.714 176.714 174.976 1.738 18995
699 1 3 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.735 5.765 18995
700 1 3 . 1 1 33 33 LYS CB C 33 32.900 32.900 35.273 -2.373 18995
701 1 3 . 1 1 33 33 LYS H H 33 8.390 8.390 9.330 -0.940 18995
702 1 3 . 1 1 34 34 GLU N N 34 116.152 116.152 128.192 -12.040 18995
703 1 3 . 1 1 34 34 GLU C C 34 177.689 177.689 175.777 1.912 18995
704 1 3 . 1 1 34 34 GLU CA C 34 59.400 59.400 55.797 3.603 18995
705 1 3 . 1 1 34 34 GLU CB C 34 29.400 29.400 31.320 -1.920 18995
706 1 3 . 1 1 34 34 GLU H H 34 7.326 7.326 8.312 -0.986 18995
707 1 3 . 1 1 35 35 LEU N N 35 123.632 123.632 128.439 -4.807 18995
708 1 3 . 1 1 35 35 LEU C C 35 178.845 178.845 176.334 2.511 18995
709 1 3 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.360 7.440 18995
710 1 3 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.025 -1.024 18995
711 1 3 . 1 1 35 35 LEU H H 35 7.978 7.978 9.152 -1.174 18995
712 1 3 . 1 1 36 36 ILE C C 36 178.328 178.328 175.691 2.637 18995
713 1 3 . 1 1 36 36 ILE CA C 36 66.300 66.300 63.390 2.910 18995
714 1 3 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.080 0.620 18995
715 1 3 . 1 1 37 37 ASN N N 37 118.242 118.242 112.159 6.083 18995
716 1 3 . 1 1 37 37 ASN C C 37 177.052 177.052 176.499 0.553 18995
717 1 3 . 1 1 37 37 ASN CA C 37 54.800 54.800 52.486 2.314 18995
718 1 3 . 1 1 37 37 ASN CB C 37 37.500 37.500 37.500 0.000 18995
719 1 3 . 1 1 37 37 ASN H H 37 8.336 8.336 8.337 -0.001 18995
720 1 3 . 1 1 38 38 ASN N N 38 114.845 114.845 118.551 -3.706 18995
721 1 3 . 1 1 38 38 ASN C C 38 176.578 176.578 174.762 1.816 18995
722 1 3 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.748 2.452 18995
723 1 3 . 1 1 38 38 ASN H H 38 8.213 8.213 7.985 0.228 18995
724 1 3 . 1 1 39 39 GLU N N 39 113.797 113.797 120.691 -6.894 18995
725 1 3 . 1 1 39 39 GLU C C 39 177.689 177.689 174.321 3.368 18995
726 1 3 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.452 -1.252 18995
727 1 3 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.183 0.117 18995
728 1 3 . 1 1 39 39 GLU H H 39 8.522 8.522 8.546 -0.024 18995
729 1 3 . 1 1 40 40 LEU N N 40 119.982 119.982 123.170 -3.188 18995
730 1 3 . 1 1 40 40 LEU C C 40 177.212 177.212 175.583 1.629 18995
731 1 3 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.314 0.786 18995
732 1 3 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.153 -1.453 18995
733 1 3 . 1 1 40 40 LEU H H 40 7.552 7.552 8.474 -0.922 18995
734 1 3 . 1 1 41 41 SER N N 41 114.635 114.635 120.002 -5.367 18995
735 1 3 . 1 1 41 41 SER C C 41 175.688 175.688 172.616 3.072 18995
736 1 3 . 1 1 41 41 SER CA C 41 60.800 60.800 57.134 3.666 18995
737 1 3 . 1 1 41 41 SER CB C 41 64.100 64.100 66.966 -2.866 18995
738 1 3 . 1 1 41 41 SER H H 41 7.592 7.592 9.049 -1.457 18995
739 1 3 . 1 1 42 42 HIS N N 42 122.397 122.397 115.682 6.715 18995
740 1 3 . 1 1 42 42 HIS C C 42 175.523 175.523 172.613 2.910 18995
741 1 3 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.216 3.484 18995
742 1 3 . 1 1 42 42 HIS H H 42 10.406 10.406 8.553 1.853 18995
743 1 3 . 1 1 43 43 PHE N N 43 117.618 117.618 121.710 -4.092 18995
744 1 3 . 1 1 43 43 PHE C C 43 177.431 177.431 176.002 1.429 18995
745 1 3 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.466 3.334 18995
746 1 3 . 1 1 43 43 PHE H H 43 7.785 7.785 8.833 -1.048 18995
747 1 3 . 1 1 44 44 LEU N N 44 120.185 120.185 127.146 -6.961 18995
748 1 3 . 1 1 44 44 LEU C C 44 175.829 175.829 176.405 -0.576 18995
749 1 3 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.857 -3.057 18995
750 1 3 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.336 2.664 18995
751 1 3 . 1 1 44 44 LEU H H 44 8.533 8.533 8.754 -0.221 18995
752 1 3 . 1 1 45 45 GLU N N 45 121.499 121.499 119.541 1.958 18995
753 1 3 . 1 1 45 45 GLU C C 45 175.060 175.060 177.202 -2.142 18995
754 1 3 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.306 0.294 18995
755 1 3 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.484 1.116 18995
756 1 3 . 1 1 45 45 GLU H H 45 8.130 8.130 8.330 -0.200 18995
757 1 3 . 1 1 46 46 GLU N N 46 122.480 122.480 124.955 -2.475 18995
758 1 3 . 1 1 46 46 GLU C C 46 176.861 176.861 176.004 0.857 18995
759 1 3 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.181 -0.381 18995
760 1 3 . 1 1 46 46 GLU CB C 46 30.700 30.700 28.814 1.887 18995
761 1 3 . 1 1 46 46 GLU H H 46 8.123 8.123 8.658 -0.535 18995
762 1 3 . 1 1 47 47 ILE N N 47 127.680 127.680 119.123 8.557 18995
763 1 3 . 1 1 47 47 ILE C C 47 175.931 175.931 176.007 -0.076 18995
764 1 3 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.451 0.649 18995
765 1 3 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.756 0.844 18995
766 1 3 . 1 1 47 47 ILE H H 47 9.897 9.897 7.776 2.121 18995
767 1 3 . 1 1 48 48 LYS N N 48 126.846 126.846 123.693 3.153 18995
768 1 3 . 1 1 48 48 LYS C C 48 175.896 175.896 175.872 0.024 18995
769 1 3 . 1 1 48 48 LYS CA C 48 56.600 56.600 53.868 2.732 18995
770 1 3 . 1 1 48 48 LYS CB C 48 34.700 34.700 33.993 0.707 18995
771 1 3 . 1 1 48 48 LYS H H 48 9.077 9.077 7.426 1.651 18995
772 1 3 . 1 1 49 49 GLU C C 49 179.470 179.470 176.600 2.870 18995
773 1 3 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.212 -1.613 18995
774 1 3 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.668 2.132 18995
775 1 3 . 1 1 50 50 GLN N N 50 125.850 125.850 119.476 6.374 18995
776 1 3 . 1 1 50 50 GLN C C 50 176.883 176.883 176.460 0.423 18995
777 1 3 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.934 0.565 18995
778 1 3 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.258 0.142 18995
779 1 3 . 1 1 50 50 GLN H H 50 9.041 9.041 8.925 0.116 18995
780 1 3 . 1 1 51 51 GLU N N 51 117.404 117.404 112.482 4.922 18995
781 1 3 . 1 1 51 51 GLU C C 51 178.262 178.262 175.286 2.976 18995
782 1 3 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.581 4.119 18995
783 1 3 . 1 1 51 51 GLU CB C 51 29.300 29.300 30.187 -0.887 18995
784 1 3 . 1 1 51 51 GLU H H 51 9.352 9.352 7.431 1.921 18995
785 1 3 . 1 1 52 52 VAL N N 52 118.888 118.888 122.103 -3.215 18995
786 1 3 . 1 1 52 52 VAL C C 52 177.677 177.677 174.795 2.882 18995
787 1 3 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.889 4.211 18995
788 1 3 . 1 1 52 52 VAL CB C 52 31.700 31.700 30.733 0.967 18995
789 1 3 . 1 1 52 52 VAL H H 52 7.247 7.247 7.241 0.006 18995
790 1 3 . 1 1 53 53 VAL N N 53 119.906 119.906 123.346 -3.440 18995
791 1 3 . 1 1 53 53 VAL C C 53 176.742 176.742 174.936 1.806 18995
792 1 3 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.545 5.655 18995
793 1 3 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.951 -3.351 18995
794 1 3 . 1 1 53 53 VAL H H 53 7.264 7.264 8.787 -1.523 18995
795 1 3 . 1 1 54 54 ASP N N 54 121.483 121.483 119.901 1.582 18995
796 1 3 . 1 1 54 54 ASP C C 54 178.291 178.291 174.373 3.918 18995
797 1 3 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.288 5.912 18995
798 1 3 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.631 -4.631 18995
799 1 3 . 1 1 54 54 ASP H H 54 8.524 8.524 9.010 -0.486 18995
800 1 3 . 1 1 55 55 LYS N N 55 120.875 120.875 127.582 -6.707 18995
801 1 3 . 1 1 55 55 LYS C C 55 179.054 179.054 176.215 2.839 18995
802 1 3 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.249 3.651 18995
803 1 3 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.256 -0.056 18995
804 1 3 . 1 1 55 55 LYS H H 55 7.580 7.580 8.833 -1.253 18995
805 1 3 . 1 1 56 56 VAL N N 56 121.960 121.960 123.388 -1.428 18995
806 1 3 . 1 1 56 56 VAL C C 56 178.221 178.221 175.065 3.156 18995
807 1 3 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.232 5.768 18995
808 1 3 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.305 -1.605 18995
809 1 3 . 1 1 56 56 VAL H H 56 8.279 8.279 8.311 -0.032 18995
810 1 3 . 1 1 57 57 MET N N 57 118.815 118.815 126.177 -7.362 18995
811 1 3 . 1 1 57 57 MET C C 57 176.888 176.888 175.526 1.362 18995
812 1 3 . 1 1 57 57 MET CA C 57 57.900 57.900 54.462 3.438 18995
813 1 3 . 1 1 57 57 MET CB C 57 32.900 32.900 32.911 -0.011 18995
814 1 3 . 1 1 57 57 MET H H 57 8.467 8.467 8.918 -0.451 18995
815 1 3 . 1 1 58 58 GLU N N 58 117.894 117.894 125.695 -7.801 18995
816 1 3 . 1 1 58 58 GLU C C 58 178.510 178.510 176.429 2.081 18995
817 1 3 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.338 2.062 18995
818 1 3 . 1 1 58 58 GLU CB C 58 29.800 29.800 30.712 -0.912 18995
819 1 3 . 1 1 58 58 GLU H H 58 8.073 8.073 8.738 -0.665 18995
820 1 3 . 1 1 59 59 THR N N 59 113.244 113.244 112.508 0.736 18995
821 1 3 . 1 1 59 59 THR C C 59 174.778 174.778 172.620 2.158 18995
822 1 3 . 1 1 59 59 THR CA C 59 65.600 65.600 60.094 5.505 18995
823 1 3 . 1 1 59 59 THR CB C 59 69.600 69.600 71.285 -1.685 18995
824 1 3 . 1 1 59 59 THR H H 59 7.739 7.739 7.458 0.281 18995
825 1 3 . 1 1 60 60 LEU N N 60 119.636 119.636 123.210 -3.574 18995
826 1 3 . 1 1 60 60 LEU C C 60 177.561 177.561 177.335 0.226 18995
827 1 3 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.695 -1.095 18995
828 1 3 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.243 2.057 18995
829 1 3 . 1 1 60 60 LEU H H 60 7.643 7.643 8.721 -1.078 18995
830 1 3 . 1 1 61 61 ASP N N 61 117.424 117.424 125.319 -7.895 18995
831 1 3 . 1 1 61 61 ASP C C 61 175.915 175.915 174.788 1.127 18995
832 1 3 . 1 1 61 61 ASP CA C 61 54.600 54.600 54.032 0.568 18995
833 1 3 . 1 1 61 61 ASP H H 61 7.984 7.984 8.738 -0.754 18995
834 1 3 . 1 1 62 62 ASN N N 62 127.650 127.650 122.079 5.571 18995
835 1 3 . 1 1 62 62 ASN C C 62 175.905 175.905 174.468 1.437 18995
836 1 3 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.898 2.002 18995
837 1 3 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.336 1.064 18995
838 1 3 . 1 1 62 62 ASN H H 62 9.032 9.032 8.148 0.884 18995
839 1 3 . 1 1 63 63 ASP N N 63 116.676 116.676 123.806 -7.130 18995
840 1 3 . 1 1 63 63 ASP C C 63 177.604 177.604 175.198 2.406 18995
841 1 3 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.676 2.724 18995
842 1 3 . 1 1 63 63 ASP CB C 63 40.200 40.200 44.827 -4.627 18995
843 1 3 . 1 1 63 63 ASP H H 63 8.302 8.302 9.607 -1.305 18995
844 1 3 . 1 1 64 64 GLY N N 64 109.334 109.334 111.200 -1.866 18995
845 1 3 . 1 1 64 64 GLY C C 64 174.834 174.834 174.891 -0.057 18995
846 1 3 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.339 4.361 18995
847 1 3 . 1 1 64 64 GLY H H 64 7.681 7.681 9.137 -1.456 18995
848 1 3 . 1 1 65 65 ASP N N 65 120.960 120.960 126.978 -6.018 18995
849 1 3 . 1 1 65 65 ASP C C 65 177.010 177.010 174.808 2.202 18995
850 1 3 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.191 -0.391 18995
851 1 3 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.516 -0.216 18995
852 1 3 . 1 1 65 65 ASP H H 65 8.386 8.386 9.156 -0.770 18995
853 1 3 . 1 1 66 66 GLY N N 66 113.875 113.875 117.477 -3.602 18995
854 1 3 . 1 1 66 66 GLY C C 66 172.343 172.343 174.080 -1.737 18995
855 1 3 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.825 3.075 18995
856 1 3 . 1 1 66 66 GLY H H 66 10.212 10.212 9.005 1.208 18995
857 1 3 . 1 1 67 67 GLU N N 67 118.701 118.701 125.208 -6.507 18995
858 1 3 . 1 1 67 67 GLU C C 67 174.711 174.711 176.128 -1.417 18995
859 1 3 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.626 -0.426 18995
860 1 3 . 1 1 67 67 GLU H H 67 7.949 7.949 9.058 -1.109 18995
861 1 3 . 1 1 68 68 CYS N N 68 124.753 124.753 127.077 -2.324 18995
862 1 3 . 1 1 68 68 CYS C C 68 174.411 174.411 176.742 -2.331 18995
863 1 3 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.829 -5.829 18995
864 1 3 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.894 0.206 18995
865 1 3 . 1 1 68 68 CYS H H 68 9.486 9.486 8.430 1.056 18995
866 1 3 . 1 1 69 69 ASP N N 69 132.376 132.376 119.717 12.659 18995
867 1 3 . 1 1 69 69 ASP C C 69 175.307 175.307 174.912 0.395 18995
868 1 3 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.281 -0.981 18995
869 1 3 . 1 1 69 69 ASP CB C 69 40.600 40.600 39.095 1.505 18995
870 1 3 . 1 1 69 69 ASP H H 69 9.911 9.911 8.513 1.398 18995
871 1 3 . 1 1 70 70 PHE N N 70 119.131 119.131 119.344 -0.213 18995
872 1 3 . 1 1 70 70 PHE C C 70 176.482 176.482 174.483 1.999 18995
873 1 3 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.313 4.587 18995
874 1 3 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.536 -1.436 18995
875 1 3 . 1 1 70 70 PHE H H 70 9.075 9.075 7.963 1.112 18995
876 1 3 . 1 1 71 71 GLN N N 71 119.323 119.323 117.699 1.624 18995
877 1 3 . 1 1 71 71 GLN C C 71 179.517 179.517 174.232 5.285 18995
878 1 3 . 1 1 71 71 GLN CA C 71 60.100 60.100 57.075 3.025 18995
879 1 3 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.805 0.395 18995
880 1 3 . 1 1 71 71 GLN H H 71 8.047 8.047 8.374 -0.327 18995
881 1 3 . 1 1 72 72 GLU N N 72 123.228 123.228 115.963 7.265 18995
882 1 3 . 1 1 72 72 GLU C C 72 179.337 179.337 175.098 4.239 18995
883 1 3 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.160 3.740 18995
884 1 3 . 1 1 72 72 GLU CB C 72 30.300 30.300 32.707 -2.407 18995
885 1 3 . 1 1 72 72 GLU H H 72 9.061 9.061 7.265 1.796 18995
886 1 3 . 1 1 73 73 PHE N N 73 123.155 123.155 118.998 4.157 18995
887 1 3 . 1 1 73 73 PHE C C 73 176.497 176.497 175.195 1.302 18995
888 1 3 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.362 3.438 18995
889 1 3 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.875 -1.175 18995
890 1 3 . 1 1 73 73 PHE H H 73 8.863 8.863 9.363 -0.500 18995
891 1 3 . 1 1 74 74 MET N N 74 119.622 119.622 122.899 -3.277 18995
892 1 3 . 1 1 74 74 MET C C 74 178.476 178.476 174.737 3.739 18995
893 1 3 . 1 1 74 74 MET CA C 74 56.200 56.200 55.702 0.498 18995
894 1 3 . 1 1 74 74 MET CB C 74 30.400 30.400 33.408 -3.008 18995
895 1 3 . 1 1 74 74 MET H H 74 8.217 8.217 9.072 -0.855 18995
896 1 3 . 1 1 75 75 ALA N N 75 123.073 123.073 128.765 -5.692 18995
897 1 3 . 1 1 75 75 ALA C C 75 180.129 180.129 175.110 5.019 18995
898 1 3 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.295 4.905 18995
899 1 3 . 1 1 75 75 ALA H H 75 7.490 7.490 9.281 -1.791 18995
900 1 3 . 1 1 76 76 PHE N N 76 122.171 122.171 122.535 -0.364 18995
901 1 3 . 1 1 76 76 PHE C C 76 176.365 176.365 175.094 1.271 18995
902 1 3 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.417 2.383 18995
903 1 3 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.689 -4.089 18995
904 1 3 . 1 1 76 76 PHE H H 76 7.676 7.676 8.227 -0.551 18995
905 1 3 . 1 1 77 77 VAL N N 77 119.765 119.765 124.214 -4.449 18995
906 1 3 . 1 1 77 77 VAL C C 77 179.175 179.175 177.795 1.380 18995
907 1 3 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.155 6.645 18995
908 1 3 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.397 -1.197 18995
909 1 3 . 1 1 77 77 VAL H H 77 8.498 8.498 8.640 -0.142 18995
910 1 3 . 1 1 78 78 ALA N N 78 123.880 123.880 122.249 1.631 18995
911 1 3 . 1 1 78 78 ALA C C 78 178.630 178.630 177.302 1.328 18995
912 1 3 . 1 1 78 78 ALA CA C 78 56.100 56.100 54.914 1.185 18995
913 1 3 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.682 -0.382 18995
914 1 3 . 1 1 78 78 ALA H H 78 8.193 8.193 8.768 -0.575 18995
915 1 3 . 1 1 79 79 MET N N 79 120.537 120.537 114.078 6.459 18995
916 1 3 . 1 1 79 79 MET C C 79 178.430 178.430 176.766 1.664 18995
917 1 3 . 1 1 79 79 MET CA C 79 59.500 59.500 54.327 5.173 18995
918 1 3 . 1 1 79 79 MET CB C 79 32.800 32.800 31.724 1.076 18995
919 1 3 . 1 1 79 79 MET H H 79 7.883 7.883 7.755 0.128 18995
920 1 3 . 1 1 80 80 VAL N N 80 120.374 120.374 119.209 1.165 18995
921 1 3 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.670 4.530 18995
922 1 3 . 1 1 80 80 VAL H H 80 8.299 8.299 7.502 0.797 18995
923 1 3 . 1 1 82 82 THR C C 82 175.144 175.144 172.322 2.822 18995
924 1 3 . 1 1 82 82 THR CA C 82 65.800 65.800 61.083 4.717 18995
925 1 3 . 1 1 83 83 ALA N N 83 123.244 123.244 122.870 0.374 18995
926 1 3 . 1 1 83 83 ALA C C 83 178.574 178.574 175.144 3.430 18995
927 1 3 . 1 1 83 83 ALA CA C 83 53.900 53.900 50.179 3.721 18995
928 1 3 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.878 -2.878 18995
929 1 3 . 1 1 83 83 ALA H H 83 7.587 7.587 8.659 -1.072 18995
930 1 3 . 1 1 84 84 CYS N N 84 116.910 116.910 117.313 -0.403 18995
931 1 3 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.444 2.356 18995
932 1 3 . 1 1 84 84 CYS CB C 84 27.900 27.900 28.787 -0.887 18995
933 1 3 . 1 1 84 84 CYS H H 84 7.788 7.788 8.446 -0.658 18995
934 1 3 . 1 1 86 86 GLU CA C 86 58.600 58.600 58.257 0.343 18995
935 1 3 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.193 -0.793 18995
936 1 3 . 1 1 87 87 PHE N N 87 118.550 118.550 117.893 0.657 18995
937 1 3 . 1 1 87 87 PHE C C 87 175.597 175.597 174.897 0.700 18995
938 1 3 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.730 1.370 18995
939 1 3 . 1 1 87 87 PHE CB C 87 39.400 39.400 39.931 -0.531 18995
940 1 3 . 1 1 87 87 PHE H H 87 7.838 7.838 7.810 0.028 18995
941 1 3 . 1 1 88 88 PHE N N 88 118.438 118.438 125.107 -6.669 18995
942 1 3 . 1 1 88 88 PHE C C 88 175.241 175.241 175.917 -0.676 18995
943 1 3 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.490 0.710 18995
944 1 3 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.585 2.115 18995
945 1 3 . 1 1 88 88 PHE H H 88 7.718 7.718 8.435 -0.717 18995
946 1 3 . 1 1 89 89 GLU N N 89 121.366 121.366 125.794 -4.428 18995
947 1 3 . 1 1 89 89 GLU C C 89 175.437 175.437 177.054 -1.617 18995
948 1 3 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.347 2.253 18995
949 1 3 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.105 -0.805 18995
950 1 3 . 1 1 89 89 GLU H H 89 7.959 7.959 7.895 0.064 18995
951 1 3 . 1 1 90 90 HIS N N 90 120.349 120.349 116.179 4.170 18995
952 1 3 . 1 1 90 90 HIS C C 90 173.652 173.652 175.272 -1.620 18995
953 1 3 . 1 1 90 90 HIS CA C 90 55.800 55.800 57.892 -2.092 18995
954 1 3 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.428 0.672 18995
955 1 3 . 1 1 90 90 HIS H H 90 8.116 8.116 8.619 -0.503 18995
956 1 3 . 1 1 91 91 GLU N N 91 127.965 127.965 117.689 10.276 18995
957 1 3 . 1 1 91 91 GLU H H 91 8.235 8.235 7.511 0.724 18995
958 1 4 . 1 1 20 20 ARG C C 20 177.097 177.097 175.066 2.031 18995
959 1 4 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.858 4.242 18995
960 1 4 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.885 0.115 18995
961 1 4 . 1 1 21 21 GLU N N 21 116.519 116.519 120.581 -4.062 18995
962 1 4 . 1 1 21 21 GLU C C 21 175.055 175.055 175.392 -0.337 18995
963 1 4 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.511 1.089 18995
964 1 4 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.171 1.529 18995
965 1 4 . 1 1 21 21 GLU H H 21 9.468 9.468 9.121 0.347 18995
966 1 4 . 1 1 22 22 GLY N N 22 122.197 122.197 109.850 12.347 18995
967 1 4 . 1 1 22 22 GLY C C 22 180.081 180.081 173.702 6.379 18995
968 1 4 . 1 1 22 22 GLY H H 22 10.096 10.096 9.183 0.913 18995
969 1 4 . 1 1 23 23 ASP N N 23 113.764 113.764 126.209 -12.445 18995
970 1 4 . 1 1 23 23 ASP C C 23 178.957 178.957 175.536 3.421 18995
971 1 4 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.539 1.961 18995
972 1 4 . 1 1 23 23 ASP H H 23 8.115 8.115 9.302 -1.187 18995
973 1 4 . 1 1 24 24 LYS N N 24 131.954 131.954 127.647 4.307 18995
974 1 4 . 1 1 24 24 LYS C C 24 176.539 176.539 175.073 1.466 18995
975 1 4 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.434 2.766 18995
976 1 4 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.832 -2.132 18995
977 1 4 . 1 1 24 24 LYS H H 24 9.484 9.484 8.975 0.509 18995
978 1 4 . 1 1 25 25 HIS N N 25 119.313 119.313 127.889 -8.576 18995
979 1 4 . 1 1 25 25 HIS C C 25 172.815 172.815 174.329 -1.514 18995
980 1 4 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.336 1.164 18995
981 1 4 . 1 1 25 25 HIS CB C 25 30.800 30.800 32.314 -1.514 18995
982 1 4 . 1 1 25 25 HIS H H 25 9.589 9.589 8.676 0.913 18995
983 1 4 . 1 1 26 26 LYS N N 26 115.394 115.394 125.895 -10.501 18995
984 1 4 . 1 1 26 26 LYS C C 26 174.608 174.608 175.036 -0.428 18995
985 1 4 . 1 1 26 26 LYS CA C 26 55.400 55.400 56.905 -1.505 18995
986 1 4 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.221 6.879 18995
987 1 4 . 1 1 26 26 LYS H H 26 7.095 7.095 8.184 -1.089 18995
988 1 4 . 1 1 27 27 LEU N N 27 126.263 126.263 119.555 6.708 18995
989 1 4 . 1 1 27 27 LEU C C 27 175.637 175.637 176.528 -0.891 18995
990 1 4 . 1 1 27 27 LEU CA C 27 52.800 52.800 53.861 -1.061 18995
991 1 4 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.033 1.667 18995
992 1 4 . 1 1 27 27 LEU H H 27 9.595 9.595 6.965 2.630 18995
993 1 4 . 1 1 28 28 LYS N N 28 124.436 124.436 124.816 -0.380 18995
994 1 4 . 1 1 28 28 LYS C C 28 177.395 177.395 175.841 1.554 18995
995 1 4 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.398 -1.198 18995
996 1 4 . 1 1 28 28 LYS H H 28 9.711 9.711 8.451 1.260 18995
997 1 4 . 1 1 29 29 LYS N N 29 121.980 121.980 118.633 3.347 18995
998 1 4 . 1 1 29 29 LYS C C 29 177.400 177.400 174.844 2.556 18995
999 1 4 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.769 6.931 18995
1000 1 4 . 1 1 29 29 LYS H H 29 9.084 9.084 7.369 1.715 18995
1001 1 4 . 1 1 30 30 SER N N 30 111.519 111.519 113.556 -2.037 18995
1002 1 4 . 1 1 30 30 SER C C 30 176.950 176.950 173.304 3.646 18995
1003 1 4 . 1 1 30 30 SER CA C 30 61.100 61.100 56.266 4.834 18995
1004 1 4 . 1 1 30 30 SER CB C 30 61.300 61.300 64.894 -3.594 18995
1005 1 4 . 1 1 30 30 SER H H 30 8.267 8.267 6.964 1.303 18995
1006 1 4 . 1 1 31 31 GLU N N 31 123.792 123.792 119.913 3.879 18995
1007 1 4 . 1 1 31 31 GLU C C 31 179.463 179.463 176.928 2.535 18995
1008 1 4 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.246 4.854 18995
1009 1 4 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.059 -1.859 18995
1010 1 4 . 1 1 31 31 GLU H H 31 6.603 6.603 9.398 -2.795 18995
1011 1 4 . 1 1 32 32 LEU N N 32 121.954 121.954 125.251 -3.297 18995
1012 1 4 . 1 1 32 32 LEU C C 32 176.995 176.995 175.742 1.253 18995
1013 1 4 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.480 2.420 18995
1014 1 4 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.162 0.138 18995
1015 1 4 . 1 1 32 32 LEU H H 32 8.936 8.936 9.065 -0.129 18995
1016 1 4 . 1 1 33 33 LYS N N 33 118.576 118.576 128.670 -10.094 18995
1017 1 4 . 1 1 33 33 LYS C C 33 176.714 176.714 175.144 1.570 18995
1018 1 4 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.802 5.698 18995
1019 1 4 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.161 -1.262 18995
1020 1 4 . 1 1 33 33 LYS H H 33 8.390 8.390 9.248 -0.858 18995
1021 1 4 . 1 1 34 34 GLU N N 34 116.152 116.152 128.351 -12.199 18995
1022 1 4 . 1 1 34 34 GLU C C 34 177.689 177.689 175.327 2.362 18995
1023 1 4 . 1 1 34 34 GLU CA C 34 59.400 59.400 56.000 3.400 18995
1024 1 4 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.627 -1.227 18995
1025 1 4 . 1 1 34 34 GLU H H 34 7.326 7.326 8.383 -1.057 18995
1026 1 4 . 1 1 35 35 LEU N N 35 123.632 123.632 127.889 -4.257 18995
1027 1 4 . 1 1 35 35 LEU C C 35 178.845 178.845 176.556 2.289 18995
1028 1 4 . 1 1 35 35 LEU CA C 35 59.800 59.800 53.040 6.760 18995
1029 1 4 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.141 -1.141 18995
1030 1 4 . 1 1 35 35 LEU H H 35 7.978 7.978 9.019 -1.041 18995
1031 1 4 . 1 1 36 36 ILE C C 36 178.328 178.328 176.149 2.179 18995
1032 1 4 . 1 1 36 36 ILE CA C 36 66.300 66.300 62.988 3.312 18995
1033 1 4 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.381 0.319 18995
1034 1 4 . 1 1 37 37 ASN N N 37 118.242 118.242 113.188 5.054 18995
1035 1 4 . 1 1 37 37 ASN C C 37 177.052 177.052 176.651 0.401 18995
1036 1 4 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.558 1.242 18995
1037 1 4 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.325 -0.825 18995
1038 1 4 . 1 1 37 37 ASN H H 37 8.336 8.336 8.473 -0.137 18995
1039 1 4 . 1 1 38 38 ASN N N 38 114.845 114.845 118.975 -4.130 18995
1040 1 4 . 1 1 38 38 ASN C C 38 176.578 176.578 174.627 1.951 18995
1041 1 4 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.738 2.462 18995
1042 1 4 . 1 1 38 38 ASN H H 38 8.213 8.213 8.007 0.206 18995
1043 1 4 . 1 1 39 39 GLU N N 39 113.797 113.797 121.225 -7.428 18995
1044 1 4 . 1 1 39 39 GLU C C 39 177.689 177.689 174.650 3.039 18995
1045 1 4 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.829 -1.629 18995
1046 1 4 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.011 0.289 18995
1047 1 4 . 1 1 39 39 GLU H H 39 8.522 8.522 8.487 0.035 18995
1048 1 4 . 1 1 40 40 LEU N N 40 119.982 119.982 122.383 -2.401 18995
1049 1 4 . 1 1 40 40 LEU C C 40 177.212 177.212 175.559 1.653 18995
1050 1 4 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.524 0.576 18995
1051 1 4 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.236 -1.536 18995
1052 1 4 . 1 1 40 40 LEU H H 40 7.552 7.552 8.585 -1.033 18995
1053 1 4 . 1 1 41 41 SER N N 41 114.635 114.635 120.372 -5.737 18995
1054 1 4 . 1 1 41 41 SER C C 41 175.688 175.688 172.655 3.033 18995
1055 1 4 . 1 1 41 41 SER CA C 41 60.800 60.800 56.954 3.846 18995
