data_19497
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19497
_Entry.PDB_ID 2MDO
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 19497
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ARG N N 2 117.187 117.187 121.685 -4.498 19497
2 1 1 . 1 1 2 2 ARG C C 2 172.315 172.315 175.486 -3.171 19497
3 1 1 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.837 -0.737 19497
4 1 1 . 1 1 2 2 ARG CB C 2 29.000 29.000 29.889 -0.889 19497
5 1 1 . 1 1 2 2 ARG H H 2 7.766 7.766 8.215 -0.449 19497
6 1 1 . 1 1 3 3 LEU N N 3 125.426 125.426 123.236 2.190 19497
7 1 1 . 1 1 3 3 LEU C C 3 173.996 173.996 174.776 -0.780 19497
8 1 1 . 1 1 3 3 LEU CA C 3 52.600 52.600 54.363 -1.763 19497
9 1 1 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.160 -1.060 19497
10 1 1 . 1 1 3 3 LEU H H 3 8.246 8.246 8.081 0.165 19497
11 1 1 . 1 1 4 4 PHE N N 4 122.682 122.682 124.476 -1.794 19497
12 1 1 . 1 1 4 4 PHE C C 4 175.512 175.512 174.663 0.849 19497
13 1 1 . 1 1 4 4 PHE CA C 4 55.700 55.700 54.828 0.872 19497
14 1 1 . 1 1 4 4 PHE CB C 4 41.800 41.800 39.382 2.418 19497
15 1 1 . 1 1 4 4 PHE H H 4 9.390 9.390 8.899 0.491 19497
16 1 1 . 1 1 5 5 GLU N N 5 125.826 125.826 123.427 2.399 19497
17 1 1 . 1 1 5 5 GLU C C 5 175.679 175.679 175.402 0.277 19497
18 1 1 . 1 1 5 5 GLU CA C 5 56.400 56.400 53.752 2.648 19497
19 1 1 . 1 1 5 5 GLU CB C 5 29.400 29.400 33.523 -4.123 19497
20 1 1 . 1 1 5 5 GLU H H 5 9.190 9.190 8.667 0.523 19497
21 1 1 . 1 1 6 6 CYS N N 6 121.540 121.540 119.703 1.837 19497
22 1 1 . 1 1 6 6 CYS C C 6 175.738 175.738 174.061 1.677 19497
23 1 1 . 1 1 6 6 CYS CA C 6 56.100 56.100 57.705 -1.605 19497
24 1 1 . 1 1 6 6 CYS CB C 6 28.200 28.200 30.078 -1.878 19497
25 1 1 . 1 1 6 6 CYS H H 6 8.158 8.158 8.591 -0.433 19497
26 1 1 . 1 1 7 7 SER N N 7 116.299 116.299 118.478 -2.179 19497
27 1 1 . 1 1 7 7 SER C C 7 173.277 173.277 173.128 0.149 19497
28 1 1 . 1 1 7 7 SER CA C 7 58.300 58.300 57.089 1.211 19497
29 1 1 . 1 1 7 7 SER CB C 7 64.300 64.300 63.809 0.491 19497
30 1 1 . 1 1 7 7 SER H H 7 7.734 7.734 8.267 -0.533 19497
31 1 1 . 1 1 8 8 ASN N N 8 127.642 127.642 125.034 2.608 19497
32 1 1 . 1 1 8 8 ASN C C 8 177.812 177.812 174.800 3.012 19497
33 1 1 . 1 1 8 8 ASN CA C 8 55.900 55.900 52.981 2.919 19497
34 1 1 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.548 -0.348 19497
35 1 1 . 1 1 8 8 ASN H H 8 8.006 8.006 8.777 -0.771 19497
36 1 1 . 1 1 9 9 LYS N N 9 122.472 122.472 120.233 2.239 19497
37 1 1 . 1 1 9 9 LYS C C 9 177.932 177.932 177.060 0.872 19497
38 1 1 . 1 1 9 9 LYS CA C 9 59.300 59.300 57.209 2.091 19497
39 1 1 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.199 -0.799 19497
40 1 1 . 1 1 9 9 LYS H H 9 8.350 8.350 8.296 0.054 19497
41 1 1 . 1 1 10 10 THR N N 10 109.478 109.478 114.826 -5.348 19497
42 1 1 . 1 1 10 10 THR C C 10 175.241 175.241 174.875 0.366 19497
43 1 1 . 1 1 10 10 THR CA C 10 62.400 62.400 61.948 0.452 19497
44 1 1 . 1 1 10 10 THR CB C 10 69.700 69.700 68.357 1.343 19497
45 1 1 . 1 1 10 10 THR H H 10 8.486 8.486 8.510 -0.024 19497
46 1 1 . 1 1 11 11 GLY N N 11 110.146 110.146 110.470 -0.324 19497
47 1 1 . 1 1 11 11 GLY C C 11 172.717 172.717 173.447 -0.730 19497
48 1 1 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.671 0.029 19497
49 1 1 . 1 1 11 11 GLY H H 11 8.014 8.014 7.624 0.390 19497
50 1 1 . 1 1 12 12 ARG N N 12 117.911 117.911 117.647 0.264 19497
51 1 1 . 1 1 12 12 ARG C C 12 173.660 173.660 175.734 -2.074 19497
52 1 1 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.194 -1.395 19497
53 1 1 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.365 3.035 19497
54 1 1 . 1 1 12 12 ARG H H 12 7.342 7.342 7.801 -0.459 19497
55 1 1 . 1 1 13 13 PHE N N 13 122.082 122.082 118.948 3.134 19497
56 1 1 . 1 1 13 13 PHE C C 13 174.525 174.525 175.261 -0.736 19497
57 1 1 . 1 1 13 13 PHE CA C 13 58.700 58.700 56.249 2.451 19497
58 1 1 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.064 0.836 19497
59 1 1 . 1 1 13 13 PHE H H 13 8.462 8.462 8.023 0.439 19497
60 1 1 . 1 1 14 14 LEU N N 14 129.559 129.559 121.775 7.784 19497
61 1 1 . 1 1 14 14 LEU C C 14 174.071 174.071 175.569 -1.498 19497
62 1 1 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.292 -0.192 19497
63 1 1 . 1 1 14 14 LEU CB C 14 45.500 45.500 43.141 2.359 19497
64 1 1 . 1 1 14 14 LEU H H 14 8.054 8.054 7.317 0.737 19497
65 1 1 . 1 1 15 15 ALA N N 15 126.873 126.873 130.552 -3.679 19497
66 1 1 . 1 1 15 15 ALA C C 15 176.826 176.826 176.499 0.327 19497
67 1 1 . 1 1 15 15 ALA CA C 15 49.900 49.900 50.997 -1.097 19497
68 1 1 . 1 1 15 15 ALA CB C 15 20.300 20.300 22.118 -1.818 19497
69 1 1 . 1 1 15 15 ALA H H 15 8.190 8.190 8.097 0.093 19497
70 1 1 . 1 1 16 16 THR N N 16 120.557 120.557 117.558 2.999 19497
71 1 1 . 1 1 16 16 THR C C 16 173.449 173.449 174.758 -1.309 19497
72 1 1 . 1 1 16 16 THR CA C 16 61.500 61.500 62.723 -1.223 19497
73 1 1 . 1 1 16 16 THR CB C 16 70.500 70.500 68.830 1.670 19497
74 1 1 . 1 1 16 16 THR H H 16 9.014 9.014 8.669 0.345 19497
75 1 1 . 1 1 17 17 GLU N N 17 129.862 129.862 126.499 3.363 19497
76 1 1 . 1 1 17 17 GLU C C 17 175.703 175.703 175.882 -0.179 19497
77 1 1 . 1 1 17 17 GLU CA C 17 56.900 56.900 54.892 2.007 19497
78 1 1 . 1 1 17 17 GLU CB C 17 29.200 29.200 29.166 0.034 19497
79 1 1 . 1 1 17 17 GLU H H 17 9.118 9.118 8.501 0.617 19497
80 1 1 . 1 1 18 18 ILE N N 18 128.992 128.992 119.785 9.207 19497
81 1 1 . 1 1 18 18 ILE C C 18 175.994 175.994 175.682 0.312 19497
82 1 1 . 1 1 18 18 ILE CA C 18 59.600 59.600 61.048 -1.448 19497
83 1 1 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.478 -1.179 19497
84 1 1 . 1 1 18 18 ILE H H 18 8.686 8.686 7.662 1.024 19497
85 1 1 . 1 1 19 19 VAL N N 19 127.812 127.812 116.569 11.243 19497
86 1 1 . 1 1 19 19 VAL C C 19 175.611 175.611 175.232 0.379 19497
87 1 1 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.120 0.580 19497
88 1 1 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.476 0.524 19497
89 1 1 . 1 1 19 19 VAL H H 19 8.422 8.422 8.102 0.320 19497
90 1 1 . 1 1 20 20 ASP N N 20 123.008 123.008 120.959 2.049 19497
91 1 1 . 1 1 20 20 ASP C C 20 175.669 175.669 176.265 -0.596 19497
92 1 1 . 1 1 20 20 ASP CA C 20 54.900 54.900 55.146 -0.246 19497
93 1 1 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.300 -2.800 19497
94 1 1 . 1 1 20 20 ASP H H 20 8.894 8.894 8.151 0.743 19497
95 1 1 . 1 1 21 21 PHE N N 21 112.724 112.724 124.753 -12.029 19497
96 1 1 . 1 1 21 21 PHE C C 21 174.706 174.706 175.966 -1.260 19497
97 1 1 . 1 1 21 21 PHE CA C 21 56.200 56.200 57.696 -1.496 19497
98 1 1 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.228 1.772 19497
99 1 1 . 1 1 21 21 PHE H H 21 6.261 6.261 8.322 -2.061 19497
100 1 1 . 1 1 22 22 THR N N 22 112.022 112.022 117.385 -5.363 19497
101 1 1 . 1 1 22 22 THR C C 22 175.111 175.111 175.125 -0.014 19497
102 1 1 . 1 1 22 22 THR CA C 22 60.100 60.100 61.528 -1.428 19497
103 1 1 . 1 1 22 22 THR H H 22 9.422 9.422 8.414 1.008 19497
104 1 1 . 1 1 23 23 GLN N N 23 122.305 122.305 122.980 -0.675 19497
105 1 1 . 1 1 23 23 GLN C C 23 176.564 176.564 177.827 -1.263 19497
106 1 1 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.907 -1.307 19497
107 1 1 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.471 -1.571 19497
108 1 1 . 1 1 23 23 GLN H H 23 9.470 9.470 9.027 0.443 19497
109 1 1 . 1 1 24 24 ASP N N 24 114.251 114.251 118.852 -4.601 19497
110 1 1 . 1 1 24 24 ASP C C 24 174.839 174.839 176.989 -2.150 19497
111 1 1 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.530 -0.830 19497
112 1 1 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.439 0.061 19497
113 1 1 . 1 1 24 24 ASP H H 24 7.534 7.534 8.590 -1.056 19497
114 1 1 . 1 1 25 25 ASP N N 25 116.046 116.046 117.931 -1.885 19497
115 1 1 . 1 1 25 25 ASP C C 25 176.087 176.087 175.025 1.062 19497
116 1 1 . 1 1 25 25 ASP CA C 25 54.500 54.500 54.607 -0.107 19497
117 1 1 . 1 1 25 25 ASP CB C 25 40.600 40.600 41.078 -0.478 19497
118 1 1 . 1 1 25 25 ASP H H 25 7.454 7.454 7.788 -0.334 19497
119 1 1 . 1 1 26 26 LEU N N 26 121.535 121.535 121.257 0.278 19497
120 1 1 . 1 1 26 26 LEU C C 26 176.343 176.343 175.154 1.189 19497
121 1 1 . 1 1 26 26 LEU CA C 26 55.000 55.000 53.179 1.821 19497
122 1 1 . 1 1 26 26 LEU CB C 26 41.300 41.300 41.769 -0.469 19497
123 1 1 . 1 1 26 26 LEU H H 26 8.014 8.014 7.081 0.933 19497
124 1 1 . 1 1 27 27 ASP N N 27 127.804 127.804 124.539 3.265 19497
125 1 1 . 1 1 27 27 ASP C C 27 176.947 176.947 176.767 0.180 19497
126 1 1 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.684 0.316 19497
127 1 1 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.339 1.061 19497
128 1 1 . 1 1 27 27 ASP H H 27 8.326 8.326 7.947 0.379 19497
129 1 1 . 1 1 28 28 GLU N N 28 123.641 123.641 120.624 3.017 19497
130 1 1 . 1 1 28 28 GLU C C 28 176.141 176.141 176.009 0.132 19497
131 1 1 . 1 1 28 28 GLU CA C 28 54.500 54.500 57.481 -2.982 19497
132 1 1 . 1 1 28 28 GLU CB C 28 32.700 32.700 29.356 3.344 19497
133 1 1 . 1 1 28 28 GLU H H 28 8.278 8.278 8.964 -0.686 19497
134 1 1 . 1 1 29 29 ASN N N 29 120.901 120.901 116.996 3.905 19497
135 1 1 . 1 1 29 29 ASN C C 29 174.383 174.383 174.344 0.039 19497
136 1 1 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.768 4.532 19497
137 1 1 . 1 1 29 29 ASN CB C 29 38.300 38.300 39.112 -0.812 19497
138 1 1 . 1 1 29 29 ASN H H 29 8.022 8.022 8.345 -0.323 19497
139 1 1 . 1 1 30 30 ASP N N 30 125.016 125.016 118.698 6.318 19497
140 1 1 . 1 1 30 30 ASP C C 30 175.679 175.679 173.772 1.907 19497
141 1 1 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.320 -1.020 19497
142 1 1 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.889 -3.889 19497
143 1 1 . 1 1 30 30 ASP H H 30 8.142 8.142 7.970 0.172 19497
144 1 1 . 1 1 31 31 VAL N N 31 121.540 121.540 118.804 2.736 19497
145 1 1 . 1 1 31 31 VAL C C 31 175.675 175.675 174.621 1.054 19497
146 1 1 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.301 0.699 19497
147 1 1 . 1 1 31 31 VAL CB C 31 32.800 32.800 33.469 -0.669 19497
148 1 1 . 1 1 31 31 VAL H H 31 8.158 8.158 8.596 -0.438 19497
149 1 1 . 1 1 32 32 TYR N N 32 126.116 126.116 124.331 1.785 19497
150 1 1 . 1 1 32 32 TYR C C 32 173.449 173.449 175.071 -1.622 19497
151 1 1 . 1 1 32 32 TYR CA C 32 56.000 56.000 55.944 0.056 19497
152 1 1 . 1 1 32 32 TYR H H 32 8.294 8.294 8.578 -0.284 19497
153 1 1 . 1 1 33 33 LEU N N 33 121.235 121.235 119.507 1.728 19497
154 1 1 . 1 1 33 33 LEU C C 33 174.948 174.948 175.554 -0.606 19497
155 1 1 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.419 -0.119 19497
156 1 1 . 1 1 33 33 LEU CB C 33 45.700 45.700 43.190 2.510 19497
157 1 1 . 1 1 33 33 LEU H H 33 9.142 9.142 8.672 0.470 19497
158 1 1 . 1 1 34 34 LEU N N 34 127.452 127.452 125.429 2.023 19497
159 1 1 . 1 1 34 34 LEU C C 34 174.084 174.084 175.872 -1.788 19497
160 1 1 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.082 -0.882 19497
161 1 1 . 1 1 34 34 LEU CB C 34 44.700 44.700 42.222 2.478 19497
162 1 1 . 1 1 34 34 LEU H H 34 9.686 9.686 8.262 1.424 19497
163 1 1 . 1 1 35 35 ASP N N 35 126.977 126.977 126.779 0.198 19497
164 1 1 . 1 1 35 35 ASP C C 35 177.009 177.009 175.641 1.368 19497
165 1 1 . 1 1 35 35 ASP CA C 35 52.600 52.600 53.209 -0.609 19497
166 1 1 . 1 1 35 35 ASP CB C 35 41.400 41.400 40.444 0.956 19497
167 1 1 . 1 1 35 35 ASP H H 35 9.446 9.446 8.599 0.847 19497
168 1 1 . 1 1 36 36 THR N N 36 118.735 118.735 117.951 0.784 19497
169 1 1 . 1 1 36 36 THR C C 36 175.252 175.252 175.830 -0.578 19497
170 1 1 . 1 1 36 36 THR CA C 36 60.500 60.500 62.839 -2.339 19497
171 1 1 . 1 1 36 36 THR CB C 36 68.000 68.000 69.143 -1.143 19497
172 1 1 . 1 1 36 36 THR H H 36 8.310 8.310 7.909 0.401 19497
173 1 1 . 1 1 37 37 TRP N N 37 122.289 122.289 127.743 -5.454 19497
174 1 1 . 1 1 37 37 TRP C C 37 177.189 177.189 177.012 0.177 19497
175 1 1 . 1 1 37 37 TRP CA C 37 61.500 61.500 61.274 0.226 19497
176 1 1 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.360 -0.560 19497
177 1 1 . 1 1 37 37 TRP H H 37 9.022 9.022 9.027 -0.005 19497
178 1 1 . 1 1 38 38 ASP N N 38 117.370 117.370 115.593 1.777 19497
179 1 1 . 1 1 38 38 ASP C C 38 175.290 175.290 175.888 -0.598 19497
180 1 1 . 1 1 38 38 ASP CA C 38 55.400 55.400 56.193 -0.793 19497
181 1 1 . 1 1 38 38 ASP CB C 38 41.100 41.100 41.206 -0.107 19497
182 1 1 . 1 1 38 38 ASP H H 38 8.518 8.518 8.348 0.170 19497
183 1 1 . 1 1 39 39 GLN N N 39 111.522 111.522 117.023 -5.501 19497
184 1 1 . 1 1 39 39 GLN C C 39 173.099 173.099 173.992 -0.893 19497
185 1 1 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.620 -1.120 19497
186 1 1 . 1 1 39 39 GLN CB C 39 28.900 28.900 31.729 -2.829 19497
187 1 1 . 1 1 39 39 GLN H H 39 7.118 7.118 7.400 -0.282 19497
188 1 1 . 1 1 40 40 ILE N N 40 121.103 121.103 124.355 -3.252 19497
189 1 1 . 1 1 40 40 ILE C C 40 174.406 174.406 175.062 -0.656 19497
190 1 1 . 1 1 40 40 ILE CA C 40 58.900 58.900 59.786 -0.886 19497
191 1 1 . 1 1 40 40 ILE CB C 40 38.900 38.900 38.700 0.200 19497
192 1 1 . 1 1 40 40 ILE H H 40 8.422 8.422 8.304 0.118 19497
193 1 1 . 1 1 41 41 PHE N N 41 123.856 123.856 126.295 -2.439 19497
194 1 1 . 1 1 41 41 PHE C C 41 174.537 174.537 175.416 -0.879 19497
195 1 1 . 1 1 41 41 PHE CA C 41 55.900 55.900 58.883 -2.983 19497
196 1 1 . 1 1 41 41 PHE CB C 41 42.200 42.200 40.336 1.864 19497
197 1 1 . 1 1 41 41 PHE H H 41 9.222 9.222 8.077 1.145 19497
198 1 1 . 1 1 42 42 PHE N N 42 127.400 127.400 119.737 7.663 19497
199 1 1 . 1 1 42 42 PHE C C 42 173.021 173.021 174.613 -1.592 19497
200 1 1 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.907 -0.607 19497
201 1 1 . 1 1 42 42 PHE CB C 42 42.300 42.300 41.326 0.974 19497
202 1 1 . 1 1 42 42 PHE H H 42 9.358 9.358 9.141 0.217 19497
203 1 1 . 1 1 43 43 TRP N N 43 129.616 129.616 127.674 1.942 19497
204 1 1 . 1 1 43 43 TRP C C 43 174.538 174.538 175.998 -1.460 19497
205 1 1 . 1 1 43 43 TRP CA C 43 61.600 61.600 57.992 3.608 19497
206 1 1 . 1 1 43 43 TRP CB C 43 38.200 38.200 29.791 8.409 19497
207 1 1 . 1 1 43 43 TRP H H 43 9.646 9.646 8.894 0.752 19497
208 1 1 . 1 1 44 44 ILE N N 44 121.402 121.402 129.657 -8.255 19497
209 1 1 . 1 1 44 44 ILE C C 44 175.738 175.738 175.667 0.071 19497
210 1 1 . 1 1 44 44 ILE CA C 44 57.600 57.600 59.864 -2.264 19497
211 1 1 . 1 1 44 44 ILE CB C 44 39.100 39.100 36.941 2.159 19497
212 1 1 . 1 1 44 44 ILE H H 44 7.838 7.838 9.047 -1.209 19497
213 1 1 . 1 1 45 45 GLY N N 45 114.403 114.403 114.334 0.069 19497
214 1 1 . 1 1 45 45 GLY C C 45 175.519 175.519 174.306 1.213 19497
215 1 1 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.475 2.025 19497
216 1 1 . 1 1 45 45 GLY H H 45 7.742 7.742 8.629 -0.887 19497
217 1 1 . 1 1 46 46 LYS N N 46 123.585 123.585 122.828 0.757 19497
218 1 1 . 1 1 46 46 LYS C C 46 177.790 177.790 178.540 -0.750 19497
219 1 1 . 1 1 46 46 LYS CA C 46 58.700 58.700 58.964 -0.264 19497
220 1 1 . 1 1 46 46 LYS CB C 46 32.200 32.200 32.761 -0.561 19497
221 1 1 . 1 1 46 46 LYS H H 46 8.942 8.942 9.017 -0.075 19497
222 1 1 . 1 1 47 47 GLY N N 47 107.819 107.819 106.856 0.963 19497
223 1 1 . 1 1 47 47 GLY C C 47 174.298 174.298 173.240 1.058 19497
224 1 1 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.703 -0.403 19497
225 1 1 . 1 1 47 47 GLY H H 47 8.670 8.670 7.835 0.835 19497
226 1 1 . 1 1 48 48 ALA N N 48 123.965 123.965 123.070 0.895 19497
227 1 1 . 1 1 48 48 ALA C C 48 177.189 177.189 177.239 -0.050 19497
228 1 1 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.073 1.027 19497
229 1 1 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.942 -0.942 19497
230 1 1 . 1 1 48 48 ALA H H 48 7.230 7.230 7.501 -0.271 19497
231 1 1 . 1 1 49 49 ASN N N 49 119.667 119.667 116.876 2.791 19497
232 1 1 . 1 1 49 49 ASN C C 49 175.797 175.797 176.750 -0.953 19497
233 1 1 . 1 1 49 49 ASN CA C 49 54.200 54.200 52.632 1.569 19497
234 1 1 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.816 1.284 19497
235 1 1 . 1 1 49 49 ASN H H 49 8.526 8.526 8.570 -0.044 19497
236 1 1 . 1 1 50 50 GLU N N 50 112.272 112.272 124.754 -12.482 19497
237 1 1 . 1 1 50 50 GLU C C 50 178.128 178.128 178.488 -0.360 19497
238 1 1 . 1 1 50 50 GLU CA C 50 59.600 59.600 59.045 0.554 19497
239 1 1 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.820 -0.520 19497
240 1 1 . 1 1 50 50 GLU H H 50 7.814 7.814 9.001 -1.187 19497
241 1 1 . 1 1 51 51 SER N N 51 113.952 113.952 115.896 -1.944 19497
242 1 1 . 1 1 51 51 SER C C 51 177.874 177.874 176.441 1.433 19497
243 1 1 . 1 1 51 51 SER CA C 51 61.100 61.100 61.953 -0.853 19497
244 1 1 . 1 1 51 51 SER CB C 51 60.900 60.900 63.092 -2.192 19497
245 1 1 . 1 1 51 51 SER H H 51 8.342 8.342 8.623 -0.281 19497
246 1 1 . 1 1 52 52 GLU N N 52 119.930 119.930 119.738 0.192 19497
247 1 1 . 1 1 52 52 GLU C C 52 178.827 178.827 177.153 1.674 19497
248 1 1 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.450 -0.550 19497
249 1 1 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.623 -0.323 19497
250 1 1 . 1 1 52 52 GLU H H 52 7.806 7.806 8.209 -0.403 19497
251 1 1 . 1 1 53 53 LYS N N 53 118.112 118.112 117.488 0.624 19497
252 1 1 . 1 1 53 53 LYS C C 53 178.802 178.802 179.087 -0.285 19497
253 1 1 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.465 1.535 19497
254 1 1 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.805 -0.605 19497
255 1 1 . 1 1 53 53 LYS H H 53 7.670 7.670 7.429 0.241 19497
256 1 1 . 1 1 54 54 GLU N N 54 117.700 117.700 120.459 -2.759 19497
257 1 1 . 1 1 54 54 GLU C C 54 177.733 177.733 178.000 -0.267 19497
258 1 1 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.603 -0.403 19497
259 1 1 . 1 1 54 54 GLU CB C 54 29.300 29.300 29.785 -0.485 19497
260 1 1 . 1 1 54 54 GLU H H 54 7.934 7.934 8.440 -0.506 19497
261 1 1 . 1 1 55 55 ALA N N 55 120.395 120.395 121.893 -1.498 19497
262 1 1 . 1 1 55 55 ALA CA C 55 52.200 52.200 51.084 1.116 19497
263 1 1 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.478 -0.278 19497
264 1 1 . 1 1 55 55 ALA H H 55 7.238 7.238 7.752 -0.514 19497
265 1 1 . 1 1 56 56 ALA C C 56 177.526 177.526 178.565 -1.039 19497
266 1 1 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.748 0.851 19497
267 1 1 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.743 0.857 19497
268 1 1 . 1 1 57 57 ALA N N 57 117.753 117.753 120.628 -2.875 19497
269 1 1 . 1 1 57 57 ALA C C 57 180.072 180.072 179.544 0.528 19497
270 1 1 . 1 1 57 57 ALA CA C 57 55.200 55.200 55.297 -0.097 19497
271 1 1 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.064 -0.664 19497
272 1 1 . 1 1 57 57 ALA H H 57 7.990 7.990 8.369 -0.379 19497
273 1 1 . 1 1 58 58 GLU N N 58 118.444 118.444 116.952 1.492 19497
274 1 1 . 1 1 58 58 GLU C C 58 179.225 179.225 179.020 0.205 19497
275 1 1 . 1 1 58 58 GLU CA C 58 59.600 59.600 59.681 -0.081 19497
276 1 1 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.253 -0.353 19497
277 1 1 . 1 1 58 58 GLU H H 58 7.582 7.582 8.496 -0.914 19497
278 1 1 . 1 1 59 59 THR N N 59 119.842 119.842 117.093 2.749 19497
279 1 1 . 1 1 59 59 THR C C 59 175.781 175.781 176.111 -0.330 19497
280 1 1 . 1 1 59 59 THR CA C 59 66.200 66.200 66.405 -0.205 19497
281 1 1 . 1 1 59 59 THR CB C 59 67.600 67.600 68.145 -0.545 19497
282 1 1 . 1 1 59 59 THR H H 59 8.422 8.422 7.588 0.834 19497
283 1 1 . 1 1 60 60 ALA N N 60 122.454 122.454 124.096 -1.642 19497
284 1 1 . 1 1 60 60 ALA C C 60 178.583 178.583 179.201 -0.618 19497
285 1 1 . 1 1 60 60 ALA CA C 60 55.200 55.200 55.061 0.139 19497
286 1 1 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.531 0.569 19497
287 1 1 . 1 1 60 60 ALA H H 60 7.966 7.966 7.887 0.079 19497
288 1 1 . 1 1 61 61 GLN N N 61 115.462 115.462 116.801 -1.339 19497
289 1 1 . 1 1 61 61 GLN C C 61 178.101 178.101 178.046 0.055 19497
290 1 1 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.395 0.505 19497
291 1 1 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.473 -0.373 19497
292 1 1 . 1 1 61 61 GLN H H 61 7.598 7.598 7.853 -0.255 19497
293 1 1 . 1 1 62 62 GLU N N 62 120.883 120.883 122.150 -1.267 19497
294 1 1 . 1 1 62 62 GLU C C 62 174.071 174.071 178.580 -4.509 19497
295 1 1 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.223 -5.123 19497
296 1 1 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.755 0.545 19497
297 1 1 . 1 1 62 62 GLU H H 62 7.910 7.910 8.006 -0.096 19497
298 1 1 . 1 1 63 63 TYR N N 63 118.888 118.888 121.729 -2.841 19497
299 1 1 . 1 1 63 63 TYR C C 63 177.874 177.874 177.792 0.082 19497
300 1 1 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.706 0.394 19497
301 1 1 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.432 1.067 19497
302 1 1 . 1 1 63 63 TYR H H 63 8.182 8.182 8.320 -0.138 19497
303 1 1 . 1 1 64 64 LEU N N 64 119.930 119.930 118.874 1.056 19497
304 1 1 . 1 1 64 64 LEU C C 64 178.536 178.536 177.959 0.577 19497
305 1 1 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.485 0.415 19497
306 1 1 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.734 -2.834 19497
307 1 1 . 1 1 64 64 LEU H H 64 7.806 7.806 8.212 -0.406 19497
308 1 1 . 1 1 65 65 ARG N N 65 117.322 117.322 116.047 1.275 19497
309 1 1 . 1 1 65 65 ARG C C 65 177.436 177.436 178.172 -0.736 19497
310 1 1 . 1 1 65 65 ARG CA C 65 58.600 58.600 57.864 0.737 19497
311 1 1 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.660 -0.260 19497
312 1 1 . 1 1 65 65 ARG H H 65 8.054 8.054 7.977 0.077 19497
313 1 1 . 1 1 66 66 SER N N 66 111.783 111.783 113.110 -1.327 19497
314 1 1 . 1 1 66 66 SER C C 66 173.652 173.652 174.440 -0.788 19497
315 1 1 . 1 1 66 66 SER CA C 66 58.900 58.900 59.131 -0.231 19497
316 1 1 . 1 1 66 66 SER CB C 66 63.800 63.800 64.193 -0.393 19497
317 1 1 . 1 1 66 66 SER H H 66 7.550 7.550 7.907 -0.357 19497
318 1 1 . 1 1 67 67 HIS N N 67 124.135 124.135 124.832 -0.697 19497
319 1 1 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.751 -0.051 19497
320 1 1 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.239 -1.039 19497
321 1 1 . 1 1 67 67 HIS H H 67 7.134 7.134 7.504 -0.370 19497
322 1 1 . 1 1 68 68 PRO C C 68 178.101 178.101 177.033 1.068 19497
323 1 1 . 1 1 68 68 PRO CA C 68 58.900 58.900 64.549 -5.649 19497
324 1 1 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.633 -1.733 19497
325 1 1 . 1 1 69 69 GLY N N 69 115.697 115.697 104.285 11.412 19497
326 1 1 . 1 1 69 69 GLY C C 69 176.641 176.641 174.797 1.844 19497
327 1 1 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.274 0.726 19497
328 1 1 . 1 1 69 69 GLY H H 69 7.926 7.926 7.286 0.640 19497
329 1 1 . 1 1 70 70 SER N N 70 115.440 115.440 115.464 -0.024 19497
330 1 1 . 1 1 70 70 SER C C 70 173.277 173.277 174.596 -1.319 19497
331 1 1 . 1 1 70 70 SER CA C 70 58.300 58.300 58.911 -0.612 19497
332 1 1 . 1 1 70 70 SER CB C 70 64.300 64.300 62.092 2.208 19497
333 1 1 . 1 1 70 70 SER H H 70 8.030 8.030 7.836 0.194 19497
334 1 1 . 1 1 71 71 ARG N N 71 127.642 127.642 120.315 7.327 19497
335 1 1 . 1 1 71 71 ARG C C 71 175.849 175.849 175.559 0.290 19497
336 1 1 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.838 -1.938 19497
337 1 1 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.831 0.069 19497
338 1 1 . 1 1 71 71 ARG H H 71 8.006 8.006 8.067 -0.061 19497
339 1 1 . 1 1 72 72 ASP N N 72 120.975 120.975 122.357 -1.382 19497
340 1 1 . 1 1 72 72 ASP C C 72 176.087 176.087 175.253 0.834 19497
341 1 1 . 1 1 72 72 ASP CA C 72 54.500 54.500 55.001 -0.501 19497
342 1 1 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.643 -0.743 19497
343 1 1 . 1 1 72 72 ASP H H 72 8.182 8.182 8.584 -0.402 19497
344 1 1 . 1 1 73 73 LEU N N 73 121.535 121.535 123.047 -1.512 19497
345 1 1 . 1 1 73 73 LEU C C 73 177.020 177.020 176.797 0.223 19497
346 1 1 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.681 0.319 19497
347 1 1 . 1 1 73 73 LEU CB C 73 42.000 42.000 42.059 -0.059 19497
348 1 1 . 1 1 73 73 LEU H H 73 8.014 8.014 8.411 -0.397 19497
349 1 1 . 1 1 74 74 ASP N N 74 120.525 120.525 118.398 2.127 19497
350 1 1 . 1 1 74 74 ASP C C 74 175.797 175.797 175.995 -0.198 19497
351 1 1 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.190 1.010 19497
352 1 1 . 1 1 74 74 ASP CB C 74 41.000 41.000 40.871 0.129 19497
353 1 1 . 1 1 74 74 ASP H H 74 8.134 8.134 7.900 0.234 19497
354 1 1 . 1 1 75 75 THR N N 75 116.656 116.656 118.067 -1.411 19497
355 1 1 . 1 1 75 75 THR CA C 75 59.700 59.700 60.870 -1.170 19497
356 1 1 . 1 1 75 75 THR CB C 75 69.600 69.600 69.002 0.598 19497
357 1 1 . 1 1 75 75 THR H H 75 7.814 7.814 7.339 0.475 19497
358 1 1 . 1 1 76 76 PRO C C 76 174.538 174.538 175.416 -0.878 19497
359 1 1 . 1 1 76 76 PRO CA C 76 63.500 63.500 63.120 0.380 19497
360 1 1 . 1 1 76 76 PRO CB C 76 32.600 32.600 31.992 0.608 19497
361 1 1 . 1 1 77 77 ILE N N 77 121.402 121.402 123.128 -1.726 19497
362 1 1 . 1 1 77 77 ILE C C 77 176.132 176.132 175.629 0.503 19497
363 1 1 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.434 -1.334 19497
364 1 1 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.301 -0.301 19497
365 1 1 . 1 1 77 77 ILE H H 77 7.838 7.838 8.146 -0.308 19497
366 1 1 . 1 1 78 78 ILE N N 78 130.292 130.292 128.775 1.517 19497
367 1 1 . 1 1 78 78 ILE C C 78 175.084 175.084 174.318 0.766 19497
368 1 1 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.464 0.436 19497
369 1 1 . 1 1 78 78 ILE CB C 78 39.000 39.000 40.462 -1.462 19497
370 1 1 . 1 1 78 78 ILE H H 78 8.910 8.910 8.724 0.186 19497
371 1 1 . 1 1 79 79 VAL N N 79 129.237 129.237 125.999 3.238 19497
372 1 1 . 1 1 79 79 VAL C C 79 175.907 175.907 175.669 0.238 19497
373 1 1 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.571 1.629 19497
374 1 1 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.534 -0.834 19497
375 1 1 . 1 1 79 79 VAL H H 79 8.670 8.670 8.540 0.130 19497
376 1 1 . 1 1 80 80 VAL N N 80 128.354 128.354 129.238 -0.884 19497
377 1 1 . 1 1 80 80 VAL C C 80 172.823 172.823 174.503 -1.680 19497
378 1 1 . 1 1 80 80 VAL CA C 80 59.400 59.400 60.976 -1.576 19497
379 1 1 . 1 1 80 80 VAL CB C 80 32.600 32.600 34.977 -2.377 19497
380 1 1 . 1 1 80 80 VAL H H 80 9.598 9.598 8.955 0.643 19497
381 1 1 . 1 1 81 81 LYS N N 81 123.077 123.077 123.528 -0.451 19497
382 1 1 . 1 1 81 81 LYS C C 81 178.101 178.101 175.277 2.824 19497
383 1 1 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.746 0.654 19497
384 1 1 . 1 1 81 81 LYS CB C 81 34.300 34.300 34.290 0.010 19497
385 1 1 . 1 1 81 81 LYS H H 81 8.198 8.198 8.843 -0.645 19497
386 1 1 . 1 1 82 82 GLN N N 82 121.436 121.436 124.426 -2.990 19497
387 1 1 . 1 1 82 82 GLN C C 82 177.068 177.068 176.449 0.619 19497
388 1 1 . 1 1 82 82 GLN CA C 82 56.200 56.200 58.223 -2.023 19497
389 1 1 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.527 0.873 19497
390 1 1 . 1 1 82 82 GLN H H 82 7.910 7.910 7.829 0.081 19497
391 1 1 . 1 1 83 83 GLY N N 83 110.688 110.688 113.893 -3.205 19497
392 1 1 . 1 1 83 83 GLY C C 83 173.348 173.348 174.224 -0.876 19497
393 1 1 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.980 0.020 19497
394 1 1 . 1 1 83 83 GLY H H 83 8.382 8.382 8.945 -0.563 19497
395 1 1 . 1 1 84 84 PHE N N 84 119.493 119.493 121.243 -1.750 19497
396 1 1 . 1 1 84 84 PHE C C 84 175.035 175.035 174.126 0.909 19497
397 1 1 . 1 1 84 84 PHE CA C 84 57.300 57.300 56.549 0.751 19497
398 1 1 . 1 1 84 84 PHE CB C 84 42.200 42.200 39.554 2.646 19497
399 1 1 . 1 1 84 84 PHE H H 84 7.910 7.910 7.962 -0.052 19497
400 1 1 . 1 1 85 85 GLU N N 85 124.672 124.672 122.213 2.459 19497
401 1 1 . 1 1 85 85 GLU CA C 85 59.000 59.000 54.187 4.813 19497
402 1 1 . 1 1 85 85 GLU CB C 85 29.700 29.700 29.648 0.052 19497
403 1 1 . 1 1 85 85 GLU H H 85 8.142 8.142 8.027 0.115 19497
404 1 1 . 1 1 87 87 PRO C C 87 178.284 178.284 178.777 -0.493 19497
405 1 1 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.917 -1.817 19497
406 1 1 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.588 -0.488 19497
407 1 1 . 1 1 88 88 THR N N 88 106.959 106.959 111.317 -4.358 19497
408 1 1 . 1 1 88 88 THR C C 88 174.182 174.182 176.284 -2.102 19497
409 1 1 . 1 1 88 88 THR CA C 88 62.900 62.900 64.436 -1.536 19497
410 1 1 . 1 1 88 88 THR CB C 88 68.000 68.000 68.664 -0.664 19497
411 1 1 . 1 1 88 88 THR H H 88 7.110 7.110 8.186 -1.076 19497
412 1 1 . 1 1 89 89 PHE N N 89 118.766 118.766 119.783 -1.017 19497
413 1 1 . 1 1 89 89 PHE C C 89 175.468 175.468 177.711 -2.243 19497
414 1 1 . 1 1 89 89 PHE CA C 89 59.800 59.800 60.826 -1.026 19497
415 1 1 . 1 1 89 89 PHE CB C 89 40.700 40.700 38.891 1.809 19497
416 1 1 . 1 1 89 89 PHE H H 89 7.198 7.198 7.676 -0.478 19497
417 1 1 . 1 1 90 90 THR N N 90 107.050 107.050 114.846 -7.796 19497
418 1 1 . 1 1 90 90 THR C C 90 177.260 177.260 177.154 0.106 19497
419 1 1 . 1 1 90 90 THR CA C 90 64.600 64.600 64.697 -0.097 19497
420 1 1 . 1 1 90 90 THR CB C 90 67.900 67.900 67.486 0.414 19497
421 1 1 . 1 1 90 90 THR H H 90 7.446 7.446 8.146 -0.700 19497
422 1 1 . 1 1 91 91 GLY N N 91 106.738 106.738 110.098 -3.360 19497
423 1 1 . 1 1 91 91 GLY C C 91 174.422 174.422 175.297 -0.875 19497
424 1 1 . 1 1 91 91 GLY CA C 91 46.000 46.000 46.829 -0.829 19497
425 1 1 . 1 1 91 91 GLY H H 91 7.646 7.646 8.517 -0.871 19497
426 1 1 . 1 1 92 92 TRP N N 92 117.500 117.500 120.439 -2.939 19497
427 1 1 . 1 1 92 92 TRP C C 92 174.209 174.209 176.367 -2.158 19497
428 1 1 . 1 1 92 92 TRP CA C 92 56.900 56.900 58.066 -1.166 19497
429 1 1 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.384 0.016 19497
430 1 1 . 1 1 92 92 TRP H H 92 6.790 6.790 7.338 -0.548 19497
431 1 1 . 1 1 93 93 PHE N N 93 119.092 119.092 119.220 -0.128 19497
432 1 1 . 1 1 93 93 PHE C C 93 175.953 175.953 176.546 -0.593 19497
433 1 1 . 1 1 93 93 PHE CA C 93 56.700 56.700 58.133 -1.433 19497
434 1 1 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.043 1.257 19497
435 1 1 . 1 1 93 93 PHE H H 93 7.750 7.750 8.046 -0.296 19497
436 1 1 . 1 1 94 94 MET N N 94 121.554 121.554 127.523 -5.969 19497
437 1 1 . 1 1 94 94 MET C C 94 175.738 175.738 176.368 -0.630 19497
438 1 1 . 1 1 94 94 MET CA C 94 57.600 57.600 58.250 -0.650 19497
439 1 1 . 1 1 94 94 MET CB C 94 32.000 32.000 32.971 -0.971 19497
440 1 1 . 1 1 94 94 MET H H 94 8.654 8.654 8.825 -0.171 19497
441 1 1 . 1 1 95 95 ALA N N 95 119.777 119.777 120.720 -0.943 19497
442 1 1 . 1 1 95 95 ALA C C 95 175.441 175.441 176.878 -1.437 19497
443 1 1 . 1 1 95 95 ALA CA C 95 51.300 51.300 50.944 0.356 19497
444 1 1 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.498 2.202 19497
445 1 1 . 1 1 95 95 ALA H H 95 7.750 7.750 8.114 -0.364 19497
446 1 1 . 1 1 96 96 TRP N N 96 120.813 120.813 122.416 -1.603 19497
447 1 1 . 1 1 96 96 TRP C C 96 175.488 175.488 174.272 1.216 19497
448 1 1 . 1 1 96 96 TRP CA C 96 57.700 57.700 57.672 0.028 19497
449 1 1 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.917 -0.517 19497
450 1 1 . 1 1 96 96 TRP H H 96 8.254 8.254 8.016 0.238 19497
451 1 1 . 1 1 97 97 ASP N N 97 117.140 117.140 125.281 -8.141 19497
452 1 1 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.530 3.170 19497
453 1 1 . 1 1 97 97 ASP CB C 97 39.600 39.600 42.281 -2.681 19497
454 1 1 . 1 1 97 97 ASP H H 97 8.958 8.958 7.289 1.669 19497
455 1 1 . 1 1 98 98 PRO C C 98 174.071 174.071 177.349 -3.278 19497
456 1 1 . 1 1 98 98 PRO CA C 98 63.100 63.100 63.865 -0.765 19497
457 1 1 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.222 0.178 19497
458 1 1 . 1 1 99 99 LEU N N 99 118.888 118.888 114.944 3.944 19497
459 1 1 . 1 1 99 99 LEU C C 99 177.519 177.519 176.952 0.567 19497
460 1 1 . 1 1 99 99 LEU CA C 99 54.400 54.400 55.283 -0.883 19497
461 1 1 . 1 1 99 99 LEU CB C 99 40.500 40.500 42.059 -1.559 19497
462 1 1 . 1 1 99 99 LEU H H 99 8.182 8.182 7.886 0.296 19497
463 1 1 . 1 1 100 100 CYS N N 100 118.788 118.788 115.021 3.767 19497
464 1 1 . 1 1 100 100 CYS C C 100 174.685 174.685 175.345 -0.660 19497
465 1 1 . 1 1 100 100 CYS CA C 100 60.800 60.800 59.159 1.641 19497
466 1 1 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.309 0.091 19497
467 1 1 . 1 1 100 100 CYS H H 100 6.862 6.862 7.501 -0.639 19497
468 1 1 . 1 1 101 101 TRP N N 101 117.558 117.558 121.472 -3.914 19497
469 1 1 . 1 1 101 101 TRP C C 101 176.478 176.478 175.642 0.836 19497
470 1 1 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.765 -2.365 19497
471 1 1 . 1 1 101 101 TRP CB C 101 28.200 28.200 28.907 -0.707 19497
472 1 1 . 1 1 101 101 TRP H H 101 7.662 7.662 8.487 -0.825 19497
473 1 1 . 1 1 102 102 SER N N 102 115.626 115.626 116.409 -0.783 19497
474 1 1 . 1 1 102 102 SER C C 102 174.303 174.303 174.191 0.112 19497
475 1 1 . 1 1 102 102 SER CA C 102 58.900 58.900 57.011 1.889 19497
476 1 1 . 1 1 102 102 SER CB C 102 63.700 63.700 65.342 -1.642 19497
477 1 1 . 1 1 102 102 SER H H 102 7.734 7.734 7.170 0.564 19497
478 1 1 . 1 1 103 103 ASP N N 103 121.936 121.936 119.351 2.585 19497
479 1 1 . 1 1 103 103 ASP CA C 103 54.400 54.400 56.236 -1.836 19497
480 1 1 . 1 1 103 103 ASP CB C 103 40.600 40.600 40.258 0.342 19497
481 1 1 . 1 1 103 103 ASP H H 103 8.254 8.254 8.523 -0.269 19497
482 1 1 . 1 1 104 104 ARG N N 104 120.567 120.567 118.149 2.418 19497
483 1 1 . 1 1 104 104 ARG C C 104 176.177 176.177 177.699 -1.522 19497
484 1 1 . 1 1 104 104 ARG CA C 104 56.000 56.000 58.763 -2.763 19497
485 1 1 . 1 1 104 104 ARG CB C 104 30.300 30.300 28.588 1.712 19497
486 1 1 . 1 1 104 104 ARG H H 104 7.910 7.910 7.984 -0.074 19497
487 1 1 . 1 1 105 105 LYS N N 105 121.805 121.805 120.314 1.491 19497
488 1 1 . 1 1 105 105 LYS C C 105 176.141 176.141 177.911 -1.770 19497
489 1 1 . 1 1 105 105 LYS CA C 105 56.100 56.100 58.648 -2.548 19497
490 1 1 . 1 1 105 105 LYS CB C 105 32.800 32.800 32.080 0.720 19497
491 1 1 . 1 1 105 105 LYS H H 105 8.094 8.094 8.240 -0.146 19497
492 1 1 . 1 1 106 106 SER N N 106 116.792 116.792 112.609 4.183 19497
493 1 1 . 1 1 106 106 SER C C 106 172.841 172.841 175.267 -2.426 19497
494 1 1 . 1 1 106 106 SER CA C 106 57.900 57.900 59.478 -1.578 19497
495 1 1 . 1 1 106 106 SER CB C 106 63.800 63.800 63.429 0.371 19497
496 1 1 . 1 1 106 106 SER H H 106 8.030 8.030 7.276 0.754 19497
497 1 2 . 1 1 2 2 ARG N N 2 117.187 117.187 121.931 -4.744 19497
498 1 2 . 1 1 2 2 ARG C C 2 172.315 172.315 174.402 -2.087 19497
499 1 2 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.401 -0.301 19497
500 1 2 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.364 -1.364 19497
501 1 2 . 1 1 2 2 ARG H H 2 7.766 7.766 8.551 -0.785 19497
502 1 2 . 1 1 3 3 LEU N N 3 125.426 125.426 121.325 4.101 19497
503 1 2 . 1 1 3 3 LEU C C 3 173.996 173.996 174.695 -0.699 19497
504 1 2 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.451 -0.851 19497
505 1 2 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.489 -1.389 19497
506 1 2 . 1 1 3 3 LEU H H 3 8.246 8.246 8.005 0.241 19497
507 1 2 . 1 1 4 4 PHE N N 4 122.682 122.682 121.442 1.240 19497
508 1 2 . 1 1 4 4 PHE C C 4 175.512 175.512 174.358 1.154 19497
509 1 2 . 1 1 4 4 PHE CA C 4 55.700 55.700 56.649 -0.949 19497
510 1 2 . 1 1 4 4 PHE CB C 4 41.800 41.800 40.664 1.136 19497
511 1 2 . 1 1 4 4 PHE H H 4 9.390 9.390 8.647 0.743 19497
512 1 2 . 1 1 5 5 GLU N N 5 125.826 125.826 124.585 1.241 19497
513 1 2 . 1 1 5 5 GLU C C 5 175.679 175.679 175.496 0.183 19497
514 1 2 . 1 1 5 5 GLU CA C 5 56.400 56.400 53.733 2.667 19497
515 1 2 . 1 1 5 5 GLU CB C 5 29.400 29.400 33.218 -3.818 19497
516 1 2 . 1 1 5 5 GLU H H 5 9.190 9.190 8.434 0.756 19497
517 1 2 . 1 1 6 6 CYS N N 6 121.540 121.540 120.920 0.620 19497
518 1 2 . 1 1 6 6 CYS C C 6 175.738 175.738 174.397 1.341 19497
519 1 2 . 1 1 6 6 CYS CA C 6 56.100 56.100 56.341 -0.241 19497
520 1 2 . 1 1 6 6 CYS CB C 6 28.200 28.200 29.323 -1.123 19497
521 1 2 . 1 1 6 6 CYS H H 6 8.158 8.158 8.620 -0.462 19497
522 1 2 . 1 1 7 7 SER N N 7 116.299 116.299 116.874 -0.575 19497
523 1 2 . 1 1 7 7 SER C C 7 173.277 173.277 172.690 0.587 19497
524 1 2 . 1 1 7 7 SER CA C 7 58.300 58.300 56.465 1.835 19497
525 1 2 . 1 1 7 7 SER CB C 7 64.300 64.300 65.029 -0.729 19497
526 1 2 . 1 1 7 7 SER H H 7 7.734 7.734 8.173 -0.439 19497
527 1 2 . 1 1 8 8 ASN N N 8 127.642 127.642 119.235 8.407 19497
528 1 2 . 1 1 8 8 ASN C C 8 177.812 177.812 173.514 4.298 19497
529 1 2 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.128 2.772 19497
530 1 2 . 1 1 8 8 ASN CB C 8 39.200 39.200 40.917 -1.718 19497
531 1 2 . 1 1 8 8 ASN H H 8 8.006 8.006 8.662 -0.656 19497
532 1 2 . 1 1 9 9 LYS N N 9 122.472 122.472 120.788 1.684 19497
533 1 2 . 1 1 9 9 LYS C C 9 177.932 177.932 176.747 1.185 19497
534 1 2 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.280 3.020 19497
535 1 2 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.782 -1.383 19497
536 1 2 . 1 1 9 9 LYS H H 9 8.350 8.350 8.304 0.046 19497
537 1 2 . 1 1 10 10 THR N N 10 109.478 109.478 114.142 -4.664 19497
538 1 2 . 1 1 10 10 THR C C 10 175.241 175.241 174.925 0.316 19497
539 1 2 . 1 1 10 10 THR CA C 10 62.400 62.400 60.778 1.622 19497
540 1 2 . 1 1 10 10 THR CB C 10 69.700 69.700 67.821 1.879 19497
541 1 2 . 1 1 10 10 THR H H 10 8.486 8.486 8.528 -0.042 19497
542 1 2 . 1 1 11 11 GLY N N 11 110.146 110.146 109.595 0.551 19497
543 1 2 . 1 1 11 11 GLY C C 11 172.717 172.717 174.046 -1.329 19497
544 1 2 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.336 0.364 19497
545 1 2 . 1 1 11 11 GLY H H 11 8.014 8.014 7.146 0.868 19497
546 1 2 . 1 1 12 12 ARG N N 12 117.911 117.911 118.025 -0.114 19497
547 1 2 . 1 1 12 12 ARG C C 12 173.660 173.660 174.979 -1.319 19497
548 1 2 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.680 -1.880 19497
549 1 2 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.453 2.947 19497
550 1 2 . 1 1 12 12 ARG H H 12 7.342 7.342 7.969 -0.627 19497
551 1 2 . 1 1 13 13 PHE N N 13 122.082 122.082 119.486 2.596 19497
552 1 2 . 1 1 13 13 PHE C C 13 174.525 174.525 174.943 -0.418 19497
553 1 2 . 1 1 13 13 PHE CA C 13 58.700 58.700 55.237 3.463 19497
554 1 2 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.361 0.539 19497
555 1 2 . 1 1 13 13 PHE H H 13 8.462 8.462 7.746 0.716 19497
556 1 2 . 1 1 14 14 LEU N N 14 129.559 129.559 123.822 5.737 19497
557 1 2 . 1 1 14 14 LEU C C 14 174.071 174.071 175.706 -1.635 19497
558 1 2 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.785 -0.685 19497
559 1 2 . 1 1 14 14 LEU CB C 14 45.500 45.500 42.247 3.253 19497
560 1 2 . 1 1 14 14 LEU H H 14 8.054 8.054 7.609 0.445 19497
561 1 2 . 1 1 15 15 ALA N N 15 126.873 126.873 131.973 -5.100 19497
562 1 2 . 1 1 15 15 ALA C C 15 176.826 176.826 176.198 0.628 19497
563 1 2 . 1 1 15 15 ALA CA C 15 49.900 49.900 51.076 -1.176 19497
564 1 2 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.783 -1.483 19497
565 1 2 . 1 1 15 15 ALA H H 15 8.190 8.190 8.175 0.015 19497
566 1 2 . 1 1 16 16 THR N N 16 120.557 120.557 119.668 0.889 19497
567 1 2 . 1 1 16 16 THR C C 16 173.449 173.449 174.605 -1.156 19497
568 1 2 . 1 1 16 16 THR CA C 16 61.500 61.500 62.520 -1.020 19497
569 1 2 . 1 1 16 16 THR CB C 16 70.500 70.500 68.870 1.630 19497
570 1 2 . 1 1 16 16 THR H H 16 9.014 9.014 8.651 0.363 19497
571 1 2 . 1 1 17 17 GLU N N 17 129.862 129.862 126.663 3.199 19497
572 1 2 . 1 1 17 17 GLU C C 17 175.703 175.703 176.106 -0.403 19497
573 1 2 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.768 1.132 19497
574 1 2 . 1 1 17 17 GLU CB C 17 29.200 29.200 30.454 -1.254 19497
575 1 2 . 1 1 17 17 GLU H H 17 9.118 9.118 8.444 0.674 19497
576 1 2 . 1 1 18 18 ILE N N 18 128.992 128.992 118.563 10.429 19497
577 1 2 . 1 1 18 18 ILE C C 18 175.994 175.994 176.112 -0.118 19497
578 1 2 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.731 -1.131 19497
579 1 2 . 1 1 18 18 ILE CB C 18 37.300 37.300 39.248 -1.948 19497
580 1 2 . 1 1 18 18 ILE H H 18 8.686 8.686 8.129 0.557 19497
581 1 2 . 1 1 19 19 VAL N N 19 127.812 127.812 117.485 10.327 19497
582 1 2 . 1 1 19 19 VAL C C 19 175.611 175.611 175.408 0.203 19497
583 1 2 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.959 -0.259 19497
584 1 2 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.236 0.764 19497
585 1 2 . 1 1 19 19 VAL H H 19 8.422 8.422 8.368 0.054 19497
586 1 2 . 1 1 20 20 ASP N N 20 123.008 123.008 120.098 2.910 19497
587 1 2 . 1 1 20 20 ASP C C 20 175.669 175.669 175.199 0.470 19497
588 1 2 . 1 1 20 20 ASP CA C 20 54.900 54.900 54.443 0.457 19497
589 1 2 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.507 -3.007 19497
590 1 2 . 1 1 20 20 ASP H H 20 8.894 8.894 8.072 0.822 19497
591 1 2 . 1 1 21 21 PHE N N 21 112.724 112.724 120.575 -7.851 19497
592 1 2 . 1 1 21 21 PHE C C 21 174.706 174.706 175.738 -1.032 19497
593 1 2 . 1 1 21 21 PHE CA C 21 56.200 56.200 56.700 -0.500 19497
594 1 2 . 1 1 21 21 PHE CB C 21 41.000 41.000 40.506 0.494 19497
595 1 2 . 1 1 21 21 PHE H H 21 6.261 6.261 8.043 -1.782 19497
596 1 2 . 1 1 22 22 THR N N 22 112.022 112.022 112.369 -0.347 19497
597 1 2 . 1 1 22 22 THR C C 22 175.111 175.111 173.987 1.124 19497
598 1 2 . 1 1 22 22 THR CA C 22 60.100 60.100 61.731 -1.631 19497
599 1 2 . 1 1 22 22 THR H H 22 9.422 9.422 8.073 1.349 19497
600 1 2 . 1 1 23 23 GLN N N 23 122.305 122.305 121.068 1.237 19497
601 1 2 . 1 1 23 23 GLN C C 23 176.564 176.564 176.927 -0.363 19497
602 1 2 . 1 1 23 23 GLN CA C 23 58.600 58.600 58.257 0.343 19497
603 1 2 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.588 -1.688 19497
604 1 2 . 1 1 23 23 GLN H H 23 9.470 9.470 8.766 0.704 19497
605 1 2 . 1 1 24 24 ASP N N 24 114.251 114.251 119.244 -4.993 19497
606 1 2 . 1 1 24 24 ASP C C 24 174.839 174.839 176.903 -2.064 19497
607 1 2 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.407 -0.707 19497
608 1 2 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.190 0.310 19497
609 1 2 . 1 1 24 24 ASP H H 24 7.534 7.534 8.512 -0.978 19497
610 1 2 . 1 1 25 25 ASP N N 25 116.046 116.046 118.157 -2.111 19497
611 1 2 . 1 1 25 25 ASP C C 25 176.087 176.087 176.859 -0.772 19497
612 1 2 . 1 1 25 25 ASP CA C 25 54.500 54.500 55.248 -0.748 19497
613 1 2 . 1 1 25 25 ASP CB C 25 40.600 40.600 40.581 0.018 19497
614 1 2 . 1 1 25 25 ASP H H 25 7.454 7.454 8.230 -0.776 19497
615 1 2 . 1 1 26 26 LEU N N 26 121.535 121.535 121.722 -0.187 19497
616 1 2 . 1 1 26 26 LEU C C 26 176.343 176.343 176.674 -0.331 19497
617 1 2 . 1 1 26 26 LEU CA C 26 55.000 55.000 54.038 0.962 19497
618 1 2 . 1 1 26 26 LEU CB C 26 41.300 41.300 40.668 0.632 19497
619 1 2 . 1 1 26 26 LEU H H 26 8.014 8.014 7.316 0.698 19497
620 1 2 . 1 1 27 27 ASP N N 27 127.804 127.804 125.103 2.701 19497
621 1 2 . 1 1 27 27 ASP C C 27 176.947 176.947 176.759 0.188 19497
622 1 2 . 1 1 27 27 ASP CA C 27 54.000 54.000 54.310 -0.310 19497
623 1 2 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.595 0.805 19497
624 1 2 . 1 1 27 27 ASP H H 27 8.326 8.326 8.144 0.182 19497
625 1 2 . 1 1 28 28 GLU N N 28 123.641 123.641 124.208 -0.567 19497
626 1 2 . 1 1 28 28 GLU C C 28 176.141 176.141 176.465 -0.324 19497
627 1 2 . 1 1 28 28 GLU CA C 28 54.500 54.500 57.875 -3.375 19497
628 1 2 . 1 1 28 28 GLU CB C 28 32.700 32.700 29.361 3.339 19497
629 1 2 . 1 1 28 28 GLU H H 28 8.278 8.278 8.970 -0.692 19497
630 1 2 . 1 1 29 29 ASN N N 29 120.901 120.901 116.626 4.275 19497
631 1 2 . 1 1 29 29 ASN C C 29 174.383 174.383 174.436 -0.053 19497
632 1 2 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.539 4.761 19497
633 1 2 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.901 -0.601 19497
634 1 2 . 1 1 29 29 ASN H H 29 8.022 8.022 8.305 -0.283 19497
635 1 2 . 1 1 30 30 ASP N N 30 125.016 125.016 118.793 6.223 19497
636 1 2 . 1 1 30 30 ASP C C 30 175.679 175.679 174.087 1.592 19497
637 1 2 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.040 -0.740 19497
638 1 2 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.148 -3.148 19497
639 1 2 . 1 1 30 30 ASP H H 30 8.142 8.142 7.695 0.447 19497
640 1 2 . 1 1 31 31 VAL N N 31 121.540 121.540 120.895 0.645 19497
641 1 2 . 1 1 31 31 VAL C C 31 175.675 175.675 174.715 0.960 19497
642 1 2 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.535 0.465 19497
643 1 2 . 1 1 31 31 VAL CB C 31 32.800 32.800 33.308 -0.508 19497
644 1 2 . 1 1 31 31 VAL H H 31 8.158 8.158 8.576 -0.418 19497
645 1 2 . 1 1 32 32 TYR N N 32 126.116 126.116 126.866 -0.750 19497
646 1 2 . 1 1 32 32 TYR C C 32 173.449 173.449 175.510 -2.061 19497
647 1 2 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.387 -0.387 19497
648 1 2 . 1 1 32 32 TYR H H 32 8.294 8.294 8.521 -0.227 19497
649 1 2 . 1 1 33 33 LEU N N 33 121.235 121.235 120.893 0.342 19497
650 1 2 . 1 1 33 33 LEU C C 33 174.948 174.948 175.144 -0.196 19497
651 1 2 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.834 -0.534 19497
652 1 2 . 1 1 33 33 LEU CB C 33 45.700 45.700 44.212 1.488 19497
653 1 2 . 1 1 33 33 LEU H H 33 9.142 9.142 9.211 -0.069 19497
654 1 2 . 1 1 34 34 LEU N N 34 127.452 127.452 124.755 2.697 19497
655 1 2 . 1 1 34 34 LEU C C 34 174.084 174.084 174.847 -0.763 19497
656 1 2 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.259 -1.059 19497
657 1 2 . 1 1 34 34 LEU CB C 34 44.700 44.700 43.086 1.614 19497
658 1 2 . 1 1 34 34 LEU H H 34 9.686 9.686 8.278 1.408 19497
659 1 2 . 1 1 35 35 ASP N N 35 126.977 126.977 127.042 -0.065 19497
660 1 2 . 1 1 35 35 ASP C C 35 177.009 177.009 175.298 1.711 19497
661 1 2 . 1 1 35 35 ASP CA C 35 52.600 52.600 52.307 0.293 19497
662 1 2 . 1 1 35 35 ASP CB C 35 41.400 41.400 41.914 -0.514 19497
663 1 2 . 1 1 35 35 ASP H H 35 9.446 9.446 8.035 1.411 19497
664 1 2 . 1 1 36 36 THR N N 36 118.735 118.735 118.370 0.365 19497
665 1 2 . 1 1 36 36 THR C C 36 175.252 175.252 175.223 0.029 19497
666 1 2 . 1 1 36 36 THR CA C 36 60.500 60.500 61.659 -1.159 19497
667 1 2 . 1 1 36 36 THR CB C 36 68.000 68.000 69.356 -1.356 19497
668 1 2 . 1 1 36 36 THR H H 36 8.310 8.310 7.724 0.586 19497
669 1 2 . 1 1 37 37 TRP N N 37 122.289 122.289 125.968 -3.679 19497
670 1 2 . 1 1 37 37 TRP C C 37 177.189 177.189 176.316 0.873 19497
671 1 2 . 1 1 37 37 TRP CA C 37 61.500 61.500 60.708 0.792 19497
672 1 2 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.313 -0.513 19497
673 1 2 . 1 1 37 37 TRP H H 37 9.022 9.022 8.668 0.354 19497
674 1 2 . 1 1 38 38 ASP N N 38 117.370 117.370 114.651 2.719 19497
675 1 2 . 1 1 38 38 ASP C C 38 175.290 175.290 175.919 -0.629 19497
676 1 2 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.357 0.043 19497
677 1 2 . 1 1 38 38 ASP CB C 38 41.100 41.100 40.761 0.339 19497
678 1 2 . 1 1 38 38 ASP H H 38 8.518 8.518 8.150 0.368 19497
679 1 2 . 1 1 39 39 GLN N N 39 111.522 111.522 118.829 -7.307 19497
680 1 2 . 1 1 39 39 GLN C C 39 173.099 173.099 173.800 -0.701 19497
681 1 2 . 1 1 39 39 GLN CA C 39 54.500 54.500 54.872 -0.372 19497
682 1 2 . 1 1 39 39 GLN CB C 39 28.900 28.900 31.515 -2.615 19497
683 1 2 . 1 1 39 39 GLN H H 39 7.118 7.118 7.077 0.041 19497
684 1 2 . 1 1 40 40 ILE N N 40 121.103 121.103 122.940 -1.837 19497
685 1 2 . 1 1 40 40 ILE C C 40 174.406 174.406 174.115 0.291 19497
686 1 2 . 1 1 40 40 ILE CA C 40 58.900 58.900 59.688 -0.788 19497
687 1 2 . 1 1 40 40 ILE CB C 40 38.900 38.900 37.721 1.179 19497
688 1 2 . 1 1 40 40 ILE H H 40 8.422 8.422 7.840 0.582 19497
689 1 2 . 1 1 41 41 PHE N N 41 123.856 123.856 125.373 -1.517 19497
690 1 2 . 1 1 41 41 PHE C C 41 174.537 174.537 174.631 -0.094 19497
691 1 2 . 1 1 41 41 PHE CA C 41 55.900 55.900 56.635 -0.735 19497
692 1 2 . 1 1 41 41 PHE CB C 41 42.200 42.200 41.182 1.018 19497
693 1 2 . 1 1 41 41 PHE H H 41 9.222 9.222 7.585 1.637 19497
694 1 2 . 1 1 42 42 PHE N N 42 127.400 127.400 117.463 9.937 19497
