data_25109
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25109
_Entry.PDB_ID 2MS8
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 25109
_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 0 0 SER N N 0 115.693 115.693 115.637 0.056 25109
2 1 1 . 1 1 0 0 SER HA H 0 4.531 4.531 4.783 -0.252 25109
3 1 1 . 1 1 0 0 SER C C 0 174.557 174.557 174.142 0.415 25109
4 1 1 . 1 1 0 0 SER CA C 0 58.478 58.478 57.595 0.883 25109
5 1 1 . 1 1 0 0 SER CB C 0 64.380 64.380 65.125 -0.745 25109
6 1 1 . 1 1 0 0 SER H H 0 8.631 8.631 8.318 0.313 25109
7 1 1 . 1 1 1 1 MET N N 1 123.111 123.111 120.244 2.867 25109
8 1 1 . 1 1 1 1 MET HA H 1 4.728 4.728 4.386 0.342 25109
9 1 1 . 1 1 1 1 MET C C 1 174.846 174.846 173.958 0.888 25109
10 1 1 . 1 1 1 1 MET CA C 1 55.655 55.655 54.656 0.999 25109
11 1 1 . 1 1 1 1 MET CB C 1 32.035 32.035 31.139 0.896 25109
12 1 1 . 1 1 1 1 MET H H 1 8.641 8.641 8.452 0.189 25109
13 1 1 . 1 1 2 2 PRO HA H 2 4.477 4.477 5.047 -0.570 25109
14 1 1 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.802 0.198 25109
15 1 1 . 1 1 3 3 PHE N N 3 121.126 121.126 125.027 -3.901 25109
16 1 1 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.597 -0.231 25109
17 1 1 . 1 1 3 3 PHE CA C 3 60.862 60.862 60.126 0.736 25109
18 1 1 . 1 1 3 3 PHE CB C 3 39.368 39.368 41.157 -1.789 25109
19 1 1 . 1 1 3 3 PHE H H 3 8.177 8.177 9.492 -1.315 25109
20 1 1 . 1 1 4 4 ALA N N 4 121.170 121.170 122.564 -1.394 25109
21 1 1 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.017 -0.182 25109
22 1 1 . 1 1 4 4 ALA C C 4 181.522 181.522 179.094 2.428 25109
23 1 1 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.453 0.001 25109
24 1 1 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.404 1.032 25109
25 1 1 . 1 1 4 4 ALA H H 4 8.444 8.444 8.905 -0.461 25109
26 1 1 . 1 1 5 5 GLU N N 5 118.932 118.932 118.174 0.758 25109
27 1 1 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.999 -0.144 25109
28 1 1 . 1 1 5 5 GLU C C 5 177.971 177.971 177.926 0.045 25109
29 1 1 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.681 0.950 25109
30 1 1 . 1 1 5 5 GLU CB C 5 28.761 28.761 29.010 -0.249 25109
31 1 1 . 1 1 5 5 GLU H H 5 8.454 8.454 8.593 -0.139 25109
32 1 1 . 1 1 6 6 ASP N N 6 120.471 120.471 119.785 0.686 25109
33 1 1 . 1 1 6 6 ASP C C 6 178.885 178.885 178.045 0.840 25109
34 1 1 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.114 -0.042 25109
35 1 1 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.706 -1.574 25109
36 1 1 . 1 1 6 6 ASP H H 6 8.316 8.316 8.322 -0.006 25109
37 1 1 . 1 1 7 7 LYS N N 7 118.335 118.335 119.763 -1.428 25109
38 1 1 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.916 -0.226 25109
39 1 1 . 1 1 7 7 LYS C C 7 180.080 180.080 178.983 1.097 25109
40 1 1 . 1 1 7 7 LYS CA C 7 58.720 58.720 59.235 -0.515 25109
41 1 1 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.980 -0.186 25109
42 1 1 . 1 1 7 7 LYS H H 7 8.249 8.249 7.977 0.272 25109
43 1 1 . 1 1 8 8 THR N N 8 119.222 119.222 116.642 2.580 25109
44 1 1 . 1 1 8 8 THR HA H 8 3.975 3.975 3.948 0.027 25109
45 1 1 . 1 1 8 8 THR CA C 8 68.453 68.453 66.968 1.485 25109
46 1 1 . 1 1 8 8 THR CB C 8 67.387 67.387 68.701 -1.315 25109
47 1 1 . 1 1 8 8 THR H H 8 7.897 7.897 8.227 -0.330 25109
48 1 1 . 1 1 9 9 TYR N N 9 123.054 123.054 122.668 0.386 25109
49 1 1 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.114 0.139 25109
50 1 1 . 1 1 9 9 TYR C C 9 177.441 177.441 177.082 0.359 25109