1056 1 4 . 1 1 41 41 SER CB C 41 64.100 64.100 67.179 -3.079 18995
1057 1 4 . 1 1 41 41 SER H H 41 7.592 7.592 9.170 -1.578 18995
1058 1 4 . 1 1 42 42 HIS N N 42 122.397 122.397 115.541 6.856 18995
1059 1 4 . 1 1 42 42 HIS C C 42 175.523 175.523 172.300 3.223 18995
1060 1 4 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.385 3.316 18995
1061 1 4 . 1 1 42 42 HIS H H 42 10.406 10.406 8.365 2.041 18995
1062 1 4 . 1 1 43 43 PHE N N 43 117.618 117.618 121.698 -4.080 18995
1063 1 4 . 1 1 43 43 PHE C C 43 177.431 177.431 176.018 1.413 18995
1064 1 4 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.411 3.389 18995
1065 1 4 . 1 1 43 43 PHE H H 43 7.785 7.785 8.263 -0.478 18995
1066 1 4 . 1 1 44 44 LEU N N 44 120.185 120.185 125.794 -5.609 18995
1067 1 4 . 1 1 44 44 LEU C C 44 175.829 175.829 176.288 -0.459 18995
1068 1 4 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.007 -2.207 18995
1069 1 4 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.629 2.371 18995
1070 1 4 . 1 1 44 44 LEU H H 44 8.533 8.533 8.844 -0.311 18995
1071 1 4 . 1 1 45 45 GLU N N 45 121.499 121.499 119.993 1.506 18995
1072 1 4 . 1 1 45 45 GLU C C 45 175.060 175.060 177.278 -2.218 18995
1073 1 4 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.355 0.245 18995
1074 1 4 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.656 0.944 18995
1075 1 4 . 1 1 45 45 GLU H H 45 8.130 8.130 8.374 -0.244 18995
1076 1 4 . 1 1 46 46 GLU N N 46 122.480 122.480 125.550 -3.070 18995
1077 1 4 . 1 1 46 46 GLU C C 46 176.861 176.861 176.061 0.800 18995
1078 1 4 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.349 -0.549 18995
1079 1 4 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.155 1.545 18995
1080 1 4 . 1 1 46 46 GLU H H 46 8.123 8.123 8.777 -0.654 18995
1081 1 4 . 1 1 47 47 ILE N N 47 127.680 127.680 118.831 8.849 18995
1082 1 4 . 1 1 47 47 ILE C C 47 175.931 175.931 175.746 0.185 18995
1083 1 4 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.816 0.284 18995
1084 1 4 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.815 0.785 18995
1085 1 4 . 1 1 47 47 ILE H H 47 9.897 9.897 7.811 2.086 18995
1086 1 4 . 1 1 48 48 LYS N N 48 126.846 126.846 123.841 3.005 18995
1087 1 4 . 1 1 48 48 LYS C C 48 175.896 175.896 175.971 -0.075 18995
1088 1 4 . 1 1 48 48 LYS CA C 48 56.600 56.600 54.302 2.298 18995
1089 1 4 . 1 1 48 48 LYS CB C 48 34.700 34.700 34.366 0.334 18995
1090 1 4 . 1 1 48 48 LYS H H 48 9.077 9.077 7.380 1.697 18995
1091 1 4 . 1 1 49 49 GLU C C 49 179.470 179.470 176.641 2.829 18995
1092 1 4 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.343 -1.742 18995
1093 1 4 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.642 2.159 18995
1094 1 4 . 1 1 50 50 GLN N N 50 125.850 125.850 118.978 6.872 18995
1095 1 4 . 1 1 50 50 GLN C C 50 176.883 176.883 176.195 0.688 18995
1096 1 4 . 1 1 50 50 GLN CA C 50 58.500 58.500 58.010 0.490 18995
1097 1 4 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.359 0.041 18995
1098 1 4 . 1 1 50 50 GLN H H 50 9.041 9.041 8.837 0.204 18995
1099 1 4 . 1 1 51 51 GLU N N 51 117.404 117.404 112.195 5.209 18995
1100 1 4 . 1 1 51 51 GLU C C 51 178.262 178.262 175.650 2.612 18995
1101 1 4 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.488 4.212 18995
1102 1 4 . 1 1 51 51 GLU CB C 51 29.300 29.300 30.220 -0.920 18995
1103 1 4 . 1 1 51 51 GLU H H 51 9.352 9.352 7.329 2.023 18995
1104 1 4 . 1 1 52 52 VAL N N 52 118.888 118.888 122.713 -3.825 18995
1105 1 4 . 1 1 52 52 VAL C C 52 177.677 177.677 174.807 2.870 18995
1106 1 4 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.723 4.377 18995
1107 1 4 . 1 1 52 52 VAL CB C 52 31.700 31.700 30.585 1.115 18995
1108 1 4 . 1 1 52 52 VAL H H 52 7.247 7.247 7.235 0.012 18995
1109 1 4 . 1 1 53 53 VAL N N 53 119.906 119.906 123.448 -3.542 18995
1110 1 4 . 1 1 53 53 VAL C C 53 176.742 176.742 174.777 1.965 18995
1111 1 4 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.650 5.550 18995
1112 1 4 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.621 -3.022 18995
1113 1 4 . 1 1 53 53 VAL H H 53 7.264 7.264 8.919 -1.655 18995
1114 1 4 . 1 1 54 54 ASP N N 54 121.483 121.483 120.545 0.938 18995
1115 1 4 . 1 1 54 54 ASP C C 54 178.291 178.291 174.588 3.703 18995
1116 1 4 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.248 5.952 18995
1117 1 4 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.067 -4.067 18995
1118 1 4 . 1 1 54 54 ASP H H 54 8.524 8.524 9.069 -0.545 18995
1119 1 4 . 1 1 55 55 LYS N N 55 120.875 120.875 127.731 -6.856 18995
1120 1 4 . 1 1 55 55 LYS C C 55 179.054 179.054 176.214 2.840 18995
1121 1 4 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.322 3.578 18995
1122 1 4 . 1 1 55 55 LYS CB C 55 32.200 32.200 31.681 0.519 18995
1123 1 4 . 1 1 55 55 LYS H H 55 7.580 7.580 8.871 -1.291 18995
1124 1 4 . 1 1 56 56 VAL N N 56 121.960 121.960 122.878 -0.918 18995
1125 1 4 . 1 1 56 56 VAL C C 56 178.221 178.221 175.029 3.192 18995
1126 1 4 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.700 5.300 18995
1127 1 4 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.255 -1.555 18995
1128 1 4 . 1 1 56 56 VAL H H 56 8.279 8.279 7.946 0.333 18995
1129 1 4 . 1 1 57 57 MET N N 57 118.815 118.815 125.550 -6.735 18995
1130 1 4 . 1 1 57 57 MET C C 57 176.888 176.888 175.365 1.523 18995
1131 1 4 . 1 1 57 57 MET CA C 57 57.900 57.900 54.164 3.736 18995
1132 1 4 . 1 1 57 57 MET CB C 57 32.900 32.900 33.264 -0.364 18995
1133 1 4 . 1 1 57 57 MET H H 57 8.467 8.467 8.785 -0.318 18995
1134 1 4 . 1 1 58 58 GLU N N 58 117.894 117.894 125.535 -7.641 18995
1135 1 4 . 1 1 58 58 GLU C C 58 178.510 178.510 176.566 1.944 18995
1136 1 4 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.560 1.840 18995
1137 1 4 . 1 1 58 58 GLU CB C 58 29.800 29.800 30.841 -1.041 18995
1138 1 4 . 1 1 58 58 GLU H H 58 8.073 8.073 8.717 -0.644 18995
1139 1 4 . 1 1 59 59 THR N N 59 113.244 113.244 112.828 0.416 18995
1140 1 4 . 1 1 59 59 THR C C 59 174.778 174.778 172.793 1.985 18995
1141 1 4 . 1 1 59 59 THR CA C 59 65.600 65.600 59.751 5.849 18995
1142 1 4 . 1 1 59 59 THR CB C 59 69.600 69.600 71.167 -1.567 18995
1143 1 4 . 1 1 59 59 THR H H 59 7.739 7.739 7.509 0.230 18995
1144 1 4 . 1 1 60 60 LEU N N 60 119.636 119.636 123.290 -3.654 18995
1145 1 4 . 1 1 60 60 LEU C C 60 177.561 177.561 177.280 0.281 18995
1146 1 4 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.495 -0.895 18995
1147 1 4 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.153 2.147 18995
1148 1 4 . 1 1 60 60 LEU H H 60 7.643 7.643 8.675 -1.032 18995
1149 1 4 . 1 1 61 61 ASP N N 61 117.424 117.424 124.952 -7.528 18995
1150 1 4 . 1 1 61 61 ASP C C 61 175.915 175.915 174.644 1.271 18995
1151 1 4 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.823 0.777 18995
1152 1 4 . 1 1 61 61 ASP H H 61 7.984 7.984 8.604 -0.620 18995
1153 1 4 . 1 1 62 62 ASN N N 62 127.650 127.650 122.194 5.456 18995
1154 1 4 . 1 1 62 62 ASN C C 62 175.905 175.905 174.463 1.442 18995
1155 1 4 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.883 2.017 18995
1156 1 4 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.498 0.902 18995
1157 1 4 . 1 1 62 62 ASN H H 62 9.032 9.032 8.147 0.885 18995
1158 1 4 . 1 1 63 63 ASP N N 63 116.676 116.676 123.067 -6.391 18995
1159 1 4 . 1 1 63 63 ASP C C 63 177.604 177.604 174.897 2.707 18995
1160 1 4 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.898 2.502 18995
1161 1 4 . 1 1 63 63 ASP CB C 63 40.200 40.200 44.990 -4.790 18995
1162 1 4 . 1 1 63 63 ASP H H 63 8.302 8.302 9.658 -1.356 18995
1163 1 4 . 1 1 64 64 GLY N N 64 109.334 109.334 110.459 -1.125 18995
1164 1 4 . 1 1 64 64 GLY C C 64 174.834 174.834 174.260 0.574 18995
1165 1 4 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.762 3.938 18995
1166 1 4 . 1 1 64 64 GLY H H 64 7.681 7.681 9.102 -1.421 18995
1167 1 4 . 1 1 65 65 ASP N N 65 120.960 120.960 126.856 -5.896 18995
1168 1 4 . 1 1 65 65 ASP C C 65 177.010 177.010 174.611 2.399 18995
1169 1 4 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.062 -0.262 18995
1170 1 4 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.712 -0.411 18995
1171 1 4 . 1 1 65 65 ASP H H 65 8.386 8.386 9.274 -0.888 18995
1172 1 4 . 1 1 66 66 GLY N N 66 113.875 113.875 117.435 -3.560 18995
1173 1 4 . 1 1 66 66 GLY C C 66 172.343 172.343 174.194 -1.851 18995
1174 1 4 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.763 3.137 18995
1175 1 4 . 1 1 66 66 GLY H H 66 10.212 10.212 8.855 1.357 18995
1176 1 4 . 1 1 67 67 GLU N N 67 118.701 118.701 126.038 -7.337 18995
1177 1 4 . 1 1 67 67 GLU C C 67 174.711 174.711 176.250 -1.539 18995
1178 1 4 . 1 1 67 67 GLU CA C 67 55.200 55.200 56.103 -0.903 18995
1179 1 4 . 1 1 67 67 GLU H H 67 7.949 7.949 9.002 -1.053 18995
1180 1 4 . 1 1 68 68 CYS N N 68 124.753 124.753 127.143 -2.390 18995
1181 1 4 . 1 1 68 68 CYS C C 68 174.411 174.411 175.617 -1.206 18995
1182 1 4 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.339 -5.339 18995
1183 1 4 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.885 0.215 18995
1184 1 4 . 1 1 68 68 CYS H H 68 9.486 9.486 8.521 0.965 18995
1185 1 4 . 1 1 69 69 ASP N N 69 132.376 132.376 118.115 14.261 18995
1186 1 4 . 1 1 69 69 ASP C C 69 175.307 175.307 175.182 0.125 18995
1187 1 4 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.939 -1.639 18995
1188 1 4 . 1 1 69 69 ASP CB C 69 40.600 40.600 40.661 -0.061 18995
1189 1 4 . 1 1 69 69 ASP H H 69 9.911 9.911 8.232 1.679 18995
1190 1 4 . 1 1 70 70 PHE N N 70 119.131 119.131 118.295 0.836 18995
1191 1 4 . 1 1 70 70 PHE C C 70 176.482 176.482 174.908 1.574 18995
1192 1 4 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.027 4.873 18995
1193 1 4 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.774 -1.674 18995
1194 1 4 . 1 1 70 70 PHE H H 70 9.075 9.075 7.200 1.875 18995
1195 1 4 . 1 1 71 71 GLN N N 71 119.323 119.323 118.448 0.875 18995
1196 1 4 . 1 1 71 71 GLN C C 71 179.517 179.517 173.787 5.730 18995
1197 1 4 . 1 1 71 71 GLN CA C 71 60.100 60.100 56.927 3.173 18995
1198 1 4 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.489 0.711 18995
1199 1 4 . 1 1 71 71 GLN H H 71 8.047 8.047 8.436 -0.389 18995
1200 1 4 . 1 1 72 72 GLU N N 72 123.228 123.228 115.927 7.301 18995
1201 1 4 . 1 1 72 72 GLU C C 72 179.337 179.337 174.840 4.497 18995
1202 1 4 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.058 3.842 18995
1203 1 4 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.649 -3.349 18995
1204 1 4 . 1 1 72 72 GLU H H 72 9.061 9.061 7.305 1.756 18995
1205 1 4 . 1 1 73 73 PHE N N 73 123.155 123.155 120.087 3.068 18995
1206 1 4 . 1 1 73 73 PHE C C 73 176.497 176.497 175.587 0.910 18995
1207 1 4 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.774 3.026 18995
1208 1 4 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.659 -0.959 18995
1209 1 4 . 1 1 73 73 PHE H H 73 8.863 8.863 9.426 -0.563 18995
1210 1 4 . 1 1 74 74 MET N N 74 119.622 119.622 122.968 -3.346 18995
1211 1 4 . 1 1 74 74 MET C C 74 178.476 178.476 174.729 3.747 18995
1212 1 4 . 1 1 74 74 MET CA C 74 56.200 56.200 55.548 0.652 18995
1213 1 4 . 1 1 74 74 MET CB C 74 30.400 30.400 33.500 -3.100 18995
1214 1 4 . 1 1 74 74 MET H H 74 8.217 8.217 9.059 -0.842 18995
1215 1 4 . 1 1 75 75 ALA N N 75 123.073 123.073 128.687 -5.614 18995
1216 1 4 . 1 1 75 75 ALA C C 75 180.129 180.129 175.150 4.979 18995
1217 1 4 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.337 4.863 18995
1218 1 4 . 1 1 75 75 ALA H H 75 7.490 7.490 9.271 -1.781 18995
1219 1 4 . 1 1 76 76 PHE N N 76 122.171 122.171 121.786 0.385 18995
1220 1 4 . 1 1 76 76 PHE C C 76 176.365 176.365 175.075 1.290 18995
1221 1 4 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.217 2.583 18995
1222 1 4 . 1 1 76 76 PHE CB C 76 38.600 38.600 43.070 -4.470 18995
1223 1 4 . 1 1 76 76 PHE H H 76 7.676 7.676 8.274 -0.598 18995
1224 1 4 . 1 1 77 77 VAL N N 77 119.765 119.765 124.223 -4.458 18995
1225 1 4 . 1 1 77 77 VAL C C 77 179.175 179.175 177.630 1.545 18995
1226 1 4 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.449 6.351 18995
1227 1 4 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.404 -1.204 18995
1228 1 4 . 1 1 77 77 VAL H H 77 8.498 8.498 8.754 -0.256 18995
1229 1 4 . 1 1 78 78 ALA N N 78 123.880 123.880 122.433 1.447 18995
1230 1 4 . 1 1 78 78 ALA C C 78 178.630 178.630 177.509 1.121 18995
1231 1 4 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.189 0.911 18995
1232 1 4 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.683 -0.383 18995
1233 1 4 . 1 1 78 78 ALA H H 78 8.193 8.193 8.807 -0.614 18995
1234 1 4 . 1 1 79 79 MET N N 79 120.537 120.537 114.139 6.398 18995
1235 1 4 . 1 1 79 79 MET C C 79 178.430 178.430 176.863 1.567 18995
1236 1 4 . 1 1 79 79 MET CA C 79 59.500 59.500 54.470 5.030 18995
1237 1 4 . 1 1 79 79 MET CB C 79 32.800 32.800 31.832 0.968 18995
1238 1 4 . 1 1 79 79 MET H H 79 7.883 7.883 7.780 0.103 18995
1239 1 4 . 1 1 80 80 VAL N N 80 120.374 120.374 119.628 0.746 18995
1240 1 4 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.791 4.409 18995
1241 1 4 . 1 1 80 80 VAL H H 80 8.299 8.299 7.774 0.525 18995
1242 1 4 . 1 1 82 82 THR C C 82 175.144 175.144 172.608 2.536 18995
1243 1 4 . 1 1 82 82 THR CA C 82 65.800 65.800 61.263 4.537 18995
1244 1 4 . 1 1 83 83 ALA N N 83 123.244 123.244 123.244 0.000 18995
1245 1 4 . 1 1 83 83 ALA C C 83 178.574 178.574 175.320 3.254 18995
1246 1 4 . 1 1 83 83 ALA CA C 83 53.900 53.900 49.747 4.153 18995
1247 1 4 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.888 -2.888 18995
1248 1 4 . 1 1 83 83 ALA H H 83 7.587 7.587 8.742 -1.155 18995
1249 1 4 . 1 1 84 84 CYS N N 84 116.910 116.910 117.204 -0.294 18995
1250 1 4 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.292 2.508 18995
1251 1 4 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.712 -1.812 18995
1252 1 4 . 1 1 84 84 CYS H H 84 7.788 7.788 8.512 -0.724 18995
1253 1 4 . 1 1 86 86 GLU CA C 86 58.600 58.600 58.282 0.318 18995
1254 1 4 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.094 -0.694 18995
1255 1 4 . 1 1 87 87 PHE N N 87 118.550 118.550 120.542 -1.992 18995
1256 1 4 . 1 1 87 87 PHE C C 87 175.597 175.597 175.089 0.508 18995
1257 1 4 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.801 1.298 18995
1258 1 4 . 1 1 87 87 PHE CB C 87 39.400 39.400 39.506 -0.106 18995
1259 1 4 . 1 1 87 87 PHE H H 87 7.838 7.838 7.603 0.235 18995
1260 1 4 . 1 1 88 88 PHE N N 88 118.438 118.438 128.007 -9.569 18995
1261 1 4 . 1 1 88 88 PHE C C 88 175.241 175.241 176.173 -0.932 18995
1262 1 4 . 1 1 88 88 PHE CA C 88 58.200 58.200 58.103 0.097 18995
1263 1 4 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.252 2.448 18995
1264 1 4 . 1 1 88 88 PHE H H 88 7.718 7.718 8.645 -0.927 18995
1265 1 4 . 1 1 89 89 GLU N N 89 121.366 121.366 126.391 -5.025 18995
1266 1 4 . 1 1 89 89 GLU C C 89 175.437 175.437 177.169 -1.732 18995
1267 1 4 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.346 2.255 18995
1268 1 4 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.506 -1.206 18995
1269 1 4 . 1 1 89 89 GLU H H 89 7.959 7.959 8.020 -0.061 18995
1270 1 4 . 1 1 90 90 HIS N N 90 120.349 120.349 115.754 4.595 18995
1271 1 4 . 1 1 90 90 HIS C C 90 173.652 173.652 175.000 -1.348 18995
1272 1 4 . 1 1 90 90 HIS CA C 90 55.800 55.800 57.390 -1.590 18995
1273 1 4 . 1 1 90 90 HIS CB C 90 30.100 30.100 28.769 1.331 18995
1274 1 4 . 1 1 90 90 HIS H H 90 8.116 8.116 8.680 -0.564 18995
1275 1 4 . 1 1 91 91 GLU N N 91 127.965 127.965 116.696 11.269 18995
1276 1 4 . 1 1 91 91 GLU H H 91 8.235 8.235 7.488 0.747 18995
1277 1 5 . 1 1 20 20 ARG C C 20 177.097 177.097 175.043 2.054 18995
1278 1 5 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.758 4.341 18995
1279 1 5 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.970 0.031 18995
1280 1 5 . 1 1 21 21 GLU N N 21 116.519 116.519 120.345 -3.826 18995
1281 1 5 . 1 1 21 21 GLU C C 21 175.055 175.055 175.901 -0.846 18995
1282 1 5 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.375 1.225 18995
1283 1 5 . 1 1 21 21 GLU CB C 21 35.700 35.700 33.707 1.993 18995
1284 1 5 . 1 1 21 21 GLU H H 21 9.468 9.468 9.094 0.374 18995
1285 1 5 . 1 1 22 22 GLY N N 22 122.197 122.197 110.633 11.564 18995
1286 1 5 . 1 1 22 22 GLY C C 22 180.081 180.081 174.419 5.662 18995
1287 1 5 . 1 1 22 22 GLY H H 22 10.096 10.096 9.205 0.891 18995
1288 1 5 . 1 1 23 23 ASP N N 23 113.764 113.764 126.283 -12.519 18995
1289 1 5 . 1 1 23 23 ASP C C 23 178.957 178.957 175.491 3.466 18995
1290 1 5 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.723 1.777 18995
1291 1 5 . 1 1 23 23 ASP H H 23 8.115 8.115 9.242 -1.127 18995
1292 1 5 . 1 1 24 24 LYS N N 24 131.954 131.954 127.793 4.161 18995
1293 1 5 . 1 1 24 24 LYS C C 24 176.539 176.539 175.241 1.298 18995
1294 1 5 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.215 2.985 18995
1295 1 5 . 1 1 24 24 LYS CB C 24 31.700 31.700 34.469 -2.769 18995
1296 1 5 . 1 1 24 24 LYS H H 24 9.484 9.484 8.992 0.492 18995
1297 1 5 . 1 1 25 25 HIS N N 25 119.313 119.313 128.347 -9.034 18995
1298 1 5 . 1 1 25 25 HIS C C 25 172.815 172.815 174.515 -1.700 18995
1299 1 5 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.180 1.320 18995
1300 1 5 . 1 1 25 25 HIS CB C 25 30.800 30.800 31.997 -1.198 18995
1301 1 5 . 1 1 25 25 HIS H H 25 9.589 9.589 8.590 0.999 18995
1302 1 5 . 1 1 26 26 LYS N N 26 115.394 115.394 126.526 -11.132 18995
1303 1 5 . 1 1 26 26 LYS C C 26 174.608 174.608 175.753 -1.145 18995
1304 1 5 . 1 1 26 26 LYS CA C 26 55.400 55.400 57.670 -2.270 18995
1305 1 5 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.238 6.862 18995
1306 1 5 . 1 1 26 26 LYS H H 26 7.095 7.095 8.071 -0.976 18995
1307 1 5 . 1 1 27 27 LEU N N 27 126.263 126.263 119.483 6.780 18995
1308 1 5 . 1 1 27 27 LEU C C 27 175.637 175.637 176.711 -1.074 18995
1309 1 5 . 1 1 27 27 LEU CA C 27 52.800 52.800 54.656 -1.856 18995
1310 1 5 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.256 1.444 18995
1311 1 5 . 1 1 27 27 LEU H H 27 9.595 9.595 7.062 2.533 18995
1312 1 5 . 1 1 28 28 LYS N N 28 124.436 124.436 125.607 -1.171 18995
1313 1 5 . 1 1 28 28 LYS C C 28 177.395 177.395 176.096 1.299 18995
1314 1 5 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.539 -1.339 18995
1315 1 5 . 1 1 28 28 LYS H H 28 9.711 9.711 8.717 0.994 18995
1316 1 5 . 1 1 29 29 LYS N N 29 121.980 121.980 119.252 2.728 18995
1317 1 5 . 1 1 29 29 LYS C C 29 177.400 177.400 174.917 2.483 18995
1318 1 5 . 1 1 29 29 LYS CA C 29 62.700 62.700 56.094 6.606 18995
1319 1 5 . 1 1 29 29 LYS H H 29 9.084 9.084 7.450 1.634 18995
1320 1 5 . 1 1 30 30 SER N N 30 111.519 111.519 112.877 -1.358 18995
1321 1 5 . 1 1 30 30 SER C C 30 176.950 176.950 172.836 4.114 18995
1322 1 5 . 1 1 30 30 SER CA C 30 61.100 61.100 56.550 4.550 18995
1323 1 5 . 1 1 30 30 SER CB C 30 61.300 61.300 66.306 -5.006 18995
1324 1 5 . 1 1 30 30 SER H H 30 8.267 8.267 7.115 1.152 18995
1325 1 5 . 1 1 31 31 GLU N N 31 123.792 123.792 119.306 4.486 18995
1326 1 5 . 1 1 31 31 GLU C C 31 179.463 179.463 176.658 2.805 18995
1327 1 5 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.246 4.854 18995
1328 1 5 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.667 -2.467 18995
1329 1 5 . 1 1 31 31 GLU H H 31 6.603 6.603 9.570 -2.967 18995
1330 1 5 . 1 1 32 32 LEU N N 32 121.954 121.954 124.873 -2.919 18995
1331 1 5 . 1 1 32 32 LEU C C 32 176.995 176.995 175.599 1.396 18995
1332 1 5 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.512 2.388 18995
1333 1 5 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.291 0.009 18995
1334 1 5 . 1 1 32 32 LEU H H 32 8.936 8.936 9.062 -0.126 18995
1335 1 5 . 1 1 33 33 LYS N N 33 118.576 118.576 128.603 -10.027 18995
1336 1 5 . 1 1 33 33 LYS C C 33 176.714 176.714 174.867 1.847 18995
1337 1 5 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.557 5.943 18995
1338 1 5 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.765 -1.865 18995
1339 1 5 . 1 1 33 33 LYS H H 33 8.390 8.390 9.223 -0.833 18995
1340 1 5 . 1 1 34 34 GLU N N 34 116.152 116.152 128.031 -11.879 18995
1341 1 5 . 1 1 34 34 GLU C C 34 177.689 177.689 175.259 2.430 18995
1342 1 5 . 1 1 34 34 GLU CA C 34 59.400 59.400 55.907 3.493 18995
1343 1 5 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.993 -1.593 18995
1344 1 5 . 1 1 34 34 GLU H H 34 7.326 7.326 8.110 -0.784 18995
1345 1 5 . 1 1 35 35 LEU N N 35 123.632 123.632 127.048 -3.416 18995
1346 1 5 . 1 1 35 35 LEU C C 35 178.845 178.845 176.331 2.514 18995
1347 1 5 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.771 7.029 18995
1348 1 5 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.392 -1.392 18995
1349 1 5 . 1 1 35 35 LEU H H 35 7.978 7.978 8.834 -0.856 18995
1350 1 5 . 1 1 36 36 ILE C C 36 178.328 178.328 175.675 2.653 18995
1351 1 5 . 1 1 36 36 ILE CA C 36 66.300 66.300 62.821 3.479 18995
1352 1 5 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.319 0.381 18995
1353 1 5 . 1 1 37 37 ASN N N 37 118.242 118.242 112.483 5.759 18995
1354 1 5 . 1 1 37 37 ASN C C 37 177.052 177.052 176.523 0.529 18995
1355 1 5 . 1 1 37 37 ASN CA C 37 54.800 54.800 52.992 1.808 18995
1356 1 5 . 1 1 37 37 ASN CB C 37 37.500 37.500 37.739 -0.239 18995
1357 1 5 . 1 1 37 37 ASN H H 37 8.336 8.336 8.334 0.002 18995
1358 1 5 . 1 1 38 38 ASN N N 38 114.845 114.845 118.601 -3.756 18995
1359 1 5 . 1 1 38 38 ASN C C 38 176.578 176.578 174.619 1.959 18995
1360 1 5 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.696 2.504 18995
1361 1 5 . 1 1 38 38 ASN H H 38 8.213 8.213 7.967 0.246 18995
1362 1 5 . 1 1 39 39 GLU N N 39 113.797 113.797 120.941 -7.144 18995
1363 1 5 . 1 1 39 39 GLU C C 39 177.689 177.689 174.549 3.140 18995
1364 1 5 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.524 -1.324 18995
1365 1 5 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.410 -0.110 18995
1366 1 5 . 1 1 39 39 GLU H H 39 8.522 8.522 8.659 -0.137 18995
1367 1 5 . 1 1 40 40 LEU N N 40 119.982 119.982 122.688 -2.706 18995
1368 1 5 . 1 1 40 40 LEU C C 40 177.212 177.212 175.690 1.522 18995
1369 1 5 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.498 0.602 18995
1370 1 5 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.371 -1.671 18995
1371 1 5 . 1 1 40 40 LEU H H 40 7.552 7.552 8.678 -1.126 18995
1372 1 5 . 1 1 41 41 SER N N 41 114.635 114.635 120.350 -5.715 18995
1373 1 5 . 1 1 41 41 SER C C 41 175.688 175.688 172.624 3.064 18995
1374 1 5 . 1 1 41 41 SER CA C 41 60.800 60.800 57.107 3.693 18995
1375 1 5 . 1 1 41 41 SER CB C 41 64.100 64.100 66.870 -2.770 18995
1376 1 5 . 1 1 41 41 SER H H 41 7.592 7.592 9.186 -1.594 18995
1377 1 5 . 1 1 42 42 HIS N N 42 122.397 122.397 115.642 6.755 18995
1378 1 5 . 1 1 42 42 HIS C C 42 175.523 175.523 172.607 2.916 18995
1379 1 5 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.236 3.465 18995
1380 1 5 . 1 1 42 42 HIS H H 42 10.406 10.406 8.235 2.171 18995
1381 1 5 . 1 1 43 43 PHE N N 43 117.618 117.618 121.479 -3.861 18995
1382 1 5 . 1 1 43 43 PHE C C 43 177.431 177.431 175.926 1.505 18995
1383 1 5 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.546 3.254 18995
1384 1 5 . 1 1 43 43 PHE H H 43 7.785 7.785 8.647 -0.862 18995
1385 1 5 . 1 1 44 44 LEU N N 44 120.185 120.185 125.892 -5.707 18995
1386 1 5 . 1 1 44 44 LEU C C 44 175.829 175.829 176.294 -0.465 18995
1387 1 5 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.081 -2.281 18995
1388 1 5 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.682 2.318 18995
1389 1 5 . 1 1 44 44 LEU H H 44 8.533 8.533 8.756 -0.223 18995
1390 1 5 . 1 1 45 45 GLU N N 45 121.499 121.499 120.743 0.756 18995
1391 1 5 . 1 1 45 45 GLU C C 45 175.060 175.060 177.358 -2.298 18995
1392 1 5 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.199 0.401 18995
1393 1 5 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.092 1.508 18995
1394 1 5 . 1 1 45 45 GLU H H 45 8.130 8.130 8.473 -0.343 18995
1395 1 5 . 1 1 46 46 GLU N N 46 122.480 122.480 125.429 -2.949 18995
1396 1 5 . 1 1 46 46 GLU C C 46 176.861 176.861 176.068 0.793 18995
1397 1 5 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.697 -0.897 18995
1398 1 5 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.065 1.635 18995
1399 1 5 . 1 1 46 46 GLU H H 46 8.123 8.123 8.733 -0.610 18995
1400 1 5 . 1 1 47 47 ILE N N 47 127.680 127.680 118.743 8.937 18995
1401 1 5 . 1 1 47 47 ILE C C 47 175.931 175.931 176.084 -0.153 18995
1402 1 5 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.224 0.876 18995
1403 1 5 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.827 0.773 18995
1404 1 5 . 1 1 47 47 ILE H H 47 9.897 9.897 7.717 2.180 18995
1405 1 5 . 1 1 48 48 LYS N N 48 126.846 126.846 124.152 2.694 18995
1406 1 5 . 1 1 48 48 LYS C C 48 175.896 175.896 175.988 -0.092 18995
1407 1 5 . 1 1 48 48 LYS CA C 48 56.600 56.600 54.081 2.519 18995
1408 1 5 . 1 1 48 48 LYS CB C 48 34.700 34.700 33.992 0.708 18995
1409 1 5 . 1 1 48 48 LYS H H 48 9.077 9.077 7.439 1.638 18995