695 1 2 . 1 1 42 42 PHE C C 42 173.021 173.021 174.378 -1.357 19497
696 1 2 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.387 -0.087 19497
697 1 2 . 1 1 42 42 PHE CB C 42 42.300 42.300 40.734 1.566 19497
698 1 2 . 1 1 42 42 PHE H H 42 9.358 9.358 8.818 0.540 19497
699 1 2 . 1 1 43 43 TRP N N 43 129.616 129.616 126.085 3.531 19497
700 1 2 . 1 1 43 43 TRP C C 43 174.538 174.538 174.654 -0.116 19497
701 1 2 . 1 1 43 43 TRP CA C 43 61.600 61.600 56.196 5.404 19497
702 1 2 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.381 7.819 19497
703 1 2 . 1 1 43 43 TRP H H 43 9.646 9.646 8.947 0.699 19497
704 1 2 . 1 1 44 44 ILE N N 44 121.402 121.402 128.651 -7.249 19497
705 1 2 . 1 1 44 44 ILE C C 44 175.738 175.738 175.091 0.647 19497
706 1 2 . 1 1 44 44 ILE CA C 44 57.600 57.600 60.331 -2.731 19497
707 1 2 . 1 1 44 44 ILE CB C 44 39.100 39.100 39.811 -0.711 19497
708 1 2 . 1 1 44 44 ILE H H 44 7.838 7.838 8.350 -0.512 19497
709 1 2 . 1 1 45 45 GLY N N 45 114.403 114.403 113.096 1.307 19497
710 1 2 . 1 1 45 45 GLY C C 45 175.519 175.519 173.758 1.761 19497
711 1 2 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.307 2.192 19497
712 1 2 . 1 1 45 45 GLY H H 45 7.742 7.742 8.286 -0.544 19497
713 1 2 . 1 1 46 46 LYS N N 46 123.585 123.585 120.191 3.394 19497
714 1 2 . 1 1 46 46 LYS C C 46 177.790 177.790 177.914 -0.124 19497
715 1 2 . 1 1 46 46 LYS CA C 46 58.700 58.700 56.394 2.306 19497
716 1 2 . 1 1 46 46 LYS CB C 46 32.200 32.200 34.671 -2.471 19497
717 1 2 . 1 1 46 46 LYS H H 46 8.942 8.942 8.102 0.840 19497
718 1 2 . 1 1 47 47 GLY N N 47 107.819 107.819 108.380 -0.561 19497
719 1 2 . 1 1 47 47 GLY C C 47 174.298 174.298 173.083 1.215 19497
720 1 2 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.681 -0.382 19497
721 1 2 . 1 1 47 47 GLY H H 47 8.670 8.670 7.764 0.906 19497
722 1 2 . 1 1 48 48 ALA N N 48 123.965 123.965 122.163 1.802 19497
723 1 2 . 1 1 48 48 ALA C C 48 177.189 177.189 176.868 0.321 19497
724 1 2 . 1 1 48 48 ALA CA C 48 52.100 52.100 50.755 1.345 19497
725 1 2 . 1 1 48 48 ALA CB C 48 19.000 19.000 20.957 -1.958 19497
726 1 2 . 1 1 48 48 ALA H H 48 7.230 7.230 7.025 0.205 19497
727 1 2 . 1 1 49 49 ASN N N 49 119.667 119.667 118.791 0.876 19497
728 1 2 . 1 1 49 49 ASN C C 49 175.797 175.797 176.556 -0.759 19497
729 1 2 . 1 1 49 49 ASN CA C 49 54.200 54.200 54.312 -0.112 19497
730 1 2 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.390 1.710 19497
731 1 2 . 1 1 49 49 ASN H H 49 8.526 8.526 8.648 -0.122 19497
732 1 2 . 1 1 50 50 GLU N N 50 112.272 112.272 124.149 -11.877 19497
733 1 2 . 1 1 50 50 GLU C C 50 178.128 178.128 178.009 0.119 19497
734 1 2 . 1 1 50 50 GLU CA C 50 59.600 59.600 58.695 0.905 19497
735 1 2 . 1 1 50 50 GLU CB C 50 29.300 29.300 30.016 -0.716 19497
736 1 2 . 1 1 50 50 GLU H H 50 7.814 7.814 9.043 -1.229 19497
737 1 2 . 1 1 51 51 SER N N 51 113.952 113.952 115.948 -1.996 19497
738 1 2 . 1 1 51 51 SER C C 51 177.874 177.874 176.411 1.463 19497
739 1 2 . 1 1 51 51 SER CA C 51 61.100 61.100 61.275 -0.175 19497
740 1 2 . 1 1 51 51 SER CB C 51 60.900 60.900 63.055 -2.155 19497
741 1 2 . 1 1 51 51 SER H H 51 8.342 8.342 7.955 0.387 19497
742 1 2 . 1 1 52 52 GLU N N 52 119.930 119.930 121.432 -1.502 19497
743 1 2 . 1 1 52 52 GLU C C 52 178.827 178.827 177.490 1.337 19497
744 1 2 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.423 -0.523 19497
745 1 2 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.856 -0.556 19497
746 1 2 . 1 1 52 52 GLU H H 52 7.806 7.806 8.371 -0.565 19497
747 1 2 . 1 1 53 53 LYS N N 53 118.112 118.112 117.071 1.041 19497
748 1 2 . 1 1 53 53 LYS C C 53 178.802 178.802 177.943 0.859 19497
749 1 2 . 1 1 53 53 LYS CA C 53 60.000 60.000 57.871 2.129 19497
750 1 2 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.232 -0.032 19497
751 1 2 . 1 1 53 53 LYS H H 53 7.670 7.670 7.772 -0.102 19497
752 1 2 . 1 1 54 54 GLU N N 54 117.700 117.700 118.990 -1.290 19497
753 1 2 . 1 1 54 54 GLU C C 54 177.733 177.733 176.876 0.857 19497
754 1 2 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.041 0.159 19497
755 1 2 . 1 1 54 54 GLU CB C 54 29.300 29.300 30.775 -1.475 19497
756 1 2 . 1 1 54 54 GLU H H 54 7.934 7.934 7.843 0.091 19497
757 1 2 . 1 1 55 55 ALA N N 55 120.395 120.395 121.493 -1.098 19497
758 1 2 . 1 1 55 55 ALA CA C 55 52.200 52.200 51.021 1.179 19497
759 1 2 . 1 1 55 55 ALA CB C 55 17.200 17.200 18.113 -0.913 19497
760 1 2 . 1 1 55 55 ALA H H 55 7.238 7.238 7.564 -0.326 19497
761 1 2 . 1 1 56 56 ALA C C 56 177.526 177.526 178.300 -0.774 19497
762 1 2 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.291 1.308 19497
763 1 2 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.583 1.017 19497
764 1 2 . 1 1 57 57 ALA N N 57 117.753 117.753 118.438 -0.685 19497
765 1 2 . 1 1 57 57 ALA C C 57 180.072 180.072 178.512 1.560 19497
766 1 2 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.300 1.900 19497
767 1 2 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.503 -1.103 19497
768 1 2 . 1 1 57 57 ALA H H 57 7.990 7.990 8.378 -0.388 19497
769 1 2 . 1 1 58 58 GLU N N 58 118.444 118.444 118.359 0.085 19497
770 1 2 . 1 1 58 58 GLU C C 58 179.225 179.225 178.106 1.119 19497
771 1 2 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.055 1.545 19497
772 1 2 . 1 1 58 58 GLU CB C 58 28.900 28.900 30.715 -1.815 19497
773 1 2 . 1 1 58 58 GLU H H 58 7.582 7.582 8.002 -0.420 19497
774 1 2 . 1 1 59 59 THR N N 59 119.842 119.842 116.027 3.815 19497
775 1 2 . 1 1 59 59 THR C C 59 175.781 175.781 175.816 -0.035 19497
776 1 2 . 1 1 59 59 THR CA C 59 66.200 66.200 65.046 1.154 19497
777 1 2 . 1 1 59 59 THR CB C 59 67.600 67.600 67.939 -0.339 19497
778 1 2 . 1 1 59 59 THR H H 59 8.422 8.422 7.948 0.474 19497
779 1 2 . 1 1 60 60 ALA N N 60 122.454 122.454 124.701 -2.247 19497
780 1 2 . 1 1 60 60 ALA C C 60 178.583 178.583 178.918 -0.335 19497
781 1 2 . 1 1 60 60 ALA CA C 60 55.200 55.200 54.962 0.238 19497
782 1 2 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.851 0.249 19497
783 1 2 . 1 1 60 60 ALA H H 60 7.966 7.966 7.548 0.418 19497
784 1 2 . 1 1 61 61 GLN N N 61 115.462 115.462 117.048 -1.586 19497
785 1 2 . 1 1 61 61 GLN C C 61 178.101 178.101 177.880 0.221 19497
786 1 2 . 1 1 61 61 GLN CA C 61 58.900 58.900 57.753 1.147 19497
787 1 2 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.423 -0.323 19497
788 1 2 . 1 1 61 61 GLN H H 61 7.598 7.598 7.725 -0.127 19497
789 1 2 . 1 1 62 62 GLU N N 62 120.883 120.883 122.095 -1.212 19497
790 1 2 . 1 1 62 62 GLU C C 62 174.071 174.071 178.261 -4.190 19497
791 1 2 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.437 -5.337 19497
792 1 2 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.475 0.825 19497
793 1 2 . 1 1 62 62 GLU H H 62 7.910 7.910 7.696 0.214 19497
794 1 2 . 1 1 63 63 TYR N N 63 118.888 118.888 119.667 -0.779 19497
795 1 2 . 1 1 63 63 TYR C C 63 177.874 177.874 178.279 -0.405 19497
796 1 2 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.658 0.442 19497
797 1 2 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.377 1.123 19497
798 1 2 . 1 1 63 63 TYR H H 63 8.182 8.182 7.550 0.632 19497
799 1 2 . 1 1 64 64 LEU N N 64 119.930 119.930 119.675 0.255 19497
800 1 2 . 1 1 64 64 LEU C C 64 178.536 178.536 179.060 -0.524 19497
801 1 2 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.513 0.387 19497
802 1 2 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.870 -2.970 19497
803 1 2 . 1 1 64 64 LEU H H 64 7.806 7.806 7.758 0.048 19497
804 1 2 . 1 1 65 65 ARG N N 65 117.322 117.322 117.431 -0.109 19497
805 1 2 . 1 1 65 65 ARG C C 65 177.436 177.436 177.909 -0.473 19497
806 1 2 . 1 1 65 65 ARG CA C 65 58.600 58.600 57.915 0.685 19497
807 1 2 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.007 0.393 19497
808 1 2 . 1 1 65 65 ARG H H 65 8.054 8.054 7.747 0.307 19497
809 1 2 . 1 1 66 66 SER N N 66 111.783 111.783 113.059 -1.276 19497
810 1 2 . 1 1 66 66 SER C C 66 173.652 173.652 173.768 -0.116 19497
811 1 2 . 1 1 66 66 SER CA C 66 58.900 58.900 58.501 0.399 19497
812 1 2 . 1 1 66 66 SER CB C 66 63.800 63.800 63.687 0.113 19497
813 1 2 . 1 1 66 66 SER H H 66 7.550 7.550 7.595 -0.045 19497
814 1 2 . 1 1 67 67 HIS N N 67 124.135 124.135 123.366 0.769 19497
815 1 2 . 1 1 67 67 HIS CA C 67 55.700 55.700 54.490 1.210 19497
816 1 2 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.827 -1.627 19497
817 1 2 . 1 1 67 67 HIS H H 67 7.134 7.134 7.353 -0.219 19497
818 1 2 . 1 1 68 68 PRO C C 68 178.101 178.101 175.998 2.103 19497
819 1 2 . 1 1 68 68 PRO CA C 68 58.900 58.900 62.706 -3.806 19497
820 1 2 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.529 -1.629 19497
821 1 2 . 1 1 69 69 GLY N N 69 115.697 115.697 106.483 9.214 19497
822 1 2 . 1 1 69 69 GLY C C 69 176.641 176.641 174.824 1.817 19497
823 1 2 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.101 0.899 19497
824 1 2 . 1 1 69 69 GLY H H 69 7.926 7.926 6.783 1.143 19497
825 1 2 . 1 1 70 70 SER N N 70 115.440 115.440 115.249 0.191 19497
826 1 2 . 1 1 70 70 SER C C 70 173.277 173.277 174.271 -0.994 19497
827 1 2 . 1 1 70 70 SER CA C 70 58.300 58.300 58.596 -0.296 19497
828 1 2 . 1 1 70 70 SER CB C 70 64.300 64.300 62.311 1.989 19497
829 1 2 . 1 1 70 70 SER H H 70 8.030 8.030 7.867 0.163 19497
830 1 2 . 1 1 71 71 ARG N N 71 127.642 127.642 121.926 5.716 19497
831 1 2 . 1 1 71 71 ARG C C 71 175.849 175.849 175.438 0.411 19497
832 1 2 . 1 1 71 71 ARG CA C 71 53.900 53.900 54.746 -0.846 19497
833 1 2 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.724 0.176 19497
834 1 2 . 1 1 71 71 ARG H H 71 8.006 8.006 8.040 -0.034 19497
835 1 2 . 1 1 72 72 ASP N N 72 120.975 120.975 119.450 1.525 19497
836 1 2 . 1 1 72 72 ASP C C 72 176.087 176.087 176.114 -0.027 19497
837 1 2 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.618 -0.118 19497
838 1 2 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.470 -0.570 19497
839 1 2 . 1 1 72 72 ASP H H 72 8.182 8.182 8.451 -0.269 19497
840 1 2 . 1 1 73 73 LEU N N 73 121.535 121.535 126.376 -4.841 19497
841 1 2 . 1 1 73 73 LEU C C 73 177.020 177.020 175.958 1.062 19497
842 1 2 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.492 0.508 19497
843 1 2 . 1 1 73 73 LEU CB C 73 42.000 42.000 40.784 1.216 19497
844 1 2 . 1 1 73 73 LEU H H 73 8.014 8.014 8.509 -0.495 19497
845 1 2 . 1 1 74 74 ASP N N 74 120.525 120.525 118.716 1.809 19497
846 1 2 . 1 1 74 74 ASP C C 74 175.797 175.797 175.405 0.392 19497
847 1 2 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.304 0.896 19497
848 1 2 . 1 1 74 74 ASP CB C 74 41.000 41.000 42.221 -1.221 19497
849 1 2 . 1 1 74 74 ASP H H 74 8.134 8.134 7.656 0.478 19497
850 1 2 . 1 1 75 75 THR N N 75 116.656 116.656 118.111 -1.455 19497
851 1 2 . 1 1 75 75 THR CA C 75 59.700 59.700 60.829 -1.129 19497
852 1 2 . 1 1 75 75 THR CB C 75 69.600 69.600 68.707 0.893 19497
853 1 2 . 1 1 75 75 THR H H 75 7.814 7.814 7.880 -0.066 19497
854 1 2 . 1 1 76 76 PRO C C 76 174.538 174.538 175.575 -1.037 19497
855 1 2 . 1 1 76 76 PRO CA C 76 63.500 63.500 63.072 0.428 19497
856 1 2 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.025 0.575 19497
857 1 2 . 1 1 77 77 ILE N N 77 121.402 121.402 123.323 -1.921 19497
858 1 2 . 1 1 77 77 ILE C C 77 176.132 176.132 175.843 0.289 19497
859 1 2 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.912 -1.812 19497
860 1 2 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.392 -0.392 19497
861 1 2 . 1 1 77 77 ILE H H 77 7.838 7.838 8.258 -0.420 19497
862 1 2 . 1 1 78 78 ILE N N 78 130.292 130.292 127.713 2.579 19497
863 1 2 . 1 1 78 78 ILE C C 78 175.084 175.084 174.401 0.683 19497
864 1 2 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.818 0.083 19497
865 1 2 . 1 1 78 78 ILE CB C 78 39.000 39.000 40.968 -1.968 19497
866 1 2 . 1 1 78 78 ILE H H 78 8.910 8.910 8.495 0.415 19497
867 1 2 . 1 1 79 79 VAL N N 79 129.237 129.237 125.836 3.401 19497
868 1 2 . 1 1 79 79 VAL C C 79 175.907 175.907 175.667 0.240 19497
869 1 2 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.510 1.690 19497
870 1 2 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.303 -0.603 19497
871 1 2 . 1 1 79 79 VAL H H 79 8.670 8.670 8.569 0.101 19497
872 1 2 . 1 1 80 80 VAL N N 80 128.354 128.354 127.721 0.633 19497
873 1 2 . 1 1 80 80 VAL C C 80 172.823 172.823 174.542 -1.719 19497
874 1 2 . 1 1 80 80 VAL CA C 80 59.400 59.400 60.873 -1.473 19497
875 1 2 . 1 1 80 80 VAL CB C 80 32.600 32.600 35.743 -3.143 19497
876 1 2 . 1 1 80 80 VAL H H 80 9.598 9.598 8.821 0.777 19497
877 1 2 . 1 1 81 81 LYS N N 81 123.077 123.077 123.122 -0.045 19497
878 1 2 . 1 1 81 81 LYS C C 81 178.101 178.101 174.935 3.166 19497
879 1 2 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.878 0.522 19497
880 1 2 . 1 1 81 81 LYS CB C 81 34.300 34.300 34.748 -0.448 19497
881 1 2 . 1 1 81 81 LYS H H 81 8.198 8.198 8.821 -0.623 19497
882 1 2 . 1 1 82 82 GLN N N 82 121.436 121.436 123.212 -1.776 19497
883 1 2 . 1 1 82 82 GLN C C 82 177.068 177.068 176.092 0.976 19497
884 1 2 . 1 1 82 82 GLN CA C 82 56.200 56.200 56.744 -0.544 19497
885 1 2 . 1 1 82 82 GLN CB C 82 29.400 29.400 27.893 1.507 19497
886 1 2 . 1 1 82 82 GLN H H 82 7.910 7.910 7.812 0.098 19497
887 1 2 . 1 1 83 83 GLY N N 83 110.688 110.688 113.861 -3.173 19497
888 1 2 . 1 1 83 83 GLY C C 83 173.348 173.348 174.066 -0.718 19497
889 1 2 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.670 0.330 19497
890 1 2 . 1 1 83 83 GLY H H 83 8.382 8.382 8.504 -0.122 19497
891 1 2 . 1 1 84 84 PHE N N 84 119.493 119.493 119.689 -0.196 19497
892 1 2 . 1 1 84 84 PHE C C 84 175.035 175.035 174.564 0.471 19497
893 1 2 . 1 1 84 84 PHE CA C 84 57.300 57.300 56.720 0.580 19497
894 1 2 . 1 1 84 84 PHE CB C 84 42.200 42.200 40.699 1.502 19497
895 1 2 . 1 1 84 84 PHE H H 84 7.910 7.910 8.037 -0.127 19497
896 1 2 . 1 1 85 85 GLU N N 85 124.672 124.672 122.854 1.818 19497
897 1 2 . 1 1 85 85 GLU CA C 85 59.000 59.000 54.471 4.529 19497
898 1 2 . 1 1 85 85 GLU CB C 85 29.700 29.700 29.606 0.094 19497
899 1 2 . 1 1 85 85 GLU H H 85 8.142 8.142 8.157 -0.015 19497
900 1 2 . 1 1 87 87 PRO C C 87 178.284 178.284 178.476 -0.192 19497
901 1 2 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.112 -1.012 19497
902 1 2 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.731 -0.631 19497
903 1 2 . 1 1 88 88 THR N N 88 106.959 106.959 111.305 -4.346 19497
904 1 2 . 1 1 88 88 THR C C 88 174.182 174.182 175.286 -1.104 19497
905 1 2 . 1 1 88 88 THR CA C 88 62.900 62.900 63.260 -0.360 19497
906 1 2 . 1 1 88 88 THR CB C 88 68.000 68.000 68.470 -0.470 19497
907 1 2 . 1 1 88 88 THR H H 88 7.110 7.110 8.070 -0.960 19497
908 1 2 . 1 1 89 89 PHE N N 89 118.766 118.766 119.813 -1.047 19497
909 1 2 . 1 1 89 89 PHE C C 89 175.468 175.468 177.153 -1.685 19497
910 1 2 . 1 1 89 89 PHE CA C 89 59.800 59.800 60.177 -0.377 19497
911 1 2 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.504 1.196 19497
912 1 2 . 1 1 89 89 PHE H H 89 7.198 7.198 7.249 -0.051 19497
913 1 2 . 1 1 90 90 THR N N 90 107.050 107.050 113.687 -6.637 19497
914 1 2 . 1 1 90 90 THR C C 90 177.260 177.260 177.104 0.156 19497
915 1 2 . 1 1 90 90 THR CA C 90 64.600 64.600 64.890 -0.290 19497
916 1 2 . 1 1 90 90 THR CB C 90 67.900 67.900 67.911 -0.011 19497
917 1 2 . 1 1 90 90 THR H H 90 7.446 7.446 7.817 -0.371 19497
918 1 2 . 1 1 91 91 GLY N N 91 106.738 106.738 109.594 -2.856 19497
919 1 2 . 1 1 91 91 GLY C C 91 174.422 174.422 175.001 -0.579 19497
920 1 2 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.355 0.645 19497
921 1 2 . 1 1 91 91 GLY H H 91 7.646 7.646 7.890 -0.244 19497
922 1 2 . 1 1 92 92 TRP N N 92 117.500 117.500 119.045 -1.545 19497
923 1 2 . 1 1 92 92 TRP C C 92 174.209 174.209 174.607 -0.398 19497
924 1 2 . 1 1 92 92 TRP CA C 92 56.900 56.900 53.706 3.194 19497
925 1 2 . 1 1 92 92 TRP CB C 92 29.400 29.400 27.499 1.901 19497
926 1 2 . 1 1 92 92 TRP H H 92 6.790 6.790 7.278 -0.488 19497
927 1 2 . 1 1 93 93 PHE N N 93 119.092 119.092 117.332 1.760 19497
928 1 2 . 1 1 93 93 PHE C C 93 175.953 175.953 176.036 -0.083 19497
929 1 2 . 1 1 93 93 PHE CA C 93 56.700 56.700 56.444 0.257 19497
930 1 2 . 1 1 93 93 PHE CB C 93 40.300 40.300 41.476 -1.176 19497
931 1 2 . 1 1 93 93 PHE H H 93 7.750 7.750 7.595 0.155 19497
932 1 2 . 1 1 94 94 MET N N 94 121.554 121.554 124.146 -2.592 19497
933 1 2 . 1 1 94 94 MET C C 94 175.738 175.738 176.244 -0.506 19497
934 1 2 . 1 1 94 94 MET CA C 94 57.600 57.600 56.954 0.646 19497
935 1 2 . 1 1 94 94 MET CB C 94 32.000 32.000 33.552 -1.552 19497
936 1 2 . 1 1 94 94 MET H H 94 8.654 8.654 9.305 -0.651 19497
937 1 2 . 1 1 95 95 ALA N N 95 119.777 119.777 121.812 -2.035 19497
938 1 2 . 1 1 95 95 ALA C C 95 175.441 175.441 176.165 -0.724 19497
939 1 2 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.709 -0.409 19497
940 1 2 . 1 1 95 95 ALA CB C 95 20.700 20.700 19.087 1.613 19497
941 1 2 . 1 1 95 95 ALA H H 95 7.750 7.750 8.019 -0.269 19497
942 1 2 . 1 1 96 96 TRP N N 96 120.813 120.813 121.190 -0.377 19497
943 1 2 . 1 1 96 96 TRP C C 96 175.488 175.488 174.715 0.773 19497
944 1 2 . 1 1 96 96 TRP CA C 96 57.700 57.700 56.331 1.369 19497
945 1 2 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.300 0.100 19497
946 1 2 . 1 1 96 96 TRP H H 96 8.254 8.254 7.921 0.333 19497
947 1 2 . 1 1 97 97 ASP N N 97 117.140 117.140 127.819 -10.679 19497
948 1 2 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.629 3.071 19497
949 1 2 . 1 1 97 97 ASP CB C 97 39.600 39.600 43.618 -4.018 19497
950 1 2 . 1 1 97 97 ASP H H 97 8.958 8.958 8.026 0.932 19497
951 1 2 . 1 1 98 98 PRO C C 98 174.071 174.071 176.589 -2.518 19497
952 1 2 . 1 1 98 98 PRO CA C 98 63.100 63.100 64.743 -1.643 19497
953 1 2 . 1 1 98 98 PRO CB C 98 32.400 32.400 31.987 0.413 19497
954 1 2 . 1 1 99 99 LEU N N 99 118.888 118.888 117.190 1.698 19497
955 1 2 . 1 1 99 99 LEU C C 99 177.519 177.519 177.033 0.486 19497
956 1 2 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.349 0.052 19497
957 1 2 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.546 -1.046 19497
958 1 2 . 1 1 99 99 LEU H H 99 8.182 8.182 7.629 0.553 19497
959 1 2 . 1 1 100 100 CYS N N 100 118.788 118.788 117.910 0.878 19497
960 1 2 . 1 1 100 100 CYS C C 100 174.685 174.685 173.438 1.247 19497
961 1 2 . 1 1 100 100 CYS CA C 100 60.800 60.800 59.138 1.662 19497
962 1 2 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.073 0.327 19497
963 1 2 . 1 1 100 100 CYS H H 100 6.862 6.862 7.778 -0.916 19497
964 1 2 . 1 1 101 101 TRP N N 101 117.558 117.558 121.110 -3.552 19497
965 1 2 . 1 1 101 101 TRP C C 101 176.478 176.478 174.768 1.710 19497
966 1 2 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.097 -1.697 19497
967 1 2 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.738 -2.538 19497
968 1 2 . 1 1 101 101 TRP H H 101 7.662 7.662 7.346 0.316 19497
969 1 2 . 1 1 102 102 SER N N 102 115.626 115.626 115.820 -0.194 19497
970 1 2 . 1 1 102 102 SER C C 102 174.303 174.303 173.807 0.496 19497
971 1 2 . 1 1 102 102 SER CA C 102 58.900 58.900 57.362 1.538 19497
972 1 2 . 1 1 102 102 SER CB C 102 63.700 63.700 65.815 -2.115 19497
973 1 2 . 1 1 102 102 SER H H 102 7.734 7.734 8.149 -0.415 19497
974 1 2 . 1 1 103 103 ASP N N 103 121.936 121.936 116.889 5.047 19497
975 1 2 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.914 -0.514 19497
976 1 2 . 1 1 103 103 ASP CB C 103 40.600 40.600 39.689 0.911 19497
977 1 2 . 1 1 103 103 ASP H H 103 8.254 8.254 8.761 -0.507 19497
978 1 2 . 1 1 104 104 ARG N N 104 120.567 120.567 122.102 -1.535 19497
979 1 2 . 1 1 104 104 ARG C C 104 176.177 176.177 176.414 -0.237 19497
980 1 2 . 1 1 104 104 ARG CA C 104 56.000 56.000 55.473 0.527 19497
981 1 2 . 1 1 104 104 ARG CB C 104 30.300 30.300 30.942 -0.642 19497
982 1 2 . 1 1 104 104 ARG H H 104 7.910 7.910 8.432 -0.522 19497
983 1 2 . 1 1 105 105 LYS N N 105 121.805 121.805 121.413 0.392 19497
984 1 2 . 1 1 105 105 LYS C C 105 176.141 176.141 176.458 -0.317 19497
985 1 2 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.931 -1.831 19497
986 1 2 . 1 1 105 105 LYS CB C 105 32.800 32.800 31.997 0.803 19497
987 1 2 . 1 1 105 105 LYS H H 105 8.094 8.094 8.205 -0.111 19497
988 1 2 . 1 1 106 106 SER N N 106 116.792 116.792 111.168 5.624 19497
989 1 2 . 1 1 106 106 SER C C 106 172.841 172.841 172.063 0.778 19497
990 1 2 . 1 1 106 106 SER CA C 106 57.900 57.900 57.734 0.166 19497
991 1 2 . 1 1 106 106 SER CB C 106 63.800 63.800 62.660 1.140 19497
992 1 2 . 1 1 106 106 SER H H 106 8.030 8.030 8.105 -0.075 19497
993 1 3 . 1 1 2 2 ARG N N 2 117.187 117.187 121.323 -4.136 19497
994 1 3 . 1 1 2 2 ARG C C 2 172.315 172.315 174.305 -1.990 19497
995 1 3 . 1 1 2 2 ARG CA C 2 55.100 55.100 54.966 0.134 19497
996 1 3 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.348 -1.348 19497
997 1 3 . 1 1 2 2 ARG H H 2 7.766 7.766 8.541 -0.775 19497
998 1 3 . 1 1 3 3 LEU N N 3 125.426 125.426 120.268 5.158 19497
999 1 3 . 1 1 3 3 LEU C C 3 173.996 173.996 174.614 -0.618 19497
1000 1 3 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.664 -1.064 19497
1001 1 3 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.207 -1.107 19497
1002 1 3 . 1 1 3 3 LEU H H 3 8.246 8.246 7.963 0.283 19497
1003 1 3 . 1 1 4 4 PHE N N 4 122.682 122.682 121.640 1.042 19497
1004 1 3 . 1 1 4 4 PHE C C 4 175.512 175.512 174.517 0.995 19497
1005 1 3 . 1 1 4 4 PHE CA C 4 55.700 55.700 57.005 -1.306 19497
1006 1 3 . 1 1 4 4 PHE CB C 4 41.800 41.800 41.230 0.570 19497
1007 1 3 . 1 1 4 4 PHE H H 4 9.390 9.390 8.436 0.954 19497
1008 1 3 . 1 1 5 5 GLU N N 5 125.826 125.826 119.656 6.170 19497
1009 1 3 . 1 1 5 5 GLU C C 5 175.679 175.679 175.137 0.542 19497
1010 1 3 . 1 1 5 5 GLU CA C 5 56.400 56.400 54.617 1.783 19497
1011 1 3 . 1 1 5 5 GLU CB C 5 29.400 29.400 34.548 -5.148 19497
1012 1 3 . 1 1 5 5 GLU H H 5 9.190 9.190 8.719 0.471 19497
1013 1 3 . 1 1 6 6 CYS N N 6 121.540 121.540 119.427 2.113 19497
1014 1 3 . 1 1 6 6 CYS C C 6 175.738 175.738 174.509 1.229 19497
1015 1 3 . 1 1 6 6 CYS CA C 6 56.100 56.100 58.579 -2.479 19497
1016 1 3 . 1 1 6 6 CYS CB C 6 28.200 28.200 30.253 -2.053 19497
1017 1 3 . 1 1 6 6 CYS H H 6 8.158 8.158 8.599 -0.441 19497
1018 1 3 . 1 1 7 7 SER N N 7 116.299 116.299 116.602 -0.303 19497
1019 1 3 . 1 1 7 7 SER C C 7 173.277 173.277 172.928 0.349 19497
1020 1 3 . 1 1 7 7 SER CA C 7 58.300 58.300 57.341 0.959 19497
1021 1 3 . 1 1 7 7 SER CB C 7 64.300 64.300 65.197 -0.897 19497
1022 1 3 . 1 1 7 7 SER H H 7 7.734 7.734 8.171 -0.437 19497
1023 1 3 . 1 1 8 8 ASN N N 8 127.642 127.642 122.870 4.772 19497
1024 1 3 . 1 1 8 8 ASN C C 8 177.812 177.812 174.822 2.990 19497
1025 1 3 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.561 2.339 19497
1026 1 3 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.865 -0.665 19497
1027 1 3 . 1 1 8 8 ASN H H 8 8.006 8.006 8.680 -0.674 19497
1028 1 3 . 1 1 9 9 LYS N N 9 122.472 122.472 120.019 2.453 19497
1029 1 3 . 1 1 9 9 LYS C C 9 177.932 177.932 177.554 0.378 19497
1030 1 3 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.973 2.327 19497
1031 1 3 . 1 1 9 9 LYS CB C 9 32.400 32.400 32.996 -0.596 19497
1032 1 3 . 1 1 9 9 LYS H H 9 8.350 8.350 8.207 0.143 19497
1033 1 3 . 1 1 10 10 THR N N 10 109.478 109.478 115.042 -5.564 19497
1034 1 3 . 1 1 10 10 THR C C 10 175.241 175.241 174.915 0.326 19497
1035 1 3 . 1 1 10 10 THR CA C 10 62.400 62.400 62.449 -0.049 19497
1036 1 3 . 1 1 10 10 THR CB C 10 69.700 69.700 68.692 1.008 19497
1037 1 3 . 1 1 10 10 THR H H 10 8.486 8.486 8.470 0.016 19497
1038 1 3 . 1 1 11 11 GLY N N 11 110.146 110.146 109.262 0.884 19497
1039 1 3 . 1 1 11 11 GLY C C 11 172.717 172.717 173.990 -1.273 19497
1040 1 3 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.791 -0.091 19497
1041 1 3 . 1 1 11 11 GLY H H 11 8.014 8.014 7.767 0.247 19497
1042 1 3 . 1 1 12 12 ARG N N 12 117.911 117.911 117.942 -0.031 19497
1043 1 3 . 1 1 12 12 ARG C C 12 173.660 173.660 175.511 -1.851 19497
1044 1 3 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.710 -1.910 19497
1045 1 3 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.421 2.979 19497
1046 1 3 . 1 1 12 12 ARG H H 12 7.342 7.342 8.045 -0.703 19497
1047 1 3 . 1 1 13 13 PHE N N 13 122.082 122.082 119.287 2.795 19497
1048 1 3 . 1 1 13 13 PHE C C 13 174.525 174.525 175.659 -1.134 19497
1049 1 3 . 1 1 13 13 PHE CA C 13 58.700 58.700 56.531 2.169 19497
1050 1 3 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.474 0.426 19497
1051 1 3 . 1 1 13 13 PHE H H 13 8.462 8.462 8.209 0.253 19497
1052 1 3 . 1 1 14 14 LEU N N 14 129.559 129.559 123.266 6.293 19497
1053 1 3 . 1 1 14 14 LEU C C 14 174.071 174.071 176.131 -2.060 19497
1054 1 3 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.097 -0.997 19497
1055 1 3 . 1 1 14 14 LEU CB C 14 45.500 45.500 42.131 3.369 19497
1056 1 3 . 1 1 14 14 LEU H H 14 8.054 8.054 7.430 0.624 19497
1057 1 3 . 1 1 15 15 ALA N N 15 126.873 126.873 131.402 -4.529 19497
1058 1 3 . 1 1 15 15 ALA C C 15 176.826 176.826 176.753 0.073 19497
1059 1 3 . 1 1 15 15 ALA CA C 15 49.900 49.900 51.206 -1.306 19497
1060 1 3 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.330 -1.030 19497
1061 1 3 . 1 1 15 15 ALA H H 15 8.190 8.190 8.209 -0.019 19497
1062 1 3 . 1 1 16 16 THR N N 16 120.557 120.557 119.644 0.913 19497
1063 1 3 . 1 1 16 16 THR C C 16 173.449 173.449 174.807 -1.358 19497
1064 1 3 . 1 1 16 16 THR CA C 16 61.500 61.500 62.606 -1.106 19497
1065 1 3 . 1 1 16 16 THR CB C 16 70.500 70.500 68.821 1.679 19497
1066 1 3 . 1 1 16 16 THR H H 16 9.014 9.014 8.668 0.346 19497
1067 1 3 . 1 1 17 17 GLU N N 17 129.862 129.862 126.504 3.358 19497
1068 1 3 . 1 1 17 17 GLU C C 17 175.703 175.703 176.360 -0.657 19497
1069 1 3 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.115 1.784 19497
1070 1 3 . 1 1 17 17 GLU CB C 17 29.200 29.200 29.037 0.163 19497
1071 1 3 . 1 1 17 17 GLU H H 17 9.118 9.118 8.357 0.761 19497
1072 1 3 . 1 1 18 18 ILE N N 18 128.992 128.992 118.342 10.650 19497
1073 1 3 . 1 1 18 18 ILE C C 18 175.994 175.994 176.740 -0.746 19497
1074 1 3 . 1 1 18 18 ILE CA C 18 59.600 59.600 61.261 -1.661 19497
1075 1 3 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.342 -1.042 19497
1076 1 3 . 1 1 18 18 ILE H H 18 8.686 8.686 7.883 0.803 19497
1077 1 3 . 1 1 19 19 VAL N N 19 127.812 127.812 118.902 8.910 19497
1078 1 3 . 1 1 19 19 VAL C C 19 175.611 175.611 175.277 0.334 19497
1079 1 3 . 1 1 19 19 VAL CA C 19 62.700 62.700 63.093 -0.393 19497
1080 1 3 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.925 0.075 19497
1081 1 3 . 1 1 19 19 VAL H H 19 8.422 8.422 8.131 0.291 19497
1082 1 3 . 1 1 20 20 ASP N N 20 123.008 123.008 119.673 3.335 19497
1083 1 3 . 1 1 20 20 ASP C C 20 175.669 175.669 174.971 0.698 19497
1084 1 3 . 1 1 20 20 ASP CA C 20 54.900 54.900 55.104 -0.204 19497
1085 1 3 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.405 -2.905 19497
1086 1 3 . 1 1 20 20 ASP H H 20 8.894 8.894 8.067 0.827 19497
1087 1 3 . 1 1 21 21 PHE N N 21 112.724 112.724 121.087 -8.363 19497
1088 1 3 . 1 1 21 21 PHE C C 21 174.706 174.706 175.823 -1.117 19497
1089 1 3 . 1 1 21 21 PHE CA C 21 56.200 56.200 57.122 -0.922 19497
1090 1 3 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.970 1.030 19497
1091 1 3 . 1 1 21 21 PHE H H 21 6.261 6.261 7.827 -1.566 19497
1092 1 3 . 1 1 22 22 THR N N 22 112.022 112.022 113.215 -1.193 19497
1093 1 3 . 1 1 22 22 THR C C 22 175.111 175.111 173.773 1.338 19497
1094 1 3 . 1 1 22 22 THR CA C 22 60.100 60.100 61.175 -1.075 19497
1095 1 3 . 1 1 22 22 THR H H 22 9.422 9.422 8.090 1.332 19497
1096 1 3 . 1 1 23 23 GLN N N 23 122.305 122.305 121.301 1.004 19497
1097 1 3 . 1 1 23 23 GLN C C 23 176.564 176.564 177.790 -1.226 19497
1098 1 3 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.002 -0.402 19497
1099 1 3 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.542 -1.642 19497
1100 1 3 . 1 1 23 23 GLN H H 23 9.470 9.470 8.905 0.565 19497
1101 1 3 . 1 1 24 24 ASP N N 24 114.251 114.251 120.605 -6.354 19497
1102 1 3 . 1 1 24 24 ASP C C 24 174.839 174.839 176.457 -1.618 19497
1103 1 3 . 1 1 24 24 ASP CA C 24 55.700 55.700 57.074 -1.374 19497
1104 1 3 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.602 -0.102 19497
1105 1 3 . 1 1 24 24 ASP H H 24 7.534 7.534 8.814 -1.280 19497
1106 1 3 . 1 1 25 25 ASP N N 25 116.046 116.046 116.716 -0.670 19497
1107 1 3 . 1 1 25 25 ASP C C 25 176.087 176.087 175.455 0.632 19497
1108 1 3 . 1 1 25 25 ASP CA C 25 54.500 54.500 53.447 1.053 19497
1109 1 3 . 1 1 25 25 ASP CB C 25 40.600 40.600 40.189 0.411 19497
1110 1 3 . 1 1 25 25 ASP H H 25 7.454 7.454 8.403 -0.949 19497
1111 1 3 . 1 1 26 26 LEU N N 26 121.535 121.535 122.605 -1.070 19497
1112 1 3 . 1 1 26 26 LEU C C 26 176.343 176.343 176.080 0.263 19497
1113 1 3 . 1 1 26 26 LEU CA C 26 55.000 55.000 53.874 1.126 19497
1114 1 3 . 1 1 26 26 LEU CB C 26 41.300 41.300 42.152 -0.852 19497
1115 1 3 . 1 1 26 26 LEU H H 26 8.014 8.014 7.464 0.550 19497
1116 1 3 . 1 1 27 27 ASP N N 27 127.804 127.804 124.986 2.818 19497
1117 1 3 . 1 1 27 27 ASP C C 27 176.947 176.947 176.059 0.888 19497
1118 1 3 . 1 1 27 27 ASP CA C 27 54.000 54.000 54.195 -0.195 19497
1119 1 3 . 1 1 27 27 ASP CB C 27 43.400 43.400 41.695 1.705 19497
1120 1 3 . 1 1 27 27 ASP H H 27 8.326 8.326 7.941 0.385 19497
1121 1 3 . 1 1 28 28 GLU N N 28 123.641 123.641 119.330 4.311 19497
1122 1 3 . 1 1 28 28 GLU C C 28 176.141 176.141 175.924 0.217 19497
1123 1 3 . 1 1 28 28 GLU CA C 28 54.500 54.500 57.882 -3.382 19497
1124 1 3 . 1 1 28 28 GLU CB C 28 32.700 32.700 30.857 1.843 19497
1125 1 3 . 1 1 28 28 GLU H H 28 8.278 8.278 8.771 -0.493 19497
1126 1 3 . 1 1 29 29 ASN N N 29 120.901 120.901 117.027 3.874 19497
1127 1 3 . 1 1 29 29 ASN C C 29 174.383 174.383 173.666 0.717 19497
1128 1 3 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.839 4.461 19497
1129 1 3 . 1 1 29 29 ASN CB C 29 38.300 38.300 39.109 -0.809 19497
1130 1 3 . 1 1 29 29 ASN H H 29 8.022 8.022 8.485 -0.463 19497
1131 1 3 . 1 1 30 30 ASP N N 30 125.016 125.016 119.127 5.889 19497
1132 1 3 . 1 1 30 30 ASP C C 30 175.679 175.679 174.105 1.574 19497
1133 1 3 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.272 -0.972 19497
1134 1 3 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.167 -3.167 19497
1135 1 3 . 1 1 30 30 ASP H H 30 8.142 8.142 7.708 0.434 19497
1136 1 3 . 1 1 31 31 VAL N N 31 121.540 121.540 117.597 3.943 19497
1137 1 3 . 1 1 31 31 VAL C C 31 175.675 175.675 174.479 1.196 19497
1138 1 3 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.016 0.984 19497
1139 1 3 . 1 1 31 31 VAL CB C 31 32.800 32.800 33.820 -1.020 19497
1140 1 3 . 1 1 31 31 VAL H H 31 8.158 8.158 8.294 -0.136 19497
1141 1 3 . 1 1 32 32 TYR N N 32 126.116 126.116 123.889 2.227 19497
1142 1 3 . 1 1 32 32 TYR C C 32 173.449 173.449 175.254 -1.805 19497
1143 1 3 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.321 -0.321 19497
1144 1 3 . 1 1 32 32 TYR H H 32 8.294 8.294 8.487 -0.193 19497
1145 1 3 . 1 1 33 33 LEU N N 33 121.235 121.235 121.128 0.107 19497
1146 1 3 . 1 1 33 33 LEU C C 33 174.948 174.948 175.255 -0.307 19497
1147 1 3 . 1 1 33 33 LEU CA C 33 53.300 53.300 54.001 -0.701 19497
1148 1 3 . 1 1 33 33 LEU CB C 33 45.700 45.700 43.172 2.528 19497
1149 1 3 . 1 1 33 33 LEU H H 33 9.142 9.142 8.890 0.252 19497
1150 1 3 . 1 1 34 34 LEU N N 34 127.452 127.452 125.446 2.006 19497
1151 1 3 . 1 1 34 34 LEU C C 34 174.084 174.084 174.868 -0.784 19497
1152 1 3 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.177 -0.977 19497
1153 1 3 . 1 1 34 34 LEU CB C 34 44.700 44.700 41.627 3.073 19497
1154 1 3 . 1 1 34 34 LEU H H 34 9.686 9.686 7.770 1.916 19497
1155 1 3 . 1 1 35 35 ASP N N 35 126.977 126.977 128.997 -2.020 19497
1156 1 3 . 1 1 35 35 ASP C C 35 177.009 177.009 175.276 1.733 19497
1157 1 3 . 1 1 35 35 ASP CA C 35 52.600 52.600 52.899 -0.299 19497
1158 1 3 . 1 1 35 35 ASP CB C 35 41.400 41.400 42.809 -1.409 19497
1159 1 3 . 1 1 35 35 ASP H H 35 9.446 9.446 8.632 0.814 19497
1160 1 3 . 1 1 36 36 THR N N 36 118.735 118.735 120.102 -1.367 19497
1161 1 3 . 1 1 36 36 THR C C 36 175.252 175.252 175.402 -0.150 19497
1162 1 3 . 1 1 36 36 THR CA C 36 60.500 60.500 61.124 -0.624 19497
1163 1 3 . 1 1 36 36 THR CB C 36 68.000 68.000 70.014 -2.014 19497
1164 1 3 . 1 1 36 36 THR H H 36 8.310 8.310 8.617 -0.307 19497
1165 1 3 . 1 1 37 37 TRP N N 37 122.289 122.289 122.925 -0.636 19497
1166 1 3 . 1 1 37 37 TRP C C 37 177.189 177.189 177.390 -0.201 19497
1167 1 3 . 1 1 37 37 TRP CA C 37 61.500 61.500 59.867 1.633 19497
1168 1 3 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.739 -0.939 19497
1169 1 3 . 1 1 37 37 TRP H H 37 9.022 9.022 8.816 0.206 19497
1170 1 3 . 1 1 38 38 ASP N N 38 117.370 117.370 115.867 1.503 19497
1171 1 3 . 1 1 38 38 ASP C C 38 175.290 175.290 175.948 -0.658 19497
1172 1 3 . 1 1 38 38 ASP CA C 38 55.400 55.400 54.733 0.667 19497
1173 1 3 . 1 1 38 38 ASP CB C 38 41.100 41.100 42.025 -0.925 19497
1174 1 3 . 1 1 38 38 ASP H H 38 8.518 8.518 8.209 0.309 19497
1175 1 3 . 1 1 39 39 GLN N N 39 111.522 111.522 119.049 -7.527 19497
1176 1 3 . 1 1 39 39 GLN C C 39 173.099 173.099 173.714 -0.615 19497
1177 1 3 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.043 -0.543 19497
1178 1 3 . 1 1 39 39 GLN CB C 39 28.900 28.900 32.502 -3.602 19497
1179 1 3 . 1 1 39 39 GLN H H 39 7.118 7.118 7.621 -0.503 19497
1180 1 3 . 1 1 40 40 ILE N N 40 121.103 121.103 121.046 0.057 19497
1181 1 3 . 1 1 40 40 ILE C C 40 174.406 174.406 174.203 0.203 19497
1182 1 3 . 1 1 40 40 ILE CA C 40 58.900 58.900 59.696 -0.796 19497
1183 1 3 . 1 1 40 40 ILE CB C 40 38.900 38.900 39.374 -0.474 19497
1184 1 3 . 1 1 40 40 ILE H H 40 8.422 8.422 7.974 0.448 19497
1185 1 3 . 1 1 41 41 PHE N N 41 123.856 123.856 124.331 -0.475 19497
1186 1 3 . 1 1 41 41 PHE C C 41 174.537 174.537 175.005 -0.468 19497
1187 1 3 . 1 1 41 41 PHE CA C 41 55.900 55.900 55.752 0.148 19497
1188 1 3 . 1 1 41 41 PHE CB C 41 42.200 42.200 40.983 1.217 19497
1189 1 3 . 1 1 41 41 PHE H H 41 9.222 9.222 8.779 0.443 19497
1190 1 3 . 1 1 42 42 PHE N N 42 127.400 127.400 122.628 4.772 19497
1191 1 3 . 1 1 42 42 PHE C C 42 173.021 173.021 175.111 -2.090 19497
1192 1 3 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.425 -0.125 19497
1193 1 3 . 1 1 42 42 PHE CB C 42 42.300 42.300 38.890 3.410 19497
1194 1 3 . 1 1 42 42 PHE H H 42 9.358 9.358 8.888 0.470 19497
1195 1 3 . 1 1 43 43 TRP N N 43 129.616 129.616 127.198 2.418 19497
1196 1 3 . 1 1 43 43 TRP C C 43 174.538 174.538 175.368 -0.830 19497
1197 1 3 . 1 1 43 43 TRP CA C 43 61.600 61.600 56.565 5.035 19497
1198 1 3 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.332 7.868 19497
1199 1 3 . 1 1 43 43 TRP H H 43 9.646 9.646 8.912 0.734 19497
1200 1 3 . 1 1 44 44 ILE N N 44 121.402 121.402 130.140 -8.738 19497
1201 1 3 . 1 1 44 44 ILE C C 44 175.738 175.738 175.054 0.684 19497
1202 1 3 . 1 1 44 44 ILE CA C 44 57.600 57.600 60.068 -2.468 19497
1203 1 3 . 1 1 44 44 ILE CB C 44 39.100 39.100 37.877 1.223 19497
1204 1 3 . 1 1 44 44 ILE H H 44 7.838 7.838 8.840 -1.002 19497
1205 1 3 . 1 1 45 45 GLY N N 45 114.403 114.403 112.445 1.958 19497
1206 1 3 . 1 1 45 45 GLY C C 45 175.519 175.519 173.975 1.544 19497
1207 1 3 . 1 1 45 45 GLY CA C 45 46.500 46.500 45.279 1.221 19497
1208 1 3 . 1 1 45 45 GLY H H 45 7.742 7.742 7.945 -0.203 19497
1209 1 3 . 1 1 46 46 LYS N N 46 123.585 123.585 122.424 1.161 19497
1210 1 3 . 1 1 46 46 LYS C C 46 177.790 177.790 177.940 -0.150 19497
1211 1 3 . 1 1 46 46 LYS CA C 46 58.700 58.700 58.040 0.660 19497
1212 1 3 . 1 1 46 46 LYS CB C 46 32.200 32.200 32.744 -0.544 19497
1213 1 3 . 1 1 46 46 LYS H H 46 8.942 8.942 8.024 0.918 19497
1214 1 3 . 1 1 47 47 GLY N N 47 107.819 107.819 108.435 -0.616 19497
1215 1 3 . 1 1 47 47 GLY C C 47 174.298 174.298 173.949 0.349 19497
1216 1 3 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.667 -0.367 19497
1217 1 3 . 1 1 47 47 GLY H H 47 8.670 8.670 7.647 1.023 19497
1218 1 3 . 1 1 48 48 ALA N N 48 123.965 123.965 123.463 0.502 19497
1219 1 3 . 1 1 48 48 ALA C C 48 177.189 177.189 177.126 0.063 19497
1220 1 3 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.441 0.659 19497
1221 1 3 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.772 -0.772 19497
1222 1 3 . 1 1 48 48 ALA H H 48 7.230 7.230 7.025 0.205 19497
1223 1 3 . 1 1 49 49 ASN N N 49 119.667 119.667 119.797 -0.130 19497
1224 1 3 . 1 1 49 49 ASN C C 49 175.797 175.797 176.514 -0.717 19497
1225 1 3 . 1 1 49 49 ASN CA C 49 54.200 54.200 53.530 0.670 19497
1226 1 3 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.440 1.660 19497
1227 1 3 . 1 1 49 49 ASN H H 49 8.526 8.526 8.555 -0.029 19497
1228 1 3 . 1 1 50 50 GLU N N 50 112.272 112.272 123.542 -11.270 19497
1229 1 3 . 1 1 50 50 GLU C C 50 178.128 178.128 178.015 0.113 19497
1230 1 3 . 1 1 50 50 GLU CA C 50 59.600 59.600 58.172 1.428 19497
1231 1 3 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.815 -0.515 19497
1232 1 3 . 1 1 50 50 GLU H H 50 7.814 7.814 8.935 -1.121 19497
1233 1 3 . 1 1 51 51 SER N N 51 113.952 113.952 115.487 -1.535 19497
1234 1 3 . 1 1 51 51 SER C C 51 177.874 177.874 175.165 2.709 19497
1235 1 3 . 1 1 51 51 SER CA C 51 61.100 61.100 60.949 0.151 19497
1236 1 3 . 1 1 51 51 SER CB C 51 60.900 60.900 63.283 -2.383 19497
1237 1 3 . 1 1 51 51 SER H H 51 8.342 8.342 7.966 0.376 19497
1238 1 3 . 1 1 52 52 GLU N N 52 119.930 119.930 120.652 -0.722 19497
1239 1 3 . 1 1 52 52 GLU C C 52 178.827 178.827 176.643 2.184 19497
1240 1 3 . 1 1 52 52 GLU CA C 52 57.900 57.900 57.494 0.406 19497
1241 1 3 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.906 -0.606 19497
1242 1 3 . 1 1 52 52 GLU H H 52 7.806 7.806 8.312 -0.506 19497
1243 1 3 . 1 1 53 53 LYS N N 53 118.112 118.112 116.902 1.210 19497
1244 1 3 . 1 1 53 53 LYS C C 53 178.802 178.802 178.732 0.070 19497
1245 1 3 . 1 1 53 53 LYS CA C 53 60.000 60.000 57.533 2.467 19497
1246 1 3 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.912 -0.712 19497
1247 1 3 . 1 1 53 53 LYS H H 53 7.670 7.670 7.405 0.265 19497
1248 1 3 . 1 1 54 54 GLU N N 54 117.700 117.700 119.894 -2.194 19497
1249 1 3 . 1 1 54 54 GLU C C 54 177.733 177.733 176.403 1.330 19497
1250 1 3 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.416 -0.216 19497
1251 1 3 . 1 1 54 54 GLU CB C 54 29.300 29.300 30.236 -0.936 19497
1252 1 3 . 1 1 54 54 GLU H H 54 7.934 7.934 8.302 -0.368 19497
1253 1 3 . 1 1 55 55 ALA N N 55 120.395 120.395 120.770 -0.375 19497
1254 1 3 . 1 1 55 55 ALA CA C 55 52.200 52.200 50.868 1.332 19497
1255 1 3 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.851 -0.651 19497
1256 1 3 . 1 1 55 55 ALA H H 55 7.238 7.238 8.172 -0.934 19497
1257 1 3 . 1 1 56 56 ALA C C 56 177.526 177.526 178.342 -0.816 19497
1258 1 3 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.902 0.698 19497
1259 1 3 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.852 0.748 19497
1260 1 3 . 1 1 57 57 ALA N N 57 117.753 117.753 118.180 -0.427 19497
1261 1 3 . 1 1 57 57 ALA C C 57 180.072 180.072 178.623 1.449 19497
1262 1 3 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.351 1.849 19497
1263 1 3 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.366 -0.967 19497
1264 1 3 . 1 1 57 57 ALA H H 57 7.990 7.990 8.097 -0.107 19497
1265 1 3 . 1 1 58 58 GLU N N 58 118.444 118.444 118.893 -0.449 19497
1266 1 3 . 1 1 58 58 GLU C C 58 179.225 179.225 178.372 0.853 19497
1267 1 3 . 1 1 58 58 GLU CA C 58 59.600 59.600 59.160 0.440 19497
1268 1 3 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.627 -0.727 19497
1269 1 3 . 1 1 58 58 GLU H H 58 7.582 7.582 8.369 -0.787 19497
1270 1 3 . 1 1 59 59 THR N N 59 119.842 119.842 116.670 3.172 19497
1271 1 3 . 1 1 59 59 THR C C 59 175.781 175.781 176.214 -0.433 19497
1272 1 3 . 1 1 59 59 THR CA C 59 66.200 66.200 65.733 0.467 19497
1273 1 3 . 1 1 59 59 THR CB C 59 67.600 67.600 68.088 -0.488 19497
1274 1 3 . 1 1 59 59 THR H H 59 8.422 8.422 8.175 0.247 19497
1275 1 3 . 1 1 60 60 ALA N N 60 122.454 122.454 124.881 -2.427 19497
1276 1 3 . 1 1 60 60 ALA C C 60 178.583 178.583 179.124 -0.541 19497
1277 1 3 . 1 1 60 60 ALA CA C 60 55.200 55.200 54.753 0.447 19497
1278 1 3 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.390 0.710 19497
1279 1 3 . 1 1 60 60 ALA H H 60 7.966 7.966 7.931 0.035 19497
1280 1 3 . 1 1 61 61 GLN N N 61 115.462 115.462 117.719 -2.257 19497
1281 1 3 . 1 1 61 61 GLN C C 61 178.101 178.101 178.073 0.028 19497
1282 1 3 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.412 0.488 19497
1283 1 3 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.253 -0.153 19497
1284 1 3 . 1 1 61 61 GLN H H 61 7.598 7.598 7.709 -0.111 19497
1285 1 3 . 1 1 62 62 GLU N N 62 120.883 120.883 120.809 0.074 19497
1286 1 3 . 1 1 62 62 GLU C C 62 174.071 174.071 178.179 -4.108 19497
1287 1 3 . 1 1 62 62 GLU CA C 62 54.100 54.100 58.927 -4.827 19497
1288 1 3 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.678 0.622 19497
1289 1 3 . 1 1 62 62 GLU H H 62 7.910 7.910 7.939 -0.029 19497
1290 1 3 . 1 1 63 63 TYR N N 63 118.888 118.888 120.598 -1.710 19497
1291 1 3 . 1 1 63 63 TYR C C 63 177.874 177.874 177.761 0.113 19497
1292 1 3 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.835 0.265 19497
1293 1 3 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.389 1.111 19497
1294 1 3 . 1 1 63 63 TYR H H 63 8.182 8.182 7.576 0.606 19497
1295 1 3 . 1 1 64 64 LEU N N 64 119.930 119.930 119.300 0.630 19497
1296 1 3 . 1 1 64 64 LEU C C 64 178.536 178.536 178.282 0.254 19497
1297 1 3 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.351 0.549 19497
1298 1 3 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.707 -2.807 19497
1299 1 3 . 1 1 64 64 LEU H H 64 7.806 7.806 7.538 0.268 19497
1300 1 3 . 1 1 65 65 ARG N N 65 117.322 117.322 117.191 0.131 19497
1301 1 3 . 1 1 65 65 ARG C C 65 177.436 177.436 178.011 -0.575 19497
1302 1 3 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.322 0.278 19497
1303 1 3 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.302 0.098 19497
1304 1 3 . 1 1 65 65 ARG H H 65 8.054 8.054 7.887 0.167 19497
1305 1 3 . 1 1 66 66 SER N N 66 111.783 111.783 112.269 -0.486 19497
1306 1 3 . 1 1 66 66 SER C C 66 173.652 173.652 174.200 -0.548 19497
1307 1 3 . 1 1 66 66 SER CA C 66 58.900 58.900 58.462 0.438 19497
1308 1 3 . 1 1 66 66 SER CB C 66 63.800 63.800 63.769 0.031 19497
1309 1 3 . 1 1 66 66 SER H H 66 7.550 7.550 7.383 0.167 19497
1310 1 3 . 1 1 67 67 HIS N N 67 124.135 124.135 123.864 0.271 19497
1311 1 3 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.169 0.531 19497
1312 1 3 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.900 -1.700 19497
1313 1 3 . 1 1 67 67 HIS H H 67 7.134 7.134 7.316 -0.182 19497
1314 1 3 . 1 1 68 68 PRO C C 68 178.101 178.101 176.630 1.471 19497
1315 1 3 . 1 1 68 68 PRO CA C 68 58.900 58.900 63.649 -4.749 19497
1316 1 3 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.786 -1.886 19497
1317 1 3 . 1 1 69 69 GLY N N 69 115.697 115.697 105.409 10.288 19497
1318 1 3 . 1 1 69 69 GLY C C 69 176.641 176.641 174.975 1.666 19497
1319 1 3 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.849 0.151 19497
1320 1 3 . 1 1 69 69 GLY H H 69 7.926 7.926 7.155 0.771 19497
1321 1 3 . 1 1 70 70 SER N N 70 115.440 115.440 114.399 1.041 19497
1322 1 3 . 1 1 70 70 SER C C 70 173.277 173.277 174.111 -0.834 19497
1323 1 3 . 1 1 70 70 SER CA C 70 58.300 58.300 58.506 -0.206 19497
1324 1 3 . 1 1 70 70 SER CB C 70 64.300 64.300 62.343 1.957 19497
1325 1 3 . 1 1 70 70 SER H H 70 8.030 8.030 7.903 0.127 19497
1326 1 3 . 1 1 71 71 ARG N N 71 127.642 127.642 119.872 7.770 19497
1327 1 3 . 1 1 71 71 ARG C C 71 175.849 175.849 175.638 0.211 19497
1328 1 3 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.005 -1.105 19497
1329 1 3 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.877 0.023 19497
1330 1 3 . 1 1 71 71 ARG H H 71 8.006 8.006 7.865 0.141 19497
1331 1 3 . 1 1 72 72 ASP N N 72 120.975 120.975 119.485 1.490 19497
1332 1 3 . 1 1 72 72 ASP C C 72 176.087 176.087 176.532 -0.445 19497
1333 1 3 . 1 1 72 72 ASP CA C 72 54.500 54.500 55.514 -1.014 19497
1334 1 3 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.397 -0.497 19497
1335 1 3 . 1 1 72 72 ASP H H 72 8.182 8.182 8.547 -0.365 19497
1336 1 3 . 1 1 73 73 LEU N N 73 121.535 121.535 125.317 -3.782 19497
1337 1 3 . 1 1 73 73 LEU C C 73 177.020 177.020 175.901 1.119 19497
1338 1 3 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.706 0.294 19497
1339 1 3 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.835 0.165 19497
1340 1 3 . 1 1 73 73 LEU H H 73 8.014 8.014 8.480 -0.466 19497
1341 1 3 . 1 1 74 74 ASP N N 74 120.525 120.525 118.401 2.124 19497
1342 1 3 . 1 1 74 74 ASP C C 74 175.797 175.797 175.613 0.184 19497
1343 1 3 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.415 0.785 19497
1344 1 3 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.026 -0.026 19497
1345 1 3 . 1 1 74 74 ASP H H 74 8.134 8.134 8.014 0.120 19497
1346 1 3 . 1 1 75 75 THR N N 75 116.656 116.656 118.395 -1.739 19497
1347 1 3 . 1 1 75 75 THR CA C 75 59.700 59.700 61.055 -1.355 19497
1348 1 3 . 1 1 75 75 THR CB C 75 69.600 69.600 68.833 0.767 19497
1349 1 3 . 1 1 75 75 THR H H 75 7.814 7.814 7.706 0.108 19497
1350 1 3 . 1 1 76 76 PRO C C 76 174.538 174.538 175.367 -0.829 19497
1351 1 3 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.828 0.672 19497
1352 1 3 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.222 0.378 19497
1353 1 3 . 1 1 77 77 ILE N N 77 121.402 121.402 122.362 -0.960 19497
1354 1 3 . 1 1 77 77 ILE C C 77 176.132 176.132 175.747 0.385 19497
1355 1 3 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.575 -1.475 19497
1356 1 3 . 1 1 77 77 ILE CB C 77 39.000 39.000 38.553 0.447 19497
1357 1 3 . 1 1 77 77 ILE H H 77 7.838 7.838 8.217 -0.379 19497
1358 1 3 . 1 1 78 78 ILE N N 78 130.292 130.292 128.951 1.341 19497
1359 1 3 . 1 1 78 78 ILE C C 78 175.084 175.084 174.428 0.656 19497
1360 1 3 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.833 0.068 19497
1361 1 3 . 1 1 78 78 ILE CB C 78 39.000 39.000 39.863 -0.863 19497
1362 1 3 . 1 1 78 78 ILE H H 78 8.910 8.910 8.466 0.444 19497
1363 1 3 . 1 1 79 79 VAL N N 79 129.237 129.237 126.313 2.924 19497
1364 1 3 . 1 1 79 79 VAL C C 79 175.907 175.907 175.596 0.311 19497
1365 1 3 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.797 1.403 19497
1366 1 3 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.203 -0.503 19497
1367 1 3 . 1 1 79 79 VAL H H 79 8.670 8.670 8.579 0.091 19497
1368 1 3 . 1 1 80 80 VAL N N 80 128.354 128.354 127.244 1.110 19497
1369 1 3 . 1 1 80 80 VAL C C 80 172.823 172.823 174.607 -1.784 19497
1370 1 3 . 1 1 80 80 VAL CA C 80 59.400 59.400 60.152 -0.752 19497
1371 1 3 . 1 1 80 80 VAL CB C 80 32.600 32.600 34.522 -1.922 19497
1372 1 3 . 1 1 80 80 VAL H H 80 9.598 9.598 8.386 1.212 19497
1373 1 3 . 1 1 81 81 LYS N N 81 123.077 123.077 121.703 1.374 19497
1374 1 3 . 1 1 81 81 LYS C C 81 178.101 178.101 175.106 2.995 19497
1375 1 3 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.551 0.849 19497
1376 1 3 . 1 1 81 81 LYS CB C 81 34.300 34.300 35.475 -1.175 19497
1377 1 3 . 1 1 81 81 LYS H H 81 8.198 8.198 8.697 -0.499 19497
1378 1 3 . 1 1 82 82 GLN N N 82 121.436 121.436 122.219 -0.783 19497
1379 1 3 . 1 1 82 82 GLN C C 82 177.068 177.068 176.508 0.560 19497
1380 1 3 . 1 1 82 82 GLN CA C 82 56.200 56.200 57.105 -0.905 19497