51 1 1 . 1 1 9 9 TYR CA C 9 61.898 61.898 61.921 -0.023 25109
52 1 1 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.227 -0.378 25109
53 1 1 . 1 1 9 9 TYR H H 9 8.605 8.605 7.733 0.872 25109
54 1 1 . 1 1 10 10 LYS N N 10 118.366 118.366 118.472 -0.106 25109
55 1 1 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.757 -0.163 25109
56 1 1 . 1 1 10 10 LYS C C 10 178.885 178.885 179.040 -0.155 25109
57 1 1 . 1 1 10 10 LYS CA C 10 60.044 60.044 59.318 0.726 25109
58 1 1 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.311 -0.266 25109
59 1 1 . 1 1 10 10 LYS H H 10 8.066 8.066 7.639 0.427 25109
60 1 1 . 1 1 11 11 TYR N N 11 120.539 120.539 120.553 -0.014 25109
61 1 1 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.188 -0.198 25109
62 1 1 . 1 1 11 11 TYR C C 11 178.233 178.233 178.072 0.161 25109
63 1 1 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.419 1.109 25109
64 1 1 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.877 -0.514 25109
65 1 1 . 1 1 11 11 TYR H H 11 7.875 7.875 8.191 -0.316 25109
66 1 1 . 1 1 12 12 ILE N N 12 121.893 121.893 119.209 2.684 25109
67 1 1 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.766 -0.670 25109
68 1 1 . 1 1 12 12 ILE C C 12 177.015 177.015 177.916 -0.901 25109
69 1 1 . 1 1 12 12 ILE CA C 12 65.763 65.763 62.971 2.792 25109
70 1 1 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.083 1.469 25109
71 1 1 . 1 1 12 12 ILE H H 12 8.154 8.154 8.655 -0.501 25109
72 1 1 . 1 1 13 13 CYS N N 13 113.894 113.894 118.889 -4.995 25109
73 1 1 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.952 -0.065 25109
74 1 1 . 1 1 13 13 CYS C C 13 178.288 178.288 176.692 1.596 25109
75 1 1 . 1 1 13 13 CYS CA C 13 64.337 64.337 62.091 2.246 25109
76 1 1 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.612 0.393 25109
77 1 1 . 1 1 13 13 CYS H H 13 7.551 7.551 8.164 -0.613 25109
78 1 1 . 1 1 14 14 ARG N N 14 119.228 119.228 117.848 1.380 25109
79 1 1 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.181 -0.111 25109
80 1 1 . 1 1 14 14 ARG C C 14 177.127 177.127 176.719 0.408 25109
81 1 1 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.192 0.302 25109
82 1 1 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.399 0.023 25109
83 1 1 . 1 1 14 14 ARG H H 14 7.991 7.991 7.373 0.618 25109
84 1 1 . 1 1 15 15 ASN N N 15 117.367 117.367 115.742 1.625 25109
85 1 1 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.934 0.035 25109
86 1 1 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.630 0.133 25109
87 1 1 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.986 -0.401 25109
88 1 1 . 1 1 15 15 ASN H H 15 7.643 7.643 7.986 -0.343 25109
89 1 1 . 1 1 16 16 PHE N N 16 122.356 122.356 122.757 -0.401 25109
90 1 1 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.130 0.086 25109
91 1 1 . 1 1 16 16 PHE C C 16 178.084 178.084 176.458 1.626 25109
92 1 1 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.498 1.679 25109
93 1 1 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.343 1.246 25109
94 1 1 . 1 1 16 16 PHE H H 16 6.992 6.992 7.605 -0.613 25109
95 1 1 . 1 1 17 17 SER N N 17 112.937 112.937 113.316 -0.379 25109
96 1 1 . 1 1 17 17 SER HA H 17 4.199 4.199 4.120 0.079 25109
97 1 1 . 1 1 17 17 SER C C 17 176.726 176.726 175.512 1.214 25109
98 1 1 . 1 1 17 17 SER CA C 17 62.052 62.052 60.870 1.182 25109
99 1 1 . 1 1 17 17 SER CB C 17 62.552 62.552 63.097 -0.545 25109
100 1 1 . 1 1 17 17 SER H H 17 8.840 8.840 8.458 0.382 25109