1410 1 5 . 1 1 49 49 GLU C C 49 179.470 179.470 176.694 2.776 18995
1411 1 5 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.217 -1.617 18995
1412 1 5 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.674 2.126 18995
1413 1 5 . 1 1 50 50 GLN N N 50 125.850 125.850 120.278 5.572 18995
1414 1 5 . 1 1 50 50 GLN C C 50 176.883 176.883 177.204 -0.321 18995
1415 1 5 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.550 0.950 18995
1416 1 5 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.612 -0.212 18995
1417 1 5 . 1 1 50 50 GLN H H 50 9.041 9.041 8.789 0.252 18995
1418 1 5 . 1 1 51 51 GLU N N 51 117.404 117.404 113.012 4.392 18995
1419 1 5 . 1 1 51 51 GLU C C 51 178.262 178.262 175.405 2.857 18995
1420 1 5 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.871 3.829 18995
1421 1 5 . 1 1 51 51 GLU CB C 51 29.300 29.300 29.941 -0.641 18995
1422 1 5 . 1 1 51 51 GLU H H 51 9.352 9.352 7.382 1.970 18995
1423 1 5 . 1 1 52 52 VAL N N 52 118.888 118.888 122.231 -3.343 18995
1424 1 5 . 1 1 52 52 VAL C C 52 177.677 177.677 174.844 2.833 18995
1425 1 5 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.899 4.201 18995
1426 1 5 . 1 1 52 52 VAL CB C 52 31.700 31.700 31.064 0.636 18995
1427 1 5 . 1 1 52 52 VAL H H 52 7.247 7.247 7.201 0.046 18995
1428 1 5 . 1 1 53 53 VAL N N 53 119.906 119.906 123.448 -3.542 18995
1429 1 5 . 1 1 53 53 VAL C C 53 176.742 176.742 174.775 1.967 18995
1430 1 5 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.514 5.686 18995
1431 1 5 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.543 -2.943 18995
1432 1 5 . 1 1 53 53 VAL H H 53 7.264 7.264 8.890 -1.626 18995
1433 1 5 . 1 1 54 54 ASP N N 54 121.483 121.483 121.166 0.317 18995
1434 1 5 . 1 1 54 54 ASP C C 54 178.291 178.291 174.722 3.569 18995
1435 1 5 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.378 5.822 18995
1436 1 5 . 1 1 54 54 ASP CB C 54 40.000 40.000 43.259 -3.259 18995
1437 1 5 . 1 1 54 54 ASP H H 54 8.524 8.524 9.080 -0.556 18995
1438 1 5 . 1 1 55 55 LYS N N 55 120.875 120.875 128.327 -7.452 18995
1439 1 5 . 1 1 55 55 LYS C C 55 179.054 179.054 176.355 2.699 18995
1440 1 5 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.417 3.483 18995
1441 1 5 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.369 -0.169 18995
1442 1 5 . 1 1 55 55 LYS H H 55 7.580 7.580 8.899 -1.319 18995
1443 1 5 . 1 1 56 56 VAL N N 56 121.960 121.960 124.141 -2.181 18995
1444 1 5 . 1 1 56 56 VAL C C 56 178.221 178.221 174.938 3.283 18995
1445 1 5 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.213 5.787 18995
1446 1 5 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.505 -1.805 18995
1447 1 5 . 1 1 56 56 VAL H H 56 8.279 8.279 8.814 -0.535 18995
1448 1 5 . 1 1 57 57 MET N N 57 118.815 118.815 126.327 -7.512 18995
1449 1 5 . 1 1 57 57 MET C C 57 176.888 176.888 175.283 1.605 18995
1450 1 5 . 1 1 57 57 MET CA C 57 57.900 57.900 54.400 3.500 18995
1451 1 5 . 1 1 57 57 MET CB C 57 32.900 32.900 32.791 0.109 18995
1452 1 5 . 1 1 57 57 MET H H 57 8.467 8.467 8.957 -0.490 18995
1453 1 5 . 1 1 58 58 GLU N N 58 117.894 117.894 125.859 -7.965 18995
1454 1 5 . 1 1 58 58 GLU C C 58 178.510 178.510 176.435 2.075 18995
1455 1 5 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.412 1.988 18995
1456 1 5 . 1 1 58 58 GLU CB C 58 29.800 29.800 30.615 -0.815 18995
1457 1 5 . 1 1 58 58 GLU H H 58 8.073 8.073 8.708 -0.635 18995
1458 1 5 . 1 1 59 59 THR N N 59 113.244 113.244 112.906 0.338 18995
1459 1 5 . 1 1 59 59 THR C C 59 174.778 174.778 172.937 1.841 18995
1460 1 5 . 1 1 59 59 THR CA C 59 65.600 65.600 59.840 5.760 18995
1461 1 5 . 1 1 59 59 THR CB C 59 69.600 69.600 70.625 -1.025 18995
1462 1 5 . 1 1 59 59 THR H H 59 7.739 7.739 7.433 0.306 18995
1463 1 5 . 1 1 60 60 LEU N N 60 119.636 119.636 123.525 -3.889 18995
1464 1 5 . 1 1 60 60 LEU C C 60 177.561 177.561 177.218 0.343 18995
1465 1 5 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.292 -0.692 18995
1466 1 5 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.010 2.291 18995
1467 1 5 . 1 1 60 60 LEU H H 60 7.643 7.643 8.624 -0.981 18995
1468 1 5 . 1 1 61 61 ASP N N 61 117.424 117.424 125.092 -7.668 18995
1469 1 5 . 1 1 61 61 ASP C C 61 175.915 175.915 174.382 1.533 18995
1470 1 5 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.731 0.869 18995
1471 1 5 . 1 1 61 61 ASP H H 61 7.984 7.984 8.556 -0.572 18995
1472 1 5 . 1 1 62 62 ASN N N 62 127.650 127.650 122.346 5.304 18995
1473 1 5 . 1 1 62 62 ASN C C 62 175.905 175.905 174.371 1.534 18995
1474 1 5 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.887 2.013 18995
1475 1 5 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.075 1.325 18995
1476 1 5 . 1 1 62 62 ASN H H 62 9.032 9.032 7.925 1.107 18995
1477 1 5 . 1 1 63 63 ASP N N 63 116.676 116.676 123.462 -6.786 18995
1478 1 5 . 1 1 63 63 ASP C C 63 177.604 177.604 175.046 2.558 18995
1479 1 5 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.580 2.821 18995
1480 1 5 . 1 1 63 63 ASP CB C 63 40.200 40.200 45.137 -4.937 18995
1481 1 5 . 1 1 63 63 ASP H H 63 8.302 8.302 9.629 -1.327 18995
1482 1 5 . 1 1 64 64 GLY N N 64 109.334 109.334 109.670 -0.336 18995
1483 1 5 . 1 1 64 64 GLY C C 64 174.834 174.834 174.505 0.329 18995
1484 1 5 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.255 4.445 18995
1485 1 5 . 1 1 64 64 GLY H H 64 7.681 7.681 9.059 -1.378 18995
1486 1 5 . 1 1 65 65 ASP N N 65 120.960 120.960 125.371 -4.411 18995
1487 1 5 . 1 1 65 65 ASP C C 65 177.010 177.010 174.593 2.417 18995
1488 1 5 . 1 1 65 65 ASP CA C 65 53.800 53.800 53.808 -0.008 18995
1489 1 5 . 1 1 65 65 ASP CB C 65 40.300 40.300 41.249 -0.949 18995
1490 1 5 . 1 1 65 65 ASP H H 65 8.386 8.386 9.160 -0.774 18995
1491 1 5 . 1 1 66 66 GLY N N 66 113.875 113.875 117.204 -3.329 18995
1492 1 5 . 1 1 66 66 GLY C C 66 172.343 172.343 174.204 -1.861 18995
1493 1 5 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.790 3.110 18995
1494 1 5 . 1 1 66 66 GLY H H 66 10.212 10.212 8.832 1.380 18995
1495 1 5 . 1 1 67 67 GLU N N 67 118.701 118.701 125.607 -6.906 18995
1496 1 5 . 1 1 67 67 GLU C C 67 174.711 174.711 176.183 -1.472 18995
1497 1 5 . 1 1 67 67 GLU CA C 67 55.200 55.200 56.028 -0.827 18995
1498 1 5 . 1 1 67 67 GLU H H 67 7.949 7.949 8.963 -1.014 18995
1499 1 5 . 1 1 68 68 CYS N N 68 124.753 124.753 126.492 -1.739 18995
1500 1 5 . 1 1 68 68 CYS C C 68 174.411 174.411 176.115 -1.704 18995
1501 1 5 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.012 -5.012 18995
1502 1 5 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.926 0.174 18995
1503 1 5 . 1 1 68 68 CYS H H 68 9.486 9.486 8.442 1.044 18995
1504 1 5 . 1 1 69 69 ASP N N 69 132.376 132.376 116.704 15.672 18995
1505 1 5 . 1 1 69 69 ASP C C 69 175.307 175.307 175.968 -0.661 18995
1506 1 5 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.412 -1.112 18995
1507 1 5 . 1 1 69 69 ASP CB C 69 40.600 40.600 40.869 -0.269 18995
1508 1 5 . 1 1 69 69 ASP H H 69 9.911 9.911 8.452 1.459 18995
1509 1 5 . 1 1 70 70 PHE N N 70 119.131 119.131 120.395 -1.264 18995
1510 1 5 . 1 1 70 70 PHE C C 70 176.482 176.482 175.150 1.332 18995
1511 1 5 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.019 4.881 18995
1512 1 5 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.910 -1.810 18995
1513 1 5 . 1 1 70 70 PHE H H 70 9.075 9.075 7.398 1.677 18995
1514 1 5 . 1 1 71 71 GLN N N 71 119.323 119.323 118.050 1.273 18995
1515 1 5 . 1 1 71 71 GLN C C 71 179.517 179.517 173.887 5.630 18995
1516 1 5 . 1 1 71 71 GLN CA C 71 60.100 60.100 56.971 3.128 18995
1517 1 5 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.617 0.583 18995
1518 1 5 . 1 1 71 71 GLN H H 71 8.047 8.047 8.396 -0.349 18995
1519 1 5 . 1 1 72 72 GLU N N 72 123.228 123.228 115.683 7.545 18995
1520 1 5 . 1 1 72 72 GLU C C 72 179.337 179.337 175.010 4.327 18995
1521 1 5 . 1 1 72 72 GLU CA C 72 58.900 58.900 54.955 3.945 18995
1522 1 5 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.222 -2.922 18995
1523 1 5 . 1 1 72 72 GLU H H 72 9.061 9.061 7.224 1.837 18995
1524 1 5 . 1 1 73 73 PHE N N 73 123.155 123.155 118.954 4.201 18995
1525 1 5 . 1 1 73 73 PHE C C 73 176.497 176.497 175.600 0.897 18995
1526 1 5 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.196 3.604 18995
1527 1 5 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.445 -0.745 18995
1528 1 5 . 1 1 73 73 PHE H H 73 8.863 8.863 9.362 -0.499 18995
1529 1 5 . 1 1 74 74 MET N N 74 119.622 119.622 123.073 -3.451 18995
1530 1 5 . 1 1 74 74 MET C C 74 178.476 178.476 174.771 3.705 18995
1531 1 5 . 1 1 74 74 MET CA C 74 56.200 56.200 55.765 0.435 18995
1532 1 5 . 1 1 74 74 MET CB C 74 30.400 30.400 33.591 -3.191 18995
1533 1 5 . 1 1 74 74 MET H H 74 8.217 8.217 8.973 -0.756 18995
1534 1 5 . 1 1 75 75 ALA N N 75 123.073 123.073 128.210 -5.137 18995
1535 1 5 . 1 1 75 75 ALA C C 75 180.129 180.129 175.105 5.024 18995
1536 1 5 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.556 4.644 18995
1537 1 5 . 1 1 75 75 ALA H H 75 7.490 7.490 9.241 -1.751 18995
1538 1 5 . 1 1 76 76 PHE N N 76 122.171 122.171 122.227 -0.056 18995
1539 1 5 . 1 1 76 76 PHE C C 76 176.365 176.365 174.843 1.522 18995
1540 1 5 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.315 2.485 18995
1541 1 5 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.757 -4.157 18995
1542 1 5 . 1 1 76 76 PHE H H 76 7.676 7.676 8.294 -0.618 18995
1543 1 5 . 1 1 77 77 VAL N N 77 119.765 119.765 123.545 -3.780 18995
1544 1 5 . 1 1 77 77 VAL C C 77 179.175 179.175 177.784 1.391 18995
1545 1 5 . 1 1 77 77 VAL CA C 77 66.800 66.800 59.846 6.954 18995
1546 1 5 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.636 -1.436 18995
1547 1 5 . 1 1 77 77 VAL H H 77 8.498 8.498 8.622 -0.124 18995
1548 1 5 . 1 1 78 78 ALA N N 78 123.880 123.880 122.438 1.442 18995
1549 1 5 . 1 1 78 78 ALA C C 78 178.630 178.630 177.428 1.202 18995
1550 1 5 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.200 0.900 18995
1551 1 5 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.760 -0.460 18995
1552 1 5 . 1 1 78 78 ALA H H 78 8.193 8.193 8.760 -0.567 18995
1553 1 5 . 1 1 79 79 MET N N 79 120.537 120.537 114.533 6.004 18995
1554 1 5 . 1 1 79 79 MET C C 79 178.430 178.430 176.767 1.663 18995
1555 1 5 . 1 1 79 79 MET CA C 79 59.500 59.500 54.601 4.899 18995
1556 1 5 . 1 1 79 79 MET CB C 79 32.800 32.800 31.908 0.892 18995
1557 1 5 . 1 1 79 79 MET H H 79 7.883 7.883 7.726 0.157 18995
1558 1 5 . 1 1 80 80 VAL N N 80 120.374 120.374 120.071 0.303 18995
1559 1 5 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.952 4.248 18995
1560 1 5 . 1 1 80 80 VAL H H 80 8.299 8.299 8.007 0.292 18995
1561 1 5 . 1 1 82 82 THR C C 82 175.144 175.144 172.720 2.424 18995
1562 1 5 . 1 1 82 82 THR CA C 82 65.800 65.800 61.088 4.712 18995
1563 1 5 . 1 1 83 83 ALA N N 83 123.244 123.244 123.021 0.223 18995
1564 1 5 . 1 1 83 83 ALA C C 83 178.574 178.574 175.096 3.478 18995
1565 1 5 . 1 1 83 83 ALA CA C 83 53.900 53.900 50.239 3.662 18995
1566 1 5 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.899 -2.899 18995
1567 1 5 . 1 1 83 83 ALA H H 83 7.587 7.587 8.783 -1.196 18995
1568 1 5 . 1 1 84 84 CYS N N 84 116.910 116.910 116.799 0.111 18995
1569 1 5 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.367 2.433 18995
1570 1 5 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.705 -1.805 18995
1571 1 5 . 1 1 84 84 CYS H H 84 7.788 7.788 8.610 -0.822 18995
1572 1 5 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.655 0.945 18995
1573 1 5 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.265 -0.865 18995
1574 1 5 . 1 1 87 87 PHE N N 87 118.550 118.550 119.576 -1.026 18995
1575 1 5 . 1 1 87 87 PHE C C 87 175.597 175.597 174.649 0.948 18995
1576 1 5 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.540 1.560 18995
1577 1 5 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.335 -0.935 18995
1578 1 5 . 1 1 87 87 PHE H H 87 7.838 7.838 7.720 0.118 18995
1579 1 5 . 1 1 88 88 PHE N N 88 118.438 118.438 125.067 -6.629 18995
1580 1 5 . 1 1 88 88 PHE C C 88 175.241 175.241 176.110 -0.869 18995
1581 1 5 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.788 0.412 18995
1582 1 5 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.818 1.882 18995
1583 1 5 . 1 1 88 88 PHE H H 88 7.718 7.718 8.469 -0.751 18995
1584 1 5 . 1 1 89 89 GLU N N 89 121.366 121.366 126.609 -5.243 18995
1585 1 5 . 1 1 89 89 GLU C C 89 175.437 175.437 177.217 -1.780 18995
1586 1 5 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.331 2.269 18995
1587 1 5 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.346 -1.046 18995
1588 1 5 . 1 1 89 89 GLU H H 89 7.959 7.959 8.075 -0.116 18995
1589 1 5 . 1 1 90 90 HIS N N 90 120.349 120.349 115.980 4.369 18995
1590 1 5 . 1 1 90 90 HIS C C 90 173.652 173.652 175.457 -1.805 18995
1591 1 5 . 1 1 90 90 HIS CA C 90 55.800 55.800 57.869 -2.069 18995
1592 1 5 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.189 0.911 18995
1593 1 5 . 1 1 90 90 HIS H H 90 8.116 8.116 8.686 -0.570 18995
1594 1 5 . 1 1 91 91 GLU N N 91 127.965 127.965 117.558 10.407 18995
1595 1 5 . 1 1 91 91 GLU H H 91 8.235 8.235 7.559 0.676 18995
1596 1 6 . 1 1 20 20 ARG C C 20 177.097 177.097 174.777 2.320 18995
1597 1 6 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.598 4.502 18995
1598 1 6 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.921 0.079 18995
1599 1 6 . 1 1 21 21 GLU N N 21 116.519 116.519 121.018 -4.499 18995
1600 1 6 . 1 1 21 21 GLU C C 21 175.055 175.055 176.076 -1.021 18995
1601 1 6 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.821 0.779 18995
1602 1 6 . 1 1 21 21 GLU CB C 21 35.700 35.700 33.262 2.438 18995
1603 1 6 . 1 1 21 21 GLU H H 21 9.468 9.468 9.009 0.459 18995
1604 1 6 . 1 1 22 22 GLY N N 22 122.197 122.197 113.150 9.047 18995
1605 1 6 . 1 1 22 22 GLY C C 22 180.081 180.081 174.010 6.071 18995
1606 1 6 . 1 1 22 22 GLY H H 22 10.096 10.096 9.265 0.831 18995
1607 1 6 . 1 1 23 23 ASP N N 23 113.764 113.764 126.345 -12.581 18995
1608 1 6 . 1 1 23 23 ASP C C 23 178.957 178.957 175.308 3.649 18995
1609 1 6 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.561 1.939 18995
1610 1 6 . 1 1 23 23 ASP H H 23 8.115 8.115 9.285 -1.170 18995
1611 1 6 . 1 1 24 24 LYS N N 24 131.954 131.954 128.073 3.881 18995
1612 1 6 . 1 1 24 24 LYS C C 24 176.539 176.539 175.287 1.252 18995
1613 1 6 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.071 3.129 18995
1614 1 6 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.670 -1.970 18995
1615 1 6 . 1 1 24 24 LYS H H 24 9.484 9.484 9.268 0.216 18995
1616 1 6 . 1 1 25 25 HIS N N 25 119.313 119.313 128.080 -8.767 18995
1617 1 6 . 1 1 25 25 HIS C C 25 172.815 172.815 174.369 -1.554 18995
1618 1 6 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.698 0.802 18995
1619 1 6 . 1 1 25 25 HIS CB C 25 30.800 30.800 32.206 -1.406 18995
1620 1 6 . 1 1 25 25 HIS H H 25 9.589 9.589 8.899 0.690 18995
1621 1 6 . 1 1 26 26 LYS N N 26 115.394 115.394 125.989 -10.595 18995
1622 1 6 . 1 1 26 26 LYS C C 26 174.608 174.608 175.144 -0.536 18995
1623 1 6 . 1 1 26 26 LYS CA C 26 55.400 55.400 55.884 -0.484 18995
1624 1 6 . 1 1 26 26 LYS CB C 26 39.100 39.100 31.897 7.203 18995
1625 1 6 . 1 1 26 26 LYS H H 26 7.095 7.095 8.265 -1.170 18995
1626 1 6 . 1 1 27 27 LEU N N 27 126.263 126.263 120.781 5.482 18995
1627 1 6 . 1 1 27 27 LEU C C 27 175.637 175.637 176.221 -0.584 18995
1628 1 6 . 1 1 27 27 LEU CA C 27 52.800 52.800 53.717 -0.917 18995
1629 1 6 . 1 1 27 27 LEU CB C 27 43.700 43.700 41.717 1.983 18995
1630 1 6 . 1 1 27 27 LEU H H 27 9.595 9.595 6.968 2.627 18995
1631 1 6 . 1 1 28 28 LYS N N 28 124.436 124.436 123.526 0.910 18995
1632 1 6 . 1 1 28 28 LYS C C 28 177.395 177.395 175.876 1.519 18995
1633 1 6 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.217 -1.017 18995
1634 1 6 . 1 1 28 28 LYS H H 28 9.711 9.711 8.224 1.487 18995
1635 1 6 . 1 1 29 29 LYS N N 29 121.980 121.980 119.349 2.631 18995
1636 1 6 . 1 1 29 29 LYS C C 29 177.400 177.400 174.593 2.807 18995
1637 1 6 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.772 6.928 18995
1638 1 6 . 1 1 29 29 LYS H H 29 9.084 9.084 7.321 1.763 18995
1639 1 6 . 1 1 30 30 SER N N 30 111.519 111.519 112.883 -1.364 18995
1640 1 6 . 1 1 30 30 SER C C 30 176.950 176.950 172.916 4.034 18995
1641 1 6 . 1 1 30 30 SER CA C 30 61.100 61.100 56.158 4.942 18995
1642 1 6 . 1 1 30 30 SER CB C 30 61.300 61.300 65.815 -4.515 18995
1643 1 6 . 1 1 30 30 SER H H 30 8.267 8.267 7.004 1.263 18995
1644 1 6 . 1 1 31 31 GLU N N 31 123.792 123.792 119.688 4.104 18995
1645 1 6 . 1 1 31 31 GLU C C 31 179.463 179.463 176.869 2.594 18995
1646 1 6 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.314 4.786 18995
1647 1 6 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.403 -2.203 18995
1648 1 6 . 1 1 31 31 GLU H H 31 6.603 6.603 9.547 -2.944 18995
1649 1 6 . 1 1 32 32 LEU N N 32 121.954 121.954 124.888 -2.934 18995
1650 1 6 . 1 1 32 32 LEU C C 32 176.995 176.995 175.709 1.286 18995
1651 1 6 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.310 2.590 18995
1652 1 6 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.100 0.200 18995
1653 1 6 . 1 1 32 32 LEU H H 32 8.936 8.936 9.006 -0.070 18995
1654 1 6 . 1 1 33 33 LYS N N 33 118.576 118.576 128.630 -10.054 18995
1655 1 6 . 1 1 33 33 LYS C C 33 176.714 176.714 175.151 1.563 18995
1656 1 6 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.926 5.574 18995
1657 1 6 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.163 -1.263 18995
1658 1 6 . 1 1 33 33 LYS H H 33 8.390 8.390 9.183 -0.793 18995
1659 1 6 . 1 1 34 34 GLU N N 34 116.152 116.152 128.012 -11.860 18995
1660 1 6 . 1 1 34 34 GLU C C 34 177.689 177.689 175.451 2.238 18995
1661 1 6 . 1 1 34 34 GLU CA C 34 59.400 59.400 56.052 3.348 18995
1662 1 6 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.817 -1.417 18995
1663 1 6 . 1 1 34 34 GLU H H 34 7.326 7.326 8.243 -0.917 18995
1664 1 6 . 1 1 35 35 LEU N N 35 123.632 123.632 126.855 -3.223 18995
1665 1 6 . 1 1 35 35 LEU C C 35 178.845 178.845 176.410 2.435 18995
1666 1 6 . 1 1 35 35 LEU CA C 35 59.800 59.800 51.642 8.158 18995
1667 1 6 . 1 1 35 35 LEU CB C 35 42.000 42.000 42.974 -0.974 18995
1668 1 6 . 1 1 35 35 LEU H H 35 7.978 7.978 8.689 -0.711 18995
1669 1 6 . 1 1 36 36 ILE C C 36 178.328 178.328 176.007 2.321 18995
1670 1 6 . 1 1 36 36 ILE CA C 36 66.300 66.300 62.739 3.561 18995
1671 1 6 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.334 0.366 18995
1672 1 6 . 1 1 37 37 ASN N N 37 118.242 118.242 113.324 4.918 18995
1673 1 6 . 1 1 37 37 ASN C C 37 177.052 177.052 176.744 0.308 18995
1674 1 6 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.145 1.655 18995
1675 1 6 . 1 1 37 37 ASN CB C 37 37.500 37.500 37.868 -0.368 18995
1676 1 6 . 1 1 37 37 ASN H H 37 8.336 8.336 8.471 -0.135 18995
1677 1 6 . 1 1 38 38 ASN N N 38 114.845 114.845 119.181 -4.336 18995
1678 1 6 . 1 1 38 38 ASN C C 38 176.578 176.578 174.547 2.031 18995
1679 1 6 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.867 2.333 18995
1680 1 6 . 1 1 38 38 ASN H H 38 8.213 8.213 7.955 0.258 18995
1681 1 6 . 1 1 39 39 GLU N N 39 113.797 113.797 120.791 -6.994 18995
1682 1 6 . 1 1 39 39 GLU C C 39 177.689 177.689 174.251 3.438 18995
1683 1 6 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.320 -1.120 18995
1684 1 6 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.374 -0.074 18995
1685 1 6 . 1 1 39 39 GLU H H 39 8.522 8.522 8.477 0.045 18995
1686 1 6 . 1 1 40 40 LEU N N 40 119.982 119.982 121.992 -2.010 18995
1687 1 6 . 1 1 40 40 LEU C C 40 177.212 177.212 175.450 1.762 18995
1688 1 6 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.049 1.051 18995
1689 1 6 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.336 -1.636 18995
1690 1 6 . 1 1 40 40 LEU H H 40 7.552 7.552 8.425 -0.873 18995
1691 1 6 . 1 1 41 41 SER N N 41 114.635 114.635 119.383 -4.748 18995
1692 1 6 . 1 1 41 41 SER C C 41 175.688 175.688 172.642 3.046 18995
1693 1 6 . 1 1 41 41 SER CA C 41 60.800 60.800 57.031 3.769 18995
1694 1 6 . 1 1 41 41 SER CB C 41 64.100 64.100 66.936 -2.836 18995
1695 1 6 . 1 1 41 41 SER H H 41 7.592 7.592 8.967 -1.375 18995
1696 1 6 . 1 1 42 42 HIS N N 42 122.397 122.397 115.921 6.476 18995
1697 1 6 . 1 1 42 42 HIS C C 42 175.523 175.523 172.914 2.609 18995
1698 1 6 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.307 3.393 18995
1699 1 6 . 1 1 42 42 HIS H H 42 10.406 10.406 8.361 2.045 18995
1700 1 6 . 1 1 43 43 PHE N N 43 117.618 117.618 123.292 -5.674 18995
1701 1 6 . 1 1 43 43 PHE C C 43 177.431 177.431 175.958 1.473 18995
1702 1 6 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.536 3.264 18995
1703 1 6 . 1 1 43 43 PHE H H 43 7.785 7.785 8.426 -0.641 18995
1704 1 6 . 1 1 44 44 LEU N N 44 120.185 120.185 125.666 -5.481 18995
1705 1 6 . 1 1 44 44 LEU C C 44 175.829 175.829 176.269 -0.440 18995
1706 1 6 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.427 -2.627 18995
1707 1 6 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.763 2.237 18995
1708 1 6 . 1 1 44 44 LEU H H 44 8.533 8.533 8.835 -0.302 18995
1709 1 6 . 1 1 45 45 GLU N N 45 121.499 121.499 118.934 2.565 18995
1710 1 6 . 1 1 45 45 GLU C C 45 175.060 175.060 177.467 -2.407 18995
1711 1 6 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.790 -0.190 18995
1712 1 6 . 1 1 45 45 GLU CB C 45 30.600 30.600 28.170 2.430 18995
1713 1 6 . 1 1 45 45 GLU H H 45 8.130 8.130 8.235 -0.105 18995
1714 1 6 . 1 1 46 46 GLU N N 46 122.480 122.480 125.149 -2.669 18995
1715 1 6 . 1 1 46 46 GLU C C 46 176.861 176.861 176.206 0.655 18995
1716 1 6 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.617 -0.817 18995
1717 1 6 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.233 1.467 18995
1718 1 6 . 1 1 46 46 GLU H H 46 8.123 8.123 8.367 -0.244 18995
1719 1 6 . 1 1 47 47 ILE N N 47 127.680 127.680 118.325 9.355 18995
1720 1 6 . 1 1 47 47 ILE C C 47 175.931 175.931 175.599 0.332 18995
1721 1 6 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.073 1.027 18995
1722 1 6 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.846 0.754 18995
1723 1 6 . 1 1 47 47 ILE H H 47 9.897 9.897 7.720 2.177 18995
1724 1 6 . 1 1 48 48 LYS N N 48 126.846 126.846 124.449 2.397 18995
1725 1 6 . 1 1 48 48 LYS C C 48 175.896 175.896 175.966 -0.070 18995
1726 1 6 . 1 1 48 48 LYS CA C 48 56.600 56.600 53.965 2.635 18995
1727 1 6 . 1 1 48 48 LYS CB C 48 34.700 34.700 34.403 0.297 18995
1728 1 6 . 1 1 48 48 LYS H H 48 9.077 9.077 7.448 1.629 18995
1729 1 6 . 1 1 49 49 GLU C C 49 179.470 179.470 176.779 2.691 18995
1730 1 6 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.458 -1.857 18995
1731 1 6 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.648 2.152 18995
1732 1 6 . 1 1 50 50 GLN N N 50 125.850 125.850 119.001 6.849 18995
1733 1 6 . 1 1 50 50 GLN C C 50 176.883 176.883 176.878 0.005 18995
1734 1 6 . 1 1 50 50 GLN CA C 50 58.500 58.500 58.720 -0.220 18995
1735 1 6 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.844 -0.444 18995
1736 1 6 . 1 1 50 50 GLN H H 50 9.041 9.041 8.835 0.206 18995
1737 1 6 . 1 1 51 51 GLU N N 51 117.404 117.404 112.253 5.151 18995
1738 1 6 . 1 1 51 51 GLU C C 51 178.262 178.262 175.665 2.597 18995
1739 1 6 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.650 4.050 18995
1740 1 6 . 1 1 51 51 GLU CB C 51 29.300 29.300 29.944 -0.644 18995
1741 1 6 . 1 1 51 51 GLU H H 51 9.352 9.352 7.476 1.876 18995
1742 1 6 . 1 1 52 52 VAL N N 52 118.888 118.888 122.713 -3.825 18995
1743 1 6 . 1 1 52 52 VAL C C 52 177.677 177.677 174.623 3.054 18995
1744 1 6 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.573 4.527 18995
1745 1 6 . 1 1 52 52 VAL CB C 52 31.700 31.700 31.028 0.672 18995
1746 1 6 . 1 1 52 52 VAL H H 52 7.247 7.247 7.318 -0.071 18995
1747 1 6 . 1 1 53 53 VAL N N 53 119.906 119.906 123.535 -3.629 18995
1748 1 6 . 1 1 53 53 VAL C C 53 176.742 176.742 175.107 1.635 18995
1749 1 6 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.763 5.437 18995
1750 1 6 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.264 -2.664 18995
1751 1 6 . 1 1 53 53 VAL H H 53 7.264 7.264 8.067 -0.803 18995
1752 1 6 . 1 1 54 54 ASP N N 54 121.483 121.483 120.846 0.637 18995
1753 1 6 . 1 1 54 54 ASP C C 54 178.291 178.291 174.555 3.736 18995
1754 1 6 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.278 5.922 18995
1755 1 6 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.080 -4.080 18995
1756 1 6 . 1 1 54 54 ASP H H 54 8.524 8.524 9.073 -0.549 18995
1757 1 6 . 1 1 55 55 LYS N N 55 120.875 120.875 127.941 -7.066 18995
1758 1 6 . 1 1 55 55 LYS C C 55 179.054 179.054 176.216 2.838 18995
1759 1 6 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.461 3.439 18995
1760 1 6 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.111 0.089 18995
1761 1 6 . 1 1 55 55 LYS H H 55 7.580 7.580 8.899 -1.319 18995
1762 1 6 . 1 1 56 56 VAL N N 56 121.960 121.960 123.646 -1.686 18995
1763 1 6 . 1 1 56 56 VAL C C 56 178.221 178.221 175.235 2.986 18995