1381 1 3 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.752 0.648 19497
1382 1 3 . 1 1 82 82 GLN H H 82 7.910 7.910 8.482 -0.572 19497
1383 1 3 . 1 1 83 83 GLY N N 83 110.688 110.688 114.535 -3.847 19497
1384 1 3 . 1 1 83 83 GLY C C 83 173.348 173.348 174.644 -1.296 19497
1385 1 3 . 1 1 83 83 GLY CA C 83 45.000 45.000 45.222 -0.223 19497
1386 1 3 . 1 1 83 83 GLY H H 83 8.382 8.382 8.859 -0.477 19497
1387 1 3 . 1 1 84 84 PHE N N 84 119.493 119.493 120.334 -0.841 19497
1388 1 3 . 1 1 84 84 PHE C C 84 175.035 175.035 174.937 0.098 19497
1389 1 3 . 1 1 84 84 PHE CA C 84 57.300 57.300 56.609 0.691 19497
1390 1 3 . 1 1 84 84 PHE CB C 84 42.200 42.200 39.952 2.248 19497
1391 1 3 . 1 1 84 84 PHE H H 84 7.910 7.910 7.966 -0.056 19497
1392 1 3 . 1 1 85 85 GLU N N 85 124.672 124.672 122.328 2.344 19497
1393 1 3 . 1 1 85 85 GLU CA C 85 59.000 59.000 54.756 4.244 19497
1394 1 3 . 1 1 85 85 GLU CB C 85 29.700 29.700 29.653 0.047 19497
1395 1 3 . 1 1 85 85 GLU H H 85 8.142 8.142 8.059 0.083 19497
1396 1 3 . 1 1 87 87 PRO C C 87 178.284 178.284 178.496 -0.212 19497
1397 1 3 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.223 -1.123 19497
1398 1 3 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.771 -0.671 19497
1399 1 3 . 1 1 88 88 THR N N 88 106.959 106.959 111.094 -4.135 19497
1400 1 3 . 1 1 88 88 THR C C 88 174.182 174.182 176.251 -2.069 19497
1401 1 3 . 1 1 88 88 THR CA C 88 62.900 62.900 62.999 -0.099 19497
1402 1 3 . 1 1 88 88 THR CB C 88 68.000 68.000 68.678 -0.678 19497
1403 1 3 . 1 1 88 88 THR H H 88 7.110 7.110 8.071 -0.961 19497
1404 1 3 . 1 1 89 89 PHE N N 89 118.766 118.766 120.880 -2.114 19497
1405 1 3 . 1 1 89 89 PHE C C 89 175.468 175.468 177.272 -1.804 19497
1406 1 3 . 1 1 89 89 PHE CA C 89 59.800 59.800 60.985 -1.185 19497
1407 1 3 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.025 1.675 19497
1408 1 3 . 1 1 89 89 PHE H H 89 7.198 7.198 7.977 -0.779 19497
1409 1 3 . 1 1 90 90 THR N N 90 107.050 107.050 114.161 -7.111 19497
1410 1 3 . 1 1 90 90 THR C C 90 177.260 177.260 177.149 0.111 19497
1411 1 3 . 1 1 90 90 THR CA C 90 64.600 64.600 65.692 -1.092 19497
1412 1 3 . 1 1 90 90 THR CB C 90 67.900 67.900 67.757 0.143 19497
1413 1 3 . 1 1 90 90 THR H H 90 7.446 7.446 7.770 -0.324 19497
1414 1 3 . 1 1 91 91 GLY N N 91 106.738 106.738 110.763 -4.025 19497
1415 1 3 . 1 1 91 91 GLY C C 91 174.422 174.422 175.334 -0.912 19497
1416 1 3 . 1 1 91 91 GLY CA C 91 46.000 46.000 47.149 -1.149 19497
1417 1 3 . 1 1 91 91 GLY H H 91 7.646 7.646 7.925 -0.279 19497
1418 1 3 . 1 1 92 92 TRP N N 92 117.500 117.500 119.221 -1.721 19497
1419 1 3 . 1 1 92 92 TRP C C 92 174.209 174.209 176.770 -2.561 19497
1420 1 3 . 1 1 92 92 TRP CA C 92 56.900 56.900 56.938 -0.038 19497
1421 1 3 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.473 -0.073 19497
1422 1 3 . 1 1 92 92 TRP H H 92 6.790 6.790 7.363 -0.573 19497
1423 1 3 . 1 1 93 93 PHE N N 93 119.092 119.092 119.909 -0.817 19497
1424 1 3 . 1 1 93 93 PHE C C 93 175.953 175.953 176.866 -0.913 19497
1425 1 3 . 1 1 93 93 PHE CA C 93 56.700 56.700 59.133 -2.433 19497
1426 1 3 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.373 0.927 19497
1427 1 3 . 1 1 93 93 PHE H H 93 7.750 7.750 7.746 0.004 19497
1428 1 3 . 1 1 94 94 MET N N 94 121.554 121.554 126.686 -5.132 19497
1429 1 3 . 1 1 94 94 MET C C 94 175.738 175.738 176.110 -0.372 19497
1430 1 3 . 1 1 94 94 MET CA C 94 57.600 57.600 57.099 0.501 19497
1431 1 3 . 1 1 94 94 MET CB C 94 32.000 32.000 33.398 -1.398 19497
1432 1 3 . 1 1 94 94 MET H H 94 8.654 8.654 8.570 0.084 19497
1433 1 3 . 1 1 95 95 ALA N N 95 119.777 119.777 121.478 -1.701 19497
1434 1 3 . 1 1 95 95 ALA C C 95 175.441 175.441 176.082 -0.641 19497
1435 1 3 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.491 -0.191 19497
1436 1 3 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.830 1.870 19497
1437 1 3 . 1 1 95 95 ALA H H 95 7.750 7.750 8.066 -0.316 19497
1438 1 3 . 1 1 96 96 TRP N N 96 120.813 120.813 121.592 -0.779 19497
1439 1 3 . 1 1 96 96 TRP C C 96 175.488 175.488 174.819 0.669 19497
1440 1 3 . 1 1 96 96 TRP CA C 96 57.700 57.700 57.031 0.669 19497
1441 1 3 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.484 -0.084 19497
1442 1 3 . 1 1 96 96 TRP H H 96 8.254 8.254 8.075 0.179 19497
1443 1 3 . 1 1 97 97 ASP N N 97 117.140 117.140 123.037 -5.897 19497
1444 1 3 . 1 1 97 97 ASP CA C 97 53.700 53.700 51.257 2.443 19497
1445 1 3 . 1 1 97 97 ASP CB C 97 39.600 39.600 43.786 -4.186 19497
1446 1 3 . 1 1 97 97 ASP H H 97 8.958 8.958 8.547 0.411 19497
1447 1 3 . 1 1 98 98 PRO C C 98 174.071 174.071 176.321 -2.250 19497
1448 1 3 . 1 1 98 98 PRO CA C 98 63.100 63.100 64.410 -1.310 19497
1449 1 3 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.038 0.361 19497
1450 1 3 . 1 1 99 99 LEU N N 99 118.888 118.888 117.956 0.932 19497
1451 1 3 . 1 1 99 99 LEU C C 99 177.519 177.519 177.006 0.513 19497
1452 1 3 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.096 0.304 19497
1453 1 3 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.305 -0.805 19497
1454 1 3 . 1 1 99 99 LEU H H 99 8.182 8.182 7.709 0.473 19497
1455 1 3 . 1 1 100 100 CYS N N 100 118.788 118.788 117.623 1.165 19497
1456 1 3 . 1 1 100 100 CYS C C 100 174.685 174.685 173.707 0.978 19497
1457 1 3 . 1 1 100 100 CYS CA C 100 60.800 60.800 59.433 1.367 19497
1458 1 3 . 1 1 100 100 CYS CB C 100 27.400 27.400 26.748 0.652 19497
1459 1 3 . 1 1 100 100 CYS H H 100 6.862 6.862 7.951 -1.089 19497
1460 1 3 . 1 1 101 101 TRP N N 101 117.558 117.558 121.125 -3.567 19497
1461 1 3 . 1 1 101 101 TRP C C 101 176.478 176.478 174.911 1.567 19497
1462 1 3 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.238 -1.838 19497
1463 1 3 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.388 -2.188 19497
1464 1 3 . 1 1 101 101 TRP H H 101 7.662 7.662 7.419 0.243 19497
1465 1 3 . 1 1 102 102 SER N N 102 115.626 115.626 115.050 0.576 19497
1466 1 3 . 1 1 102 102 SER C C 102 174.303 174.303 173.363 0.940 19497
1467 1 3 . 1 1 102 102 SER CA C 102 58.900 58.900 57.871 1.029 19497
1468 1 3 . 1 1 102 102 SER CB C 102 63.700 63.700 65.521 -1.821 19497
1469 1 3 . 1 1 102 102 SER H H 102 7.734 7.734 8.075 -0.341 19497
1470 1 3 . 1 1 103 103 ASP N N 103 121.936 121.936 119.583 2.353 19497
1471 1 3 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.345 0.055 19497
1472 1 3 . 1 1 103 103 ASP CB C 103 40.600 40.600 39.832 0.768 19497
1473 1 3 . 1 1 103 103 ASP H H 103 8.254 8.254 8.842 -0.588 19497
1474 1 3 . 1 1 104 104 ARG N N 104 120.567 120.567 119.705 0.862 19497
1475 1 3 . 1 1 104 104 ARG C C 104 176.177 176.177 177.175 -0.998 19497
1476 1 3 . 1 1 104 104 ARG CA C 104 56.000 56.000 56.748 -0.748 19497
1477 1 3 . 1 1 104 104 ARG CB C 104 30.300 30.300 31.949 -1.649 19497
1478 1 3 . 1 1 104 104 ARG H H 104 7.910 7.910 8.093 -0.183 19497
1479 1 3 . 1 1 105 105 LYS N N 105 121.805 121.805 118.777 3.028 19497
1480 1 3 . 1 1 105 105 LYS C C 105 176.141 176.141 176.553 -0.412 19497
1481 1 3 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.196 -1.096 19497
1482 1 3 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.510 -0.710 19497
1483 1 3 . 1 1 105 105 LYS H H 105 8.094 8.094 8.244 -0.150 19497
1484 1 3 . 1 1 106 106 SER N N 106 116.792 116.792 110.273 6.519 19497
1485 1 3 . 1 1 106 106 SER C C 106 172.841 172.841 173.246 -0.405 19497
1486 1 3 . 1 1 106 106 SER CA C 106 57.900 57.900 58.118 -0.218 19497
1487 1 3 . 1 1 106 106 SER CB C 106 63.800 63.800 63.508 0.292 19497
1488 1 3 . 1 1 106 106 SER H H 106 8.030 8.030 7.817 0.213 19497
1489 1 4 . 1 1 2 2 ARG N N 2 117.187 117.187 121.473 -4.286 19497
1490 1 4 . 1 1 2 2 ARG C C 2 172.315 172.315 174.636 -2.321 19497
1491 1 4 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.450 -0.350 19497
1492 1 4 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.327 -1.327 19497
1493 1 4 . 1 1 2 2 ARG H H 2 7.766 7.766 8.050 -0.284 19497
1494 1 4 . 1 1 3 3 LEU N N 3 125.426 125.426 120.961 4.465 19497
1495 1 4 . 1 1 3 3 LEU C C 3 173.996 173.996 175.183 -1.187 19497
1496 1 4 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.766 -1.165 19497
1497 1 4 . 1 1 3 3 LEU CB C 3 45.100 45.100 45.293 -0.193 19497
1498 1 4 . 1 1 3 3 LEU H H 3 8.246 8.246 7.732 0.514 19497
1499 1 4 . 1 1 4 4 PHE N N 4 122.682 122.682 123.961 -1.279 19497
1500 1 4 . 1 1 4 4 PHE C C 4 175.512 175.512 174.777 0.735 19497
1501 1 4 . 1 1 4 4 PHE CA C 4 55.700 55.700 57.592 -1.892 19497
1502 1 4 . 1 1 4 4 PHE CB C 4 41.800 41.800 40.686 1.114 19497
1503 1 4 . 1 1 4 4 PHE H H 4 9.390 9.390 9.021 0.369 19497
1504 1 4 . 1 1 5 5 GLU N N 5 125.826 125.826 122.145 3.681 19497
1505 1 4 . 1 1 5 5 GLU C C 5 175.679 175.679 175.459 0.220 19497
1506 1 4 . 1 1 5 5 GLU CA C 5 56.400 56.400 54.241 2.159 19497
1507 1 4 . 1 1 5 5 GLU CB C 5 29.400 29.400 34.127 -4.728 19497
1508 1 4 . 1 1 5 5 GLU H H 5 9.190 9.190 8.457 0.733 19497
1509 1 4 . 1 1 6 6 CYS N N 6 121.540 121.540 118.725 2.815 19497
1510 1 4 . 1 1 6 6 CYS C C 6 175.738 175.738 174.823 0.915 19497
1511 1 4 . 1 1 6 6 CYS CA C 6 56.100 56.100 56.721 -0.622 19497
1512 1 4 . 1 1 6 6 CYS CB C 6 28.200 28.200 28.928 -0.728 19497
1513 1 4 . 1 1 6 6 CYS H H 6 8.158 8.158 8.618 -0.460 19497
1514 1 4 . 1 1 7 7 SER N N 7 116.299 116.299 116.871 -0.572 19497
1515 1 4 . 1 1 7 7 SER C C 7 173.277 173.277 172.534 0.743 19497
1516 1 4 . 1 1 7 7 SER CA C 7 58.300 58.300 57.573 0.727 19497
1517 1 4 . 1 1 7 7 SER CB C 7 64.300 64.300 65.862 -1.562 19497
1518 1 4 . 1 1 7 7 SER H H 7 7.734 7.734 8.591 -0.857 19497
1519 1 4 . 1 1 8 8 ASN N N 8 127.642 127.642 120.805 6.837 19497
1520 1 4 . 1 1 8 8 ASN C C 8 177.812 177.812 173.772 4.040 19497
1521 1 4 . 1 1 8 8 ASN CA C 8 55.900 55.900 52.991 2.909 19497
1522 1 4 . 1 1 8 8 ASN CB C 8 39.200 39.200 40.744 -1.544 19497
1523 1 4 . 1 1 8 8 ASN H H 8 8.006 8.006 8.626 -0.620 19497
1524 1 4 . 1 1 9 9 LYS N N 9 122.472 122.472 119.998 2.474 19497
1525 1 4 . 1 1 9 9 LYS C C 9 177.932 177.932 177.644 0.288 19497
1526 1 4 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.975 2.325 19497
1527 1 4 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.292 -0.892 19497
1528 1 4 . 1 1 9 9 LYS H H 9 8.350 8.350 8.357 -0.007 19497
1529 1 4 . 1 1 10 10 THR N N 10 109.478 109.478 117.702 -8.224 19497
1530 1 4 . 1 1 10 10 THR C C 10 175.241 175.241 174.049 1.192 19497
1531 1 4 . 1 1 10 10 THR CA C 10 62.400 62.400 61.564 0.836 19497
1532 1 4 . 1 1 10 10 THR CB C 10 69.700 69.700 66.802 2.898 19497
1533 1 4 . 1 1 10 10 THR H H 10 8.486 8.486 8.434 0.052 19497
1534 1 4 . 1 1 11 11 GLY N N 11 110.146 110.146 112.326 -2.180 19497
1535 1 4 . 1 1 11 11 GLY C C 11 172.717 172.717 173.215 -0.498 19497
1536 1 4 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.525 0.175 19497
1537 1 4 . 1 1 11 11 GLY H H 11 8.014 8.014 7.840 0.174 19497
1538 1 4 . 1 1 12 12 ARG N N 12 117.911 117.911 118.031 -0.120 19497
1539 1 4 . 1 1 12 12 ARG C C 12 173.660 173.660 176.683 -3.023 19497
1540 1 4 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.914 -2.114 19497
1541 1 4 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.640 2.760 19497
1542 1 4 . 1 1 12 12 ARG H H 12 7.342 7.342 7.906 -0.564 19497
1543 1 4 . 1 1 13 13 PHE N N 13 122.082 122.082 122.080 0.002 19497
1544 1 4 . 1 1 13 13 PHE C C 13 174.525 174.525 174.298 0.227 19497
1545 1 4 . 1 1 13 13 PHE CA C 13 58.700 58.700 55.635 3.065 19497
1546 1 4 . 1 1 13 13 PHE CB C 13 38.900 38.900 36.924 1.976 19497
1547 1 4 . 1 1 13 13 PHE H H 13 8.462 8.462 7.892 0.570 19497
1548 1 4 . 1 1 14 14 LEU N N 14 129.559 129.559 123.732 5.827 19497
1549 1 4 . 1 1 14 14 LEU C C 14 174.071 174.071 175.278 -1.207 19497
1550 1 4 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.142 -0.042 19497
1551 1 4 . 1 1 14 14 LEU CB C 14 45.500 45.500 43.098 2.402 19497
1552 1 4 . 1 1 14 14 LEU H H 14 8.054 8.054 7.632 0.422 19497
1553 1 4 . 1 1 15 15 ALA N N 15 126.873 126.873 130.866 -3.993 19497
1554 1 4 . 1 1 15 15 ALA C C 15 176.826 176.826 176.501 0.325 19497
1555 1 4 . 1 1 15 15 ALA CA C 15 49.900 49.900 51.009 -1.109 19497
1556 1 4 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.872 -1.572 19497
1557 1 4 . 1 1 15 15 ALA H H 15 8.190 8.190 8.065 0.125 19497
1558 1 4 . 1 1 16 16 THR N N 16 120.557 120.557 118.655 1.902 19497
1559 1 4 . 1 1 16 16 THR C C 16 173.449 173.449 174.311 -0.862 19497
1560 1 4 . 1 1 16 16 THR CA C 16 61.500 61.500 61.870 -0.370 19497
1561 1 4 . 1 1 16 16 THR CB C 16 70.500 70.500 69.101 1.399 19497
1562 1 4 . 1 1 16 16 THR H H 16 9.014 9.014 8.612 0.402 19497
1563 1 4 . 1 1 17 17 GLU N N 17 129.862 129.862 125.139 4.723 19497
1564 1 4 . 1 1 17 17 GLU C C 17 175.703 175.703 175.558 0.145 19497
1565 1 4 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.306 1.593 19497
1566 1 4 . 1 1 17 17 GLU CB C 17 29.200 29.200 30.414 -1.214 19497
1567 1 4 . 1 1 17 17 GLU H H 17 9.118 9.118 8.294 0.824 19497
1568 1 4 . 1 1 18 18 ILE N N 18 128.992 128.992 118.981 10.011 19497
1569 1 4 . 1 1 18 18 ILE C C 18 175.994 175.994 175.109 0.885 19497
1570 1 4 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.522 -0.922 19497
1571 1 4 . 1 1 18 18 ILE CB C 18 37.300 37.300 39.083 -1.783 19497
1572 1 4 . 1 1 18 18 ILE H H 18 8.686 8.686 7.967 0.719 19497
1573 1 4 . 1 1 19 19 VAL N N 19 127.812 127.812 116.304 11.508 19497
1574 1 4 . 1 1 19 19 VAL C C 19 175.611 175.611 174.915 0.696 19497
1575 1 4 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.025 0.675 19497
1576 1 4 . 1 1 19 19 VAL CB C 19 32.000 32.000 30.762 1.238 19497
1577 1 4 . 1 1 19 19 VAL H H 19 8.422 8.422 8.028 0.394 19497
1578 1 4 . 1 1 20 20 ASP N N 20 123.008 123.008 119.735 3.273 19497
1579 1 4 . 1 1 20 20 ASP C C 20 175.669 175.669 175.542 0.127 19497
1580 1 4 . 1 1 20 20 ASP CA C 20 54.900 54.900 55.121 -0.221 19497
1581 1 4 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.389 -2.889 19497
1582 1 4 . 1 1 20 20 ASP H H 20 8.894 8.894 8.047 0.847 19497
1583 1 4 . 1 1 21 21 PHE N N 21 112.724 112.724 121.847 -9.123 19497
1584 1 4 . 1 1 21 21 PHE C C 21 174.706 174.706 174.985 -0.279 19497
1585 1 4 . 1 1 21 21 PHE CA C 21 56.200 56.200 57.719 -1.519 19497
1586 1 4 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.699 1.302 19497
1587 1 4 . 1 1 21 21 PHE H H 21 6.261 6.261 8.364 -2.103 19497
1588 1 4 . 1 1 22 22 THR N N 22 112.022 112.022 114.434 -2.412 19497
1589 1 4 . 1 1 22 22 THR C C 22 175.111 175.111 174.531 0.580 19497
1590 1 4 . 1 1 22 22 THR CA C 22 60.100 60.100 60.985 -0.885 19497
1591 1 4 . 1 1 22 22 THR H H 22 9.422 9.422 8.194 1.228 19497
1592 1 4 . 1 1 23 23 GLN N N 23 122.305 122.305 122.295 0.010 19497
1593 1 4 . 1 1 23 23 GLN C C 23 176.564 176.564 177.183 -0.619 19497
1594 1 4 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.040 -0.440 19497
1595 1 4 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.402 -1.502 19497
1596 1 4 . 1 1 23 23 GLN H H 23 9.470 9.470 8.925 0.545 19497
1597 1 4 . 1 1 24 24 ASP N N 24 114.251 114.251 119.201 -4.950 19497
1598 1 4 . 1 1 24 24 ASP C C 24 174.839 174.839 177.091 -2.252 19497
1599 1 4 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.590 -0.890 19497
1600 1 4 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.519 -0.019 19497
1601 1 4 . 1 1 24 24 ASP H H 24 7.534 7.534 8.661 -1.127 19497
1602 1 4 . 1 1 25 25 ASP N N 25 116.046 116.046 117.361 -1.315 19497
1603 1 4 . 1 1 25 25 ASP C C 25 176.087 176.087 175.929 0.158 19497
1604 1 4 . 1 1 25 25 ASP CA C 25 54.500 54.500 54.952 -0.452 19497
1605 1 4 . 1 1 25 25 ASP CB C 25 40.600 40.600 40.676 -0.076 19497
1606 1 4 . 1 1 25 25 ASP H H 25 7.454 7.454 7.853 -0.399 19497
1607 1 4 . 1 1 26 26 LEU N N 26 121.535 121.535 121.625 -0.090 19497
1608 1 4 . 1 1 26 26 LEU C C 26 176.343 176.343 175.465 0.878 19497
1609 1 4 . 1 1 26 26 LEU CA C 26 55.000 55.000 53.734 1.266 19497
1610 1 4 . 1 1 26 26 LEU CB C 26 41.300 41.300 41.333 -0.033 19497
1611 1 4 . 1 1 26 26 LEU H H 26 8.014 8.014 6.975 1.039 19497
1612 1 4 . 1 1 27 27 ASP N N 27 127.804 127.804 124.848 2.956 19497
1613 1 4 . 1 1 27 27 ASP C C 27 176.947 176.947 176.643 0.304 19497
1614 1 4 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.159 0.841 19497
1615 1 4 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.325 1.075 19497
1616 1 4 . 1 1 27 27 ASP H H 27 8.326 8.326 8.581 -0.255 19497
1617 1 4 . 1 1 28 28 GLU N N 28 123.641 123.641 119.386 4.255 19497
1618 1 4 . 1 1 28 28 GLU C C 28 176.141 176.141 176.336 -0.195 19497
1619 1 4 . 1 1 28 28 GLU CA C 28 54.500 54.500 57.143 -2.643 19497
1620 1 4 . 1 1 28 28 GLU CB C 28 32.700 32.700 29.239 3.461 19497
1621 1 4 . 1 1 28 28 GLU H H 28 8.278 8.278 8.931 -0.653 19497
1622 1 4 . 1 1 29 29 ASN N N 29 120.901 120.901 117.418 3.483 19497
1623 1 4 . 1 1 29 29 ASN C C 29 174.383 174.383 173.797 0.586 19497
1624 1 4 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.444 4.856 19497
1625 1 4 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.764 -0.464 19497
1626 1 4 . 1 1 29 29 ASN H H 29 8.022 8.022 8.338 -0.316 19497
1627 1 4 . 1 1 30 30 ASP N N 30 125.016 125.016 117.375 7.641 19497
1628 1 4 . 1 1 30 30 ASP C C 30 175.679 175.679 173.427 2.252 19497
1629 1 4 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.495 -1.195 19497
1630 1 4 . 1 1 30 30 ASP CB C 30 41.000 41.000 43.942 -2.942 19497
1631 1 4 . 1 1 30 30 ASP H H 30 8.142 8.142 7.559 0.583 19497
1632 1 4 . 1 1 31 31 VAL N N 31 121.540 121.540 119.557 1.983 19497
1633 1 4 . 1 1 31 31 VAL C C 31 175.675 175.675 174.515 1.160 19497
1634 1 4 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.291 0.709 19497
1635 1 4 . 1 1 31 31 VAL CB C 31 32.800 32.800 33.181 -0.382 19497
1636 1 4 . 1 1 31 31 VAL H H 31 8.158 8.158 8.485 -0.327 19497
1637 1 4 . 1 1 32 32 TYR N N 32 126.116 126.116 125.641 0.475 19497
1638 1 4 . 1 1 32 32 TYR C C 32 173.449 173.449 174.810 -1.361 19497
1639 1 4 . 1 1 32 32 TYR CA C 32 56.000 56.000 55.897 0.103 19497
1640 1 4 . 1 1 32 32 TYR H H 32 8.294 8.294 8.421 -0.127 19497
1641 1 4 . 1 1 33 33 LEU N N 33 121.235 121.235 118.106 3.129 19497
1642 1 4 . 1 1 33 33 LEU C C 33 174.948 174.948 175.230 -0.282 19497
1643 1 4 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.769 -0.469 19497
1644 1 4 . 1 1 33 33 LEU CB C 33 45.700 45.700 43.993 1.706 19497
1645 1 4 . 1 1 33 33 LEU H H 33 9.142 9.142 8.380 0.762 19497
1646 1 4 . 1 1 34 34 LEU N N 34 127.452 127.452 124.727 2.725 19497
1647 1 4 . 1 1 34 34 LEU C C 34 174.084 174.084 175.113 -1.029 19497
1648 1 4 . 1 1 34 34 LEU CA C 34 53.200 53.200 53.602 -0.402 19497
1649 1 4 . 1 1 34 34 LEU CB C 34 44.700 44.700 41.572 3.128 19497
1650 1 4 . 1 1 34 34 LEU H H 34 9.686 9.686 8.550 1.136 19497
1651 1 4 . 1 1 35 35 ASP N N 35 126.977 126.977 127.339 -0.362 19497
1652 1 4 . 1 1 35 35 ASP C C 35 177.009 177.009 174.943 2.066 19497
1653 1 4 . 1 1 35 35 ASP CA C 35 52.600 52.600 52.941 -0.341 19497
1654 1 4 . 1 1 35 35 ASP CB C 35 41.400 41.400 40.676 0.724 19497
1655 1 4 . 1 1 35 35 ASP H H 35 9.446 9.446 7.595 1.851 19497
1656 1 4 . 1 1 36 36 THR N N 36 118.735 118.735 119.251 -0.516 19497
1657 1 4 . 1 1 36 36 THR C C 36 175.252 175.252 175.688 -0.436 19497
1658 1 4 . 1 1 36 36 THR CA C 36 60.500 60.500 61.568 -1.068 19497
1659 1 4 . 1 1 36 36 THR CB C 36 68.000 68.000 69.555 -1.556 19497
1660 1 4 . 1 1 36 36 THR H H 36 8.310 8.310 7.733 0.577 19497
1661 1 4 . 1 1 37 37 TRP N N 37 122.289 122.289 128.416 -6.127 19497
1662 1 4 . 1 1 37 37 TRP C C 37 177.189 177.189 177.074 0.115 19497
1663 1 4 . 1 1 37 37 TRP CA C 37 61.500 61.500 61.282 0.218 19497
1664 1 4 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.220 -0.419 19497
1665 1 4 . 1 1 37 37 TRP H H 37 9.022 9.022 8.894 0.128 19497
1666 1 4 . 1 1 38 38 ASP N N 38 117.370 117.370 114.993 2.377 19497
1667 1 4 . 1 1 38 38 ASP C C 38 175.290 175.290 176.119 -0.829 19497
1668 1 4 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.326 0.074 19497
1669 1 4 . 1 1 38 38 ASP CB C 38 41.100 41.100 40.816 0.284 19497
1670 1 4 . 1 1 38 38 ASP H H 38 8.518 8.518 8.378 0.140 19497
1671 1 4 . 1 1 39 39 GLN N N 39 111.522 111.522 118.585 -7.063 19497
1672 1 4 . 1 1 39 39 GLN C C 39 173.099 173.099 174.149 -1.050 19497
1673 1 4 . 1 1 39 39 GLN CA C 39 54.500 54.500 54.964 -0.464 19497
1674 1 4 . 1 1 39 39 GLN CB C 39 28.900 28.900 31.567 -2.667 19497
1675 1 4 . 1 1 39 39 GLN H H 39 7.118 7.118 7.605 -0.487 19497
1676 1 4 . 1 1 40 40 ILE N N 40 121.103 121.103 123.612 -2.509 19497
1677 1 4 . 1 1 40 40 ILE C C 40 174.406 174.406 174.843 -0.437 19497
1678 1 4 . 1 1 40 40 ILE CA C 40 58.900 58.900 59.881 -0.981 19497
1679 1 4 . 1 1 40 40 ILE CB C 40 38.900 38.900 37.907 0.993 19497
1680 1 4 . 1 1 40 40 ILE H H 40 8.422 8.422 7.965 0.457 19497
1681 1 4 . 1 1 41 41 PHE N N 41 123.856 123.856 125.290 -1.434 19497
1682 1 4 . 1 1 41 41 PHE C C 41 174.537 174.537 175.019 -0.482 19497
1683 1 4 . 1 1 41 41 PHE CA C 41 55.900 55.900 57.991 -2.091 19497
1684 1 4 . 1 1 41 41 PHE CB C 41 42.200 42.200 40.718 1.482 19497
1685 1 4 . 1 1 41 41 PHE H H 41 9.222 9.222 8.068 1.154 19497
1686 1 4 . 1 1 42 42 PHE N N 42 127.400 127.400 121.437 5.963 19497
1687 1 4 . 1 1 42 42 PHE C C 42 173.021 173.021 174.714 -1.693 19497
1688 1 4 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.562 -0.263 19497
1689 1 4 . 1 1 42 42 PHE CB C 42 42.300 42.300 39.800 2.501 19497
1690 1 4 . 1 1 42 42 PHE H H 42 9.358 9.358 8.928 0.430 19497
1691 1 4 . 1 1 43 43 TRP N N 43 129.616 129.616 126.776 2.840 19497
1692 1 4 . 1 1 43 43 TRP C C 43 174.538 174.538 175.222 -0.684 19497
1693 1 4 . 1 1 43 43 TRP CA C 43 61.600 61.600 58.832 2.768 19497
1694 1 4 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.597 7.603 19497
1695 1 4 . 1 1 43 43 TRP H H 43 9.646 9.646 8.713 0.933 19497
1696 1 4 . 1 1 44 44 ILE N N 44 121.402 121.402 126.386 -4.984 19497
1697 1 4 . 1 1 44 44 ILE C C 44 175.738 175.738 174.731 1.007 19497
1698 1 4 . 1 1 44 44 ILE CA C 44 57.600 57.600 59.494 -1.894 19497
1699 1 4 . 1 1 44 44 ILE CB C 44 39.100 39.100 39.085 0.015 19497
1700 1 4 . 1 1 44 44 ILE H H 44 7.838 7.838 7.589 0.249 19497
1701 1 4 . 1 1 45 45 GLY N N 45 114.403 114.403 110.980 3.423 19497
1702 1 4 . 1 1 45 45 GLY C C 45 175.519 175.519 174.006 1.513 19497
1703 1 4 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.110 2.390 19497
1704 1 4 . 1 1 45 45 GLY H H 45 7.742 7.742 8.001 -0.259 19497
1705 1 4 . 1 1 46 46 LYS N N 46 123.585 123.585 122.194 1.391 19497
1706 1 4 . 1 1 46 46 LYS C C 46 177.790 177.790 178.665 -0.875 19497
1707 1 4 . 1 1 46 46 LYS CA C 46 58.700 58.700 58.685 0.015 19497
1708 1 4 . 1 1 46 46 LYS CB C 46 32.200 32.200 32.585 -0.385 19497
1709 1 4 . 1 1 46 46 LYS H H 46 8.942 8.942 8.001 0.941 19497
1710 1 4 . 1 1 47 47 GLY N N 47 107.819 107.819 107.668 0.151 19497
1711 1 4 . 1 1 47 47 GLY C C 47 174.298 174.298 173.805 0.493 19497
1712 1 4 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.085 0.215 19497
1713 1 4 . 1 1 47 47 GLY H H 47 8.670 8.670 7.695 0.975 19497
1714 1 4 . 1 1 48 48 ALA N N 48 123.965 123.965 123.137 0.828 19497
1715 1 4 . 1 1 48 48 ALA C C 48 177.189 177.189 177.892 -0.703 19497
1716 1 4 . 1 1 48 48 ALA CA C 48 52.100 52.100 52.617 -0.517 19497
1717 1 4 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.305 -0.305 19497
1718 1 4 . 1 1 48 48 ALA H H 48 7.230 7.230 7.000 0.230 19497
1719 1 4 . 1 1 49 49 ASN N N 49 119.667 119.667 117.953 1.714 19497
1720 1 4 . 1 1 49 49 ASN C C 49 175.797 175.797 176.792 -0.995 19497
1721 1 4 . 1 1 49 49 ASN CA C 49 54.200 54.200 53.647 0.554 19497
1722 1 4 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.476 1.624 19497
1723 1 4 . 1 1 49 49 ASN H H 49 8.526 8.526 8.560 -0.034 19497
1724 1 4 . 1 1 50 50 GLU N N 50 112.272 112.272 122.024 -9.752 19497
1725 1 4 . 1 1 50 50 GLU C C 50 178.128 178.128 178.818 -0.690 19497
1726 1 4 . 1 1 50 50 GLU CA C 50 59.600 59.600 59.128 0.472 19497
1727 1 4 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.923 -0.623 19497
1728 1 4 . 1 1 50 50 GLU H H 50 7.814 7.814 8.944 -1.130 19497
1729 1 4 . 1 1 51 51 SER N N 51 113.952 113.952 116.394 -2.442 19497
1730 1 4 . 1 1 51 51 SER C C 51 177.874 177.874 176.310 1.564 19497
1731 1 4 . 1 1 51 51 SER CA C 51 61.100 61.100 61.750 -0.650 19497
1732 1 4 . 1 1 51 51 SER CB C 51 60.900 60.900 63.013 -2.113 19497
1733 1 4 . 1 1 51 51 SER H H 51 8.342 8.342 8.163 0.179 19497
1734 1 4 . 1 1 52 52 GLU N N 52 119.930 119.930 119.367 0.563 19497
1735 1 4 . 1 1 52 52 GLU C C 52 178.827 178.827 177.459 1.368 19497
1736 1 4 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.416 -0.516 19497
1737 1 4 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.572 -0.272 19497
1738 1 4 . 1 1 52 52 GLU H H 52 7.806 7.806 8.231 -0.425 19497
1739 1 4 . 1 1 53 53 LYS N N 53 118.112 118.112 119.113 -1.001 19497
1740 1 4 . 1 1 53 53 LYS C C 53 178.802 178.802 179.202 -0.400 19497
1741 1 4 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.693 1.307 19497
1742 1 4 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.752 -0.552 19497
1743 1 4 . 1 1 53 53 LYS H H 53 7.670 7.670 7.546 0.124 19497
1744 1 4 . 1 1 54 54 GLU N N 54 117.700 117.700 118.874 -1.174 19497
1745 1 4 . 1 1 54 54 GLU C C 54 177.733 177.733 178.365 -0.632 19497
1746 1 4 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.497 -0.297 19497
1747 1 4 . 1 1 54 54 GLU CB C 54 29.300 29.300 29.508 -0.208 19497
1748 1 4 . 1 1 54 54 GLU H H 54 7.934 7.934 8.391 -0.457 19497
1749 1 4 . 1 1 55 55 ALA N N 55 120.395 120.395 121.711 -1.316 19497
1750 1 4 . 1 1 55 55 ALA CA C 55 52.200 52.200 50.713 1.487 19497
1751 1 4 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.708 -0.508 19497
1752 1 4 . 1 1 55 55 ALA H H 55 7.238 7.238 7.638 -0.400 19497
1753 1 4 . 1 1 56 56 ALA C C 56 177.526 177.526 177.959 -0.433 19497
1754 1 4 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.614 0.986 19497
1755 1 4 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.721 0.879 19497
1756 1 4 . 1 1 57 57 ALA N N 57 117.753 117.753 118.797 -1.044 19497
1757 1 4 . 1 1 57 57 ALA C C 57 180.072 180.072 178.591 1.481 19497
1758 1 4 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.206 1.994 19497
1759 1 4 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.788 -1.388 19497
1760 1 4 . 1 1 57 57 ALA H H 57 7.990 7.990 8.274 -0.284 19497
1761 1 4 . 1 1 58 58 GLU N N 58 118.444 118.444 118.224 0.220 19497
1762 1 4 . 1 1 58 58 GLU C C 58 179.225 179.225 178.137 1.088 19497
1763 1 4 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.807 0.793 19497
1764 1 4 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.686 -0.786 19497
1765 1 4 . 1 1 58 58 GLU H H 58 7.582 7.582 8.303 -0.721 19497
1766 1 4 . 1 1 59 59 THR N N 59 119.842 119.842 116.373 3.469 19497
1767 1 4 . 1 1 59 59 THR C C 59 175.781 175.781 176.076 -0.295 19497
1768 1 4 . 1 1 59 59 THR CA C 59 66.200 66.200 66.849 -0.649 19497
1769 1 4 . 1 1 59 59 THR CB C 59 67.600 67.600 68.202 -0.602 19497
1770 1 4 . 1 1 59 59 THR H H 59 8.422 8.422 7.655 0.767 19497
1771 1 4 . 1 1 60 60 ALA N N 60 122.454 122.454 123.858 -1.404 19497
1772 1 4 . 1 1 60 60 ALA C C 60 178.583 178.583 179.229 -0.646 19497
1773 1 4 . 1 1 60 60 ALA CA C 60 55.200 55.200 54.809 0.391 19497
1774 1 4 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.486 0.614 19497
1775 1 4 . 1 1 60 60 ALA H H 60 7.966 7.966 7.542 0.424 19497
1776 1 4 . 1 1 61 61 GLN N N 61 115.462 115.462 116.971 -1.509 19497
1777 1 4 . 1 1 61 61 GLN C C 61 178.101 178.101 177.872 0.229 19497
1778 1 4 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.153 0.747 19497
1779 1 4 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.287 -0.187 19497
1780 1 4 . 1 1 61 61 GLN H H 61 7.598 7.598 7.741 -0.143 19497
1781 1 4 . 1 1 62 62 GLU N N 62 120.883 120.883 121.726 -0.843 19497
1782 1 4 . 1 1 62 62 GLU C C 62 174.071 174.071 178.420 -4.349 19497
1783 1 4 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.009 -4.909 19497
1784 1 4 . 1 1 62 62 GLU CB C 62 30.300 30.300 30.168 0.132 19497
1785 1 4 . 1 1 62 62 GLU H H 62 7.910 7.910 8.050 -0.140 19497
1786 1 4 . 1 1 63 63 TYR N N 63 118.888 118.888 119.618 -0.730 19497
1787 1 4 . 1 1 63 63 TYR C C 63 177.874 177.874 175.530 2.344 19497
1788 1 4 . 1 1 63 63 TYR CA C 63 61.100 61.100 59.908 1.192 19497
1789 1 4 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.663 0.838 19497
1790 1 4 . 1 1 63 63 TYR H H 63 8.182 8.182 8.097 0.085 19497
1791 1 4 . 1 1 64 64 LEU N N 64 119.930 119.930 118.547 1.383 19497
1792 1 4 . 1 1 64 64 LEU C C 64 178.536 178.536 177.524 1.012 19497
1793 1 4 . 1 1 64 64 LEU CA C 64 57.900 57.900 55.052 2.848 19497
1794 1 4 . 1 1 64 64 LEU CB C 64 38.900 38.900 42.547 -3.647 19497
1795 1 4 . 1 1 64 64 LEU H H 64 7.806 7.806 7.258 0.548 19497
1796 1 4 . 1 1 65 65 ARG N N 65 117.322 117.322 118.928 -1.606 19497
1797 1 4 . 1 1 65 65 ARG C C 65 177.436 177.436 178.520 -1.084 19497
1798 1 4 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.758 -0.158 19497
1799 1 4 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.045 0.355 19497
1800 1 4 . 1 1 65 65 ARG H H 65 8.054 8.054 7.687 0.367 19497
1801 1 4 . 1 1 66 66 SER N N 66 111.783 111.783 112.202 -0.419 19497
1802 1 4 . 1 1 66 66 SER C C 66 173.652 173.652 174.130 -0.478 19497
1803 1 4 . 1 1 66 66 SER CA C 66 58.900 58.900 59.466 -0.566 19497
1804 1 4 . 1 1 66 66 SER CB C 66 63.800 63.800 63.639 0.161 19497
1805 1 4 . 1 1 66 66 SER H H 66 7.550 7.550 7.726 -0.176 19497
1806 1 4 . 1 1 67 67 HIS N N 67 124.135 124.135 122.573 1.562 19497
1807 1 4 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.511 0.189 19497
1808 1 4 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.520 -1.320 19497
1809 1 4 . 1 1 67 67 HIS H H 67 7.134 7.134 7.383 -0.249 19497
1810 1 4 . 1 1 68 68 PRO C C 68 178.101 178.101 177.431 0.670 19497
1811 1 4 . 1 1 68 68 PRO CA C 68 58.900 58.900 63.540 -4.640 19497
1812 1 4 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.842 -1.942 19497
1813 1 4 . 1 1 69 69 GLY N N 69 115.697 115.697 106.910 8.787 19497
1814 1 4 . 1 1 69 69 GLY C C 69 176.641 176.641 174.379 2.262 19497
1815 1 4 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.612 0.388 19497
1816 1 4 . 1 1 69 69 GLY H H 69 7.926 7.926 7.508 0.418 19497
1817 1 4 . 1 1 70 70 SER N N 70 115.440 115.440 114.349 1.091 19497
1818 1 4 . 1 1 70 70 SER C C 70 173.277 173.277 174.254 -0.977 19497
1819 1 4 . 1 1 70 70 SER CA C 70 58.300 58.300 58.770 -0.471 19497
1820 1 4 . 1 1 70 70 SER CB C 70 64.300 64.300 62.513 1.787 19497
1821 1 4 . 1 1 70 70 SER H H 70 8.030 8.030 7.838 0.192 19497
1822 1 4 . 1 1 71 71 ARG N N 71 127.642 127.642 122.673 4.969 19497
1823 1 4 . 1 1 71 71 ARG C C 71 175.849 175.849 175.664 0.185 19497
1824 1 4 . 1 1 71 71 ARG CA C 71 53.900 53.900 54.573 -0.673 19497
1825 1 4 . 1 1 71 71 ARG CB C 71 30.900 30.900 31.081 -0.181 19497
1826 1 4 . 1 1 71 71 ARG H H 71 8.006 8.006 8.218 -0.212 19497
1827 1 4 . 1 1 72 72 ASP N N 72 120.975 120.975 119.825 1.150 19497
1828 1 4 . 1 1 72 72 ASP C C 72 176.087 176.087 177.038 -0.951 19497
1829 1 4 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.426 0.074 19497
1830 1 4 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.427 -0.527 19497
1831 1 4 . 1 1 72 72 ASP H H 72 8.182 8.182 8.539 -0.357 19497
1832 1 4 . 1 1 73 73 LEU N N 73 121.535 121.535 123.921 -2.386 19497
1833 1 4 . 1 1 73 73 LEU C C 73 177.020 177.020 175.861 1.159 19497
1834 1 4 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.611 0.389 19497
1835 1 4 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.956 0.044 19497
1836 1 4 . 1 1 73 73 LEU H H 73 8.014 8.014 8.342 -0.328 19497
1837 1 4 . 1 1 74 74 ASP N N 74 120.525 120.525 117.857 2.668 19497
1838 1 4 . 1 1 74 74 ASP C C 74 175.797 175.797 175.801 -0.004 19497
1839 1 4 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.142 1.058 19497
1840 1 4 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.167 -0.168 19497
1841 1 4 . 1 1 74 74 ASP H H 74 8.134 8.134 7.931 0.203 19497
1842 1 4 . 1 1 75 75 THR N N 75 116.656 116.656 118.470 -1.814 19497
1843 1 4 . 1 1 75 75 THR CA C 75 59.700 59.700 61.182 -1.482 19497
1844 1 4 . 1 1 75 75 THR CB C 75 69.600 69.600 69.109 0.491 19497
1845 1 4 . 1 1 75 75 THR H H 75 7.814 7.814 7.574 0.240 19497
1846 1 4 . 1 1 76 76 PRO C C 76 174.538 174.538 175.498 -0.960 19497
1847 1 4 . 1 1 76 76 PRO CA C 76 63.500 63.500 63.333 0.168 19497
1848 1 4 . 1 1 76 76 PRO CB C 76 32.600 32.600 31.648 0.952 19497
1849 1 4 . 1 1 77 77 ILE N N 77 121.402 121.402 123.542 -2.140 19497
1850 1 4 . 1 1 77 77 ILE C C 77 176.132 176.132 175.549 0.583 19497
1851 1 4 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.913 -1.813 19497
1852 1 4 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.218 -0.218 19497
1853 1 4 . 1 1 77 77 ILE H H 77 7.838 7.838 8.161 -0.323 19497
1854 1 4 . 1 1 78 78 ILE N N 78 130.292 130.292 126.197 4.095 19497
1855 1 4 . 1 1 78 78 ILE C C 78 175.084 175.084 174.879 0.205 19497
1856 1 4 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.653 0.247 19497
1857 1 4 . 1 1 78 78 ILE CB C 78 39.000 39.000 41.751 -2.751 19497
1858 1 4 . 1 1 78 78 ILE H H 78 8.910 8.910 8.434 0.476 19497
1859 1 4 . 1 1 79 79 VAL N N 79 129.237 129.237 124.299 4.938 19497
1860 1 4 . 1 1 79 79 VAL C C 79 175.907 175.907 175.500 0.407 19497
1861 1 4 . 1 1 79 79 VAL CA C 79 63.200 63.200 60.896 2.304 19497
1862 1 4 . 1 1 79 79 VAL CB C 79 31.700 31.700 33.004 -1.304 19497
1863 1 4 . 1 1 79 79 VAL H H 79 8.670 8.670 8.254 0.416 19497
1864 1 4 . 1 1 80 80 VAL N N 80 128.354 128.354 127.495 0.859 19497
1865 1 4 . 1 1 80 80 VAL C C 80 172.823 172.823 174.283 -1.460 19497
1866 1 4 . 1 1 80 80 VAL CA C 80 59.400 59.400 61.496 -2.096 19497
1867 1 4 . 1 1 80 80 VAL CB C 80 32.600 32.600 36.265 -3.665 19497
1868 1 4 . 1 1 80 80 VAL H H 80 9.598 9.598 9.149 0.449 19497
1869 1 4 . 1 1 81 81 LYS N N 81 123.077 123.077 122.909 0.168 19497
1870 1 4 . 1 1 81 81 LYS C C 81 178.101 178.101 174.737 3.364 19497
1871 1 4 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.603 0.797 19497
1872 1 4 . 1 1 81 81 LYS CB C 81 34.300 34.300 35.801 -1.501 19497
1873 1 4 . 1 1 81 81 LYS H H 81 8.198 8.198 8.425 -0.227 19497
1874 1 4 . 1 1 82 82 GLN N N 82 121.436 121.436 123.867 -2.431 19497
1875 1 4 . 1 1 82 82 GLN C C 82 177.068 177.068 176.110 0.958 19497
1876 1 4 . 1 1 82 82 GLN CA C 82 56.200 56.200 57.228 -1.028 19497
1877 1 4 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.668 0.732 19497
1878 1 4 . 1 1 82 82 GLN H H 82 7.910 7.910 8.326 -0.416 19497
1879 1 4 . 1 1 83 83 GLY N N 83 110.688 110.688 114.351 -3.663 19497
1880 1 4 . 1 1 83 83 GLY C C 83 173.348 173.348 174.137 -0.789 19497
1881 1 4 . 1 1 83 83 GLY CA C 83 45.000 45.000 45.020 -0.020 19497
1882 1 4 . 1 1 83 83 GLY H H 83 8.382 8.382 8.777 -0.395 19497
1883 1 4 . 1 1 84 84 PHE N N 84 119.493 119.493 120.390 -0.897 19497
1884 1 4 . 1 1 84 84 PHE C C 84 175.035 175.035 174.437 0.598 19497
1885 1 4 . 1 1 84 84 PHE CA C 84 57.300 57.300 55.181 2.119 19497
1886 1 4 . 1 1 84 84 PHE CB C 84 42.200 42.200 38.733 3.467 19497
1887 1 4 . 1 1 84 84 PHE H H 84 7.910 7.910 7.479 0.431 19497
1888 1 4 . 1 1 85 85 GLU N N 85 124.672 124.672 123.910 0.762 19497
1889 1 4 . 1 1 85 85 GLU CA C 85 59.000 59.000 54.442 4.558 19497
1890 1 4 . 1 1 85 85 GLU CB C 85 29.700 29.700 30.261 -0.561 19497
1891 1 4 . 1 1 85 85 GLU H H 85 8.142 8.142 8.445 -0.303 19497
1892 1 4 . 1 1 87 87 PRO C C 87 178.284 178.284 177.554 0.730 19497
1893 1 4 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.175 -1.075 19497
1894 1 4 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.863 -0.763 19497
1895 1 4 . 1 1 88 88 THR N N 88 106.959 106.959 109.139 -2.180 19497
1896 1 4 . 1 1 88 88 THR C C 88 174.182 174.182 176.549 -2.367 19497
1897 1 4 . 1 1 88 88 THR CA C 88 62.900 62.900 63.177 -0.277 19497
1898 1 4 . 1 1 88 88 THR CB C 88 68.000 68.000 68.810 -0.810 19497
1899 1 4 . 1 1 88 88 THR H H 88 7.110 7.110 7.876 -0.766 19497
1900 1 4 . 1 1 89 89 PHE N N 89 118.766 118.766 121.987 -3.221 19497
1901 1 4 . 1 1 89 89 PHE C C 89 175.468 175.468 176.948 -1.480 19497
1902 1 4 . 1 1 89 89 PHE CA C 89 59.800 59.800 59.942 -0.142 19497
1903 1 4 . 1 1 89 89 PHE CB C 89 40.700 40.700 38.613 2.087 19497
1904 1 4 . 1 1 89 89 PHE H H 89 7.198 7.198 7.727 -0.529 19497
1905 1 4 . 1 1 90 90 THR N N 90 107.050 107.050 113.535 -6.485 19497
1906 1 4 . 1 1 90 90 THR C C 90 177.260 177.260 176.077 1.183 19497
1907 1 4 . 1 1 90 90 THR CA C 90 64.600 64.600 62.998 1.602 19497
1908 1 4 . 1 1 90 90 THR CB C 90 67.900 67.900 67.097 0.804 19497
1909 1 4 . 1 1 90 90 THR H H 90 7.446 7.446 7.647 -0.201 19497
1910 1 4 . 1 1 91 91 GLY N N 91 106.738 106.738 109.051 -2.313 19497
1911 1 4 . 1 1 91 91 GLY C C 91 174.422 174.422 175.098 -0.676 19497
1912 1 4 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.276 0.724 19497
1913 1 4 . 1 1 91 91 GLY H H 91 7.646 7.646 7.804 -0.158 19497
1914 1 4 . 1 1 92 92 TRP N N 92 117.500 117.500 120.775 -3.275 19497
1915 1 4 . 1 1 92 92 TRP C C 92 174.209 174.209 176.547 -2.338 19497
1916 1 4 . 1 1 92 92 TRP CA C 92 56.900 56.900 57.159 -0.259 19497
1917 1 4 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.761 -0.360 19497
1918 1 4 . 1 1 92 92 TRP H H 92 6.790 6.790 7.177 -0.387 19497
1919 1 4 . 1 1 93 93 PHE N N 93 119.092 119.092 116.191 2.901 19497
1920 1 4 . 1 1 93 93 PHE C C 93 175.953 175.953 176.396 -0.443 19497
1921 1 4 . 1 1 93 93 PHE CA C 93 56.700 56.700 58.441 -1.741 19497
1922 1 4 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.537 0.763 19497
1923 1 4 . 1 1 93 93 PHE H H 93 7.750 7.750 7.482 0.268 19497
1924 1 4 . 1 1 94 94 MET N N 94 121.554 121.554 119.081 2.473 19497
1925 1 4 . 1 1 94 94 MET C C 94 175.738 175.738 176.138 -0.400 19497
1926 1 4 . 1 1 94 94 MET CA C 94 57.600 57.600 56.487 1.113 19497
1927 1 4 . 1 1 94 94 MET CB C 94 32.000 32.000 34.349 -2.349 19497
1928 1 4 . 1 1 94 94 MET H H 94 8.654 8.654 9.200 -0.546 19497
1929 1 4 . 1 1 95 95 ALA N N 95 119.777 119.777 122.875 -3.098 19497
1930 1 4 . 1 1 95 95 ALA C C 95 175.441 175.441 176.335 -0.894 19497
1931 1 4 . 1 1 95 95 ALA CA C 95 51.300 51.300 50.873 0.427 19497
1932 1 4 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.183 2.517 19497
1933 1 4 . 1 1 95 95 ALA H H 95 7.750 7.750 8.311 -0.561 19497
1934 1 4 . 1 1 96 96 TRP N N 96 120.813 120.813 122.013 -1.200 19497
1935 1 4 . 1 1 96 96 TRP C C 96 175.488 175.488 175.374 0.114 19497
1936 1 4 . 1 1 96 96 TRP CA C 96 57.700 57.700 56.968 0.732 19497
1937 1 4 . 1 1 96 96 TRP CB C 96 30.400 30.400 29.669 0.731 19497
1938 1 4 . 1 1 96 96 TRP H H 96 8.254 8.254 8.022 0.232 19497
1939 1 4 . 1 1 97 97 ASP N N 97 117.140 117.140 129.213 -12.073 19497
1940 1 4 . 1 1 97 97 ASP CA C 97 53.700 53.700 51.088 2.612 19497
1941 1 4 . 1 1 97 97 ASP CB C 97 39.600 39.600 42.729 -3.129 19497
1942 1 4 . 1 1 97 97 ASP H H 97 8.958 8.958 8.583 0.375 19497
1943 1 4 . 1 1 98 98 PRO C C 98 174.071 174.071 177.132 -3.061 19497
1944 1 4 . 1 1 98 98 PRO CA C 98 63.100 63.100 64.861 -1.761 19497
1945 1 4 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.075 0.325 19497
1946 1 4 . 1 1 99 99 LEU N N 99 118.888 118.888 115.101 3.787 19497
1947 1 4 . 1 1 99 99 LEU C C 99 177.519 177.519 176.543 0.976 19497
1948 1 4 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.322 0.078 19497
1949 1 4 . 1 1 99 99 LEU CB C 99 40.500 40.500 40.642 -0.143 19497
1950 1 4 . 1 1 99 99 LEU H H 99 8.182 8.182 8.147 0.035 19497
1951 1 4 . 1 1 100 100 CYS N N 100 118.788 118.788 116.662 2.126 19497
1952 1 4 . 1 1 100 100 CYS C C 100 174.685 174.685 173.880 0.805 19497
1953 1 4 . 1 1 100 100 CYS CA C 100 60.800 60.800 59.124 1.676 19497
1954 1 4 . 1 1 100 100 CYS CB C 100 27.400 27.400 26.634 0.766 19497
1955 1 4 . 1 1 100 100 CYS H H 100 6.862 6.862 7.610 -0.748 19497
1956 1 4 . 1 1 101 101 TRP N N 101 117.558 117.558 121.854 -4.296 19497
1957 1 4 . 1 1 101 101 TRP C C 101 176.478 176.478 174.814 1.664 19497
1958 1 4 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.221 -1.821 19497
1959 1 4 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.970 -2.770 19497
1960 1 4 . 1 1 101 101 TRP H H 101 7.662 7.662 7.365 0.297 19497
1961 1 4 . 1 1 102 102 SER N N 102 115.626 115.626 115.849 -0.223 19497
1962 1 4 . 1 1 102 102 SER C C 102 174.303 174.303 172.927 1.376 19497
1963 1 4 . 1 1 102 102 SER CA C 102 58.900 58.900 57.686 1.214 19497
1964 1 4 . 1 1 102 102 SER CB C 102 63.700 63.700 64.701 -1.002 19497
1965 1 4 . 1 1 102 102 SER H H 102 7.734 7.734 8.042 -0.308 19497
1966 1 4 . 1 1 103 103 ASP N N 103 121.936 121.936 119.806 2.130 19497
1967 1 4 . 1 1 103 103 ASP CA C 103 54.400 54.400 55.088 -0.688 19497
1968 1 4 . 1 1 103 103 ASP CB C 103 40.600 40.600 39.959 0.641 19497
1969 1 4 . 1 1 103 103 ASP H H 103 8.254 8.254 8.683 -0.429 19497
1970 1 4 . 1 1 104 104 ARG N N 104 120.567 120.567 118.479 2.088 19497
1971 1 4 . 1 1 104 104 ARG C C 104 176.177 176.177 176.176 0.001 19497
1972 1 4 . 1 1 104 104 ARG CA C 104 56.000 56.000 56.556 -0.556 19497
1973 1 4 . 1 1 104 104 ARG CB C 104 30.300 30.300 30.866 -0.566 19497
1974 1 4 . 1 1 104 104 ARG H H 104 7.910 7.910 8.019 -0.109 19497
1975 1 4 . 1 1 105 105 LYS N N 105 121.805 121.805 119.010 2.795 19497
1976 1 4 . 1 1 105 105 LYS C C 105 176.141 176.141 176.574 -0.433 19497
1977 1 4 . 1 1 105 105 LYS CA C 105 56.100 56.100 56.738 -0.638 19497
1978 1 4 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.473 -0.673 19497
1979 1 4 . 1 1 105 105 LYS H H 105 8.094 8.094 8.290 -0.196 19497
1980 1 4 . 1 1 106 106 SER N N 106 116.792 116.792 111.826 4.966 19497
1981 1 4 . 1 1 106 106 SER C C 106 172.841 172.841 172.790 0.051 19497
1982 1 4 . 1 1 106 106 SER CA C 106 57.900 57.900 58.887 -0.987 19497
1983 1 4 . 1 1 106 106 SER CB C 106 63.800 63.800 63.612 0.188 19497
1984 1 4 . 1 1 106 106 SER H H 106 8.030 8.030 8.097 -0.067 19497
1985 1 5 . 1 1 2 2 ARG N N 2 117.187 117.187 123.468 -6.281 19497
1986 1 5 . 1 1 2 2 ARG C C 2 172.315 172.315 175.187 -2.872 19497
1987 1 5 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.679 -0.579 19497
1988 1 5 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.378 -1.377 19497
1989 1 5 . 1 1 2 2 ARG H H 2 7.766 7.766 8.123 -0.357 19497
1990 1 5 . 1 1 3 3 LEU N N 3 125.426 125.426 120.887 4.539 19497
1991 1 5 . 1 1 3 3 LEU C C 3 173.996 173.996 175.150 -1.154 19497
1992 1 5 . 1 1 3 3 LEU CA C 3 52.600 52.600 54.880 -2.280 19497
1993 1 5 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.175 -1.075 19497
1994 1 5 . 1 1 3 3 LEU H H 3 8.246 8.246 8.210 0.036 19497
1995 1 5 . 1 1 4 4 PHE N N 4 122.682 122.682 123.033 -0.351 19497
1996 1 5 . 1 1 4 4 PHE C C 4 175.512 175.512 174.442 1.070 19497
1997 1 5 . 1 1 4 4 PHE CA C 4 55.700 55.700 57.704 -2.004 19497
1998 1 5 . 1 1 4 4 PHE CB C 4 41.800 41.800 40.288 1.512 19497
1999 1 5 . 1 1 4 4 PHE H H 4 9.390 9.390 9.010 0.380 19497
2000 1 5 . 1 1 5 5 GLU N N 5 125.826 125.826 123.535 2.291 19497
2001 1 5 . 1 1 5 5 GLU C C 5 175.679 175.679 175.699 -0.020 19497
2002 1 5 . 1 1 5 5 GLU CA C 5 56.400 56.400 53.852 2.548 19497
2003 1 5 . 1 1 5 5 GLU CB C 5 29.400 29.400 33.190 -3.790 19497
2004 1 5 . 1 1 5 5 GLU H H 5 9.190 9.190 8.521 0.669 19497
2005 1 5 . 1 1 6 6 CYS N N 6 121.540 121.540 119.652 1.888 19497
2006 1 5 . 1 1 6 6 CYS C C 6 175.738 175.738 174.326 1.412 19497
2007 1 5 . 1 1 6 6 CYS CA C 6 56.100 56.100 57.744 -1.644 19497
2008 1 5 . 1 1 6 6 CYS CB C 6 28.200 28.200 29.980 -1.780 19497
2009 1 5 . 1 1 6 6 CYS H H 6 8.158 8.158 8.856 -0.698 19497
2010 1 5 . 1 1 7 7 SER N N 7 116.299 116.299 116.356 -0.057 19497
2011 1 5 . 1 1 7 7 SER C C 7 173.277 173.277 173.081 0.196 19497
2012 1 5 . 1 1 7 7 SER CA C 7 58.300 58.300 56.959 1.341 19497
2013 1 5 . 1 1 7 7 SER CB C 7 64.300 64.300 65.019 -0.719 19497
2014 1 5 . 1 1 7 7 SER H H 7 7.734 7.734 8.471 -0.737 19497
2015 1 5 . 1 1 8 8 ASN N N 8 127.642 127.642 123.696 3.946 19497
2016 1 5 . 1 1 8 8 ASN C C 8 177.812 177.812 175.275 2.537 19497
2017 1 5 . 1 1 8 8 ASN CA C 8 55.900 55.900 54.014 1.885 19497
2018 1 5 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.763 -0.563 19497
2019 1 5 . 1 1 8 8 ASN H H 8 8.006 8.006 8.528 -0.522 19497
2020 1 5 . 1 1 9 9 LYS N N 9 122.472 122.472 120.205 2.267 19497
2021 1 5 . 1 1 9 9 LYS C C 9 177.932 177.932 177.284 0.648 19497
2022 1 5 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.967 2.333 19497
2023 1 5 . 1 1 9 9 LYS CB C 9 32.400 32.400 32.852 -0.452 19497
2024 1 5 . 1 1 9 9 LYS H H 9 8.350 8.350 7.845 0.505 19497
2025 1 5 . 1 1 10 10 THR N N 10 109.478 109.478 114.350 -4.872 19497
2026 1 5 . 1 1 10 10 THR C C 10 175.241 175.241 174.738 0.503 19497
2027 1 5 . 1 1 10 10 THR CA C 10 62.400 62.400 62.248 0.152 19497
2028 1 5 . 1 1 10 10 THR CB C 10 69.700 69.700 68.874 0.826 19497
2029 1 5 . 1 1 10 10 THR H H 10 8.486 8.486 8.420 0.066 19497
2030 1 5 . 1 1 11 11 GLY N N 11 110.146 110.146 108.830 1.316 19497
2031 1 5 . 1 1 11 11 GLY C C 11 172.717 172.717 174.277 -1.560 19497
2032 1 5 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.215 0.485 19497
2033 1 5 . 1 1 11 11 GLY H H 11 8.014 8.014 7.522 0.492 19497
2034 1 5 . 1 1 12 12 ARG N N 12 117.911 117.911 117.282 0.629 19497
2035 1 5 . 1 1 12 12 ARG C C 12 173.660 173.660 175.959 -2.299 19497
2036 1 5 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.556 -1.756 19497
2037 1 5 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.681 2.719 19497
2038 1 5 . 1 1 12 12 ARG H H 12 7.342 7.342 8.049 -0.707 19497
2039 1 5 . 1 1 13 13 PHE N N 13 122.082 122.082 120.667 1.415 19497
2040 1 5 . 1 1 13 13 PHE C C 13 174.525 174.525 174.064 0.461 19497
2041 1 5 . 1 1 13 13 PHE CA C 13 58.700 58.700 56.160 2.539 19497
2042 1 5 . 1 1 13 13 PHE CB C 13 38.900 38.900 36.766 2.134 19497
2043 1 5 . 1 1 13 13 PHE H H 13 8.462 8.462 7.864 0.598 19497
2044 1 5 . 1 1 14 14 LEU N N 14 129.559 129.559 123.494 6.065 19497
2045 1 5 . 1 1 14 14 LEU C C 14 174.071 174.071 175.295 -1.224 19497
2046 1 5 . 1 1 14 14 LEU CA C 14 54.100 54.100 53.970 0.130 19497
2047 1 5 . 1 1 14 14 LEU CB C 14 45.500 45.500 44.035 1.465 19497
2048 1 5 . 1 1 14 14 LEU H H 14 8.054 8.054 7.962 0.092 19497
2049 1 5 . 1 1 15 15 ALA N N 15 126.873 126.873 130.760 -3.887 19497
2050 1 5 . 1 1 15 15 ALA C C 15 176.826 176.826 175.865 0.961 19497
2051 1 5 . 1 1 15 15 ALA CA C 15 49.900 49.900 50.871 -0.971 19497
2052 1 5 . 1 1 15 15 ALA CB C 15 20.300 20.300 22.289 -1.989 19497
2053 1 5 . 1 1 15 15 ALA H H 15 8.190 8.190 8.350 -0.160 19497
2054 1 5 . 1 1 16 16 THR N N 16 120.557 120.557 118.109 2.448 19497
2055 1 5 . 1 1 16 16 THR C C 16 173.449 173.449 174.305 -0.856 19497
2056 1 5 . 1 1 16 16 THR CA C 16 61.500 61.500 61.829 -0.329 19497
2057 1 5 . 1 1 16 16 THR CB C 16 70.500 70.500 68.926 1.574 19497
2058 1 5 . 1 1 16 16 THR H H 16 9.014 9.014 8.593 0.421 19497
2059 1 5 . 1 1 17 17 GLU N N 17 129.862 129.862 128.589 1.273 19497
2060 1 5 . 1 1 17 17 GLU C C 17 175.703 175.703 176.177 -0.474 19497
2061 1 5 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.638 1.262 19497
2062 1 5 . 1 1 17 17 GLU CB C 17 29.200 29.200 29.425 -0.225 19497
2063 1 5 . 1 1 17 17 GLU H H 17 9.118 9.118 8.185 0.933 19497
2064 1 5 . 1 1 18 18 ILE N N 18 128.992 128.992 119.411 9.581 19497
2065 1 5 . 1 1 18 18 ILE C C 18 175.994 175.994 175.702 0.292 19497