101 1 1 . 1 1 18 18 ASN N N 18 118.809 118.809 120.654 -1.845 25109
102 1 1 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.631 -0.273 25109
103 1 1 . 1 1 18 18 ASN C C 18 175.967 175.967 176.787 -0.820 25109
104 1 1 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.153 -0.242 25109
105 1 1 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.767 -0.939 25109
106 1 1 . 1 1 18 18 ASN H H 18 8.130 8.130 8.250 -0.120 25109
107 1 1 . 1 1 19 19 PHE N N 19 115.750 115.750 116.616 -0.866 25109
108 1 1 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.543 -0.258 25109
109 1 1 . 1 1 19 19 PHE C C 19 175.370 175.370 176.169 -0.799 25109
110 1 1 . 1 1 19 19 PHE CA C 19 58.862 58.862 59.424 -0.562 25109
111 1 1 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.933 0.945 25109
112 1 1 . 1 1 19 19 PHE H H 19 8.062 8.062 7.533 0.529 25109
113 1 1 . 1 1 20 20 CYS N N 20 113.958 113.958 117.093 -3.135 25109
114 1 1 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.430 -0.487 25109
115 1 1 . 1 1 20 20 CYS C C 20 173.823 173.823 174.574 -0.751 25109
116 1 1 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.097 3.691 25109
117 1 1 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.025 0.358 25109
118 1 1 . 1 1 20 20 CYS H H 20 6.850 6.850 7.479 -0.629 25109
119 1 1 . 1 1 21 21 ASN N N 21 116.691 116.691 119.757 -3.066 25109
120 1 1 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.830 -0.086 25109
121 1 1 . 1 1 21 21 ASN C C 21 175.299 175.299 173.366 1.933 25109
122 1 1 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.915 0.375 25109
123 1 1 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.679 -0.366 25109
124 1 1 . 1 1 21 21 ASN H H 21 8.251 8.251 7.520 0.731 25109
125 1 1 . 1 1 22 22 VAL N N 22 122.431 122.431 119.066 3.365 25109
126 1 1 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.171 -0.621 25109
127 1 1 . 1 1 22 22 VAL C C 22 174.034 174.034 173.732 0.302 25109
128 1 1 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.271 3.666 25109
129 1 1 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.870 -4.347 25109
130 1 1 . 1 1 22 22 VAL H H 22 7.573 7.573 7.565 0.008 25109
131 1 1 . 1 1 23 23 ASP N N 23 127.219 127.219 123.036 4.183 25109
132 1 1 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.178 -0.992 25109
133 1 1 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.458 -2.665 25109
134 1 1 . 1 1 23 23 ASP H H 23 8.687 8.687 8.546 0.141 25109
135 1 1 . 1 1 24 24 VAL N N 24 127.835 127.835 124.688 3.147 25109
136 1 1 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.899 -0.606 25109
137 1 1 . 1 1 24 24 VAL C C 24 176.867 176.867 177.209 -0.342 25109
138 1 1 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.488 2.675 25109
139 1 1 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.089 -0.074 25109
140 1 1 . 1 1 24 24 VAL H H 24 9.409 9.409 8.823 0.586 25109
141 1 1 . 1 1 25 25 VAL N N 25 114.324 114.324 115.811 -1.487 25109
142 1 1 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.003 -0.484 25109
143 1 1 . 1 1 25 25 VAL C C 25 178.006 178.006 177.550 0.456 25109
144 1 1 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.020 1.668 25109
145 1 1 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.137 0.395 25109
146 1 1 . 1 1 25 25 VAL H H 25 8.038 8.038 7.839 0.199 25109
147 1 1 . 1 1 26 26 GLU N N 26 117.009 117.009 119.798 -2.789 25109
148 1 1 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.199 -0.108 25109