1764 1 6 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.378 5.622 18995
1765 1 6 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.469 -1.769 18995
1766 1 6 . 1 1 56 56 VAL H H 56 8.279 8.279 8.557 -0.278 18995
1767 1 6 . 1 1 57 57 MET N N 57 118.815 118.815 126.770 -7.955 18995
1768 1 6 . 1 1 57 57 MET C C 57 176.888 176.888 175.334 1.554 18995
1769 1 6 . 1 1 57 57 MET CA C 57 57.900 57.900 54.959 2.941 18995
1770 1 6 . 1 1 57 57 MET CB C 57 32.900 32.900 33.002 -0.102 18995
1771 1 6 . 1 1 57 57 MET H H 57 8.467 8.467 8.984 -0.517 18995
1772 1 6 . 1 1 58 58 GLU N N 58 117.894 117.894 125.349 -7.455 18995
1773 1 6 . 1 1 58 58 GLU C C 58 178.510 178.510 176.389 2.121 18995
1774 1 6 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.148 2.252 18995
1775 1 6 . 1 1 58 58 GLU CB C 58 29.800 29.800 31.166 -1.366 18995
1776 1 6 . 1 1 58 58 GLU H H 58 8.073 8.073 8.896 -0.823 18995
1777 1 6 . 1 1 59 59 THR N N 59 113.244 113.244 112.955 0.289 18995
1778 1 6 . 1 1 59 59 THR C C 59 174.778 174.778 172.726 2.052 18995
1779 1 6 . 1 1 59 59 THR CA C 59 65.600 65.600 60.026 5.574 18995
1780 1 6 . 1 1 59 59 THR CB C 59 69.600 69.600 71.374 -1.774 18995
1781 1 6 . 1 1 59 59 THR H H 59 7.739 7.739 7.549 0.190 18995
1782 1 6 . 1 1 60 60 LEU N N 60 119.636 119.636 123.339 -3.703 18995
1783 1 6 . 1 1 60 60 LEU C C 60 177.561 177.561 177.278 0.283 18995
1784 1 6 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.479 -0.879 18995
1785 1 6 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.033 2.267 18995
1786 1 6 . 1 1 60 60 LEU H H 60 7.643 7.643 8.682 -1.039 18995
1787 1 6 . 1 1 61 61 ASP N N 61 117.424 117.424 124.794 -7.370 18995
1788 1 6 . 1 1 61 61 ASP C C 61 175.915 175.915 174.621 1.294 18995
1789 1 6 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.849 0.751 18995
1790 1 6 . 1 1 61 61 ASP H H 61 7.984 7.984 8.605 -0.621 18995
1791 1 6 . 1 1 62 62 ASN N N 62 127.650 127.650 121.933 5.717 18995
1792 1 6 . 1 1 62 62 ASN C C 62 175.905 175.905 174.465 1.440 18995
1793 1 6 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.745 2.155 18995
1794 1 6 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.796 0.604 18995
1795 1 6 . 1 1 62 62 ASN H H 62 9.032 9.032 8.101 0.931 18995
1796 1 6 . 1 1 63 63 ASP N N 63 116.676 116.676 122.841 -6.165 18995
1797 1 6 . 1 1 63 63 ASP C C 63 177.604 177.604 174.991 2.613 18995
1798 1 6 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.909 2.491 18995
1799 1 6 . 1 1 63 63 ASP CB C 63 40.200 40.200 44.940 -4.739 18995
1800 1 6 . 1 1 63 63 ASP H H 63 8.302 8.302 9.675 -1.373 18995
1801 1 6 . 1 1 64 64 GLY N N 64 109.334 109.334 111.569 -2.235 18995
1802 1 6 . 1 1 64 64 GLY C C 64 174.834 174.834 174.647 0.187 18995
1803 1 6 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.698 4.002 18995
1804 1 6 . 1 1 64 64 GLY H H 64 7.681 7.681 9.233 -1.552 18995
1805 1 6 . 1 1 65 65 ASP N N 65 120.960 120.960 127.473 -6.513 18995
1806 1 6 . 1 1 65 65 ASP C C 65 177.010 177.010 174.603 2.407 18995
1807 1 6 . 1 1 65 65 ASP CA C 65 53.800 53.800 53.998 -0.198 18995
1808 1 6 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.732 -0.432 18995
1809 1 6 . 1 1 65 65 ASP H H 65 8.386 8.386 9.252 -0.866 18995
1810 1 6 . 1 1 66 66 GLY N N 66 113.875 113.875 117.271 -3.396 18995
1811 1 6 . 1 1 66 66 GLY C C 66 172.343 172.343 174.029 -1.686 18995
1812 1 6 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.655 3.245 18995
1813 1 6 . 1 1 66 66 GLY H H 66 10.212 10.212 8.804 1.408 18995
1814 1 6 . 1 1 67 67 GLU N N 67 118.701 118.701 125.150 -6.449 18995
1815 1 6 . 1 1 67 67 GLU C C 67 174.711 174.711 176.229 -1.518 18995
1816 1 6 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.724 -0.524 18995
1817 1 6 . 1 1 67 67 GLU H H 67 7.949 7.949 8.807 -0.858 18995
1818 1 6 . 1 1 68 68 CYS N N 68 124.753 124.753 126.688 -1.935 18995
1819 1 6 . 1 1 68 68 CYS C C 68 174.411 174.411 176.708 -2.297 18995
1820 1 6 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.868 -5.869 18995
1821 1 6 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.918 0.183 18995
1822 1 6 . 1 1 68 68 CYS H H 68 9.486 9.486 8.952 0.534 18995
1823 1 6 . 1 1 69 69 ASP N N 69 132.376 132.376 119.796 12.580 18995
1824 1 6 . 1 1 69 69 ASP C C 69 175.307 175.307 174.721 0.586 18995
1825 1 6 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.334 -1.034 18995
1826 1 6 . 1 1 69 69 ASP CB C 69 40.600 40.600 39.273 1.327 18995
1827 1 6 . 1 1 69 69 ASP H H 69 9.911 9.911 8.512 1.399 18995
1828 1 6 . 1 1 70 70 PHE N N 70 119.131 119.131 119.949 -0.818 18995
1829 1 6 . 1 1 70 70 PHE C C 70 176.482 176.482 174.672 1.810 18995
1830 1 6 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.474 4.426 18995
1831 1 6 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.454 -1.354 18995
1832 1 6 . 1 1 70 70 PHE H H 70 9.075 9.075 8.170 0.905 18995
1833 1 6 . 1 1 71 71 GLN N N 71 119.323 119.323 119.211 0.112 18995
1834 1 6 . 1 1 71 71 GLN C C 71 179.517 179.517 173.832 5.685 18995
1835 1 6 . 1 1 71 71 GLN CA C 71 60.100 60.100 56.895 3.205 18995
1836 1 6 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.342 0.858 18995
1837 1 6 . 1 1 71 71 GLN H H 71 8.047 8.047 8.409 -0.362 18995
1838 1 6 . 1 1 72 72 GLU N N 72 123.228 123.228 115.807 7.421 18995
1839 1 6 . 1 1 72 72 GLU C C 72 179.337 179.337 174.921 4.416 18995
1840 1 6 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.047 3.853 18995
1841 1 6 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.647 -3.347 18995
1842 1 6 . 1 1 72 72 GLU H H 72 9.061 9.061 7.274 1.787 18995
1843 1 6 . 1 1 73 73 PHE N N 73 123.155 123.155 119.746 3.409 18995
1844 1 6 . 1 1 73 73 PHE C C 73 176.497 176.497 175.502 0.995 18995
1845 1 6 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.657 3.143 18995
1846 1 6 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.564 -0.864 18995
1847 1 6 . 1 1 73 73 PHE H H 73 8.863 8.863 9.352 -0.489 18995
1848 1 6 . 1 1 74 74 MET N N 74 119.622 119.622 123.186 -3.564 18995
1849 1 6 . 1 1 74 74 MET C C 74 178.476 178.476 174.715 3.761 18995
1850 1 6 . 1 1 74 74 MET CA C 74 56.200 56.200 55.806 0.394 18995
1851 1 6 . 1 1 74 74 MET CB C 74 30.400 30.400 33.623 -3.223 18995
1852 1 6 . 1 1 74 74 MET H H 74 8.217 8.217 9.092 -0.875 18995
1853 1 6 . 1 1 75 75 ALA N N 75 123.073 123.073 128.436 -5.363 18995
1854 1 6 . 1 1 75 75 ALA C C 75 180.129 180.129 175.174 4.955 18995
1855 1 6 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.372 4.828 18995
1856 1 6 . 1 1 75 75 ALA H H 75 7.490 7.490 9.329 -1.839 18995
1857 1 6 . 1 1 76 76 PHE N N 76 122.171 122.171 122.602 -0.431 18995
1858 1 6 . 1 1 76 76 PHE C C 76 176.365 176.365 175.078 1.287 18995
1859 1 6 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.238 2.562 18995
1860 1 6 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.782 -4.182 18995
1861 1 6 . 1 1 76 76 PHE H H 76 7.676 7.676 8.224 -0.548 18995
1862 1 6 . 1 1 77 77 VAL N N 77 119.765 119.765 124.359 -4.594 18995
1863 1 6 . 1 1 77 77 VAL C C 77 179.175 179.175 177.639 1.536 18995
1864 1 6 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.672 6.128 18995
1865 1 6 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.210 -1.010 18995
1866 1 6 . 1 1 77 77 VAL H H 77 8.498 8.498 8.617 -0.119 18995
1867 1 6 . 1 1 78 78 ALA N N 78 123.880 123.880 122.256 1.624 18995
1868 1 6 . 1 1 78 78 ALA C C 78 178.630 178.630 177.703 0.927 18995
1869 1 6 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.215 0.885 18995
1870 1 6 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.623 -0.323 18995
1871 1 6 . 1 1 78 78 ALA H H 78 8.193 8.193 8.757 -0.564 18995
1872 1 6 . 1 1 79 79 MET N N 79 120.537 120.537 114.042 6.495 18995
1873 1 6 . 1 1 79 79 MET C C 79 178.430 178.430 176.818 1.612 18995
1874 1 6 . 1 1 79 79 MET CA C 79 59.500 59.500 55.085 4.415 18995
1875 1 6 . 1 1 79 79 MET CB C 79 32.800 32.800 32.596 0.204 18995
1876 1 6 . 1 1 79 79 MET H H 79 7.883 7.883 8.013 -0.130 18995
1877 1 6 . 1 1 80 80 VAL N N 80 120.374 120.374 119.139 1.235 18995
1878 1 6 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.695 4.505 18995
1879 1 6 . 1 1 80 80 VAL H H 80 8.299 8.299 7.571 0.728 18995
1880 1 6 . 1 1 82 82 THR C C 82 175.144 175.144 172.343 2.801 18995
1881 1 6 . 1 1 82 82 THR CA C 82 65.800 65.800 61.066 4.734 18995
1882 1 6 . 1 1 83 83 ALA N N 83 123.244 123.244 123.134 0.110 18995
1883 1 6 . 1 1 83 83 ALA C C 83 178.574 178.574 175.171 3.403 18995
1884 1 6 . 1 1 83 83 ALA CA C 83 53.900 53.900 49.926 3.974 18995
1885 1 6 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.768 -2.768 18995
1886 1 6 . 1 1 83 83 ALA H H 83 7.587 7.587 8.673 -1.086 18995
1887 1 6 . 1 1 84 84 CYS N N 84 116.910 116.910 117.457 -0.547 18995
1888 1 6 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.133 2.667 18995
1889 1 6 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.221 -1.321 18995
1890 1 6 . 1 1 84 84 CYS H H 84 7.788 7.788 8.461 -0.673 18995
1891 1 6 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.307 1.293 18995
1892 1 6 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.247 -0.847 18995
1893 1 6 . 1 1 87 87 PHE N N 87 118.550 118.550 120.227 -1.677 18995
1894 1 6 . 1 1 87 87 PHE C C 87 175.597 175.597 174.592 1.005 18995
1895 1 6 . 1 1 87 87 PHE CA C 87 59.100 59.100 56.882 2.219 18995
1896 1 6 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.748 -1.347 18995
1897 1 6 . 1 1 87 87 PHE H H 87 7.838 7.838 7.713 0.125 18995
1898 1 6 . 1 1 88 88 PHE N N 88 118.438 118.438 127.244 -8.806 18995
1899 1 6 . 1 1 88 88 PHE C C 88 175.241 175.241 176.040 -0.799 18995
1900 1 6 . 1 1 88 88 PHE CA C 88 58.200 58.200 58.230 -0.030 18995
1901 1 6 . 1 1 88 88 PHE CB C 88 39.700 39.700 36.797 2.903 18995
1902 1 6 . 1 1 88 88 PHE H H 88 7.718 7.718 8.686 -0.968 18995
1903 1 6 . 1 1 89 89 GLU N N 89 121.366 121.366 126.245 -4.879 18995
1904 1 6 . 1 1 89 89 GLU C C 89 175.437 175.437 177.002 -1.565 18995
1905 1 6 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.377 2.223 18995
1906 1 6 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.191 -0.891 18995
1907 1 6 . 1 1 89 89 GLU H H 89 7.959 7.959 7.891 0.068 18995
1908 1 6 . 1 1 90 90 HIS N N 90 120.349 120.349 115.424 4.925 18995
1909 1 6 . 1 1 90 90 HIS C C 90 173.652 173.652 175.079 -1.427 18995
1910 1 6 . 1 1 90 90 HIS CA C 90 55.800 55.800 57.555 -1.755 18995
1911 1 6 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.222 0.878 18995
1912 1 6 . 1 1 90 90 HIS H H 90 8.116 8.116 8.632 -0.516 18995
1913 1 6 . 1 1 91 91 GLU N N 91 127.965 127.965 117.439 10.526 18995
1914 1 6 . 1 1 91 91 GLU H H 91 8.235 8.235 7.435 0.800 18995
1915 1 7 . 1 1 20 20 ARG C C 20 177.097 177.097 175.004 2.093 18995
1916 1 7 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.728 4.372 18995
1917 1 7 . 1 1 20 20 ARG CB C 20 31.000 31.000 31.038 -0.038 18995
1918 1 7 . 1 1 21 21 GLU N N 21 116.519 116.519 120.256 -3.737 18995
1919 1 7 . 1 1 21 21 GLU C C 21 175.055 175.055 176.128 -1.073 18995
1920 1 7 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.441 1.159 18995
1921 1 7 . 1 1 21 21 GLU CB C 21 35.700 35.700 33.334 2.366 18995
1922 1 7 . 1 1 21 21 GLU H H 21 9.468 9.468 9.120 0.348 18995
1923 1 7 . 1 1 22 22 GLY N N 22 122.197 122.197 112.313 9.884 18995
1924 1 7 . 1 1 22 22 GLY C C 22 180.081 180.081 174.144 5.937 18995
1925 1 7 . 1 1 22 22 GLY H H 22 10.096 10.096 9.186 0.910 18995
1926 1 7 . 1 1 23 23 ASP N N 23 113.764 113.764 126.621 -12.857 18995
1927 1 7 . 1 1 23 23 ASP C C 23 178.957 178.957 175.474 3.483 18995
1928 1 7 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.656 1.844 18995
1929 1 7 . 1 1 23 23 ASP H H 23 8.115 8.115 9.267 -1.152 18995
1930 1 7 . 1 1 24 24 LYS N N 24 131.954 131.954 127.827 4.127 18995
1931 1 7 . 1 1 24 24 LYS C C 24 176.539 176.539 175.297 1.242 18995
1932 1 7 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.224 2.976 18995
1933 1 7 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.924 -2.224 18995
1934 1 7 . 1 1 24 24 LYS H H 24 9.484 9.484 9.004 0.480 18995
1935 1 7 . 1 1 25 25 HIS N N 25 119.313 119.313 128.358 -9.045 18995
1936 1 7 . 1 1 25 25 HIS C C 25 172.815 172.815 174.603 -1.788 18995
1937 1 7 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.494 1.006 18995
1938 1 7 . 1 1 25 25 HIS CB C 25 30.800 30.800 32.072 -1.272 18995
1939 1 7 . 1 1 25 25 HIS H H 25 9.589 9.589 8.641 0.948 18995
1940 1 7 . 1 1 26 26 LYS N N 26 115.394 115.394 126.022 -10.628 18995
1941 1 7 . 1 1 26 26 LYS C C 26 174.608 174.608 175.365 -0.757 18995
1942 1 7 . 1 1 26 26 LYS CA C 26 55.400 55.400 56.706 -1.306 18995
1943 1 7 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.039 7.061 18995
1944 1 7 . 1 1 26 26 LYS H H 26 7.095 7.095 8.057 -0.962 18995
1945 1 7 . 1 1 27 27 LEU N N 27 126.263 126.263 120.147 6.116 18995
1946 1 7 . 1 1 27 27 LEU C C 27 175.637 175.637 175.976 -0.339 18995
1947 1 7 . 1 1 27 27 LEU CA C 27 52.800 52.800 53.992 -1.192 18995
1948 1 7 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.430 1.270 18995
1949 1 7 . 1 1 27 27 LEU H H 27 9.595 9.595 7.084 2.511 18995
1950 1 7 . 1 1 28 28 LYS N N 28 124.436 124.436 124.400 0.036 18995
1951 1 7 . 1 1 28 28 LYS C C 28 177.395 177.395 175.932 1.463 18995
1952 1 7 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.209 -1.009 18995
1953 1 7 . 1 1 28 28 LYS H H 28 9.711 9.711 8.599 1.112 18995
1954 1 7 . 1 1 29 29 LYS N N 29 121.980 121.980 118.656 3.324 18995
1955 1 7 . 1 1 29 29 LYS C C 29 177.400 177.400 174.836 2.564 18995
1956 1 7 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.964 6.736 18995
1957 1 7 . 1 1 29 29 LYS H H 29 9.084 9.084 7.456 1.628 18995
1958 1 7 . 1 1 30 30 SER N N 30 111.519 111.519 113.182 -1.663 18995
1959 1 7 . 1 1 30 30 SER C C 30 176.950 176.950 173.196 3.754 18995
1960 1 7 . 1 1 30 30 SER CA C 30 61.100 61.100 56.573 4.527 18995
1961 1 7 . 1 1 30 30 SER CB C 30 61.300 61.300 65.252 -3.952 18995
1962 1 7 . 1 1 30 30 SER H H 30 8.267 8.267 7.223 1.044 18995
1963 1 7 . 1 1 31 31 GLU N N 31 123.792 123.792 120.214 3.578 18995
1964 1 7 . 1 1 31 31 GLU C C 31 179.463 179.463 176.841 2.622 18995
1965 1 7 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.405 4.695 18995
1966 1 7 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.645 -2.445 18995
1967 1 7 . 1 1 31 31 GLU H H 31 6.603 6.603 9.623 -3.020 18995
1968 1 7 . 1 1 32 32 LEU N N 32 121.954 121.954 124.828 -2.874 18995
1969 1 7 . 1 1 32 32 LEU C C 32 176.995 176.995 175.606 1.389 18995
1970 1 7 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.506 2.394 18995
1971 1 7 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.235 0.065 18995
1972 1 7 . 1 1 32 32 LEU H H 32 8.936 8.936 9.019 -0.083 18995
1973 1 7 . 1 1 33 33 LYS N N 33 118.576 118.576 128.569 -9.993 18995
1974 1 7 . 1 1 33 33 LYS C C 33 176.714 176.714 175.023 1.691 18995
1975 1 7 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.676 5.824 18995
1976 1 7 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.507 -1.607 18995
1977 1 7 . 1 1 33 33 LYS H H 33 8.390 8.390 9.319 -0.929 18995
1978 1 7 . 1 1 34 34 GLU N N 34 116.152 116.152 128.475 -12.323 18995
1979 1 7 . 1 1 34 34 GLU C C 34 177.689 177.689 175.723 1.966 18995
1980 1 7 . 1 1 34 34 GLU CA C 34 59.400 59.400 56.047 3.353 18995
1981 1 7 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.811 -1.411 18995
1982 1 7 . 1 1 34 34 GLU H H 34 7.326 7.326 8.013 -0.687 18995
1983 1 7 . 1 1 35 35 LEU N N 35 123.632 123.632 128.295 -4.663 18995
1984 1 7 . 1 1 35 35 LEU C C 35 178.845 178.845 176.303 2.542 18995
1985 1 7 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.767 7.033 18995
1986 1 7 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.178 -1.178 18995
1987 1 7 . 1 1 35 35 LEU H H 35 7.978 7.978 8.967 -0.989 18995
1988 1 7 . 1 1 36 36 ILE C C 36 178.328 178.328 176.181 2.147 18995
1989 1 7 . 1 1 36 36 ILE CA C 36 66.300 66.300 63.135 3.165 18995
1990 1 7 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.277 0.423 18995
1991 1 7 . 1 1 37 37 ASN N N 37 118.242 118.242 113.210 5.032 18995
1992 1 7 . 1 1 37 37 ASN C C 37 177.052 177.052 176.744 0.308 18995
1993 1 7 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.587 1.213 18995
1994 1 7 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.274 -0.774 18995
1995 1 7 . 1 1 37 37 ASN H H 37 8.336 8.336 8.491 -0.155 18995
1996 1 7 . 1 1 38 38 ASN N N 38 114.845 114.845 119.053 -4.208 18995
1997 1 7 . 1 1 38 38 ASN C C 38 176.578 176.578 174.497 2.081 18995
1998 1 7 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.746 2.454 18995
1999 1 7 . 1 1 38 38 ASN H H 38 8.213 8.213 8.181 0.032 18995
2000 1 7 . 1 1 39 39 GLU N N 39 113.797 113.797 121.129 -7.332 18995
2001 1 7 . 1 1 39 39 GLU C C 39 177.689 177.689 174.580 3.109 18995
2002 1 7 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.648 -1.448 18995
2003 1 7 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.055 0.245 18995
2004 1 7 . 1 1 39 39 GLU H H 39 8.522 8.522 8.219 0.303 18995
2005 1 7 . 1 1 40 40 LEU N N 40 119.982 119.982 122.983 -3.001 18995
2006 1 7 . 1 1 40 40 LEU C C 40 177.212 177.212 175.559 1.653 18995
2007 1 7 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.645 0.455 18995
2008 1 7 . 1 1 40 40 LEU CB C 40 42.700 42.700 43.946 -1.246 18995
2009 1 7 . 1 1 40 40 LEU H H 40 7.552 7.552 8.608 -1.056 18995
2010 1 7 . 1 1 41 41 SER N N 41 114.635 114.635 120.888 -6.253 18995
2011 1 7 . 1 1 41 41 SER C C 41 175.688 175.688 172.614 3.074 18995
2012 1 7 . 1 1 41 41 SER CA C 41 60.800 60.800 56.848 3.952 18995
2013 1 7 . 1 1 41 41 SER CB C 41 64.100 64.100 67.184 -3.084 18995
2014 1 7 . 1 1 41 41 SER H H 41 7.592 7.592 9.096 -1.504 18995
2015 1 7 . 1 1 42 42 HIS N N 42 122.397 122.397 115.606 6.791 18995
2016 1 7 . 1 1 42 42 HIS C C 42 175.523 175.523 172.564 2.959 18995
2017 1 7 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.196 3.504 18995
2018 1 7 . 1 1 42 42 HIS H H 42 10.406 10.406 8.278 2.128 18995
2019 1 7 . 1 1 43 43 PHE N N 43 117.618 117.618 121.787 -4.169 18995
2020 1 7 . 1 1 43 43 PHE C C 43 177.431 177.431 175.903 1.528 18995
2021 1 7 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.663 3.137 18995
2022 1 7 . 1 1 43 43 PHE H H 43 7.785 7.785 8.527 -0.742 18995
2023 1 7 . 1 1 44 44 LEU N N 44 120.185 120.185 127.091 -6.906 18995
2024 1 7 . 1 1 44 44 LEU C C 44 175.829 175.829 176.631 -0.802 18995
2025 1 7 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.886 -3.086 18995
2026 1 7 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.528 2.472 18995
2027 1 7 . 1 1 44 44 LEU H H 44 8.533 8.533 8.807 -0.274 18995
2028 1 7 . 1 1 45 45 GLU N N 45 121.499 121.499 120.451 1.048 18995
2029 1 7 . 1 1 45 45 GLU C C 45 175.060 175.060 177.384 -2.324 18995
2030 1 7 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.845 -0.245 18995
2031 1 7 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.257 1.343 18995
2032 1 7 . 1 1 45 45 GLU H H 45 8.130 8.130 8.506 -0.376 18995
2033 1 7 . 1 1 46 46 GLU N N 46 122.480 122.480 125.638 -3.158 18995
2034 1 7 . 1 1 46 46 GLU C C 46 176.861 176.861 176.110 0.751 18995
2035 1 7 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.373 -0.573 18995
2036 1 7 . 1 1 46 46 GLU CB C 46 30.700 30.700 28.974 1.726 18995
2037 1 7 . 1 1 46 46 GLU H H 46 8.123 8.123 8.683 -0.560 18995
2038 1 7 . 1 1 47 47 ILE N N 47 127.680 127.680 119.484 8.196 18995
2039 1 7 . 1 1 47 47 ILE C C 47 175.931 175.931 176.042 -0.111 18995
2040 1 7 . 1 1 47 47 ILE CA C 47 62.100 62.100 62.725 -0.625 18995
2041 1 7 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.832 0.768 18995
2042 1 7 . 1 1 47 47 ILE H H 47 9.897 9.897 7.803 2.094 18995
2043 1 7 . 1 1 48 48 LYS N N 48 126.846 126.846 123.160 3.686 18995
2044 1 7 . 1 1 48 48 LYS C C 48 175.896 175.896 175.568 0.328 18995
2045 1 7 . 1 1 48 48 LYS CA C 48 56.600 56.600 54.345 2.255 18995
2046 1 7 . 1 1 48 48 LYS CB C 48 34.700 34.700 33.917 0.783 18995
2047 1 7 . 1 1 48 48 LYS H H 48 9.077 9.077 7.375 1.702 18995
2048 1 7 . 1 1 49 49 GLU C C 49 179.470 179.470 176.743 2.727 18995
2049 1 7 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.155 -1.555 18995
2050 1 7 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.668 2.132 18995
2051 1 7 . 1 1 50 50 GLN N N 50 125.850 125.850 119.152 6.698 18995
2052 1 7 . 1 1 50 50 GLN C C 50 176.883 176.883 176.998 -0.115 18995
2053 1 7 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.736 0.764 18995
2054 1 7 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.287 0.113 18995
2055 1 7 . 1 1 50 50 GLN H H 50 9.041 9.041 8.900 0.141 18995
2056 1 7 . 1 1 51 51 GLU N N 51 117.404 117.404 112.285 5.119 18995
2057 1 7 . 1 1 51 51 GLU C C 51 178.262 178.262 175.806 2.456 18995
2058 1 7 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.605 4.095 18995
2059 1 7 . 1 1 51 51 GLU CB C 51 29.300 29.300 29.974 -0.673 18995
2060 1 7 . 1 1 51 51 GLU H H 51 9.352 9.352 7.365 1.987 18995
2061 1 7 . 1 1 52 52 VAL N N 52 118.888 118.888 122.694 -3.806 18995
2062 1 7 . 1 1 52 52 VAL C C 52 177.677 177.677 174.652 3.025 18995
2063 1 7 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.478 4.622 18995
2064 1 7 . 1 1 52 52 VAL CB C 52 31.700 31.700 30.731 0.969 18995
2065 1 7 . 1 1 52 52 VAL H H 52 7.247 7.247 7.325 -0.078 18995
2066 1 7 . 1 1 53 53 VAL N N 53 119.906 119.906 122.787 -2.881 18995
2067 1 7 . 1 1 53 53 VAL C C 53 176.742 176.742 175.201 1.541 18995
2068 1 7 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.754 5.446 18995
2069 1 7 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.068 -2.468 18995
2070 1 7 . 1 1 53 53 VAL H H 53 7.264 7.264 7.988 -0.724 18995
2071 1 7 . 1 1 54 54 ASP N N 54 121.483 121.483 120.121 1.362 18995
2072 1 7 . 1 1 54 54 ASP C C 54 178.291 178.291 174.607 3.684 18995
2073 1 7 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.272 5.928 18995
2074 1 7 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.261 -4.261 18995
2075 1 7 . 1 1 54 54 ASP H H 54 8.524 8.524 9.145 -0.621 18995
2076 1 7 . 1 1 55 55 LYS N N 55 120.875 120.875 127.643 -6.768 18995
2077 1 7 . 1 1 55 55 LYS C C 55 179.054 179.054 176.474 2.580 18995
2078 1 7 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.505 3.395 18995
2079 1 7 . 1 1 55 55 LYS CB C 55 32.200 32.200 31.846 0.354 18995
2080 1 7 . 1 1 55 55 LYS H H 55 7.580 7.580 8.846 -1.266 18995
2081 1 7 . 1 1 56 56 VAL N N 56 121.960 121.960 123.526 -1.566 18995
2082 1 7 . 1 1 56 56 VAL C C 56 178.221 178.221 175.045 3.176 18995
2083 1 7 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.749 5.251 18995
2084 1 7 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.884 -2.184 18995
2085 1 7 . 1 1 56 56 VAL H H 56 8.279 8.279 8.568 -0.289 18995
2086 1 7 . 1 1 57 57 MET N N 57 118.815 118.815 123.509 -4.694 18995
2087 1 7 . 1 1 57 57 MET C C 57 176.888 176.888 174.937 1.951 18995
2088 1 7 . 1 1 57 57 MET CA C 57 57.900 57.900 54.094 3.806 18995
2089 1 7 . 1 1 57 57 MET CB C 57 32.900 32.900 33.858 -0.958 18995
2090 1 7 . 1 1 57 57 MET H H 57 8.467 8.467 8.612 -0.145 18995
2091 1 7 . 1 1 58 58 GLU N N 58 117.894 117.894 124.854 -6.960 18995
2092 1 7 . 1 1 58 58 GLU C C 58 178.510 178.510 176.268 2.242 18995
2093 1 7 . 1 1 58 58 GLU CA C 58 59.400 59.400 56.893 2.507 18995
2094 1 7 . 1 1 58 58 GLU CB C 58 29.800 29.800 31.148 -1.348 18995
2095 1 7 . 1 1 58 58 GLU H H 58 8.073 8.073 8.791 -0.718 18995
2096 1 7 . 1 1 59 59 THR N N 59 113.244 113.244 113.288 -0.044 18995
2097 1 7 . 1 1 59 59 THR C C 59 174.778 174.778 172.843 1.935 18995
2098 1 7 . 1 1 59 59 THR CA C 59 65.600 65.600 59.792 5.808 18995
2099 1 7 . 1 1 59 59 THR CB C 59 69.600 69.600 70.775 -1.175 18995
2100 1 7 . 1 1 59 59 THR H H 59 7.739 7.739 7.484 0.255 18995
2101 1 7 . 1 1 60 60 LEU N N 60 119.636 119.636 123.487 -3.851 18995
2102 1 7 . 1 1 60 60 LEU C C 60 177.561 177.561 177.218 0.343 18995
2103 1 7 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.400 -0.800 18995
2104 1 7 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.039 2.261 18995
2105 1 7 . 1 1 60 60 LEU H H 60 7.643 7.643 8.647 -1.004 18995
2106 1 7 . 1 1 61 61 ASP N N 61 117.424 117.424 125.136 -7.712 18995
2107 1 7 . 1 1 61 61 ASP C C 61 175.915 175.915 174.397 1.518 18995
2108 1 7 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.736 0.864 18995
2109 1 7 . 1 1 61 61 ASP H H 61 7.984 7.984 8.543 -0.559 18995
2110 1 7 . 1 1 62 62 ASN N N 62 127.650 127.650 122.784 4.866 18995
2111 1 7 . 1 1 62 62 ASN C C 62 175.905 175.905 174.455 1.450 18995
2112 1 7 . 1 1 62 62 ASN CA C 62 54.900 54.900 53.008 1.892 18995
2113 1 7 . 1 1 62 62 ASN CB C 62 40.400 40.400 38.942 1.458 18995
2114 1 7 . 1 1 62 62 ASN H H 62 9.032 9.032 7.967 1.065 18995
2115 1 7 . 1 1 63 63 ASP N N 63 116.676 116.676 123.421 -6.745 18995
2116 1 7 . 1 1 63 63 ASP C C 63 177.604 177.604 174.860 2.744 18995
2117 1 7 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.677 2.723 18995
2118 1 7 . 1 1 63 63 ASP CB C 63 40.200 40.200 45.027 -4.827 18995