2066 1 5 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.774 -1.174 19497
2067 1 5 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.746 -1.446 19497
2068 1 5 . 1 1 18 18 ILE H H 18 8.686 8.686 7.996 0.690 19497
2069 1 5 . 1 1 19 19 VAL N N 19 127.812 127.812 118.435 9.377 19497
2070 1 5 . 1 1 19 19 VAL C C 19 175.611 175.611 175.996 -0.385 19497
2071 1 5 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.663 0.038 19497
2072 1 5 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.276 0.724 19497
2073 1 5 . 1 1 19 19 VAL H H 19 8.422 8.422 8.127 0.295 19497
2074 1 5 . 1 1 20 20 ASP N N 20 123.008 123.008 120.627 2.381 19497
2075 1 5 . 1 1 20 20 ASP C C 20 175.669 175.669 176.035 -0.366 19497
2076 1 5 . 1 1 20 20 ASP CA C 20 54.900 54.900 54.376 0.525 19497
2077 1 5 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.916 -3.416 19497
2078 1 5 . 1 1 20 20 ASP H H 20 8.894 8.894 8.442 0.452 19497
2079 1 5 . 1 1 21 21 PHE N N 21 112.724 112.724 119.270 -6.546 19497
2080 1 5 . 1 1 21 21 PHE C C 21 174.706 174.706 175.438 -0.732 19497
2081 1 5 . 1 1 21 21 PHE CA C 21 56.200 56.200 56.035 0.165 19497
2082 1 5 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.788 1.212 19497
2083 1 5 . 1 1 21 21 PHE H H 21 6.261 6.261 8.528 -2.267 19497
2084 1 5 . 1 1 22 22 THR N N 22 112.022 112.022 115.649 -3.627 19497
2085 1 5 . 1 1 22 22 THR C C 22 175.111 175.111 174.634 0.477 19497
2086 1 5 . 1 1 22 22 THR CA C 22 60.100 60.100 60.887 -0.787 19497
2087 1 5 . 1 1 22 22 THR H H 22 9.422 9.422 8.493 0.929 19497
2088 1 5 . 1 1 23 23 GLN N N 23 122.305 122.305 121.853 0.452 19497
2089 1 5 . 1 1 23 23 GLN C C 23 176.564 176.564 177.339 -0.775 19497
2090 1 5 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.151 -0.551 19497
2091 1 5 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.513 -1.613 19497
2092 1 5 . 1 1 23 23 GLN H H 23 9.470 9.470 8.736 0.734 19497
2093 1 5 . 1 1 24 24 ASP N N 24 114.251 114.251 118.011 -3.760 19497
2094 1 5 . 1 1 24 24 ASP C C 24 174.839 174.839 177.100 -2.261 19497
2095 1 5 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.023 -0.322 19497
2096 1 5 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.414 0.086 19497
2097 1 5 . 1 1 24 24 ASP H H 24 7.534 7.534 8.376 -0.842 19497
2098 1 5 . 1 1 25 25 ASP N N 25 116.046 116.046 118.299 -2.253 19497
2099 1 5 . 1 1 25 25 ASP C C 25 176.087 176.087 175.455 0.632 19497
2100 1 5 . 1 1 25 25 ASP CA C 25 54.500 54.500 54.056 0.444 19497
2101 1 5 . 1 1 25 25 ASP CB C 25 40.600 40.600 40.721 -0.121 19497
2102 1 5 . 1 1 25 25 ASP H H 25 7.454 7.454 7.999 -0.545 19497
2103 1 5 . 1 1 26 26 LEU N N 26 121.535 121.535 122.186 -0.651 19497
2104 1 5 . 1 1 26 26 LEU C C 26 176.343 176.343 175.305 1.038 19497
2105 1 5 . 1 1 26 26 LEU CA C 26 55.000 55.000 54.280 0.720 19497
2106 1 5 . 1 1 26 26 LEU CB C 26 41.300 41.300 43.496 -2.196 19497
2107 1 5 . 1 1 26 26 LEU H H 26 8.014 8.014 7.409 0.605 19497
2108 1 5 . 1 1 27 27 ASP N N 27 127.804 127.804 124.342 3.462 19497
2109 1 5 . 1 1 27 27 ASP C C 27 176.947 176.947 176.337 0.610 19497
2110 1 5 . 1 1 27 27 ASP CA C 27 54.000 54.000 52.908 1.092 19497
2111 1 5 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.469 0.931 19497
2112 1 5 . 1 1 27 27 ASP H H 27 8.326 8.326 8.717 -0.391 19497
2113 1 5 . 1 1 28 28 GLU N N 28 123.641 123.641 121.718 1.923 19497
2114 1 5 . 1 1 28 28 GLU C C 28 176.141 176.141 176.403 -0.262 19497
2115 1 5 . 1 1 28 28 GLU CA C 28 54.500 54.500 57.675 -3.175 19497
2116 1 5 . 1 1 28 28 GLU CB C 28 32.700 32.700 29.456 3.244 19497
2117 1 5 . 1 1 28 28 GLU H H 28 8.278 8.278 8.937 -0.659 19497
2118 1 5 . 1 1 29 29 ASN N N 29 120.901 120.901 116.104 4.797 19497
2119 1 5 . 1 1 29 29 ASN C C 29 174.383 174.383 174.391 -0.008 19497
2120 1 5 . 1 1 29 29 ASN CA C 29 57.300 57.300 53.441 3.859 19497
2121 1 5 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.398 -0.098 19497
2122 1 5 . 1 1 29 29 ASN H H 29 8.022 8.022 8.163 -0.141 19497
2123 1 5 . 1 1 30 30 ASP N N 30 125.016 125.016 118.723 6.293 19497
2124 1 5 . 1 1 30 30 ASP C C 30 175.679 175.679 173.990 1.689 19497
2125 1 5 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.329 -1.029 19497
2126 1 5 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.110 -3.110 19497
2127 1 5 . 1 1 30 30 ASP H H 30 8.142 8.142 7.529 0.613 19497
2128 1 5 . 1 1 31 31 VAL N N 31 121.540 121.540 120.427 1.113 19497
2129 1 5 . 1 1 31 31 VAL C C 31 175.675 175.675 174.859 0.816 19497
2130 1 5 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.215 0.785 19497
2131 1 5 . 1 1 31 31 VAL CB C 31 32.800 32.800 32.840 -0.040 19497
2132 1 5 . 1 1 31 31 VAL H H 31 8.158 8.158 8.459 -0.301 19497
2133 1 5 . 1 1 32 32 TYR N N 32 126.116 126.116 125.573 0.543 19497
2134 1 5 . 1 1 32 32 TYR C C 32 173.449 173.449 174.884 -1.435 19497
2135 1 5 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.379 -0.379 19497
2136 1 5 . 1 1 32 32 TYR H H 32 8.294 8.294 8.238 0.056 19497
2137 1 5 . 1 1 33 33 LEU N N 33 121.235 121.235 114.758 6.477 19497
2138 1 5 . 1 1 33 33 LEU C C 33 174.948 174.948 174.732 0.216 19497
2139 1 5 . 1 1 33 33 LEU CA C 33 53.300 53.300 52.657 0.643 19497
2140 1 5 . 1 1 33 33 LEU CB C 33 45.700 45.700 44.428 1.272 19497
2141 1 5 . 1 1 33 33 LEU H H 33 9.142 9.142 8.121 1.021 19497
2142 1 5 . 1 1 34 34 LEU N N 34 127.452 127.452 120.017 7.435 19497
2143 1 5 . 1 1 34 34 LEU C C 34 174.084 174.084 176.604 -2.520 19497
2144 1 5 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.830 -1.630 19497
2145 1 5 . 1 1 34 34 LEU CB C 34 44.700 44.700 42.856 1.843 19497
2146 1 5 . 1 1 34 34 LEU H H 34 9.686 9.686 8.062 1.624 19497
2147 1 5 . 1 1 35 35 ASP N N 35 126.977 126.977 123.532 3.445 19497
2148 1 5 . 1 1 35 35 ASP C C 35 177.009 177.009 175.611 1.398 19497
2149 1 5 . 1 1 35 35 ASP CA C 35 52.600 52.600 52.779 -0.179 19497
2150 1 5 . 1 1 35 35 ASP CB C 35 41.400 41.400 41.147 0.253 19497
2151 1 5 . 1 1 35 35 ASP H H 35 9.446 9.446 8.245 1.201 19497
2152 1 5 . 1 1 36 36 THR N N 36 118.735 118.735 115.104 3.631 19497
2153 1 5 . 1 1 36 36 THR C C 36 175.252 175.252 175.288 -0.036 19497
2154 1 5 . 1 1 36 36 THR CA C 36 60.500 60.500 61.233 -0.733 19497
2155 1 5 . 1 1 36 36 THR CB C 36 68.000 68.000 69.911 -1.911 19497
2156 1 5 . 1 1 36 36 THR H H 36 8.310 8.310 7.837 0.473 19497
2157 1 5 . 1 1 37 37 TRP N N 37 122.289 122.289 124.568 -2.279 19497
2158 1 5 . 1 1 37 37 TRP C C 37 177.189 177.189 176.653 0.536 19497
2159 1 5 . 1 1 37 37 TRP CA C 37 61.500 61.500 59.892 1.608 19497
2160 1 5 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.724 -0.924 19497
2161 1 5 . 1 1 37 37 TRP H H 37 9.022 9.022 8.778 0.244 19497
2162 1 5 . 1 1 38 38 ASP N N 38 117.370 117.370 115.755 1.615 19497
2163 1 5 . 1 1 38 38 ASP C C 38 175.290 175.290 176.083 -0.793 19497
2164 1 5 . 1 1 38 38 ASP CA C 38 55.400 55.400 54.670 0.730 19497
2165 1 5 . 1 1 38 38 ASP CB C 38 41.100 41.100 41.230 -0.130 19497
2166 1 5 . 1 1 38 38 ASP H H 38 8.518 8.518 8.124 0.394 19497
2167 1 5 . 1 1 39 39 GLN N N 39 111.522 111.522 119.571 -8.049 19497
2168 1 5 . 1 1 39 39 GLN C C 39 173.099 173.099 174.585 -1.486 19497
2169 1 5 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.105 -0.605 19497
2170 1 5 . 1 1 39 39 GLN CB C 39 28.900 28.900 31.275 -2.375 19497
2171 1 5 . 1 1 39 39 GLN H H 39 7.118 7.118 7.562 -0.444 19497
2172 1 5 . 1 1 40 40 ILE N N 40 121.103 121.103 127.122 -6.019 19497
2173 1 5 . 1 1 40 40 ILE C C 40 174.406 174.406 174.876 -0.470 19497
2174 1 5 . 1 1 40 40 ILE CA C 40 58.900 58.900 61.446 -2.546 19497
2175 1 5 . 1 1 40 40 ILE CB C 40 38.900 38.900 38.715 0.185 19497
2176 1 5 . 1 1 40 40 ILE H H 40 8.422 8.422 7.981 0.441 19497
2177 1 5 . 1 1 41 41 PHE N N 41 123.856 123.856 126.717 -2.861 19497
2178 1 5 . 1 1 41 41 PHE C C 41 174.537 174.537 175.626 -1.089 19497
2179 1 5 . 1 1 41 41 PHE CA C 41 55.900 55.900 57.004 -1.104 19497
2180 1 5 . 1 1 41 41 PHE CB C 41 42.200 42.200 41.518 0.682 19497
2181 1 5 . 1 1 41 41 PHE H H 41 9.222 9.222 8.535 0.687 19497
2182 1 5 . 1 1 42 42 PHE N N 42 127.400 127.400 118.771 8.629 19497
2183 1 5 . 1 1 42 42 PHE C C 42 173.021 173.021 174.040 -1.019 19497
2184 1 5 . 1 1 42 42 PHE CA C 42 56.300 56.300 58.031 -1.731 19497
2185 1 5 . 1 1 42 42 PHE CB C 42 42.300 42.300 41.008 1.292 19497
2186 1 5 . 1 1 42 42 PHE H H 42 9.358 9.358 8.905 0.453 19497
2187 1 5 . 1 1 43 43 TRP N N 43 129.616 129.616 128.109 1.507 19497
2188 1 5 . 1 1 43 43 TRP C C 43 174.538 174.538 174.993 -0.455 19497
2189 1 5 . 1 1 43 43 TRP CA C 43 61.600 61.600 56.321 5.279 19497
2190 1 5 . 1 1 43 43 TRP CB C 43 38.200 38.200 29.938 8.262 19497
2191 1 5 . 1 1 43 43 TRP H H 43 9.646 9.646 9.091 0.555 19497
2192 1 5 . 1 1 44 44 ILE N N 44 121.402 121.402 129.565 -8.163 19497
2193 1 5 . 1 1 44 44 ILE C C 44 175.738 175.738 174.659 1.079 19497
2194 1 5 . 1 1 44 44 ILE CA C 44 57.600 57.600 60.146 -2.546 19497
2195 1 5 . 1 1 44 44 ILE CB C 44 39.100 39.100 38.867 0.233 19497
2196 1 5 . 1 1 44 44 ILE H H 44 7.838 7.838 7.599 0.239 19497
2197 1 5 . 1 1 45 45 GLY N N 45 114.403 114.403 112.048 2.355 19497
2198 1 5 . 1 1 45 45 GLY C C 45 175.519 175.519 173.688 1.831 19497
2199 1 5 . 1 1 45 45 GLY CA C 45 46.500 46.500 43.962 2.538 19497
2200 1 5 . 1 1 45 45 GLY H H 45 7.742 7.742 7.675 0.067 19497
2201 1 5 . 1 1 46 46 LYS N N 46 123.585 123.585 120.149 3.436 19497
2202 1 5 . 1 1 46 46 LYS C C 46 177.790 177.790 178.893 -1.103 19497
2203 1 5 . 1 1 46 46 LYS CA C 46 58.700 58.700 59.120 -0.420 19497
2204 1 5 . 1 1 46 46 LYS CB C 46 32.200 32.200 32.680 -0.480 19497
2205 1 5 . 1 1 46 46 LYS H H 46 8.942 8.942 7.994 0.948 19497
2206 1 5 . 1 1 47 47 GLY N N 47 107.819 107.819 105.609 2.210 19497
2207 1 5 . 1 1 47 47 GLY C C 47 174.298 174.298 174.050 0.248 19497
2208 1 5 . 1 1 47 47 GLY CA C 47 44.300 44.300 43.963 0.337 19497
2209 1 5 . 1 1 47 47 GLY H H 47 8.670 8.670 7.599 1.071 19497
2210 1 5 . 1 1 48 48 ALA N N 48 123.965 123.965 123.499 0.466 19497
2211 1 5 . 1 1 48 48 ALA C C 48 177.189 177.189 177.231 -0.042 19497
2212 1 5 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.908 0.191 19497
2213 1 5 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.733 -0.733 19497
2214 1 5 . 1 1 48 48 ALA H H 48 7.230 7.230 7.344 -0.114 19497
2215 1 5 . 1 1 49 49 ASN N N 49 119.667 119.667 122.036 -2.369 19497
2216 1 5 . 1 1 49 49 ASN C C 49 175.797 175.797 176.436 -0.639 19497
2217 1 5 . 1 1 49 49 ASN CA C 49 54.200 54.200 54.356 -0.156 19497
2218 1 5 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.199 1.901 19497
2219 1 5 . 1 1 49 49 ASN H H 49 8.526 8.526 8.684 -0.158 19497
2220 1 5 . 1 1 50 50 GLU N N 50 112.272 112.272 124.328 -12.056 19497
2221 1 5 . 1 1 50 50 GLU C C 50 178.128 178.128 177.875 0.253 19497
2222 1 5 . 1 1 50 50 GLU CA C 50 59.600 59.600 58.904 0.696 19497
2223 1 5 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.572 -0.272 19497
2224 1 5 . 1 1 50 50 GLU H H 50 7.814 7.814 8.839 -1.025 19497
2225 1 5 . 1 1 51 51 SER N N 51 113.952 113.952 115.727 -1.775 19497
2226 1 5 . 1 1 51 51 SER C C 51 177.874 177.874 176.443 1.431 19497
2227 1 5 . 1 1 51 51 SER CA C 51 61.100 61.100 61.257 -0.157 19497
2228 1 5 . 1 1 51 51 SER CB C 51 60.900 60.900 63.253 -2.353 19497
2229 1 5 . 1 1 51 51 SER H H 51 8.342 8.342 7.918 0.424 19497
2230 1 5 . 1 1 52 52 GLU N N 52 119.930 119.930 120.494 -0.564 19497
2231 1 5 . 1 1 52 52 GLU C C 52 178.827 178.827 177.340 1.487 19497
2232 1 5 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.686 -0.786 19497
2233 1 5 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.588 -0.288 19497
2234 1 5 . 1 1 52 52 GLU H H 52 7.806 7.806 7.772 0.034 19497
2235 1 5 . 1 1 53 53 LYS N N 53 118.112 118.112 118.137 -0.025 19497
2236 1 5 . 1 1 53 53 LYS C C 53 178.802 178.802 179.291 -0.489 19497
2237 1 5 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.736 1.264 19497
2238 1 5 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.691 -0.491 19497
2239 1 5 . 1 1 53 53 LYS H H 53 7.670 7.670 7.394 0.276 19497
2240 1 5 . 1 1 54 54 GLU N N 54 117.700 117.700 119.585 -1.885 19497
2241 1 5 . 1 1 54 54 GLU C C 54 177.733 177.733 176.488 1.245 19497
2242 1 5 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.203 -0.003 19497
2243 1 5 . 1 1 54 54 GLU CB C 54 29.300 29.300 30.143 -0.843 19497
2244 1 5 . 1 1 54 54 GLU H H 54 7.934 7.934 8.319 -0.385 19497
2245 1 5 . 1 1 55 55 ALA N N 55 120.395 120.395 120.921 -0.526 19497
2246 1 5 . 1 1 55 55 ALA CA C 55 52.200 52.200 50.657 1.543 19497
2247 1 5 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.941 -0.741 19497
2248 1 5 . 1 1 55 55 ALA H H 55 7.238 7.238 7.396 -0.158 19497
2249 1 5 . 1 1 56 56 ALA C C 56 177.526 177.526 177.514 0.012 19497
2250 1 5 . 1 1 56 56 ALA CA C 56 55.600 55.600 53.158 2.442 19497
2251 1 5 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.995 0.605 19497
2252 1 5 . 1 1 57 57 ALA N N 57 117.753 117.753 119.944 -2.191 19497
2253 1 5 . 1 1 57 57 ALA C C 57 180.072 180.072 179.046 1.026 19497
2254 1 5 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.615 1.585 19497
2255 1 5 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.934 -1.534 19497
2256 1 5 . 1 1 57 57 ALA H H 57 7.990 7.990 8.070 -0.080 19497
2257 1 5 . 1 1 58 58 GLU N N 58 118.444 118.444 117.032 1.412 19497
2258 1 5 . 1 1 58 58 GLU C C 58 179.225 179.225 177.781 1.444 19497
2259 1 5 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.947 0.653 19497
2260 1 5 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.514 -0.614 19497
2261 1 5 . 1 1 58 58 GLU H H 58 7.582 7.582 8.603 -1.021 19497
2262 1 5 . 1 1 59 59 THR N N 59 119.842 119.842 114.698 5.144 19497
2263 1 5 . 1 1 59 59 THR C C 59 175.781 175.781 175.598 0.183 19497
2264 1 5 . 1 1 59 59 THR CA C 59 66.200 66.200 63.555 2.645 19497
2265 1 5 . 1 1 59 59 THR CB C 59 67.600 67.600 68.412 -0.812 19497
2266 1 5 . 1 1 59 59 THR H H 59 8.422 8.422 7.700 0.722 19497
2267 1 5 . 1 1 60 60 ALA N N 60 122.454 122.454 125.833 -3.379 19497
2268 1 5 . 1 1 60 60 ALA C C 60 178.583 178.583 179.329 -0.746 19497
2269 1 5 . 1 1 60 60 ALA CA C 60 55.200 55.200 54.938 0.262 19497
2270 1 5 . 1 1 60 60 ALA CB C 60 18.100 18.100 18.598 -0.497 19497
2271 1 5 . 1 1 60 60 ALA H H 60 7.966 7.966 7.937 0.029 19497
2272 1 5 . 1 1 61 61 GLN N N 61 115.462 115.462 117.385 -1.923 19497
2273 1 5 . 1 1 61 61 GLN C C 61 178.101 178.101 178.081 0.020 19497
2274 1 5 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.611 0.290 19497
2275 1 5 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.175 -0.075 19497
2276 1 5 . 1 1 61 61 GLN H H 61 7.598 7.598 7.796 -0.198 19497
2277 1 5 . 1 1 62 62 GLU N N 62 120.883 120.883 119.870 1.013 19497
2278 1 5 . 1 1 62 62 GLU C C 62 174.071 174.071 178.682 -4.611 19497
2279 1 5 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.436 -5.336 19497
2280 1 5 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.650 0.650 19497
2281 1 5 . 1 1 62 62 GLU H H 62 7.910 7.910 7.823 0.087 19497
2282 1 5 . 1 1 63 63 TYR N N 63 118.888 118.888 120.337 -1.449 19497
2283 1 5 . 1 1 63 63 TYR C C 63 177.874 177.874 177.786 0.088 19497
2284 1 5 . 1 1 63 63 TYR CA C 63 61.100 61.100 61.635 -0.535 19497
2285 1 5 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.638 0.862 19497
2286 1 5 . 1 1 63 63 TYR H H 63 8.182 8.182 7.553 0.629 19497
2287 1 5 . 1 1 64 64 LEU N N 64 119.930 119.930 119.205 0.725 19497
2288 1 5 . 1 1 64 64 LEU C C 64 178.536 178.536 179.398 -0.862 19497
2289 1 5 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.892 0.008 19497
2290 1 5 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.866 -2.966 19497
2291 1 5 . 1 1 64 64 LEU H H 64 7.806 7.806 7.749 0.057 19497
2292 1 5 . 1 1 65 65 ARG N N 65 117.322 117.322 119.073 -1.751 19497
2293 1 5 . 1 1 65 65 ARG C C 65 177.436 177.436 178.020 -0.584 19497
2294 1 5 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.932 -0.332 19497
2295 1 5 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.037 0.363 19497
2296 1 5 . 1 1 65 65 ARG H H 65 8.054 8.054 8.110 -0.056 19497
2297 1 5 . 1 1 66 66 SER N N 66 111.783 111.783 112.123 -0.340 19497
2298 1 5 . 1 1 66 66 SER C C 66 173.652 173.652 174.144 -0.492 19497
2299 1 5 . 1 1 66 66 SER CA C 66 58.900 58.900 58.432 0.468 19497
2300 1 5 . 1 1 66 66 SER CB C 66 63.800 63.800 63.433 0.367 19497
2301 1 5 . 1 1 66 66 SER H H 66 7.550 7.550 7.575 -0.025 19497
2302 1 5 . 1 1 67 67 HIS N N 67 124.135 124.135 123.395 0.740 19497
2303 1 5 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.208 0.492 19497
2304 1 5 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.568 -1.368 19497
2305 1 5 . 1 1 67 67 HIS H H 67 7.134 7.134 7.711 -0.577 19497
2306 1 5 . 1 1 68 68 PRO C C 68 178.101 178.101 177.321 0.780 19497
2307 1 5 . 1 1 68 68 PRO CA C 68 58.900 58.900 64.121 -5.221 19497
2308 1 5 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.703 -1.803 19497
2309 1 5 . 1 1 69 69 GLY N N 69 115.697 115.697 104.337 11.360 19497
2310 1 5 . 1 1 69 69 GLY C C 69 176.641 176.641 174.401 2.240 19497
2311 1 5 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.869 0.131 19497
2312 1 5 . 1 1 69 69 GLY H H 69 7.926 7.926 7.882 0.044 19497
2313 1 5 . 1 1 70 70 SER N N 70 115.440 115.440 113.765 1.675 19497
2314 1 5 . 1 1 70 70 SER C C 70 173.277 173.277 174.344 -1.067 19497
2315 1 5 . 1 1 70 70 SER CA C 70 58.300 58.300 57.900 0.400 19497
2316 1 5 . 1 1 70 70 SER CB C 70 64.300 64.300 62.363 1.937 19497
2317 1 5 . 1 1 70 70 SER H H 70 8.030 8.030 7.723 0.307 19497
2318 1 5 . 1 1 71 71 ARG N N 71 127.642 127.642 120.632 7.010 19497
2319 1 5 . 1 1 71 71 ARG C C 71 175.849 175.849 175.942 -0.093 19497
2320 1 5 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.298 -1.398 19497
2321 1 5 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.738 0.162 19497
2322 1 5 . 1 1 71 71 ARG H H 71 8.006 8.006 8.040 -0.034 19497
2323 1 5 . 1 1 72 72 ASP N N 72 120.975 120.975 119.270 1.705 19497
2324 1 5 . 1 1 72 72 ASP C C 72 176.087 176.087 176.299 -0.212 19497
2325 1 5 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.340 0.160 19497
2326 1 5 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.619 -0.719 19497
2327 1 5 . 1 1 72 72 ASP H H 72 8.182 8.182 8.586 -0.404 19497
2328 1 5 . 1 1 73 73 LEU N N 73 121.535 121.535 124.125 -2.590 19497
2329 1 5 . 1 1 73 73 LEU C C 73 177.020 177.020 176.464 0.556 19497
2330 1 5 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.310 0.690 19497
2331 1 5 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.017 0.982 19497
2332 1 5 . 1 1 73 73 LEU H H 73 8.014 8.014 8.463 -0.449 19497
2333 1 5 . 1 1 74 74 ASP N N 74 120.525 120.525 118.636 1.889 19497
2334 1 5 . 1 1 74 74 ASP C C 74 175.797 175.797 175.455 0.342 19497
2335 1 5 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.488 0.712 19497
2336 1 5 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.886 -0.887 19497
2337 1 5 . 1 1 74 74 ASP H H 74 8.134 8.134 7.774 0.360 19497
2338 1 5 . 1 1 75 75 THR N N 75 116.656 116.656 118.553 -1.897 19497
2339 1 5 . 1 1 75 75 THR CA C 75 59.700 59.700 61.849 -2.149 19497
2340 1 5 . 1 1 75 75 THR CB C 75 69.600 69.600 69.164 0.436 19497
2341 1 5 . 1 1 75 75 THR H H 75 7.814 7.814 7.656 0.158 19497
2342 1 5 . 1 1 76 76 PRO C C 76 174.538 174.538 175.248 -0.710 19497
2343 1 5 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.426 1.074 19497
2344 1 5 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.678 -0.078 19497
2345 1 5 . 1 1 77 77 ILE N N 77 121.402 121.402 120.495 0.907 19497
2346 1 5 . 1 1 77 77 ILE C C 77 176.132 176.132 175.337 0.795 19497
2347 1 5 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.214 -1.114 19497
2348 1 5 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.873 -0.873 19497
2349 1 5 . 1 1 77 77 ILE H H 77 7.838 7.838 8.129 -0.291 19497
2350 1 5 . 1 1 78 78 ILE N N 78 130.292 130.292 128.455 1.837 19497
2351 1 5 . 1 1 78 78 ILE C C 78 175.084 175.084 174.658 0.426 19497
2352 1 5 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.515 0.385 19497
2353 1 5 . 1 1 78 78 ILE CB C 78 39.000 39.000 39.161 -0.161 19497
2354 1 5 . 1 1 78 78 ILE H H 78 8.910 8.910 8.089 0.821 19497
2355 1 5 . 1 1 79 79 VAL N N 79 129.237 129.237 126.289 2.948 19497
2356 1 5 . 1 1 79 79 VAL C C 79 175.907 175.907 175.691 0.216 19497
2357 1 5 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.514 1.687 19497
2358 1 5 . 1 1 79 79 VAL CB C 79 31.700 31.700 31.741 -0.041 19497
2359 1 5 . 1 1 79 79 VAL H H 79 8.670 8.670 8.275 0.395 19497
2360 1 5 . 1 1 80 80 VAL N N 80 128.354 128.354 128.929 -0.575 19497
2361 1 5 . 1 1 80 80 VAL C C 80 172.823 172.823 175.038 -2.215 19497
2362 1 5 . 1 1 80 80 VAL CA C 80 59.400 59.400 61.756 -2.356 19497
2363 1 5 . 1 1 80 80 VAL CB C 80 32.600 32.600 34.210 -1.610 19497
2364 1 5 . 1 1 80 80 VAL H H 80 9.598 9.598 8.324 1.274 19497
2365 1 5 . 1 1 81 81 LYS N N 81 123.077 123.077 125.788 -2.711 19497
2366 1 5 . 1 1 81 81 LYS C C 81 178.101 178.101 176.128 1.973 19497
2367 1 5 . 1 1 81 81 LYS CA C 81 54.400 54.400 54.652 -0.252 19497
2368 1 5 . 1 1 81 81 LYS CB C 81 34.300 34.300 33.420 0.880 19497
2369 1 5 . 1 1 81 81 LYS H H 81 8.198 8.198 8.795 -0.597 19497
2370 1 5 . 1 1 82 82 GLN N N 82 121.436 121.436 120.204 1.232 19497
2371 1 5 . 1 1 82 82 GLN C C 82 177.068 177.068 176.032 1.036 19497
2372 1 5 . 1 1 82 82 GLN CA C 82 56.200 56.200 56.069 0.131 19497
2373 1 5 . 1 1 82 82 GLN CB C 82 29.400 29.400 29.575 -0.175 19497
2374 1 5 . 1 1 82 82 GLN H H 82 7.910 7.910 8.522 -0.612 19497
2375 1 5 . 1 1 83 83 GLY N N 83 110.688 110.688 115.517 -4.829 19497
2376 1 5 . 1 1 83 83 GLY C C 83 173.348 173.348 174.346 -0.998 19497
2377 1 5 . 1 1 83 83 GLY CA C 83 45.000 45.000 45.070 -0.070 19497
2378 1 5 . 1 1 83 83 GLY H H 83 8.382 8.382 8.833 -0.451 19497
2379 1 5 . 1 1 84 84 PHE N N 84 119.493 119.493 124.544 -5.051 19497
2380 1 5 . 1 1 84 84 PHE C C 84 175.035 175.035 174.855 0.180 19497
2381 1 5 . 1 1 84 84 PHE CA C 84 57.300 57.300 56.820 0.480 19497
2382 1 5 . 1 1 84 84 PHE CB C 84 42.200 42.200 37.528 4.672 19497
2383 1 5 . 1 1 84 84 PHE H H 84 7.910 7.910 7.775 0.135 19497
2384 1 5 . 1 1 85 85 GLU N N 85 124.672 124.672 122.940 1.732 19497
2385 1 5 . 1 1 85 85 GLU CA C 85 59.000 59.000 55.439 3.561 19497
2386 1 5 . 1 1 85 85 GLU CB C 85 29.700 29.700 29.924 -0.224 19497
2387 1 5 . 1 1 85 85 GLU H H 85 8.142 8.142 7.850 0.292 19497
2388 1 5 . 1 1 87 87 PRO C C 87 178.284 178.284 178.526 -0.242 19497
2389 1 5 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.448 -1.348 19497
2390 1 5 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.791 -0.691 19497
2391 1 5 . 1 1 88 88 THR N N 88 106.959 106.959 111.004 -4.045 19497
2392 1 5 . 1 1 88 88 THR C C 88 174.182 174.182 176.330 -2.148 19497
2393 1 5 . 1 1 88 88 THR CA C 88 62.900 62.900 64.502 -1.602 19497
2394 1 5 . 1 1 88 88 THR CB C 88 68.000 68.000 68.557 -0.557 19497
2395 1 5 . 1 1 88 88 THR H H 88 7.110 7.110 8.044 -0.934 19497
2396 1 5 . 1 1 89 89 PHE N N 89 118.766 118.766 121.381 -2.615 19497
2397 1 5 . 1 1 89 89 PHE C C 89 175.468 175.468 176.539 -1.071 19497
2398 1 5 . 1 1 89 89 PHE CA C 89 59.800 59.800 60.627 -0.827 19497
2399 1 5 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.080 1.620 19497
2400 1 5 . 1 1 89 89 PHE H H 89 7.198 7.198 7.681 -0.483 19497
2401 1 5 . 1 1 90 90 THR N N 90 107.050 107.050 111.921 -4.871 19497
2402 1 5 . 1 1 90 90 THR C C 90 177.260 177.260 176.715 0.545 19497
2403 1 5 . 1 1 90 90 THR CA C 90 64.600 64.600 61.687 2.913 19497
2404 1 5 . 1 1 90 90 THR CB C 90 67.900 67.900 67.061 0.839 19497
2405 1 5 . 1 1 90 90 THR H H 90 7.446 7.446 7.768 -0.322 19497
2406 1 5 . 1 1 91 91 GLY N N 91 106.738 106.738 109.424 -2.686 19497
2407 1 5 . 1 1 91 91 GLY C C 91 174.422 174.422 174.849 -0.427 19497
2408 1 5 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.358 0.643 19497
2409 1 5 . 1 1 91 91 GLY H H 91 7.646 7.646 7.239 0.407 19497
2410 1 5 . 1 1 92 92 TRP N N 92 117.500 117.500 120.046 -2.546 19497
2411 1 5 . 1 1 92 92 TRP C C 92 174.209 174.209 175.445 -1.236 19497
2412 1 5 . 1 1 92 92 TRP CA C 92 56.900 56.900 56.548 0.352 19497
2413 1 5 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.377 0.023 19497
2414 1 5 . 1 1 92 92 TRP H H 92 6.790 6.790 6.957 -0.167 19497
2415 1 5 . 1 1 93 93 PHE N N 93 119.092 119.092 116.800 2.292 19497
2416 1 5 . 1 1 93 93 PHE C C 93 175.953 175.953 176.130 -0.177 19497
2417 1 5 . 1 1 93 93 PHE CA C 93 56.700 56.700 57.593 -0.893 19497
2418 1 5 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.655 0.645 19497
2419 1 5 . 1 1 93 93 PHE H H 93 7.750 7.750 7.098 0.652 19497
2420 1 5 . 1 1 94 94 MET N N 94 121.554 121.554 121.911 -0.357 19497
2421 1 5 . 1 1 94 94 MET C C 94 175.738 175.738 176.238 -0.500 19497
2422 1 5 . 1 1 94 94 MET CA C 94 57.600 57.600 56.275 1.325 19497
2423 1 5 . 1 1 94 94 MET CB C 94 32.000 32.000 34.111 -2.111 19497
2424 1 5 . 1 1 94 94 MET H H 94 8.654 8.654 9.076 -0.422 19497
2425 1 5 . 1 1 95 95 ALA N N 95 119.777 119.777 121.908 -2.131 19497
2426 1 5 . 1 1 95 95 ALA C C 95 175.441 175.441 176.243 -0.802 19497
2427 1 5 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.663 -0.363 19497
2428 1 5 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.794 1.906 19497
2429 1 5 . 1 1 95 95 ALA H H 95 7.750 7.750 8.045 -0.295 19497
2430 1 5 . 1 1 96 96 TRP N N 96 120.813 120.813 122.158 -1.345 19497
2431 1 5 . 1 1 96 96 TRP C C 96 175.488 175.488 175.263 0.225 19497
2432 1 5 . 1 1 96 96 TRP CA C 96 57.700 57.700 57.495 0.205 19497
2433 1 5 . 1 1 96 96 TRP CB C 96 30.400 30.400 29.213 1.187 19497
2434 1 5 . 1 1 96 96 TRP H H 96 8.254 8.254 7.824 0.430 19497
2435 1 5 . 1 1 97 97 ASP N N 97 117.140 117.140 129.058 -11.918 19497
2436 1 5 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.809 2.891 19497
2437 1 5 . 1 1 97 97 ASP CB C 97 39.600 39.600 43.104 -3.504 19497
2438 1 5 . 1 1 97 97 ASP H H 97 8.958 8.958 7.926 1.032 19497
2439 1 5 . 1 1 98 98 PRO C C 98 174.071 174.071 177.257 -3.186 19497
2440 1 5 . 1 1 98 98 PRO CA C 98 63.100 63.100 63.873 -0.773 19497
2441 1 5 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.150 0.250 19497
2442 1 5 . 1 1 99 99 LEU N N 99 118.888 118.888 117.985 0.903 19497
2443 1 5 . 1 1 99 99 LEU C C 99 177.519 177.519 176.974 0.545 19497
2444 1 5 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.623 -0.223 19497
2445 1 5 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.893 -1.393 19497
2446 1 5 . 1 1 99 99 LEU H H 99 8.182 8.182 7.980 0.202 19497
2447 1 5 . 1 1 100 100 CYS N N 100 118.788 118.788 115.668 3.120 19497
2448 1 5 . 1 1 100 100 CYS C C 100 174.685 174.685 173.765 0.920 19497
2449 1 5 . 1 1 100 100 CYS CA C 100 60.800 60.800 58.464 2.336 19497
2450 1 5 . 1 1 100 100 CYS CB C 100 27.400 27.400 26.631 0.769 19497
2451 1 5 . 1 1 100 100 CYS H H 100 6.862 6.862 7.512 -0.650 19497
2452 1 5 . 1 1 101 101 TRP N N 101 117.558 117.558 121.345 -3.787 19497
2453 1 5 . 1 1 101 101 TRP C C 101 176.478 176.478 174.786 1.692 19497
2454 1 5 . 1 1 101 101 TRP CA C 101 54.400 54.400 55.978 -1.578 19497
2455 1 5 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.375 -2.175 19497
2456 1 5 . 1 1 101 101 TRP H H 101 7.662 7.662 6.966 0.696 19497
2457 1 5 . 1 1 102 102 SER N N 102 115.626 115.626 115.006 0.620 19497
2458 1 5 . 1 1 102 102 SER C C 102 174.303 174.303 173.157 1.146 19497
2459 1 5 . 1 1 102 102 SER CA C 102 58.900 58.900 58.319 0.581 19497
2460 1 5 . 1 1 102 102 SER CB C 102 63.700 63.700 65.130 -1.430 19497
2461 1 5 . 1 1 102 102 SER H H 102 7.734 7.734 8.200 -0.466 19497
2462 1 5 . 1 1 103 103 ASP N N 103 121.936 121.936 122.428 -0.492 19497
2463 1 5 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.993 -0.593 19497
2464 1 5 . 1 1 103 103 ASP CB C 103 40.600 40.600 39.779 0.821 19497
2465 1 5 . 1 1 103 103 ASP H H 103 8.254 8.254 8.666 -0.412 19497
2466 1 5 . 1 1 104 104 ARG N N 104 120.567 120.567 123.346 -2.779 19497
2467 1 5 . 1 1 104 104 ARG C C 104 176.177 176.177 176.655 -0.478 19497
2468 1 5 . 1 1 104 104 ARG CA C 104 56.000 56.000 58.010 -2.010 19497
2469 1 5 . 1 1 104 104 ARG CB C 104 30.300 30.300 31.065 -0.765 19497
2470 1 5 . 1 1 104 104 ARG H H 104 7.910 7.910 8.622 -0.712 19497
2471 1 5 . 1 1 105 105 LYS N N 105 121.805 121.805 113.747 8.058 19497
2472 1 5 . 1 1 105 105 LYS C C 105 176.141 176.141 175.981 0.160 19497
2473 1 5 . 1 1 105 105 LYS CA C 105 56.100 56.100 56.924 -0.824 19497
2474 1 5 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.253 -0.453 19497
2475 1 5 . 1 1 105 105 LYS H H 105 8.094 8.094 7.805 0.289 19497
2476 1 5 . 1 1 106 106 SER N N 106 116.792 116.792 112.639 4.153 19497
2477 1 5 . 1 1 106 106 SER C C 106 172.841 172.841 172.630 0.211 19497
2478 1 5 . 1 1 106 106 SER CA C 106 57.900 57.900 58.816 -0.916 19497
2479 1 5 . 1 1 106 106 SER CB C 106 63.800 63.800 63.920 -0.121 19497
2480 1 5 . 1 1 106 106 SER H H 106 8.030 8.030 7.800 0.230 19497
2481 1 6 . 1 1 2 2 ARG N N 2 117.187 117.187 121.596 -4.409 19497
2482 1 6 . 1 1 2 2 ARG C C 2 172.315 172.315 174.985 -2.670 19497
2483 1 6 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.460 -0.360 19497
2484 1 6 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.325 -1.325 19497
2485 1 6 . 1 1 2 2 ARG H H 2 7.766 7.766 8.275 -0.509 19497
2486 1 6 . 1 1 3 3 LEU N N 3 125.426 125.426 123.669 1.757 19497
2487 1 6 . 1 1 3 3 LEU C C 3 173.996 173.996 174.974 -0.978 19497
2488 1 6 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.199 -0.599 19497
2489 1 6 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.598 -1.498 19497
2490 1 6 . 1 1 3 3 LEU H H 3 8.246 8.246 8.187 0.059 19497
2491 1 6 . 1 1 4 4 PHE N N 4 122.682 122.682 119.641 3.041 19497
2492 1 6 . 1 1 4 4 PHE C C 4 175.512 175.512 174.189 1.323 19497
2493 1 6 . 1 1 4 4 PHE CA C 4 55.700 55.700 55.842 -0.142 19497
2494 1 6 . 1 1 4 4 PHE CB C 4 41.800 41.800 41.938 -0.138 19497
2495 1 6 . 1 1 4 4 PHE H H 4 9.390 9.390 8.694 0.696 19497
2496 1 6 . 1 1 5 5 GLU N N 5 125.826 125.826 123.237 2.589 19497
2497 1 6 . 1 1 5 5 GLU C C 5 175.679 175.679 175.656 0.023 19497
2498 1 6 . 1 1 5 5 GLU CA C 5 56.400 56.400 53.707 2.693 19497
2499 1 6 . 1 1 5 5 GLU CB C 5 29.400 29.400 32.963 -3.563 19497
2500 1 6 . 1 1 5 5 GLU H H 5 9.190 9.190 8.773 0.417 19497
2501 1 6 . 1 1 6 6 CYS N N 6 121.540 121.540 120.438 1.102 19497
2502 1 6 . 1 1 6 6 CYS C C 6 175.738 175.738 174.939 0.799 19497
2503 1 6 . 1 1 6 6 CYS CA C 6 56.100 56.100 57.893 -1.793 19497
2504 1 6 . 1 1 6 6 CYS CB C 6 28.200 28.200 29.191 -0.991 19497
2505 1 6 . 1 1 6 6 CYS H H 6 8.158 8.158 9.132 -0.974 19497
2506 1 6 . 1 1 7 7 SER N N 7 116.299 116.299 118.608 -2.309 19497
2507 1 6 . 1 1 7 7 SER C C 7 173.277 173.277 173.351 -0.074 19497
2508 1 6 . 1 1 7 7 SER CA C 7 58.300 58.300 57.368 0.932 19497
2509 1 6 . 1 1 7 7 SER CB C 7 64.300 64.300 64.145 0.155 19497
2510 1 6 . 1 1 7 7 SER H H 7 7.734 7.734 8.673 -0.939 19497
2511 1 6 . 1 1 8 8 ASN N N 8 127.642 127.642 126.296 1.346 19497
2512 1 6 . 1 1 8 8 ASN C C 8 177.812 177.812 175.177 2.635 19497
2513 1 6 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.521 2.379 19497
2514 1 6 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.827 -0.626 19497
2515 1 6 . 1 1 8 8 ASN H H 8 8.006 8.006 8.669 -0.663 19497
2516 1 6 . 1 1 9 9 LYS N N 9 122.472 122.472 119.203 3.269 19497
2517 1 6 . 1 1 9 9 LYS C C 9 177.932 177.932 177.031 0.901 19497
2518 1 6 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.040 3.260 19497
2519 1 6 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.232 -0.832 19497
2520 1 6 . 1 1 9 9 LYS H H 9 8.350 8.350 7.758 0.592 19497
2521 1 6 . 1 1 10 10 THR N N 10 109.478 109.478 114.388 -4.910 19497
2522 1 6 . 1 1 10 10 THR C C 10 175.241 175.241 174.652 0.589 19497
2523 1 6 . 1 1 10 10 THR CA C 10 62.400 62.400 61.653 0.748 19497
2524 1 6 . 1 1 10 10 THR CB C 10 69.700 69.700 68.921 0.779 19497
2525 1 6 . 1 1 10 10 THR H H 10 8.486 8.486 8.438 0.048 19497
2526 1 6 . 1 1 11 11 GLY N N 11 110.146 110.146 109.667 0.479 19497
2527 1 6 . 1 1 11 11 GLY C C 11 172.717 172.717 173.942 -1.225 19497
2528 1 6 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.916 -0.216 19497
2529 1 6 . 1 1 11 11 GLY H H 11 8.014 8.014 7.825 0.189 19497
2530 1 6 . 1 1 12 12 ARG N N 12 117.911 117.911 118.908 -0.997 19497
2531 1 6 . 1 1 12 12 ARG C C 12 173.660 173.660 176.608 -2.948 19497
2532 1 6 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.387 -1.587 19497
2533 1 6 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.873 2.527 19497
2534 1 6 . 1 1 12 12 ARG H H 12 7.342 7.342 8.354 -1.012 19497
2535 1 6 . 1 1 13 13 PHE N N 13 122.082 122.082 121.320 0.762 19497
2536 1 6 . 1 1 13 13 PHE C C 13 174.525 174.525 174.256 0.269 19497
2537 1 6 . 1 1 13 13 PHE CA C 13 58.700 58.700 57.124 1.575 19497
2538 1 6 . 1 1 13 13 PHE CB C 13 38.900 38.900 37.928 0.972 19497
2539 1 6 . 1 1 13 13 PHE H H 13 8.462 8.462 8.489 -0.027 19497
2540 1 6 . 1 1 14 14 LEU N N 14 129.559 129.559 122.106 7.453 19497
2541 1 6 . 1 1 14 14 LEU C C 14 174.071 174.071 175.752 -1.681 19497
2542 1 6 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.275 -0.175 19497
2543 1 6 . 1 1 14 14 LEU CB C 14 45.500 45.500 42.544 2.956 19497
2544 1 6 . 1 1 14 14 LEU H H 14 8.054 8.054 7.809 0.245 19497
2545 1 6 . 1 1 15 15 ALA N N 15 126.873 126.873 130.500 -3.627 19497
2546 1 6 . 1 1 15 15 ALA C C 15 176.826 176.826 175.531 1.295 19497
2547 1 6 . 1 1 15 15 ALA CA C 15 49.900 49.900 51.182 -1.282 19497
2548 1 6 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.230 -0.930 19497
2549 1 6 . 1 1 15 15 ALA H H 15 8.190 8.190 8.432 -0.242 19497
2550 1 6 . 1 1 16 16 THR N N 16 120.557 120.557 119.343 1.214 19497
2551 1 6 . 1 1 16 16 THR C C 16 173.449 173.449 174.467 -1.018 19497
2552 1 6 . 1 1 16 16 THR CA C 16 61.500 61.500 61.864 -0.364 19497
2553 1 6 . 1 1 16 16 THR CB C 16 70.500 70.500 69.569 0.931 19497
2554 1 6 . 1 1 16 16 THR H H 16 9.014 9.014 8.314 0.700 19497
2555 1 6 . 1 1 17 17 GLU N N 17 129.862 129.862 126.646 3.216 19497
2556 1 6 . 1 1 17 17 GLU C C 17 175.703 175.703 176.321 -0.618 19497
2557 1 6 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.309 1.591 19497
2558 1 6 . 1 1 17 17 GLU CB C 17 29.200 29.200 29.824 -0.624 19497
2559 1 6 . 1 1 17 17 GLU H H 17 9.118 9.118 8.252 0.866 19497
2560 1 6 . 1 1 18 18 ILE N N 18 128.992 128.992 120.070 8.922 19497
2561 1 6 . 1 1 18 18 ILE C C 18 175.994 175.994 176.092 -0.098 19497
2562 1 6 . 1 1 18 18 ILE CA C 18 59.600 59.600 61.100 -1.500 19497
2563 1 6 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.340 -1.040 19497
2564 1 6 . 1 1 18 18 ILE H H 18 8.686 8.686 8.155 0.531 19497
2565 1 6 . 1 1 19 19 VAL N N 19 127.812 127.812 117.406 10.406 19497
2566 1 6 . 1 1 19 19 VAL C C 19 175.611 175.611 176.164 -0.553 19497
2567 1 6 . 1 1 19 19 VAL CA C 19 62.700 62.700 63.264 -0.563 19497
2568 1 6 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.496 0.504 19497
2569 1 6 . 1 1 19 19 VAL H H 19 8.422 8.422 8.313 0.109 19497
2570 1 6 . 1 1 20 20 ASP N N 20 123.008 123.008 120.967 2.041 19497
2571 1 6 . 1 1 20 20 ASP C C 20 175.669 175.669 175.535 0.134 19497
2572 1 6 . 1 1 20 20 ASP CA C 20 54.900 54.900 54.503 0.397 19497
2573 1 6 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.756 -3.256 19497
2574 1 6 . 1 1 20 20 ASP H H 20 8.894 8.894 8.362 0.532 19497
2575 1 6 . 1 1 21 21 PHE N N 21 112.724 112.724 119.968 -7.244 19497
2576 1 6 . 1 1 21 21 PHE C C 21 174.706 174.706 175.453 -0.747 19497
2577 1 6 . 1 1 21 21 PHE CA C 21 56.200 56.200 56.094 0.106 19497
2578 1 6 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.950 1.050 19497
2579 1 6 . 1 1 21 21 PHE H H 21 6.261 6.261 8.575 -2.314 19497
2580 1 6 . 1 1 22 22 THR N N 22 112.022 112.022 115.625 -3.603 19497
2581 1 6 . 1 1 22 22 THR C C 22 175.111 175.111 173.804 1.307 19497
2582 1 6 . 1 1 22 22 THR CA C 22 60.100 60.100 60.870 -0.770 19497
2583 1 6 . 1 1 22 22 THR H H 22 9.422 9.422 8.474 0.948 19497
2584 1 6 . 1 1 23 23 GLN N N 23 122.305 122.305 121.026 1.279 19497
2585 1 6 . 1 1 23 23 GLN C C 23 176.564 176.564 177.090 -0.526 19497
2586 1 6 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.922 -1.322 19497
2587 1 6 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.361 -1.461 19497
2588 1 6 . 1 1 23 23 GLN H H 23 9.470 9.470 8.565 0.905 19497
2589 1 6 . 1 1 24 24 ASP N N 24 114.251 114.251 118.516 -4.265 19497
2590 1 6 . 1 1 24 24 ASP C C 24 174.839 174.839 176.215 -1.376 19497
2591 1 6 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.718 -1.018 19497
2592 1 6 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.267 0.233 19497
2593 1 6 . 1 1 24 24 ASP H H 24 7.534 7.534 8.715 -1.181 19497
2594 1 6 . 1 1 25 25 ASP N N 25 116.046 116.046 117.494 -1.448 19497
2595 1 6 . 1 1 25 25 ASP C C 25 176.087 176.087 175.606 0.481 19497
2596 1 6 . 1 1 25 25 ASP CA C 25 54.500 54.500 53.357 1.143 19497
2597 1 6 . 1 1 25 25 ASP CB C 25 40.600 40.600 39.565 1.035 19497
2598 1 6 . 1 1 25 25 ASP H H 25 7.454 7.454 8.213 -0.759 19497
2599 1 6 . 1 1 26 26 LEU N N 26 121.535 121.535 121.578 -0.043 19497
2600 1 6 . 1 1 26 26 LEU C C 26 176.343 176.343 174.972 1.371 19497
2601 1 6 . 1 1 26 26 LEU CA C 26 55.000 55.000 54.140 0.860 19497
2602 1 6 . 1 1 26 26 LEU CB C 26 41.300 41.300 43.297 -1.997 19497
2603 1 6 . 1 1 26 26 LEU H H 26 8.014 8.014 7.639 0.375 19497
2604 1 6 . 1 1 27 27 ASP N N 27 127.804 127.804 122.587 5.217 19497
2605 1 6 . 1 1 27 27 ASP C C 27 176.947 176.947 176.810 0.137 19497
2606 1 6 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.624 0.376 19497
2607 1 6 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.375 1.025 19497
2608 1 6 . 1 1 27 27 ASP H H 27 8.326 8.326 8.428 -0.102 19497
2609 1 6 . 1 1 28 28 GLU N N 28 123.641 123.641 121.699 1.942 19497
2610 1 6 . 1 1 28 28 GLU C C 28 176.141 176.141 175.963 0.178 19497
2611 1 6 . 1 1 28 28 GLU CA C 28 54.500 54.500 58.812 -4.312 19497
2612 1 6 . 1 1 28 28 GLU CB C 28 32.700 32.700 30.095 2.605 19497
2613 1 6 . 1 1 28 28 GLU H H 28 8.278 8.278 8.839 -0.561 19497
2614 1 6 . 1 1 29 29 ASN N N 29 120.901 120.901 116.891 4.010 19497
2615 1 6 . 1 1 29 29 ASN C C 29 174.383 174.383 174.189 0.194 19497
2616 1 6 . 1 1 29 29 ASN CA C 29 57.300 57.300 53.094 4.206 19497
2617 1 6 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.248 0.052 19497
2618 1 6 . 1 1 29 29 ASN H H 29 8.022 8.022 8.165 -0.143 19497
2619 1 6 . 1 1 30 30 ASP N N 30 125.016 125.016 119.692 5.324 19497
2620 1 6 . 1 1 30 30 ASP C C 30 175.679 175.679 173.544 2.135 19497
2621 1 6 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.549 -1.249 19497
2622 1 6 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.530 -3.530 19497
2623 1 6 . 1 1 30 30 ASP H H 30 8.142 8.142 7.602 0.540 19497
2624 1 6 . 1 1 31 31 VAL N N 31 121.540 121.540 118.439 3.101 19497
2625 1 6 . 1 1 31 31 VAL C C 31 175.675 175.675 174.678 0.997 19497
2626 1 6 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.099 0.901 19497
2627 1 6 . 1 1 31 31 VAL CB C 31 32.800 32.800 32.175 0.625 19497
2628 1 6 . 1 1 31 31 VAL H H 31 8.158 8.158 8.193 -0.035 19497
2629 1 6 . 1 1 32 32 TYR N N 32 126.116 126.116 126.592 -0.476 19497
2630 1 6 . 1 1 32 32 TYR C C 32 173.449 173.449 174.495 -1.046 19497
2631 1 6 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.256 -0.256 19497
2632 1 6 . 1 1 32 32 TYR H H 32 8.294 8.294 8.747 -0.453 19497
2633 1 6 . 1 1 33 33 LEU N N 33 121.235 121.235 118.710 2.525 19497
2634 1 6 . 1 1 33 33 LEU C C 33 174.948 174.948 175.138 -0.190 19497
2635 1 6 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.893 -0.593 19497
2636 1 6 . 1 1 33 33 LEU CB C 33 45.700 45.700 44.202 1.498 19497
2637 1 6 . 1 1 33 33 LEU H H 33 9.142 9.142 8.612 0.530 19497
2638 1 6 . 1 1 34 34 LEU N N 34 127.452 127.452 123.356 4.096 19497
2639 1 6 . 1 1 34 34 LEU C C 34 174.084 174.084 175.568 -1.484 19497
2640 1 6 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.894 -1.694 19497
2641 1 6 . 1 1 34 34 LEU CB C 34 44.700 44.700 43.203 1.497 19497
2642 1 6 . 1 1 34 34 LEU H H 34 9.686 9.686 8.116 1.570 19497
2643 1 6 . 1 1 35 35 ASP N N 35 126.977 126.977 126.072 0.905 19497
2644 1 6 . 1 1 35 35 ASP C C 35 177.009 177.009 174.749 2.260 19497
2645 1 6 . 1 1 35 35 ASP CA C 35 52.600 52.600 53.168 -0.568 19497
2646 1 6 . 1 1 35 35 ASP CB C 35 41.400 41.400 42.828 -1.428 19497
2647 1 6 . 1 1 35 35 ASP H H 35 9.446 9.446 8.726 0.720 19497
2648 1 6 . 1 1 36 36 THR N N 36 118.735 118.735 117.337 1.398 19497
2649 1 6 . 1 1 36 36 THR C C 36 175.252 175.252 174.371 0.881 19497
2650 1 6 . 1 1 36 36 THR CA C 36 60.500 60.500 60.526 -0.026 19497
2651 1 6 . 1 1 36 36 THR CB C 36 68.000 68.000 70.643 -2.643 19497
2652 1 6 . 1 1 36 36 THR H H 36 8.310 8.310 8.055 0.255 19497
2653 1 6 . 1 1 37 37 TRP N N 37 122.289 122.289 123.799 -1.510 19497
2654 1 6 . 1 1 37 37 TRP C C 37 177.189 177.189 176.647 0.542 19497
2655 1 6 . 1 1 37 37 TRP CA C 37 61.500 61.500 59.434 2.066 19497
2656 1 6 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.329 -0.529 19497
2657 1 6 . 1 1 37 37 TRP H H 37 9.022 9.022 8.688 0.334 19497
2658 1 6 . 1 1 38 38 ASP N N 38 117.370 117.370 117.548 -0.178 19497
2659 1 6 . 1 1 38 38 ASP C C 38 175.290 175.290 176.718 -1.428 19497
2660 1 6 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.993 -0.593 19497
2661 1 6 . 1 1 38 38 ASP CB C 38 41.100 41.100 41.142 -0.042 19497
2662 1 6 . 1 1 38 38 ASP H H 38 8.518 8.518 8.053 0.465 19497
2663 1 6 . 1 1 39 39 GLN N N 39 111.522 111.522 119.404 -7.882 19497
2664 1 6 . 1 1 39 39 GLN C C 39 173.099 173.099 174.825 -1.726 19497
2665 1 6 . 1 1 39 39 GLN CA C 39 54.500 54.500 54.811 -0.311 19497
2666 1 6 . 1 1 39 39 GLN CB C 39 28.900 28.900 29.890 -0.990 19497
2667 1 6 . 1 1 39 39 GLN H H 39 7.118 7.118 7.836 -0.718 19497
2668 1 6 . 1 1 40 40 ILE N N 40 121.103 121.103 121.634 -0.531 19497
2669 1 6 . 1 1 40 40 ILE C C 40 174.406 174.406 174.872 -0.466 19497
2670 1 6 . 1 1 40 40 ILE CA C 40 58.900 58.900 60.389 -1.489 19497
2671 1 6 . 1 1 40 40 ILE CB C 40 38.900 38.900 38.661 0.239 19497
2672 1 6 . 1 1 40 40 ILE H H 40 8.422 8.422 7.967 0.455 19497
2673 1 6 . 1 1 41 41 PHE N N 41 123.856 123.856 124.779 -0.923 19497
2674 1 6 . 1 1 41 41 PHE C C 41 174.537 174.537 175.243 -0.706 19497
2675 1 6 . 1 1 41 41 PHE CA C 41 55.900 55.900 57.108 -1.208 19497
2676 1 6 . 1 1 41 41 PHE CB C 41 42.200 42.200 41.819 0.381 19497
2677 1 6 . 1 1 41 41 PHE H H 41 9.222 9.222 8.340 0.882 19497
2678 1 6 . 1 1 42 42 PHE N N 42 127.400 127.400 123.351 4.049 19497
2679 1 6 . 1 1 42 42 PHE C C 42 173.021 173.021 175.300 -2.279 19497
2680 1 6 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.923 -0.623 19497
2681 1 6 . 1 1 42 42 PHE CB C 42 42.300 42.300 40.363 1.937 19497
2682 1 6 . 1 1 42 42 PHE H H 42 9.358 9.358 9.144 0.214 19497
2683 1 6 . 1 1 43 43 TRP N N 43 129.616 129.616 126.760 2.856 19497
2684 1 6 . 1 1 43 43 TRP C C 43 174.538 174.538 175.503 -0.965 19497
2685 1 6 . 1 1 43 43 TRP CA C 43 61.600 61.600 58.434 3.166 19497
2686 1 6 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.608 7.593 19497
2687 1 6 . 1 1 43 43 TRP H H 43 9.646 9.646 8.864 0.782 19497
2688 1 6 . 1 1 44 44 ILE N N 44 121.402 121.402 123.751 -2.349 19497
2689 1 6 . 1 1 44 44 ILE C C 44 175.738 175.738 175.321 0.417 19497
2690 1 6 . 1 1 44 44 ILE CA C 44 57.600 57.600 59.906 -2.306 19497
2691 1 6 . 1 1 44 44 ILE CB C 44 39.100 39.100 41.536 -2.436 19497
2692 1 6 . 1 1 44 44 ILE H H 44 7.838 7.838 7.998 -0.160 19497
2693 1 6 . 1 1 45 45 GLY N N 45 114.403 114.403 111.048 3.355 19497
2694 1 6 . 1 1 45 45 GLY C C 45 175.519 175.519 174.498 1.021 19497
2695 1 6 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.720 1.780 19497
2696 1 6 . 1 1 45 45 GLY H H 45 7.742 7.742 8.169 -0.427 19497
2697 1 6 . 1 1 46 46 LYS N N 46 123.585 123.585 123.026 0.559 19497
2698 1 6 . 1 1 46 46 LYS C C 46 177.790 177.790 178.481 -0.691 19497
2699 1 6 . 1 1 46 46 LYS CA C 46 58.700 58.700 58.615 0.085 19497
2700 1 6 . 1 1 46 46 LYS CB C 46 32.200 32.200 32.573 -0.373 19497
2701 1 6 . 1 1 46 46 LYS H H 46 8.942 8.942 8.469 0.473 19497
2702 1 6 . 1 1 47 47 GLY N N 47 107.819 107.819 105.837 1.982 19497
2703 1 6 . 1 1 47 47 GLY C C 47 174.298 174.298 174.106 0.192 19497
2704 1 6 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.488 -0.188 19497
2705 1 6 . 1 1 47 47 GLY H H 47 8.670 8.670 7.834 0.836 19497
2706 1 6 . 1 1 48 48 ALA N N 48 123.965 123.965 123.490 0.475 19497
2707 1 6 . 1 1 48 48 ALA C C 48 177.189 177.189 176.841 0.348 19497
2708 1 6 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.534 0.566 19497
2709 1 6 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.593 -0.593 19497
2710 1 6 . 1 1 48 48 ALA H H 48 7.230 7.230 7.127 0.103 19497
2711 1 6 . 1 1 49 49 ASN N N 49 119.667 119.667 118.204 1.463 19497
2712 1 6 . 1 1 49 49 ASN C C 49 175.797 175.797 176.663 -0.866 19497
2713 1 6 . 1 1 49 49 ASN CA C 49 54.200 54.200 53.619 0.581 19497
2714 1 6 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.407 1.694 19497
2715 1 6 . 1 1 49 49 ASN H H 49 8.526 8.526 8.493 0.033 19497
2716 1 6 . 1 1 50 50 GLU N N 50 112.272 112.272 122.449 -10.177 19497
2717 1 6 . 1 1 50 50 GLU C C 50 178.128 178.128 178.471 -0.343 19497
2718 1 6 . 1 1 50 50 GLU CA C 50 59.600 59.600 60.056 -0.456 19497
2719 1 6 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.581 -0.281 19497
2720 1 6 . 1 1 50 50 GLU H H 50 7.814 7.814 8.933 -1.119 19497
2721 1 6 . 1 1 51 51 SER N N 51 113.952 113.952 115.883 -1.931 19497
2722 1 6 . 1 1 51 51 SER C C 51 177.874 177.874 176.709 1.165 19497
2723 1 6 . 1 1 51 51 SER CA C 51 61.100 61.100 61.557 -0.457 19497
2724 1 6 . 1 1 51 51 SER CB C 51 60.900 60.900 63.011 -2.111 19497
2725 1 6 . 1 1 51 51 SER H H 51 8.342 8.342 8.065 0.277 19497
2726 1 6 . 1 1 52 52 GLU N N 52 119.930 119.930 119.374 0.556 19497
2727 1 6 . 1 1 52 52 GLU C C 52 178.827 178.827 177.114 1.713 19497
2728 1 6 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.075 -0.174 19497
2729 1 6 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.553 -0.253 19497
2730 1 6 . 1 1 52 52 GLU H H 52 7.806 7.806 8.538 -0.732 19497
2731 1 6 . 1 1 53 53 LYS N N 53 118.112 118.112 118.504 -0.392 19497
2732 1 6 . 1 1 53 53 LYS C C 53 178.802 178.802 178.893 -0.091 19497
2733 1 6 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.314 1.686 19497
2734 1 6 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.899 -0.699 19497
2735 1 6 . 1 1 53 53 LYS H H 53 7.670 7.670 7.607 0.063 19497
2736 1 6 . 1 1 54 54 GLU N N 54 117.700 117.700 119.095 -1.395 19497
2737 1 6 . 1 1 54 54 GLU C C 54 177.733 177.733 178.565 -0.832 19497
2738 1 6 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.640 -0.440 19497
2739 1 6 . 1 1 54 54 GLU CB C 54 29.300 29.300 29.885 -0.585 19497
2740 1 6 . 1 1 54 54 GLU H H 54 7.934 7.934 8.573 -0.639 19497
2741 1 6 . 1 1 55 55 ALA N N 55 120.395 120.395 122.973 -2.578 19497
2742 1 6 . 1 1 55 55 ALA CA C 55 52.200 52.200 51.744 0.456 19497
2743 1 6 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.152 0.048 19497
2744 1 6 . 1 1 55 55 ALA H H 55 7.238 7.238 7.612 -0.374 19497
2745 1 6 . 1 1 56 56 ALA C C 56 177.526 177.526 178.685 -1.159 19497
2746 1 6 . 1 1 56 56 ALA CA C 56 55.600 55.600 53.807 1.793 19497