149 1 1 . 1 1 26 26 GLU C C 26 177.303 177.303 178.457 -1.154 25109
150 1 1 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.676 -1.244 25109
151 1 1 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.603 -0.638 25109
152 1 1 . 1 1 26 26 GLU H H 26 7.220 7.220 8.853 -1.633 25109
153 1 1 . 1 1 27 27 ILE N N 27 114.080 114.080 118.524 -4.444 25109
154 1 1 . 1 1 27 27 ILE HA H 27 4.361 4.361 4.023 0.338 25109
155 1 1 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.382 -1.650 25109
156 1 1 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.400 1.192 25109
157 1 1 . 1 1 27 27 ILE H H 27 7.647 7.647 7.279 0.368 25109
158 1 1 . 1 1 28 28 LEU N N 28 121.867 121.867 120.068 1.799 25109
159 1 1 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.373 -0.436 25109
160 1 1 . 1 1 28 28 LEU C C 28 175.756 175.756 177.683 -1.927 25109
161 1 1 . 1 1 28 28 LEU CA C 28 59.967 59.967 59.464 0.503 25109
162 1 1 . 1 1 28 28 LEU CB C 28 39.513 39.513 39.083 0.430 25109
163 1 1 . 1 1 28 28 LEU H H 28 7.434 7.434 7.399 0.035 25109
164 1 1 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.313 -0.103 25109
165 1 1 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.034 0.276 25109
166 1 1 . 1 1 30 30 TYR N N 30 113.832 113.832 115.977 -2.145 25109
167 1 1 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.663 -0.161 25109
168 1 1 . 1 1 30 30 TYR C C 30 174.386 174.386 174.841 -0.455 25109
169 1 1 . 1 1 30 30 TYR CA C 30 57.694 57.694 57.985 -0.291 25109
170 1 1 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.485 -0.386 25109
171 1 1 . 1 1 30 30 TYR H H 30 7.628 7.628 7.869 -0.241 25109
172 1 1 . 1 1 31 31 LEU N N 31 118.331 118.331 121.755 -3.424 25109
173 1 1 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.986 -0.109 25109
174 1 1 . 1 1 31 31 LEU C C 31 173.849 173.849 174.701 -0.852 25109
175 1 1 . 1 1 31 31 LEU CA C 31 51.692 51.692 52.015 -0.323 25109
176 1 1 . 1 1 31 31 LEU CB C 31 42.802 42.802 44.944 -2.142 25109
177 1 1 . 1 1 31 31 LEU H H 31 7.619 7.619 7.384 0.235 25109
178 1 1 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.633 -0.278 25109
179 1 1 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.006 0.404 25109
180 1 1 . 1 1 33 33 CYS N N 33 110.978 110.978 114.649 -3.671 25109
181 1 1 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.424 -0.083 25109
182 1 1 . 1 1 33 33 CYS C C 33 174.139 174.139 174.309 -0.170 25109
183 1 1 . 1 1 33 33 CYS CA C 33 56.212 56.212 56.806 -0.594 25109
184 1 1 . 1 1 33 33 CYS CB C 33 28.922 28.922 28.104 0.818 25109
185 1 1 . 1 1 33 33 CYS H H 33 6.414 6.414 8.065 -1.651 25109
186 1 1 . 1 1 34 34 LEU N N 34 123.111 123.111 120.420 2.691 25109
187 1 1 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.578 0.028 25109
188 1 1 . 1 1 34 34 LEU C C 34 176.646 176.646 176.776 -0.130 25109
189 1 1 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.642 0.249 25109
190 1 1 . 1 1 34 34 LEU CB C 34 42.691 42.691 44.622 -1.931 25109
191 1 1 . 1 1 34 34 LEU H H 34 7.550 7.550 7.439 0.111 25109
192 1 1 . 1 1 35 35 THR N N 35 113.831 113.831 115.557 -1.726 25109
193 1 1 . 1 1 35 35 THR HA H 35 4.205 4.205 4.367 -0.162 25109
194 1 1 . 1 1 35 35 THR C C 35 175.324 175.324 175.958 -0.634 25109
195 1 1 . 1 1 35 35 THR CA C 35 61.200 61.200 61.428 -0.228 25109
196 1 1 . 1 1 35 35 THR CB C 35 71.318 71.318 69.788 1.530 25109
197 1 1 . 1 1 35 35 THR H H 35 8.586 8.586 8.302 0.284 25109
198 1 1 . 1 1 36 36 ALA N N 36 124.128 124.128 127.630 -3.502 25109