2119 1 7 . 1 1 63 63 ASP H H 63 8.302 8.302 9.629 -1.327 18995
2120 1 7 . 1 1 64 64 GLY N N 64 109.334 109.334 109.800 -0.466 18995
2121 1 7 . 1 1 64 64 GLY C C 64 174.834 174.834 174.255 0.579 18995
2122 1 7 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.700 4.000 18995
2123 1 7 . 1 1 64 64 GLY H H 64 7.681 7.681 9.046 -1.365 18995
2124 1 7 . 1 1 65 65 ASP N N 65 120.960 120.960 126.967 -6.007 18995
2125 1 7 . 1 1 65 65 ASP C C 65 177.010 177.010 174.551 2.459 18995
2126 1 7 . 1 1 65 65 ASP CA C 65 53.800 53.800 53.969 -0.169 18995
2127 1 7 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.861 -0.561 18995
2128 1 7 . 1 1 65 65 ASP H H 65 8.386 8.386 9.411 -1.025 18995
2129 1 7 . 1 1 66 66 GLY N N 66 113.875 113.875 117.440 -3.565 18995
2130 1 7 . 1 1 66 66 GLY C C 66 172.343 172.343 174.155 -1.812 18995
2131 1 7 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.802 3.098 18995
2132 1 7 . 1 1 66 66 GLY H H 66 10.212 10.212 9.018 1.194 18995
2133 1 7 . 1 1 67 67 GLU N N 67 118.701 118.701 125.659 -6.958 18995
2134 1 7 . 1 1 67 67 GLU C C 67 174.711 174.711 176.180 -1.469 18995
2135 1 7 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.898 -0.698 18995
2136 1 7 . 1 1 67 67 GLU H H 67 7.949 7.949 8.975 -1.026 18995
2137 1 7 . 1 1 68 68 CYS N N 68 124.753 124.753 126.679 -1.926 18995
2138 1 7 . 1 1 68 68 CYS C C 68 174.411 174.411 176.189 -1.778 18995
2139 1 7 . 1 1 68 68 CYS CA C 68 57.000 57.000 61.967 -4.967 18995
2140 1 7 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.850 0.250 18995
2141 1 7 . 1 1 68 68 CYS H H 68 9.486 9.486 8.609 0.877 18995
2142 1 7 . 1 1 69 69 ASP N N 69 132.376 132.376 117.130 15.246 18995
2143 1 7 . 1 1 69 69 ASP C C 69 175.307 175.307 176.213 -0.906 18995
2144 1 7 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.847 -1.547 18995
2145 1 7 . 1 1 69 69 ASP CB C 69 40.600 40.600 40.882 -0.282 18995
2146 1 7 . 1 1 69 69 ASP H H 69 9.911 9.911 8.361 1.550 18995
2147 1 7 . 1 1 70 70 PHE N N 70 119.131 119.131 119.790 -0.659 18995
2148 1 7 . 1 1 70 70 PHE C C 70 176.482 176.482 175.199 1.283 18995
2149 1 7 . 1 1 70 70 PHE CA C 70 62.900 62.900 57.951 4.949 18995
2150 1 7 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.906 -1.806 18995
2151 1 7 . 1 1 70 70 PHE H H 70 9.075 9.075 7.384 1.691 18995
2152 1 7 . 1 1 71 71 GLN N N 71 119.323 119.323 117.691 1.632 18995
2153 1 7 . 1 1 71 71 GLN C C 71 179.517 179.517 173.970 5.547 18995
2154 1 7 . 1 1 71 71 GLN CA C 71 60.100 60.100 57.002 3.098 18995
2155 1 7 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.582 0.618 18995
2156 1 7 . 1 1 71 71 GLN H H 71 8.047 8.047 8.475 -0.428 18995
2157 1 7 . 1 1 72 72 GLU N N 72 123.228 123.228 115.734 7.494 18995
2158 1 7 . 1 1 72 72 GLU C C 72 179.337 179.337 175.015 4.322 18995
2159 1 7 . 1 1 72 72 GLU CA C 72 58.900 58.900 54.941 3.958 18995
2160 1 7 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.188 -2.888 18995
2161 1 7 . 1 1 72 72 GLU H H 72 9.061 9.061 7.193 1.868 18995
2162 1 7 . 1 1 73 73 PHE N N 73 123.155 123.155 118.944 4.211 18995
2163 1 7 . 1 1 73 73 PHE C C 73 176.497 176.497 175.609 0.888 18995
2164 1 7 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.160 3.640 18995
2165 1 7 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.349 -0.649 18995
2166 1 7 . 1 1 73 73 PHE H H 73 8.863 8.863 9.409 -0.546 18995
2167 1 7 . 1 1 74 74 MET N N 74 119.622 119.622 123.197 -3.575 18995
2168 1 7 . 1 1 74 74 MET C C 74 178.476 178.476 174.828 3.648 18995
2169 1 7 . 1 1 74 74 MET CA C 74 56.200 56.200 56.081 0.119 18995
2170 1 7 . 1 1 74 74 MET CB C 74 30.400 30.400 33.411 -3.011 18995
2171 1 7 . 1 1 74 74 MET H H 74 8.217 8.217 9.060 -0.843 18995
2172 1 7 . 1 1 75 75 ALA N N 75 123.073 123.073 128.591 -5.518 18995
2173 1 7 . 1 1 75 75 ALA C C 75 180.129 180.129 175.230 4.899 18995
2174 1 7 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.385 4.815 18995
2175 1 7 . 1 1 75 75 ALA H H 75 7.490 7.490 9.276 -1.786 18995
2176 1 7 . 1 1 76 76 PHE N N 76 122.171 122.171 122.774 -0.603 18995
2177 1 7 . 1 1 76 76 PHE C C 76 176.365 176.365 174.907 1.458 18995
2178 1 7 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.123 2.677 18995
2179 1 7 . 1 1 76 76 PHE CB C 76 38.600 38.600 43.290 -4.690 18995
2180 1 7 . 1 1 76 76 PHE H H 76 7.676 7.676 8.383 -0.707 18995
2181 1 7 . 1 1 77 77 VAL N N 77 119.765 119.765 124.798 -5.033 18995
2182 1 7 . 1 1 77 77 VAL C C 77 179.175 179.175 177.528 1.647 18995
2183 1 7 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.578 6.222 18995
2184 1 7 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.321 -1.121 18995
2185 1 7 . 1 1 77 77 VAL H H 77 8.498 8.498 8.850 -0.352 18995
2186 1 7 . 1 1 78 78 ALA N N 78 123.880 123.880 122.578 1.302 18995
2187 1 7 . 1 1 78 78 ALA C C 78 178.630 178.630 177.312 1.318 18995
2188 1 7 . 1 1 78 78 ALA CA C 78 56.100 56.100 54.972 1.128 18995
2189 1 7 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.608 -0.308 18995
2190 1 7 . 1 1 78 78 ALA H H 78 8.193 8.193 8.793 -0.600 18995
2191 1 7 . 1 1 79 79 MET N N 79 120.537 120.537 113.957 6.580 18995
2192 1 7 . 1 1 79 79 MET C C 79 178.430 178.430 176.748 1.682 18995
2193 1 7 . 1 1 79 79 MET CA C 79 59.500 59.500 54.567 4.933 18995
2194 1 7 . 1 1 79 79 MET CB C 79 32.800 32.800 32.277 0.523 18995
2195 1 7 . 1 1 79 79 MET H H 79 7.883 7.883 7.739 0.144 18995
2196 1 7 . 1 1 80 80 VAL N N 80 120.374 120.374 119.517 0.857 18995
2197 1 7 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.599 4.601 18995
2198 1 7 . 1 1 80 80 VAL H H 80 8.299 8.299 7.859 0.440 18995
2199 1 7 . 1 1 82 82 THR C C 82 175.144 175.144 172.558 2.586 18995
2200 1 7 . 1 1 82 82 THR CA C 82 65.800 65.800 61.230 4.570 18995
2201 1 7 . 1 1 83 83 ALA N N 83 123.244 123.244 123.141 0.103 18995
2202 1 7 . 1 1 83 83 ALA C C 83 178.574 178.574 175.258 3.316 18995
2203 1 7 . 1 1 83 83 ALA CA C 83 53.900 53.900 49.906 3.994 18995
2204 1 7 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.750 -2.750 18995
2205 1 7 . 1 1 83 83 ALA H H 83 7.587 7.587 8.863 -1.276 18995
2206 1 7 . 1 1 84 84 CYS N N 84 116.910 116.910 117.026 -0.116 18995
2207 1 7 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.202 2.598 18995
2208 1 7 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.443 -1.543 18995
2209 1 7 . 1 1 84 84 CYS H H 84 7.788 7.788 8.432 -0.644 18995
2210 1 7 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.644 0.956 18995
2211 1 7 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.205 -0.805 18995
2212 1 7 . 1 1 87 87 PHE N N 87 118.550 118.550 119.322 -0.772 18995
2213 1 7 . 1 1 87 87 PHE C C 87 175.597 175.597 174.733 0.864 18995
2214 1 7 . 1 1 87 87 PHE CA C 87 59.100 59.100 56.711 2.389 18995
2215 1 7 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.757 -1.357 18995
2216 1 7 . 1 1 87 87 PHE H H 87 7.838 7.838 7.547 0.291 18995
2217 1 7 . 1 1 88 88 PHE N N 88 118.438 118.438 123.181 -4.743 18995
2218 1 7 . 1 1 88 88 PHE C C 88 175.241 175.241 175.466 -0.225 18995
2219 1 7 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.446 0.754 18995
2220 1 7 . 1 1 88 88 PHE CB C 88 39.700 39.700 36.842 2.858 18995
2221 1 7 . 1 1 88 88 PHE H H 88 7.718 7.718 8.373 -0.655 18995
2222 1 7 . 1 1 89 89 GLU N N 89 121.366 121.366 126.208 -4.842 18995
2223 1 7 . 1 1 89 89 GLU C C 89 175.437 175.437 177.482 -2.045 18995
2224 1 7 . 1 1 89 89 GLU CA C 89 56.600 56.600 55.282 1.318 18995
2225 1 7 . 1 1 89 89 GLU CB C 89 30.300 30.300 30.813 -0.513 18995
2226 1 7 . 1 1 89 89 GLU H H 89 7.959 7.959 7.720 0.239 18995
2227 1 7 . 1 1 90 90 HIS N N 90 120.349 120.349 118.593 1.756 18995
2228 1 7 . 1 1 90 90 HIS C C 90 173.652 173.652 176.012 -2.360 18995
2229 1 7 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.875 -3.075 18995
2230 1 7 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.213 0.887 18995
2231 1 7 . 1 1 90 90 HIS H H 90 8.116 8.116 8.865 -0.749 18995
2232 1 7 . 1 1 91 91 GLU N N 91 127.965 127.965 115.773 12.192 18995
2233 1 7 . 1 1 91 91 GLU H H 91 8.235 8.235 8.223 0.012 18995
2234 1 8 . 1 1 20 20 ARG C C 20 177.097 177.097 174.777 2.320 18995
2235 1 8 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.779 4.321 18995
2236 1 8 . 1 1 20 20 ARG CB C 20 31.000 31.000 31.227 -0.227 18995
2237 1 8 . 1 1 21 21 GLU N N 21 116.519 116.519 119.496 -2.977 18995
2238 1 8 . 1 1 21 21 GLU C C 21 175.055 175.055 175.597 -0.542 18995
2239 1 8 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.754 0.846 18995
2240 1 8 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.581 1.119 18995
2241 1 8 . 1 1 21 21 GLU H H 21 9.468 9.468 9.055 0.413 18995
2242 1 8 . 1 1 22 22 GLY N N 22 122.197 122.197 109.926 12.271 18995
2243 1 8 . 1 1 22 22 GLY C C 22 180.081 180.081 173.835 6.246 18995
2244 1 8 . 1 1 22 22 GLY H H 22 10.096 10.096 9.194 0.902 18995
2245 1 8 . 1 1 23 23 ASP N N 23 113.764 113.764 126.073 -12.309 18995
2246 1 8 . 1 1 23 23 ASP C C 23 178.957 178.957 175.331 3.626 18995
2247 1 8 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.339 2.162 18995
2248 1 8 . 1 1 23 23 ASP H H 23 8.115 8.115 9.303 -1.188 18995
2249 1 8 . 1 1 24 24 LYS N N 24 131.954 131.954 127.848 4.106 18995
2250 1 8 . 1 1 24 24 LYS C C 24 176.539 176.539 175.424 1.115 18995
2251 1 8 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.649 2.551 18995
2252 1 8 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.354 -1.654 18995
2253 1 8 . 1 1 24 24 LYS H H 24 9.484 9.484 9.183 0.301 18995
2254 1 8 . 1 1 25 25 HIS N N 25 119.313 119.313 128.090 -8.777 18995
2255 1 8 . 1 1 25 25 HIS C C 25 172.815 172.815 175.491 -2.676 18995
2256 1 8 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.467 1.034 18995
2257 1 8 . 1 1 25 25 HIS CB C 25 30.800 30.800 31.451 -0.651 18995
2258 1 8 . 1 1 25 25 HIS H H 25 9.589 9.589 8.899 0.690 18995
2259 1 8 . 1 1 26 26 LYS N N 26 115.394 115.394 129.721 -14.327 18995
2260 1 8 . 1 1 26 26 LYS C C 26 174.608 174.608 174.085 0.523 18995
2261 1 8 . 1 1 26 26 LYS CA C 26 55.400 55.400 55.858 -0.458 18995
2262 1 8 . 1 1 26 26 LYS CB C 26 39.100 39.100 30.064 9.036 18995
2263 1 8 . 1 1 26 26 LYS H H 26 7.095 7.095 8.273 -1.178 18995
2264 1 8 . 1 1 27 27 LEU N N 27 126.263 126.263 120.046 6.217 18995
2265 1 8 . 1 1 27 27 LEU C C 27 175.637 175.637 176.127 -0.490 18995
2266 1 8 . 1 1 27 27 LEU CA C 27 52.800 52.800 55.067 -2.267 18995
2267 1 8 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.811 0.889 18995
2268 1 8 . 1 1 27 27 LEU H H 27 9.595 9.595 7.265 2.330 18995
2269 1 8 . 1 1 28 28 LYS N N 28 124.436 124.436 123.528 0.908 18995
2270 1 8 . 1 1 28 28 LYS C C 28 177.395 177.395 176.177 1.218 18995
2271 1 8 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.469 -1.269 18995
2272 1 8 . 1 1 28 28 LYS H H 28 9.711 9.711 8.659 1.052 18995
2273 1 8 . 1 1 29 29 LYS N N 29 121.980 121.980 118.477 3.503 18995
2274 1 8 . 1 1 29 29 LYS C C 29 177.400 177.400 174.801 2.599 18995
2275 1 8 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.934 6.766 18995
2276 1 8 . 1 1 29 29 LYS H H 29 9.084 9.084 7.519 1.565 18995
2277 1 8 . 1 1 30 30 SER N N 30 111.519 111.519 113.109 -1.590 18995
2278 1 8 . 1 1 30 30 SER C C 30 176.950 176.950 173.015 3.935 18995
2279 1 8 . 1 1 30 30 SER CA C 30 61.100 61.100 56.142 4.958 18995
2280 1 8 . 1 1 30 30 SER CB C 30 61.300 61.300 65.903 -4.603 18995
2281 1 8 . 1 1 30 30 SER H H 30 8.267 8.267 7.122 1.145 18995
2282 1 8 . 1 1 31 31 GLU N N 31 123.792 123.792 119.826 3.966 18995
2283 1 8 . 1 1 31 31 GLU C C 31 179.463 179.463 176.727 2.736 18995
2284 1 8 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.420 4.680 18995
2285 1 8 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.620 -2.420 18995
2286 1 8 . 1 1 31 31 GLU H H 31 6.603 6.603 9.537 -2.934 18995
2287 1 8 . 1 1 32 32 LEU N N 32 121.954 121.954 124.926 -2.972 18995
2288 1 8 . 1 1 32 32 LEU C C 32 176.995 176.995 175.571 1.424 18995
2289 1 8 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.675 2.225 18995
2290 1 8 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.288 0.012 18995
2291 1 8 . 1 1 32 32 LEU H H 32 8.936 8.936 9.090 -0.154 18995
2292 1 8 . 1 1 33 33 LYS N N 33 118.576 118.576 128.621 -10.045 18995
2293 1 8 . 1 1 33 33 LYS C C 33 176.714 176.714 174.853 1.861 18995
2294 1 8 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.655 5.845 18995
2295 1 8 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.978 -2.078 18995
2296 1 8 . 1 1 33 33 LYS H H 33 8.390 8.390 9.352 -0.962 18995
2297 1 8 . 1 1 34 34 GLU N N 34 116.152 116.152 127.966 -11.814 18995
2298 1 8 . 1 1 34 34 GLU C C 34 177.689 177.689 175.074 2.615 18995
2299 1 8 . 1 1 34 34 GLU CA C 34 59.400 59.400 55.765 3.635 18995
2300 1 8 . 1 1 34 34 GLU CB C 34 29.400 29.400 31.145 -1.745 18995
2301 1 8 . 1 1 34 34 GLU H H 34 7.326 7.326 8.460 -1.134 18995
2302 1 8 . 1 1 35 35 LEU N N 35 123.632 123.632 127.479 -3.847 18995
2303 1 8 . 1 1 35 35 LEU C C 35 178.845 178.845 176.265 2.580 18995
2304 1 8 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.907 6.893 18995
2305 1 8 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.333 -1.333 18995
2306 1 8 . 1 1 35 35 LEU H H 35 7.978 7.978 8.919 -0.941 18995
2307 1 8 . 1 1 36 36 ILE C C 36 178.328 178.328 176.043 2.285 18995
2308 1 8 . 1 1 36 36 ILE CA C 36 66.300 66.300 63.161 3.139 18995
2309 1 8 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.273 0.427 18995
2310 1 8 . 1 1 37 37 ASN N N 37 118.242 118.242 113.026 5.216 18995
2311 1 8 . 1 1 37 37 ASN C C 37 177.052 177.052 176.662 0.390 18995
2312 1 8 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.565 1.235 18995
2313 1 8 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.209 -0.709 18995
2314 1 8 . 1 1 37 37 ASN H H 37 8.336 8.336 8.458 -0.122 18995
2315 1 8 . 1 1 38 38 ASN N N 38 114.845 114.845 118.812 -3.967 18995
2316 1 8 . 1 1 38 38 ASN C C 38 176.578 176.578 174.601 1.977 18995
2317 1 8 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.674 2.526 18995
2318 1 8 . 1 1 38 38 ASN H H 38 8.213 8.213 7.993 0.220 18995
2319 1 8 . 1 1 39 39 GLU N N 39 113.797 113.797 121.161 -7.364 18995
2320 1 8 . 1 1 39 39 GLU C C 39 177.689 177.689 174.599 3.090 18995
2321 1 8 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.998 -1.798 18995
2322 1 8 . 1 1 39 39 GLU CB C 39 31.300 31.300 30.970 0.330 18995
2323 1 8 . 1 1 39 39 GLU H H 39 8.522 8.522 8.303 0.219 18995
2324 1 8 . 1 1 40 40 LEU N N 40 119.982 119.982 123.064 -3.082 18995
2325 1 8 . 1 1 40 40 LEU C C 40 177.212 177.212 175.619 1.593 18995
2326 1 8 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.540 0.560 18995
2327 1 8 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.293 -1.593 18995
2328 1 8 . 1 1 40 40 LEU H H 40 7.552 7.552 8.579 -1.027 18995
2329 1 8 . 1 1 41 41 SER N N 41 114.635 114.635 120.549 -5.914 18995
2330 1 8 . 1 1 41 41 SER C C 41 175.688 175.688 172.391 3.297 18995
2331 1 8 . 1 1 41 41 SER CA C 41 60.800 60.800 56.848 3.952 18995
2332 1 8 . 1 1 41 41 SER CB C 41 64.100 64.100 66.640 -2.540 18995
2333 1 8 . 1 1 41 41 SER H H 41 7.592 7.592 9.174 -1.582 18995
2334 1 8 . 1 1 42 42 HIS N N 42 122.397 122.397 115.397 7.000 18995
2335 1 8 . 1 1 42 42 HIS C C 42 175.523 175.523 172.440 3.083 18995
2336 1 8 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.152 3.548 18995
2337 1 8 . 1 1 42 42 HIS H H 42 10.406 10.406 8.131 2.275 18995
2338 1 8 . 1 1 43 43 PHE N N 43 117.618 117.618 120.766 -3.148 18995
2339 1 8 . 1 1 43 43 PHE C C 43 177.431 177.431 176.081 1.350 18995
2340 1 8 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.456 3.344 18995
2341 1 8 . 1 1 43 43 PHE H H 43 7.785 7.785 8.497 -0.712 18995
2342 1 8 . 1 1 44 44 LEU N N 44 120.185 120.185 126.834 -6.649 18995
2343 1 8 . 1 1 44 44 LEU C C 44 175.829 175.829 176.585 -0.756 18995
2344 1 8 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.805 -3.005 18995
2345 1 8 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.396 2.604 18995
2346 1 8 . 1 1 44 44 LEU H H 44 8.533 8.533 8.796 -0.263 18995
2347 1 8 . 1 1 45 45 GLU N N 45 121.499 121.499 119.795 1.704 18995
2348 1 8 . 1 1 45 45 GLU C C 45 175.060 175.060 177.422 -2.362 18995
2349 1 8 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.824 -0.224 18995
2350 1 8 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.530 1.070 18995
2351 1 8 . 1 1 45 45 GLU H H 45 8.130 8.130 8.325 -0.195 18995
2352 1 8 . 1 1 46 46 GLU N N 46 122.480 122.480 123.991 -1.511 18995
2353 1 8 . 1 1 46 46 GLU C C 46 176.861 176.861 175.810 1.051 18995
2354 1 8 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.021 -0.221 18995
2355 1 8 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.015 1.685 18995
2356 1 8 . 1 1 46 46 GLU H H 46 8.123 8.123 8.533 -0.410 18995
2357 1 8 . 1 1 47 47 ILE N N 47 127.680 127.680 118.515 9.165 18995
2358 1 8 . 1 1 47 47 ILE C C 47 175.931 175.931 175.598 0.333 18995
2359 1 8 . 1 1 47 47 ILE CA C 47 62.100 62.100 60.700 1.400 18995
2360 1 8 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.996 0.604 18995
2361 1 8 . 1 1 47 47 ILE H H 47 9.897 9.897 7.715 2.182 18995
2362 1 8 . 1 1 48 48 LYS N N 48 126.846 126.846 124.721 2.125 18995
2363 1 8 . 1 1 48 48 LYS C C 48 175.896 175.896 175.875 0.021 18995
2364 1 8 . 1 1 48 48 LYS CA C 48 56.600 56.600 53.832 2.768 18995
2365 1 8 . 1 1 48 48 LYS CB C 48 34.700 34.700 34.287 0.413 18995
2366 1 8 . 1 1 48 48 LYS H H 48 9.077 9.077 7.512 1.565 18995
2367 1 8 . 1 1 49 49 GLU C C 49 179.470 179.470 175.951 3.519 18995
2368 1 8 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.183 -1.583 18995
2369 1 8 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.643 2.157 18995
2370 1 8 . 1 1 50 50 GLN N N 50 125.850 125.850 117.055 8.795 18995
2371 1 8 . 1 1 50 50 GLN C C 50 176.883 176.883 176.614 0.269 18995
2372 1 8 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.462 1.038 18995
2373 1 8 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.813 -0.413 18995
2374 1 8 . 1 1 50 50 GLN H H 50 9.041 9.041 8.807 0.234 18995
2375 1 8 . 1 1 51 51 GLU N N 51 117.404 117.404 112.570 4.834 18995
2376 1 8 . 1 1 51 51 GLU C C 51 178.262 178.262 175.201 3.061 18995
2377 1 8 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.605 4.095 18995
2378 1 8 . 1 1 51 51 GLU CB C 51 29.300 29.300 30.030 -0.730 18995
2379 1 8 . 1 1 51 51 GLU H H 51 9.352 9.352 7.457 1.895 18995
2380 1 8 . 1 1 52 52 VAL N N 52 118.888 118.888 121.987 -3.099 18995
2381 1 8 . 1 1 52 52 VAL C C 52 177.677 177.677 174.620 3.057 18995
2382 1 8 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.674 4.426 18995
2383 1 8 . 1 1 52 52 VAL CB C 52 31.700 31.700 31.135 0.565 18995
2384 1 8 . 1 1 52 52 VAL H H 52 7.247 7.247 7.221 0.026 18995
2385 1 8 . 1 1 53 53 VAL N N 53 119.906 119.906 123.913 -4.007 18995
2386 1 8 . 1 1 53 53 VAL C C 53 176.742 176.742 174.897 1.845 18995
2387 1 8 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.694 5.506 18995
2388 1 8 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.456 -2.856 18995
2389 1 8 . 1 1 53 53 VAL H H 53 7.264 7.264 8.502 -1.238 18995
2390 1 8 . 1 1 54 54 ASP N N 54 121.483 121.483 121.507 -0.024 18995
2391 1 8 . 1 1 54 54 ASP C C 54 178.291 178.291 174.476 3.815 18995
2392 1 8 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.322 5.878 18995
2393 1 8 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.130 -4.130 18995
2394 1 8 . 1 1 54 54 ASP H H 54 8.524 8.524 9.104 -0.580 18995
2395 1 8 . 1 1 55 55 LYS N N 55 120.875 120.875 127.731 -6.856 18995
2396 1 8 . 1 1 55 55 LYS C C 55 179.054 179.054 176.343 2.711 18995
2397 1 8 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.580 3.320 18995
2398 1 8 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.897 -0.697 18995
2399 1 8 . 1 1 55 55 LYS H H 55 7.580 7.580 8.829 -1.249 18995
2400 1 8 . 1 1 56 56 VAL N N 56 121.960 121.960 124.366 -2.406 18995
2401 1 8 . 1 1 56 56 VAL C C 56 178.221 178.221 174.964 3.257 18995
2402 1 8 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.153 5.847 18995
2403 1 8 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.563 -1.863 18995
2404 1 8 . 1 1 56 56 VAL H H 56 8.279 8.279 8.763 -0.484 18995
2405 1 8 . 1 1 57 57 MET N N 57 118.815 118.815 126.041 -7.226 18995
2406 1 8 . 1 1 57 57 MET C C 57 176.888 176.888 175.318 1.570 18995
2407 1 8 . 1 1 57 57 MET CA C 57 57.900 57.900 54.273 3.627 18995
2408 1 8 . 1 1 57 57 MET CB C 57 32.900 32.900 33.182 -0.282 18995
2409 1 8 . 1 1 57 57 MET H H 57 8.467 8.467 8.948 -0.481 18995
2410 1 8 . 1 1 58 58 GLU N N 58 117.894 117.894 125.812 -7.918 18995
2411 1 8 . 1 1 58 58 GLU C C 58 178.510 178.510 176.435 2.075 18995
2412 1 8 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.284 2.116 18995
2413 1 8 . 1 1 58 58 GLU CB C 58 29.800 29.800 30.745 -0.945 18995
2414 1 8 . 1 1 58 58 GLU H H 58 8.073 8.073 8.792 -0.719 18995
2415 1 8 . 1 1 59 59 THR N N 59 113.244 113.244 113.076 0.168 18995
2416 1 8 . 1 1 59 59 THR C C 59 174.778 174.778 172.869 1.909 18995
2417 1 8 . 1 1 59 59 THR CA C 59 65.600 65.600 59.843 5.757 18995
2418 1 8 . 1 1 59 59 THR CB C 59 69.600 69.600 70.858 -1.258 18995
2419 1 8 . 1 1 59 59 THR H H 59 7.739 7.739 7.574 0.165 18995
2420 1 8 . 1 1 60 60 LEU N N 60 119.636 119.636 123.753 -4.117 18995
2421 1 8 . 1 1 60 60 LEU C C 60 177.561 177.561 177.414 0.147 18995
2422 1 8 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.989 -1.389 18995
2423 1 8 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.081 2.219 18995
2424 1 8 . 1 1 60 60 LEU H H 60 7.643 7.643 8.798 -1.155 18995
2425 1 8 . 1 1 61 61 ASP N N 61 117.424 117.424 125.098 -7.674 18995
2426 1 8 . 1 1 61 61 ASP C C 61 175.915 175.915 174.796 1.119 18995
2427 1 8 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.812 0.788 18995
2428 1 8 . 1 1 61 61 ASP H H 61 7.984 7.984 8.652 -0.668 18995
2429 1 8 . 1 1 62 62 ASN N N 62 127.650 127.650 122.499 5.151 18995
2430 1 8 . 1 1 62 62 ASN C C 62 175.905 175.905 174.387 1.518 18995
2431 1 8 . 1 1 62 62 ASN CA C 62 54.900 54.900 53.187 1.714 18995
2432 1 8 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.900 0.500 18995
2433 1 8 . 1 1 62 62 ASN H H 62 9.032 9.032 8.313 0.719 18995
2434 1 8 . 1 1 63 63 ASP N N 63 116.676 116.676 123.551 -6.875 18995
2435 1 8 . 1 1 63 63 ASP C C 63 177.604 177.604 174.815 2.789 18995
2436 1 8 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.622 2.778 18995
2437 1 8 . 1 1 63 63 ASP CB C 63 40.200 40.200 45.282 -5.082 18995
2438 1 8 . 1 1 63 63 ASP H H 63 8.302 8.302 9.686 -1.384 18995
2439 1 8 . 1 1 64 64 GLY N N 64 109.334 109.334 109.685 -0.351 18995
2440 1 8 . 1 1 64 64 GLY C C 64 174.834 174.834 174.464 0.370 18995
2441 1 8 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.317 4.383 18995
2442 1 8 . 1 1 64 64 GLY H H 64 7.681 7.681 9.032 -1.351 18995
2443 1 8 . 1 1 65 65 ASP N N 65 120.960 120.960 125.986 -5.026 18995
2444 1 8 . 1 1 65 65 ASP C C 65 177.010 177.010 174.709 2.301 18995
2445 1 8 . 1 1 65 65 ASP CA C 65 53.800 53.800 53.901 -0.101 18995
2446 1 8 . 1 1 65 65 ASP CB C 65 40.300 40.300 41.173 -0.873 18995
2447 1 8 . 1 1 65 65 ASP H H 65 8.386 8.386 9.400 -1.014 18995
2448 1 8 . 1 1 66 66 GLY N N 66 113.875 113.875 117.202 -3.327 18995
2449 1 8 . 1 1 66 66 GLY C C 66 172.343 172.343 174.098 -1.755 18995
2450 1 8 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.848 3.052 18995
2451 1 8 . 1 1 66 66 GLY H H 66 10.212 10.212 9.051 1.161 18995
2452 1 8 . 1 1 67 67 GLU N N 67 118.701 118.701 125.666 -6.965 18995
2453 1 8 . 1 1 67 67 GLU C C 67 174.711 174.711 176.137 -1.426 18995
2454 1 8 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.800 -0.600 18995
2455 1 8 . 1 1 67 67 GLU H H 67 7.949 7.949 8.888 -0.939 18995
2456 1 8 . 1 1 68 68 CYS N N 68 124.753 124.753 127.170 -2.417 18995
2457 1 8 . 1 1 68 68 CYS C C 68 174.411 174.411 176.791 -2.380 18995
2458 1 8 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.995 -5.995 18995
2459 1 8 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.842 0.258 18995
2460 1 8 . 1 1 68 68 CYS H H 68 9.486 9.486 8.815 0.671 18995
2461 1 8 . 1 1 69 69 ASP N N 69 132.376 132.376 119.012 13.364 18995
2462 1 8 . 1 1 69 69 ASP C C 69 175.307 175.307 174.502 0.805 18995
2463 1 8 . 1 1 69 69 ASP CA C 69 53.300 53.300 53.960 -0.660 18995
2464 1 8 . 1 1 69 69 ASP CB C 69 40.600 40.600 38.849 1.751 18995
2465 1 8 . 1 1 69 69 ASP H H 69 9.911 9.911 8.481 1.430 18995
2466 1 8 . 1 1 70 70 PHE N N 70 119.131 119.131 120.060 -0.929 18995
2467 1 8 . 1 1 70 70 PHE C C 70 176.482 176.482 174.775 1.707 18995
2468 1 8 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.347 4.553 18995
2469 1 8 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.093 -0.993 18995
2470 1 8 . 1 1 70 70 PHE H H 70 9.075 9.075 8.089 0.986 18995
2471 1 8 . 1 1 71 71 GLN N N 71 119.323 119.323 118.265 1.058 18995
2472 1 8 . 1 1 71 71 GLN C C 71 179.517 179.517 173.996 5.521 18995
2473 1 8 . 1 1 71 71 GLN CA C 71 60.100 60.100 57.040 3.060 18995