2747 1 6 . 1 1 56 56 ALA CB C 56 19.600 19.600 19.582 0.018 19497
2748 1 6 . 1 1 57 57 ALA N N 57 117.753 117.753 120.441 -2.688 19497
2749 1 6 . 1 1 57 57 ALA C C 57 180.072 180.072 179.158 0.914 19497
2750 1 6 . 1 1 57 57 ALA CA C 57 55.200 55.200 54.368 0.832 19497
2751 1 6 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.295 -0.895 19497
2752 1 6 . 1 1 57 57 ALA H H 57 7.990 7.990 8.352 -0.362 19497
2753 1 6 . 1 1 58 58 GLU N N 58 118.444 118.444 117.021 1.423 19497
2754 1 6 . 1 1 58 58 GLU C C 58 179.225 179.225 178.026 1.199 19497
2755 1 6 . 1 1 58 58 GLU CA C 58 59.600 59.600 59.262 0.338 19497
2756 1 6 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.445 -0.545 19497
2757 1 6 . 1 1 58 58 GLU H H 58 7.582 7.582 8.583 -1.001 19497
2758 1 6 . 1 1 59 59 THR N N 59 119.842 119.842 115.969 3.873 19497
2759 1 6 . 1 1 59 59 THR C C 59 175.781 175.781 175.969 -0.188 19497
2760 1 6 . 1 1 59 59 THR CA C 59 66.200 66.200 65.447 0.753 19497
2761 1 6 . 1 1 59 59 THR CB C 59 67.600 67.600 68.088 -0.488 19497
2762 1 6 . 1 1 59 59 THR H H 59 8.422 8.422 7.597 0.825 19497
2763 1 6 . 1 1 60 60 ALA N N 60 122.454 122.454 124.584 -2.130 19497
2764 1 6 . 1 1 60 60 ALA C C 60 178.583 178.583 179.172 -0.589 19497
2765 1 6 . 1 1 60 60 ALA CA C 60 55.200 55.200 55.091 0.109 19497
2766 1 6 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.538 0.562 19497
2767 1 6 . 1 1 60 60 ALA H H 60 7.966 7.966 7.429 0.537 19497
2768 1 6 . 1 1 61 61 GLN N N 61 115.462 115.462 117.429 -1.967 19497
2769 1 6 . 1 1 61 61 GLN C C 61 178.101 178.101 178.300 -0.199 19497
2770 1 6 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.532 0.368 19497
2771 1 6 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.177 -0.077 19497
2772 1 6 . 1 1 61 61 GLN H H 61 7.598 7.598 7.559 0.039 19497
2773 1 6 . 1 1 62 62 GLU N N 62 120.883 120.883 120.832 0.051 19497
2774 1 6 . 1 1 62 62 GLU C C 62 174.071 174.071 178.869 -4.798 19497
2775 1 6 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.537 -5.437 19497
2776 1 6 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.759 0.541 19497
2777 1 6 . 1 1 62 62 GLU H H 62 7.910 7.910 8.290 -0.380 19497
2778 1 6 . 1 1 63 63 TYR N N 63 118.888 118.888 120.076 -1.188 19497
2779 1 6 . 1 1 63 63 TYR C C 63 177.874 177.874 177.934 -0.060 19497
2780 1 6 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.621 0.479 19497
2781 1 6 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.472 1.028 19497
2782 1 6 . 1 1 63 63 TYR H H 63 8.182 8.182 8.229 -0.047 19497
2783 1 6 . 1 1 64 64 LEU N N 64 119.930 119.930 119.433 0.497 19497
2784 1 6 . 1 1 64 64 LEU C C 64 178.536 178.536 179.111 -0.575 19497
2785 1 6 . 1 1 64 64 LEU CA C 64 57.900 57.900 58.084 -0.184 19497
2786 1 6 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.819 -2.920 19497
2787 1 6 . 1 1 64 64 LEU H H 64 7.806 7.806 8.036 -0.230 19497
2788 1 6 . 1 1 65 65 ARG N N 65 117.322 117.322 116.849 0.473 19497
2789 1 6 . 1 1 65 65 ARG C C 65 177.436 177.436 177.647 -0.211 19497
2790 1 6 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.696 -0.096 19497
2791 1 6 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.001 0.399 19497
2792 1 6 . 1 1 65 65 ARG H H 65 8.054 8.054 7.718 0.336 19497
2793 1 6 . 1 1 66 66 SER N N 66 111.783 111.783 111.588 0.195 19497
2794 1 6 . 1 1 66 66 SER C C 66 173.652 173.652 174.543 -0.891 19497
2795 1 6 . 1 1 66 66 SER CA C 66 58.900 58.900 58.512 0.388 19497
2796 1 6 . 1 1 66 66 SER CB C 66 63.800 63.800 63.957 -0.157 19497
2797 1 6 . 1 1 66 66 SER H H 66 7.550 7.550 7.424 0.126 19497
2798 1 6 . 1 1 67 67 HIS N N 67 124.135 124.135 123.828 0.307 19497
2799 1 6 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.160 0.541 19497
2800 1 6 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.816 -1.616 19497
2801 1 6 . 1 1 67 67 HIS H H 67 7.134 7.134 7.527 -0.393 19497
2802 1 6 . 1 1 68 68 PRO C C 68 178.101 178.101 175.698 2.403 19497
2803 1 6 . 1 1 68 68 PRO CA C 68 58.900 58.900 62.984 -4.084 19497
2804 1 6 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.142 -1.242 19497
2805 1 6 . 1 1 69 69 GLY N N 69 115.697 115.697 107.013 8.684 19497
2806 1 6 . 1 1 69 69 GLY C C 69 176.641 176.641 174.610 2.031 19497
2807 1 6 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.261 0.739 19497
2808 1 6 . 1 1 69 69 GLY H H 69 7.926 7.926 6.718 1.208 19497
2809 1 6 . 1 1 70 70 SER N N 70 115.440 115.440 116.035 -0.595 19497
2810 1 6 . 1 1 70 70 SER C C 70 173.277 173.277 174.765 -1.488 19497
2811 1 6 . 1 1 70 70 SER CA C 70 58.300 58.300 59.000 -0.700 19497
2812 1 6 . 1 1 70 70 SER CB C 70 64.300 64.300 62.269 2.031 19497
2813 1 6 . 1 1 70 70 SER H H 70 8.030 8.030 7.679 0.351 19497
2814 1 6 . 1 1 71 71 ARG N N 71 127.642 127.642 120.405 7.237 19497
2815 1 6 . 1 1 71 71 ARG C C 71 175.849 175.849 175.178 0.671 19497
2816 1 6 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.492 -1.592 19497
2817 1 6 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.920 -0.020 19497
2818 1 6 . 1 1 71 71 ARG H H 71 8.006 8.006 8.000 0.006 19497
2819 1 6 . 1 1 72 72 ASP N N 72 120.975 120.975 119.757 1.218 19497
2820 1 6 . 1 1 72 72 ASP C C 72 176.087 176.087 177.154 -1.067 19497
2821 1 6 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.305 0.195 19497
2822 1 6 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.636 -0.736 19497
2823 1 6 . 1 1 72 72 ASP H H 72 8.182 8.182 8.373 -0.191 19497
2824 1 6 . 1 1 73 73 LEU N N 73 121.535 121.535 125.182 -3.647 19497
2825 1 6 . 1 1 73 73 LEU C C 73 177.020 177.020 176.794 0.226 19497
2826 1 6 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.750 0.250 19497
2827 1 6 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.393 0.607 19497
2828 1 6 . 1 1 73 73 LEU H H 73 8.014 8.014 8.435 -0.421 19497
2829 1 6 . 1 1 74 74 ASP N N 74 120.525 120.525 118.950 1.575 19497
2830 1 6 . 1 1 74 74 ASP C C 74 175.797 175.797 175.709 0.088 19497
2831 1 6 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.177 1.023 19497
2832 1 6 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.472 -0.472 19497
2833 1 6 . 1 1 74 74 ASP H H 74 8.134 8.134 7.739 0.395 19497
2834 1 6 . 1 1 75 75 THR N N 75 116.656 116.656 118.002 -1.346 19497
2835 1 6 . 1 1 75 75 THR CA C 75 59.700 59.700 60.780 -1.080 19497
2836 1 6 . 1 1 75 75 THR CB C 75 69.600 69.600 68.724 0.876 19497
2837 1 6 . 1 1 75 75 THR H H 75 7.814 7.814 7.351 0.463 19497
2838 1 6 . 1 1 76 76 PRO C C 76 174.538 174.538 175.749 -1.211 19497
2839 1 6 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.881 0.619 19497
2840 1 6 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.228 0.372 19497
2841 1 6 . 1 1 77 77 ILE N N 77 121.402 121.402 122.517 -1.115 19497
2842 1 6 . 1 1 77 77 ILE C C 77 176.132 176.132 175.622 0.510 19497
2843 1 6 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.432 -1.332 19497
2844 1 6 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.163 -0.163 19497
2845 1 6 . 1 1 77 77 ILE H H 77 7.838 7.838 8.098 -0.260 19497
2846 1 6 . 1 1 78 78 ILE N N 78 130.292 130.292 128.190 2.102 19497
2847 1 6 . 1 1 78 78 ILE C C 78 175.084 175.084 174.344 0.740 19497
2848 1 6 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.924 -0.024 19497
2849 1 6 . 1 1 78 78 ILE CB C 78 39.000 39.000 40.382 -1.382 19497
2850 1 6 . 1 1 78 78 ILE H H 78 8.910 8.910 8.281 0.629 19497
2851 1 6 . 1 1 79 79 VAL N N 79 129.237 129.237 124.431 4.806 19497
2852 1 6 . 1 1 79 79 VAL C C 79 175.907 175.907 175.232 0.675 19497
2853 1 6 . 1 1 79 79 VAL CA C 79 63.200 63.200 60.947 2.253 19497
2854 1 6 . 1 1 79 79 VAL CB C 79 31.700 31.700 33.645 -1.945 19497
2855 1 6 . 1 1 79 79 VAL H H 79 8.670 8.670 8.489 0.181 19497
2856 1 6 . 1 1 80 80 VAL N N 80 128.354 128.354 126.297 2.057 19497
2857 1 6 . 1 1 80 80 VAL C C 80 172.823 172.823 174.394 -1.571 19497
2858 1 6 . 1 1 80 80 VAL CA C 80 59.400 59.400 60.925 -1.525 19497
2859 1 6 . 1 1 80 80 VAL CB C 80 32.600 32.600 35.509 -2.909 19497
2860 1 6 . 1 1 80 80 VAL H H 80 9.598 9.598 8.593 1.005 19497
2861 1 6 . 1 1 81 81 LYS N N 81 123.077 123.077 121.824 1.253 19497
2862 1 6 . 1 1 81 81 LYS C C 81 178.101 178.101 174.773 3.328 19497
2863 1 6 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.758 0.642 19497
2864 1 6 . 1 1 81 81 LYS CB C 81 34.300 34.300 35.314 -1.014 19497
2865 1 6 . 1 1 81 81 LYS H H 81 8.198 8.198 8.770 -0.572 19497
2866 1 6 . 1 1 82 82 GLN N N 82 121.436 121.436 125.832 -4.396 19497
2867 1 6 . 1 1 82 82 GLN C C 82 177.068 177.068 175.947 1.121 19497
2868 1 6 . 1 1 82 82 GLN CA C 82 56.200 56.200 57.807 -1.607 19497
2869 1 6 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.143 1.257 19497
2870 1 6 . 1 1 82 82 GLN H H 82 7.910 7.910 8.489 -0.579 19497
2871 1 6 . 1 1 83 83 GLY N N 83 110.688 110.688 113.521 -2.833 19497
2872 1 6 . 1 1 83 83 GLY C C 83 173.348 173.348 173.524 -0.176 19497
2873 1 6 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.803 0.197 19497
2874 1 6 . 1 1 83 83 GLY H H 83 8.382 8.382 8.311 0.071 19497
2875 1 6 . 1 1 84 84 PHE N N 84 119.493 119.493 123.133 -3.640 19497
2876 1 6 . 1 1 84 84 PHE C C 84 175.035 175.035 174.224 0.811 19497
2877 1 6 . 1 1 84 84 PHE CA C 84 57.300 57.300 57.028 0.272 19497
2878 1 6 . 1 1 84 84 PHE CB C 84 42.200 42.200 39.490 2.710 19497
2879 1 6 . 1 1 84 84 PHE H H 84 7.910 7.910 8.134 -0.224 19497
2880 1 6 . 1 1 85 85 GLU N N 85 124.672 124.672 124.136 0.536 19497
2881 1 6 . 1 1 85 85 GLU CA C 85 59.000 59.000 53.542 5.458 19497
2882 1 6 . 1 1 85 85 GLU CB C 85 29.700 29.700 30.776 -1.076 19497
2883 1 6 . 1 1 85 85 GLU H H 85 8.142 8.142 8.568 -0.426 19497
2884 1 6 . 1 1 87 87 PRO C C 87 178.284 178.284 177.139 1.145 19497
2885 1 6 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.093 -0.993 19497
2886 1 6 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.701 -0.601 19497
2887 1 6 . 1 1 88 88 THR N N 88 106.959 106.959 105.882 1.077 19497
2888 1 6 . 1 1 88 88 THR C C 88 174.182 174.182 175.568 -1.386 19497
2889 1 6 . 1 1 88 88 THR CA C 88 62.900 62.900 61.955 0.945 19497
2890 1 6 . 1 1 88 88 THR CB C 88 68.000 68.000 68.816 -0.816 19497
2891 1 6 . 1 1 88 88 THR H H 88 7.110 7.110 7.904 -0.794 19497
2892 1 6 . 1 1 89 89 PHE N N 89 118.766 118.766 122.032 -3.266 19497
2893 1 6 . 1 1 89 89 PHE C C 89 175.468 175.468 175.890 -0.422 19497
2894 1 6 . 1 1 89 89 PHE CA C 89 59.800 59.800 58.904 0.896 19497
2895 1 6 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.099 1.601 19497
2896 1 6 . 1 1 89 89 PHE H H 89 7.198 7.198 7.562 -0.364 19497
2897 1 6 . 1 1 90 90 THR N N 90 107.050 107.050 113.615 -6.565 19497
2898 1 6 . 1 1 90 90 THR C C 90 177.260 177.260 176.593 0.667 19497
2899 1 6 . 1 1 90 90 THR CA C 90 64.600 64.600 61.227 3.373 19497
2900 1 6 . 1 1 90 90 THR CB C 90 67.900 67.900 67.127 0.773 19497
2901 1 6 . 1 1 90 90 THR H H 90 7.446 7.446 7.847 -0.401 19497
2902 1 6 . 1 1 91 91 GLY N N 91 106.738 106.738 110.096 -3.358 19497
2903 1 6 . 1 1 91 91 GLY C C 91 174.422 174.422 174.592 -0.170 19497
2904 1 6 . 1 1 91 91 GLY CA C 91 46.000 46.000 46.042 -0.042 19497
2905 1 6 . 1 1 91 91 GLY H H 91 7.646 7.646 7.496 0.150 19497
2906 1 6 . 1 1 92 92 TRP N N 92 117.500 117.500 119.836 -2.336 19497
2907 1 6 . 1 1 92 92 TRP C C 92 174.209 174.209 174.938 -0.729 19497
2908 1 6 . 1 1 92 92 TRP CA C 92 56.900 56.900 55.301 1.599 19497
2909 1 6 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.519 -0.119 19497
2910 1 6 . 1 1 92 92 TRP H H 92 6.790 6.790 6.902 -0.112 19497
2911 1 6 . 1 1 93 93 PHE N N 93 119.092 119.092 119.076 0.016 19497
2912 1 6 . 1 1 93 93 PHE C C 93 175.953 175.953 175.927 0.026 19497
2913 1 6 . 1 1 93 93 PHE CA C 93 56.700 56.700 56.543 0.157 19497
2914 1 6 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.808 0.492 19497
2915 1 6 . 1 1 93 93 PHE H H 93 7.750 7.750 7.214 0.536 19497
2916 1 6 . 1 1 94 94 MET N N 94 121.554 121.554 125.118 -3.564 19497
2917 1 6 . 1 1 94 94 MET C C 94 175.738 175.738 176.528 -0.790 19497
2918 1 6 . 1 1 94 94 MET CA C 94 57.600 57.600 57.111 0.489 19497
2919 1 6 . 1 1 94 94 MET CB C 94 32.000 32.000 33.998 -1.998 19497
2920 1 6 . 1 1 94 94 MET H H 94 8.654 8.654 9.260 -0.606 19497
2921 1 6 . 1 1 95 95 ALA N N 95 119.777 119.777 121.470 -1.693 19497
2922 1 6 . 1 1 95 95 ALA C C 95 175.441 175.441 175.997 -0.556 19497
2923 1 6 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.215 0.084 19497
2924 1 6 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.932 1.768 19497
2925 1 6 . 1 1 95 95 ALA H H 95 7.750 7.750 8.090 -0.340 19497
2926 1 6 . 1 1 96 96 TRP N N 96 120.813 120.813 121.416 -0.603 19497
2927 1 6 . 1 1 96 96 TRP C C 96 175.488 175.488 174.764 0.724 19497
2928 1 6 . 1 1 96 96 TRP CA C 96 57.700 57.700 57.015 0.685 19497
2929 1 6 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.009 0.391 19497
2930 1 6 . 1 1 96 96 TRP H H 96 8.254 8.254 7.836 0.418 19497
2931 1 6 . 1 1 97 97 ASP N N 97 117.140 117.140 127.709 -10.569 19497
2932 1 6 . 1 1 97 97 ASP CA C 97 53.700 53.700 51.087 2.613 19497
2933 1 6 . 1 1 97 97 ASP CB C 97 39.600 39.600 42.724 -3.124 19497
2934 1 6 . 1 1 97 97 ASP H H 97 8.958 8.958 8.106 0.852 19497
2935 1 6 . 1 1 98 98 PRO C C 98 174.071 174.071 176.675 -2.604 19497
2936 1 6 . 1 1 98 98 PRO CA C 98 63.100 63.100 65.063 -1.963 19497
2937 1 6 . 1 1 98 98 PRO CB C 98 32.400 32.400 31.942 0.458 19497
2938 1 6 . 1 1 99 99 LEU N N 99 118.888 118.888 117.038 1.850 19497
2939 1 6 . 1 1 99 99 LEU C C 99 177.519 177.519 176.821 0.698 19497
2940 1 6 . 1 1 99 99 LEU CA C 99 54.400 54.400 55.054 -0.654 19497
2941 1 6 . 1 1 99 99 LEU CB C 99 40.500 40.500 42.367 -1.867 19497
2942 1 6 . 1 1 99 99 LEU H H 99 8.182 8.182 7.746 0.436 19497
2943 1 6 . 1 1 100 100 CYS N N 100 118.788 118.788 116.431 2.357 19497
2944 1 6 . 1 1 100 100 CYS C C 100 174.685 174.685 173.555 1.130 19497
2945 1 6 . 1 1 100 100 CYS CA C 100 60.800 60.800 58.549 2.251 19497
2946 1 6 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.128 0.272 19497
2947 1 6 . 1 1 100 100 CYS H H 100 6.862 6.862 7.390 -0.528 19497
2948 1 6 . 1 1 101 101 TRP N N 101 117.558 117.558 122.091 -4.533 19497
2949 1 6 . 1 1 101 101 TRP C C 101 176.478 176.478 175.152 1.326 19497
2950 1 6 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.522 -2.122 19497
2951 1 6 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.289 -2.089 19497
2952 1 6 . 1 1 101 101 TRP H H 101 7.662 7.662 7.802 -0.140 19497
2953 1 6 . 1 1 102 102 SER N N 102 115.626 115.626 116.768 -1.142 19497
2954 1 6 . 1 1 102 102 SER C C 102 174.303 174.303 173.767 0.536 19497
2955 1 6 . 1 1 102 102 SER CA C 102 58.900 58.900 57.304 1.596 19497
2956 1 6 . 1 1 102 102 SER CB C 102 63.700 63.700 64.727 -1.027 19497
2957 1 6 . 1 1 102 102 SER H H 102 7.734 7.734 8.310 -0.576 19497
2958 1 6 . 1 1 103 103 ASP N N 103 121.936 121.936 120.260 1.676 19497
2959 1 6 . 1 1 103 103 ASP CA C 103 54.400 54.400 55.889 -1.489 19497
2960 1 6 . 1 1 103 103 ASP CB C 103 40.600 40.600 40.035 0.565 19497
2961 1 6 . 1 1 103 103 ASP H H 103 8.254 8.254 8.660 -0.406 19497
2962 1 6 . 1 1 104 104 ARG N N 104 120.567 120.567 117.009 3.558 19497
2963 1 6 . 1 1 104 104 ARG C C 104 176.177 176.177 176.365 -0.188 19497
2964 1 6 . 1 1 104 104 ARG CA C 104 56.000 56.000 55.971 0.029 19497
2965 1 6 . 1 1 104 104 ARG CB C 104 30.300 30.300 31.003 -0.703 19497
2966 1 6 . 1 1 104 104 ARG H H 104 7.910 7.910 8.108 -0.198 19497
2967 1 6 . 1 1 105 105 LYS N N 105 121.805 121.805 119.854 1.951 19497
2968 1 6 . 1 1 105 105 LYS C C 105 176.141 176.141 176.596 -0.455 19497
2969 1 6 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.141 -1.041 19497
2970 1 6 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.431 -0.631 19497
2971 1 6 . 1 1 105 105 LYS H H 105 8.094 8.094 8.221 -0.127 19497
2972 1 6 . 1 1 106 106 SER N N 106 116.792 116.792 111.487 5.305 19497
2973 1 6 . 1 1 106 106 SER C C 106 172.841 172.841 174.021 -1.180 19497
2974 1 6 . 1 1 106 106 SER CA C 106 57.900 57.900 58.392 -0.491 19497
2975 1 6 . 1 1 106 106 SER CB C 106 63.800 63.800 63.792 0.008 19497
2976 1 6 . 1 1 106 106 SER H H 106 8.030 8.030 7.982 0.048 19497
2977 1 7 . 1 1 2 2 ARG N N 2 117.187 117.187 119.888 -2.701 19497
2978 1 7 . 1 1 2 2 ARG C C 2 172.315 172.315 175.043 -2.728 19497
2979 1 7 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.108 -0.008 19497
2980 1 7 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.718 -1.718 19497
2981 1 7 . 1 1 2 2 ARG H H 2 7.766 7.766 8.197 -0.431 19497
2982 1 7 . 1 1 3 3 LEU N N 3 125.426 125.426 124.768 0.658 19497
2983 1 7 . 1 1 3 3 LEU C C 3 173.996 173.996 174.871 -0.875 19497
2984 1 7 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.683 -1.083 19497
2985 1 7 . 1 1 3 3 LEU CB C 3 45.100 45.100 45.738 -0.638 19497
2986 1 7 . 1 1 3 3 LEU H H 3 8.246 8.246 8.713 -0.467 19497
2987 1 7 . 1 1 4 4 PHE N N 4 122.682 122.682 124.546 -1.864 19497
2988 1 7 . 1 1 4 4 PHE C C 4 175.512 175.512 175.388 0.124 19497
2989 1 7 . 1 1 4 4 PHE CA C 4 55.700 55.700 56.592 -0.892 19497
2990 1 7 . 1 1 4 4 PHE CB C 4 41.800 41.800 39.292 2.508 19497
2991 1 7 . 1 1 4 4 PHE H H 4 9.390 9.390 9.192 0.198 19497
2992 1 7 . 1 1 5 5 GLU N N 5 125.826 125.826 123.545 2.281 19497
2993 1 7 . 1 1 5 5 GLU C C 5 175.679 175.679 175.590 0.089 19497
2994 1 7 . 1 1 5 5 GLU CA C 5 56.400 56.400 54.440 1.960 19497
2995 1 7 . 1 1 5 5 GLU CB C 5 29.400 29.400 34.239 -4.839 19497
2996 1 7 . 1 1 5 5 GLU H H 5 9.190 9.190 8.623 0.567 19497
2997 1 7 . 1 1 6 6 CYS N N 6 121.540 121.540 118.197 3.343 19497
2998 1 7 . 1 1 6 6 CYS C C 6 175.738 175.738 173.679 2.059 19497
2999 1 7 . 1 1 6 6 CYS CA C 6 56.100 56.100 56.837 -0.737 19497
3000 1 7 . 1 1 6 6 CYS CB C 6 28.200 28.200 30.867 -2.667 19497
3001 1 7 . 1 1 6 6 CYS H H 6 8.158 8.158 8.633 -0.475 19497
3002 1 7 . 1 1 7 7 SER N N 7 116.299 116.299 118.029 -1.730 19497
3003 1 7 . 1 1 7 7 SER C C 7 173.277 173.277 173.150 0.127 19497
3004 1 7 . 1 1 7 7 SER CA C 7 58.300 58.300 57.288 1.012 19497
3005 1 7 . 1 1 7 7 SER CB C 7 64.300 64.300 65.140 -0.840 19497
3006 1 7 . 1 1 7 7 SER H H 7 7.734 7.734 8.047 -0.313 19497
3007 1 7 . 1 1 8 8 ASN N N 8 127.642 127.642 122.584 5.058 19497
3008 1 7 . 1 1 8 8 ASN C C 8 177.812 177.812 175.171 2.641 19497
3009 1 7 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.184 2.716 19497
3010 1 7 . 1 1 8 8 ASN CB C 8 39.200 39.200 40.171 -0.971 19497
3011 1 7 . 1 1 8 8 ASN H H 8 8.006 8.006 8.525 -0.519 19497
3012 1 7 . 1 1 9 9 LYS N N 9 122.472 122.472 119.987 2.485 19497
3013 1 7 . 1 1 9 9 LYS C C 9 177.932 177.932 176.282 1.650 19497
3014 1 7 . 1 1 9 9 LYS CA C 9 59.300 59.300 55.990 3.310 19497
3015 1 7 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.019 -0.619 19497
3016 1 7 . 1 1 9 9 LYS H H 9 8.350 8.350 7.598 0.752 19497
3017 1 7 . 1 1 10 10 THR N N 10 109.478 109.478 115.714 -6.236 19497
3018 1 7 . 1 1 10 10 THR C C 10 175.241 175.241 174.275 0.966 19497
3019 1 7 . 1 1 10 10 THR CA C 10 62.400 62.400 61.710 0.690 19497
3020 1 7 . 1 1 10 10 THR CB C 10 69.700 69.700 68.413 1.286 19497
3021 1 7 . 1 1 10 10 THR H H 10 8.486 8.486 8.272 0.214 19497
3022 1 7 . 1 1 11 11 GLY N N 11 110.146 110.146 110.962 -0.816 19497
3023 1 7 . 1 1 11 11 GLY C C 11 172.717 172.717 174.105 -1.388 19497
3024 1 7 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.970 -0.270 19497
3025 1 7 . 1 1 11 11 GLY H H 11 8.014 8.014 7.681 0.333 19497
3026 1 7 . 1 1 12 12 ARG N N 12 117.911 117.911 119.151 -1.240 19497
3027 1 7 . 1 1 12 12 ARG C C 12 173.660 173.660 176.205 -2.545 19497
3028 1 7 . 1 1 12 12 ARG CA C 12 53.800 53.800 56.128 -2.328 19497
3029 1 7 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.454 2.946 19497
3030 1 7 . 1 1 12 12 ARG H H 12 7.342 7.342 8.526 -1.184 19497
3031 1 7 . 1 1 13 13 PHE N N 13 122.082 122.082 119.112 2.970 19497
3032 1 7 . 1 1 13 13 PHE C C 13 174.525 174.525 174.445 0.080 19497
3033 1 7 . 1 1 13 13 PHE CA C 13 58.700 58.700 57.000 1.700 19497
3034 1 7 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.521 0.379 19497
3035 1 7 . 1 1 13 13 PHE H H 13 8.462 8.462 8.193 0.269 19497
3036 1 7 . 1 1 14 14 LEU N N 14 129.559 129.559 123.413 6.146 19497
3037 1 7 . 1 1 14 14 LEU C C 14 174.071 174.071 175.940 -1.869 19497
3038 1 7 . 1 1 14 14 LEU CA C 14 54.100 54.100 53.542 0.558 19497
3039 1 7 . 1 1 14 14 LEU CB C 14 45.500 45.500 40.987 4.513 19497
3040 1 7 . 1 1 14 14 LEU H H 14 8.054 8.054 7.529 0.525 19497
3041 1 7 . 1 1 15 15 ALA N N 15 126.873 126.873 129.529 -2.656 19497
3042 1 7 . 1 1 15 15 ALA C C 15 176.826 176.826 175.858 0.968 19497
3043 1 7 . 1 1 15 15 ALA CA C 15 49.900 49.900 51.027 -1.127 19497
3044 1 7 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.796 -1.496 19497
3045 1 7 . 1 1 15 15 ALA H H 15 8.190 8.190 8.584 -0.394 19497
3046 1 7 . 1 1 16 16 THR N N 16 120.557 120.557 116.354 4.203 19497
3047 1 7 . 1 1 16 16 THR C C 16 173.449 173.449 173.905 -0.456 19497
3048 1 7 . 1 1 16 16 THR CA C 16 61.500 61.500 61.756 -0.256 19497
3049 1 7 . 1 1 16 16 THR CB C 16 70.500 70.500 70.087 0.413 19497
3050 1 7 . 1 1 16 16 THR H H 16 9.014 9.014 8.182 0.832 19497
3051 1 7 . 1 1 17 17 GLU N N 17 129.862 129.862 126.857 3.005 19497
3052 1 7 . 1 1 17 17 GLU C C 17 175.703 175.703 175.793 -0.090 19497
3053 1 7 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.327 1.573 19497
3054 1 7 . 1 1 17 17 GLU CB C 17 29.200 29.200 32.194 -2.994 19497
3055 1 7 . 1 1 17 17 GLU H H 17 9.118 9.118 8.656 0.462 19497
3056 1 7 . 1 1 18 18 ILE N N 18 128.992 128.992 118.354 10.638 19497
3057 1 7 . 1 1 18 18 ILE C C 18 175.994 175.994 175.344 0.650 19497
3058 1 7 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.281 -0.680 19497
3059 1 7 . 1 1 18 18 ILE CB C 18 37.300 37.300 39.497 -2.197 19497
3060 1 7 . 1 1 18 18 ILE H H 18 8.686 8.686 8.057 0.629 19497
3061 1 7 . 1 1 19 19 VAL N N 19 127.812 127.812 117.432 10.380 19497
3062 1 7 . 1 1 19 19 VAL C C 19 175.611 175.611 174.962 0.649 19497
3063 1 7 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.480 0.221 19497
3064 1 7 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.104 0.896 19497
3065 1 7 . 1 1 19 19 VAL H H 19 8.422 8.422 8.038 0.384 19497
3066 1 7 . 1 1 20 20 ASP N N 20 123.008 123.008 119.299 3.709 19497
3067 1 7 . 1 1 20 20 ASP C C 20 175.669 175.669 175.448 0.221 19497
3068 1 7 . 1 1 20 20 ASP CA C 20 54.900 54.900 54.330 0.570 19497
3069 1 7 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.446 -2.946 19497
3070 1 7 . 1 1 20 20 ASP H H 20 8.894 8.894 8.054 0.840 19497
3071 1 7 . 1 1 21 21 PHE N N 21 112.724 112.724 119.459 -6.735 19497
3072 1 7 . 1 1 21 21 PHE C C 21 174.706 174.706 174.757 -0.051 19497
3073 1 7 . 1 1 21 21 PHE CA C 21 56.200 56.200 56.634 -0.434 19497
3074 1 7 . 1 1 21 21 PHE CB C 21 41.000 41.000 38.860 2.140 19497
3075 1 7 . 1 1 21 21 PHE H H 21 6.261 6.261 8.375 -2.114 19497
3076 1 7 . 1 1 22 22 THR N N 22 112.022 112.022 113.918 -1.896 19497
3077 1 7 . 1 1 22 22 THR C C 22 175.111 175.111 174.945 0.166 19497
3078 1 7 . 1 1 22 22 THR CA C 22 60.100 60.100 60.489 -0.389 19497
3079 1 7 . 1 1 22 22 THR H H 22 9.422 9.422 8.169 1.253 19497
3080 1 7 . 1 1 23 23 GLN N N 23 122.305 122.305 121.824 0.481 19497
3081 1 7 . 1 1 23 23 GLN C C 23 176.564 176.564 176.877 -0.313 19497
3082 1 7 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.294 -0.694 19497
3083 1 7 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.491 -1.591 19497
3084 1 7 . 1 1 23 23 GLN H H 23 9.470 9.470 9.070 0.400 19497
3085 1 7 . 1 1 24 24 ASP N N 24 114.251 114.251 118.245 -3.994 19497
3086 1 7 . 1 1 24 24 ASP C C 24 174.839 174.839 177.319 -2.480 19497
3087 1 7 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.592 -0.892 19497
3088 1 7 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.319 0.180 19497
3089 1 7 . 1 1 24 24 ASP H H 24 7.534 7.534 8.256 -0.722 19497
3090 1 7 . 1 1 25 25 ASP N N 25 116.046 116.046 118.791 -2.745 19497
3091 1 7 . 1 1 25 25 ASP C C 25 176.087 176.087 176.449 -0.362 19497
3092 1 7 . 1 1 25 25 ASP CA C 25 54.500 54.500 56.017 -1.517 19497
3093 1 7 . 1 1 25 25 ASP CB C 25 40.600 40.600 41.190 -0.590 19497
3094 1 7 . 1 1 25 25 ASP H H 25 7.454 7.454 7.868 -0.414 19497
3095 1 7 . 1 1 26 26 LEU N N 26 121.535 121.535 120.745 0.790 19497
3096 1 7 . 1 1 26 26 LEU C C 26 176.343 176.343 176.090 0.253 19497
3097 1 7 . 1 1 26 26 LEU CA C 26 55.000 55.000 55.064 -0.064 19497
3098 1 7 . 1 1 26 26 LEU CB C 26 41.300 41.300 41.805 -0.505 19497
3099 1 7 . 1 1 26 26 LEU H H 26 8.014 8.014 7.488 0.526 19497
3100 1 7 . 1 1 27 27 ASP N N 27 127.804 127.804 124.539 3.265 19497
3101 1 7 . 1 1 27 27 ASP C C 27 176.947 176.947 176.836 0.111 19497
3102 1 7 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.317 0.683 19497
3103 1 7 . 1 1 27 27 ASP CB C 27 43.400 43.400 43.255 0.145 19497
3104 1 7 . 1 1 27 27 ASP H H 27 8.326 8.326 8.354 -0.028 19497
3105 1 7 . 1 1 28 28 GLU N N 28 123.641 123.641 121.530 2.111 19497
3106 1 7 . 1 1 28 28 GLU C C 28 176.141 176.141 176.700 -0.559 19497
3107 1 7 . 1 1 28 28 GLU CA C 28 54.500 54.500 58.776 -4.276 19497
3108 1 7 . 1 1 28 28 GLU CB C 28 32.700 32.700 29.860 2.840 19497
3109 1 7 . 1 1 28 28 GLU H H 28 8.278 8.278 8.909 -0.631 19497
3110 1 7 . 1 1 29 29 ASN N N 29 120.901 120.901 114.553 6.348 19497
3111 1 7 . 1 1 29 29 ASN C C 29 174.383 174.383 175.140 -0.757 19497
3112 1 7 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.876 4.424 19497
3113 1 7 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.527 -0.227 19497
3114 1 7 . 1 1 29 29 ASN H H 29 8.022 8.022 8.352 -0.330 19497
3115 1 7 . 1 1 30 30 ASP N N 30 125.016 125.016 117.509 7.507 19497
3116 1 7 . 1 1 30 30 ASP C C 30 175.679 175.679 174.047 1.632 19497
3117 1 7 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.244 -0.944 19497
3118 1 7 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.405 -3.405 19497
3119 1 7 . 1 1 30 30 ASP H H 30 8.142 8.142 7.649 0.493 19497
3120 1 7 . 1 1 31 31 VAL N N 31 121.540 121.540 120.042 1.498 19497
3121 1 7 . 1 1 31 31 VAL C C 31 175.675 175.675 174.269 1.406 19497
3122 1 7 . 1 1 31 31 VAL CA C 31 62.000 62.000 60.866 1.134 19497
3123 1 7 . 1 1 31 31 VAL CB C 31 32.800 32.800 33.593 -0.792 19497
3124 1 7 . 1 1 31 31 VAL H H 31 8.158 8.158 8.608 -0.450 19497
3125 1 7 . 1 1 32 32 TYR N N 32 126.116 126.116 127.307 -1.191 19497
3126 1 7 . 1 1 32 32 TYR C C 32 173.449 173.449 175.148 -1.699 19497
3127 1 7 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.176 -0.176 19497
3128 1 7 . 1 1 32 32 TYR H H 32 8.294 8.294 8.526 -0.232 19497
3129 1 7 . 1 1 33 33 LEU N N 33 121.235 121.235 122.138 -0.903 19497
3130 1 7 . 1 1 33 33 LEU C C 33 174.948 174.948 176.590 -1.642 19497
3131 1 7 . 1 1 33 33 LEU CA C 33 53.300 53.300 54.599 -1.299 19497
3132 1 7 . 1 1 33 33 LEU CB C 33 45.700 45.700 41.432 4.268 19497
3133 1 7 . 1 1 33 33 LEU H H 33 9.142 9.142 8.874 0.268 19497
3134 1 7 . 1 1 34 34 LEU N N 34 127.452 127.452 126.347 1.105 19497
3135 1 7 . 1 1 34 34 LEU C C 34 174.084 174.084 176.198 -2.114 19497
3136 1 7 . 1 1 34 34 LEU CA C 34 53.200 53.200 53.954 -0.754 19497
3137 1 7 . 1 1 34 34 LEU CB C 34 44.700 44.700 41.490 3.209 19497
3138 1 7 . 1 1 34 34 LEU H H 34 9.686 9.686 8.193 1.493 19497
3139 1 7 . 1 1 35 35 ASP N N 35 126.977 126.977 123.798 3.179 19497
3140 1 7 . 1 1 35 35 ASP C C 35 177.009 177.009 174.681 2.328 19497
3141 1 7 . 1 1 35 35 ASP CA C 35 52.600 52.600 55.166 -2.567 19497
3142 1 7 . 1 1 35 35 ASP CB C 35 41.400 41.400 42.921 -1.521 19497
3143 1 7 . 1 1 35 35 ASP H H 35 9.446 9.446 8.100 1.346 19497
3144 1 7 . 1 1 36 36 THR N N 36 118.735 118.735 114.338 4.397 19497
3145 1 7 . 1 1 36 36 THR C C 36 175.252 175.252 174.167 1.085 19497
3146 1 7 . 1 1 36 36 THR CA C 36 60.500 60.500 61.424 -0.924 19497
3147 1 7 . 1 1 36 36 THR CB C 36 68.000 68.000 71.083 -3.083 19497
3148 1 7 . 1 1 36 36 THR H H 36 8.310 8.310 7.905 0.405 19497
3149 1 7 . 1 1 37 37 TRP N N 37 122.289 122.289 122.109 0.180 19497
3150 1 7 . 1 1 37 37 TRP C C 37 177.189 177.189 176.971 0.218 19497
3151 1 7 . 1 1 37 37 TRP CA C 37 61.500 61.500 59.094 2.406 19497
3152 1 7 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.805 -1.005 19497
3153 1 7 . 1 1 37 37 TRP H H 37 9.022 9.022 8.710 0.312 19497
3154 1 7 . 1 1 38 38 ASP N N 38 117.370 117.370 117.455 -0.085 19497
3155 1 7 . 1 1 38 38 ASP C C 38 175.290 175.290 176.155 -0.865 19497
3156 1 7 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.596 -0.196 19497
3157 1 7 . 1 1 38 38 ASP CB C 38 41.100 41.100 40.550 0.550 19497
3158 1 7 . 1 1 38 38 ASP H H 38 8.518 8.518 8.057 0.461 19497
3159 1 7 . 1 1 39 39 GLN N N 39 111.522 111.522 117.042 -5.520 19497
3160 1 7 . 1 1 39 39 GLN C C 39 173.099 173.099 174.945 -1.846 19497
3161 1 7 . 1 1 39 39 GLN CA C 39 54.500 54.500 53.764 0.736 19497
3162 1 7 . 1 1 39 39 GLN CB C 39 28.900 28.900 32.563 -3.663 19497
3163 1 7 . 1 1 39 39 GLN H H 39 7.118 7.118 7.797 -0.679 19497
3164 1 7 . 1 1 40 40 ILE N N 40 121.103 121.103 120.793 0.310 19497
3165 1 7 . 1 1 40 40 ILE C C 40 174.406 174.406 174.377 0.029 19497
3166 1 7 . 1 1 40 40 ILE CA C 40 58.900 58.900 60.614 -1.714 19497
3167 1 7 . 1 1 40 40 ILE CB C 40 38.900 38.900 39.003 -0.103 19497
3168 1 7 . 1 1 40 40 ILE H H 40 8.422 8.422 8.390 0.032 19497
3169 1 7 . 1 1 41 41 PHE N N 41 123.856 123.856 126.854 -2.998 19497
3170 1 7 . 1 1 41 41 PHE C C 41 174.537 174.537 174.854 -0.317 19497
3171 1 7 . 1 1 41 41 PHE CA C 41 55.900 55.900 55.557 0.343 19497
3172 1 7 . 1 1 41 41 PHE CB C 41 42.200 42.200 42.809 -0.609 19497
3173 1 7 . 1 1 41 41 PHE H H 41 9.222 9.222 8.048 1.174 19497
3174 1 7 . 1 1 42 42 PHE N N 42 127.400 127.400 125.597 1.803 19497
3175 1 7 . 1 1 42 42 PHE C C 42 173.021 173.021 174.520 -1.499 19497
3176 1 7 . 1 1 42 42 PHE CA C 42 56.300 56.300 55.995 0.305 19497
3177 1 7 . 1 1 42 42 PHE CB C 42 42.300 42.300 39.351 2.949 19497
3178 1 7 . 1 1 42 42 PHE H H 42 9.358 9.358 8.571 0.787 19497
3179 1 7 . 1 1 43 43 TRP N N 43 129.616 129.616 124.829 4.787 19497
3180 1 7 . 1 1 43 43 TRP C C 43 174.538 174.538 175.516 -0.978 19497
3181 1 7 . 1 1 43 43 TRP CA C 43 61.600 61.600 58.158 3.442 19497
3182 1 7 . 1 1 43 43 TRP CB C 43 38.200 38.200 28.909 9.291 19497
3183 1 7 . 1 1 43 43 TRP H H 43 9.646 9.646 8.812 0.834 19497
3184 1 7 . 1 1 44 44 ILE N N 44 121.402 121.402 126.767 -5.365 19497
3185 1 7 . 1 1 44 44 ILE C C 44 175.738 175.738 175.667 0.071 19497
3186 1 7 . 1 1 44 44 ILE CA C 44 57.600 57.600 60.319 -2.720 19497
3187 1 7 . 1 1 44 44 ILE CB C 44 39.100 39.100 39.204 -0.104 19497
3188 1 7 . 1 1 44 44 ILE H H 44 7.838 7.838 7.884 -0.046 19497
3189 1 7 . 1 1 45 45 GLY N N 45 114.403 114.403 111.567 2.836 19497
3190 1 7 . 1 1 45 45 GLY C C 45 175.519 175.519 173.719 1.800 19497
3191 1 7 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.489 2.011 19497
3192 1 7 . 1 1 45 45 GLY H H 45 7.742 7.742 8.598 -0.856 19497
3193 1 7 . 1 1 46 46 LYS N N 46 123.585 123.585 119.767 3.818 19497
3194 1 7 . 1 1 46 46 LYS C C 46 177.790 177.790 178.218 -0.428 19497
3195 1 7 . 1 1 46 46 LYS CA C 46 58.700 58.700 57.911 0.789 19497
3196 1 7 . 1 1 46 46 LYS CB C 46 32.200 32.200 33.230 -1.030 19497
3197 1 7 . 1 1 46 46 LYS H H 46 8.942 8.942 8.020 0.922 19497
3198 1 7 . 1 1 47 47 GLY N N 47 107.819 107.819 106.603 1.216 19497
3199 1 7 . 1 1 47 47 GLY C C 47 174.298 174.298 173.851 0.447 19497
3200 1 7 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.520 -0.220 19497
3201 1 7 . 1 1 47 47 GLY H H 47 8.670 8.670 7.802 0.868 19497
3202 1 7 . 1 1 48 48 ALA N N 48 123.965 123.965 123.611 0.354 19497
3203 1 7 . 1 1 48 48 ALA C C 48 177.189 177.189 177.191 -0.002 19497
3204 1 7 . 1 1 48 48 ALA CA C 48 52.100 52.100 50.742 1.358 19497
3205 1 7 . 1 1 48 48 ALA CB C 48 19.000 19.000 20.161 -1.161 19497
3206 1 7 . 1 1 48 48 ALA H H 48 7.230 7.230 7.483 -0.253 19497
3207 1 7 . 1 1 49 49 ASN N N 49 119.667 119.667 117.277 2.390 19497
3208 1 7 . 1 1 49 49 ASN C C 49 175.797 175.797 176.846 -1.049 19497
3209 1 7 . 1 1 49 49 ASN CA C 49 54.200 54.200 53.313 0.887 19497
3210 1 7 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.515 1.585 19497
3211 1 7 . 1 1 49 49 ASN H H 49 8.526 8.526 8.770 -0.244 19497
3212 1 7 . 1 1 50 50 GLU N N 50 112.272 112.272 123.138 -10.866 19497
3213 1 7 . 1 1 50 50 GLU C C 50 178.128 178.128 178.632 -0.504 19497
3214 1 7 . 1 1 50 50 GLU CA C 50 59.600 59.600 59.885 -0.285 19497
3215 1 7 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.722 -0.422 19497
3216 1 7 . 1 1 50 50 GLU H H 50 7.814 7.814 9.014 -1.200 19497
3217 1 7 . 1 1 51 51 SER N N 51 113.952 113.952 115.888 -1.936 19497
3218 1 7 . 1 1 51 51 SER C C 51 177.874 177.874 176.729 1.145 19497
3219 1 7 . 1 1 51 51 SER CA C 51 61.100 61.100 61.111 -0.011 19497
3220 1 7 . 1 1 51 51 SER CB C 51 60.900 60.900 62.901 -2.001 19497
3221 1 7 . 1 1 51 51 SER H H 51 8.342 8.342 8.536 -0.194 19497
3222 1 7 . 1 1 52 52 GLU N N 52 119.930 119.930 121.737 -1.807 19497
3223 1 7 . 1 1 52 52 GLU C C 52 178.827 178.827 177.368 1.459 19497
3224 1 7 . 1 1 52 52 GLU CA C 52 57.900 57.900 59.129 -1.229 19497
3225 1 7 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.427 -0.127 19497
3226 1 7 . 1 1 52 52 GLU H H 52 7.806 7.806 8.409 -0.603 19497
3227 1 7 . 1 1 53 53 LYS N N 53 118.112 118.112 117.434 0.678 19497
3228 1 7 . 1 1 53 53 LYS C C 53 178.802 178.802 179.491 -0.689 19497
3229 1 7 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.527 1.473 19497
3230 1 7 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.791 -0.591 19497
3231 1 7 . 1 1 53 53 LYS H H 53 7.670 7.670 7.531 0.139 19497
3232 1 7 . 1 1 54 54 GLU N N 54 117.700 117.700 119.198 -1.498 19497
3233 1 7 . 1 1 54 54 GLU C C 54 177.733 177.733 177.682 0.051 19497
3234 1 7 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.356 -0.156 19497
3235 1 7 . 1 1 54 54 GLU CB C 54 29.300 29.300 29.726 -0.426 19497
3236 1 7 . 1 1 54 54 GLU H H 54 7.934 7.934 8.311 -0.377 19497
3237 1 7 . 1 1 55 55 ALA N N 55 120.395 120.395 121.341 -0.946 19497
3238 1 7 . 1 1 55 55 ALA CA C 55 52.200 52.200 51.358 0.842 19497
3239 1 7 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.622 -0.422 19497
3240 1 7 . 1 1 55 55 ALA H H 55 7.238 7.238 7.687 -0.449 19497
3241 1 7 . 1 1 56 56 ALA C C 56 177.526 177.526 177.889 -0.363 19497
3242 1 7 . 1 1 56 56 ALA CA C 56 55.600 55.600 53.958 1.642 19497
3243 1 7 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.803 0.797 19497
3244 1 7 . 1 1 57 57 ALA N N 57 117.753 117.753 119.688 -1.935 19497
3245 1 7 . 1 1 57 57 ALA C C 57 180.072 180.072 179.323 0.749 19497
3246 1 7 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.511 1.688 19497
3247 1 7 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.983 -1.583 19497
3248 1 7 . 1 1 57 57 ALA H H 57 7.990 7.990 8.087 -0.097 19497
3249 1 7 . 1 1 58 58 GLU N N 58 118.444 118.444 118.000 0.444 19497
3250 1 7 . 1 1 58 58 GLU C C 58 179.225 179.225 177.976 1.249 19497
3251 1 7 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.545 1.055 19497
3252 1 7 . 1 1 58 58 GLU CB C 58 28.900 28.900 28.969 -0.069 19497
3253 1 7 . 1 1 58 58 GLU H H 58 7.582 7.582 8.656 -1.074 19497
3254 1 7 . 1 1 59 59 THR N N 59 119.842 119.842 114.600 5.242 19497
3255 1 7 . 1 1 59 59 THR C C 59 175.781 175.781 175.727 0.054 19497
3256 1 7 . 1 1 59 59 THR CA C 59 66.200 66.200 64.713 1.487 19497
3257 1 7 . 1 1 59 59 THR CB C 59 67.600 67.600 68.218 -0.618 19497
3258 1 7 . 1 1 59 59 THR H H 59 8.422 8.422 7.693 0.729 19497
3259 1 7 . 1 1 60 60 ALA N N 60 122.454 122.454 124.220 -1.766 19497
3260 1 7 . 1 1 60 60 ALA C C 60 178.583 178.583 178.954 -0.371 19497
3261 1 7 . 1 1 60 60 ALA CA C 60 55.200 55.200 55.105 0.095 19497
3262 1 7 . 1 1 60 60 ALA CB C 60 18.100 18.100 19.163 -1.063 19497
3263 1 7 . 1 1 60 60 ALA H H 60 7.966 7.966 7.662 0.304 19497
3264 1 7 . 1 1 61 61 GLN N N 61 115.462 115.462 116.479 -1.017 19497
3265 1 7 . 1 1 61 61 GLN C C 61 178.101 178.101 177.952 0.149 19497
3266 1 7 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.340 0.560 19497
3267 1 7 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.351 -0.251 19497
3268 1 7 . 1 1 61 61 GLN H H 61 7.598 7.598 8.252 -0.654 19497
3269 1 7 . 1 1 62 62 GLU N N 62 120.883 120.883 120.875 0.008 19497
3270 1 7 . 1 1 62 62 GLU C C 62 174.071 174.071 178.505 -4.434 19497
3271 1 7 . 1 1 62 62 GLU CA C 62 54.100 54.100 58.805 -4.705 19497
3272 1 7 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.940 0.360 19497
3273 1 7 . 1 1 62 62 GLU H H 62 7.910 7.910 8.060 -0.150 19497
3274 1 7 . 1 1 63 63 TYR N N 63 118.888 118.888 120.774 -1.886 19497
3275 1 7 . 1 1 63 63 TYR C C 63 177.874 177.874 178.021 -0.147 19497
3276 1 7 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.524 0.576 19497
3277 1 7 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.695 0.805 19497
3278 1 7 . 1 1 63 63 TYR H H 63 8.182 8.182 7.926 0.256 19497
3279 1 7 . 1 1 64 64 LEU N N 64 119.930 119.930 118.517 1.413 19497
3280 1 7 . 1 1 64 64 LEU C C 64 178.536 178.536 177.586 0.950 19497
3281 1 7 . 1 1 64 64 LEU CA C 64 57.900 57.900 56.374 1.526 19497
3282 1 7 . 1 1 64 64 LEU CB C 64 38.900 38.900 42.027 -3.127 19497
3283 1 7 . 1 1 64 64 LEU H H 64 7.806 7.806 8.352 -0.546 19497
3284 1 7 . 1 1 65 65 ARG N N 65 117.322 117.322 115.942 1.380 19497
3285 1 7 . 1 1 65 65 ARG C C 65 177.436 177.436 177.786 -0.350 19497
3286 1 7 . 1 1 65 65 ARG CA C 65 58.600 58.600 57.091 1.509 19497
3287 1 7 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.863 -0.463 19497
3288 1 7 . 1 1 65 65 ARG H H 65 8.054 8.054 7.646 0.408 19497
3289 1 7 . 1 1 66 66 SER N N 66 111.783 111.783 113.828 -2.045 19497
3290 1 7 . 1 1 66 66 SER C C 66 173.652 173.652 174.442 -0.790 19497
3291 1 7 . 1 1 66 66 SER CA C 66 58.900 58.900 58.636 0.264 19497
3292 1 7 . 1 1 66 66 SER CB C 66 63.800 63.800 64.139 -0.339 19497
3293 1 7 . 1 1 66 66 SER H H 66 7.550 7.550 7.695 -0.145 19497
3294 1 7 . 1 1 67 67 HIS N N 67 124.135 124.135 123.524 0.611 19497
3295 1 7 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.925 -0.225 19497
3296 1 7 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.312 -1.112 19497
3297 1 7 . 1 1 67 67 HIS H H 67 7.134 7.134 7.524 -0.390 19497
3298 1 7 . 1 1 68 68 PRO C C 68 178.101 178.101 176.660 1.441 19497
3299 1 7 . 1 1 68 68 PRO CA C 68 58.900 58.900 62.789 -3.889 19497
3300 1 7 . 1 1 68 68 PRO CB C 68 29.900 29.900 32.379 -2.479 19497
3301 1 7 . 1 1 69 69 GLY N N 69 115.697 115.697 108.220 7.477 19497
3302 1 7 . 1 1 69 69 GLY C C 69 176.641 176.641 174.324 2.317 19497
3303 1 7 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.913 0.087 19497
3304 1 7 . 1 1 69 69 GLY H H 69 7.926 7.926 7.242 0.684 19497
3305 1 7 . 1 1 70 70 SER N N 70 115.440 115.440 113.650 1.790 19497
3306 1 7 . 1 1 70 70 SER C C 70 173.277 173.277 174.153 -0.876 19497
3307 1 7 . 1 1 70 70 SER CA C 70 58.300 58.300 58.538 -0.238 19497
3308 1 7 . 1 1 70 70 SER CB C 70 64.300 64.300 62.039 2.261 19497
3309 1 7 . 1 1 70 70 SER H H 70 8.030 8.030 8.372 -0.342 19497
3310 1 7 . 1 1 71 71 ARG N N 71 127.642 127.642 121.530 6.112 19497
3311 1 7 . 1 1 71 71 ARG C C 71 175.849 175.849 175.750 0.099 19497
3312 1 7 . 1 1 71 71 ARG CA C 71 53.900 53.900 54.824 -0.924 19497
3313 1 7 . 1 1 71 71 ARG CB C 71 30.900 30.900 31.106 -0.206 19497
3314 1 7 . 1 1 71 71 ARG H H 71 8.006 8.006 7.947 0.059 19497
3315 1 7 . 1 1 72 72 ASP N N 72 120.975 120.975 119.393 1.582 19497
3316 1 7 . 1 1 72 72 ASP C C 72 176.087 176.087 176.605 -0.518 19497
3317 1 7 . 1 1 72 72 ASP CA C 72 54.500 54.500 53.877 0.623 19497
3318 1 7 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.400 -0.500 19497
3319 1 7 . 1 1 72 72 ASP H H 72 8.182 8.182 8.553 -0.371 19497
3320 1 7 . 1 1 73 73 LEU N N 73 121.535 121.535 122.586 -1.051 19497
3321 1 7 . 1 1 73 73 LEU C C 73 177.020 177.020 176.436 0.584 19497
3322 1 7 . 1 1 73 73 LEU CA C 73 55.000 55.000 55.256 -0.256 19497
3323 1 7 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.808 0.192 19497
3324 1 7 . 1 1 73 73 LEU H H 73 8.014 8.014 8.451 -0.437 19497
3325 1 7 . 1 1 74 74 ASP N N 74 120.525 120.525 117.901 2.624 19497
3326 1 7 . 1 1 74 74 ASP C C 74 175.797 175.797 175.899 -0.102 19497
3327 1 7 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.694 0.506 19497
3328 1 7 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.568 -0.568 19497
3329 1 7 . 1 1 74 74 ASP H H 74 8.134 8.134 7.809 0.325 19497
3330 1 7 . 1 1 75 75 THR N N 75 116.656 116.656 117.486 -0.830 19497
3331 1 7 . 1 1 75 75 THR CA C 75 59.700 59.700 61.135 -1.435 19497
3332 1 7 . 1 1 75 75 THR CB C 75 69.600 69.600 68.766 0.834 19497
3333 1 7 . 1 1 75 75 THR H H 75 7.814 7.814 8.147 -0.333 19497
3334 1 7 . 1 1 76 76 PRO C C 76 174.538 174.538 175.576 -1.038 19497
3335 1 7 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.982 0.518 19497
3336 1 7 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.117 0.483 19497
3337 1 7 . 1 1 77 77 ILE N N 77 121.402 121.402 122.335 -0.933 19497
3338 1 7 . 1 1 77 77 ILE C C 77 176.132 176.132 175.403 0.729 19497
3339 1 7 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.515 -1.415 19497
3340 1 7 . 1 1 77 77 ILE CB C 77 39.000 39.000 40.330 -1.330 19497
3341 1 7 . 1 1 77 77 ILE H H 77 7.838 7.838 8.113 -0.275 19497
3342 1 7 . 1 1 78 78 ILE N N 78 130.292 130.292 127.594 2.698 19497
3343 1 7 . 1 1 78 78 ILE C C 78 175.084 175.084 174.901 0.183 19497
3344 1 7 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.257 0.643 19497
3345 1 7 . 1 1 78 78 ILE CB C 78 39.000 39.000 39.907 -0.907 19497
3346 1 7 . 1 1 78 78 ILE H H 78 8.910 8.910 8.526 0.384 19497
3347 1 7 . 1 1 79 79 VAL N N 79 129.237 129.237 126.020 3.217 19497
3348 1 7 . 1 1 79 79 VAL C C 79 175.907 175.907 175.540 0.367 19497
3349 1 7 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.663 1.537 19497
3350 1 7 . 1 1 79 79 VAL CB C 79 31.700 31.700 31.296 0.404 19497
3351 1 7 . 1 1 79 79 VAL H H 79 8.670 8.670 8.609 0.061 19497
3352 1 7 . 1 1 80 80 VAL N N 80 128.354 128.354 129.138 -0.784 19497
3353 1 7 . 1 1 80 80 VAL C C 80 172.823 172.823 174.341 -1.518 19497
3354 1 7 . 1 1 80 80 VAL CA C 80 59.400 59.400 61.330 -1.930 19497
3355 1 7 . 1 1 80 80 VAL CB C 80 32.600 32.600 35.145 -2.545 19497
3356 1 7 . 1 1 80 80 VAL H H 80 9.598 9.598 8.013 1.585 19497
3357 1 7 . 1 1 81 81 LYS N N 81 123.077 123.077 122.843 0.234 19497
3358 1 7 . 1 1 81 81 LYS C C 81 178.101 178.101 174.889 3.212 19497
3359 1 7 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.640 0.760 19497
3360 1 7 . 1 1 81 81 LYS CB C 81 34.300 34.300 35.925 -1.625 19497
3361 1 7 . 1 1 81 81 LYS H H 81 8.198 8.198 8.622 -0.424 19497
3362 1 7 . 1 1 82 82 GLN N N 82 121.436 121.436 121.656 -0.220 19497
3363 1 7 . 1 1 82 82 GLN C C 82 177.068 177.068 175.980 1.088 19497
3364 1 7 . 1 1 82 82 GLN CA C 82 56.200 56.200 57.461 -1.260 19497
3365 1 7 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.297 1.103 19497
3366 1 7 . 1 1 82 82 GLN H H 82 7.910 7.910 7.700 0.210 19497
3367 1 7 . 1 1 83 83 GLY N N 83 110.688 110.688 112.740 -2.052 19497
3368 1 7 . 1 1 83 83 GLY C C 83 173.348 173.348 174.203 -0.855 19497
3369 1 7 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.739 0.261 19497
3370 1 7 . 1 1 83 83 GLY H H 83 8.382 8.382 8.188 0.194 19497
3371 1 7 . 1 1 84 84 PHE N N 84 119.493 119.493 123.083 -3.590 19497
3372 1 7 . 1 1 84 84 PHE C C 84 175.035 175.035 173.944 1.091 19497
3373 1 7 . 1 1 84 84 PHE CA C 84 57.300 57.300 56.185 1.115 19497
3374 1 7 . 1 1 84 84 PHE CB C 84 42.200 42.200 38.591 3.609 19497
3375 1 7 . 1 1 84 84 PHE H H 84 7.910 7.910 7.377 0.533 19497
3376 1 7 . 1 1 85 85 GLU N N 85 124.672 124.672 123.760 0.912 19497
3377 1 7 . 1 1 85 85 GLU CA C 85 59.000 59.000 53.134 5.866 19497
3378 1 7 . 1 1 85 85 GLU CB C 85 29.700 29.700 30.615 -0.915 19497
3379 1 7 . 1 1 85 85 GLU H H 85 8.142 8.142 8.394 -0.252 19497
3380 1 7 . 1 1 87 87 PRO C C 87 178.284 178.284 178.726 -0.442 19497
3381 1 7 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.461 -1.361 19497
3382 1 7 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.616 -0.516 19497
3383 1 7 . 1 1 88 88 THR N N 88 106.959 106.959 111.773 -4.814 19497
3384 1 7 . 1 1 88 88 THR C C 88 174.182 174.182 177.078 -2.896 19497
3385 1 7 . 1 1 88 88 THR CA C 88 62.900 62.900 65.148 -2.248 19497
3386 1 7 . 1 1 88 88 THR CB C 88 68.000 68.000 68.548 -0.548 19497
3387 1 7 . 1 1 88 88 THR H H 88 7.110 7.110 8.232 -1.122 19497
3388 1 7 . 1 1 89 89 PHE N N 89 118.766 118.766 121.220 -2.454 19497
3389 1 7 . 1 1 89 89 PHE C C 89 175.468 175.468 177.346 -1.878 19497
3390 1 7 . 1 1 89 89 PHE CA C 89 59.800 59.800 61.664 -1.864 19497
3391 1 7 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.060 1.640 19497
3392 1 7 . 1 1 89 89 PHE H H 89 7.198 7.198 8.041 -0.843 19497
3393 1 7 . 1 1 90 90 THR N N 90 107.050 107.050 113.247 -6.197 19497
3394 1 7 . 1 1 90 90 THR C C 90 177.260 177.260 175.594 1.666 19497
3395 1 7 . 1 1 90 90 THR CA C 90 64.600 64.600 64.328 0.272 19497
3396 1 7 . 1 1 90 90 THR CB C 90 67.900 67.900 68.052 -0.152 19497
3397 1 7 . 1 1 90 90 THR H H 90 7.446 7.446 7.825 -0.379 19497
3398 1 7 . 1 1 91 91 GLY N N 91 106.738 106.738 107.630 -0.892 19497
3399 1 7 . 1 1 91 91 GLY C C 91 174.422 174.422 174.982 -0.560 19497
3400 1 7 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.520 0.480 19497
3401 1 7 . 1 1 91 91 GLY H H 91 7.646 7.646 7.249 0.397 19497
3402 1 7 . 1 1 92 92 TRP N N 92 117.500 117.500 119.792 -2.292 19497
3403 1 7 . 1 1 92 92 TRP C C 92 174.209 174.209 177.247 -3.038 19497
3404 1 7 . 1 1 92 92 TRP CA C 92 56.900 56.900 58.246 -1.346 19497
3405 1 7 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.220 0.180 19497
3406 1 7 . 1 1 92 92 TRP H H 92 6.790 6.790 6.586 0.204 19497
3407 1 7 . 1 1 93 93 PHE N N 93 119.092 119.092 115.964 3.128 19497
3408 1 7 . 1 1 93 93 PHE C C 93 175.953 175.953 176.034 -0.081 19497
3409 1 7 . 1 1 93 93 PHE CA C 93 56.700 56.700 59.137 -2.437 19497
3410 1 7 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.291 1.008 19497
3411 1 7 . 1 1 93 93 PHE H H 93 7.750 7.750 7.010 0.740 19497
3412 1 7 . 1 1 94 94 MET N N 94 121.554 121.554 120.593 0.961 19497
3413 1 7 . 1 1 94 94 MET C C 94 175.738 175.738 175.977 -0.239 19497
3414 1 7 . 1 1 94 94 MET CA C 94 57.600 57.600 56.261 1.339 19497
3415 1 7 . 1 1 94 94 MET CB C 94 32.000 32.000 34.251 -2.251 19497
3416 1 7 . 1 1 94 94 MET H H 94 8.654 8.654 8.895 -0.241 19497
3417 1 7 . 1 1 95 95 ALA N N 95 119.777 119.777 123.162 -3.385 19497
3418 1 7 . 1 1 95 95 ALA C C 95 175.441 175.441 175.908 -0.467 19497
3419 1 7 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.248 0.052 19497
3420 1 7 . 1 1 95 95 ALA CB C 95 20.700 20.700 19.101 1.599 19497
3421 1 7 . 1 1 95 95 ALA H H 95 7.750 7.750 8.076 -0.326 19497
3422 1 7 . 1 1 96 96 TRP N N 96 120.813 120.813 123.898 -3.085 19497
3423 1 7 . 1 1 96 96 TRP C C 96 175.488 175.488 174.395 1.093 19497
3424 1 7 . 1 1 96 96 TRP CA C 96 57.700 57.700 56.008 1.692 19497
3425 1 7 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.872 -0.472 19497
3426 1 7 . 1 1 96 96 TRP H H 96 8.254 8.254 8.512 -0.258 19497
3427 1 7 . 1 1 97 97 ASP N N 97 117.140 117.140 128.002 -10.862 19497
3428 1 7 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.971 2.729 19497
3429 1 7 . 1 1 97 97 ASP CB C 97 39.600 39.600 43.673 -4.073 19497
3430 1 7 . 1 1 97 97 ASP H H 97 8.958 8.958 7.893 1.065 19497
3431 1 7 . 1 1 98 98 PRO C C 98 174.071 174.071 176.507 -2.436 19497
3432 1 7 . 1 1 98 98 PRO CA C 98 63.100 63.100 63.778 -0.678 19497
3433 1 7 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.209 0.192 19497
3434 1 7 . 1 1 99 99 LEU N N 99 118.888 118.888 117.018 1.870 19497
3435 1 7 . 1 1 99 99 LEU C C 99 177.519 177.519 175.688 1.831 19497
3436 1 7 . 1 1 99 99 LEU CA C 99 54.400 54.400 53.874 0.526 19497
3437 1 7 . 1 1 99 99 LEU CB C 99 40.500 40.500 40.962 -0.462 19497
3438 1 7 . 1 1 99 99 LEU H H 99 8.182 8.182 7.482 0.700 19497
3439 1 7 . 1 1 100 100 CYS N N 100 118.788 118.788 116.560 2.228 19497
3440 1 7 . 1 1 100 100 CYS C C 100 174.685 174.685 174.230 0.455 19497
3441 1 7 . 1 1 100 100 CYS CA C 100 60.800 60.800 58.168 2.632 19497
3442 1 7 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.556 -0.156 19497
3443 1 7 . 1 1 100 100 CYS H H 100 6.862 6.862 7.332 -0.470 19497
3444 1 7 . 1 1 101 101 TRP N N 101 117.558 117.558 122.252 -4.694 19497
3445 1 7 . 1 1 101 101 TRP C C 101 176.478 176.478 175.129 1.349 19497
3446 1 7 . 1 1 101 101 TRP CA C 101 54.400 54.400 55.985 -1.585 19497
3447 1 7 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.416 -2.216 19497
3448 1 7 . 1 1 101 101 TRP H H 101 7.662 7.662 6.530 1.132 19497
3449 1 7 . 1 1 102 102 SER N N 102 115.626 115.626 114.301 1.325 19497
3450 1 7 . 1 1 102 102 SER C C 102 174.303 174.303 173.407 0.896 19497
3451 1 7 . 1 1 102 102 SER CA C 102 58.900 58.900 58.085 0.815 19497
3452 1 7 . 1 1 102 102 SER CB C 102 63.700 63.700 65.490 -1.790 19497
3453 1 7 . 1 1 102 102 SER H H 102 7.734 7.734 7.993 -0.259 19497
3454 1 7 . 1 1 103 103 ASP N N 103 121.936 121.936 120.291 1.645 19497
3455 1 7 . 1 1 103 103 ASP CA C 103 54.400 54.400 55.553 -1.153 19497
3456 1 7 . 1 1 103 103 ASP CB C 103 40.600 40.600 40.062 0.538 19497
3457 1 7 . 1 1 103 103 ASP H H 103 8.254 8.254 8.585 -0.331 19497
3458 1 7 . 1 1 104 104 ARG N N 104 120.567 120.567 119.968 0.599 19497
3459 1 7 . 1 1 104 104 ARG C C 104 176.177 176.177 176.952 -0.775 19497
3460 1 7 . 1 1 104 104 ARG CA C 104 56.000 56.000 57.486 -1.486 19497
3461 1 7 . 1 1 104 104 ARG CB C 104 30.300 30.300 30.695 -0.395 19497
3462 1 7 . 1 1 104 104 ARG H H 104 7.910 7.910 8.107 -0.197 19497
3463 1 7 . 1 1 105 105 LYS N N 105 121.805 121.805 117.332 4.473 19497
3464 1 7 . 1 1 105 105 LYS C C 105 176.141 176.141 176.737 -0.596 19497
3465 1 7 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.103 -1.003 19497
3466 1 7 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.301 -0.501 19497
3467 1 7 . 1 1 105 105 LYS H H 105 8.094 8.094 8.292 -0.198 19497
3468 1 7 . 1 1 106 106 SER N N 106 116.792 116.792 111.387 5.405 19497
3469 1 7 . 1 1 106 106 SER C C 106 172.841 172.841 173.526 -0.685 19497
3470 1 7 . 1 1 106 106 SER CA C 106 57.900 57.900 58.170 -0.270 19497
3471 1 7 . 1 1 106 106 SER CB C 106 63.800 63.800 63.596 0.204 19497
3472 1 7 . 1 1 106 106 SER H H 106 8.030 8.030 8.015 0.015 19497
3473 1 8 . 1 1 2 2 ARG N N 2 117.187 117.187 121.002 -3.815 19497
3474 1 8 . 1 1 2 2 ARG C C 2 172.315 172.315 175.098 -2.783 19497
3475 1 8 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.697 -0.598 19497
3476 1 8 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.121 -1.121 19497
3477 1 8 . 1 1 2 2 ARG H H 2 7.766 7.766 8.312 -0.546 19497
3478 1 8 . 1 1 3 3 LEU N N 3 125.426 125.426 122.010 3.416 19497
3479 1 8 . 1 1 3 3 LEU C C 3 173.996 173.996 174.757 -0.761 19497
3480 1 8 . 1 1 3 3 LEU CA C 3 52.600 52.600 54.616 -2.016 19497
3481 1 8 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.687 -1.587 19497
3482 1 8 . 1 1 3 3 LEU H H 3 8.246 8.246 8.300 -0.054 19497
3483 1 8 . 1 1 4 4 PHE N N 4 122.682 122.682 121.647 1.035 19497
3484 1 8 . 1 1 4 4 PHE C C 4 175.512 175.512 174.867 0.645 19497
3485 1 8 . 1 1 4 4 PHE CA C 4 55.700 55.700 54.778 0.922 19497
3486 1 8 . 1 1 4 4 PHE CB C 4 41.800 41.800 39.887 1.913 19497
3487 1 8 . 1 1 4 4 PHE H H 4 9.390 9.390 8.974 0.416 19497
3488 1 8 . 1 1 5 5 GLU N N 5 125.826 125.826 122.475 3.351 19497
3489 1 8 . 1 1 5 5 GLU C C 5 175.679 175.679 175.816 -0.137 19497
3490 1 8 . 1 1 5 5 GLU CA C 5 56.400 56.400 53.788 2.612 19497
3491 1 8 . 1 1 5 5 GLU CB C 5 29.400 29.400 32.270 -2.870 19497
3492 1 8 . 1 1 5 5 GLU H H 5 9.190 9.190 8.934 0.256 19497
3493 1 8 . 1 1 6 6 CYS N N 6 121.540 121.540 123.570 -2.030 19497
3494 1 8 . 1 1 6 6 CYS C C 6 175.738 175.738 174.638 1.100 19497
3495 1 8 . 1 1 6 6 CYS CA C 6 56.100 56.100 58.065 -1.965 19497
3496 1 8 . 1 1 6 6 CYS CB C 6 28.200 28.200 28.454 -0.254 19497
3497 1 8 . 1 1 6 6 CYS H H 6 8.158 8.158 8.742 -0.584 19497
3498 1 8 . 1 1 7 7 SER N N 7 116.299 116.299 119.768 -3.469 19497
3499 1 8 . 1 1 7 7 SER C C 7 173.277 173.277 173.260 0.017 19497
3500 1 8 . 1 1 7 7 SER CA C 7 58.300 58.300 57.590 0.710 19497
3501 1 8 . 1 1 7 7 SER CB C 7 64.300 64.300 64.099 0.201 19497
3502 1 8 . 1 1 7 7 SER H H 7 7.734 7.734 8.453 -0.719 19497
3503 1 8 . 1 1 8 8 ASN N N 8 127.642 127.642 124.745 2.897 19497
3504 1 8 . 1 1 8 8 ASN C C 8 177.812 177.812 174.253 3.559 19497
3505 1 8 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.195 2.705 19497
3506 1 8 . 1 1 8 8 ASN CB C 8 39.200 39.200 40.299 -1.099 19497
3507 1 8 . 1 1 8 8 ASN H H 8 8.006 8.006 8.702 -0.696 19497
3508 1 8 . 1 1 9 9 LYS N N 9 122.472 122.472 119.487 2.985 19497
3509 1 8 . 1 1 9 9 LYS C C 9 177.932 177.932 177.079 0.853 19497
3510 1 8 . 1 1 9 9 LYS CA C 9 59.300 59.300 55.531 3.769 19497
3511 1 8 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.558 -1.158 19497
3512 1 8 . 1 1 9 9 LYS H H 9 8.350 8.350 8.071 0.279 19497
3513 1 8 . 1 1 10 10 THR N N 10 109.478 109.478 115.704 -6.226 19497
3514 1 8 . 1 1 10 10 THR C C 10 175.241 175.241 174.859 0.382 19497
3515 1 8 . 1 1 10 10 THR CA C 10 62.400 62.400 62.035 0.365 19497
3516 1 8 . 1 1 10 10 THR CB C 10 69.700 69.700 68.641 1.059 19497
3517 1 8 . 1 1 10 10 THR H H 10 8.486 8.486 8.288 0.198 19497
3518 1 8 . 1 1 11 11 GLY N N 11 110.146 110.146 110.251 -0.105 19497
3519 1 8 . 1 1 11 11 GLY C C 11 172.717 172.717 174.483 -1.766 19497
3520 1 8 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.642 0.058 19497
3521 1 8 . 1 1 11 11 GLY H H 11 8.014 8.014 7.718 0.296 19497
3522 1 8 . 1 1 12 12 ARG N N 12 117.911 117.911 119.099 -1.188 19497
3523 1 8 . 1 1 12 12 ARG C C 12 173.660 173.660 175.133 -1.473 19497
3524 1 8 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.545 -1.745 19497
3525 1 8 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.166 3.234 19497
3526 1 8 . 1 1 12 12 ARG H H 12 7.342 7.342 8.541 -1.199 19497
3527 1 8 . 1 1 13 13 PHE N N 13 122.082 122.082 120.030 2.052 19497
3528 1 8 . 1 1 13 13 PHE C C 13 174.525 174.525 174.737 -0.212 19497
3529 1 8 . 1 1 13 13 PHE CA C 13 58.700 58.700 54.871 3.829 19497
3530 1 8 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.865 0.035 19497
3531 1 8 . 1 1 13 13 PHE H H 13 8.462 8.462 7.975 0.487 19497
3532 1 8 . 1 1 14 14 LEU N N 14 129.559 129.559 122.555 7.004 19497
3533 1 8 . 1 1 14 14 LEU C C 14 174.071 174.071 175.493 -1.422 19497
3534 1 8 . 1 1 14 14 LEU CA C 14 54.100 54.100 53.978 0.122 19497
3535 1 8 . 1 1 14 14 LEU CB C 14 45.500 45.500 42.984 2.516 19497
3536 1 8 . 1 1 14 14 LEU H H 14 8.054 8.054 7.564 0.490 19497
3537 1 8 . 1 1 15 15 ALA N N 15 126.873 126.873 129.638 -2.765 19497
3538 1 8 . 1 1 15 15 ALA C C 15 176.826 176.826 175.511 1.315 19497
3539 1 8 . 1 1 15 15 ALA CA C 15 49.900 49.900 51.039 -1.139 19497
3540 1 8 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.641 -1.341 19497
3541 1 8 . 1 1 15 15 ALA H H 15 8.190 8.190 8.306 -0.116 19497
3542 1 8 . 1 1 16 16 THR N N 16 120.557 120.557 116.784 3.773 19497
3543 1 8 . 1 1 16 16 THR C C 16 173.449 173.449 174.227 -0.778 19497
3544 1 8 . 1 1 16 16 THR CA C 16 61.500 61.500 61.765 -0.265 19497
3545 1 8 . 1 1 16 16 THR CB C 16 70.500 70.500 69.412 1.088 19497
3546 1 8 . 1 1 16 16 THR H H 16 9.014 9.014 8.254 0.760 19497
3547 1 8 . 1 1 17 17 GLU N N 17 129.862 129.862 127.303 2.559 19497
3548 1 8 . 1 1 17 17 GLU C C 17 175.703 175.703 176.054 -0.351 19497
3549 1 8 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.745 1.155 19497
3550 1 8 . 1 1 17 17 GLU CB C 17 29.200 29.200 30.632 -1.432 19497
3551 1 8 . 1 1 17 17 GLU H H 17 9.118 9.118 8.444 0.674 19497
3552 1 8 . 1 1 18 18 ILE N N 18 128.992 128.992 119.020 9.972 19497
3553 1 8 . 1 1 18 18 ILE C C 18 175.994 175.994 175.519 0.475 19497
3554 1 8 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.439 -0.839 19497
3555 1 8 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.809 -1.509 19497
3556 1 8 . 1 1 18 18 ILE H H 18 8.686 8.686 8.095 0.591 19497
3557 1 8 . 1 1 19 19 VAL N N 19 127.812 127.812 117.148 10.664 19497
3558 1 8 . 1 1 19 19 VAL C C 19 175.611 175.611 175.554 0.057 19497
3559 1 8 . 1 1 19 19 VAL CA C 19 62.700 62.700 63.052 -0.352 19497
3560 1 8 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.132 0.868 19497
3561 1 8 . 1 1 19 19 VAL H H 19 8.422 8.422 8.074 0.348 19497
3562 1 8 . 1 1 20 20 ASP N N 20 123.008 123.008 121.973 1.035 19497
3563 1 8 . 1 1 20 20 ASP C C 20 175.669 175.669 174.801 0.868 19497
3564 1 8 . 1 1 20 20 ASP CA C 20 54.900 54.900 53.309 1.591 19497
3565 1 8 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.796 -3.296 19497
3566 1 8 . 1 1 20 20 ASP H H 20 8.894 8.894 8.083 0.811 19497
3567 1 8 . 1 1 21 21 PHE N N 21 112.724 112.724 120.788 -8.064 19497
3568 1 8 . 1 1 21 21 PHE C C 21 174.706 174.706 175.466 -0.760 19497
3569 1 8 . 1 1 21 21 PHE CA C 21 56.200 56.200 57.862 -1.663 19497
3570 1 8 . 1 1 21 21 PHE CB C 21 41.000 41.000 38.622 2.378 19497
3571 1 8 . 1 1 21 21 PHE H H 21 6.261 6.261 7.843 -1.582 19497
3572 1 8 . 1 1 22 22 THR N N 22 112.022 112.022 113.744 -1.722 19497
3573 1 8 . 1 1 22 22 THR C C 22 175.111 175.111 174.262 0.849 19497
3574 1 8 . 1 1 22 22 THR CA C 22 60.100 60.100 61.583 -1.483 19497
3575 1 8 . 1 1 22 22 THR H H 22 9.422 9.422 8.237 1.185 19497
3576 1 8 . 1 1 23 23 GLN N N 23 122.305 122.305 121.059 1.246 19497
3577 1 8 . 1 1 23 23 GLN C C 23 176.564 176.564 176.980 -0.416 19497
3578 1 8 . 1 1 23 23 GLN CA C 23 58.600 58.600 58.111 0.489 19497
3579 1 8 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.636 -1.736 19497
3580 1 8 . 1 1 23 23 GLN H H 23 9.470 9.470 9.019 0.451 19497
3581 1 8 . 1 1 24 24 ASP N N 24 114.251 114.251 120.229 -5.978 19497
3582 1 8 . 1 1 24 24 ASP C C 24 174.839 174.839 177.363 -2.524 19497
3583 1 8 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.719 -1.019 19497
3584 1 8 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.678 -0.178 19497
3585 1 8 . 1 1 24 24 ASP H H 24 7.534 7.534 8.873 -1.339 19497
3586 1 8 . 1 1 25 25 ASP N N 25 116.046 116.046 118.293 -2.247 19497
3587 1 8 . 1 1 25 25 ASP C C 25 176.087 176.087 175.813 0.274 19497
3588 1 8 . 1 1 25 25 ASP CA C 25 54.500 54.500 55.160 -0.660 19497
3589 1 8 . 1 1 25 25 ASP CB C 25 40.600 40.600 41.522 -0.922 19497
3590 1 8 . 1 1 25 25 ASP H H 25 7.454 7.454 7.864 -0.410 19497
3591 1 8 . 1 1 26 26 LEU N N 26 121.535 121.535 121.436 0.099 19497
3592 1 8 . 1 1 26 26 LEU C C 26 176.343 176.343 175.138 1.205 19497
3593 1 8 . 1 1 26 26 LEU CA C 26 55.000 55.000 54.060 0.940 19497
3594 1 8 . 1 1 26 26 LEU CB C 26 41.300 41.300 42.529 -1.229 19497
3595 1 8 . 1 1 26 26 LEU H H 26 8.014 8.014 7.528 0.486 19497
3596 1 8 . 1 1 27 27 ASP N N 27 127.804 127.804 124.075 3.729 19497
3597 1 8 . 1 1 27 27 ASP C C 27 176.947 176.947 177.150 -0.203 19497
3598 1 8 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.276 0.724 19497
3599 1 8 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.298 1.102 19497
3600 1 8 . 1 1 27 27 ASP H H 27 8.326 8.326 8.355 -0.029 19497
3601 1 8 . 1 1 28 28 GLU N N 28 123.641 123.641 122.018 1.623 19497
3602 1 8 . 1 1 28 28 GLU C C 28 176.141 176.141 176.479 -0.338 19497
3603 1 8 . 1 1 28 28 GLU CA C 28 54.500 54.500 59.639 -5.139 19497
3604 1 8 . 1 1 28 28 GLU CB C 28 32.700 32.700 30.129 2.571 19497
3605 1 8 . 1 1 28 28 GLU H H 28 8.278 8.278 8.908 -0.630 19497
3606 1 8 . 1 1 29 29 ASN N N 29 120.901 120.901 116.553 4.348 19497
3607 1 8 . 1 1 29 29 ASN C C 29 174.383 174.383 174.198 0.185 19497
3608 1 8 . 1 1 29 29 ASN CA C 29 57.300 57.300 53.185 4.115 19497
3609 1 8 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.109 0.191 19497
3610 1 8 . 1 1 29 29 ASN H H 29 8.022 8.022 8.336 -0.314 19497
3611 1 8 . 1 1 30 30 ASP N N 30 125.016 125.016 119.528 5.488 19497
3612 1 8 . 1 1 30 30 ASP C C 30 175.679 175.679 173.985 1.694 19497
3613 1 8 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.272 -0.972 19497
3614 1 8 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.475 -3.475 19497
3615 1 8 . 1 1 30 30 ASP H H 30 8.142 8.142 7.556 0.586 19497
3616 1 8 . 1 1 31 31 VAL N N 31 121.540 121.540 120.221 1.319 19497
3617 1 8 . 1 1 31 31 VAL C C 31 175.675 175.675 174.911 0.764 19497
3618 1 8 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.570 0.430 19497
3619 1 8 . 1 1 31 31 VAL CB C 31 32.800 32.800 32.932 -0.132 19497
3620 1 8 . 1 1 31 31 VAL H H 31 8.158 8.158 8.433 -0.275 19497
3621 1 8 . 1 1 32 32 TYR N N 32 126.116 126.116 126.363 -0.247 19497
3622 1 8 . 1 1 32 32 TYR C C 32 173.449 173.449 174.519 -1.070 19497
3623 1 8 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.194 -0.194 19497
3624 1 8 . 1 1 32 32 TYR H H 32 8.294 8.294 8.725 -0.431 19497
3625 1 8 . 1 1 33 33 LEU N N 33 121.235 121.235 120.215 1.020 19497
3626 1 8 . 1 1 33 33 LEU C C 33 174.948 174.948 175.950 -1.002 19497
3627 1 8 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.521 -0.221 19497
3628 1 8 . 1 1 33 33 LEU CB C 33 45.700 45.700 43.092 2.608 19497
3629 1 8 . 1 1 33 33 LEU H H 33 9.142 9.142 8.962 0.180 19497
3630 1 8 . 1 1 34 34 LEU N N 34 127.452 127.452 125.926 1.526 19497
3631 1 8 . 1 1 34 34 LEU C C 34 174.084 174.084 175.413 -1.329 19497
3632 1 8 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.027 -0.827 19497
3633 1 8 . 1 1 34 34 LEU CB C 34 44.700 44.700 41.661 3.039 19497
3634 1 8 . 1 1 34 34 LEU H H 34 9.686 9.686 8.276 1.410 19497
3635 1 8 . 1 1 35 35 ASP N N 35 126.977 126.977 125.248 1.729 19497
3636 1 8 . 1 1 35 35 ASP C C 35 177.009 177.009 175.225 1.784 19497
3637 1 8 . 1 1 35 35 ASP CA C 35 52.600 52.600 54.862 -2.262 19497
3638 1 8 . 1 1 35 35 ASP CB C 35 41.400 41.400 42.585 -1.185 19497
3639 1 8 . 1 1 35 35 ASP H H 35 9.446 9.446 7.890 1.556 19497
3640 1 8 . 1 1 36 36 THR N N 36 118.735 118.735 119.314 -0.579 19497
3641 1 8 . 1 1 36 36 THR C C 36 175.252 175.252 175.760 -0.508 19497
3642 1 8 . 1 1 36 36 THR CA C 36 60.500 60.500 60.069 0.431 19497
3643 1 8 . 1 1 36 36 THR CB C 36 68.000 68.000 70.965 -2.965 19497
3644 1 8 . 1 1 36 36 THR H H 36 8.310 8.310 8.250 0.060 19497
3645 1 8 . 1 1 37 37 TRP N N 37 122.289 122.289 124.043 -1.754 19497
3646 1 8 . 1 1 37 37 TRP C C 37 177.189 177.189 175.212 1.977 19497
3647 1 8 . 1 1 37 37 TRP CA C 37 61.500 61.500 60.009 1.491 19497
3648 1 8 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.369 -0.570 19497
3649 1 8 . 1 1 37 37 TRP H H 37 9.022 9.022 8.782 0.240 19497
3650 1 8 . 1 1 38 38 ASP N N 38 117.370 117.370 113.601 3.769 19497
3651 1 8 . 1 1 38 38 ASP C C 38 175.290 175.290 175.640 -0.350 19497
3652 1 8 . 1 1 38 38 ASP CA C 38 55.400 55.400 53.885 1.515 19497
3653 1 8 . 1 1 38 38 ASP CB C 38 41.100 41.100 41.063 0.037 19497
3654 1 8 . 1 1 38 38 ASP H H 38 8.518 8.518 7.931 0.587 19497
3655 1 8 . 1 1 39 39 GLN N N 39 111.522 111.522 118.989 -7.467 19497
3656 1 8 . 1 1 39 39 GLN C C 39 173.099 173.099 173.489 -0.390 19497
3657 1 8 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.618 -1.118 19497
3658 1 8 . 1 1 39 39 GLN CB C 39 28.900 28.900 32.352 -3.452 19497
3659 1 8 . 1 1 39 39 GLN H H 39 7.118 7.118 7.241 -0.123 19497
3660 1 8 . 1 1 40 40 ILE N N 40 121.103 121.103 124.817 -3.714 19497
3661 1 8 . 1 1 40 40 ILE C C 40 174.406 174.406 173.967 0.439 19497
3662 1 8 . 1 1 40 40 ILE CA C 40 58.900 58.900 60.116 -1.216 19497
3663 1 8 . 1 1 40 40 ILE CB C 40 38.900 38.900 40.436 -1.536 19497
3664 1 8 . 1 1 40 40 ILE H H 40 8.422 8.422 8.293 0.129 19497
3665 1 8 . 1 1 41 41 PHE N N 41 123.856 123.856 126.813 -2.957 19497
3666 1 8 . 1 1 41 41 PHE C C 41 174.537 174.537 175.124 -0.587 19497
3667 1 8 . 1 1 41 41 PHE CA C 41 55.900 55.900 57.090 -1.190 19497
3668 1 8 . 1 1 41 41 PHE CB C 41 42.200 42.200 40.496 1.704 19497
3669 1 8 . 1 1 41 41 PHE H H 41 9.222 9.222 7.956 1.266 19497
3670 1 8 . 1 1 42 42 PHE N N 42 127.400 127.400 123.390 4.010 19497
3671 1 8 . 1 1 42 42 PHE C C 42 173.021 173.021 174.638 -1.617 19497
3672 1 8 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.739 -0.439 19497
3673 1 8 . 1 1 42 42 PHE CB C 42 42.300 42.300 40.199 2.101 19497
3674 1 8 . 1 1 42 42 PHE H H 42 9.358 9.358 9.030 0.328 19497
3675 1 8 . 1 1 43 43 TRP N N 43 129.616 129.616 127.704 1.912 19497
3676 1 8 . 1 1 43 43 TRP C C 43 174.538 174.538 174.733 -0.195 19497
3677 1 8 . 1 1 43 43 TRP CA C 43 61.600 61.600 57.610 3.990 19497
3678 1 8 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.828 7.372 19497
3679 1 8 . 1 1 43 43 TRP H H 43 9.646 9.646 8.968 0.678 19497
3680 1 8 . 1 1 44 44 ILE N N 44 121.402 121.402 128.319 -6.917 19497
3681 1 8 . 1 1 44 44 ILE C C 44 175.738 175.738 174.711 1.027 19497
3682 1 8 . 1 1 44 44 ILE CA C 44 57.600 57.600 59.510 -1.910 19497
3683 1 8 . 1 1 44 44 ILE CB C 44 39.100 39.100 38.924 0.176 19497
3684 1 8 . 1 1 44 44 ILE H H 44 7.838 7.838 8.515 -0.677 19497
3685 1 8 . 1 1 45 45 GLY N N 45 114.403 114.403 111.160 3.243 19497
3686 1 8 . 1 1 45 45 GLY C C 45 175.519 175.519 174.365 1.154 19497
3687 1 8 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.337 2.163 19497
3688 1 8 . 1 1 45 45 GLY H H 45 7.742 7.742 7.985 -0.243 19497
3689 1 8 . 1 1 46 46 LYS N N 46 123.585 123.585 123.136 0.449 19497
3690 1 8 . 1 1 46 46 LYS C C 46 177.790 177.790 178.276 -0.486 19497
3691 1 8 . 1 1 46 46 LYS CA C 46 58.700 58.700 58.853 -0.153 19497
3692 1 8 . 1 1 46 46 LYS CB C 46 32.200 32.200 32.493 -0.293 19497
3693 1 8 . 1 1 46 46 LYS H H 46 8.942 8.942 8.097 0.845 19497
3694 1 8 . 1 1 47 47 GLY N N 47 107.819 107.819 106.739 1.080 19497
3695 1 8 . 1 1 47 47 GLY C C 47 174.298 174.298 174.880 -0.582 19497
3696 1 8 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.979 -0.679 19497
3697 1 8 . 1 1 47 47 GLY H H 47 8.670 8.670 7.616 1.054 19497
3698 1 8 . 1 1 48 48 ALA N N 48 123.965 123.965 123.464 0.501 19497
3699 1 8 . 1 1 48 48 ALA C C 48 177.189 177.189 176.933 0.256 19497
3700 1 8 . 1 1 48 48 ALA CA C 48 52.100 52.100 52.688 -0.588 19497
3701 1 8 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.435 -0.435 19497
3702 1 8 . 1 1 48 48 ALA H H 48 7.230 7.230 7.281 -0.051 19497
3703 1 8 . 1 1 49 49 ASN N N 49 119.667 119.667 118.604 1.063 19497
3704 1 8 . 1 1 49 49 ASN C C 49 175.797 175.797 176.607 -0.810 19497
3705 1 8 . 1 1 49 49 ASN CA C 49 54.200 54.200 52.865 1.335 19497
3706 1 8 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.641 1.459 19497
3707 1 8 . 1 1 49 49 ASN H H 49 8.526 8.526 8.568 -0.042 19497
3708 1 8 . 1 1 50 50 GLU N N 50 112.272 112.272 123.544 -11.272 19497
3709 1 8 . 1 1 50 50 GLU C C 50 178.128 178.128 178.362 -0.234 19497
3710 1 8 . 1 1 50 50 GLU CA C 50 59.600 59.600 59.876 -0.276 19497
3711 1 8 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.604 -0.304 19497
3712 1 8 . 1 1 50 50 GLU H H 50 7.814 7.814 8.938 -1.124 19497
3713 1 8 . 1 1 51 51 SER N N 51 113.952 113.952 115.050 -1.098 19497
3714 1 8 . 1 1 51 51 SER C C 51 177.874 177.874 176.407 1.467 19497
3715 1 8 . 1 1 51 51 SER CA C 51 61.100 61.100 61.156 -0.056 19497
3716 1 8 . 1 1 51 51 SER CB C 51 60.900 60.900 63.033 -2.133 19497
3717 1 8 . 1 1 51 51 SER H H 51 8.342 8.342 8.070 0.272 19497
3718 1 8 . 1 1 52 52 GLU N N 52 119.930 119.930 120.127 -0.197 19497
3719 1 8 . 1 1 52 52 GLU C C 52 178.827 178.827 177.123 1.704 19497
3720 1 8 . 1 1 52 52 GLU CA C 52 57.900 57.900 57.882 0.018 19497
3721 1 8 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.390 -0.090 19497
3722 1 8 . 1 1 52 52 GLU H H 52 7.806 7.806 8.545 -0.739 19497
3723 1 8 . 1 1 53 53 LYS N N 53 118.112 118.112 118.523 -0.411 19497
3724 1 8 . 1 1 53 53 LYS C C 53 178.802 178.802 178.493 0.309 19497
3725 1 8 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.052 1.948 19497
3726 1 8 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.852 -0.652 19497
3727 1 8 . 1 1 53 53 LYS H H 53 7.670 7.670 7.497 0.173 19497
3728 1 8 . 1 1 54 54 GLU N N 54 117.700 117.700 119.660 -1.960 19497
3729 1 8 . 1 1 54 54 GLU C C 54 177.733 177.733 177.059 0.674 19497
3730 1 8 . 1 1 54 54 GLU CA C 54 58.200 58.200 57.439 0.761 19497
3731 1 8 . 1 1 54 54 GLU CB C 54 29.300 29.300 30.301 -1.001 19497
3732 1 8 . 1 1 54 54 GLU H H 54 7.934 7.934 8.177 -0.243 19497
3733 1 8 . 1 1 55 55 ALA N N 55 120.395 120.395 122.355 -1.960 19497
3734 1 8 . 1 1 55 55 ALA CA C 55 52.200 52.200 50.725 1.475 19497
3735 1 8 . 1 1 55 55 ALA CB C 55 17.200 17.200 18.076 -0.876 19497
3736 1 8 . 1 1 55 55 ALA H H 55 7.238 7.238 7.639 -0.401 19497
3737 1 8 . 1 1 56 56 ALA C C 56 177.526 177.526 178.310 -0.784 19497
3738 1 8 . 1 1 56 56 ALA CA C 56 55.600 55.600 53.851 1.749 19497
3739 1 8 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.906 0.694 19497
3740 1 8 . 1 1 57 57 ALA N N 57 117.753 117.753 120.593 -2.840 19497
3741 1 8 . 1 1 57 57 ALA C C 57 180.072 180.072 178.975 1.097 19497
3742 1 8 . 1 1 57 57 ALA CA C 57 55.200 55.200 54.447 0.753 19497
3743 1 8 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.231 -0.831 19497
3744 1 8 . 1 1 57 57 ALA H H 57 7.990 7.990 8.182 -0.192 19497
3745 1 8 . 1 1 58 58 GLU N N 58 118.444 118.444 117.388 1.056 19497
3746 1 8 . 1 1 58 58 GLU C C 58 179.225 179.225 178.755 0.470 19497
3747 1 8 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.428 1.172 19497
3748 1 8 . 1 1 58 58 GLU CB C 58 28.900 28.900 28.894 0.006 19497
3749 1 8 . 1 1 58 58 GLU H H 58 7.582 7.582 8.166 -0.584 19497
3750 1 8 . 1 1 59 59 THR N N 59 119.842 119.842 117.081 2.761 19497
3751 1 8 . 1 1 59 59 THR C C 59 175.781 175.781 176.069 -0.288 19497
3752 1 8 . 1 1 59 59 THR CA C 59 66.200 66.200 66.222 -0.021 19497
3753 1 8 . 1 1 59 59 THR CB C 59 67.600 67.600 68.062 -0.462 19497
3754 1 8 . 1 1 59 59 THR H H 59 8.422 8.422 7.591 0.831 19497
3755 1 8 . 1 1 60 60 ALA N N 60 122.454 122.454 123.369 -0.915 19497
3756 1 8 . 1 1 60 60 ALA C C 60 178.583 178.583 179.223 -0.640 19497
3757 1 8 . 1 1 60 60 ALA CA C 60 55.200 55.200 55.068 0.133 19497
3758 1 8 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.837 0.263 19497
3759 1 8 . 1 1 60 60 ALA H H 60 7.966 7.966 7.494 0.472 19497
3760 1 8 . 1 1 61 61 GLN N N 61 115.462 115.462 116.411 -0.949 19497
3761 1 8 . 1 1 61 61 GLN C C 61 178.101 178.101 178.369 -0.268 19497
3762 1 8 . 1 1 61 61 GLN CA C 61 58.900 58.900 57.714 1.186 19497
3763 1 8 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.412 -0.312 19497
3764 1 8 . 1 1 61 61 GLN H H 61 7.598 7.598 7.945 -0.347 19497
3765 1 8 . 1 1 62 62 GLU N N 62 120.883 120.883 121.956 -1.073 19497
3766 1 8 . 1 1 62 62 GLU C C 62 174.071 174.071 178.933 -4.862 19497
3767 1 8 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.753 -5.653 19497
3768 1 8 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.683 0.617 19497
3769 1 8 . 1 1 62 62 GLU H H 62 7.910 7.910 8.175 -0.265 19497
3770 1 8 . 1 1 63 63 TYR N N 63 118.888 118.888 119.848 -0.960 19497
3771 1 8 . 1 1 63 63 TYR C C 63 177.874 177.874 177.830 0.044 19497
3772 1 8 . 1 1 63 63 TYR CA C 63 61.100 61.100 59.748 1.352 19497
3773 1 8 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.625 0.875 19497
3774 1 8 . 1 1 63 63 TYR H H 63 8.182 8.182 7.533 0.649 19497
3775 1 8 . 1 1 64 64 LEU N N 64 119.930 119.930 119.460 0.470 19497
3776 1 8 . 1 1 64 64 LEU C C 64 178.536 178.536 177.974 0.562 19497
3777 1 8 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.334 0.566 19497
3778 1 8 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.798 -2.898 19497
3779 1 8 . 1 1 64 64 LEU H H 64 7.806 7.806 8.227 -0.421 19497
3780 1 8 . 1 1 65 65 ARG N N 65 117.322 117.322 115.547 1.775 19497
3781 1 8 . 1 1 65 65 ARG C C 65 177.436 177.436 177.466 -0.030 19497
3782 1 8 . 1 1 65 65 ARG CA C 65 58.600 58.600 57.529 1.071 19497
3783 1 8 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.436 -0.036 19497
3784 1 8 . 1 1 65 65 ARG H H 65 8.054 8.054 7.544 0.510 19497
3785 1 8 . 1 1 66 66 SER N N 66 111.783 111.783 113.449 -1.666 19497
3786 1 8 . 1 1 66 66 SER C C 66 173.652 173.652 175.008 -1.356 19497
3787 1 8 . 1 1 66 66 SER CA C 66 58.900 58.900 60.152 -1.252 19497
3788 1 8 . 1 1 66 66 SER CB C 66 63.800 63.800 63.681 0.119 19497
3789 1 8 . 1 1 66 66 SER H H 66 7.550 7.550 7.454 0.096 19497
3790 1 8 . 1 1 67 67 HIS N N 67 124.135 124.135 123.966 0.169 19497
3791 1 8 . 1 1 67 67 HIS CA C 67 55.700 55.700 56.089 -0.389 19497
3792 1 8 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.394 -1.194 19497
3793 1 8 . 1 1 67 67 HIS H H 67 7.134 7.134 7.743 -0.609 19497
3794 1 8 . 1 1 68 68 PRO C C 68 178.101 178.101 176.689 1.412 19497
3795 1 8 . 1 1 68 68 PRO CA C 68 58.900 58.900 64.124 -5.224 19497
3796 1 8 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.703 -1.803 19497
3797 1 8 . 1 1 69 69 GLY N N 69 115.697 115.697 105.477 10.220 19497
3798 1 8 . 1 1 69 69 GLY C C 69 176.641 176.641 174.302 2.339 19497
3799 1 8 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.478 0.522 19497
3800 1 8 . 1 1 69 69 GLY H H 69 7.926 7.926 6.951 0.975 19497
3801 1 8 . 1 1 70 70 SER N N 70 115.440 115.440 115.086 0.354 19497
3802 1 8 . 1 1 70 70 SER C C 70 173.277 173.277 174.204 -0.927 19497
3803 1 8 . 1 1 70 70 SER CA C 70 58.300 58.300 58.814 -0.514 19497
3804 1 8 . 1 1 70 70 SER CB C 70 64.300 64.300 61.980 2.320 19497
3805 1 8 . 1 1 70 70 SER H H 70 8.030 8.030 7.924 0.106 19497
3806 1 8 . 1 1 71 71 ARG N N 71 127.642 127.642 119.605 8.037 19497
3807 1 8 . 1 1 71 71 ARG C C 71 175.849 175.849 175.891 -0.042 19497
3808 1 8 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.822 -1.922 19497
3809 1 8 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.337 0.562 19497
3810 1 8 . 1 1 71 71 ARG H H 71 8.006 8.006 8.074 -0.068 19497
3811 1 8 . 1 1 72 72 ASP N N 72 120.975 120.975 119.490 1.485 19497
3812 1 8 . 1 1 72 72 ASP C C 72 176.087 176.087 174.755 1.332 19497
3813 1 8 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.717 -0.217 19497
3814 1 8 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.569 -0.669 19497
3815 1 8 . 1 1 72 72 ASP H H 72 8.182 8.182 8.415 -0.233 19497
3816 1 8 . 1 1 73 73 LEU N N 73 121.535 121.535 122.462 -0.927 19497
3817 1 8 . 1 1 73 73 LEU C C 73 177.020 177.020 176.185 0.835 19497
3818 1 8 . 1 1 73 73 LEU CA C 73 55.000 55.000 53.456 1.544 19497
3819 1 8 . 1 1 73 73 LEU CB C 73 42.000 42.000 42.155 -0.155 19497
3820 1 8 . 1 1 73 73 LEU H H 73 8.014 8.014 8.202 -0.188 19497
3821 1 8 . 1 1 74 74 ASP N N 74 120.525 120.525 119.397 1.128 19497
3822 1 8 . 1 1 74 74 ASP C C 74 175.797 175.797 175.567 0.230 19497
3823 1 8 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.752 0.448 19497
3824 1 8 . 1 1 74 74 ASP CB C 74 41.000 41.000 40.493 0.507 19497
3825 1 8 . 1 1 74 74 ASP H H 74 8.134 8.134 8.030 0.104 19497
3826 1 8 . 1 1 75 75 THR N N 75 116.656 116.656 116.436 0.220 19497
3827 1 8 . 1 1 75 75 THR CA C 75 59.700 59.700 59.609 0.091 19497
3828 1 8 . 1 1 75 75 THR CB C 75 69.600 69.600 69.277 0.323 19497
3829 1 8 . 1 1 75 75 THR H H 75 7.814 7.814 7.913 -0.099 19497
3830 1 8 . 1 1 76 76 PRO C C 76 174.538 174.538 175.728 -1.190 19497
3831 1 8 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.474 1.026 19497
3832 1 8 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.110 0.490 19497
3833 1 8 . 1 1 77 77 ILE N N 77 121.402 121.402 123.429 -2.027 19497
3834 1 8 . 1 1 77 77 ILE C C 77 176.132 176.132 175.450 0.682 19497
3835 1 8 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.775 -1.675 19497
3836 1 8 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.785 -0.785 19497
3837 1 8 . 1 1 77 77 ILE H H 77 7.838 7.838 8.172 -0.334 19497
3838 1 8 . 1 1 78 78 ILE N N 78 130.292 130.292 125.550 4.742 19497
3839 1 8 . 1 1 78 78 ILE C C 78 175.084 175.084 174.428 0.656 19497
3840 1 8 . 1 1 78 78 ILE CA C 78 59.900 59.900 60.435 -0.535 19497
3841 1 8 . 1 1 78 78 ILE CB C 78 39.000 39.000 40.833 -1.833 19497
3842 1 8 . 1 1 78 78 ILE H H 78 8.910 8.910 8.851 0.059 19497
3843 1 8 . 1 1 79 79 VAL N N 79 129.237 129.237 126.353 2.884 19497
3844 1 8 . 1 1 79 79 VAL C C 79 175.907 175.907 175.406 0.501 19497
3845 1 8 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.870 1.330 19497
3846 1 8 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.539 -0.839 19497
3847 1 8 . 1 1 79 79 VAL H H 79 8.670 8.670 8.354 0.316 19497
3848 1 8 . 1 1 80 80 VAL N N 80 128.354 128.354 127.521 0.833 19497
3849 1 8 . 1 1 80 80 VAL C C 80 172.823 172.823 174.490 -1.667 19497
3850 1 8 . 1 1 80 80 VAL CA C 80 59.400 59.400 60.791 -1.391 19497
3851 1 8 . 1 1 80 80 VAL CB C 80 32.600 32.600 34.917 -2.317 19497
3852 1 8 . 1 1 80 80 VAL H H 80 9.598 9.598 8.694 0.904 19497
3853 1 8 . 1 1 81 81 LYS N N 81 123.077 123.077 123.088 -0.011 19497
3854 1 8 . 1 1 81 81 LYS C C 81 178.101 178.101 174.925 3.176 19497
3855 1 8 . 1 1 81 81 LYS CA C 81 54.400 54.400 54.332 0.068 19497
3856 1 8 . 1 1 81 81 LYS CB C 81 34.300 34.300 34.690 -0.390 19497
3857 1 8 . 1 1 81 81 LYS H H 81 8.198 8.198 8.528 -0.330 19497
3858 1 8 . 1 1 82 82 GLN N N 82 121.436 121.436 121.682 -0.246 19497
3859 1 8 . 1 1 82 82 GLN C C 82 177.068 177.068 176.099 0.969 19497
3860 1 8 . 1 1 82 82 GLN CA C 82 56.200 56.200 57.079 -0.879 19497
3861 1 8 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.309 1.091 19497
3862 1 8 . 1 1 82 82 GLN H H 82 7.910 7.910 8.278 -0.368 19497
3863 1 8 . 1 1 83 83 GLY N N 83 110.688 110.688 115.945 -5.257 19497
3864 1 8 . 1 1 83 83 GLY C C 83 173.348 173.348 174.061 -0.713 19497
3865 1 8 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.916 0.084 19497
3866 1 8 . 1 1 83 83 GLY H H 83 8.382 8.382 8.664 -0.282 19497
3867 1 8 . 1 1 84 84 PHE N N 84 119.493 119.493 123.551 -4.058 19497
3868 1 8 . 1 1 84 84 PHE C C 84 175.035 175.035 174.470 0.565 19497
3869 1 8 . 1 1 84 84 PHE CA C 84 57.300 57.300 55.067 2.233 19497
3870 1 8 . 1 1 84 84 PHE CB C 84 42.200 42.200 38.091 4.109 19497
3871 1 8 . 1 1 84 84 PHE H H 84 7.910 7.910 6.504 1.406 19497
3872 1 8 . 1 1 85 85 GLU N N 85 124.672 124.672 124.548 0.124 19497
3873 1 8 . 1 1 85 85 GLU CA C 85 59.000 59.000 53.541 5.459 19497
3874 1 8 . 1 1 85 85 GLU CB C 85 29.700 29.700 29.928 -0.228 19497
3875 1 8 . 1 1 85 85 GLU H H 85 8.142 8.142 8.014 0.128 19497
3876 1 8 . 1 1 87 87 PRO C C 87 178.284 178.284 177.912 0.372 19497
3877 1 8 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.376 -1.276 19497
3878 1 8 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.797 -0.697 19497
3879 1 8 . 1 1 88 88 THR N N 88 106.959 106.959 110.463 -3.504 19497
3880 1 8 . 1 1 88 88 THR C C 88 174.182 174.182 174.894 -0.712 19497
3881 1 8 . 1 1 88 88 THR CA C 88 62.900 62.900 61.813 1.087 19497
3882 1 8 . 1 1 88 88 THR CB C 88 68.000 68.000 68.096 -0.096 19497
3883 1 8 . 1 1 88 88 THR H H 88 7.110 7.110 8.000 -0.890 19497
3884 1 8 . 1 1 89 89 PHE N N 89 118.766 118.766 118.946 -0.180 19497
3885 1 8 . 1 1 89 89 PHE C C 89 175.468 175.468 176.139 -0.671 19497
3886 1 8 . 1 1 89 89 PHE CA C 89 59.800 59.800 59.323 0.477 19497
3887 1 8 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.327 1.373 19497
3888 1 8 . 1 1 89 89 PHE H H 89 7.198 7.198 7.467 -0.269 19497
3889 1 8 . 1 1 90 90 THR N N 90 107.050 107.050 110.475 -3.425 19497
3890 1 8 . 1 1 90 90 THR C C 90 177.260 177.260 175.379 1.881 19497
3891 1 8 . 1 1 90 90 THR CA C 90 64.600 64.600 61.275 3.325 19497
3892 1 8 . 1 1 90 90 THR CB C 90 67.900 67.900 68.124 -0.223 19497
3893 1 8 . 1 1 90 90 THR H H 90 7.446 7.446 7.365 0.081 19497
3894 1 8 . 1 1 91 91 GLY N N 91 106.738 106.738 108.256 -1.518 19497
3895 1 8 . 1 1 91 91 GLY C C 91 174.422 174.422 175.419 -0.997 19497
3896 1 8 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.285 0.715 19497
3897 1 8 . 1 1 91 91 GLY H H 91 7.646 7.646 7.649 -0.003 19497
3898 1 8 . 1 1 92 92 TRP N N 92 117.500 117.500 119.700 -2.200 19497
3899 1 8 . 1 1 92 92 TRP C C 92 174.209 174.209 176.565 -2.356 19497
3900 1 8 . 1 1 92 92 TRP CA C 92 56.900 56.900 57.808 -0.908 19497
3901 1 8 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.171 0.229 19497
3902 1 8 . 1 1 92 92 TRP H H 92 6.790 6.790 6.767 0.023 19497
3903 1 8 . 1 1 93 93 PHE N N 93 119.092 119.092 118.425 0.667 19497
3904 1 8 . 1 1 93 93 PHE C C 93 175.953 175.953 176.118 -0.165 19497
3905 1 8 . 1 1 93 93 PHE CA C 93 56.700 56.700 58.498 -1.798 19497
3906 1 8 . 1 1 93 93 PHE CB C 93 40.300 40.300 38.803 1.497 19497
3907 1 8 . 1 1 93 93 PHE H H 93 7.750 7.750 7.383 0.367 19497
3908 1 8 . 1 1 94 94 MET N N 94 121.554 121.554 124.096 -2.542 19497
3909 1 8 . 1 1 94 94 MET C C 94 175.738 175.738 176.680 -0.942 19497
3910 1 8 . 1 1 94 94 MET CA C 94 57.600 57.600 57.467 0.133 19497
3911 1 8 . 1 1 94 94 MET CB C 94 32.000 32.000 32.741 -0.741 19497
3912 1 8 . 1 1 94 94 MET H H 94 8.654 8.654 8.788 -0.134 19497
3913 1 8 . 1 1 95 95 ALA N N 95 119.777 119.777 122.131 -2.354 19497
3914 1 8 . 1 1 95 95 ALA C C 95 175.441 175.441 175.707 -0.266 19497
3915 1 8 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.444 -0.144 19497
3916 1 8 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.955 1.745 19497
3917 1 8 . 1 1 95 95 ALA H H 95 7.750 7.750 8.095 -0.345 19497
3918 1 8 . 1 1 96 96 TRP N N 96 120.813 120.813 122.241 -1.428 19497
3919 1 8 . 1 1 96 96 TRP C C 96 175.488 175.488 174.357 1.131 19497
3920 1 8 . 1 1 96 96 TRP CA C 96 57.700 57.700 56.127 1.573 19497
3921 1 8 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.189 0.211 19497
3922 1 8 . 1 1 96 96 TRP H H 96 8.254 8.254 7.895 0.359 19497
3923 1 8 . 1 1 97 97 ASP N N 97 117.140 117.140 128.874 -11.734 19497
3924 1 8 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.504 3.196 19497
3925 1 8 . 1 1 97 97 ASP CB C 97 39.600 39.600 42.887 -3.287 19497
3926 1 8 . 1 1 97 97 ASP H H 97 8.958 8.958 7.998 0.960 19497
3927 1 8 . 1 1 98 98 PRO C C 98 174.071 174.071 176.791 -2.720 19497
3928 1 8 . 1 1 98 98 PRO CA C 98 63.100 63.100 64.023 -0.923 19497
3929 1 8 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.126 0.274 19497
3930 1 8 . 1 1 99 99 LEU N N 99 118.888 118.888 116.286 2.602 19497
3931 1 8 . 1 1 99 99 LEU C C 99 177.519 177.519 177.049 0.470 19497
3932 1 8 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.173 0.227 19497
3933 1 8 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.281 -0.781 19497
3934 1 8 . 1 1 99 99 LEU H H 99 8.182 8.182 8.075 0.107 19497
3935 1 8 . 1 1 100 100 CYS N N 100 118.788 118.788 116.271 2.517 19497
3936 1 8 . 1 1 100 100 CYS C C 100 174.685 174.685 173.815 0.870 19497
3937 1 8 . 1 1 100 100 CYS CA C 100 60.800 60.800 58.392 2.408 19497
3938 1 8 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.759 -0.359 19497
3939 1 8 . 1 1 100 100 CYS H H 100 6.862 6.862 7.230 -0.368 19497
3940 1 8 . 1 1 101 101 TRP N N 101 117.558 117.558 121.322 -3.764 19497
3941 1 8 . 1 1 101 101 TRP C C 101 176.478 176.478 174.830 1.648 19497
3942 1 8 . 1 1 101 101 TRP CA C 101 54.400 54.400 55.654 -1.254 19497
3943 1 8 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.580 -2.380 19497
3944 1 8 . 1 1 101 101 TRP H H 101 7.662 7.662 7.266 0.396 19497
3945 1 8 . 1 1 102 102 SER N N 102 115.626 115.626 117.082 -1.456 19497
3946 1 8 . 1 1 102 102 SER C C 102 174.303 174.303 173.467 0.836 19497
3947 1 8 . 1 1 102 102 SER CA C 102 58.900 58.900 57.188 1.712 19497
3948 1 8 . 1 1 102 102 SER CB C 102 63.700 63.700 65.879 -2.179 19497
3949 1 8 . 1 1 102 102 SER H H 102 7.734 7.734 8.157 -0.423 19497
3950 1 8 . 1 1 103 103 ASP N N 103 121.936 121.936 119.845 2.091 19497
3951 1 8 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.103 0.297 19497
3952 1 8 . 1 1 103 103 ASP CB C 103 40.600 40.600 39.908 0.692 19497
3953 1 8 . 1 1 103 103 ASP H H 103 8.254 8.254 8.484 -0.230 19497
3954 1 8 . 1 1 104 104 ARG N N 104 120.567 120.567 122.104 -1.537 19497
3955 1 8 . 1 1 104 104 ARG C C 104 176.177 176.177 177.489 -1.312 19497
3956 1 8 . 1 1 104 104 ARG CA C 104 56.000 56.000 57.834 -1.834 19497
3957 1 8 . 1 1 104 104 ARG CB C 104 30.300 30.300 30.286 0.014 19497
3958 1 8 . 1 1 104 104 ARG H H 104 7.910 7.910 8.522 -0.612 19497
3959 1 8 . 1 1 105 105 LYS N N 105 121.805 121.805 117.203 4.602 19497
3960 1 8 . 1 1 105 105 LYS C C 105 176.141 176.141 176.525 -0.384 19497
3961 1 8 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.606 -1.506 19497
3962 1 8 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.762 -0.962 19497
3963 1 8 . 1 1 105 105 LYS H H 105 8.094 8.094 8.241 -0.147 19497
3964 1 8 . 1 1 106 106 SER N N 106 116.792 116.792 110.761 6.031 19497
3965 1 8 . 1 1 106 106 SER C C 106 172.841 172.841 172.920 -0.079 19497
3966 1 8 . 1 1 106 106 SER CA C 106 57.900 57.900 58.087 -0.187 19497
3967 1 8 . 1 1 106 106 SER CB C 106 63.800 63.800 64.020 -0.220 19497
3968 1 8 . 1 1 106 106 SER H H 106 8.030 8.030 7.985 0.045 19497
3969 1 9 . 1 1 2 2 ARG N N 2 117.187 117.187 121.305 -4.118 19497
3970 1 9 . 1 1 2 2 ARG C C 2 172.315 172.315 174.764 -2.449 19497
3971 1 9 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.205 -0.105 19497
3972 1 9 . 1 1 2 2 ARG CB C 2 29.000 29.000 31.040 -2.040 19497
3973 1 9 . 1 1 2 2 ARG H H 2 7.766 7.766 8.458 -0.692 19497
3974 1 9 . 1 1 3 3 LEU N N 3 125.426 125.426 118.102 7.324 19497
3975 1 9 . 1 1 3 3 LEU C C 3 173.996 173.996 174.743 -0.747 19497
3976 1 9 . 1 1 3 3 LEU CA C 3 52.600 52.600 54.471 -1.871 19497
3977 1 9 . 1 1 3 3 LEU CB C 3 45.100 45.100 45.848 -0.748 19497
3978 1 9 . 1 1 3 3 LEU H H 3 8.246 8.246 7.921 0.325 19497
3979 1 9 . 1 1 4 4 PHE N N 4 122.682 122.682 119.336 3.346 19497
3980 1 9 . 1 1 4 4 PHE C C 4 175.512 175.512 174.140 1.372 19497
3981 1 9 . 1 1 4 4 PHE CA C 4 55.700 55.700 56.904 -1.204 19497
3982 1 9 . 1 1 4 4 PHE CB C 4 41.800 41.800 42.516 -0.716 19497
3983 1 9 . 1 1 4 4 PHE H H 4 9.390 9.390 9.023 0.367 19497
3984 1 9 . 1 1 5 5 GLU N N 5 125.826 125.826 121.170 4.656 19497
3985 1 9 . 1 1 5 5 GLU C C 5 175.679 175.679 176.104 -0.425 19497
3986 1 9 . 1 1 5 5 GLU CA C 5 56.400 56.400 54.325 2.075 19497
3987 1 9 . 1 1 5 5 GLU CB C 5 29.400 29.400 33.517 -4.117 19497
3988 1 9 . 1 1 5 5 GLU H H 5 9.190 9.190 8.367 0.823 19497
3989 1 9 . 1 1 6 6 CYS N N 6 121.540 121.540 121.661 -0.121 19497
3990 1 9 . 1 1 6 6 CYS C C 6 175.738 175.738 174.945 0.793 19497
3991 1 9 . 1 1 6 6 CYS CA C 6 56.100 56.100 60.662 -4.562 19497
3992 1 9 . 1 1 6 6 CYS CB C 6 28.200 28.200 28.489 -0.289 19497
3993 1 9 . 1 1 6 6 CYS H H 6 8.158 8.158 8.751 -0.593 19497
3994 1 9 . 1 1 7 7 SER N N 7 116.299 116.299 113.622 2.677 19497
3995 1 9 . 1 1 7 7 SER C C 7 173.277 173.277 172.741 0.536 19497
3996 1 9 . 1 1 7 7 SER CA C 7 58.300 58.300 57.898 0.402 19497
3997 1 9 . 1 1 7 7 SER CB C 7 64.300 64.300 64.725 -0.424 19497
3998 1 9 . 1 1 7 7 SER H H 7 7.734 7.734 8.398 -0.664 19497
3999 1 9 . 1 1 8 8 ASN N N 8 127.642 127.642 122.788 4.854 19497
4000 1 9 . 1 1 8 8 ASN C C 8 177.812 177.812 174.443 3.369 19497
4001 1 9 . 1 1 8 8 ASN CA C 8 55.900 55.900 52.559 3.341 19497
4002 1 9 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.272 -0.072 19497
4003 1 9 . 1 1 8 8 ASN H H 8 8.006 8.006 8.404 -0.398 19497
4004 1 9 . 1 1 9 9 LYS N N 9 122.472 122.472 120.858 1.614 19497
4005 1 9 . 1 1 9 9 LYS C C 9 177.932 177.932 177.387 0.545 19497
4006 1 9 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.634 2.666 19497
4007 1 9 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.490 -1.090 19497
4008 1 9 . 1 1 9 9 LYS H H 9 8.350 8.350 8.311 0.039 19497
4009 1 9 . 1 1 10 10 THR N N 10 109.478 109.478 116.859 -7.381 19497
4010 1 9 . 1 1 10 10 THR C C 10 175.241 175.241 174.327 0.914 19497
4011 1 9 . 1 1 10 10 THR CA C 10 62.400 62.400 61.507 0.894 19497
4012 1 9 . 1 1 10 10 THR CB C 10 69.700 69.700 67.074 2.626 19497
4013 1 9 . 1 1 10 10 THR H H 10 8.486 8.486 8.671 -0.185 19497
4014 1 9 . 1 1 11 11 GLY N N 11 110.146 110.146 113.601 -3.455 19497
4015 1 9 . 1 1 11 11 GLY C C 11 172.717 172.717 172.735 -0.018 19497
4016 1 9 . 1 1 11 11 GLY CA C 11 44.700 44.700 45.815 -1.115 19497
4017 1 9 . 1 1 11 11 GLY H H 11 8.014 8.014 8.014 0.000 19497
4018 1 9 . 1 1 12 12 ARG N N 12 117.911 117.911 119.244 -1.333 19497
4019 1 9 . 1 1 12 12 ARG C C 12 173.660 173.660 176.181 -2.521 19497
4020 1 9 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.397 -1.597 19497
4021 1 9 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.631 2.769 19497
4022 1 9 . 1 1 12 12 ARG H H 12 7.342 7.342 7.866 -0.524 19497
4023 1 9 . 1 1 13 13 PHE N N 13 122.082 122.082 119.728 2.354 19497
4024 1 9 . 1 1 13 13 PHE C C 13 174.525 174.525 174.809 -0.284 19497
4025 1 9 . 1 1 13 13 PHE CA C 13 58.700 58.700 56.583 2.117 19497
4026 1 9 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.269 0.631 19497
4027 1 9 . 1 1 13 13 PHE H H 13 8.462 8.462 8.166 0.296 19497
4028 1 9 . 1 1 14 14 LEU N N 14 129.559 129.559 122.623 6.936 19497
4029 1 9 . 1 1 14 14 LEU C C 14 174.071 174.071 175.641 -1.570 19497
4030 1 9 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.622 -0.522 19497
4031 1 9 . 1 1 14 14 LEU CB C 14 45.500 45.500 42.428 3.072 19497
4032 1 9 . 1 1 14 14 LEU H H 14 8.054 8.054 7.449 0.605 19497
4033 1 9 . 1 1 15 15 ALA N N 15 126.873 126.873 130.917 -4.044 19497
4034 1 9 . 1 1 15 15 ALA C C 15 176.826 176.826 176.000 0.826 19497
4035 1 9 . 1 1 15 15 ALA CA C 15 49.900 49.900 50.938 -1.038 19497
4036 1 9 . 1 1 15 15 ALA CB C 15 20.300 20.300 22.140 -1.840 19497
4037 1 9 . 1 1 15 15 ALA H H 15 8.190 8.190 7.936 0.254 19497
4038 1 9 . 1 1 16 16 THR N N 16 120.557 120.557 116.978 3.579 19497
4039 1 9 . 1 1 16 16 THR C C 16 173.449 173.449 174.350 -0.901 19497
4040 1 9 . 1 1 16 16 THR CA C 16 61.500 61.500 61.691 -0.192 19497
4041 1 9 . 1 1 16 16 THR CB C 16 70.500 70.500 69.246 1.254 19497
4042 1 9 . 1 1 16 16 THR H H 16 9.014 9.014 8.651 0.363 19497
4043 1 9 . 1 1 17 17 GLU N N 17 129.862 129.862 126.304 3.558 19497
4044 1 9 . 1 1 17 17 GLU C C 17 175.703 175.703 175.991 -0.288 19497
4045 1 9 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.231 1.669 19497
4046 1 9 . 1 1 17 17 GLU CB C 17 29.200 29.200 29.564 -0.364 19497
4047 1 9 . 1 1 17 17 GLU H H 17 9.118 9.118 8.855 0.263 19497
4048 1 9 . 1 1 18 18 ILE N N 18 128.992 128.992 118.087 10.905 19497
4049 1 9 . 1 1 18 18 ILE C C 18 175.994 175.994 175.853 0.141 19497
4050 1 9 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.796 -1.196 19497
4051 1 9 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.629 -1.329 19497
4052 1 9 . 1 1 18 18 ILE H H 18 8.686 8.686 8.001 0.685 19497
4053 1 9 . 1 1 19 19 VAL N N 19 127.812 127.812 117.275 10.537 19497
4054 1 9 . 1 1 19 19 VAL C C 19 175.611 175.611 175.350 0.261 19497
4055 1 9 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.717 -0.017 19497
4056 1 9 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.274 0.726 19497
4057 1 9 . 1 1 19 19 VAL H H 19 8.422 8.422 8.275 0.147 19497
4058 1 9 . 1 1 20 20 ASP N N 20 123.008 123.008 119.832 3.176 19497
4059 1 9 . 1 1 20 20 ASP C C 20 175.669 175.669 174.900 0.769 19497
4060 1 9 . 1 1 20 20 ASP CA C 20 54.900 54.900 54.947 -0.047 19497
4061 1 9 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.580 -3.079 19497
4062 1 9 . 1 1 20 20 ASP H H 20 8.894 8.894 8.041 0.853 19497
4063 1 9 . 1 1 21 21 PHE N N 21 112.724 112.724 119.316 -6.592 19497
4064 1 9 . 1 1 21 21 PHE C C 21 174.706 174.706 175.523 -0.817 19497
4065 1 9 . 1 1 21 21 PHE CA C 21 56.200 56.200 57.392 -1.192 19497
4066 1 9 . 1 1 21 21 PHE CB C 21 41.000 41.000 40.896 0.104 19497
4067 1 9 . 1 1 21 21 PHE H H 21 6.261 6.261 8.087 -1.826 19497
4068 1 9 . 1 1 22 22 THR N N 22 112.022 112.022 112.857 -0.835 19497
4069 1 9 . 1 1 22 22 THR C C 22 175.111 175.111 173.920 1.191 19497
4070 1 9 . 1 1 22 22 THR CA C 22 60.100 60.100 60.968 -0.868 19497
4071 1 9 . 1 1 22 22 THR H H 22 9.422 9.422 8.173 1.249 19497
4072 1 9 . 1 1 23 23 GLN N N 23 122.305 122.305 121.706 0.599 19497
4073 1 9 . 1 1 23 23 GLN C C 23 176.564 176.564 176.594 -0.030 19497
4074 1 9 . 1 1 23 23 GLN CA C 23 58.600 58.600 58.748 -0.148 19497
4075 1 9 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.423 -1.523 19497
4076 1 9 . 1 1 23 23 GLN H H 23 9.470 9.470 8.850 0.620 19497
4077 1 9 . 1 1 24 24 ASP N N 24 114.251 114.251 119.463 -5.212 19497
4078 1 9 . 1 1 24 24 ASP C C 24 174.839 174.839 177.147 -2.308 19497
4079 1 9 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.644 -0.944 19497
4080 1 9 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.492 0.007 19497
4081 1 9 . 1 1 24 24 ASP H H 24 7.534 7.534 8.325 -0.791 19497
4082 1 9 . 1 1 25 25 ASP N N 25 116.046 116.046 117.697 -1.651 19497
4083 1 9 . 1 1 25 25 ASP C C 25 176.087 176.087 175.510 0.577 19497
4084 1 9 . 1 1 25 25 ASP CA C 25 54.500 54.500 54.168 0.332 19497
4085 1 9 . 1 1 25 25 ASP CB C 25 40.600 40.600 41.254 -0.654 19497
4086 1 9 . 1 1 25 25 ASP H H 25 7.454 7.454 7.598 -0.144 19497
4087 1 9 . 1 1 26 26 LEU N N 26 121.535 121.535 121.819 -0.284 19497
4088 1 9 . 1 1 26 26 LEU C C 26 176.343 176.343 175.920 0.423 19497
4089 1 9 . 1 1 26 26 LEU CA C 26 55.000 55.000 53.886 1.114 19497
4090 1 9 . 1 1 26 26 LEU CB C 26 41.300 41.300 41.989 -0.689 19497
4091 1 9 . 1 1 26 26 LEU H H 26 8.014 8.014 7.516 0.498 19497
4092 1 9 . 1 1 27 27 ASP N N 27 127.804 127.804 123.628 4.176 19497
4093 1 9 . 1 1 27 27 ASP C C 27 176.947 176.947 176.508 0.439 19497
4094 1 9 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.880 0.120 19497
4095 1 9 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.268 1.132 19497
4096 1 9 . 1 1 27 27 ASP H H 27 8.326 8.326 8.227 0.099 19497
4097 1 9 . 1 1 28 28 GLU N N 28 123.641 123.641 120.964 2.677 19497
4098 1 9 . 1 1 28 28 GLU C C 28 176.141 176.141 176.476 -0.335 19497
4099 1 9 . 1 1 28 28 GLU CA C 28 54.500 54.500 59.159 -4.659 19497
4100 1 9 . 1 1 28 28 GLU CB C 28 32.700 32.700 30.268 2.432 19497
4101 1 9 . 1 1 28 28 GLU H H 28 8.278 8.278 8.825 -0.547 19497
4102 1 9 . 1 1 29 29 ASN N N 29 120.901 120.901 115.225 5.676 19497
4103 1 9 . 1 1 29 29 ASN C C 29 174.383 174.383 174.336 0.047 19497
4104 1 9 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.305 4.995 19497
4105 1 9 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.655 -0.355 19497
4106 1 9 . 1 1 29 29 ASN H H 29 8.022 8.022 8.269 -0.247 19497
4107 1 9 . 1 1 30 30 ASP N N 30 125.016 125.016 117.856 7.160 19497
4108 1 9 . 1 1 30 30 ASP C C 30 175.679 175.679 174.752 0.927 19497
4109 1 9 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.005 -0.705 19497
4110 1 9 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.361 -3.361 19497
4111 1 9 . 1 1 30 30 ASP H H 30 8.142 8.142 7.599 0.543 19497
4112 1 9 . 1 1 31 31 VAL N N 31 121.540 121.540 119.711 1.829 19497
4113 1 9 . 1 1 31 31 VAL C C 31 175.675 175.675 174.681 0.994 19497
4114 1 9 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.164 0.836 19497