2474 1 8 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.625 0.576 18995
2475 1 8 . 1 1 71 71 GLN H H 71 8.047 8.047 8.459 -0.412 18995
2476 1 8 . 1 1 72 72 GLU N N 72 123.228 123.228 115.758 7.470 18995
2477 1 8 . 1 1 72 72 GLU C C 72 179.337 179.337 174.876 4.461 18995
2478 1 8 . 1 1 72 72 GLU CA C 72 58.900 58.900 54.963 3.937 18995
2479 1 8 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.294 -2.994 18995
2480 1 8 . 1 1 72 72 GLU H H 72 9.061 9.061 7.183 1.878 18995
2481 1 8 . 1 1 73 73 PHE N N 73 123.155 123.155 118.596 4.559 18995
2482 1 8 . 1 1 73 73 PHE C C 73 176.497 176.497 175.369 1.128 18995
2483 1 8 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.010 3.790 18995
2484 1 8 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.689 -0.989 18995
2485 1 8 . 1 1 73 73 PHE H H 73 8.863 8.863 9.389 -0.526 18995
2486 1 8 . 1 1 74 74 MET N N 74 119.622 119.622 122.758 -3.136 18995
2487 1 8 . 1 1 74 74 MET C C 74 178.476 178.476 174.844 3.632 18995
2488 1 8 . 1 1 74 74 MET CA C 74 56.200 56.200 55.792 0.408 18995
2489 1 8 . 1 1 74 74 MET CB C 74 30.400 30.400 33.470 -3.070 18995
2490 1 8 . 1 1 74 74 MET H H 74 8.217 8.217 8.976 -0.759 18995
2491 1 8 . 1 1 75 75 ALA N N 75 123.073 123.073 128.621 -5.548 18995
2492 1 8 . 1 1 75 75 ALA C C 75 180.129 180.129 175.160 4.969 18995
2493 1 8 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.318 4.882 18995
2494 1 8 . 1 1 75 75 ALA H H 75 7.490 7.490 9.347 -1.857 18995
2495 1 8 . 1 1 76 76 PHE N N 76 122.171 122.171 122.397 -0.226 18995
2496 1 8 . 1 1 76 76 PHE C C 76 176.365 176.365 175.076 1.289 18995
2497 1 8 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.361 2.439 18995
2498 1 8 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.705 -4.105 18995
2499 1 8 . 1 1 76 76 PHE H H 76 7.676 7.676 8.211 -0.535 18995
2500 1 8 . 1 1 77 77 VAL N N 77 119.765 119.765 123.853 -4.088 18995
2501 1 8 . 1 1 77 77 VAL C C 77 179.175 179.175 177.732 1.443 18995
2502 1 8 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.501 6.299 18995
2503 1 8 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.287 -1.087 18995
2504 1 8 . 1 1 77 77 VAL H H 77 8.498 8.498 8.631 -0.133 18995
2505 1 8 . 1 1 78 78 ALA N N 78 123.880 123.880 121.926 1.954 18995
2506 1 8 . 1 1 78 78 ALA C C 78 178.630 178.630 177.561 1.069 18995
2507 1 8 . 1 1 78 78 ALA CA C 78 56.100 56.100 54.843 1.257 18995
2508 1 8 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.573 -0.273 18995
2509 1 8 . 1 1 78 78 ALA H H 78 8.193 8.193 8.693 -0.500 18995
2510 1 8 . 1 1 79 79 MET N N 79 120.537 120.537 114.805 5.732 18995
2511 1 8 . 1 1 79 79 MET C C 79 178.430 178.430 176.597 1.833 18995
2512 1 8 . 1 1 79 79 MET CA C 79 59.500 59.500 54.788 4.712 18995
2513 1 8 . 1 1 79 79 MET CB C 79 32.800 32.800 32.240 0.560 18995
2514 1 8 . 1 1 79 79 MET H H 79 7.883 7.883 7.923 -0.040 18995
2515 1 8 . 1 1 80 80 VAL N N 80 120.374 120.374 119.167 1.207 18995
2516 1 8 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.552 4.648 18995
2517 1 8 . 1 1 80 80 VAL H H 80 8.299 8.299 7.425 0.874 18995
2518 1 8 . 1 1 82 82 THR C C 82 175.144 175.144 173.002 2.142 18995
2519 1 8 . 1 1 82 82 THR CA C 82 65.800 65.800 61.124 4.676 18995
2520 1 8 . 1 1 83 83 ALA N N 83 123.244 123.244 123.503 -0.259 18995
2521 1 8 . 1 1 83 83 ALA C C 83 178.574 178.574 175.241 3.333 18995
2522 1 8 . 1 1 83 83 ALA CA C 83 53.900 53.900 49.790 4.110 18995
2523 1 8 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.447 -2.447 18995
2524 1 8 . 1 1 83 83 ALA H H 83 7.587 7.587 8.653 -1.066 18995
2525 1 8 . 1 1 84 84 CYS N N 84 116.910 116.910 117.685 -0.775 18995
2526 1 8 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.193 2.607 18995
2527 1 8 . 1 1 84 84 CYS CB C 84 27.900 27.900 28.792 -0.892 18995
2528 1 8 . 1 1 84 84 CYS H H 84 7.788 7.788 8.349 -0.561 18995
2529 1 8 . 1 1 86 86 GLU CA C 86 58.600 58.600 58.245 0.355 18995
2530 1 8 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.172 -0.773 18995
2531 1 8 . 1 1 87 87 PHE N N 87 118.550 118.550 119.341 -0.791 18995
2532 1 8 . 1 1 87 87 PHE C C 87 175.597 175.597 174.387 1.210 18995
2533 1 8 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.269 1.831 18995
2534 1 8 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.423 -1.023 18995
2535 1 8 . 1 1 87 87 PHE H H 87 7.838 7.838 7.647 0.191 18995
2536 1 8 . 1 1 88 88 PHE N N 88 118.438 118.438 125.251 -6.813 18995
2537 1 8 . 1 1 88 88 PHE C C 88 175.241 175.241 176.013 -0.772 18995
2538 1 8 . 1 1 88 88 PHE CA C 88 58.200 58.200 58.227 -0.027 18995
2539 1 8 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.504 2.196 18995
2540 1 8 . 1 1 88 88 PHE H H 88 7.718 7.718 8.493 -0.775 18995
2541 1 8 . 1 1 89 89 GLU N N 89 121.366 121.366 126.727 -5.361 18995
2542 1 8 . 1 1 89 89 GLU C C 89 175.437 175.437 177.005 -1.568 18995
2543 1 8 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.156 2.444 18995
2544 1 8 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.826 -1.526 18995
2545 1 8 . 1 1 89 89 GLU H H 89 7.959 7.959 8.108 -0.149 18995
2546 1 8 . 1 1 90 90 HIS N N 90 120.349 120.349 116.539 3.810 18995
2547 1 8 . 1 1 90 90 HIS C C 90 173.652 173.652 176.060 -2.408 18995
2548 1 8 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.369 -2.569 18995
2549 1 8 . 1 1 90 90 HIS CB C 90 30.100 30.100 28.935 1.165 18995
2550 1 8 . 1 1 90 90 HIS H H 90 8.116 8.116 8.752 -0.636 18995
2551 1 8 . 1 1 91 91 GLU N N 91 127.965 127.965 118.910 9.055 18995
2552 1 8 . 1 1 91 91 GLU H H 91 8.235 8.235 7.639 0.596 18995
2553 1 9 . 1 1 20 20 ARG C C 20 177.097 177.097 174.788 2.309 18995
2554 1 9 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.574 4.526 18995
2555 1 9 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.947 0.053 18995
2556 1 9 . 1 1 21 21 GLU N N 21 116.519 116.519 120.504 -3.985 18995
2557 1 9 . 1 1 21 21 GLU C C 21 175.055 175.055 175.649 -0.594 18995
2558 1 9 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.305 1.295 18995
2559 1 9 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.046 1.654 18995
2560 1 9 . 1 1 21 21 GLU H H 21 9.468 9.468 9.245 0.223 18995
2561 1 9 . 1 1 22 22 GLY N N 22 122.197 122.197 109.767 12.430 18995
2562 1 9 . 1 1 22 22 GLY C C 22 180.081 180.081 173.815 6.266 18995
2563 1 9 . 1 1 22 22 GLY H H 22 10.096 10.096 9.296 0.800 18995
2564 1 9 . 1 1 23 23 ASP N N 23 113.764 113.764 126.374 -12.610 18995
2565 1 9 . 1 1 23 23 ASP C C 23 178.957 178.957 175.469 3.488 18995
2566 1 9 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.549 1.951 18995
2567 1 9 . 1 1 23 23 ASP H H 23 8.115 8.115 9.349 -1.234 18995
2568 1 9 . 1 1 24 24 LYS N N 24 131.954 131.954 127.725 4.229 18995
2569 1 9 . 1 1 24 24 LYS C C 24 176.539 176.539 175.251 1.288 18995
2570 1 9 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.171 3.029 18995
2571 1 9 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.262 -1.562 18995
2572 1 9 . 1 1 24 24 LYS H H 24 9.484 9.484 9.060 0.424 18995
2573 1 9 . 1 1 25 25 HIS N N 25 119.313 119.313 128.655 -9.342 18995
2574 1 9 . 1 1 25 25 HIS C C 25 172.815 172.815 174.649 -1.834 18995
2575 1 9 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.918 0.582 18995
2576 1 9 . 1 1 25 25 HIS CB C 25 30.800 30.800 31.946 -1.146 18995
2577 1 9 . 1 1 25 25 HIS H H 25 9.589 9.589 8.767 0.822 18995
2578 1 9 . 1 1 26 26 LYS N N 26 115.394 115.394 126.157 -10.763 18995
2579 1 9 . 1 1 26 26 LYS C C 26 174.608 174.608 175.068 -0.460 18995
2580 1 9 . 1 1 26 26 LYS CA C 26 55.400 55.400 56.775 -1.375 18995
2581 1 9 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.088 7.012 18995
2582 1 9 . 1 1 26 26 LYS H H 26 7.095 7.095 7.944 -0.849 18995
2583 1 9 . 1 1 27 27 LEU N N 27 126.263 126.263 119.681 6.582 18995
2584 1 9 . 1 1 27 27 LEU C C 27 175.637 175.637 176.281 -0.644 18995
2585 1 9 . 1 1 27 27 LEU CA C 27 52.800 52.800 53.762 -0.962 18995
2586 1 9 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.001 1.699 18995
2587 1 9 . 1 1 27 27 LEU H H 27 9.595 9.595 7.064 2.531 18995
2588 1 9 . 1 1 28 28 LYS N N 28 124.436 124.436 124.090 0.346 18995
2589 1 9 . 1 1 28 28 LYS C C 28 177.395 177.395 176.168 1.227 18995
2590 1 9 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.423 -1.223 18995
2591 1 9 . 1 1 28 28 LYS H H 28 9.711 9.711 8.539 1.172 18995
2592 1 9 . 1 1 29 29 LYS N N 29 121.980 121.980 118.715 3.265 18995
2593 1 9 . 1 1 29 29 LYS C C 29 177.400 177.400 175.097 2.303 18995
2594 1 9 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.923 6.777 18995
2595 1 9 . 1 1 29 29 LYS H H 29 9.084 9.084 7.495 1.589 18995
2596 1 9 . 1 1 30 30 SER N N 30 111.519 111.519 113.636 -2.117 18995
2597 1 9 . 1 1 30 30 SER C C 30 176.950 176.950 173.399 3.551 18995
2598 1 9 . 1 1 30 30 SER CA C 30 61.100 61.100 57.186 3.914 18995
2599 1 9 . 1 1 30 30 SER CB C 30 61.300 61.300 65.088 -3.788 18995
2600 1 9 . 1 1 30 30 SER H H 30 8.267 8.267 7.193 1.074 18995
2601 1 9 . 1 1 31 31 GLU N N 31 123.792 123.792 120.178 3.614 18995
2602 1 9 . 1 1 31 31 GLU C C 31 179.463 179.463 177.131 2.332 18995
2603 1 9 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.301 4.799 18995
2604 1 9 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.707 -2.507 18995
2605 1 9 . 1 1 31 31 GLU H H 31 6.603 6.603 9.671 -3.068 18995
2606 1 9 . 1 1 32 32 LEU N N 32 121.954 121.954 124.838 -2.884 18995
2607 1 9 . 1 1 32 32 LEU C C 32 176.995 176.995 175.621 1.374 18995
2608 1 9 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.403 2.497 18995
2609 1 9 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.287 0.013 18995
2610 1 9 . 1 1 32 32 LEU H H 32 8.936 8.936 8.631 0.305 18995
2611 1 9 . 1 1 33 33 LYS N N 33 118.576 118.576 128.660 -10.084 18995
2612 1 9 . 1 1 33 33 LYS C C 33 176.714 176.714 175.199 1.515 18995
2613 1 9 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.732 5.768 18995
2614 1 9 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.236 -1.336 18995
2615 1 9 . 1 1 33 33 LYS H H 33 8.390 8.390 9.298 -0.908 18995
2616 1 9 . 1 1 34 34 GLU N N 34 116.152 116.152 128.487 -12.335 18995
2617 1 9 . 1 1 34 34 GLU C C 34 177.689 177.689 175.572 2.117 18995
2618 1 9 . 1 1 34 34 GLU CA C 34 59.400 59.400 56.110 3.290 18995
2619 1 9 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.674 -1.274 18995
2620 1 9 . 1 1 34 34 GLU H H 34 7.326 7.326 8.091 -0.765 18995
2621 1 9 . 1 1 35 35 LEU N N 35 123.632 123.632 127.457 -3.825 18995
2622 1 9 . 1 1 35 35 LEU C C 35 178.845 178.845 176.442 2.403 18995
2623 1 9 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.115 7.685 18995
2624 1 9 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.149 -1.149 18995
2625 1 9 . 1 1 35 35 LEU H H 35 7.978 7.978 8.978 -1.000 18995
2626 1 9 . 1 1 36 36 ILE C C 36 178.328 178.328 175.698 2.630 18995
2627 1 9 . 1 1 36 36 ILE CA C 36 66.300 66.300 62.951 3.349 18995
2628 1 9 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.213 0.487 18995
2629 1 9 . 1 1 37 37 ASN N N 37 118.242 118.242 112.834 5.408 18995
2630 1 9 . 1 1 37 37 ASN C C 37 177.052 177.052 176.575 0.477 18995
2631 1 9 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.173 1.627 18995
2632 1 9 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.512 -1.012 18995
2633 1 9 . 1 1 37 37 ASN H H 37 8.336 8.336 8.417 -0.081 18995
2634 1 9 . 1 1 38 38 ASN N N 38 114.845 114.845 118.992 -4.147 18995
2635 1 9 . 1 1 38 38 ASN C C 38 176.578 176.578 174.500 2.078 18995
2636 1 9 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.709 2.491 18995
2637 1 9 . 1 1 38 38 ASN H H 38 8.213 8.213 7.985 0.228 18995
2638 1 9 . 1 1 39 39 GLU N N 39 113.797 113.797 120.890 -7.093 18995
2639 1 9 . 1 1 39 39 GLU C C 39 177.689 177.689 174.336 3.353 18995
2640 1 9 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.609 -1.409 18995
2641 1 9 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.069 0.231 18995
2642 1 9 . 1 1 39 39 GLU H H 39 8.522 8.522 8.372 0.150 18995
2643 1 9 . 1 1 40 40 LEU N N 40 119.982 119.982 122.720 -2.738 18995
2644 1 9 . 1 1 40 40 LEU C C 40 177.212 177.212 175.494 1.718 18995
2645 1 9 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.380 0.720 18995
2646 1 9 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.349 -1.649 18995
2647 1 9 . 1 1 40 40 LEU H H 40 7.552 7.552 8.486 -0.934 18995
2648 1 9 . 1 1 41 41 SER N N 41 114.635 114.635 120.663 -6.028 18995
2649 1 9 . 1 1 41 41 SER C C 41 175.688 175.688 172.721 2.967 18995
2650 1 9 . 1 1 41 41 SER CA C 41 60.800 60.800 56.784 4.016 18995
2651 1 9 . 1 1 41 41 SER CB C 41 64.100 64.100 66.992 -2.892 18995
2652 1 9 . 1 1 41 41 SER H H 41 7.592 7.592 9.009 -1.417 18995
2653 1 9 . 1 1 42 42 HIS N N 42 122.397 122.397 115.671 6.726 18995
2654 1 9 . 1 1 42 42 HIS C C 42 175.523 175.523 172.919 2.604 18995
2655 1 9 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.005 3.695 18995
2656 1 9 . 1 1 42 42 HIS H H 42 10.406 10.406 8.274 2.132 18995
2657 1 9 . 1 1 43 43 PHE N N 43 117.618 117.618 122.127 -4.509 18995
2658 1 9 . 1 1 43 43 PHE C C 43 177.431 177.431 175.799 1.632 18995
2659 1 9 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.638 3.162 18995
2660 1 9 . 1 1 43 43 PHE H H 43 7.785 7.785 8.816 -1.031 18995
2661 1 9 . 1 1 44 44 LEU N N 44 120.185 120.185 127.727 -7.542 18995
2662 1 9 . 1 1 44 44 LEU C C 44 175.829 175.829 176.187 -0.358 18995
2663 1 9 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.531 -2.731 18995
2664 1 9 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.555 2.445 18995
2665 1 9 . 1 1 44 44 LEU H H 44 8.533 8.533 8.810 -0.277 18995
2666 1 9 . 1 1 45 45 GLU N N 45 121.499 121.499 118.396 3.103 18995
2667 1 9 . 1 1 45 45 GLU C C 45 175.060 175.060 177.250 -2.190 18995
2668 1 9 . 1 1 45 45 GLU CA C 45 56.600 56.600 57.081 -0.481 18995
2669 1 9 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.061 1.539 18995
2670 1 9 . 1 1 45 45 GLU H H 45 8.130 8.130 8.190 -0.060 18995
2671 1 9 . 1 1 46 46 GLU N N 46 122.480 122.480 124.397 -1.917 18995
2672 1 9 . 1 1 46 46 GLU C C 46 176.861 176.861 175.809 1.052 18995
2673 1 9 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.094 -0.294 18995
2674 1 9 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.212 1.488 18995
2675 1 9 . 1 1 46 46 GLU H H 46 8.123 8.123 8.562 -0.439 18995
2676 1 9 . 1 1 47 47 ILE N N 47 127.680 127.680 119.208 8.472 18995
2677 1 9 . 1 1 47 47 ILE C C 47 175.931 175.931 175.227 0.704 18995
2678 1 9 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.427 0.673 18995
2679 1 9 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.806 0.794 18995
2680 1 9 . 1 1 47 47 ILE H H 47 9.897 9.897 7.764 2.133 18995
2681 1 9 . 1 1 48 48 LYS N N 48 126.846 126.846 123.545 3.301 18995
2682 1 9 . 1 1 48 48 LYS C C 48 175.896 175.896 175.910 -0.014 18995
2683 1 9 . 1 1 48 48 LYS CA C 48 56.600 56.600 53.777 2.823 18995
2684 1 9 . 1 1 48 48 LYS CB C 48 34.700 34.700 34.468 0.232 18995
2685 1 9 . 1 1 48 48 LYS H H 48 9.077 9.077 7.336 1.741 18995
2686 1 9 . 1 1 49 49 GLU C C 49 179.470 179.470 176.695 2.775 18995
2687 1 9 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.393 -1.793 18995
2688 1 9 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.493 2.307 18995
2689 1 9 . 1 1 50 50 GLN N N 50 125.850 125.850 119.716 6.134 18995
2690 1 9 . 1 1 50 50 GLN C C 50 176.883 176.883 177.094 -0.211 18995
2691 1 9 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.236 1.264 18995
2692 1 9 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.523 -0.123 18995
2693 1 9 . 1 1 50 50 GLN H H 50 9.041 9.041 8.786 0.255 18995
2694 1 9 . 1 1 51 51 GLU N N 51 117.404 117.404 112.514 4.890 18995
2695 1 9 . 1 1 51 51 GLU C C 51 178.262 178.262 175.246 3.016 18995
2696 1 9 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.670 4.030 18995
2697 1 9 . 1 1 51 51 GLU CB C 51 29.300 29.300 29.865 -0.565 18995
2698 1 9 . 1 1 51 51 GLU H H 51 9.352 9.352 7.510 1.842 18995
2699 1 9 . 1 1 52 52 VAL N N 52 118.888 118.888 121.966 -3.078 18995
2700 1 9 . 1 1 52 52 VAL C C 52 177.677 177.677 174.643 3.034 18995
2701 1 9 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.688 4.412 18995
2702 1 9 . 1 1 52 52 VAL CB C 52 31.700 31.700 30.796 0.904 18995
2703 1 9 . 1 1 52 52 VAL H H 52 7.247 7.247 7.251 -0.004 18995
2704 1 9 . 1 1 53 53 VAL N N 53 119.906 119.906 123.403 -3.497 18995
2705 1 9 . 1 1 53 53 VAL C C 53 176.742 176.742 174.771 1.971 18995
2706 1 9 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.713 5.487 18995
2707 1 9 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.745 -3.146 18995
2708 1 9 . 1 1 53 53 VAL H H 53 7.264 7.264 8.764 -1.500 18995
2709 1 9 . 1 1 54 54 ASP N N 54 121.483 121.483 121.126 0.357 18995
2710 1 9 . 1 1 54 54 ASP C C 54 178.291 178.291 174.587 3.704 18995
2711 1 9 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.144 6.056 18995
2712 1 9 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.372 -4.372 18995
2713 1 9 . 1 1 54 54 ASP H H 54 8.524 8.524 9.148 -0.624 18995
2714 1 9 . 1 1 55 55 LYS N N 55 120.875 120.875 127.768 -6.893 18995
2715 1 9 . 1 1 55 55 LYS C C 55 179.054 179.054 176.313 2.741 18995
2716 1 9 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.567 3.333 18995
2717 1 9 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.445 -0.245 18995
2718 1 9 . 1 1 55 55 LYS H H 55 7.580 7.580 8.882 -1.302 18995
2719 1 9 . 1 1 56 56 VAL N N 56 121.960 121.960 123.785 -1.825 18995
2720 1 9 . 1 1 56 56 VAL C C 56 178.221 178.221 175.192 3.029 18995
2721 1 9 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.237 5.763 18995
2722 1 9 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.550 -1.850 18995
2723 1 9 . 1 1 56 56 VAL H H 56 8.279 8.279 8.803 -0.524 18995
2724 1 9 . 1 1 57 57 MET N N 57 118.815 118.815 126.408 -7.593 18995
2725 1 9 . 1 1 57 57 MET C C 57 176.888 176.888 175.150 1.738 18995
2726 1 9 . 1 1 57 57 MET CA C 57 57.900 57.900 54.735 3.165 18995
2727 1 9 . 1 1 57 57 MET CB C 57 32.900 32.900 33.010 -0.110 18995
2728 1 9 . 1 1 57 57 MET H H 57 8.467 8.467 8.984 -0.517 18995
2729 1 9 . 1 1 58 58 GLU N N 58 117.894 117.894 125.777 -7.883 18995
2730 1 9 . 1 1 58 58 GLU C C 58 178.510 178.510 176.362 2.148 18995
2731 1 9 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.012 2.388 18995
2732 1 9 . 1 1 58 58 GLU CB C 58 29.800 29.800 31.155 -1.355 18995
2733 1 9 . 1 1 58 58 GLU H H 58 8.073 8.073 8.748 -0.675 18995
2734 1 9 . 1 1 59 59 THR N N 59 113.244 113.244 113.544 -0.300 18995
2735 1 9 . 1 1 59 59 THR C C 59 174.778 174.778 172.926 1.852 18995
2736 1 9 . 1 1 59 59 THR CA C 59 65.600 65.600 59.930 5.670 18995
2737 1 9 . 1 1 59 59 THR CB C 59 69.600 69.600 70.935 -1.335 18995
2738 1 9 . 1 1 59 59 THR H H 59 7.739 7.739 7.510 0.229 18995
2739 1 9 . 1 1 60 60 LEU N N 60 119.636 119.636 124.100 -4.464 18995
2740 1 9 . 1 1 60 60 LEU C C 60 177.561 177.561 177.208 0.353 18995
2741 1 9 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.247 -0.647 18995
2742 1 9 . 1 1 60 60 LEU CB C 60 43.300 43.300 40.886 2.414 18995
2743 1 9 . 1 1 60 60 LEU H H 60 7.643 7.643 8.698 -1.055 18995
2744 1 9 . 1 1 61 61 ASP N N 61 117.424 117.424 125.017 -7.593 18995
2745 1 9 . 1 1 61 61 ASP C C 61 175.915 175.915 174.437 1.478 18995
2746 1 9 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.799 0.801 18995
2747 1 9 . 1 1 61 61 ASP H H 61 7.984 7.984 8.633 -0.649 18995
2748 1 9 . 1 1 62 62 ASN N N 62 127.650 127.650 122.090 5.560 18995
2749 1 9 . 1 1 62 62 ASN C C 62 175.905 175.905 174.240 1.665 18995
2750 1 9 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.776 2.124 18995
2751 1 9 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.511 0.889 18995
2752 1 9 . 1 1 62 62 ASN H H 62 9.032 9.032 8.071 0.961 18995
2753 1 9 . 1 1 63 63 ASP N N 63 116.676 116.676 123.387 -6.711 18995
2754 1 9 . 1 1 63 63 ASP C C 63 177.604 177.604 175.053 2.551 18995
2755 1 9 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.569 2.831 18995
2756 1 9 . 1 1 63 63 ASP CB C 63 40.200 40.200 45.039 -4.839 18995
2757 1 9 . 1 1 63 63 ASP H H 63 8.302 8.302 9.495 -1.193 18995
2758 1 9 . 1 1 64 64 GLY N N 64 109.334 109.334 110.162 -0.828 18995
2759 1 9 . 1 1 64 64 GLY C C 64 174.834 174.834 174.782 0.052 18995
2760 1 9 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.368 4.332 18995
2761 1 9 . 1 1 64 64 GLY H H 64 7.681 7.681 9.042 -1.361 18995
2762 1 9 . 1 1 65 65 ASP N N 65 120.960 120.960 126.408 -5.448 18995
2763 1 9 . 1 1 65 65 ASP C C 65 177.010 177.010 174.727 2.283 18995
2764 1 9 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.118 -0.318 18995
2765 1 9 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.728 -0.428 18995
2766 1 9 . 1 1 65 65 ASP H H 65 8.386 8.386 9.329 -0.943 18995
2767 1 9 . 1 1 66 66 GLY N N 66 113.875 113.875 117.447 -3.572 18995
2768 1 9 . 1 1 66 66 GLY C C 66 172.343 172.343 174.187 -1.844 18995
2769 1 9 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.942 2.958 18995
2770 1 9 . 1 1 66 66 GLY H H 66 10.212 10.212 8.959 1.253 18995
2771 1 9 . 1 1 67 67 GLU N N 67 118.701 118.701 125.471 -6.770 18995
2772 1 9 . 1 1 67 67 GLU C C 67 174.711 174.711 176.322 -1.611 18995
2773 1 9 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.873 -0.673 18995
2774 1 9 . 1 1 67 67 GLU H H 67 7.949 7.949 8.991 -1.042 18995
2775 1 9 . 1 1 68 68 CYS N N 68 124.753 124.753 126.301 -1.548 18995
2776 1 9 . 1 1 68 68 CYS C C 68 174.411 174.411 175.679 -1.268 18995
2777 1 9 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.162 -5.162 18995
2778 1 9 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.827 0.273 18995
2779 1 9 . 1 1 68 68 CYS H H 68 9.486 9.486 8.818 0.668 18995
2780 1 9 . 1 1 69 69 ASP N N 69 132.376 132.376 118.740 13.636 18995
2781 1 9 . 1 1 69 69 ASP C C 69 175.307 175.307 176.611 -1.304 18995
2782 1 9 . 1 1 69 69 ASP CA C 69 53.300 53.300 55.806 -2.506 18995
2783 1 9 . 1 1 69 69 ASP CB C 69 40.600 40.600 41.265 -0.665 18995
2784 1 9 . 1 1 69 69 ASP H H 69 9.911 9.911 8.067 1.844 18995
2785 1 9 . 1 1 70 70 PHE N N 70 119.131 119.131 119.516 -0.385 18995
2786 1 9 . 1 1 70 70 PHE C C 70 176.482 176.482 174.875 1.607 18995
2787 1 9 . 1 1 70 70 PHE CA C 70 62.900 62.900 57.840 5.060 18995
2788 1 9 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.070 -0.970 18995
2789 1 9 . 1 1 70 70 PHE H H 70 9.075 9.075 8.071 1.004 18995
2790 1 9 . 1 1 71 71 GLN N N 71 119.323 119.323 116.494 2.829 18995
2791 1 9 . 1 1 71 71 GLN C C 71 179.517 179.517 174.112 5.405 18995
2792 1 9 . 1 1 71 71 GLN CA C 71 60.100 60.100 56.965 3.135 18995
2793 1 9 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.485 0.715 18995
2794 1 9 . 1 1 71 71 GLN H H 71 8.047 8.047 8.282 -0.235 18995
2795 1 9 . 1 1 72 72 GLU N N 72 123.228 123.228 115.393 7.835 18995
2796 1 9 . 1 1 72 72 GLU C C 72 179.337 179.337 175.070 4.267 18995
2797 1 9 . 1 1 72 72 GLU CA C 72 58.900 58.900 54.799 4.101 18995
2798 1 9 . 1 1 72 72 GLU CB C 72 30.300 30.300 32.914 -2.614 18995
2799 1 9 . 1 1 72 72 GLU H H 72 9.061 9.061 7.190 1.871 18995
2800 1 9 . 1 1 73 73 PHE N N 73 123.155 123.155 118.305 4.850 18995
2801 1 9 . 1 1 73 73 PHE C C 73 176.497 176.497 175.442 1.055 18995
2802 1 9 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.255 3.545 18995
2803 1 9 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.229 -0.529 18995
2804 1 9 . 1 1 73 73 PHE H H 73 8.863 8.863 9.245 -0.382 18995
2805 1 9 . 1 1 74 74 MET N N 74 119.622 119.622 122.898 -3.276 18995
2806 1 9 . 1 1 74 74 MET C C 74 178.476 178.476 174.895 3.581 18995
2807 1 9 . 1 1 74 74 MET CA C 74 56.200 56.200 55.780 0.420 18995
2808 1 9 . 1 1 74 74 MET CB C 74 30.400 30.400 33.668 -3.268 18995
2809 1 9 . 1 1 74 74 MET H H 74 8.217 8.217 9.084 -0.867 18995
2810 1 9 . 1 1 75 75 ALA N N 75 123.073 123.073 127.780 -4.707 18995
2811 1 9 . 1 1 75 75 ALA C C 75 180.129 180.129 175.093 5.036 18995
2812 1 9 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.591 4.609 18995
2813 1 9 . 1 1 75 75 ALA H H 75 7.490 7.490 9.264 -1.774 18995
2814 1 9 . 1 1 76 76 PHE N N 76 122.171 122.171 121.411 0.760 18995
2815 1 9 . 1 1 76 76 PHE C C 76 176.365 176.365 174.780 1.585 18995
2816 1 9 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.228 2.572 18995
2817 1 9 . 1 1 76 76 PHE CB C 76 38.600 38.600 43.089 -4.489 18995
2818 1 9 . 1 1 76 76 PHE H H 76 7.676 7.676 8.304 -0.628 18995
2819 1 9 . 1 1 77 77 VAL N N 77 119.765 119.765 125.134 -5.369 18995
2820 1 9 . 1 1 77 77 VAL C C 77 179.175 179.175 177.697 1.478 18995
2821 1 9 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.899 5.901 18995
2822 1 9 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.174 -0.974 18995
2823 1 9 . 1 1 77 77 VAL H H 77 8.498 8.498 8.914 -0.416 18995
2824 1 9 . 1 1 78 78 ALA N N 78 123.880 123.880 121.907 1.973 18995
2825 1 9 . 1 1 78 78 ALA C C 78 178.630 178.630 177.573 1.057 18995
2826 1 9 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.179 0.921 18995
2827 1 9 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.746 -0.446 18995
2828 1 9 . 1 1 78 78 ALA H H 78 8.193 8.193 8.872 -0.679 18995
2829 1 9 . 1 1 79 79 MET N N 79 120.537 120.537 113.520 7.017 18995
2830 1 9 . 1 1 79 79 MET C C 79 178.430 178.430 176.990 1.440 18995
2831 1 9 . 1 1 79 79 MET CA C 79 59.500 59.500 54.444 5.056 18995
2832 1 9 . 1 1 79 79 MET CB C 79 32.800 32.800 32.172 0.628 18995
2833 1 9 . 1 1 79 79 MET H H 79 7.883 7.883 7.874 0.009 18995
2834 1 9 . 1 1 80 80 VAL N N 80 120.374 120.374 118.983 1.391 18995
2835 1 9 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.778 4.422 18995
2836 1 9 . 1 1 80 80 VAL H H 80 8.299 8.299 7.919 0.380 18995
2837 1 9 . 1 1 82 82 THR C C 82 175.144 175.144 172.880 2.264 18995
2838 1 9 . 1 1 82 82 THR CA C 82 65.800 65.800 61.444 4.356 18995
2839 1 9 . 1 1 83 83 ALA N N 83 123.244 123.244 122.436 0.808 18995
2840 1 9 . 1 1 83 83 ALA C C 83 178.574 178.574 175.062 3.512 18995
2841 1 9 . 1 1 83 83 ALA CA C 83 53.900 53.900 50.335 3.565 18995
2842 1 9 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.487 -2.487 18995
2843 1 9 . 1 1 83 83 ALA H H 83 7.587 7.587 8.686 -1.099 18995
2844 1 9 . 1 1 84 84 CYS N N 84 116.910 116.910 117.101 -0.191 18995
2845 1 9 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.209 2.591 18995
2846 1 9 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.333 -1.433 18995
2847 1 9 . 1 1 84 84 CYS H H 84 7.788 7.788 8.579 -0.791 18995
2848 1 9 . 1 1 86 86 GLU CA C 86 58.600 58.600 56.808 1.792 18995
2849 1 9 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.280 -0.880 18995
2850 1 9 . 1 1 87 87 PHE N N 87 118.550 118.550 119.818 -1.268 18995
2851 1 9 . 1 1 87 87 PHE C C 87 175.597 175.597 174.978 0.619 18995
2852 1 9 . 1 1 87 87 PHE CA C 87 59.100 59.100 56.971 2.129 18995
2853 1 9 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.886 -1.486 18995
2854 1 9 . 1 1 87 87 PHE H H 87 7.838 7.838 7.726 0.112 18995
2855 1 9 . 1 1 88 88 PHE N N 88 118.438 118.438 124.077 -5.639 18995
2856 1 9 . 1 1 88 88 PHE C C 88 175.241 175.241 175.277 -0.036 18995
2857 1 9 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.133 1.067 18995
2858 1 9 . 1 1 88 88 PHE CB C 88 39.700 39.700 36.564 3.136 18995
2859 1 9 . 1 1 88 88 PHE H H 88 7.718 7.718 8.404 -0.686 18995
2860 1 9 . 1 1 89 89 GLU N N 89 121.366 121.366 125.073 -3.707 18995
2861 1 9 . 1 1 89 89 GLU C C 89 175.437 175.437 177.570 -2.133 18995
2862 1 9 . 1 1 89 89 GLU CA C 89 56.600 56.600 56.103 0.497 18995
2863 1 9 . 1 1 89 89 GLU CB C 89 30.300 30.300 30.639 -0.339 18995
2864 1 9 . 1 1 89 89 GLU H H 89 7.959 7.959 7.695 0.264 18995
2865 1 9 . 1 1 90 90 HIS N N 90 120.349 120.349 118.512 1.837 18995
2866 1 9 . 1 1 90 90 HIS C C 90 173.652 173.652 176.063 -2.411 18995
2867 1 9 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.883 -3.083 18995
2868 1 9 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.284 0.816 18995
2869 1 9 . 1 1 90 90 HIS H H 90 8.116 8.116 8.853 -0.737 18995
2870 1 9 . 1 1 91 91 GLU N N 91 127.965 127.965 116.254 11.711 18995
2871 1 9 . 1 1 91 91 GLU H H 91 8.235 8.235 8.269 -0.034 18995
2872 1 10 . 1 1 20 20 ARG C C 20 177.097 177.097 175.085 2.012 18995
2873 1 10 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.751 4.349 18995
2874 1 10 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.778 0.222 18995
2875 1 10 . 1 1 21 21 GLU N N 21 116.519 116.519 122.178 -5.659 18995
2876 1 10 . 1 1 21 21 GLU C C 21 175.055 175.055 175.796 -0.741 18995
2877 1 10 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.353 1.247 18995
2878 1 10 . 1 1 21 21 GLU CB C 21 35.700 35.700 33.863 1.837 18995
2879 1 10 . 1 1 21 21 GLU H H 21 9.468 9.468 9.159 0.309 18995
2880 1 10 . 1 1 22 22 GLY N N 22 122.197 122.197 111.168 11.029 18995
2881 1 10 . 1 1 22 22 GLY C C 22 180.081 180.081 174.290 5.791 18995
2882 1 10 . 1 1 22 22 GLY H H 22 10.096 10.096 9.198 0.898 18995
2883 1 10 . 1 1 23 23 ASP N N 23 113.764 113.764 126.364 -12.600 18995
2884 1 10 . 1 1 23 23 ASP C C 23 178.957 178.957 175.411 3.546 18995
2885 1 10 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.808 1.692 18995
2886 1 10 . 1 1 23 23 ASP H H 23 8.115 8.115 9.314 -1.199 18995
2887 1 10 . 1 1 24 24 LYS N N 24 131.954 131.954 127.754 4.200 18995
2888 1 10 . 1 1 24 24 LYS C C 24 176.539 176.539 175.081 1.458 18995
2889 1 10 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.196 3.004 18995
2890 1 10 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.415 -1.715 18995
2891 1 10 . 1 1 24 24 LYS H H 24 9.484 9.484 9.044 0.440 18995
2892 1 10 . 1 1 25 25 HIS N N 25 119.313 119.313 127.833 -8.520 18995
2893 1 10 . 1 1 25 25 HIS C C 25 172.815 172.815 174.385 -1.570 18995
2894 1 10 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.343 1.157 18995
2895 1 10 . 1 1 25 25 HIS CB C 25 30.800 30.800 32.382 -1.582 18995
2896 1 10 . 1 1 25 25 HIS H H 25 9.589 9.589 8.782 0.807 18995
2897 1 10 . 1 1 26 26 LYS N N 26 115.394 115.394 125.392 -9.998 18995
2898 1 10 . 1 1 26 26 LYS C C 26 174.608 174.608 175.327 -0.719 18995
2899 1 10 . 1 1 26 26 LYS CA C 26 55.400 55.400 56.756 -1.356 18995
2900 1 10 . 1 1 26 26 LYS CB C 26 39.100 39.100 32.198 6.902 18995
2901 1 10 . 1 1 26 26 LYS H H 26 7.095 7.095 7.936 -0.841 18995
2902 1 10 . 1 1 27 27 LEU N N 27 126.263 126.263 120.184 6.079 18995
2903 1 10 . 1 1 27 27 LEU C C 27 175.637 175.637 176.714 -1.077 18995
2904 1 10 . 1 1 27 27 LEU CA C 27 52.800 52.800 53.908 -1.108 18995
2905 1 10 . 1 1 27 27 LEU CB C 27 43.700 43.700 41.911 1.789 18995
2906 1 10 . 1 1 27 27 LEU H H 27 9.595 9.595 7.032 2.563 18995
2907 1 10 . 1 1 28 28 LYS N N 28 124.436 124.436 125.248 -0.812 18995
2908 1 10 . 1 1 28 28 LYS C C 28 177.395 177.395 176.198 1.197 18995
2909 1 10 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.662 -1.462 18995
2910 1 10 . 1 1 28 28 LYS H H 28 9.711 9.711 8.455 1.256 18995
2911 1 10 . 1 1 29 29 LYS N N 29 121.980 121.980 118.874 3.106 18995
2912 1 10 . 1 1 29 29 LYS C C 29 177.400 177.400 174.633 2.767 18995
2913 1 10 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.836 6.864 18995
2914 1 10 . 1 1 29 29 LYS H H 29 9.084 9.084 7.558 1.526 18995
2915 1 10 . 1 1 30 30 SER N N 30 111.519 111.519 112.996 -1.477 18995
2916 1 10 . 1 1 30 30 SER C C 30 176.950 176.950 173.183 3.767 18995
2917 1 10 . 1 1 30 30 SER CA C 30 61.100 61.100 56.552 4.548 18995
2918 1 10 . 1 1 30 30 SER CB C 30 61.300 61.300 66.049 -4.749 18995
2919 1 10 . 1 1 30 30 SER H H 30 8.267 8.267 7.094 1.173 18995
2920 1 10 . 1 1 31 31 GLU N N 31 123.792 123.792 120.241 3.551 18995
2921 1 10 . 1 1 31 31 GLU C C 31 179.463 179.463 176.816 2.647 18995
2922 1 10 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.557 4.543 18995
2923 1 10 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.442 -2.242 18995
2924 1 10 . 1 1 31 31 GLU H H 31 6.603 6.603 9.682 -3.079 18995
2925 1 10 . 1 1 32 32 LEU N N 32 121.954 121.954 124.833 -2.879 18995
2926 1 10 . 1 1 32 32 LEU C C 32 176.995 176.995 175.801 1.194 18995
2927 1 10 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.379 2.521 18995
2928 1 10 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.005 0.295 18995
2929 1 10 . 1 1 32 32 LEU H H 32 8.936 8.936 9.042 -0.106 18995
2930 1 10 . 1 1 33 33 LYS N N 33 118.576 118.576 128.665 -10.089 18995
2931 1 10 . 1 1 33 33 LYS C C 33 176.714 176.714 175.245 1.469 18995
2932 1 10 . 1 1 33 33 LYS CA C 33 60.500 60.500 55.012 5.488 18995
2933 1 10 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.159 -1.259 18995
2934 1 10 . 1 1 33 33 LYS H H 33 8.390 8.390 9.214 -0.824 18995
2935 1 10 . 1 1 34 34 GLU N N 34 116.152 116.152 128.153 -12.001 18995
2936 1 10 . 1 1 34 34 GLU C C 34 177.689 177.689 175.516 2.173 18995
2937 1 10 . 1 1 34 34 GLU CA C 34 59.400 59.400 56.026 3.374 18995
2938 1 10 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.636 -1.236 18995
2939 1 10 . 1 1 34 34 GLU H H 34 7.326 7.326 8.312 -0.986 18995
2940 1 10 . 1 1 35 35 LEU N N 35 123.632 123.632 127.655 -4.023 18995
2941 1 10 . 1 1 35 35 LEU C C 35 178.845 178.845 176.559 2.286 18995
2942 1 10 . 1 1 35 35 LEU CA C 35 59.800 59.800 51.908 7.892 18995
2943 1 10 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.047 -1.046 18995
2944 1 10 . 1 1 35 35 LEU H H 35 7.978 7.978 8.774 -0.796 18995
2945 1 10 . 1 1 36 36 ILE C C 36 178.328 178.328 175.875 2.453 18995
2946 1 10 . 1 1 36 36 ILE CA C 36 66.300 66.300 63.145 3.155 18995
2947 1 10 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.176 0.524 18995
2948 1 10 . 1 1 37 37 ASN N N 37 118.242 118.242 112.594 5.648 18995
2949 1 10 . 1 1 37 37 ASN C C 37 177.052 177.052 176.549 0.503 18995
2950 1 10 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.100 1.700 18995
2951 1 10 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.047 -0.547 18995
2952 1 10 . 1 1 37 37 ASN H H 37 8.336 8.336 8.370 -0.034 18995
2953 1 10 . 1 1 38 38 ASN N N 38 114.845 114.845 119.063 -4.218 18995
2954 1 10 . 1 1 38 38 ASN C C 38 176.578 176.578 174.509 2.069 18995
2955 1 10 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.773 2.427 18995
2956 1 10 . 1 1 38 38 ASN H H 38 8.213 8.213 8.039 0.174 18995
2957 1 10 . 1 1 39 39 GLU N N 39 113.797 113.797 121.225 -7.428 18995
2958 1 10 . 1 1 39 39 GLU C C 39 177.689 177.689 174.380 3.309 18995
2959 1 10 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.568 -1.368 18995
2960 1 10 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.038 0.262 18995
2961 1 10 . 1 1 39 39 GLU H H 39 8.522 8.522 8.237 0.285 18995
2962 1 10 . 1 1 40 40 LEU N N 40 119.982 119.982 123.534 -3.552 18995
2963 1 10 . 1 1 40 40 LEU C C 40 177.212 177.212 175.565 1.647 18995
2964 1 10 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.310 0.790 18995
2965 1 10 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.032 -1.333 18995
2966 1 10 . 1 1 40 40 LEU H H 40 7.552 7.552 8.504 -0.952 18995
2967 1 10 . 1 1 41 41 SER N N 41 114.635 114.635 120.183 -5.548 18995
2968 1 10 . 1 1 41 41 SER C C 41 175.688 175.688 172.635 3.053 18995
2969 1 10 . 1 1 41 41 SER CA C 41 60.800 60.800 56.916 3.884 18995
2970 1 10 . 1 1 41 41 SER CB C 41 64.100 64.100 66.525 -2.425 18995
2971 1 10 . 1 1 41 41 SER H H 41 7.592 7.592 8.994 -1.402 18995
2972 1 10 . 1 1 42 42 HIS N N 42 122.397 122.397 115.752 6.645 18995
2973 1 10 . 1 1 42 42 HIS C C 42 175.523 175.523 172.723 2.800 18995
2974 1 10 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.286 3.414 18995
2975 1 10 . 1 1 42 42 HIS H H 42 10.406 10.406 8.262 2.144 18995
2976 1 10 . 1 1 43 43 PHE N N 43 117.618 117.618 120.435 -2.817 18995
2977 1 10 . 1 1 43 43 PHE C C 43 177.431 177.431 175.296 2.135 18995
2978 1 10 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.788 3.012 18995
2979 1 10 . 1 1 43 43 PHE H H 43 7.785 7.785 8.308 -0.523 18995
2980 1 10 . 1 1 44 44 LEU N N 44 120.185 120.185 123.448 -3.263 18995
2981 1 10 . 1 1 44 44 LEU C C 44 175.829 175.829 176.397 -0.568 18995
2982 1 10 . 1 1 44 44 LEU CA C 44 53.800 53.800 55.621 -1.821 18995
2983 1 10 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.929 2.071 18995
2984 1 10 . 1 1 44 44 LEU H H 44 8.533 8.533 8.650 -0.117 18995
2985 1 10 . 1 1 45 45 GLU N N 45 121.499 121.499 119.355 2.144 18995
2986 1 10 . 1 1 45 45 GLU C C 45 175.060 175.060 177.274 -2.214 18995
2987 1 10 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.975 -0.375 18995
2988 1 10 . 1 1 45 45 GLU CB C 45 30.600 30.600 28.597 2.003 18995
2989 1 10 . 1 1 45 45 GLU H H 45 8.130 8.130 8.213 -0.083 18995
2990 1 10 . 1 1 46 46 GLU N N 46 122.480 122.480 125.706 -3.226 18995
2991 1 10 . 1 1 46 46 GLU C C 46 176.861 176.861 175.997 0.864 18995
2992 1 10 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.681 -0.881 18995
2993 1 10 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.213 1.487 18995
2994 1 10 . 1 1 46 46 GLU H H 46 8.123 8.123 8.660 -0.537 18995
2995 1 10 . 1 1 47 47 ILE N N 47 127.680 127.680 118.377 9.303 18995
2996 1 10 . 1 1 47 47 ILE C C 47 175.931 175.931 175.790 0.141 18995
2997 1 10 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.969 0.131 18995
2998 1 10 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.731 0.869 18995
2999 1 10 . 1 1 47 47 ILE H H 47 9.897 9.897 7.745 2.152 18995
3000 1 10 . 1 1 48 48 LYS N N 48 126.846 126.846 124.096 2.750 18995
3001 1 10 . 1 1 48 48 LYS C C 48 175.896 175.896 175.913 -0.017 18995
3002 1 10 . 1 1 48 48 LYS CA C 48 56.600 56.600 53.950 2.650 18995
3003 1 10 . 1 1 48 48 LYS CB C 48 34.700 34.700 34.216 0.484 18995
3004 1 10 . 1 1 48 48 LYS H H 48 9.077 9.077 7.418 1.659 18995
3005 1 10 . 1 1 49 49 GLU C C 49 179.470 179.470 176.905 2.565 18995
3006 1 10 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.362 -1.762 18995
3007 1 10 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.657 2.143 18995
3008 1 10 . 1 1 50 50 GLN N N 50 125.850 125.850 118.898 6.952 18995
3009 1 10 . 1 1 50 50 GLN C C 50 176.883 176.883 176.574 0.309 18995
3010 1 10 . 1 1 50 50 GLN CA C 50 58.500 58.500 58.529 -0.029 18995
3011 1 10 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.458 -0.058 18995
3012 1 10 . 1 1 50 50 GLN H H 50 9.041 9.041 8.815 0.226 18995
3013 1 10 . 1 1 51 51 GLU N N 51 117.404 117.404 113.104 4.300 18995
3014 1 10 . 1 1 51 51 GLU C C 51 178.262 178.262 175.314 2.948 18995
3015 1 10 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.833 3.867 18995
3016 1 10 . 1 1 51 51 GLU CB C 51 29.300 29.300 29.947 -0.647 18995
3017 1 10 . 1 1 51 51 GLU H H 51 9.352 9.352 7.509 1.843 18995
3018 1 10 . 1 1 52 52 VAL N N 52 118.888 118.888 122.285 -3.397 18995
3019 1 10 . 1 1 52 52 VAL C C 52 177.677 177.677 174.940 2.737 18995
3020 1 10 . 1 1 52 52 VAL CA C 52 66.100 66.100 62.197 3.903 18995
3021 1 10 . 1 1 52 52 VAL CB C 52 31.700 31.700 31.394 0.306 18995
3022 1 10 . 1 1 52 52 VAL H H 52 7.247 7.247 7.191 0.056 18995
3023 1 10 . 1 1 53 53 VAL N N 53 119.906 119.906 123.280 -3.374 18995
3024 1 10 . 1 1 53 53 VAL C C 53 176.742 176.742 174.655 2.087 18995
3025 1 10 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.473 5.727 18995
3026 1 10 . 1 1 53 53 VAL CB C 53 31.600 31.600 35.039 -3.439 18995
3027 1 10 . 1 1 53 53 VAL H H 53 7.264 7.264 8.941 -1.677 18995
3028 1 10 . 1 1 54 54 ASP N N 54 121.483 121.483 120.567 0.916 18995
3029 1 10 . 1 1 54 54 ASP C C 54 178.291 178.291 174.782 3.509 18995
3030 1 10 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.282 5.918 18995
3031 1 10 . 1 1 54 54 ASP CB C 54 40.000 40.000 43.627 -3.627 18995
3032 1 10 . 1 1 54 54 ASP H H 54 8.524 8.524 9.060 -0.536 18995
3033 1 10 . 1 1 55 55 LYS N N 55 120.875 120.875 128.101 -7.226 18995
3034 1 10 . 1 1 55 55 LYS C C 55 179.054 179.054 176.114 2.940 18995
3035 1 10 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.445 3.455 18995
3036 1 10 . 1 1 55 55 LYS CB C 55 32.200 32.200 31.620 0.580 18995
3037 1 10 . 1 1 55 55 LYS H H 55 7.580 7.580 8.950 -1.370 18995
3038 1 10 . 1 1 56 56 VAL N N 56 121.960 121.960 122.518 -0.558 18995
3039 1 10 . 1 1 56 56 VAL C C 56 178.221 178.221 175.353 2.868 18995
3040 1 10 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.362 5.638 18995
3041 1 10 . 1 1 56 56 VAL CB C 56 31.700 31.700 32.880 -1.180 18995
3042 1 10 . 1 1 56 56 VAL H H 56 8.279 8.279 7.840 0.439 18995
3043 1 10 . 1 1 57 57 MET N N 57 118.815 118.815 126.788 -7.973 18995
3044 1 10 . 1 1 57 57 MET C C 57 176.888 176.888 175.357 1.531 18995
3045 1 10 . 1 1 57 57 MET CA C 57 57.900 57.900 55.045 2.855 18995
3046 1 10 . 1 1 57 57 MET CB C 57 32.900 32.900 33.007 -0.107 18995
3047 1 10 . 1 1 57 57 MET H H 57 8.467 8.467 8.953 -0.486 18995
3048 1 10 . 1 1 58 58 GLU N N 58 117.894 117.894 125.030 -7.136 18995
3049 1 10 . 1 1 58 58 GLU C C 58 178.510 178.510 176.383 2.127 18995
3050 1 10 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.138 2.262 18995
3051 1 10 . 1 1 58 58 GLU CB C 58 29.800 29.800 31.066 -1.266 18995
3052 1 10 . 1 1 58 58 GLU H H 58 8.073 8.073 8.775 -0.702 18995
3053 1 10 . 1 1 59 59 THR N N 59 113.244 113.244 112.915 0.329 18995
3054 1 10 . 1 1 59 59 THR C C 59 174.778 174.778 172.572 2.206 18995
3055 1 10 . 1 1 59 59 THR CA C 59 65.600 65.600 60.061 5.539 18995
3056 1 10 . 1 1 59 59 THR CB C 59 69.600 69.600 71.270 -1.670 18995
3057 1 10 . 1 1 59 59 THR H H 59 7.739 7.739 7.506 0.233 18995
3058 1 10 . 1 1 60 60 LEU N N 60 119.636 119.636 123.162 -3.526 18995
3059 1 10 . 1 1 60 60 LEU C C 60 177.561 177.561 177.257 0.304 18995
3060 1 10 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.663 -1.063 18995
3061 1 10 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.131 2.169 18995
3062 1 10 . 1 1 60 60 LEU H H 60 7.643 7.643 8.668 -1.025 18995
3063 1 10 . 1 1 61 61 ASP N N 61 117.424 117.424 125.017 -7.593 18995
3064 1 10 . 1 1 61 61 ASP C C 61 175.915 175.915 174.484 1.431 18995
3065 1 10 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.954 0.646 18995
3066 1 10 . 1 1 61 61 ASP H H 61 7.984 7.984 8.642 -0.658 18995
3067 1 10 . 1 1 62 62 ASN N N 62 127.650 127.650 121.629 6.021 18995
3068 1 10 . 1 1 62 62 ASN C C 62 175.905 175.905 174.496 1.409 18995
3069 1 10 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.536 2.364 18995
3070 1 10 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.300 1.100 18995
3071 1 10 . 1 1 62 62 ASN H H 62 9.032 9.032 7.945 1.087 18995
3072 1 10 . 1 1 63 63 ASP N N 63 116.676 116.676 122.787 -6.111 18995
3073 1 10 . 1 1 63 63 ASP C C 63 177.604 177.604 174.876 2.728 18995
3074 1 10 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.983 2.417 18995
3075 1 10 . 1 1 63 63 ASP CB C 63 40.200 40.200 44.793 -4.593 18995
3076 1 10 . 1 1 63 63 ASP H H 63 8.302 8.302 9.635 -1.333 18995
3077 1 10 . 1 1 64 64 GLY N N 64 109.334 109.334 111.246 -1.912 18995
3078 1 10 . 1 1 64 64 GLY C C 64 174.834 174.834 174.720 0.114 18995
3079 1 10 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.775 3.925 18995
3080 1 10 . 1 1 64 64 GLY H H 64 7.681 7.681 8.995 -1.314 18995
3081 1 10 . 1 1 65 65 ASP N N 65 120.960 120.960 127.207 -6.247 18995
3082 1 10 . 1 1 65 65 ASP C C 65 177.010 177.010 174.664 2.346 18995
3083 1 10 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.314 -0.514 18995
3084 1 10 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.709 -0.409 18995
3085 1 10 . 1 1 65 65 ASP H H 65 8.386 8.386 9.241 -0.855 18995
3086 1 10 . 1 1 66 66 GLY N N 66 113.875 113.875 117.169 -3.294 18995
3087 1 10 . 1 1 66 66 GLY C C 66 172.343 172.343 173.937 -1.594 18995
3088 1 10 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.763 3.137 18995
3089 1 10 . 1 1 66 66 GLY H H 66 10.212 10.212 8.388 1.824 18995
3090 1 10 . 1 1 67 67 GLU N N 67 118.701 118.701 125.082 -6.381 18995
3091 1 10 . 1 1 67 67 GLU C C 67 174.711 174.711 176.348 -1.637 18995
3092 1 10 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.861 -0.660 18995
3093 1 10 . 1 1 67 67 GLU H H 67 7.949 7.949 8.830 -0.881 18995
3094 1 10 . 1 1 68 68 CYS N N 68 124.753 124.753 126.428 -1.675 18995
3095 1 10 . 1 1 68 68 CYS C C 68 174.411 174.411 175.773 -1.362 18995
3096 1 10 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.611 -5.611 18995
3097 1 10 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.969 0.131 18995
3098 1 10 . 1 1 68 68 CYS H H 68 9.486 9.486 8.430 1.056 18995
3099 1 10 . 1 1 69 69 ASP N N 69 132.376 132.376 117.752 14.624 18995
3100 1 10 . 1 1 69 69 ASP C C 69 175.307 175.307 175.479 -0.172 18995
3101 1 10 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.712 -1.412 18995
3102 1 10 . 1 1 69 69 ASP CB C 69 40.600 40.600 40.702 -0.102 18995
3103 1 10 . 1 1 69 69 ASP H H 69 9.911 9.911 8.328 1.583 18995
3104 1 10 . 1 1 70 70 PHE N N 70 119.131 119.131 119.361 -0.230 18995
3105 1 10 . 1 1 70 70 PHE C C 70 176.482 176.482 175.252 1.230 18995
3106 1 10 . 1 1 70 70 PHE CA C 70 62.900 62.900 57.939 4.961 18995
3107 1 10 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.538 -1.438 18995
3108 1 10 . 1 1 70 70 PHE H H 70 9.075 9.075 7.347 1.728 18995
3109 1 10 . 1 1 71 71 GLN N N 71 119.323 119.323 118.305 1.018 18995
3110 1 10 . 1 1 71 71 GLN C C 71 179.517 179.517 173.954 5.563 18995
3111 1 10 . 1 1 71 71 GLN CA C 71 60.100 60.100 56.992 3.108 18995
3112 1 10 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.229 0.971 18995
3113 1 10 . 1 1 71 71 GLN H H 71 8.047 8.047 8.375 -0.328 18995
3114 1 10 . 1 1 72 72 GLU N N 72 123.228 123.228 115.760 7.468 18995
3115 1 10 . 1 1 72 72 GLU C C 72 179.337 179.337 175.008 4.329 18995
3116 1 10 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.064 3.836 18995
3117 1 10 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.506 -3.206 18995
3118 1 10 . 1 1 72 72 GLU H H 72 9.061 9.061 7.297 1.764 18995
3119 1 10 . 1 1 73 73 PHE N N 73 123.155 123.155 120.069 3.086 18995
3120 1 10 . 1 1 73 73 PHE C C 73 176.497 176.497 175.480 1.017 18995
3121 1 10 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.998 2.802 18995
3122 1 10 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.618 -0.918 18995
3123 1 10 . 1 1 73 73 PHE H H 73 8.863 8.863 9.422 -0.559 18995
3124 1 10 . 1 1 74 74 MET N N 74 119.622 119.622 123.074 -3.452 18995
3125 1 10 . 1 1 74 74 MET C C 74 178.476 178.476 174.640 3.836 18995
3126 1 10 . 1 1 74 74 MET CA C 74 56.200 56.200 55.698 0.502 18995
3127 1 10 . 1 1 74 74 MET CB C 74 30.400 30.400 33.708 -3.308 18995
3128 1 10 . 1 1 74 74 MET H H 74 8.217 8.217 9.040 -0.823 18995
3129 1 10 . 1 1 75 75 ALA N N 75 123.073 123.073 128.339 -5.266 18995
3130 1 10 . 1 1 75 75 ALA C C 75 180.129 180.129 175.189 4.940 18995
3131 1 10 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.422 4.778 18995
3132 1 10 . 1 1 75 75 ALA H H 75 7.490 7.490 9.285 -1.795 18995
3133 1 10 . 1 1 76 76 PHE N N 76 122.171 122.171 123.516 -1.345 18995
3134 1 10 . 1 1 76 76 PHE C C 76 176.365 176.365 175.104 1.261 18995
3135 1 10 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.520 2.280 18995
3136 1 10 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.412 -3.812 18995
3137 1 10 . 1 1 76 76 PHE H H 76 7.676 7.676 8.355 -0.679 18995
3138 1 10 . 1 1 77 77 VAL N N 77 119.765 119.765 124.502 -4.737 18995
3139 1 10 . 1 1 77 77 VAL C C 77 179.175 179.175 177.902 1.273 18995
3140 1 10 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.361 6.439 18995
3141 1 10 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.267 -1.067 18995
3142 1 10 . 1 1 77 77 VAL H H 77 8.498 8.498 8.626 -0.128 18995
3143 1 10 . 1 1 78 78 ALA N N 78 123.880 123.880 122.318 1.562 18995
3144 1 10 . 1 1 78 78 ALA C C 78 178.630 178.630 177.669 0.961 18995
3145 1 10 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.156 0.944 18995
3146 1 10 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.652 -0.352 18995
3147 1 10 . 1 1 78 78 ALA H H 78 8.193 8.193 8.737 -0.544 18995
3148 1 10 . 1 1 79 79 MET N N 79 120.537 120.537 114.871 5.666 18995
3149 1 10 . 1 1 79 79 MET C C 79 178.430 178.430 176.797 1.633 18995
3150 1 10 . 1 1 79 79 MET CA C 79 59.500 59.500 54.890 4.610 18995
3151 1 10 . 1 1 79 79 MET CB C 79 32.800 32.800 32.269 0.531 18995
3152 1 10 . 1 1 79 79 MET H H 79 7.883 7.883 7.952 -0.069 18995
3153 1 10 . 1 1 80 80 VAL N N 80 120.374 120.374 119.308 1.066 18995
3154 1 10 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.595 4.605 18995
3155 1 10 . 1 1 80 80 VAL H H 80 8.299 8.299 7.605 0.694 18995
3156 1 10 . 1 1 82 82 THR C C 82 175.144 175.144 172.456 2.688 18995
3157 1 10 . 1 1 82 82 THR CA C 82 65.800 65.800 61.297 4.503 18995
3158 1 10 . 1 1 83 83 ALA N N 83 123.244 123.244 123.179 0.065 18995
3159 1 10 . 1 1 83 83 ALA C C 83 178.574 178.574 175.104 3.470 18995
3160 1 10 . 1 1 83 83 ALA CA C 83 53.900 53.900 50.110 3.790 18995
3161 1 10 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.959 -2.959 18995
3162 1 10 . 1 1 83 83 ALA H H 83 7.587 7.587 8.747 -1.160 18995
3163 1 10 . 1 1 84 84 CYS N N 84 116.910 116.910 116.703 0.207 18995
3164 1 10 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.447 2.353 18995
3165 1 10 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.609 -1.709 18995
3166 1 10 . 1 1 84 84 CYS H H 84 7.788 7.788 8.575 -0.787 18995
3167 1 10 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.109 1.491 18995
3168 1 10 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.108 -0.708 18995
3169 1 10 . 1 1 87 87 PHE N N 87 118.550 118.550 120.196 -1.646 18995
3170 1 10 . 1 1 87 87 PHE C C 87 175.597 175.597 174.749 0.848 18995
3171 1 10 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.205 1.895 18995
3172 1 10 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.139 -0.739 18995
3173 1 10 . 1 1 87 87 PHE H H 87 7.838 7.838 7.541 0.297 18995
3174 1 10 . 1 1 88 88 PHE N N 88 118.438 118.438 126.298 -7.860 18995
3175 1 10 . 1 1 88 88 PHE C C 88 175.241 175.241 176.030 -0.789 18995
3176 1 10 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.616 0.584 18995
3177 1 10 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.473 2.227 18995