4115 1 9 . 1 1 31 31 VAL CB C 31 32.800 32.800 31.448 1.353 19497
4116 1 9 . 1 1 31 31 VAL H H 31 8.158 8.158 8.582 -0.424 19497
4117 1 9 . 1 1 32 32 TYR N N 32 126.116 126.116 125.763 0.353 19497
4118 1 9 . 1 1 32 32 TYR C C 32 173.449 173.449 174.727 -1.278 19497
4119 1 9 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.427 -0.427 19497
4120 1 9 . 1 1 32 32 TYR H H 32 8.294 8.294 8.250 0.044 19497
4121 1 9 . 1 1 33 33 LEU N N 33 121.235 121.235 119.029 2.206 19497
4122 1 9 . 1 1 33 33 LEU C C 33 174.948 174.948 175.025 -0.077 19497
4123 1 9 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.033 0.267 19497
4124 1 9 . 1 1 33 33 LEU CB C 33 45.700 45.700 42.335 3.365 19497
4125 1 9 . 1 1 33 33 LEU H H 33 9.142 9.142 8.355 0.787 19497
4126 1 9 . 1 1 34 34 LEU N N 34 127.452 127.452 124.063 3.389 19497
4127 1 9 . 1 1 34 34 LEU C C 34 174.084 174.084 174.814 -0.730 19497
4128 1 9 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.420 -1.220 19497
4129 1 9 . 1 1 34 34 LEU CB C 34 44.700 44.700 41.999 2.701 19497
4130 1 9 . 1 1 34 34 LEU H H 34 9.686 9.686 7.618 2.068 19497
4131 1 9 . 1 1 35 35 ASP N N 35 126.977 126.977 126.601 0.376 19497
4132 1 9 . 1 1 35 35 ASP C C 35 177.009 177.009 174.896 2.113 19497
4133 1 9 . 1 1 35 35 ASP CA C 35 52.600 52.600 52.698 -0.098 19497
4134 1 9 . 1 1 35 35 ASP CB C 35 41.400 41.400 41.465 -0.065 19497
4135 1 9 . 1 1 35 35 ASP H H 35 9.446 9.446 7.528 1.918 19497
4136 1 9 . 1 1 36 36 THR N N 36 118.735 118.735 115.721 3.014 19497
4137 1 9 . 1 1 36 36 THR C C 36 175.252 175.252 175.928 -0.676 19497
4138 1 9 . 1 1 36 36 THR CA C 36 60.500 60.500 60.260 0.240 19497
4139 1 9 . 1 1 36 36 THR CB C 36 68.000 68.000 69.613 -1.613 19497
4140 1 9 . 1 1 36 36 THR H H 36 8.310 8.310 7.650 0.660 19497
4141 1 9 . 1 1 37 37 TRP N N 37 122.289 122.289 124.238 -1.949 19497
4142 1 9 . 1 1 37 37 TRP C C 37 177.189 177.189 176.397 0.792 19497
4143 1 9 . 1 1 37 37 TRP CA C 37 61.500 61.500 59.846 1.653 19497
4144 1 9 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.793 -0.993 19497
4145 1 9 . 1 1 37 37 TRP H H 37 9.022 9.022 8.765 0.257 19497
4146 1 9 . 1 1 38 38 ASP N N 38 117.370 117.370 114.883 2.487 19497
4147 1 9 . 1 1 38 38 ASP C C 38 175.290 175.290 175.978 -0.688 19497
4148 1 9 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.028 0.373 19497
4149 1 9 . 1 1 38 38 ASP CB C 38 41.100 41.100 41.552 -0.452 19497
4150 1 9 . 1 1 38 38 ASP H H 38 8.518 8.518 8.234 0.284 19497
4151 1 9 . 1 1 39 39 GLN N N 39 111.522 111.522 118.788 -7.266 19497
4152 1 9 . 1 1 39 39 GLN C C 39 173.099 173.099 174.576 -1.477 19497
4153 1 9 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.069 -0.569 19497
4154 1 9 . 1 1 39 39 GLN CB C 39 28.900 28.900 30.433 -1.533 19497
4155 1 9 . 1 1 39 39 GLN H H 39 7.118 7.118 7.527 -0.409 19497
4156 1 9 . 1 1 40 40 ILE N N 40 121.103 121.103 124.633 -3.530 19497
4157 1 9 . 1 1 40 40 ILE C C 40 174.406 174.406 175.649 -1.243 19497
4158 1 9 . 1 1 40 40 ILE CA C 40 58.900 58.900 61.870 -2.970 19497
4159 1 9 . 1 1 40 40 ILE CB C 40 38.900 38.900 36.739 2.161 19497
4160 1 9 . 1 1 40 40 ILE H H 40 8.422 8.422 8.300 0.122 19497
4161 1 9 . 1 1 41 41 PHE N N 41 123.856 123.856 125.665 -1.809 19497
4162 1 9 . 1 1 41 41 PHE C C 41 174.537 174.537 174.726 -0.189 19497
4163 1 9 . 1 1 41 41 PHE CA C 41 55.900 55.900 54.037 1.863 19497
4164 1 9 . 1 1 41 41 PHE CB C 41 42.200 42.200 39.383 2.817 19497
4165 1 9 . 1 1 41 41 PHE H H 41 9.222 9.222 8.717 0.505 19497
4166 1 9 . 1 1 42 42 PHE N N 42 127.400 127.400 119.531 7.869 19497
4167 1 9 . 1 1 42 42 PHE C C 42 173.021 173.021 174.170 -1.149 19497
4168 1 9 . 1 1 42 42 PHE CA C 42 56.300 56.300 57.245 -0.945 19497
4169 1 9 . 1 1 42 42 PHE CB C 42 42.300 42.300 42.989 -0.689 19497
4170 1 9 . 1 1 42 42 PHE H H 42 9.358 9.358 9.040 0.318 19497
4171 1 9 . 1 1 43 43 TRP N N 43 129.616 129.616 127.119 2.497 19497
4172 1 9 . 1 1 43 43 TRP C C 43 174.538 174.538 175.149 -0.611 19497
4173 1 9 . 1 1 43 43 TRP CA C 43 61.600 61.600 56.535 5.065 19497
4174 1 9 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.656 7.544 19497
4175 1 9 . 1 1 43 43 TRP H H 43 9.646 9.646 8.933 0.713 19497
4176 1 9 . 1 1 44 44 ILE N N 44 121.402 121.402 128.790 -7.388 19497
4177 1 9 . 1 1 44 44 ILE C C 44 175.738 175.738 175.165 0.573 19497
4178 1 9 . 1 1 44 44 ILE CA C 44 57.600 57.600 60.707 -3.107 19497
4179 1 9 . 1 1 44 44 ILE CB C 44 39.100 39.100 39.266 -0.166 19497
4180 1 9 . 1 1 44 44 ILE H H 44 7.838 7.838 7.786 0.052 19497
4181 1 9 . 1 1 45 45 GLY N N 45 114.403 114.403 111.018 3.385 19497
4182 1 9 . 1 1 45 45 GLY C C 45 175.519 175.519 173.408 2.111 19497
4183 1 9 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.037 2.463 19497
4184 1 9 . 1 1 45 45 GLY H H 45 7.742 7.742 8.231 -0.489 19497
4185 1 9 . 1 1 46 46 LYS N N 46 123.585 123.585 120.483 3.102 19497
4186 1 9 . 1 1 46 46 LYS C C 46 177.790 177.790 178.484 -0.694 19497
4187 1 9 . 1 1 46 46 LYS CA C 46 58.700 58.700 57.599 1.101 19497
4188 1 9 . 1 1 46 46 LYS CB C 46 32.200 32.200 33.529 -1.329 19497
4189 1 9 . 1 1 46 46 LYS H H 46 8.942 8.942 7.966 0.976 19497
4190 1 9 . 1 1 47 47 GLY N N 47 107.819 107.819 108.173 -0.354 19497
4191 1 9 . 1 1 47 47 GLY C C 47 174.298 174.298 173.154 1.144 19497
4192 1 9 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.399 -0.099 19497
4193 1 9 . 1 1 47 47 GLY H H 47 8.670 8.670 7.503 1.167 19497
4194 1 9 . 1 1 48 48 ALA N N 48 123.965 123.965 122.390 1.575 19497
4195 1 9 . 1 1 48 48 ALA C C 48 177.189 177.189 177.238 -0.049 19497
4196 1 9 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.255 0.845 19497
4197 1 9 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.897 -0.897 19497
4198 1 9 . 1 1 48 48 ALA H H 48 7.230 7.230 7.308 -0.078 19497
4199 1 9 . 1 1 49 49 ASN N N 49 119.667 119.667 118.167 1.500 19497
4200 1 9 . 1 1 49 49 ASN C C 49 175.797 175.797 176.591 -0.794 19497
4201 1 9 . 1 1 49 49 ASN CA C 49 54.200 54.200 53.812 0.388 19497
4202 1 9 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.350 1.750 19497
4203 1 9 . 1 1 49 49 ASN H H 49 8.526 8.526 8.665 -0.139 19497
4204 1 9 . 1 1 50 50 GLU N N 50 112.272 112.272 125.575 -13.303 19497
4205 1 9 . 1 1 50 50 GLU C C 50 178.128 178.128 178.382 -0.254 19497
4206 1 9 . 1 1 50 50 GLU CA C 50 59.600 59.600 58.776 0.823 19497
4207 1 9 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.771 -0.471 19497
4208 1 9 . 1 1 50 50 GLU H H 50 7.814 7.814 8.961 -1.147 19497
4209 1 9 . 1 1 51 51 SER N N 51 113.952 113.952 115.579 -1.627 19497
4210 1 9 . 1 1 51 51 SER C C 51 177.874 177.874 175.456 2.418 19497
4211 1 9 . 1 1 51 51 SER CA C 51 61.100 61.100 61.159 -0.059 19497
4212 1 9 . 1 1 51 51 SER CB C 51 60.900 60.900 63.071 -2.171 19497
4213 1 9 . 1 1 51 51 SER H H 51 8.342 8.342 8.005 0.337 19497
4214 1 9 . 1 1 52 52 GLU N N 52 119.930 119.930 120.086 -0.156 19497
4215 1 9 . 1 1 52 52 GLU C C 52 178.827 178.827 176.862 1.965 19497
4216 1 9 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.499 -0.599 19497
4217 1 9 . 1 1 52 52 GLU CB C 52 29.300 29.300 30.075 -0.775 19497
4218 1 9 . 1 1 52 52 GLU H H 52 7.806 7.806 8.243 -0.437 19497
4219 1 9 . 1 1 53 53 LYS N N 53 118.112 118.112 119.417 -1.305 19497
4220 1 9 . 1 1 53 53 LYS C C 53 178.802 178.802 179.493 -0.691 19497
4221 1 9 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.858 1.142 19497
4222 1 9 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.443 -0.243 19497
4223 1 9 . 1 1 53 53 LYS H H 53 7.670 7.670 7.647 0.023 19497
4224 1 9 . 1 1 54 54 GLU N N 54 117.700 117.700 119.901 -2.201 19497
4225 1 9 . 1 1 54 54 GLU C C 54 177.733 177.733 177.606 0.127 19497
4226 1 9 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.516 -0.316 19497
4227 1 9 . 1 1 54 54 GLU CB C 54 29.300 29.300 29.632 -0.332 19497
4228 1 9 . 1 1 54 54 GLU H H 54 7.934 7.934 8.347 -0.413 19497
4229 1 9 . 1 1 55 55 ALA N N 55 120.395 120.395 121.202 -0.807 19497
4230 1 9 . 1 1 55 55 ALA CA C 55 52.200 52.200 50.970 1.230 19497
4231 1 9 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.572 -0.372 19497
4232 1 9 . 1 1 55 55 ALA H H 55 7.238 7.238 8.127 -0.889 19497
4233 1 9 . 1 1 56 56 ALA C C 56 177.526 177.526 178.297 -0.771 19497
4234 1 9 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.756 0.844 19497
4235 1 9 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.583 1.017 19497
4236 1 9 . 1 1 57 57 ALA N N 57 117.753 117.753 119.138 -1.385 19497
4237 1 9 . 1 1 57 57 ALA C C 57 180.072 180.072 179.038 1.034 19497
4238 1 9 . 1 1 57 57 ALA CA C 57 55.200 55.200 54.064 1.136 19497
4239 1 9 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.489 -1.089 19497
4240 1 9 . 1 1 57 57 ALA H H 57 7.990 7.990 7.837 0.153 19497
4241 1 9 . 1 1 58 58 GLU N N 58 118.444 118.444 118.719 -0.275 19497
4242 1 9 . 1 1 58 58 GLU C C 58 179.225 179.225 178.579 0.646 19497
4243 1 9 . 1 1 58 58 GLU CA C 58 59.600 59.600 59.352 0.248 19497
4244 1 9 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.137 -0.237 19497
4245 1 9 . 1 1 58 58 GLU H H 58 7.582 7.582 8.457 -0.875 19497
4246 1 9 . 1 1 59 59 THR N N 59 119.842 119.842 115.419 4.423 19497
4247 1 9 . 1 1 59 59 THR C C 59 175.781 175.781 176.071 -0.290 19497
4248 1 9 . 1 1 59 59 THR CA C 59 66.200 66.200 65.687 0.513 19497
4249 1 9 . 1 1 59 59 THR CB C 59 67.600 67.600 68.107 -0.507 19497
4250 1 9 . 1 1 59 59 THR H H 59 8.422 8.422 8.497 -0.075 19497
4251 1 9 . 1 1 60 60 ALA N N 60 122.454 122.454 124.363 -1.909 19497
4252 1 9 . 1 1 60 60 ALA C C 60 178.583 178.583 179.458 -0.875 19497
4253 1 9 . 1 1 60 60 ALA CA C 60 55.200 55.200 54.927 0.273 19497
4254 1 9 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.768 0.332 19497
4255 1 9 . 1 1 60 60 ALA H H 60 7.966 7.966 7.386 0.580 19497
4256 1 9 . 1 1 61 61 GLN N N 61 115.462 115.462 117.640 -2.178 19497
4257 1 9 . 1 1 61 61 GLN C C 61 178.101 178.101 177.996 0.105 19497
4258 1 9 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.245 0.655 19497
4259 1 9 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.087 0.013 19497
4260 1 9 . 1 1 61 61 GLN H H 61 7.598 7.598 7.620 -0.022 19497
4261 1 9 . 1 1 62 62 GLU N N 62 120.883 120.883 121.299 -0.416 19497
4262 1 9 . 1 1 62 62 GLU C C 62 174.071 174.071 178.770 -4.699 19497
4263 1 9 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.634 -5.534 19497
4264 1 9 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.589 0.711 19497
4265 1 9 . 1 1 62 62 GLU H H 62 7.910 7.910 7.917 -0.007 19497
4266 1 9 . 1 1 63 63 TYR N N 63 118.888 118.888 119.057 -0.169 19497
4267 1 9 . 1 1 63 63 TYR C C 63 177.874 177.874 177.898 -0.024 19497
4268 1 9 . 1 1 63 63 TYR CA C 63 61.100 61.100 61.183 -0.083 19497
4269 1 9 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.434 1.066 19497
4270 1 9 . 1 1 63 63 TYR H H 63 8.182 8.182 7.710 0.472 19497
4271 1 9 . 1 1 64 64 LEU N N 64 119.930 119.930 118.707 1.223 19497
4272 1 9 . 1 1 64 64 LEU C C 64 178.536 178.536 177.829 0.707 19497
4273 1 9 . 1 1 64 64 LEU CA C 64 57.900 57.900 56.795 1.105 19497
4274 1 9 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.785 -2.885 19497
4275 1 9 . 1 1 64 64 LEU H H 64 7.806 7.806 7.224 0.582 19497
4276 1 9 . 1 1 65 65 ARG N N 65 117.322 117.322 117.189 0.133 19497
4277 1 9 . 1 1 65 65 ARG C C 65 177.436 177.436 178.384 -0.948 19497
4278 1 9 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.358 0.242 19497
4279 1 9 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.044 0.356 19497
4280 1 9 . 1 1 65 65 ARG H H 65 8.054 8.054 7.772 0.282 19497
4281 1 9 . 1 1 66 66 SER N N 66 111.783 111.783 111.580 0.203 19497
4282 1 9 . 1 1 66 66 SER C C 66 173.652 173.652 174.503 -0.851 19497
4283 1 9 . 1 1 66 66 SER CA C 66 58.900 58.900 59.044 -0.144 19497
4284 1 9 . 1 1 66 66 SER CB C 66 63.800 63.800 63.915 -0.115 19497
4285 1 9 . 1 1 66 66 SER H H 66 7.550 7.550 7.515 0.035 19497
4286 1 9 . 1 1 67 67 HIS N N 67 124.135 124.135 123.381 0.754 19497
4287 1 9 . 1 1 67 67 HIS CA C 67 55.700 55.700 56.320 -0.620 19497
4288 1 9 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.350 -1.150 19497
4289 1 9 . 1 1 67 67 HIS H H 67 7.134 7.134 7.417 -0.283 19497
4290 1 9 . 1 1 68 68 PRO C C 68 178.101 178.101 176.917 1.184 19497
4291 1 9 . 1 1 68 68 PRO CA C 68 58.900 58.900 63.523 -4.623 19497
4292 1 9 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.820 -1.920 19497
4293 1 9 . 1 1 69 69 GLY N N 69 115.697 115.697 106.694 9.003 19497
4294 1 9 . 1 1 69 69 GLY C C 69 176.641 176.641 174.604 2.037 19497
4295 1 9 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.954 0.046 19497
4296 1 9 . 1 1 69 69 GLY H H 69 7.926 7.926 7.540 0.386 19497
4297 1 9 . 1 1 70 70 SER N N 70 115.440 115.440 114.261 1.179 19497
4298 1 9 . 1 1 70 70 SER C C 70 173.277 173.277 174.467 -1.190 19497
4299 1 9 . 1 1 70 70 SER CA C 70 58.300 58.300 57.994 0.306 19497
4300 1 9 . 1 1 70 70 SER CB C 70 64.300 64.300 62.141 2.159 19497
4301 1 9 . 1 1 70 70 SER H H 70 8.030 8.030 7.655 0.375 19497
4302 1 9 . 1 1 71 71 ARG N N 71 127.642 127.642 121.226 6.416 19497
4303 1 9 . 1 1 71 71 ARG C C 71 175.849 175.849 176.189 -0.340 19497
4304 1 9 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.855 -1.955 19497
4305 1 9 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.657 0.243 19497
4306 1 9 . 1 1 71 71 ARG H H 71 8.006 8.006 8.058 -0.052 19497
4307 1 9 . 1 1 72 72 ASP N N 72 120.975 120.975 118.256 2.719 19497
4308 1 9 . 1 1 72 72 ASP C C 72 176.087 176.087 176.532 -0.445 19497
4309 1 9 . 1 1 72 72 ASP CA C 72 54.500 54.500 53.684 0.816 19497
4310 1 9 . 1 1 72 72 ASP CB C 72 40.900 40.900 42.050 -1.149 19497
4311 1 9 . 1 1 72 72 ASP H H 72 8.182 8.182 8.552 -0.370 19497
4312 1 9 . 1 1 73 73 LEU N N 73 121.535 121.535 122.394 -0.859 19497
4313 1 9 . 1 1 73 73 LEU C C 73 177.020 177.020 175.958 1.062 19497
4314 1 9 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.605 0.395 19497
4315 1 9 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.711 0.289 19497
4316 1 9 . 1 1 73 73 LEU H H 73 8.014 8.014 8.526 -0.512 19497
4317 1 9 . 1 1 74 74 ASP N N 74 120.525 120.525 120.195 0.330 19497
4318 1 9 . 1 1 74 74 ASP C C 74 175.797 175.797 175.430 0.367 19497
4319 1 9 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.791 0.409 19497
4320 1 9 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.576 -0.576 19497
4321 1 9 . 1 1 74 74 ASP H H 74 8.134 8.134 7.836 0.298 19497
4322 1 9 . 1 1 75 75 THR N N 75 116.656 116.656 117.375 -0.719 19497
4323 1 9 . 1 1 75 75 THR CA C 75 59.700 59.700 60.286 -0.586 19497
4324 1 9 . 1 1 75 75 THR CB C 75 69.600 69.600 69.098 0.502 19497
4325 1 9 . 1 1 75 75 THR H H 75 7.814 7.814 8.048 -0.234 19497
4326 1 9 . 1 1 76 76 PRO C C 76 174.538 174.538 175.761 -1.223 19497
4327 1 9 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.637 0.863 19497
4328 1 9 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.370 0.230 19497
4329 1 9 . 1 1 77 77 ILE N N 77 121.402 121.402 121.575 -0.173 19497
4330 1 9 . 1 1 77 77 ILE C C 77 176.132 176.132 175.526 0.606 19497
4331 1 9 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.562 -1.462 19497
4332 1 9 . 1 1 77 77 ILE CB C 77 39.000 39.000 40.017 -1.017 19497
4333 1 9 . 1 1 77 77 ILE H H 77 7.838 7.838 7.992 -0.154 19497
4334 1 9 . 1 1 78 78 ILE N N 78 130.292 130.292 128.402 1.890 19497
4335 1 9 . 1 1 78 78 ILE C C 78 175.084 175.084 174.689 0.395 19497
4336 1 9 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.612 0.288 19497
4337 1 9 . 1 1 78 78 ILE CB C 78 39.000 39.000 39.695 -0.695 19497
4338 1 9 . 1 1 78 78 ILE H H 78 8.910 8.910 8.295 0.615 19497
4339 1 9 . 1 1 79 79 VAL N N 79 129.237 129.237 126.395 2.842 19497
4340 1 9 . 1 1 79 79 VAL C C 79 175.907 175.907 175.798 0.109 19497
4341 1 9 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.861 1.339 19497
4342 1 9 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.051 -0.351 19497
4343 1 9 . 1 1 79 79 VAL H H 79 8.670 8.670 8.519 0.151 19497
4344 1 9 . 1 1 80 80 VAL N N 80 128.354 128.354 128.181 0.173 19497
4345 1 9 . 1 1 80 80 VAL C C 80 172.823 172.823 174.573 -1.750 19497
4346 1 9 . 1 1 80 80 VAL CA C 80 59.400 59.400 61.025 -1.625 19497
4347 1 9 . 1 1 80 80 VAL CB C 80 32.600 32.600 35.595 -2.995 19497
4348 1 9 . 1 1 80 80 VAL H H 80 9.598 9.598 9.374 0.224 19497
4349 1 9 . 1 1 81 81 LYS N N 81 123.077 123.077 122.148 0.929 19497
4350 1 9 . 1 1 81 81 LYS C C 81 178.101 178.101 175.041 3.060 19497
4351 1 9 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.302 1.098 19497
4352 1 9 . 1 1 81 81 LYS CB C 81 34.300 34.300 34.961 -0.661 19497
4353 1 9 . 1 1 81 81 LYS H H 81 8.198 8.198 8.481 -0.283 19497
4354 1 9 . 1 1 82 82 GLN N N 82 121.436 121.436 121.829 -0.393 19497
4355 1 9 . 1 1 82 82 GLN C C 82 177.068 177.068 176.103 0.965 19497
4356 1 9 . 1 1 82 82 GLN CA C 82 56.200 56.200 56.333 -0.133 19497
4357 1 9 . 1 1 82 82 GLN CB C 82 29.400 29.400 27.731 1.669 19497
4358 1 9 . 1 1 82 82 GLN H H 82 7.910 7.910 8.489 -0.579 19497
4359 1 9 . 1 1 83 83 GLY N N 83 110.688 110.688 114.583 -3.895 19497
4360 1 9 . 1 1 83 83 GLY C C 83 173.348 173.348 175.207 -1.859 19497
4361 1 9 . 1 1 83 83 GLY CA C 83 45.000 45.000 45.005 -0.005 19497
4362 1 9 . 1 1 83 83 GLY H H 83 8.382 8.382 9.573 -1.191 19497
4363 1 9 . 1 1 84 84 PHE N N 84 119.493 119.493 123.970 -4.477 19497
4364 1 9 . 1 1 84 84 PHE C C 84 175.035 175.035 174.904 0.131 19497
4365 1 9 . 1 1 84 84 PHE CA C 84 57.300 57.300 55.240 2.060 19497
4366 1 9 . 1 1 84 84 PHE CB C 84 42.200 42.200 36.737 5.463 19497
4367 1 9 . 1 1 84 84 PHE H H 84 7.910 7.910 7.446 0.464 19497
4368 1 9 . 1 1 85 85 GLU N N 85 124.672 124.672 122.951 1.721 19497
4369 1 9 . 1 1 85 85 GLU CA C 85 59.000 59.000 53.686 5.314 19497
4370 1 9 . 1 1 85 85 GLU CB C 85 29.700 29.700 31.372 -1.672 19497
4371 1 9 . 1 1 85 85 GLU H H 85 8.142 8.142 7.858 0.284 19497
4372 1 9 . 1 1 87 87 PRO C C 87 178.284 178.284 178.768 -0.484 19497
4373 1 9 . 1 1 87 87 PRO CA C 87 64.100 64.100 66.037 -1.937 19497
4374 1 9 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.584 -0.484 19497
4375 1 9 . 1 1 88 88 THR N N 88 106.959 106.959 110.264 -3.305 19497
4376 1 9 . 1 1 88 88 THR C C 88 174.182 174.182 176.570 -2.388 19497
4377 1 9 . 1 1 88 88 THR CA C 88 62.900 62.900 64.427 -1.526 19497
4378 1 9 . 1 1 88 88 THR CB C 88 68.000 68.000 68.686 -0.686 19497
4379 1 9 . 1 1 88 88 THR H H 88 7.110 7.110 8.265 -1.155 19497
4380 1 9 . 1 1 89 89 PHE N N 89 118.766 118.766 120.926 -2.160 19497
4381 1 9 . 1 1 89 89 PHE C C 89 175.468 175.468 177.553 -2.085 19497
4382 1 9 . 1 1 89 89 PHE CA C 89 59.800 59.800 59.967 -0.167 19497
4383 1 9 . 1 1 89 89 PHE CB C 89 40.700 40.700 38.768 1.932 19497
4384 1 9 . 1 1 89 89 PHE H H 89 7.198 7.198 7.990 -0.792 19497
4385 1 9 . 1 1 90 90 THR N N 90 107.050 107.050 112.481 -5.431 19497
4386 1 9 . 1 1 90 90 THR C C 90 177.260 177.260 177.126 0.134 19497
4387 1 9 . 1 1 90 90 THR CA C 90 64.600 64.600 64.736 -0.136 19497
4388 1 9 . 1 1 90 90 THR CB C 90 67.900 67.900 67.941 -0.041 19497
4389 1 9 . 1 1 90 90 THR H H 90 7.446 7.446 7.629 -0.183 19497
4390 1 9 . 1 1 91 91 GLY N N 91 106.738 106.738 109.330 -2.592 19497
4391 1 9 . 1 1 91 91 GLY C C 91 174.422 174.422 175.262 -0.840 19497
4392 1 9 . 1 1 91 91 GLY CA C 91 46.000 46.000 46.554 -0.554 19497
4393 1 9 . 1 1 91 91 GLY H H 91 7.646 7.646 7.940 -0.294 19497
4394 1 9 . 1 1 92 92 TRP N N 92 117.500 117.500 121.305 -3.805 19497
4395 1 9 . 1 1 92 92 TRP C C 92 174.209 174.209 177.156 -2.947 19497
4396 1 9 . 1 1 92 92 TRP CA C 92 56.900 56.900 57.877 -0.977 19497
4397 1 9 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.364 0.036 19497
4398 1 9 . 1 1 92 92 TRP H H 92 6.790 6.790 7.550 -0.760 19497
4399 1 9 . 1 1 93 93 PHE N N 93 119.092 119.092 116.666 2.426 19497
4400 1 9 . 1 1 93 93 PHE C C 93 175.953 175.953 176.595 -0.642 19497
4401 1 9 . 1 1 93 93 PHE CA C 93 56.700 56.700 59.301 -2.601 19497
4402 1 9 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.326 0.974 19497
4403 1 9 . 1 1 93 93 PHE H H 93 7.750 7.750 7.567 0.183 19497
4404 1 9 . 1 1 94 94 MET N N 94 121.554 121.554 120.747 0.807 19497
4405 1 9 . 1 1 94 94 MET C C 94 175.738 175.738 175.718 0.020 19497
4406 1 9 . 1 1 94 94 MET CA C 94 57.600 57.600 56.298 1.302 19497
4407 1 9 . 1 1 94 94 MET CB C 94 32.000 32.000 33.958 -1.958 19497
4408 1 9 . 1 1 94 94 MET H H 94 8.654 8.654 9.270 -0.616 19497
4409 1 9 . 1 1 95 95 ALA N N 95 119.777 119.777 122.311 -2.534 19497
4410 1 9 . 1 1 95 95 ALA C C 95 175.441 175.441 176.039 -0.598 19497
4411 1 9 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.467 -0.167 19497
4412 1 9 . 1 1 95 95 ALA CB C 95 20.700 20.700 19.075 1.625 19497
4413 1 9 . 1 1 95 95 ALA H H 95 7.750 7.750 8.057 -0.307 19497
4414 1 9 . 1 1 96 96 TRP N N 96 120.813 120.813 122.837 -2.024 19497
4415 1 9 . 1 1 96 96 TRP C C 96 175.488 175.488 174.906 0.582 19497
4416 1 9 . 1 1 96 96 TRP CA C 96 57.700 57.700 55.941 1.759 19497
4417 1 9 . 1 1 96 96 TRP CB C 96 30.400 30.400 29.602 0.798 19497
4418 1 9 . 1 1 96 96 TRP H H 96 8.254 8.254 8.141 0.113 19497
4419 1 9 . 1 1 97 97 ASP N N 97 117.140 117.140 129.135 -11.995 19497
4420 1 9 . 1 1 97 97 ASP CA C 97 53.700 53.700 51.469 2.231 19497
4421 1 9 . 1 1 97 97 ASP CB C 97 39.600 39.600 42.906 -3.306 19497
4422 1 9 . 1 1 97 97 ASP H H 97 8.958 8.958 7.844 1.114 19497
4423 1 9 . 1 1 98 98 PRO C C 98 174.071 174.071 176.480 -2.409 19497
4424 1 9 . 1 1 98 98 PRO CA C 98 63.100 63.100 63.529 -0.429 19497
4425 1 9 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.032 0.368 19497
4426 1 9 . 1 1 99 99 LEU N N 99 118.888 118.888 118.490 0.398 19497
4427 1 9 . 1 1 99 99 LEU C C 99 177.519 177.519 176.622 0.897 19497
4428 1 9 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.982 -0.582 19497
4429 1 9 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.883 -1.383 19497
4430 1 9 . 1 1 99 99 LEU H H 99 8.182 8.182 7.922 0.260 19497
4431 1 9 . 1 1 100 100 CYS N N 100 118.788 118.788 113.801 4.987 19497
4432 1 9 . 1 1 100 100 CYS C C 100 174.685 174.685 173.614 1.071 19497
4433 1 9 . 1 1 100 100 CYS CA C 100 60.800 60.800 57.766 3.034 19497
4434 1 9 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.451 -0.051 19497
4435 1 9 . 1 1 100 100 CYS H H 100 6.862 6.862 7.404 -0.542 19497
4436 1 9 . 1 1 101 101 TRP N N 101 117.558 117.558 121.437 -3.879 19497
4437 1 9 . 1 1 101 101 TRP C C 101 176.478 176.478 175.219 1.259 19497
4438 1 9 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.538 -2.138 19497
4439 1 9 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.040 -1.840 19497
4440 1 9 . 1 1 101 101 TRP H H 101 7.662 7.662 7.171 0.491 19497
4441 1 9 . 1 1 102 102 SER N N 102 115.626 115.626 115.549 0.077 19497
4442 1 9 . 1 1 102 102 SER C C 102 174.303 174.303 173.293 1.010 19497
4443 1 9 . 1 1 102 102 SER CA C 102 58.900 58.900 57.870 1.030 19497
4444 1 9 . 1 1 102 102 SER CB C 102 63.700 63.700 65.585 -1.885 19497
4445 1 9 . 1 1 102 102 SER H H 102 7.734 7.734 8.234 -0.500 19497
4446 1 9 . 1 1 103 103 ASP N N 103 121.936 121.936 120.200 1.736 19497
4447 1 9 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.094 0.306 19497
4448 1 9 . 1 1 103 103 ASP CB C 103 40.600 40.600 40.225 0.375 19497
4449 1 9 . 1 1 103 103 ASP H H 103 8.254 8.254 8.454 -0.200 19497
4450 1 9 . 1 1 104 104 ARG N N 104 120.567 120.567 121.289 -0.722 19497
4451 1 9 . 1 1 104 104 ARG C C 104 176.177 176.177 177.004 -0.827 19497
4452 1 9 . 1 1 104 104 ARG CA C 104 56.000 56.000 57.376 -1.376 19497
4453 1 9 . 1 1 104 104 ARG CB C 104 30.300 30.300 29.989 0.311 19497
4454 1 9 . 1 1 104 104 ARG H H 104 7.910 7.910 8.331 -0.421 19497
4455 1 9 . 1 1 105 105 LYS N N 105 121.805 121.805 118.638 3.167 19497
4456 1 9 . 1 1 105 105 LYS C C 105 176.141 176.141 177.060 -0.919 19497
4457 1 9 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.472 -1.372 19497
4458 1 9 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.204 -0.404 19497
4459 1 9 . 1 1 105 105 LYS H H 105 8.094 8.094 8.243 -0.149 19497
4460 1 9 . 1 1 106 106 SER N N 106 116.792 116.792 109.674 7.118 19497
4461 1 9 . 1 1 106 106 SER C C 106 172.841 172.841 172.801 0.040 19497
4462 1 9 . 1 1 106 106 SER CA C 106 57.900 57.900 59.015 -1.115 19497
4463 1 9 . 1 1 106 106 SER CB C 106 63.800 63.800 64.837 -1.037 19497
4464 1 9 . 1 1 106 106 SER H H 106 8.030 8.030 8.064 -0.034 19497
4465 1 10 . 1 1 2 2 ARG N N 2 117.187 117.187 120.417 -3.230 19497
4466 1 10 . 1 1 2 2 ARG C C 2 172.315 172.315 175.390 -3.075 19497
4467 1 10 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.698 -0.598 19497
4468 1 10 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.429 -1.429 19497
4469 1 10 . 1 1 2 2 ARG H H 2 7.766 7.766 8.170 -0.404 19497
4470 1 10 . 1 1 3 3 LEU N N 3 125.426 125.426 121.117 4.309 19497
4471 1 10 . 1 1 3 3 LEU C C 3 173.996 173.996 174.915 -0.919 19497
4472 1 10 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.471 -0.871 19497
4473 1 10 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.307 -1.207 19497
4474 1 10 . 1 1 3 3 LEU H H 3 8.246 8.246 8.233 0.013 19497
4475 1 10 . 1 1 4 4 PHE N N 4 122.682 122.682 120.503 2.179 19497
4476 1 10 . 1 1 4 4 PHE C C 4 175.512 175.512 174.112 1.400 19497
4477 1 10 . 1 1 4 4 PHE CA C 4 55.700 55.700 55.380 0.320 19497
4478 1 10 . 1 1 4 4 PHE CB C 4 41.800 41.800 41.816 -0.016 19497
4479 1 10 . 1 1 4 4 PHE H H 4 9.390 9.390 8.724 0.666 19497
4480 1 10 . 1 1 5 5 GLU N N 5 125.826 125.826 122.570 3.256 19497
4481 1 10 . 1 1 5 5 GLU C C 5 175.679 175.679 174.980 0.699 19497
4482 1 10 . 1 1 5 5 GLU CA C 5 56.400 56.400 54.243 2.157 19497
4483 1 10 . 1 1 5 5 GLU CB C 5 29.400 29.400 33.948 -4.548 19497
4484 1 10 . 1 1 5 5 GLU H H 5 9.190 9.190 8.226 0.964 19497
4485 1 10 . 1 1 6 6 CYS N N 6 121.540 121.540 119.273 2.267 19497
4486 1 10 . 1 1 6 6 CYS C C 6 175.738 175.738 174.763 0.975 19497
4487 1 10 . 1 1 6 6 CYS CA C 6 56.100 56.100 57.470 -1.370 19497
4488 1 10 . 1 1 6 6 CYS CB C 6 28.200 28.200 28.939 -0.739 19497
4489 1 10 . 1 1 6 6 CYS H H 6 8.158 8.158 8.218 -0.060 19497
4490 1 10 . 1 1 7 7 SER N N 7 116.299 116.299 115.425 0.874 19497
4491 1 10 . 1 1 7 7 SER C C 7 173.277 173.277 172.935 0.342 19497
4492 1 10 . 1 1 7 7 SER CA C 7 58.300 58.300 57.451 0.849 19497
4493 1 10 . 1 1 7 7 SER CB C 7 64.300 64.300 66.070 -1.770 19497
4494 1 10 . 1 1 7 7 SER H H 7 7.734 7.734 8.480 -0.746 19497
4495 1 10 . 1 1 8 8 ASN N N 8 127.642 127.642 122.778 4.864 19497
4496 1 10 . 1 1 8 8 ASN C C 8 177.812 177.812 174.880 2.932 19497
4497 1 10 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.387 2.513 19497
4498 1 10 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.537 -0.337 19497
4499 1 10 . 1 1 8 8 ASN H H 8 8.006 8.006 8.591 -0.585 19497
4500 1 10 . 1 1 9 9 LYS N N 9 122.472 122.472 119.778 2.694 19497
4501 1 10 . 1 1 9 9 LYS C C 9 177.932 177.932 177.458 0.474 19497
4502 1 10 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.435 2.865 19497
4503 1 10 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.127 -0.727 19497
4504 1 10 . 1 1 9 9 LYS H H 9 8.350 8.350 8.061 0.289 19497
4505 1 10 . 1 1 10 10 THR N N 10 109.478 109.478 114.873 -5.395 19497
4506 1 10 . 1 1 10 10 THR C C 10 175.241 175.241 174.913 0.328 19497
4507 1 10 . 1 1 10 10 THR CA C 10 62.400 62.400 62.051 0.349 19497
4508 1 10 . 1 1 10 10 THR CB C 10 69.700 69.700 68.709 0.991 19497
4509 1 10 . 1 1 10 10 THR H H 10 8.486 8.486 8.508 -0.022 19497
4510 1 10 . 1 1 11 11 GLY N N 11 110.146 110.146 109.163 0.983 19497
4511 1 10 . 1 1 11 11 GLY C C 11 172.717 172.717 174.328 -1.611 19497
4512 1 10 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.998 -0.298 19497
4513 1 10 . 1 1 11 11 GLY H H 11 8.014 8.014 7.813 0.201 19497
4514 1 10 . 1 1 12 12 ARG N N 12 117.911 117.911 118.311 -0.400 19497
4515 1 10 . 1 1 12 12 ARG C C 12 173.660 173.660 175.912 -2.252 19497
4516 1 10 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.769 -1.969 19497
4517 1 10 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.450 2.950 19497
4518 1 10 . 1 1 12 12 ARG H H 12 7.342 7.342 8.198 -0.856 19497
4519 1 10 . 1 1 13 13 PHE N N 13 122.082 122.082 120.439 1.643 19497
4520 1 10 . 1 1 13 13 PHE C C 13 174.525 174.525 174.978 -0.453 19497
4521 1 10 . 1 1 13 13 PHE CA C 13 58.700 58.700 56.980 1.720 19497
4522 1 10 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.303 0.597 19497
4523 1 10 . 1 1 13 13 PHE H H 13 8.462 8.462 8.195 0.267 19497
4524 1 10 . 1 1 14 14 LEU N N 14 129.559 129.559 122.492 7.067 19497
4525 1 10 . 1 1 14 14 LEU C C 14 174.071 174.071 175.493 -1.422 19497
4526 1 10 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.314 -0.214 19497
4527 1 10 . 1 1 14 14 LEU CB C 14 45.500 45.500 43.056 2.444 19497
4528 1 10 . 1 1 14 14 LEU H H 14 8.054 8.054 7.197 0.857 19497
4529 1 10 . 1 1 15 15 ALA N N 15 126.873 126.873 130.585 -3.712 19497
4530 1 10 . 1 1 15 15 ALA C C 15 176.826 176.826 176.522 0.304 19497
4531 1 10 . 1 1 15 15 ALA CA C 15 49.900 49.900 50.623 -0.723 19497
4532 1 10 . 1 1 15 15 ALA CB C 15 20.300 20.300 20.931 -0.631 19497
4533 1 10 . 1 1 15 15 ALA H H 15 8.190 8.190 8.185 0.005 19497
4534 1 10 . 1 1 16 16 THR N N 16 120.557 120.557 119.154 1.403 19497
4535 1 10 . 1 1 16 16 THR C C 16 173.449 173.449 174.336 -0.887 19497
4536 1 10 . 1 1 16 16 THR CA C 16 61.500 61.500 62.942 -1.442 19497
4537 1 10 . 1 1 16 16 THR CB C 16 70.500 70.500 68.754 1.746 19497
4538 1 10 . 1 1 16 16 THR H H 16 9.014 9.014 8.619 0.395 19497
4539 1 10 . 1 1 17 17 GLU N N 17 129.862 129.862 125.272 4.590 19497
4540 1 10 . 1 1 17 17 GLU C C 17 175.703 175.703 175.785 -0.082 19497
4541 1 10 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.544 1.357 19497
4542 1 10 . 1 1 17 17 GLU CB C 17 29.200 29.200 31.500 -2.300 19497
4543 1 10 . 1 1 17 17 GLU H H 17 9.118 9.118 8.304 0.814 19497
4544 1 10 . 1 1 18 18 ILE N N 18 128.992 128.992 119.392 9.600 19497
4545 1 10 . 1 1 18 18 ILE C C 18 175.994 175.994 176.147 -0.153 19497
4546 1 10 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.870 -1.270 19497
4547 1 10 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.642 -1.342 19497
4548 1 10 . 1 1 18 18 ILE H H 18 8.686 8.686 8.067 0.619 19497
4549 1 10 . 1 1 19 19 VAL N N 19 127.812 127.812 118.532 9.280 19497
4550 1 10 . 1 1 19 19 VAL C C 19 175.611 175.611 176.055 -0.444 19497
4551 1 10 . 1 1 19 19 VAL CA C 19 62.700 62.700 63.691 -0.991 19497
4552 1 10 . 1 1 19 19 VAL CB C 19 32.000 32.000 30.895 1.105 19497
4553 1 10 . 1 1 19 19 VAL H H 19 8.422 8.422 8.125 0.297 19497
4554 1 10 . 1 1 20 20 ASP N N 20 123.008 123.008 120.791 2.217 19497
4555 1 10 . 1 1 20 20 ASP C C 20 175.669 175.669 175.600 0.069 19497
4556 1 10 . 1 1 20 20 ASP CA C 20 54.900 54.900 52.955 1.945 19497
4557 1 10 . 1 1 20 20 ASP CB C 20 38.500 38.500 42.922 -4.422 19497
4558 1 10 . 1 1 20 20 ASP H H 20 8.894 8.894 8.329 0.565 19497
4559 1 10 . 1 1 21 21 PHE N N 21 112.724 112.724 122.381 -9.657 19497
4560 1 10 . 1 1 21 21 PHE C C 21 174.706 174.706 175.703 -0.997 19497
4561 1 10 . 1 1 21 21 PHE CA C 21 56.200 56.200 58.022 -1.821 19497
4562 1 10 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.080 1.920 19497
4563 1 10 . 1 1 21 21 PHE H H 21 6.261 6.261 8.569 -2.308 19497
4564 1 10 . 1 1 22 22 THR N N 22 112.022 112.022 113.776 -1.754 19497
4565 1 10 . 1 1 22 22 THR C C 22 175.111 175.111 174.716 0.395 19497
4566 1 10 . 1 1 22 22 THR CA C 22 60.100 60.100 61.764 -1.665 19497
4567 1 10 . 1 1 22 22 THR H H 22 9.422 9.422 8.294 1.128 19497
4568 1 10 . 1 1 23 23 GLN N N 23 122.305 122.305 122.613 -0.308 19497
4569 1 10 . 1 1 23 23 GLN C C 23 176.564 176.564 176.968 -0.404 19497
4570 1 10 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.357 -0.757 19497
4571 1 10 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.919 -2.019 19497
4572 1 10 . 1 1 23 23 GLN H H 23 9.470 9.470 9.189 0.281 19497
4573 1 10 . 1 1 24 24 ASP N N 24 114.251 114.251 118.489 -4.238 19497
4574 1 10 . 1 1 24 24 ASP C C 24 174.839 174.839 177.094 -2.255 19497
4575 1 10 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.633 -0.933 19497
4576 1 10 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.553 -0.053 19497
4577 1 10 . 1 1 24 24 ASP H H 24 7.534 7.534 8.560 -1.026 19497
4578 1 10 . 1 1 25 25 ASP N N 25 116.046 116.046 117.230 -1.184 19497
4579 1 10 . 1 1 25 25 ASP C C 25 176.087 176.087 175.876 0.211 19497
4580 1 10 . 1 1 25 25 ASP CA C 25 54.500 54.500 54.467 0.033 19497
4581 1 10 . 1 1 25 25 ASP CB C 25 40.600 40.600 41.624 -1.024 19497
4582 1 10 . 1 1 25 25 ASP H H 25 7.454 7.454 7.955 -0.501 19497
4583 1 10 . 1 1 26 26 LEU N N 26 121.535 121.535 123.845 -2.310 19497
4584 1 10 . 1 1 26 26 LEU C C 26 176.343 176.343 176.145 0.198 19497
4585 1 10 . 1 1 26 26 LEU CA C 26 55.000 55.000 54.241 0.759 19497
4586 1 10 . 1 1 26 26 LEU CB C 26 41.300 41.300 40.630 0.670 19497
4587 1 10 . 1 1 26 26 LEU H H 26 8.014 8.014 7.330 0.684 19497
4588 1 10 . 1 1 27 27 ASP N N 27 127.804 127.804 125.570 2.234 19497
4589 1 10 . 1 1 27 27 ASP C C 27 176.947 176.947 176.689 0.258 19497
4590 1 10 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.488 0.512 19497
4591 1 10 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.420 0.980 19497
4592 1 10 . 1 1 27 27 ASP H H 27 8.326 8.326 7.784 0.542 19497
4593 1 10 . 1 1 28 28 GLU N N 28 123.641 123.641 119.377 4.264 19497
4594 1 10 . 1 1 28 28 GLU C C 28 176.141 176.141 176.154 -0.013 19497
4595 1 10 . 1 1 28 28 GLU CA C 28 54.500 54.500 57.752 -3.252 19497
4596 1 10 . 1 1 28 28 GLU CB C 28 32.700 32.700 30.131 2.569 19497
4597 1 10 . 1 1 28 28 GLU H H 28 8.278 8.278 8.723 -0.445 19497
4598 1 10 . 1 1 29 29 ASN N N 29 120.901 120.901 117.627 3.274 19497
4599 1 10 . 1 1 29 29 ASN C C 29 174.383 174.383 174.096 0.287 19497
4600 1 10 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.848 4.452 19497
4601 1 10 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.200 0.100 19497
4602 1 10 . 1 1 29 29 ASN H H 29 8.022 8.022 8.336 -0.314 19497
4603 1 10 . 1 1 30 30 ASP N N 30 125.016 125.016 119.621 5.395 19497
4604 1 10 . 1 1 30 30 ASP C C 30 175.679 175.679 173.635 2.044 19497
4605 1 10 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.261 -0.961 19497
4606 1 10 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.347 -3.347 19497
4607 1 10 . 1 1 30 30 ASP H H 30 8.142 8.142 7.737 0.405 19497
4608 1 10 . 1 1 31 31 VAL N N 31 121.540 121.540 118.906 2.634 19497
4609 1 10 . 1 1 31 31 VAL C C 31 175.675 175.675 174.621 1.054 19497
4610 1 10 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.544 0.456 19497
4611 1 10 . 1 1 31 31 VAL CB C 31 32.800 32.800 34.222 -1.422 19497
4612 1 10 . 1 1 31 31 VAL H H 31 8.158 8.158 8.652 -0.494 19497
4613 1 10 . 1 1 32 32 TYR N N 32 126.116 126.116 125.769 0.347 19497
4614 1 10 . 1 1 32 32 TYR C C 32 173.449 173.449 174.502 -1.053 19497
4615 1 10 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.453 -0.453 19497
4616 1 10 . 1 1 32 32 TYR H H 32 8.294 8.294 8.999 -0.705 19497
4617 1 10 . 1 1 33 33 LEU N N 33 121.235 121.235 116.052 5.183 19497
4618 1 10 . 1 1 33 33 LEU C C 33 174.948 174.948 174.932 0.016 19497
4619 1 10 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.517 -0.217 19497
4620 1 10 . 1 1 33 33 LEU CB C 33 45.700 45.700 44.667 1.033 19497
4621 1 10 . 1 1 33 33 LEU H H 33 9.142 9.142 8.064 1.078 19497
4622 1 10 . 1 1 34 34 LEU N N 34 127.452 127.452 122.590 4.862 19497
4623 1 10 . 1 1 34 34 LEU C C 34 174.084 174.084 175.321 -1.237 19497
4624 1 10 . 1 1 34 34 LEU CA C 34 53.200 53.200 53.932 -0.732 19497
4625 1 10 . 1 1 34 34 LEU CB C 34 44.700 44.700 43.265 1.435 19497
4626 1 10 . 1 1 34 34 LEU H H 34 9.686 9.686 7.968 1.718 19497
4627 1 10 . 1 1 35 35 ASP N N 35 126.977 126.977 126.960 0.017 19497
4628 1 10 . 1 1 35 35 ASP C C 35 177.009 177.009 175.973 1.036 19497
4629 1 10 . 1 1 35 35 ASP CA C 35 52.600 52.600 54.582 -1.982 19497
4630 1 10 . 1 1 35 35 ASP CB C 35 41.400 41.400 40.848 0.552 19497
4631 1 10 . 1 1 35 35 ASP H H 35 9.446 9.446 8.407 1.039 19497
4632 1 10 . 1 1 36 36 THR N N 36 118.735 118.735 119.851 -1.116 19497
4633 1 10 . 1 1 36 36 THR C C 36 175.252 175.252 175.686 -0.434 19497
4634 1 10 . 1 1 36 36 THR CA C 36 60.500 60.500 61.283 -0.783 19497
4635 1 10 . 1 1 36 36 THR CB C 36 68.000 68.000 70.016 -2.016 19497
4636 1 10 . 1 1 36 36 THR H H 36 8.310 8.310 8.024 0.286 19497
4637 1 10 . 1 1 37 37 TRP N N 37 122.289 122.289 124.060 -1.771 19497
4638 1 10 . 1 1 37 37 TRP C C 37 177.189 177.189 177.523 -0.334 19497
4639 1 10 . 1 1 37 37 TRP CA C 37 61.500 61.500 60.657 0.843 19497
4640 1 10 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.547 -0.747 19497
4641 1 10 . 1 1 37 37 TRP H H 37 9.022 9.022 8.789 0.233 19497
4642 1 10 . 1 1 38 38 ASP N N 38 117.370 117.370 116.344 1.026 19497
4643 1 10 . 1 1 38 38 ASP C C 38 175.290 175.290 176.542 -1.252 19497
4644 1 10 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.298 0.102 19497
4645 1 10 . 1 1 38 38 ASP CB C 38 41.100 41.100 39.863 1.237 19497
4646 1 10 . 1 1 38 38 ASP H H 38 8.518 8.518 8.149 0.369 19497
4647 1 10 . 1 1 39 39 GLN N N 39 111.522 111.522 120.208 -8.686 19497
4648 1 10 . 1 1 39 39 GLN C C 39 173.099 173.099 175.133 -2.034 19497
4649 1 10 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.614 -1.115 19497
4650 1 10 . 1 1 39 39 GLN CB C 39 28.900 28.900 28.546 0.354 19497
4651 1 10 . 1 1 39 39 GLN H H 39 7.118 7.118 7.948 -0.830 19497
4652 1 10 . 1 1 40 40 ILE N N 40 121.103 121.103 125.978 -4.875 19497
4653 1 10 . 1 1 40 40 ILE C C 40 174.406 174.406 174.878 -0.472 19497
4654 1 10 . 1 1 40 40 ILE CA C 40 58.900 58.900 60.775 -1.875 19497
4655 1 10 . 1 1 40 40 ILE CB C 40 38.900 38.900 38.025 0.875 19497
4656 1 10 . 1 1 40 40 ILE H H 40 8.422 8.422 7.764 0.658 19497
4657 1 10 . 1 1 41 41 PHE N N 41 123.856 123.856 125.802 -1.946 19497
4658 1 10 . 1 1 41 41 PHE C C 41 174.537 174.537 175.467 -0.930 19497
4659 1 10 . 1 1 41 41 PHE CA C 41 55.900 55.900 57.459 -1.559 19497
4660 1 10 . 1 1 41 41 PHE CB C 41 42.200 42.200 42.161 0.039 19497
4661 1 10 . 1 1 41 41 PHE H H 41 9.222 9.222 8.135 1.087 19497
4662 1 10 . 1 1 42 42 PHE N N 42 127.400 127.400 119.829 7.571 19497
4663 1 10 . 1 1 42 42 PHE C C 42 173.021 173.021 175.208 -2.187 19497
4664 1 10 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.985 -0.685 19497
4665 1 10 . 1 1 42 42 PHE CB C 42 42.300 42.300 40.900 1.400 19497
4666 1 10 . 1 1 42 42 PHE H H 42 9.358 9.358 9.055 0.303 19497
4667 1 10 . 1 1 43 43 TRP N N 43 129.616 129.616 126.197 3.419 19497
4668 1 10 . 1 1 43 43 TRP C C 43 174.538 174.538 176.716 -2.178 19497
4669 1 10 . 1 1 43 43 TRP CA C 43 61.600 61.600 56.819 4.781 19497
4670 1 10 . 1 1 43 43 TRP CB C 43 38.200 38.200 28.305 9.895 19497
4671 1 10 . 1 1 43 43 TRP H H 43 9.646 9.646 8.916 0.730 19497
4672 1 10 . 1 1 44 44 ILE N N 44 121.402 121.402 126.490 -5.088 19497
4673 1 10 . 1 1 44 44 ILE C C 44 175.738 175.738 175.928 -0.190 19497
4674 1 10 . 1 1 44 44 ILE CA C 44 57.600 57.600 62.906 -5.306 19497
4675 1 10 . 1 1 44 44 ILE CB C 44 39.100 39.100 37.530 1.570 19497
4676 1 10 . 1 1 44 44 ILE H H 44 7.838 7.838 7.915 -0.077 19497
4677 1 10 . 1 1 45 45 GLY N N 45 114.403 114.403 111.043 3.360 19497
4678 1 10 . 1 1 45 45 GLY C C 45 175.519 175.519 172.794 2.725 19497
4679 1 10 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.154 2.346 19497
4680 1 10 . 1 1 45 45 GLY H H 45 7.742 7.742 8.209 -0.467 19497
4681 1 10 . 1 1 46 46 LYS N N 46 123.585 123.585 119.112 4.473 19497
4682 1 10 . 1 1 46 46 LYS C C 46 177.790 177.790 177.499 0.291 19497
4683 1 10 . 1 1 46 46 LYS CA C 46 58.700 58.700 57.031 1.669 19497
4684 1 10 . 1 1 46 46 LYS CB C 46 32.200 32.200 33.849 -1.649 19497
4685 1 10 . 1 1 46 46 LYS H H 46 8.942 8.942 7.877 1.065 19497
4686 1 10 . 1 1 47 47 GLY N N 47 107.819 107.819 106.885 0.934 19497
4687 1 10 . 1 1 47 47 GLY C C 47 174.298 174.298 174.088 0.210 19497
4688 1 10 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.608 -0.308 19497
4689 1 10 . 1 1 47 47 GLY H H 47 8.670 8.670 7.788 0.882 19497
4690 1 10 . 1 1 48 48 ALA N N 48 123.965 123.965 123.011 0.954 19497
4691 1 10 . 1 1 48 48 ALA C C 48 177.189 177.189 176.520 0.669 19497
4692 1 10 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.384 0.716 19497
4693 1 10 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.896 -0.896 19497
4694 1 10 . 1 1 48 48 ALA H H 48 7.230 7.230 7.578 -0.348 19497
4695 1 10 . 1 1 49 49 ASN N N 49 119.667 119.667 116.491 3.176 19497
4696 1 10 . 1 1 49 49 ASN C C 49 175.797 175.797 176.740 -0.943 19497
4697 1 10 . 1 1 49 49 ASN CA C 49 54.200 54.200 52.159 2.041 19497
4698 1 10 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.787 1.313 19497
4699 1 10 . 1 1 49 49 ASN H H 49 8.526 8.526 8.279 0.247 19497
4700 1 10 . 1 1 50 50 GLU N N 50 112.272 112.272 123.227 -10.955 19497
4701 1 10 . 1 1 50 50 GLU C C 50 178.128 178.128 178.282 -0.154 19497
4702 1 10 . 1 1 50 50 GLU CA C 50 59.600 59.600 59.047 0.553 19497
4703 1 10 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.689 -0.389 19497
4704 1 10 . 1 1 50 50 GLU H H 50 7.814 7.814 9.012 -1.198 19497
4705 1 10 . 1 1 51 51 SER N N 51 113.952 113.952 115.992 -2.040 19497
4706 1 10 . 1 1 51 51 SER C C 51 177.874 177.874 176.547 1.327 19497
4707 1 10 . 1 1 51 51 SER CA C 51 61.100 61.100 61.761 -0.661 19497
4708 1 10 . 1 1 51 51 SER CB C 51 60.900 60.900 63.150 -2.250 19497
4709 1 10 . 1 1 51 51 SER H H 51 8.342 8.342 7.900 0.442 19497
4710 1 10 . 1 1 52 52 GLU N N 52 119.930 119.930 119.544 0.386 19497
4711 1 10 . 1 1 52 52 GLU C C 52 178.827 178.827 177.274 1.553 19497
4712 1 10 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.323 -0.423 19497
4713 1 10 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.725 -0.425 19497
4714 1 10 . 1 1 52 52 GLU H H 52 7.806 7.806 8.411 -0.605 19497
4715 1 10 . 1 1 53 53 LYS N N 53 118.112 118.112 118.292 -0.180 19497
4716 1 10 . 1 1 53 53 LYS C C 53 178.802 178.802 178.194 0.608 19497
4717 1 10 . 1 1 53 53 LYS CA C 53 60.000 60.000 57.757 2.243 19497
4718 1 10 . 1 1 53 53 LYS CB C 53 32.200 32.200 33.081 -0.881 19497
4719 1 10 . 1 1 53 53 LYS H H 53 7.670 7.670 7.810 -0.140 19497
4720 1 10 . 1 1 54 54 GLU N N 54 117.700 117.700 118.971 -1.271 19497
4721 1 10 . 1 1 54 54 GLU C C 54 177.733 177.733 177.650 0.083 19497
4722 1 10 . 1 1 54 54 GLU CA C 54 58.200 58.200 57.994 0.206 19497
4723 1 10 . 1 1 54 54 GLU CB C 54 29.300 29.300 30.083 -0.783 19497
4724 1 10 . 1 1 54 54 GLU H H 54 7.934 7.934 8.071 -0.137 19497
4725 1 10 . 1 1 55 55 ALA N N 55 120.395 120.395 121.267 -0.872 19497
4726 1 10 . 1 1 55 55 ALA CA C 55 52.200 52.200 51.101 1.099 19497
4727 1 10 . 1 1 55 55 ALA CB C 55 17.200 17.200 18.418 -1.218 19497
4728 1 10 . 1 1 55 55 ALA H H 55 7.238 7.238 7.849 -0.611 19497
4729 1 10 . 1 1 56 56 ALA C C 56 177.526 177.526 178.355 -0.829 19497
4730 1 10 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.960 0.640 19497
4731 1 10 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.541 1.059 19497
4732 1 10 . 1 1 57 57 ALA N N 57 117.753 117.753 116.843 0.910 19497
4733 1 10 . 1 1 57 57 ALA C C 57 180.072 180.072 178.767 1.305 19497
4734 1 10 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.497 1.703 19497
4735 1 10 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.061 -0.661 19497
4736 1 10 . 1 1 57 57 ALA H H 57 7.990 7.990 8.357 -0.367 19497
4737 1 10 . 1 1 58 58 GLU N N 58 118.444 118.444 118.142 0.302 19497
4738 1 10 . 1 1 58 58 GLU C C 58 179.225 179.225 178.191 1.034 19497
4739 1 10 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.038 1.562 19497
4740 1 10 . 1 1 58 58 GLU CB C 58 28.900 28.900 30.257 -1.357 19497
4741 1 10 . 1 1 58 58 GLU H H 58 7.582 7.582 7.803 -0.221 19497
4742 1 10 . 1 1 59 59 THR N N 59 119.842 119.842 117.024 2.818 19497
4743 1 10 . 1 1 59 59 THR C C 59 175.781 175.781 175.922 -0.141 19497
4744 1 10 . 1 1 59 59 THR CA C 59 66.200 66.200 65.699 0.501 19497
4745 1 10 . 1 1 59 59 THR CB C 59 67.600 67.600 68.259 -0.659 19497
4746 1 10 . 1 1 59 59 THR H H 59 8.422 8.422 8.330 0.092 19497
4747 1 10 . 1 1 60 60 ALA N N 60 122.454 122.454 125.100 -2.646 19497
4748 1 10 . 1 1 60 60 ALA C C 60 178.583 178.583 178.837 -0.254 19497
4749 1 10 . 1 1 60 60 ALA CA C 60 55.200 55.200 55.609 -0.409 19497
4750 1 10 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.860 0.239 19497
4751 1 10 . 1 1 60 60 ALA H H 60 7.966 7.966 7.865 0.101 19497
4752 1 10 . 1 1 61 61 GLN N N 61 115.462 115.462 118.493 -3.031 19497
4753 1 10 . 1 1 61 61 GLN C C 61 178.101 178.101 178.551 -0.450 19497
4754 1 10 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.778 0.122 19497
4755 1 10 . 1 1 61 61 GLN CB C 61 28.100 28.100 27.928 0.172 19497
4756 1 10 . 1 1 61 61 GLN H H 61 7.598 7.598 8.274 -0.676 19497
4757 1 10 . 1 1 62 62 GLU N N 62 120.883 120.883 121.234 -0.351 19497
4758 1 10 . 1 1 62 62 GLU C C 62 174.071 174.071 178.930 -4.859 19497
4759 1 10 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.485 -5.385 19497
4760 1 10 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.560 0.740 19497
4761 1 10 . 1 1 62 62 GLU H H 62 7.910 7.910 7.979 -0.069 19497
4762 1 10 . 1 1 63 63 TYR N N 63 118.888 118.888 120.143 -1.255 19497
4763 1 10 . 1 1 63 63 TYR C C 63 177.874 177.874 177.489 0.385 19497
4764 1 10 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.564 0.536 19497
4765 1 10 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.785 0.715 19497
4766 1 10 . 1 1 63 63 TYR H H 63 8.182 8.182 8.109 0.073 19497
4767 1 10 . 1 1 64 64 LEU N N 64 119.930 119.930 120.279 -0.349 19497
4768 1 10 . 1 1 64 64 LEU C C 64 178.536 178.536 178.641 -0.105 19497
4769 1 10 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.966 -0.066 19497
4770 1 10 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.823 -2.923 19497
4771 1 10 . 1 1 64 64 LEU H H 64 7.806 7.806 7.849 -0.043 19497
4772 1 10 . 1 1 65 65 ARG N N 65 117.322 117.322 117.274 0.048 19497
4773 1 10 . 1 1 65 65 ARG C C 65 177.436 177.436 177.534 -0.098 19497
4774 1 10 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.447 0.153 19497
4775 1 10 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.546 -0.146 19497
4776 1 10 . 1 1 65 65 ARG H H 65 8.054 8.054 8.173 -0.119 19497
4777 1 10 . 1 1 66 66 SER N N 66 111.783 111.783 111.329 0.454 19497
4778 1 10 . 1 1 66 66 SER C C 66 173.652 173.652 174.356 -0.704 19497
4779 1 10 . 1 1 66 66 SER CA C 66 58.900 58.900 58.544 0.356 19497
4780 1 10 . 1 1 66 66 SER CB C 66 63.800 63.800 63.745 0.055 19497
4781 1 10 . 1 1 66 66 SER H H 66 7.550 7.550 7.617 -0.067 19497
4782 1 10 . 1 1 67 67 HIS N N 67 124.135 124.135 124.313 -0.178 19497
4783 1 10 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.773 -0.072 19497
4784 1 10 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.513 -1.313 19497
4785 1 10 . 1 1 67 67 HIS H H 67 7.134 7.134 7.709 -0.575 19497
4786 1 10 . 1 1 68 68 PRO C C 68 178.101 178.101 177.217 0.884 19497
4787 1 10 . 1 1 68 68 PRO CA C 68 58.900 58.900 64.417 -5.517 19497
4788 1 10 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.558 -1.658 19497
4789 1 10 . 1 1 69 69 GLY N N 69 115.697 115.697 105.615 10.082 19497
4790 1 10 . 1 1 69 69 GLY C C 69 176.641 176.641 174.979 1.662 19497
4791 1 10 . 1 1 69 69 GLY CA C 69 45.000 45.000 45.123 -0.123 19497