3178 1 10 . 1 1 88 88 PHE H H 88 7.718 7.718 8.503 -0.785 18995
3179 1 10 . 1 1 89 89 GLU N N 89 121.366 121.366 126.117 -4.751 18995
3180 1 10 . 1 1 89 89 GLU C C 89 175.437 175.437 176.925 -1.488 18995
3181 1 10 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.289 2.311 18995
3182 1 10 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.083 -0.783 18995
3183 1 10 . 1 1 89 89 GLU H H 89 7.959 7.959 7.885 0.074 18995
3184 1 10 . 1 1 90 90 HIS N N 90 120.349 120.349 115.815 4.534 18995
3185 1 10 . 1 1 90 90 HIS C C 90 173.652 173.652 175.419 -1.767 18995
3186 1 10 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.020 -2.220 18995
3187 1 10 . 1 1 90 90 HIS CB C 90 30.100 30.100 28.962 1.138 18995
3188 1 10 . 1 1 90 90 HIS H H 90 8.116 8.116 8.599 -0.483 18995
3189 1 10 . 1 1 91 91 GLU N N 91 127.965 127.965 117.817 10.148 18995
3190 1 10 . 1 1 91 91 GLU H H 91 8.235 8.235 7.430 0.805 18995
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 65 5.952 1.238 5.867 18995
2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18995
3 1 1 "Average Difference" C 66 2.456 -1.548 1.922 18995
4 1 1 "Average Difference" CA 68 3.468 -2.303 2.613 18995
5 1 1 "Average Difference" CB 55 2.174 0.511 2.133 18995
6 1 1 "Average Difference" HN 65 1.090 0.093 1.094 18995
7 1 2 "Average Difference" N 65 6.025 1.122 5.966 18995
8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18995
9 1 2 "Average Difference" C 66 2.394 -1.477 1.899 18995
10 1 2 "Average Difference" CA 68 3.432 -2.250 2.611 18995
11 1 2 "Average Difference" CB 55 2.007 0.495 1.962 18995
12 1 2 "Average Difference" HN 65 1.107 0.068 1.114 18995
13 1 3 "Average Difference" N 65 5.930 1.101 5.872 18995
14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18995
15 1 3 "Average Difference" C 66 2.412 -1.586 1.832 18995
16 1 3 "Average Difference" CA 68 3.468 -2.335 2.583 18995
17 1 3 "Average Difference" CB 55 2.275 0.492 2.242 18995
18 1 3 "Average Difference" HN 65 1.080 0.086 1.085 18995
19 1 4 "Average Difference" N 65 6.023 1.109 5.966 18995
20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18995
21 1 4 "Average Difference" C 66 2.379 -1.555 1.814 18995
22 1 4 "Average Difference" CA 68 3.414 -2.275 2.565 18995
23 1 4 "Average Difference" CB 55 2.083 0.515 2.037 18995
24 1 4 "Average Difference" HN 65 1.131 0.051 1.139 18995
25 1 5 "Average Difference" N 65 5.939 1.087 5.884 18995
26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18995
27 1 5 "Average Difference" C 66 2.392 -1.499 1.878 18995
28 1 5 "Average Difference" CA 68 3.453 -2.326 2.571 18995
29 1 5 "Average Difference" CB 55 2.121 0.578 2.060 18995
30 1 5 "Average Difference" HN 65 1.117 0.066 1.124 18995
31 1 6 "Average Difference" N 65 5.820 1.215 5.736 18995
32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18995
33 1 6 "Average Difference" C 66 2.405 -1.547 1.856 18995
34 1 6 "Average Difference" CA 68 3.459 -2.331 2.575 18995
35 1 6 "Average Difference" CB 55 2.154 0.483 2.119 18995
36 1 6 "Average Difference" HN 65 1.084 0.059 1.091 18995
37 1 7 "Average Difference" N 65 5.902 1.098 5.844 18995
38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18995
39 1 7 "Average Difference" C 66 2.382 -1.495 1.869 18995
40 1 7 "Average Difference" CA 68 3.441 -2.275 2.601 18995
41 1 7 "Average Difference" CB 55 2.141 0.517 2.097 18995
42 1 7 "Average Difference" HN 65 1.099 0.065 1.106 18995
43 1 8 "Average Difference" N 65 6.004 1.126 5.943 18995
44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18995
45 1 8 "Average Difference" C 66 2.463 -1.576 1.907 18995
46 1 8 "Average Difference" CA 68 3.485 -2.302 2.636 18995
47 1 8 "Average Difference" CB 55 2.226 0.522 2.184 18995
48 1 8 "Average Difference" HN 65 1.083 0.097 1.087 18995
49 1 9 "Average Difference" N 65 6.002 1.006 5.963 18995
50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18995
51 1 9 "Average Difference" C 66 2.385 -1.512 1.859 18995
52 1 9 "Average Difference" CA 68 3.466 -2.299 2.612 18995
53 1 9 "Average Difference" CB 55 2.105 0.501 2.063 18995
54 1 9 "Average Difference" HN 65 1.097 0.089 1.102 18995
55 1 10 "Average Difference" N 65 5.876 1.098 5.817 18995
56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18995
57 1 10 "Average Difference" C 66 2.365 -1.527 1.820 18995
58 1 10 "Average Difference" CA 68 3.416 -2.259 2.581 18995
59 1 10 "Average Difference" CB 55 2.069 0.476 2.032 18995
60 1 10 "Average Difference" HN 65 1.125 0.021 1.134 18995
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 18995
_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 20 20 ARG C C 20 177.097 177.097 174.987 2.110 18995
2 1 . 1 1 20 20 ARG CA C 20 60.100 60.100 55.731 4.369 18995
3 1 . 1 1 20 20 ARG CB C 20 31.000 31.000 30.942 0.058 18995
4 1 . 1 1 21 21 GLU N N 21 116.519 116.519 120.627 -4.108 18995
5 1 . 1 1 21 21 GLU C C 21 175.055 175.055 175.672 -0.617 18995
6 1 . 1 1 21 21 GLU CA C 21 55.600 55.600 54.570 1.030 18995
7 1 . 1 1 21 21 GLU CB C 21 35.700 35.700 34.044 1.656 18995
8 1 . 1 1 21 21 GLU H H 21 9.468 9.468 9.127 0.341 18995
9 1 . 1 1 22 22 GLY N N 22 122.197 122.197 110.525 11.672 18995
10 1 . 1 1 22 22 GLY C C 22 180.081 180.081 173.940 6.141 18995
11 1 . 1 1 22 22 GLY H H 22 10.096 10.096 9.225 0.871 18995
12 1 . 1 1 23 23 ASP N N 23 113.764 113.764 126.216 -12.452 18995
13 1 . 1 1 23 23 ASP C C 23 178.957 178.957 175.391 3.566 18995
14 1 . 1 1 23 23 ASP CA C 23 55.500 55.500 53.531 1.969 18995
15 1 . 1 1 23 23 ASP H H 23 8.115 8.115 9.296 -1.181 18995
16 1 . 1 1 24 24 LYS N N 24 131.954 131.954 127.808 4.146 18995
17 1 . 1 1 24 24 LYS C C 24 176.539 176.539 175.303 1.236 18995
18 1 . 1 1 24 24 LYS CA C 24 58.200 58.200 55.251 2.949 18995
19 1 . 1 1 24 24 LYS CB C 24 31.700 31.700 33.586 -1.886 18995
20 1 . 1 1 24 24 LYS H H 24 9.484 9.484 9.066 0.418 18995
21 1 . 1 1 25 25 HIS N N 25 119.313 119.313 128.296 -8.983 18995
22 1 . 1 1 25 25 HIS C C 25 172.815 172.815 174.640 -1.825 18995
23 1 . 1 1 25 25 HIS CA C 25 55.500 55.500 54.645 0.855 18995
24 1 . 1 1 25 25 HIS CB C 25 30.800 30.800 32.024 -1.225 18995
25 1 . 1 1 25 25 HIS H H 25 9.589 9.589 8.806 0.783 18995
26 1 . 1 1 26 26 LYS N N 26 115.394 115.394 126.649 -11.255 18995
27 1 . 1 1 26 26 LYS C C 26 174.608 174.608 175.121 -0.513 18995
28 1 . 1 1 26 26 LYS CA C 26 55.400 55.400 56.681 -1.280 18995
29 1 . 1 1 26 26 LYS CB C 26 39.100 39.100 31.783 7.317 18995
30 1 . 1 1 26 26 LYS H H 26 7.095 7.095 8.129 -1.034 18995
31 1 . 1 1 27 27 LEU N N 27 126.263 126.263 120.100 6.163 18995
32 1 . 1 1 27 27 LEU C C 27 175.637 175.637 176.280 -0.644 18995
33 1 . 1 1 27 27 LEU CA C 27 52.800 52.800 54.163 -1.363 18995
34 1 . 1 1 27 27 LEU CB C 27 43.700 43.700 42.219 1.481 18995
35 1 . 1 1 27 27 LEU H H 27 9.595 9.595 7.091 2.504 18995
36 1 . 1 1 28 28 LYS N N 28 124.436 124.436 124.145 0.291 18995
37 1 . 1 1 28 28 LYS C C 28 177.395 177.395 176.086 1.309 18995
38 1 . 1 1 28 28 LYS CA C 28 55.200 55.200 56.415 -1.215 18995
39 1 . 1 1 28 28 LYS H H 28 9.711 9.711 8.535 1.176 18995
40 1 . 1 1 29 29 LYS N N 29 121.980 121.980 118.929 3.051 18995
41 1 . 1 1 29 29 LYS C C 29 177.400 177.400 174.807 2.593 18995
42 1 . 1 1 29 29 LYS CA C 29 62.700 62.700 55.913 6.787 18995
43 1 . 1 1 29 29 LYS H H 29 9.084 9.084 7.476 1.608 18995
44 1 . 1 1 30 30 SER N N 30 111.519 111.519 113.305 -1.786 18995
45 1 . 1 1 30 30 SER C C 30 176.950 176.950 173.098 3.852 18995
46 1 . 1 1 30 30 SER CA C 30 61.100 61.100 56.582 4.518 18995
47 1 . 1 1 30 30 SER CB C 30 61.300 61.300 65.745 -4.445 18995
48 1 . 1 1 30 30 SER H H 30 8.267 8.267 7.122 1.145 18995
49 1 . 1 1 31 31 GLU N N 31 123.792 123.792 119.970 3.822 18995
50 1 . 1 1 31 31 GLU C C 31 179.463 179.463 176.845 2.618 18995
51 1 . 1 1 31 31 GLU CA C 31 60.100 60.100 55.358 4.742 18995
52 1 . 1 1 31 31 GLU CB C 31 29.200 29.200 31.473 -2.273 18995
53 1 . 1 1 31 31 GLU H H 31 6.603 6.603 9.572 -2.969 18995
54 1 . 1 1 32 32 LEU N N 32 121.954 121.954 124.918 -2.964 18995
55 1 . 1 1 32 32 LEU C C 32 176.995 176.995 175.661 1.334 18995
56 1 . 1 1 32 32 LEU CA C 32 57.900 57.900 55.448 2.452 18995
57 1 . 1 1 32 32 LEU CB C 32 42.300 42.300 42.205 0.095 18995
58 1 . 1 1 32 32 LEU H H 32 8.936 8.936 8.980 -0.044 18995
59 1 . 1 1 33 33 LYS N N 33 118.576 118.576 128.609 -10.033 18995
60 1 . 1 1 33 33 LYS C C 33 176.714 176.714 175.073 1.641 18995
61 1 . 1 1 33 33 LYS CA C 33 60.500 60.500 54.777 5.723 18995
62 1 . 1 1 33 33 LYS CB C 33 32.900 32.900 34.532 -1.632 18995
63 1 . 1 1 33 33 LYS H H 33 8.390 8.390 9.270 -0.880 18995
64 1 . 1 1 34 34 GLU N N 34 116.152 116.152 128.191 -12.039 18995
65 1 . 1 1 34 34 GLU C C 34 177.689 177.689 175.452 2.237 18995
66 1 . 1 1 34 34 GLU CA C 34 59.400 59.400 55.972 3.428 18995
67 1 . 1 1 34 34 GLU CB C 34 29.400 29.400 30.872 -1.472 18995
68 1 . 1 1 34 34 GLU H H 34 7.326 7.326 8.213 -0.887 18995
69 1 . 1 1 35 35 LEU N N 35 123.632 123.632 127.626 -3.994 18995
70 1 . 1 1 35 35 LEU C C 35 178.845 178.845 176.395 2.450 18995
71 1 . 1 1 35 35 LEU CA C 35 59.800 59.800 52.429 7.370 18995
72 1 . 1 1 35 35 LEU CB C 35 42.000 42.000 43.218 -1.218 18995
73 1 . 1 1 35 35 LEU H H 35 7.978 7.978 8.931 -0.954 18995
74 1 . 1 1 36 36 ILE C C 36 178.328 178.328 175.921 2.407 18995
75 1 . 1 1 36 36 ILE CA C 36 66.300 66.300 63.054 3.245 18995
76 1 . 1 1 36 36 ILE CB C 36 38.700 38.700 38.262 0.438 18995
77 1 . 1 1 37 37 ASN N N 37 118.242 118.242 112.806 5.436 18995
78 1 . 1 1 37 37 ASN C C 37 177.052 177.052 176.640 0.412 18995
79 1 . 1 1 37 37 ASN CA C 37 54.800 54.800 53.189 1.611 18995
80 1 . 1 1 37 37 ASN CB C 37 37.500 37.500 38.045 -0.545 18995
81 1 . 1 1 37 37 ASN H H 37 8.336 8.336 8.423 -0.087 18995
82 1 . 1 1 38 38 ASN N N 38 114.845 114.845 118.945 -4.100 18995
83 1 . 1 1 38 38 ASN C C 38 176.578 176.578 174.592 1.986 18995
84 1 . 1 1 38 38 ASN CA C 38 55.200 55.200 52.753 2.447 18995
85 1 . 1 1 38 38 ASN H H 38 8.213 8.213 8.037 0.175 18995
86 1 . 1 1 39 39 GLU N N 39 113.797 113.797 120.987 -7.189 18995
87 1 . 1 1 39 39 GLU C C 39 177.689 177.689 174.455 3.234 18995
88 1 . 1 1 39 39 GLU CA C 39 55.200 55.200 56.638 -1.438 18995
89 1 . 1 1 39 39 GLU CB C 39 31.300 31.300 31.117 0.183 18995
90 1 . 1 1 39 39 GLU H H 39 8.522 8.522 8.365 0.157 18995
91 1 . 1 1 40 40 LEU N N 40 119.982 119.982 122.739 -2.757 18995
92 1 . 1 1 40 40 LEU C C 40 177.212 177.212 175.556 1.656 18995
93 1 . 1 1 40 40 LEU CA C 40 54.100 54.100 53.415 0.685 18995
94 1 . 1 1 40 40 LEU CB C 40 42.700 42.700 44.222 -1.522 18995
95 1 . 1 1 40 40 LEU H H 40 7.552 7.552 8.533 -0.981 18995
96 1 . 1 1 41 41 SER N N 41 114.635 114.635 120.328 -5.693 18995
97 1 . 1 1 41 41 SER C C 41 175.688 175.688 172.594 3.094 18995
98 1 . 1 1 41 41 SER CA C 41 60.800 60.800 56.907 3.893 18995
99 1 . 1 1 41 41 SER CB C 41 64.100 64.100 66.832 -2.732 18995
100 1 . 1 1 41 41 SER H H 41 7.592 7.592 9.069 -1.477 18995
101 1 . 1 1 42 42 HIS N N 42 122.397 122.397 115.651 6.746 18995
102 1 . 1 1 42 42 HIS C C 42 175.523 175.523 172.665 2.858 18995
103 1 . 1 1 42 42 HIS CA C 42 58.700 58.700 55.210 3.491 18995
104 1 . 1 1 42 42 HIS H H 42 10.406 10.406 8.312 2.094 18995
105 1 . 1 1 43 43 PHE N N 43 117.618 117.618 121.660 -4.042 18995
106 1 . 1 1 43 43 PHE C C 43 177.431 177.431 175.795 1.636 18995
107 1 . 1 1 43 43 PHE CA C 43 58.800 58.800 55.610 3.190 18995
108 1 . 1 1 43 43 PHE H H 43 7.785 7.785 8.510 -0.725 18995
109 1 . 1 1 44 44 LEU N N 44 120.185 120.185 126.101 -5.916 18995
110 1 . 1 1 44 44 LEU C C 44 175.829 175.829 176.404 -0.575 18995
111 1 . 1 1 44 44 LEU CA C 44 53.800 53.800 56.329 -2.529 18995
112 1 . 1 1 44 44 LEU CB C 44 45.000 45.000 42.602 2.398 18995
113 1 . 1 1 44 44 LEU H H 44 8.533 8.533 8.770 -0.237 18995
114 1 . 1 1 45 45 GLU N N 45 121.499 121.499 119.714 1.785 18995
115 1 . 1 1 45 45 GLU C C 45 175.060 175.060 177.352 -2.292 18995
116 1 . 1 1 45 45 GLU CA C 45 56.600 56.600 56.716 -0.116 18995
117 1 . 1 1 45 45 GLU CB C 45 30.600 30.600 29.011 1.589 18995
118 1 . 1 1 45 45 GLU H H 45 8.130 8.130 8.342 -0.212 18995
119 1 . 1 1 46 46 GLU N N 46 122.480 122.480 125.125 -2.645 18995
120 1 . 1 1 46 46 GLU C C 46 176.861 176.861 176.035 0.826 18995
121 1 . 1 1 46 46 GLU CA C 46 56.800 56.800 57.447 -0.647 18995
122 1 . 1 1 46 46 GLU CB C 46 30.700 30.700 29.097 1.603 18995
123 1 . 1 1 46 46 GLU H H 46 8.123 8.123 8.611 -0.488 18995
124 1 . 1 1 47 47 ILE N N 47 127.680 127.680 118.873 8.808 18995
125 1 . 1 1 47 47 ILE C C 47 175.931 175.931 175.775 0.156 18995
126 1 . 1 1 47 47 ILE CA C 47 62.100 62.100 61.485 0.615 18995
127 1 . 1 1 47 47 ILE CB C 47 38.600 38.600 37.842 0.758 18995
128 1 . 1 1 47 47 ILE H H 47 9.897 9.897 7.750 2.147 18995
129 1 . 1 1 48 48 LYS N N 48 126.846 126.846 123.936 2.910 18995
130 1 . 1 1 48 48 LYS C C 48 175.896 175.896 175.869 0.027 18995
131 1 . 1 1 48 48 LYS CA C 48 56.600 56.600 54.006 2.593 18995
132 1 . 1 1 48 48 LYS CB C 48 34.700 34.700 34.115 0.585 18995
133 1 . 1 1 48 48 LYS H H 48 9.077 9.077 7.427 1.650 18995
134 1 . 1 1 49 49 GLU C C 49 179.470 179.470 176.454 3.016 18995
135 1 . 1 1 49 49 GLU CA C 49 55.600 55.600 57.214 -1.614 18995
136 1 . 1 1 49 49 GLU CB C 49 31.800 31.800 29.486 2.314 18995
137 1 . 1 1 50 50 GLN N N 50 125.850 125.850 119.011 6.839 18995
138 1 . 1 1 50 50 GLN C C 50 176.883 176.883 176.671 0.212 18995
139 1 . 1 1 50 50 GLN CA C 50 58.500 58.500 57.659 0.841 18995
140 1 . 1 1 50 50 GLN CB C 50 28.400 28.400 28.726 -0.326 18995
141 1 . 1 1 50 50 GLN H H 50 9.041 9.041 8.762 0.279 18995
142 1 . 1 1 51 51 GLU N N 51 117.404 117.404 112.663 4.741 18995
143 1 . 1 1 51 51 GLU C C 51 178.262 178.262 175.433 2.829 18995
144 1 . 1 1 51 51 GLU CA C 51 59.700 59.700 55.688 4.012 18995
145 1 . 1 1 51 51 GLU CB C 51 29.300 29.300 30.008 -0.708 18995
146 1 . 1 1 51 51 GLU H H 51 9.352 9.352 7.421 1.931 18995
147 1 . 1 1 52 52 VAL N N 52 118.888 118.888 122.364 -3.476 18995
148 1 . 1 1 52 52 VAL C C 52 177.677 177.677 174.704 2.973 18995
149 1 . 1 1 52 52 VAL CA C 52 66.100 66.100 61.744 4.356 18995
150 1 . 1 1 52 52 VAL CB C 52 31.700 31.700 30.914 0.786 18995
151 1 . 1 1 52 52 VAL H H 52 7.247 7.247 7.300 -0.053 18995
152 1 . 1 1 53 53 VAL N N 53 119.906 119.906 123.423 -3.517 18995
153 1 . 1 1 53 53 VAL C C 53 176.742 176.742 174.839 1.903 18995
154 1 . 1 1 53 53 VAL CA C 53 66.200 66.200 60.649 5.551 18995
155 1 . 1 1 53 53 VAL CB C 53 31.600 31.600 34.636 -3.036 18995
156 1 . 1 1 53 53 VAL H H 53 7.264 7.264 8.643 -1.379 18995
157 1 . 1 1 54 54 ASP N N 54 121.483 121.483 120.796 0.687 18995
158 1 . 1 1 54 54 ASP C C 54 178.291 178.291 174.568 3.723 18995
159 1 . 1 1 54 54 ASP CA C 54 58.200 58.200 52.285 5.915 18995
160 1 . 1 1 54 54 ASP CB C 54 40.000 40.000 44.122 -4.122 18995
161 1 . 1 1 54 54 ASP H H 54 8.524 8.524 9.091 -0.567 18995
162 1 . 1 1 55 55 LYS N N 55 120.875 120.875 127.883 -7.008 18995
163 1 . 1 1 55 55 LYS C C 55 179.054 179.054 176.244 2.810 18995
164 1 . 1 1 55 55 LYS CA C 55 58.900 58.900 55.479 3.421 18995
165 1 . 1 1 55 55 LYS CB C 55 32.200 32.200 32.120 0.080 18995
166 1 . 1 1 55 55 LYS H H 55 7.580 7.580 8.898 -1.318 18995
167 1 . 1 1 56 56 VAL N N 56 121.960 121.960 123.529 -1.569 18995
168 1 . 1 1 56 56 VAL C C 56 178.221 178.221 175.133 3.087 18995
169 1 . 1 1 56 56 VAL CA C 56 67.000 67.000 61.390 5.610 18995
170 1 . 1 1 56 56 VAL CB C 56 31.700 31.700 33.355 -1.655 18995
171 1 . 1 1 56 56 VAL H H 56 8.279 8.279 8.452 -0.173 18995
172 1 . 1 1 57 57 MET N N 57 118.815 118.815 126.117 -7.302 18995
173 1 . 1 1 57 57 MET C C 57 176.888 176.888 175.326 1.562 18995
174 1 . 1 1 57 57 MET CA C 57 57.900 57.900 54.542 3.358 18995
175 1 . 1 1 57 57 MET CB C 57 32.900 32.900 33.110 -0.210 18995
176 1 . 1 1 57 57 MET H H 57 8.467 8.467 8.909 -0.442 18995
177 1 . 1 1 58 58 GLU N N 58 117.894 117.894 125.523 -7.629 18995
178 1 . 1 1 58 58 GLU C C 58 178.510 178.510 176.427 2.083 18995
179 1 . 1 1 58 58 GLU CA C 58 59.400 59.400 57.235 2.165 18995
180 1 . 1 1 58 58 GLU CB C 58 29.800 29.800 30.922 -1.122 18995
181 1 . 1 1 58 58 GLU H H 58 8.073 8.073 8.782 -0.709 18995
182 1 . 1 1 59 59 THR N N 59 113.244 113.244 112.935 0.309 18995
183 1 . 1 1 59 59 THR C C 59 174.778 174.778 172.761 2.017 18995
184 1 . 1 1 59 59 THR CA C 59 65.600 65.600 59.942 5.658 18995
185 1 . 1 1 59 59 THR CB C 59 69.600 69.600 71.093 -1.493 18995
186 1 . 1 1 59 59 THR H H 59 7.739 7.739 7.498 0.241 18995
187 1 . 1 1 60 60 LEU N N 60 119.636 119.636 123.495 -3.859 18995
188 1 . 1 1 60 60 LEU C C 60 177.561 177.561 177.294 0.267 18995
189 1 . 1 1 60 60 LEU CA C 60 55.600 55.600 56.590 -0.990 18995
190 1 . 1 1 60 60 LEU CB C 60 43.300 43.300 41.103 2.197 18995
191 1 . 1 1 60 60 LEU H H 60 7.643 7.643 8.697 -1.054 18995
192 1 . 1 1 61 61 ASP N N 61 117.424 117.424 125.053 -7.629 18995
193 1 . 1 1 61 61 ASP C C 61 175.915 175.915 174.602 1.313 18995
194 1 . 1 1 61 61 ASP CA C 61 54.600 54.600 53.848 0.752 18995
195 1 . 1 1 61 61 ASP H H 61 7.984 7.984 8.632 -0.648 18995
196 1 . 1 1 62 62 ASN N N 62 127.650 127.650 122.177 5.473 18995
197 1 . 1 1 62 62 ASN C C 62 175.905 175.905 174.419 1.486 18995
198 1 . 1 1 62 62 ASN CA C 62 54.900 54.900 52.894 2.006 18995
199 1 . 1 1 62 62 ASN CB C 62 40.400 40.400 39.462 0.938 18995
200 1 . 1 1 62 62 ASN H H 62 9.032 9.032 8.099 0.933 18995
201 1 . 1 1 63 63 ASP N N 63 116.676 116.676 123.323 -6.647 18995
202 1 . 1 1 63 63 ASP C C 63 177.604 177.604 174.983 2.621 18995
203 1 . 1 1 63 63 ASP CA C 63 53.400 53.400 50.763 2.638 18995
204 1 . 1 1 63 63 ASP CB C 63 40.200 40.200 44.964 -4.764 18995
205 1 . 1 1 63 63 ASP H H 63 8.302 8.302 9.630 -1.328 18995
206 1 . 1 1 64 64 GLY N N 64 109.334 109.334 110.763 -1.429 18995
207 1 . 1 1 64 64 GLY C C 64 174.834 174.834 174.604 0.230 18995
208 1 . 1 1 64 64 GLY CA C 64 47.700 47.700 43.485 4.214 18995
209 1 . 1 1 64 64 GLY H H 64 7.681 7.681 9.095 -1.414 18995
210 1 . 1 1 65 65 ASP N N 65 120.960 120.960 126.864 -5.904 18995
211 1 . 1 1 65 65 ASP C C 65 177.010 177.010 174.704 2.306 18995
212 1 . 1 1 65 65 ASP CA C 65 53.800 53.800 54.080 -0.280 18995
213 1 . 1 1 65 65 ASP CB C 65 40.300 40.300 40.799 -0.498 18995
214 1 . 1 1 65 65 ASP H H 65 8.386 8.386 9.268 -0.882 18995
215 1 . 1 1 66 66 GLY N N 66 113.875 113.875 117.351 -3.476 18995
216 1 . 1 1 66 66 GLY C C 66 172.343 172.343 174.106 -1.763 18995
217 1 . 1 1 66 66 GLY CA C 66 45.900 45.900 42.798 3.102 18995
218 1 . 1 1 66 66 GLY H H 66 10.212 10.212 8.871 1.341 18995
219 1 . 1 1 67 67 GLU N N 67 118.701 118.701 125.461 -6.760 18995
220 1 . 1 1 67 67 GLU C C 67 174.711 174.711 176.232 -1.521 18995
221 1 . 1 1 67 67 GLU CA C 67 55.200 55.200 55.851 -0.651 18995
222 1 . 1 1 67 67 GLU H H 67 7.949 7.949 8.952 -1.003 18995
223 1 . 1 1 68 68 CYS N N 68 124.753 124.753 126.718 -1.965 18995
224 1 . 1 1 68 68 CYS C C 68 174.411 174.411 176.215 -1.804 18995
225 1 . 1 1 68 68 CYS CA C 68 57.000 57.000 62.486 -5.486 18995
226 1 . 1 1 68 68 CYS CB C 68 28.100 28.100 27.883 0.217 18995
227 1 . 1 1 68 68 CYS H H 68 9.486 9.486 8.661 0.825 18995
228 1 . 1 1 69 69 ASP N N 69 132.376 132.376 118.327 14.049 18995
229 1 . 1 1 69 69 ASP C C 69 175.307 175.307 175.532 -0.225 18995
230 1 . 1 1 69 69 ASP CA C 69 53.300 53.300 54.657 -1.357 18995
231 1 . 1 1 69 69 ASP CB C 69 40.600 40.600 40.224 0.376 18995
232 1 . 1 1 69 69 ASP H H 69 9.911 9.911 8.389 1.522 18995
233 1 . 1 1 70 70 PHE N N 70 119.131 119.131 119.716 -0.585 18995
234 1 . 1 1 70 70 PHE C C 70 176.482 176.482 175.022 1.460 18995
235 1 . 1 1 70 70 PHE CA C 70 62.900 62.900 58.132 4.768 18995
236 1 . 1 1 70 70 PHE CB C 70 39.100 39.100 40.513 -1.413 18995
237 1 . 1 1 70 70 PHE H H 70 9.075 9.075 7.713 1.362 18995
238 1 . 1 1 71 71 GLN N N 71 119.323 119.323 117.947 1.377 18995
239 1 . 1 1 71 71 GLN C C 71 179.517 179.517 173.995 5.522 18995
240 1 . 1 1 71 71 GLN CA C 71 60.100 60.100 57.002 3.098 18995
241 1 . 1 1 71 71 GLN CB C 71 28.200 28.200 27.558 0.642 18995
242 1 . 1 1 71 71 GLN H H 71 8.047 8.047 8.398 -0.351 18995
243 1 . 1 1 72 72 GLU N N 72 123.228 123.228 115.789 7.439 18995
244 1 . 1 1 72 72 GLU C C 72 179.337 179.337 175.033 4.304 18995
245 1 . 1 1 72 72 GLU CA C 72 58.900 58.900 55.005 3.895 18995
246 1 . 1 1 72 72 GLU CB C 72 30.300 30.300 33.186 -2.886 18995
247 1 . 1 1 72 72 GLU H H 72 9.061 9.061 7.253 1.808 18995
248 1 . 1 1 73 73 PHE N N 73 123.155 123.155 119.203 3.952 18995
249 1 . 1 1 73 73 PHE C C 73 176.497 176.497 175.476 1.021 18995
250 1 . 1 1 73 73 PHE CA C 73 60.800 60.800 57.448 3.352 18995
251 1 . 1 1 73 73 PHE CB C 73 39.700 39.700 40.614 -0.914 18995
252 1 . 1 1 73 73 PHE H H 73 8.863 8.863 9.379 -0.516 18995
253 1 . 1 1 74 74 MET N N 74 119.622 119.622 122.910 -3.288 18995
254 1 . 1 1 74 74 MET C C 74 178.476 178.476 174.755 3.721 18995
255 1 . 1 1 74 74 MET CA C 74 56.200 56.200 55.744 0.456 18995
256 1 . 1 1 74 74 MET CB C 74 30.400 30.400 33.552 -3.152 18995
257 1 . 1 1 74 74 MET H H 74 8.217 8.217 9.047 -0.831 18995
258 1 . 1 1 75 75 ALA N N 75 123.073 123.073 128.531 -5.458 18995
259 1 . 1 1 75 75 ALA C C 75 180.129 180.129 175.159 4.970 18995
260 1 . 1 1 75 75 ALA CA C 75 55.200 55.200 50.381 4.819 18995
261 1 . 1 1 75 75 ALA H H 75 7.490 7.490 9.302 -1.812 18995
262 1 . 1 1 76 76 PHE N N 76 122.171 122.171 122.552 -0.381 18995
263 1 . 1 1 76 76 PHE C C 76 176.365 176.365 174.993 1.372 18995
264 1 . 1 1 76 76 PHE CA C 76 59.800 59.800 57.346 2.454 18995
265 1 . 1 1 76 76 PHE CB C 76 38.600 38.600 42.788 -4.188 18995
266 1 . 1 1 76 76 PHE H H 76 7.676 7.676 8.271 -0.595 18995
267 1 . 1 1 77 77 VAL N N 77 119.765 119.765 124.236 -4.471 18995
268 1 . 1 1 77 77 VAL C C 77 179.175 179.175 177.699 1.476 18995
269 1 . 1 1 77 77 VAL CA C 77 66.800 66.800 60.370 6.430 18995
270 1 . 1 1 77 77 VAL CB C 77 31.200 31.200 32.353 -1.153 18995
271 1 . 1 1 77 77 VAL H H 77 8.498 8.498 8.691 -0.193 18995
272 1 . 1 1 78 78 ALA N N 78 123.880 123.880 122.376 1.504 18995
273 1 . 1 1 78 78 ALA C C 78 178.630 178.630 177.504 1.126 18995
274 1 . 1 1 78 78 ALA CA C 78 56.100 56.100 55.093 1.007 18995
275 1 . 1 1 78 78 ALA CB C 78 18.300 18.300 18.655 -0.355 18995
276 1 . 1 1 78 78 ALA H H 78 8.193 8.193 8.783 -0.590 18995
277 1 . 1 1 79 79 MET N N 79 120.537 120.537 114.228 6.309 18995
278 1 . 1 1 79 79 MET C C 79 178.430 178.430 176.795 1.635 18995
279 1 . 1 1 79 79 MET CA C 79 59.500 59.500 54.689 4.811 18995
280 1 . 1 1 79 79 MET CB C 79 32.800 32.800 32.145 0.655 18995
281 1 . 1 1 79 79 MET H H 79 7.883 7.883 7.838 0.045 18995
282 1 . 1 1 80 80 VAL N N 80 120.374 120.374 119.314 1.060 18995
283 1 . 1 1 80 80 VAL CA C 80 66.200 66.200 61.682 4.518 18995
284 1 . 1 1 80 80 VAL H H 80 8.299 8.299 7.722 0.577 18995
285 1 . 1 1 82 82 THR C C 82 175.144 175.144 172.594 2.550 18995
286 1 . 1 1 82 82 THR CA C 82 65.800 65.800 61.197 4.603 18995
287 1 . 1 1 83 83 ALA N N 83 123.244 123.244 123.030 0.214 18995
288 1 . 1 1 83 83 ALA C C 83 178.574 178.574 175.187 3.387 18995
289 1 . 1 1 83 83 ALA CA C 83 53.900 53.900 49.997 3.903 18995
290 1 . 1 1 83 83 ALA CB C 83 19.000 19.000 21.779 -2.779 18995
291 1 . 1 1 83 83 ALA H H 83 7.587 7.587 8.707 -1.120 18995
292 1 . 1 1 84 84 CYS N N 84 116.910 116.910 117.241 -0.331 18995
293 1 . 1 1 84 84 CYS CA C 84 59.800 59.800 57.241 2.559 18995
294 1 . 1 1 84 84 CYS CB C 84 27.900 27.900 29.284 -1.384 18995
295 1 . 1 1 84 84 CYS H H 84 7.788 7.788 8.491 -0.703 18995
296 1 . 1 1 86 86 GLU CA C 86 58.600 58.600 57.680 0.920 18995
297 1 . 1 1 86 86 GLU CB C 86 29.400 29.400 30.202 -0.802 18995
298 1 . 1 1 87 87 PHE N N 87 118.550 118.550 119.623 -1.073 18995
299 1 . 1 1 87 87 PHE C C 87 175.597 175.597 174.719 0.879 18995
300 1 . 1 1 87 87 PHE CA C 87 59.100 59.100 57.260 1.840 18995
301 1 . 1 1 87 87 PHE CB C 87 39.400 39.400 40.381 -0.981 18995
302 1 . 1 1 87 87 PHE H H 87 7.838 7.838 7.655 0.183 18995
303 1 . 1 1 88 88 PHE N N 88 118.438 118.438 125.599 -7.161 18995
304 1 . 1 1 88 88 PHE C C 88 175.241 175.241 175.872 -0.631 18995
305 1 . 1 1 88 88 PHE CA C 88 58.200 58.200 57.835 0.365 18995
306 1 . 1 1 88 88 PHE CB C 88 39.700 39.700 37.208 2.492 18995
307 1 . 1 1 88 88 PHE H H 88 7.718 7.718 8.510 -0.792 18995
308 1 . 1 1 89 89 GLU N N 89 121.366 121.366 126.190 -4.824 18995
309 1 . 1 1 89 89 GLU C C 89 175.437 175.437 177.152 -1.715 18995
310 1 . 1 1 89 89 GLU CA C 89 56.600 56.600 54.547 2.053 18995
311 1 . 1 1 89 89 GLU CB C 89 30.300 30.300 31.265 -0.965 18995
312 1 . 1 1 89 89 GLU H H 89 7.959 7.959 7.913 0.046 18995
313 1 . 1 1 90 90 HIS N N 90 120.349 120.349 116.667 3.682 18995
314 1 . 1 1 90 90 HIS C C 90 173.652 173.652 175.651 -1.999 18995
315 1 . 1 1 90 90 HIS CA C 90 55.800 55.800 58.151 -2.351 18995
316 1 . 1 1 90 90 HIS CB C 90 30.100 30.100 29.096 1.004 18995
317 1 . 1 1 90 90 HIS H H 90 8.116 8.116 8.713 -0.597 18995
318 1 . 1 1 91 91 GLU N N 91 127.965 127.965 117.535 10.430 18995
319 1 . 1 1 91 91 GLU H H 91 8.235 8.235 7.693 0.542 18995
stop_
save_