4792 1 10 . 1 1 69 69 GLY H H 69 7.926 7.926 7.351 0.575 19497
4793 1 10 . 1 1 70 70 SER N N 70 115.440 115.440 114.734 0.706 19497
4794 1 10 . 1 1 70 70 SER C C 70 173.277 173.277 174.399 -1.122 19497
4795 1 10 . 1 1 70 70 SER CA C 70 58.300 58.300 58.588 -0.288 19497
4796 1 10 . 1 1 70 70 SER CB C 70 64.300 64.300 62.195 2.105 19497
4797 1 10 . 1 1 70 70 SER H H 70 8.030 8.030 7.993 0.037 19497
4798 1 10 . 1 1 71 71 ARG N N 71 127.642 127.642 119.687 7.955 19497
4799 1 10 . 1 1 71 71 ARG C C 71 175.849 175.849 175.350 0.499 19497
4800 1 10 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.649 -1.749 19497
4801 1 10 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.676 0.224 19497
4802 1 10 . 1 1 71 71 ARG H H 71 8.006 8.006 7.928 0.078 19497
4803 1 10 . 1 1 72 72 ASP N N 72 120.975 120.975 120.146 0.829 19497
4804 1 10 . 1 1 72 72 ASP C C 72 176.087 176.087 174.593 1.494 19497
4805 1 10 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.375 0.125 19497
4806 1 10 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.539 -0.639 19497
4807 1 10 . 1 1 72 72 ASP H H 72 8.182 8.182 8.391 -0.209 19497
4808 1 10 . 1 1 73 73 LEU N N 73 121.535 121.535 122.051 -0.516 19497
4809 1 10 . 1 1 73 73 LEU C C 73 177.020 177.020 176.772 0.248 19497
4810 1 10 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.276 0.724 19497
4811 1 10 . 1 1 73 73 LEU CB C 73 42.000 42.000 42.536 -0.536 19497
4812 1 10 . 1 1 73 73 LEU H H 73 8.014 8.014 8.198 -0.184 19497
4813 1 10 . 1 1 74 74 ASP N N 74 120.525 120.525 119.327 1.198 19497
4814 1 10 . 1 1 74 74 ASP C C 74 175.797 175.797 175.626 0.171 19497
4815 1 10 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.552 0.648 19497
4816 1 10 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.067 -0.067 19497
4817 1 10 . 1 1 74 74 ASP H H 74 8.134 8.134 8.073 0.061 19497
4818 1 10 . 1 1 75 75 THR N N 75 116.656 116.656 117.690 -1.034 19497
4819 1 10 . 1 1 75 75 THR CA C 75 59.700 59.700 61.234 -1.534 19497
4820 1 10 . 1 1 75 75 THR CB C 75 69.600 69.600 68.720 0.880 19497
4821 1 10 . 1 1 75 75 THR H H 75 7.814 7.814 7.986 -0.172 19497
4822 1 10 . 1 1 76 76 PRO C C 76 174.538 174.538 175.632 -1.094 19497
4823 1 10 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.584 0.916 19497
4824 1 10 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.263 0.337 19497
4825 1 10 . 1 1 77 77 ILE N N 77 121.402 121.402 122.043 -0.641 19497
4826 1 10 . 1 1 77 77 ILE C C 77 176.132 176.132 175.255 0.877 19497
4827 1 10 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.607 -1.507 19497
4828 1 10 . 1 1 77 77 ILE CB C 77 39.000 39.000 40.493 -1.493 19497
4829 1 10 . 1 1 77 77 ILE H H 77 7.838 7.838 8.100 -0.262 19497
4830 1 10 . 1 1 78 78 ILE N N 78 130.292 130.292 128.910 1.382 19497
4831 1 10 . 1 1 78 78 ILE C C 78 175.084 175.084 174.355 0.729 19497
4832 1 10 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.052 0.848 19497
4833 1 10 . 1 1 78 78 ILE CB C 78 39.000 39.000 40.876 -1.876 19497
4834 1 10 . 1 1 78 78 ILE H H 78 8.910 8.910 8.894 0.016 19497
4835 1 10 . 1 1 79 79 VAL N N 79 129.237 129.237 125.297 3.940 19497
4836 1 10 . 1 1 79 79 VAL C C 79 175.907 175.907 175.680 0.227 19497
4837 1 10 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.468 1.732 19497
4838 1 10 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.586 -0.885 19497
4839 1 10 . 1 1 79 79 VAL H H 79 8.670 8.670 8.552 0.118 19497
4840 1 10 . 1 1 80 80 VAL N N 80 128.354 128.354 127.285 1.069 19497
4841 1 10 . 1 1 80 80 VAL C C 80 172.823 172.823 174.616 -1.793 19497
4842 1 10 . 1 1 80 80 VAL CA C 80 59.400 59.400 59.906 -0.506 19497
4843 1 10 . 1 1 80 80 VAL CB C 80 32.600 32.600 34.022 -1.422 19497
4844 1 10 . 1 1 80 80 VAL H H 80 9.598 9.598 8.319 1.279 19497
4845 1 10 . 1 1 81 81 LYS N N 81 123.077 123.077 120.366 2.711 19497
4846 1 10 . 1 1 81 81 LYS C C 81 178.101 178.101 174.501 3.600 19497
4847 1 10 . 1 1 81 81 LYS CA C 81 54.400 54.400 54.275 0.125 19497
4848 1 10 . 1 1 81 81 LYS CB C 81 34.300 34.300 35.741 -1.441 19497
4849 1 10 . 1 1 81 81 LYS H H 81 8.198 8.198 8.238 -0.040 19497
4850 1 10 . 1 1 82 82 GLN N N 82 121.436 121.436 120.008 1.428 19497
4851 1 10 . 1 1 82 82 GLN C C 82 177.068 177.068 176.349 0.719 19497
4852 1 10 . 1 1 82 82 GLN CA C 82 56.200 56.200 56.917 -0.717 19497
4853 1 10 . 1 1 82 82 GLN CB C 82 29.400 29.400 27.149 2.251 19497
4854 1 10 . 1 1 82 82 GLN H H 82 7.910 7.910 8.411 -0.501 19497
4855 1 10 . 1 1 83 83 GLY N N 83 110.688 110.688 112.990 -2.302 19497
4856 1 10 . 1 1 83 83 GLY C C 83 173.348 173.348 174.443 -1.095 19497
4857 1 10 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.941 0.059 19497
4858 1 10 . 1 1 83 83 GLY H H 83 8.382 8.382 8.298 0.084 19497
4859 1 10 . 1 1 84 84 PHE N N 84 119.493 119.493 122.183 -2.690 19497
4860 1 10 . 1 1 84 84 PHE C C 84 175.035 175.035 174.742 0.293 19497
4861 1 10 . 1 1 84 84 PHE CA C 84 57.300 57.300 55.730 1.570 19497
4862 1 10 . 1 1 84 84 PHE CB C 84 42.200 42.200 38.452 3.748 19497
4863 1 10 . 1 1 84 84 PHE H H 84 7.910 7.910 7.329 0.581 19497
4864 1 10 . 1 1 85 85 GLU N N 85 124.672 124.672 124.324 0.348 19497
4865 1 10 . 1 1 85 85 GLU CA C 85 59.000 59.000 53.910 5.090 19497
4866 1 10 . 1 1 85 85 GLU CB C 85 29.700 29.700 30.464 -0.764 19497
4867 1 10 . 1 1 85 85 GLU H H 85 8.142 8.142 8.385 -0.243 19497
4868 1 10 . 1 1 87 87 PRO C C 87 178.284 178.284 176.777 1.507 19497
4869 1 10 . 1 1 87 87 PRO CA C 87 64.100 64.100 64.246 -0.146 19497
4870 1 10 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.970 -0.870 19497
4871 1 10 . 1 1 88 88 THR N N 88 106.959 106.959 111.560 -4.601 19497
4872 1 10 . 1 1 88 88 THR C C 88 174.182 174.182 174.009 0.173 19497
4873 1 10 . 1 1 88 88 THR CA C 88 62.900 62.900 60.727 2.174 19497
4874 1 10 . 1 1 88 88 THR CB C 88 68.000 68.000 68.675 -0.675 19497
4875 1 10 . 1 1 88 88 THR H H 88 7.110 7.110 7.767 -0.657 19497
4876 1 10 . 1 1 89 89 PHE N N 89 118.766 118.766 121.195 -2.429 19497
4877 1 10 . 1 1 89 89 PHE C C 89 175.468 175.468 175.644 -0.176 19497
4878 1 10 . 1 1 89 89 PHE CA C 89 59.800 59.800 60.159 -0.359 19497
4879 1 10 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.789 0.911 19497
4880 1 10 . 1 1 89 89 PHE H H 89 7.198 7.198 7.634 -0.436 19497
4881 1 10 . 1 1 90 90 THR N N 90 107.050 107.050 113.656 -6.606 19497
4882 1 10 . 1 1 90 90 THR C C 90 177.260 177.260 175.572 1.688 19497
4883 1 10 . 1 1 90 90 THR CA C 90 64.600 64.600 61.397 3.203 19497
4884 1 10 . 1 1 90 90 THR CB C 90 67.900 67.900 67.007 0.893 19497
4885 1 10 . 1 1 90 90 THR H H 90 7.446 7.446 7.912 -0.466 19497
4886 1 10 . 1 1 91 91 GLY N N 91 106.738 106.738 109.660 -2.922 19497
4887 1 10 . 1 1 91 91 GLY C C 91 174.422 174.422 174.852 -0.430 19497
4888 1 10 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.312 0.688 19497
4889 1 10 . 1 1 91 91 GLY H H 91 7.646 7.646 8.615 -0.969 19497
4890 1 10 . 1 1 92 92 TRP N N 92 117.500 117.500 120.165 -2.665 19497
4891 1 10 . 1 1 92 92 TRP C C 92 174.209 174.209 176.444 -2.235 19497
4892 1 10 . 1 1 92 92 TRP CA C 92 56.900 56.900 58.168 -1.268 19497
4893 1 10 . 1 1 92 92 TRP CB C 92 29.400 29.400 28.989 0.411 19497
4894 1 10 . 1 1 92 92 TRP H H 92 6.790 6.790 7.436 -0.646 19497
4895 1 10 . 1 1 93 93 PHE N N 93 119.092 119.092 116.583 2.509 19497
4896 1 10 . 1 1 93 93 PHE C C 93 175.953 175.953 176.549 -0.596 19497
4897 1 10 . 1 1 93 93 PHE CA C 93 56.700 56.700 58.292 -1.592 19497
4898 1 10 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.651 0.649 19497
4899 1 10 . 1 1 93 93 PHE H H 93 7.750 7.750 7.451 0.299 19497
4900 1 10 . 1 1 94 94 MET N N 94 121.554 121.554 122.128 -0.574 19497
4901 1 10 . 1 1 94 94 MET C C 94 175.738 175.738 176.498 -0.760 19497
4902 1 10 . 1 1 94 94 MET CA C 94 57.600 57.600 55.914 1.686 19497
4903 1 10 . 1 1 94 94 MET CB C 94 32.000 32.000 33.138 -1.138 19497
4904 1 10 . 1 1 94 94 MET H H 94 8.654 8.654 8.656 -0.002 19497
4905 1 10 . 1 1 95 95 ALA N N 95 119.777 119.777 124.231 -4.454 19497
4906 1 10 . 1 1 95 95 ALA C C 95 175.441 175.441 175.489 -0.048 19497
4907 1 10 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.905 -0.605 19497
4908 1 10 . 1 1 95 95 ALA CB C 95 20.700 20.700 19.227 1.473 19497
4909 1 10 . 1 1 95 95 ALA H H 95 7.750 7.750 8.195 -0.445 19497
4910 1 10 . 1 1 96 96 TRP N N 96 120.813 120.813 122.741 -1.928 19497
4911 1 10 . 1 1 96 96 TRP C C 96 175.488 175.488 174.467 1.021 19497
4912 1 10 . 1 1 96 96 TRP CA C 96 57.700 57.700 56.125 1.575 19497
4913 1 10 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.557 -0.157 19497
4914 1 10 . 1 1 96 96 TRP H H 96 8.254 8.254 8.019 0.235 19497
4915 1 10 . 1 1 97 97 ASP N N 97 117.140 117.140 129.011 -11.871 19497
4916 1 10 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.928 2.772 19497
4917 1 10 . 1 1 97 97 ASP CB C 97 39.600 39.600 42.958 -3.358 19497
4918 1 10 . 1 1 97 97 ASP H H 97 8.958 8.958 8.041 0.917 19497
4919 1 10 . 1 1 98 98 PRO C C 98 174.071 174.071 176.261 -2.190 19497
4920 1 10 . 1 1 98 98 PRO CA C 98 63.100 63.100 64.947 -1.847 19497
4921 1 10 . 1 1 98 98 PRO CB C 98 32.400 32.400 31.783 0.617 19497
4922 1 10 . 1 1 99 99 LEU N N 99 118.888 118.888 114.720 4.168 19497
4923 1 10 . 1 1 99 99 LEU C C 99 177.519 177.519 176.541 0.978 19497
4924 1 10 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.062 0.339 19497
4925 1 10 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.183 -0.683 19497
4926 1 10 . 1 1 99 99 LEU H H 99 8.182 8.182 7.682 0.500 19497
4927 1 10 . 1 1 100 100 CYS N N 100 118.788 118.788 117.396 1.392 19497
4928 1 10 . 1 1 100 100 CYS C C 100 174.685 174.685 173.419 1.266 19497
4929 1 10 . 1 1 100 100 CYS CA C 100 60.800 60.800 58.242 2.558 19497
4930 1 10 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.250 0.150 19497
4931 1 10 . 1 1 100 100 CYS H H 100 6.862 6.862 7.015 -0.153 19497
4932 1 10 . 1 1 101 101 TRP N N 101 117.558 117.558 122.004 -4.446 19497
4933 1 10 . 1 1 101 101 TRP C C 101 176.478 176.478 174.536 1.942 19497
4934 1 10 . 1 1 101 101 TRP CA C 101 54.400 54.400 55.698 -1.298 19497
4935 1 10 . 1 1 101 101 TRP CB C 101 28.200 28.200 31.143 -2.943 19497
4936 1 10 . 1 1 101 101 TRP H H 101 7.662 7.662 6.447 1.215 19497
4937 1 10 . 1 1 102 102 SER N N 102 115.626 115.626 117.218 -1.592 19497
4938 1 10 . 1 1 102 102 SER C C 102 174.303 174.303 173.615 0.688 19497
4939 1 10 . 1 1 102 102 SER CA C 102 58.900 58.900 57.723 1.177 19497
4940 1 10 . 1 1 102 102 SER CB C 102 63.700 63.700 66.087 -2.387 19497
4941 1 10 . 1 1 102 102 SER H H 102 7.734 7.734 8.195 -0.461 19497
4942 1 10 . 1 1 103 103 ASP N N 103 121.936 121.936 118.369 3.567 19497
4943 1 10 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.732 -0.332 19497
4944 1 10 . 1 1 103 103 ASP CB C 103 40.600 40.600 40.445 0.155 19497
4945 1 10 . 1 1 103 103 ASP H H 103 8.254 8.254 8.718 -0.464 19497
4946 1 10 . 1 1 104 104 ARG N N 104 120.567 120.567 119.397 1.170 19497
4947 1 10 . 1 1 104 104 ARG C C 104 176.177 176.177 176.532 -0.355 19497
4948 1 10 . 1 1 104 104 ARG CA C 104 56.000 56.000 56.771 -0.771 19497
4949 1 10 . 1 1 104 104 ARG CB C 104 30.300 30.300 30.713 -0.413 19497
4950 1 10 . 1 1 104 104 ARG H H 104 7.910 7.910 7.942 -0.032 19497
4951 1 10 . 1 1 105 105 LYS N N 105 121.805 121.805 119.450 2.355 19497
4952 1 10 . 1 1 105 105 LYS C C 105 176.141 176.141 175.989 0.152 19497
4953 1 10 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.694 -1.594 19497
4954 1 10 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.306 -0.506 19497
4955 1 10 . 1 1 105 105 LYS H H 105 8.094 8.094 8.191 -0.097 19497
4956 1 10 . 1 1 106 106 SER N N 106 116.792 116.792 110.341 6.451 19497
4957 1 10 . 1 1 106 106 SER C C 106 172.841 172.841 172.859 -0.018 19497
4958 1 10 . 1 1 106 106 SER CA C 106 57.900 57.900 57.895 0.006 19497
4959 1 10 . 1 1 106 106 SER CB C 106 63.800 63.800 63.325 0.475 19497
4960 1 10 . 1 1 106 106 SER H H 106 8.030 8.030 7.662 0.368 19497
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 99 4.077 0.062 4.097 19497
2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 19497
3 1 1 "Average Difference" C 98 1.287 0.276 1.264 19497
4 1 1 "Average Difference" CA 104 1.682 0.198 1.678 19497
5 1 1 "Average Difference" CB 96 1.692 -0.027 1.701 19497
6 1 1 "Average Difference" HN 99 0.610 0.026 0.613 19497
7 1 2 "Average Difference" N 99 3.907 -0.137 3.924 19497
8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 19497
9 1 2 "Average Difference" C 98 1.185 -0.054 1.190 19497
10 1 2 "Average Difference" CA 104 1.647 -0.246 1.636 19497
11 1 2 "Average Difference" CB 96 1.739 0.197 1.737 19497
12 1 2 "Average Difference" HN 99 0.609 -0.068 0.608 19497
13 1 3 "Average Difference" N 99 3.816 -0.238 3.828 19497
14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 19497
15 1 3 "Average Difference" C 98 1.220 0.075 1.224 19497
16 1 3 "Average Difference" CA 104 1.526 -0.001 1.533 19497
17 1 3 "Average Difference" CB 96 1.751 0.166 1.753 19497
18 1 3 "Average Difference" HN 99 0.595 -0.012 0.598 19497
19 1 4 "Average Difference" N 99 3.982 -0.266 3.994 19497
20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 19497
21 1 4 "Average Difference" C 98 1.304 0.015 1.310 19497
22 1 4 "Average Difference" CA 104 1.547 -0.076 1.553 19497
23 1 4 "Average Difference" CB 96 1.788 0.081 1.796 19497
24 1 4 "Average Difference" HN 99 0.590 -0.055 0.591 19497
25 1 5 "Average Difference" N 99 4.191 -0.228 4.206 19497
26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 19497
27 1 5 "Average Difference" C 98 1.205 0.101 1.207 19497
28 1 5 "Average Difference" CA 104 1.646 -0.042 1.654 19497
29 1 5 "Average Difference" CB 96 1.694 0.113 1.699 19497
30 1 5 "Average Difference" HN 99 0.608 -0.078 0.607 19497
31 1 6 "Average Difference" N 99 3.651 -0.206 3.663 19497
32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 19497
33 1 6 "Average Difference" C 98 1.256 0.061 1.261 19497
34 1 6 "Average Difference" CA 104 1.595 -0.081 1.600 19497
35 1 6 "Average Difference" CB 96 1.610 0.191 1.607 19497
36 1 6 "Average Difference" HN 99 0.609 -0.006 0.613 19497
37 1 7 "Average Difference" N 99 3.750 -0.392 3.748 19497
38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 19497
39 1 7 "Average Difference" C 98 1.324 0.098 1.327 19497
40 1 7 "Average Difference" CA 104 1.647 -0.072 1.653 19497
41 1 7 "Average Difference" CB 96 1.994 0.232 1.991 19497
42 1 7 "Average Difference" HN 99 0.640 -0.040 0.642 19497
43 1 8 "Average Difference" N 99 3.843 -0.090 3.862 19497
44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 19497
45 1 8 "Average Difference" C 98 1.257 -0.007 1.264 19497
46 1 8 "Average Difference" CA 104 1.787 -0.145 1.790 19497
47 1 8 "Average Difference" CB 96 1.710 0.123 1.714 19497
48 1 8 "Average Difference" HN 99 0.598 -0.057 0.598 19497
49 1 9 "Average Difference" N 99 4.160 -0.424 4.159 19497
50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 19497
51 1 9 "Average Difference" C 98 1.284 0.101 1.287 19497
52 1 9 "Average Difference" CA 104 1.777 -0.013 1.786 19497
53 1 9 "Average Difference" CB 96 1.767 0.083 1.774 19497
54 1 9 "Average Difference" HN 99 0.618 -0.037 0.620 19497
55 1 10 "Average Difference" N 99 4.016 -0.388 4.017 19497
56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 19497
57 1 10 "Average Difference" C 98 1.276 0.038 1.282 19497
58 1 10 "Average Difference" CA 104 1.765 -0.073 1.772 19497
59 1 10 "Average Difference" CB 96 1.828 0.162 1.830 19497
60 1 10 "Average Difference" HN 99 0.622 -0.043 0.624 19497
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 19497
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ARG N N 2 117.187 117.187 121.409 -4.222 19497
2 1 . 1 1 2 2 ARG C C 2 172.315 172.315 174.930 -2.615 19497
3 1 . 1 1 2 2 ARG CA C 2 55.100 55.100 55.450 -0.350 19497
4 1 . 1 1 2 2 ARG CB C 2 29.000 29.000 30.394 -1.394 19497
5 1 . 1 1 2 2 ARG H H 2 7.766 7.766 8.289 -0.523 19497
6 1 . 1 1 3 3 LEU N N 3 125.426 125.426 121.634 3.792 19497
7 1 . 1 1 3 3 LEU C C 3 173.996 173.996 174.868 -0.872 19497
8 1 . 1 1 3 3 LEU CA C 3 52.600 52.600 53.956 -1.356 19497
9 1 . 1 1 3 3 LEU CB C 3 45.100 45.100 46.150 -1.050 19497
10 1 . 1 1 3 3 LEU H H 3 8.246 8.246 8.135 0.111 19497
11 1 . 1 1 4 4 PHE N N 4 122.682 122.682 122.022 0.660 19497
12 1 . 1 1 4 4 PHE C C 4 175.512 175.512 174.545 0.967 19497
13 1 . 1 1 4 4 PHE CA C 4 55.700 55.700 56.327 -0.628 19497
14 1 . 1 1 4 4 PHE CB C 4 41.800 41.800 40.770 1.030 19497
15 1 . 1 1 4 4 PHE H H 4 9.390 9.390 8.862 0.528 19497
16 1 . 1 1 5 5 GLU N N 5 125.826 125.826 122.634 3.191 19497
17 1 . 1 1 5 5 GLU C C 5 175.679 175.679 175.534 0.145 19497
18 1 . 1 1 5 5 GLU CA C 5 56.400 56.400 54.070 2.330 19497
19 1 . 1 1 5 5 GLU CB C 5 29.400 29.400 33.554 -4.154 19497
20 1 . 1 1 5 5 GLU H H 5 9.190 9.190 8.572 0.618 19497
21 1 . 1 1 6 6 CYS N N 6 121.540 121.540 120.157 1.383 19497
22 1 . 1 1 6 6 CYS C C 6 175.738 175.738 174.508 1.230 19497
23 1 . 1 1 6 6 CYS CA C 6 56.100 56.100 57.802 -1.702 19497
24 1 . 1 1 6 6 CYS CB C 6 28.200 28.200 29.450 -1.250 19497
25 1 . 1 1 6 6 CYS H H 6 8.158 8.158 8.676 -0.518 19497
26 1 . 1 1 7 7 SER N N 7 116.299 116.299 117.063 -0.764 19497
27 1 . 1 1 7 7 SER C C 7 173.277 173.277 172.980 0.297 19497
28 1 . 1 1 7 7 SER CA C 7 58.300 58.300 57.302 0.998 19497
29 1 . 1 1 7 7 SER CB C 7 64.300 64.300 64.910 -0.609 19497
30 1 . 1 1 7 7 SER H H 7 7.734 7.734 8.372 -0.638 19497
31 1 . 1 1 8 8 ASN N N 8 127.642 127.642 123.083 4.559 19497
32 1 . 1 1 8 8 ASN C C 8 177.812 177.812 174.611 3.201 19497
33 1 . 1 1 8 8 ASN CA C 8 55.900 55.900 53.252 2.648 19497
34 1 . 1 1 8 8 ASN CB C 8 39.200 39.200 39.994 -0.794 19497
35 1 . 1 1 8 8 ASN H H 8 8.006 8.006 8.616 -0.610 19497
36 1 . 1 1 9 9 LYS N N 9 122.472 122.472 120.056 2.416 19497
37 1 . 1 1 9 9 LYS C C 9 177.932 177.932 177.153 0.779 19497
38 1 . 1 1 9 9 LYS CA C 9 59.300 59.300 56.503 2.797 19497
39 1 . 1 1 9 9 LYS CB C 9 32.400 32.400 33.255 -0.855 19497
40 1 . 1 1 9 9 LYS H H 9 8.350 8.350 8.081 0.269 19497
41 1 . 1 1 10 10 THR N N 10 109.478 109.478 115.360 -5.882 19497
42 1 . 1 1 10 10 THR C C 10 175.241 175.241 174.653 0.588 19497
43 1 . 1 1 10 10 THR CA C 10 62.400 62.400 61.794 0.606 19497
44 1 . 1 1 10 10 THR CB C 10 69.700 69.700 68.230 1.469 19497
45 1 . 1 1 10 10 THR H H 10 8.486 8.486 8.454 0.032 19497
46 1 . 1 1 11 11 GLY N N 11 110.146 110.146 110.413 -0.267 19497
47 1 . 1 1 11 11 GLY C C 11 172.717 172.717 173.857 -1.140 19497
48 1 . 1 1 11 11 GLY CA C 11 44.700 44.700 44.788 -0.088 19497
49 1 . 1 1 11 11 GLY H H 11 8.014 8.014 7.695 0.319 19497
50 1 . 1 1 12 12 ARG N N 12 117.911 117.911 118.364 -0.453 19497
51 1 . 1 1 12 12 ARG C C 12 173.660 173.660 175.891 -2.230 19497
52 1 . 1 1 12 12 ARG CA C 12 53.800 53.800 55.628 -1.828 19497
53 1 . 1 1 12 12 ARG CB C 12 32.400 32.400 29.513 2.887 19497
54 1 . 1 1 12 12 ARG H H 12 7.342 7.342 8.125 -0.783 19497
55 1 . 1 1 13 13 PHE N N 13 122.082 122.082 120.110 1.972 19497
56 1 . 1 1 13 13 PHE C C 13 174.525 174.525 174.745 -0.220 19497
57 1 . 1 1 13 13 PHE CA C 13 58.700 58.700 56.237 2.463 19497
58 1 . 1 1 13 13 PHE CB C 13 38.900 38.900 38.047 0.852 19497
59 1 . 1 1 13 13 PHE H H 13 8.462 8.462 8.075 0.387 19497
60 1 . 1 1 14 14 LEU N N 14 129.559 129.559 122.928 6.631 19497
61 1 . 1 1 14 14 LEU C C 14 174.071 174.071 175.630 -1.559 19497
62 1 . 1 1 14 14 LEU CA C 14 54.100 54.100 54.302 -0.202 19497
63 1 . 1 1 14 14 LEU CB C 14 45.500 45.500 42.665 2.835 19497
64 1 . 1 1 14 14 LEU H H 14 8.054 8.054 7.550 0.504 19497
65 1 . 1 1 15 15 ALA N N 15 126.873 126.873 130.672 -3.799 19497
66 1 . 1 1 15 15 ALA C C 15 176.826 176.826 176.124 0.702 19497
67 1 . 1 1 15 15 ALA CA C 15 49.900 49.900 50.997 -1.097 19497
68 1 . 1 1 15 15 ALA CB C 15 20.300 20.300 21.713 -1.413 19497
69 1 . 1 1 15 15 ALA H H 15 8.190 8.190 8.234 -0.044 19497
70 1 . 1 1 16 16 THR N N 16 120.557 120.557 118.225 2.332 19497
71 1 . 1 1 16 16 THR C C 16 173.449 173.449 174.407 -0.958 19497
72 1 . 1 1 16 16 THR CA C 16 61.500 61.500 62.157 -0.657 19497
73 1 . 1 1 16 16 THR CB C 16 70.500 70.500 69.162 1.338 19497
74 1 . 1 1 16 16 THR H H 16 9.014 9.014 8.521 0.493 19497
75 1 . 1 1 17 17 GLU N N 17 129.862 129.862 126.578 3.284 19497
76 1 . 1 1 17 17 GLU C C 17 175.703 175.703 176.003 -0.300 19497
77 1 . 1 1 17 17 GLU CA C 17 56.900 56.900 55.388 1.512 19497
78 1 . 1 1 17 17 GLU CB C 17 29.200 29.200 30.221 -1.021 19497
79 1 . 1 1 17 17 GLU H H 17 9.118 9.118 8.429 0.689 19497
80 1 . 1 1 18 18 ILE N N 18 128.992 128.992 119.001 9.991 19497
81 1 . 1 1 18 18 ILE C C 18 175.994 175.994 175.830 0.164 19497
82 1 . 1 1 18 18 ILE CA C 18 59.600 59.600 60.782 -1.182 19497
83 1 . 1 1 18 18 ILE CB C 18 37.300 37.300 38.781 -1.482 19497
84 1 . 1 1 18 18 ILE H H 18 8.686 8.686 8.001 0.685 19497
85 1 . 1 1 19 19 VAL N N 19 127.812 127.812 117.549 10.263 19497
86 1 . 1 1 19 19 VAL C C 19 175.611 175.611 175.491 0.120 19497
87 1 . 1 1 19 19 VAL CA C 19 62.700 62.700 62.806 -0.106 19497
88 1 . 1 1 19 19 VAL CB C 19 32.000 32.000 31.258 0.742 19497
89 1 . 1 1 19 19 VAL H H 19 8.422 8.422 8.158 0.264 19497
90 1 . 1 1 20 20 ASP N N 20 123.008 123.008 120.395 2.613 19497
91 1 . 1 1 20 20 ASP C C 20 175.669 175.669 175.430 0.239 19497
92 1 . 1 1 20 20 ASP CA C 20 54.900 54.900 54.423 0.477 19497
93 1 . 1 1 20 20 ASP CB C 20 38.500 38.500 41.702 -3.202 19497
94 1 . 1 1 20 20 ASP H H 20 8.894 8.894 8.165 0.729 19497
95 1 . 1 1 21 21 PHE N N 21 112.724 112.724 120.944 -8.220 19497
96 1 . 1 1 21 21 PHE C C 21 174.706 174.706 175.485 -0.779 19497
97 1 . 1 1 21 21 PHE CA C 21 56.200 56.200 57.128 -0.928 19497
98 1 . 1 1 21 21 PHE CB C 21 41.000 41.000 39.660 1.340 19497
99 1 . 1 1 21 21 PHE H H 21 6.261 6.261 8.253 -1.992 19497
100 1 . 1 1 22 22 THR N N 22 112.022 112.022 114.297 -2.275 19497
101 1 . 1 1 22 22 THR C C 22 175.111 175.111 174.370 0.741 19497
102 1 . 1 1 22 22 THR CA C 22 60.100 60.100 61.198 -1.098 19497
103 1 . 1 1 22 22 THR H H 22 9.422 9.422 8.261 1.161 19497
104 1 . 1 1 23 23 GLN N N 23 122.305 122.305 121.772 0.532 19497
105 1 . 1 1 23 23 GLN C C 23 176.564 176.564 177.157 -0.594 19497
106 1 . 1 1 23 23 GLN CA C 23 58.600 58.600 59.079 -0.479 19497
107 1 . 1 1 23 23 GLN CB C 23 26.900 26.900 28.535 -1.635 19497
108 1 . 1 1 23 23 GLN H H 23 9.470 9.470 8.905 0.565 19497
109 1 . 1 1 24 24 ASP N N 24 114.251 114.251 119.085 -4.835 19497
110 1 . 1 1 24 24 ASP C C 24 174.839 174.839 176.968 -2.129 19497
111 1 . 1 1 24 24 ASP CA C 24 55.700 55.700 56.593 -0.893 19497
112 1 . 1 1 24 24 ASP CB C 24 40.500 40.500 40.447 0.052 19497
113 1 . 1 1 24 24 ASP H H 24 7.534 7.534 8.568 -1.034 19497
114 1 . 1 1 25 25 ASP N N 25 116.046 116.046 117.797 -1.751 19497
115 1 . 1 1 25 25 ASP C C 25 176.087 176.087 175.798 0.289 19497
116 1 . 1 1 25 25 ASP CA C 25 54.500 54.500 54.548 -0.048 19497
117 1 . 1 1 25 25 ASP CB C 25 40.600 40.600 40.840 -0.240 19497
118 1 . 1 1 25 25 ASP H H 25 7.454 7.454 7.977 -0.523 19497
119 1 . 1 1 26 26 LEU N N 26 121.535 121.535 121.882 -0.347 19497
120 1 . 1 1 26 26 LEU C C 26 176.343 176.343 175.694 0.649 19497
121 1 . 1 1 26 26 LEU CA C 26 55.000 55.000 54.050 0.950 19497
122 1 . 1 1 26 26 LEU CB C 26 41.300 41.300 41.967 -0.667 19497
123 1 . 1 1 26 26 LEU H H 26 8.014 8.014 7.375 0.639 19497
124 1 . 1 1 27 27 ASP N N 27 127.804 127.804 124.422 3.382 19497
125 1 . 1 1 27 27 ASP C C 27 176.947 176.947 176.656 0.291 19497
126 1 . 1 1 27 27 ASP CA C 27 54.000 54.000 53.584 0.416 19497
127 1 . 1 1 27 27 ASP CB C 27 43.400 43.400 42.404 0.996 19497
128 1 . 1 1 27 27 ASP H H 27 8.326 8.326 8.248 0.078 19497
129 1 . 1 1 28 28 GLU N N 28 123.641 123.641 121.085 2.556 19497
130 1 . 1 1 28 28 GLU C C 28 176.141 176.141 176.291 -0.150 19497
131 1 . 1 1 28 28 GLU CA C 28 54.500 54.500 58.219 -3.720 19497
132 1 . 1 1 28 28 GLU CB C 28 32.700 32.700 29.875 2.825 19497
133 1 . 1 1 28 28 GLU H H 28 8.278 8.278 8.878 -0.600 19497
134 1 . 1 1 29 29 ASN N N 29 120.901 120.901 116.502 4.399 19497
135 1 . 1 1 29 29 ASN C C 29 174.383 174.383 174.259 0.124 19497
136 1 . 1 1 29 29 ASN CA C 29 57.300 57.300 52.834 4.466 19497
137 1 . 1 1 29 29 ASN CB C 29 38.300 38.300 38.602 -0.302 19497
138 1 . 1 1 29 29 ASN H H 29 8.022 8.022 8.309 -0.287 19497
139 1 . 1 1 30 30 ASP N N 30 125.016 125.016 118.692 6.324 19497
140 1 . 1 1 30 30 ASP C C 30 175.679 175.679 173.934 1.745 19497
141 1 . 1 1 30 30 ASP CA C 30 52.300 52.300 53.279 -0.979 19497
142 1 . 1 1 30 30 ASP CB C 30 41.000 41.000 44.337 -3.337 19497
143 1 . 1 1 30 30 ASP H H 30 8.142 8.142 7.660 0.482 19497
144 1 . 1 1 31 31 VAL N N 31 121.540 121.540 119.460 2.080 19497
145 1 . 1 1 31 31 VAL C C 31 175.675 175.675 174.635 1.040 19497
146 1 . 1 1 31 31 VAL CA C 31 62.000 62.000 61.260 0.740 19497
147 1 . 1 1 31 31 VAL CB C 31 32.800 32.800 33.099 -0.299 19497
148 1 . 1 1 31 31 VAL H H 31 8.158 8.158 8.488 -0.330 19497
149 1 . 1 1 32 32 TYR N N 32 126.116 126.116 125.809 0.307 19497
150 1 . 1 1 32 32 TYR C C 32 173.449 173.449 174.892 -1.443 19497
151 1 . 1 1 32 32 TYR CA C 32 56.000 56.000 56.243 -0.243 19497
152 1 . 1 1 32 32 TYR H H 32 8.294 8.294 8.549 -0.255 19497
153 1 . 1 1 33 33 LEU N N 33 121.235 121.235 119.054 2.181 19497
154 1 . 1 1 33 33 LEU C C 33 174.948 174.948 175.355 -0.407 19497
155 1 . 1 1 33 33 LEU CA C 33 53.300 53.300 53.624 -0.324 19497
156 1 . 1 1 33 33 LEU CB C 33 45.700 45.700 43.472 2.228 19497
157 1 . 1 1 33 33 LEU H H 33 9.142 9.142 8.614 0.528 19497
158 1 . 1 1 34 34 LEU N N 34 127.452 127.452 124.266 3.186 19497
159 1 . 1 1 34 34 LEU C C 34 174.084 174.084 175.462 -1.378 19497
160 1 . 1 1 34 34 LEU CA C 34 53.200 53.200 54.218 -1.018 19497
161 1 . 1 1 34 34 LEU CB C 34 44.700 44.700 42.298 2.402 19497
162 1 . 1 1 34 34 LEU H H 34 9.686 9.686 8.109 1.577 19497
163 1 . 1 1 35 35 ASP N N 35 126.977 126.977 126.237 0.740 19497
164 1 . 1 1 35 35 ASP C C 35 177.009 177.009 175.229 1.780 19497
165 1 . 1 1 35 35 ASP CA C 35 52.600 52.600 53.461 -0.861 19497
166 1 . 1 1 35 35 ASP CB C 35 41.400 41.400 41.764 -0.364 19497
167 1 . 1 1 35 35 ASP H H 35 9.446 9.446 8.176 1.270 19497
168 1 . 1 1 36 36 THR N N 36 118.735 118.735 117.734 1.001 19497
169 1 . 1 1 36 36 THR C C 36 175.252 175.252 175.334 -0.082 19497
170 1 . 1 1 36 36 THR CA C 36 60.500 60.500 61.199 -0.698 19497
171 1 . 1 1 36 36 THR CB C 36 68.000 68.000 70.030 -2.030 19497
172 1 . 1 1 36 36 THR H H 36 8.310 8.310 7.970 0.340 19497
173 1 . 1 1 37 37 TRP N N 37 122.289 122.289 124.787 -2.498 19497
174 1 . 1 1 37 37 TRP C C 37 177.189 177.189 176.719 0.470 19497
175 1 . 1 1 37 37 TRP CA C 37 61.500 61.500 60.206 1.294 19497
176 1 . 1 1 37 37 TRP CB C 37 28.800 28.800 29.520 -0.720 19497
177 1 . 1 1 37 37 TRP H H 37 9.022 9.022 8.792 0.230 19497
178 1 . 1 1 38 38 ASP N N 38 117.370 117.370 115.669 1.701 19497
179 1 . 1 1 38 38 ASP C C 38 175.290 175.290 176.099 -0.809 19497
180 1 . 1 1 38 38 ASP CA C 38 55.400 55.400 55.208 0.192 19497
181 1 . 1 1 38 38 ASP CB C 38 41.100 41.100 41.021 0.079 19497
182 1 . 1 1 38 38 ASP H H 38 8.518 8.518 8.163 0.355 19497
183 1 . 1 1 39 39 GLN N N 39 111.522 111.522 118.749 -7.227 19497
184 1 . 1 1 39 39 GLN C C 39 173.099 173.099 174.321 -1.222 19497
185 1 . 1 1 39 39 GLN CA C 39 54.500 54.500 55.048 -0.548 19497
186 1 . 1 1 39 39 GLN CB C 39 28.900 28.900 31.237 -2.337 19497
187 1 . 1 1 39 39 GLN H H 39 7.118 7.118 7.561 -0.443 19497
188 1 . 1 1 40 40 ILE N N 40 121.103 121.103 123.693 -2.590 19497
189 1 . 1 1 40 40 ILE C C 40 174.406 174.406 174.684 -0.278 19497
190 1 . 1 1 40 40 ILE CA C 40 58.900 58.900 60.426 -1.526 19497
191 1 . 1 1 40 40 ILE CB C 40 38.900 38.900 38.528 0.372 19497
192 1 . 1 1 40 40 ILE H H 40 8.422 8.422 8.078 0.344 19497
193 1 . 1 1 41 41 PHE N N 41 123.856 123.856 125.792 -1.936 19497
194 1 . 1 1 41 41 PHE C C 41 174.537 174.537 175.111 -0.574 19497
195 1 . 1 1 41 41 PHE CA C 41 55.900 55.900 56.752 -0.852 19497
196 1 . 1 1 41 41 PHE CB C 41 42.200 42.200 41.140 1.060 19497
197 1 . 1 1 41 41 PHE H H 41 9.222 9.222 8.224 0.998 19497
198 1 . 1 1 42 42 PHE N N 42 127.400 127.400 121.173 6.227 19497
199 1 . 1 1 42 42 PHE C C 42 173.021 173.021 174.669 -1.648 19497
200 1 . 1 1 42 42 PHE CA C 42 56.300 56.300 56.820 -0.520 19497
201 1 . 1 1 42 42 PHE CB C 42 42.300 42.300 40.556 1.744 19497
202 1 . 1 1 42 42 PHE H H 42 9.358 9.358 8.952 0.406 19497
203 1 . 1 1 43 43 TRP N N 43 129.616 129.616 126.845 2.771 19497
204 1 . 1 1 43 43 TRP C C 43 174.538 174.538 175.385 -0.847 19497
205 1 . 1 1 43 43 TRP CA C 43 61.600 61.600 57.346 4.254 19497
206 1 . 1 1 43 43 TRP CB C 43 38.200 38.200 30.034 8.166 19497
207 1 . 1 1 43 43 TRP H H 43 9.646 9.646 8.905 0.741 19497
208 1 . 1 1 44 44 ILE N N 44 121.402 121.402 127.852 -6.450 19497
209 1 . 1 1 44 44 ILE C C 44 175.738 175.738 175.199 0.539 19497
210 1 . 1 1 44 44 ILE CA C 44 57.600 57.600 60.325 -2.725 19497
211 1 . 1 1 44 44 ILE CB C 44 39.100 39.100 38.904 0.196 19497
212 1 . 1 1 44 44 ILE H H 44 7.838 7.838 8.152 -0.314 19497
213 1 . 1 1 45 45 GLY N N 45 114.403 114.403 111.874 2.529 19497
214 1 . 1 1 45 45 GLY C C 45 175.519 175.519 173.852 1.667 19497
215 1 . 1 1 45 45 GLY CA C 45 46.500 46.500 44.387 2.113 19497
216 1 . 1 1 45 45 GLY H H 45 7.742 7.742 8.173 -0.431 19497
217 1 . 1 1 46 46 LYS N N 46 123.585 123.585 121.331 2.254 19497
218 1 . 1 1 46 46 LYS C C 46 177.790 177.790 178.291 -0.501 19497
219 1 . 1 1 46 46 LYS CA C 46 58.700 58.700 58.121 0.579 19497
220 1 . 1 1 46 46 LYS CB C 46 32.200 32.200 33.111 -0.912 19497
221 1 . 1 1 46 46 LYS H H 46 8.942 8.942 8.157 0.785 19497
222 1 . 1 1 47 47 GLY N N 47 107.819 107.819 107.118 0.701 19497
223 1 . 1 1 47 47 GLY C C 47 174.298 174.298 173.821 0.477 19497
224 1 . 1 1 47 47 GLY CA C 47 44.300 44.300 44.509 -0.209 19497
225 1 . 1 1 47 47 GLY H H 47 8.670 8.670 7.708 0.962 19497
226 1 . 1 1 48 48 ALA N N 48 123.965 123.965 123.130 0.835 19497
227 1 . 1 1 48 48 ALA C C 48 177.189 177.189 177.108 0.081 19497
228 1 . 1 1 48 48 ALA CA C 48 52.100 52.100 51.540 0.560 19497
229 1 . 1 1 48 48 ALA CB C 48 19.000 19.000 19.869 -0.869 19497
230 1 . 1 1 48 48 ALA H H 48 7.230 7.230 7.267 -0.037 19497
231 1 . 1 1 49 49 ASN N N 49 119.667 119.667 118.420 1.247 19497
232 1 . 1 1 49 49 ASN C C 49 175.797 175.797 176.650 -0.853 19497
233 1 . 1 1 49 49 ASN CA C 49 54.200 54.200 53.425 0.776 19497
234 1 . 1 1 49 49 ASN CB C 49 41.100 41.100 39.502 1.598 19497
235 1 . 1 1 49 49 ASN H H 49 8.526 8.526 8.579 -0.053 19497
236 1 . 1 1 50 50 GLU N N 50 112.272 112.272 123.673 -11.401 19497
237 1 . 1 1 50 50 GLU C C 50 178.128 178.128 178.333 -0.205 19497
238 1 . 1 1 50 50 GLU CA C 50 59.600 59.600 59.158 0.441 19497
239 1 . 1 1 50 50 GLU CB C 50 29.300 29.300 29.751 -0.451 19497
240 1 . 1 1 50 50 GLU H H 50 7.814 7.814 8.962 -1.148 19497
241 1 . 1 1 51 51 SER N N 51 113.952 113.952 115.784 -1.832 19497
242 1 . 1 1 51 51 SER C C 51 177.874 177.874 176.262 1.612 19497
243 1 . 1 1 51 51 SER CA C 51 61.100 61.100 61.393 -0.293 19497
244 1 . 1 1 51 51 SER CB C 51 60.900 60.900 63.086 -2.186 19497
245 1 . 1 1 51 51 SER H H 51 8.342 8.342 8.120 0.222 19497
246 1 . 1 1 52 52 GLU N N 52 119.930 119.930 120.255 -0.325 19497
247 1 . 1 1 52 52 GLU C C 52 178.827 178.827 177.183 1.644 19497
248 1 . 1 1 52 52 GLU CA C 52 57.900 57.900 58.338 -0.438 19497
249 1 . 1 1 52 52 GLU CB C 52 29.300 29.300 29.671 -0.371 19497
250 1 . 1 1 52 52 GLU H H 52 7.806 7.806 8.304 -0.498 19497
251 1 . 1 1 53 53 LYS N N 53 118.112 118.112 118.088 0.024 19497
252 1 . 1 1 53 53 LYS C C 53 178.802 178.802 178.882 -0.080 19497
253 1 . 1 1 53 53 LYS CA C 53 60.000 60.000 58.281 1.719 19497
254 1 . 1 1 53 53 LYS CB C 53 32.200 32.200 32.746 -0.546 19497
255 1 . 1 1 53 53 LYS H H 53 7.670 7.670 7.564 0.106 19497
256 1 . 1 1 54 54 GLU N N 54 117.700 117.700 119.463 -1.763 19497
257 1 . 1 1 54 54 GLU C C 54 177.733 177.733 177.469 0.264 19497
258 1 . 1 1 54 54 GLU CA C 54 58.200 58.200 58.271 -0.070 19497
259 1 . 1 1 54 54 GLU CB C 54 29.300 29.300 30.007 -0.707 19497
260 1 . 1 1 54 54 GLU H H 54 7.934 7.934 8.277 -0.343 19497
261 1 . 1 1 55 55 ALA N N 55 120.395 120.395 121.593 -1.198 19497
262 1 . 1 1 55 55 ALA CA C 55 52.200 52.200 51.024 1.176 19497
263 1 . 1 1 55 55 ALA CB C 55 17.200 17.200 17.793 -0.593 19497
264 1 . 1 1 55 55 ALA H H 55 7.238 7.238 7.744 -0.506 19497
265 1 . 1 1 56 56 ALA C C 56 177.526 177.526 178.222 -0.696 19497
266 1 . 1 1 56 56 ALA CA C 56 55.600 55.600 54.304 1.295 19497
267 1 . 1 1 56 56 ALA CB C 56 19.600 19.600 18.831 0.769 19497
268 1 . 1 1 57 57 ALA N N 57 117.753 117.753 119.269 -1.516 19497
269 1 . 1 1 57 57 ALA C C 57 180.072 180.072 178.958 1.114 19497
270 1 . 1 1 57 57 ALA CA C 57 55.200 55.200 53.866 1.334 19497
271 1 . 1 1 57 57 ALA CB C 57 17.400 17.400 18.471 -1.071 19497
272 1 . 1 1 57 57 ALA H H 57 7.990 7.990 8.200 -0.210 19497
273 1 . 1 1 58 58 GLU N N 58 118.444 118.444 117.873 0.571 19497
274 1 . 1 1 58 58 GLU C C 58 179.225 179.225 178.294 0.931 19497
275 1 . 1 1 58 58 GLU CA C 58 59.600 59.600 58.828 0.773 19497
276 1 . 1 1 58 58 GLU CB C 58 28.900 28.900 29.550 -0.650 19497
277 1 . 1 1 58 58 GLU H H 58 7.582 7.582 8.344 -0.762 19497
278 1 . 1 1 59 59 THR N N 59 119.842 119.842 116.095 3.747 19497
279 1 . 1 1 59 59 THR C C 59 175.781 175.781 175.957 -0.176 19497
280 1 . 1 1 59 59 THR CA C 59 66.200 66.200 65.536 0.665 19497
281 1 . 1 1 59 59 THR CB C 59 67.600 67.600 68.152 -0.552 19497
282 1 . 1 1 59 59 THR H H 59 8.422 8.422 7.877 0.545 19497
283 1 . 1 1 60 60 ALA N N 60 122.454 122.454 124.500 -2.046 19497
284 1 . 1 1 60 60 ALA C C 60 178.583 178.583 179.145 -0.561 19497
285 1 . 1 1 60 60 ALA CA C 60 55.200 55.200 55.032 0.168 19497
286 1 . 1 1 60 60 ALA CB C 60 18.100 18.100 17.902 0.198 19497
287 1 . 1 1 60 60 ALA H H 60 7.966 7.966 7.668 0.298 19497
288 1 . 1 1 61 61 GLN N N 61 115.462 115.462 117.238 -1.776 19497
289 1 . 1 1 61 61 GLN C C 61 178.101 178.101 178.112 -0.011 19497
290 1 . 1 1 61 61 GLN CA C 61 58.900 58.900 58.293 0.607 19497
291 1 . 1 1 61 61 GLN CB C 61 28.100 28.100 28.257 -0.157 19497
292 1 . 1 1 61 61 GLN H H 61 7.598 7.598 7.847 -0.249 19497
293 1 . 1 1 62 62 GLU N N 62 120.883 120.883 121.285 -0.402 19497
294 1 . 1 1 62 62 GLU C C 62 174.071 174.071 178.613 -4.542 19497
295 1 . 1 1 62 62 GLU CA C 62 54.100 54.100 59.325 -5.225 19497
296 1 . 1 1 62 62 GLU CB C 62 30.300 30.300 29.726 0.574 19497
297 1 . 1 1 62 62 GLU H H 62 7.910 7.910 7.994 -0.083 19497
298 1 . 1 1 63 63 TYR N N 63 118.888 118.888 120.185 -1.297 19497
299 1 . 1 1 63 63 TYR C C 63 177.874 177.874 177.632 0.242 19497
300 1 . 1 1 63 63 TYR CA C 63 61.100 61.100 60.638 0.462 19497
301 1 . 1 1 63 63 TYR CB C 63 39.500 39.500 38.551 0.949 19497
302 1 . 1 1 63 63 TYR H H 63 8.182 8.182 7.860 0.322 19497
303 1 . 1 1 64 64 LEU N N 64 119.930 119.930 119.200 0.730 19497
304 1 . 1 1 64 64 LEU C C 64 178.536 178.536 178.336 0.200 19497
305 1 . 1 1 64 64 LEU CA C 64 57.900 57.900 57.185 0.715 19497
306 1 . 1 1 64 64 LEU CB C 64 38.900 38.900 41.898 -2.998 19497
307 1 . 1 1 64 64 LEU H H 64 7.806 7.806 7.820 -0.014 19497
308 1 . 1 1 65 65 ARG N N 65 117.322 117.322 117.147 0.175 19497
309 1 . 1 1 65 65 ARG C C 65 177.436 177.436 177.945 -0.509 19497
310 1 . 1 1 65 65 ARG CA C 65 58.600 58.600 58.191 0.409 19497
311 1 . 1 1 65 65 ARG CB C 65 30.400 30.400 30.294 0.106 19497
312 1 . 1 1 65 65 ARG H H 65 8.054 8.054 7.826 0.228 19497
313 1 . 1 1 66 66 SER N N 66 111.783 111.783 112.454 -0.671 19497
314 1 . 1 1 66 66 SER C C 66 173.652 173.652 174.353 -0.701 19497
315 1 . 1 1 66 66 SER CA C 66 58.900 58.900 58.888 0.012 19497
316 1 . 1 1 66 66 SER CB C 66 63.800 63.800 63.816 -0.016 19497
317 1 . 1 1 66 66 SER H H 66 7.550 7.550 7.589 -0.039 19497
318 1 . 1 1 67 67 HIS N N 67 124.135 124.135 123.704 0.431 19497
319 1 . 1 1 67 67 HIS CA C 67 55.700 55.700 55.540 0.161 19497
320 1 . 1 1 67 67 HIS CB C 67 29.200 29.200 30.544 -1.344 19497
321 1 . 1 1 67 67 HIS H H 67 7.134 7.134 7.519 -0.385 19497
322 1 . 1 1 68 68 PRO C C 68 178.101 178.101 176.759 1.342 19497
323 1 . 1 1 68 68 PRO CA C 68 58.900 58.900 63.640 -4.740 19497
324 1 . 1 1 68 68 PRO CB C 68 29.900 29.900 31.709 -1.809 19497
325 1 . 1 1 69 69 GLY N N 69 115.697 115.697 106.044 9.653 19497
326 1 . 1 1 69 69 GLY C C 69 176.641 176.641 174.619 2.022 19497
327 1 . 1 1 69 69 GLY CA C 69 45.000 45.000 44.643 0.357 19497
328 1 . 1 1 69 69 GLY H H 69 7.926 7.926 7.242 0.684 19497
329 1 . 1 1 70 70 SER N N 70 115.440 115.440 114.699 0.741 19497
330 1 . 1 1 70 70 SER C C 70 173.277 173.277 174.356 -1.079 19497
331 1 . 1 1 70 70 SER CA C 70 58.300 58.300 58.562 -0.262 19497
332 1 . 1 1 70 70 SER CB C 70 64.300 64.300 62.225 2.075 19497
333 1 . 1 1 70 70 SER H H 70 8.030 8.030 7.879 0.151 19497
334 1 . 1 1 71 71 ARG N N 71 127.642 127.642 120.787 6.855 19497
335 1 . 1 1 71 71 ARG C C 71 175.849 175.849 175.660 0.189 19497
336 1 . 1 1 71 71 ARG CA C 71 53.900 53.900 55.310 -1.410 19497
337 1 . 1 1 71 71 ARG CB C 71 30.900 30.900 30.795 0.105 19497
338 1 . 1 1 71 71 ARG H H 71 8.006 8.006 8.024 -0.018 19497
339 1 . 1 1 72 72 ASP N N 72 120.975 120.975 119.743 1.232 19497
340 1 . 1 1 72 72 ASP C C 72 176.087 176.087 176.088 -0.001 19497
341 1 . 1 1 72 72 ASP CA C 72 54.500 54.500 54.486 0.014 19497
342 1 . 1 1 72 72 ASP CB C 72 40.900 40.900 41.575 -0.675 19497
343 1 . 1 1 72 72 ASP H H 72 8.182 8.182 8.499 -0.317 19497
344 1 . 1 1 73 73 LEU N N 73 121.535 121.535 123.746 -2.211 19497
345 1 . 1 1 73 73 LEU C C 73 177.020 177.020 176.313 0.707 19497
346 1 . 1 1 73 73 LEU CA C 73 55.000 55.000 54.514 0.486 19497
347 1 . 1 1 73 73 LEU CB C 73 42.000 42.000 41.725 0.275 19497
348 1 . 1 1 73 73 LEU H H 73 8.014 8.014 8.402 -0.388 19497
349 1 . 1 1 74 74 ASP N N 74 120.525 120.525 118.778 1.747 19497
350 1 . 1 1 74 74 ASP C C 74 175.797 175.797 175.650 0.147 19497
351 1 . 1 1 74 74 ASP CA C 74 54.200 54.200 53.450 0.750 19497
352 1 . 1 1 74 74 ASP CB C 74 41.000 41.000 41.335 -0.335 19497
353 1 . 1 1 74 74 ASP H H 74 8.134 8.134 7.876 0.258 19497
354 1 . 1 1 75 75 THR N N 75 116.656 116.656 117.859 -1.203 19497
355 1 . 1 1 75 75 THR CA C 75 59.700 59.700 60.883 -1.183 19497
356 1 . 1 1 75 75 THR CB C 75 69.600 69.600 68.940 0.660 19497
357 1 . 1 1 75 75 THR H H 75 7.814 7.814 7.760 0.054 19497
358 1 . 1 1 76 76 PRO C C 76 174.538 174.538 175.555 -1.017 19497
359 1 . 1 1 76 76 PRO CA C 76 63.500 63.500 62.834 0.666 19497
360 1 . 1 1 76 76 PRO CB C 76 32.600 32.600 32.165 0.435 19497
361 1 . 1 1 77 77 ILE N N 77 121.402 121.402 122.475 -1.073 19497
362 1 . 1 1 77 77 ILE C C 77 176.132 176.132 175.536 0.596 19497
363 1 . 1 1 77 77 ILE CA C 77 59.100 59.100 60.594 -1.494 19497
364 1 . 1 1 77 77 ILE CB C 77 39.000 39.000 39.612 -0.613 19497
365 1 . 1 1 77 77 ILE H H 77 7.838 7.838 8.139 -0.301 19497
366 1 . 1 1 78 78 ILE N N 78 130.292 130.292 127.874 2.418 19497
367 1 . 1 1 78 78 ILE C C 78 175.084 175.084 174.540 0.544 19497
368 1 . 1 1 78 78 ILE CA C 78 59.900 59.900 59.656 0.244 19497
369 1 . 1 1 78 78 ILE CB C 78 39.000 39.000 40.390 -1.390 19497
370 1 . 1 1 78 78 ILE H H 78 8.910 8.910 8.506 0.404 19497
371 1 . 1 1 79 79 VAL N N 79 129.237 129.237 125.723 3.514 19497
372 1 . 1 1 79 79 VAL C C 79 175.907 175.907 175.578 0.329 19497
373 1 . 1 1 79 79 VAL CA C 79 63.200 63.200 61.510 1.690 19497
374 1 . 1 1 79 79 VAL CB C 79 31.700 31.700 32.390 -0.690 19497
375 1 . 1 1 79 79 VAL H H 79 8.670 8.670 8.474 0.196 19497
376 1 . 1 1 80 80 VAL N N 80 128.354 128.354 127.905 0.449 19497
377 1 . 1 1 80 80 VAL C C 80 172.823 172.823 174.539 -1.716 19497
378 1 . 1 1 80 80 VAL CA C 80 59.400 59.400 60.923 -1.523 19497
379 1 . 1 1 80 80 VAL CB C 80 32.600 32.600 35.091 -2.490 19497
380 1 . 1 1 80 80 VAL H H 80 9.598 9.598 8.663 0.935 19497
381 1 . 1 1 81 81 LYS N N 81 123.077 123.077 122.732 0.345 19497
382 1 . 1 1 81 81 LYS C C 81 178.101 178.101 175.031 3.070 19497
383 1 . 1 1 81 81 LYS CA C 81 54.400 54.400 53.874 0.526 19497
384 1 . 1 1 81 81 LYS CB C 81 34.300 34.300 35.037 -0.736 19497
385 1 . 1 1 81 81 LYS H H 81 8.198 8.198 8.622 -0.424 19497
386 1 . 1 1 82 82 GLN N N 82 121.436 121.436 122.493 -1.058 19497
387 1 . 1 1 82 82 GLN C C 82 177.068 177.068 176.167 0.901 19497
388 1 . 1 1 82 82 GLN CA C 82 56.200 56.200 57.097 -0.897 19497
389 1 . 1 1 82 82 GLN CB C 82 29.400 29.400 28.304 1.096 19497
390 1 . 1 1 82 82 GLN H H 82 7.910 7.910 8.234 -0.324 19497
391 1 . 1 1 83 83 GLY N N 83 110.688 110.688 114.194 -3.506 19497
392 1 . 1 1 83 83 GLY C C 83 173.348 173.348 174.285 -0.938 19497
393 1 . 1 1 83 83 GLY CA C 83 45.000 45.000 44.937 0.063 19497
394 1 . 1 1 83 83 GLY H H 83 8.382 8.382 8.695 -0.313 19497
395 1 . 1 1 84 84 PHE N N 84 119.493 119.493 122.212 -2.719 19497
396 1 . 1 1 84 84 PHE C C 84 175.035 175.035 174.520 0.515 19497
397 1 . 1 1 84 84 PHE CA C 84 57.300 57.300 56.113 1.187 19497
398 1 . 1 1 84 84 PHE CB C 84 42.200 42.200 38.783 3.417 19497
399 1 . 1 1 84 84 PHE H H 84 7.910 7.910 7.601 0.309 19497
400 1 . 1 1 85 85 GLU N N 85 124.672 124.672 123.396 1.276 19497
401 1 . 1 1 85 85 GLU CA C 85 59.000 59.000 54.111 4.889 19497
402 1 . 1 1 85 85 GLU CB C 85 29.700 29.700 30.225 -0.525 19497
403 1 . 1 1 85 85 GLU H H 85 8.142 8.142 8.176 -0.034 19497
404 1 . 1 1 87 87 PRO C C 87 178.284 178.284 178.115 0.169 19497
405 1 . 1 1 87 87 PRO CA C 87 64.100 64.100 65.309 -1.209 19497
406 1 . 1 1 87 87 PRO CB C 87 31.100 31.100 31.741 -0.641 19497
407 1 . 1 1 88 88 THR N N 88 106.959 106.959 110.380 -3.421 19497
408 1 . 1 1 88 88 THR C C 88 174.182 174.182 175.882 -1.700 19497
409 1 . 1 1 88 88 THR CA C 88 62.900 62.900 63.244 -0.344 19497
410 1 . 1 1 88 88 THR CB C 88 68.000 68.000 68.600 -0.600 19497
411 1 . 1 1 88 88 THR H H 88 7.110 7.110 8.041 -0.931 19497
412 1 . 1 1 89 89 PHE N N 89 118.766 118.766 120.816 -2.050 19497
413 1 . 1 1 89 89 PHE C C 89 175.468 175.468 176.820 -1.351 19497
414 1 . 1 1 89 89 PHE CA C 89 59.800 59.800 60.257 -0.457 19497
415 1 . 1 1 89 89 PHE CB C 89 40.700 40.700 39.116 1.584 19497
416 1 . 1 1 89 89 PHE H H 89 7.198 7.198 7.700 -0.502 19497
417 1 . 1 1 90 90 THR N N 90 107.050 107.050 113.162 -6.112 19497
418 1 . 1 1 90 90 THR C C 90 177.260 177.260 176.446 0.814 19497
419 1 . 1 1 90 90 THR CA C 90 64.600 64.600 63.293 1.307 19497
420 1 . 1 1 90 90 THR CB C 90 67.900 67.900 67.556 0.344 19497
421 1 . 1 1 90 90 THR H H 90 7.446 7.446 7.773 -0.327 19497
422 1 . 1 1 91 91 GLY N N 91 106.738 106.738 109.390 -2.652 19497
423 1 . 1 1 91 91 GLY C C 91 174.422 174.422 175.069 -0.647 19497
424 1 . 1 1 91 91 GLY CA C 91 46.000 46.000 45.868 0.132 19497
425 1 . 1 1 91 91 GLY H H 91 7.646 7.646 7.832 -0.186 19497
426 1 . 1 1 92 92 TRP N N 92 117.500 117.500 120.032 -2.532 19497
427 1 . 1 1 92 92 TRP C C 92 174.209 174.209 176.209 -2.000 19497
428 1 . 1 1 92 92 TRP CA C 92 56.900 56.900 56.982 -0.082 19497
429 1 . 1 1 92 92 TRP CB C 92 29.400 29.400 29.176 0.224 19497
430 1 . 1 1 92 92 TRP H H 92 6.790 6.790 7.135 -0.345 19497
431 1 . 1 1 93 93 PHE N N 93 119.092 119.092 117.617 1.475 19497
432 1 . 1 1 93 93 PHE C C 93 175.953 175.953 176.320 -0.367 19497
433 1 . 1 1 93 93 PHE CA C 93 56.700 56.700 58.152 -1.451 19497
434 1 . 1 1 93 93 PHE CB C 93 40.300 40.300 39.596 0.704 19497
435 1 . 1 1 93 93 PHE H H 93 7.750 7.750 7.459 0.291 19497
436 1 . 1 1 94 94 MET N N 94 121.554 121.554 123.203 -1.649 19497
437 1 . 1 1 94 94 MET C C 94 175.738 175.738 176.250 -0.512 19497
438 1 . 1 1 94 94 MET CA C 94 57.600 57.600 56.812 0.788 19497
439 1 . 1 1 94 94 MET CB C 94 32.000 32.000 33.647 -1.647 19497
440 1 . 1 1 94 94 MET H H 94 8.654 8.654 8.985 -0.331 19497
441 1 . 1 1 95 95 ALA N N 95 119.777 119.777 122.210 -2.433 19497
442 1 . 1 1 95 95 ALA C C 95 175.441 175.441 176.084 -0.643 19497
443 1 . 1 1 95 95 ALA CA C 95 51.300 51.300 51.396 -0.096 19497
444 1 . 1 1 95 95 ALA CB C 95 20.700 20.700 18.868 1.832 19497
445 1 . 1 1 95 95 ALA H H 95 7.750 7.750 8.107 -0.357 19497
446 1 . 1 1 96 96 TRP N N 96 120.813 120.813 122.250 -1.437 19497
447 1 . 1 1 96 96 TRP C C 96 175.488 175.488 174.733 0.755 19497
448 1 . 1 1 96 96 TRP CA C 96 57.700 57.700 56.671 1.029 19497
449 1 . 1 1 96 96 TRP CB C 96 30.400 30.400 30.181 0.219 19497
450 1 . 1 1 96 96 TRP H H 96 8.254 8.254 8.026 0.228 19497
451 1 . 1 1 97 97 ASP N N 97 117.140 117.140 127.714 -10.574 19497
452 1 . 1 1 97 97 ASP CA C 97 53.700 53.700 50.927 2.773 19497
453 1 . 1 1 97 97 ASP CB C 97 39.600 39.600 43.067 -3.467 19497
454 1 . 1 1 97 97 ASP H H 97 8.958 8.958 8.025 0.933 19497
455 1 . 1 1 98 98 PRO C C 98 174.071 174.071 176.736 -2.665 19497
456 1 . 1 1 98 98 PRO CA C 98 63.100 63.100 64.309 -1.209 19497
457 1 . 1 1 98 98 PRO CB C 98 32.400 32.400 32.056 0.344 19497
458 1 . 1 1 99 99 LEU N N 99 118.888 118.888 116.673 2.215 19497
459 1 . 1 1 99 99 LEU C C 99 177.519 177.519 176.723 0.796 19497
460 1 . 1 1 99 99 LEU CA C 99 54.400 54.400 54.482 -0.082 19497
461 1 . 1 1 99 99 LEU CB C 99 40.500 40.500 41.512 -1.012 19497
462 1 . 1 1 99 99 LEU H H 99 8.182 8.182 7.826 0.356 19497
463 1 . 1 1 100 100 CYS N N 100 118.788 118.788 116.334 2.454 19497
464 1 . 1 1 100 100 CYS C C 100 174.685 174.685 173.877 0.808 19497
465 1 . 1 1 100 100 CYS CA C 100 60.800 60.800 58.643 2.156 19497
466 1 . 1 1 100 100 CYS CB C 100 27.400 27.400 27.154 0.246 19497
467 1 . 1 1 100 100 CYS H H 100 6.862 6.862 7.472 -0.610 19497
468 1 . 1 1 101 101 TRP N N 101 117.558 117.558 121.601 -4.043 19497
469 1 . 1 1 101 101 TRP C C 101 176.478 176.478 174.979 1.499 19497
470 1 . 1 1 101 101 TRP CA C 101 54.400 54.400 56.170 -1.770 19497
471 1 . 1 1 101 101 TRP CB C 101 28.200 28.200 30.385 -2.185 19497
472 1 . 1 1 101 101 TRP H H 101 7.662 7.662 7.280 0.382 19497
473 1 . 1 1 102 102 SER N N 102 115.626 115.626 115.905 -0.279 19497
474 1 . 1 1 102 102 SER C C 102 174.303 174.303 173.499 0.804 19497
475 1 . 1 1 102 102 SER CA C 102 58.900 58.900 57.642 1.258 19497
476 1 . 1 1 102 102 SER CB C 102 63.700 63.700 65.428 -1.728 19497
477 1 . 1 1 102 102 SER H H 102 7.734 7.734 8.053 -0.318 19497
478 1 . 1 1 103 103 ASP N N 103 121.936 121.936 119.702 2.234 19497
479 1 . 1 1 103 103 ASP CA C 103 54.400 54.400 54.995 -0.595 19497
480 1 . 1 1 103 103 ASP CB C 103 40.600 40.600 40.019 0.581 19497
481 1 . 1 1 103 103 ASP H H 103 8.254 8.254 8.638 -0.384 19497
482 1 . 1 1 104 104 ARG N N 104 120.567 120.567 120.155 0.412 19497
483 1 . 1 1 104 104 ARG C C 104 176.177 176.177 176.846 -0.669 19497
484 1 . 1 1 104 104 ARG CA C 104 56.000 56.000 57.099 -1.099 19497
485 1 . 1 1 104 104 ARG CB C 104 30.300 30.300 30.610 -0.310 19497
486 1 . 1 1 104 104 ARG H H 104 7.910 7.910 8.216 -0.306 19497
487 1 . 1 1 105 105 LYS N N 105 121.805 121.805 118.574 3.231 19497
488 1 . 1 1 105 105 LYS C C 105 176.141 176.141 176.638 -0.497 19497
489 1 . 1 1 105 105 LYS CA C 105 56.100 56.100 57.445 -1.345 19497
490 1 . 1 1 105 105 LYS CB C 105 32.800 32.800 33.132 -0.332 19497
491 1 . 1 1 105 105 LYS H H 105 8.094 8.094 8.197 -0.103 19497
492 1 . 1 1 106 106 SER N N 106 116.792 116.792 111.216 5.575 19497
493 1 . 1 1 106 106 SER C C 106 172.841 172.841 173.212 -0.371 19497
494 1 . 1 1 106 106 SER CA C 106 57.900 57.900 58.459 -0.559 19497
495 1 . 1 1 106 106 SER CB C 106 63.800 63.800 63.670 0.130 19497
496 1 . 1 1 106 106 SER H H 106 8.030 8.030 7.880 0.150 19497
stop_
save_