199 1 1 . 1 1 36 36 ALA HA H 36 3.924 3.924 3.938 -0.014 25109
200 1 1 . 1 1 36 36 ALA C C 36 180.397 180.397 179.798 0.599 25109
201 1 1 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.238 0.682 25109
202 1 1 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.685 -0.882 25109
203 1 1 . 1 1 36 36 ALA H H 36 8.836 8.836 8.762 0.074 25109
204 1 1 . 1 1 37 37 ARG N N 37 116.793 116.793 118.520 -1.727 25109
205 1 1 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.006 -0.020 25109
206 1 1 . 1 1 37 37 ARG C C 37 179.272 179.272 178.127 1.145 25109
207 1 1 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.751 -0.519 25109
208 1 1 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.776 0.129 25109
209 1 1 . 1 1 37 37 ARG H H 37 8.060 8.060 8.632 -0.572 25109
210 1 1 . 1 1 38 38 ASP N N 38 120.030 120.030 119.367 0.663 25109
211 1 1 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.340 -0.092 25109
212 1 1 . 1 1 38 38 ASP C C 38 178.885 178.885 178.988 -0.103 25109
213 1 1 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.019 -0.832 25109
214 1 1 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.293 0.640 25109
215 1 1 . 1 1 38 38 ASP H H 38 7.782 7.782 7.650 0.132 25109
216 1 1 . 1 1 39 39 GLN N N 39 118.223 118.223 117.573 0.650 25109
217 1 1 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.057 -0.392 25109
218 1 1 . 1 1 39 39 GLN C C 39 178.041 178.041 178.138 -0.097 25109
219 1 1 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.109 2.492 25109
220 1 1 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.286 -0.489 25109
221 1 1 . 1 1 39 39 GLN H H 39 8.476 8.476 7.761 0.715 25109
222 1 1 . 1 1 40 40 ASP N N 40 117.908 117.908 120.377 -2.469 25109
223 1 1 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.361 -0.108 25109
224 1 1 . 1 1 40 40 ASP C C 40 178.639 178.639 177.435 1.204 25109
225 1 1 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.084 -0.684 25109
226 1 1 . 1 1 40 40 ASP CB C 40 38.028 38.028 41.012 -2.984 25109
227 1 1 . 1 1 40 40 ASP H H 40 8.386 8.386 8.480 -0.094 25109
228 1 1 . 1 1 41 41 ARG N N 41 120.990 120.990 118.533 2.457 25109
229 1 1 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.052 -0.010 25109
230 1 1 . 1 1 41 41 ARG C C 41 179.795 179.795 178.123 1.672 25109
231 1 1 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.829 0.616 25109
232 1 1 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.470 -0.212 25109
233 1 1 . 1 1 41 41 ARG H H 41 8.130 8.130 7.934 0.196 25109
234 1 1 . 1 1 42 42 LEU N N 42 121.219 121.219 118.458 2.761 25109
235 1 1 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.095 -0.160 25109
236 1 1 . 1 1 42 42 LEU C C 42 178.850 178.850 178.385 0.465 25109
237 1 1 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.402 0.865 25109
238 1 1 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.780 0.253 25109
239 1 1 . 1 1 42 42 LEU H H 42 8.179 8.179 7.560 0.619 25109
240 1 1 . 1 1 43 43 ARG N N 43 119.310 119.310 117.914 1.396 25109
241 1 1 . 1 1 43 43 ARG HA H 43 3.724 3.724 4.140 -0.416 25109
242 1 1 . 1 1 43 43 ARG C C 43 179.099 179.099 176.044 3.055 25109
243 1 1 . 1 1 43 43 ARG CA C 43 60.814 60.814 57.270 3.544 25109
244 1 1 . 1 1 43 43 ARG CB C 43 30.179 30.179 29.875 0.304 25109
245 1 1 . 1 1 43 43 ARG H H 43 8.296 8.296 7.845 0.451 25109
246 1 1 . 1 1 44 44 ALA N N 44 121.305 121.305 121.728 -0.423 25109
247 1 1 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.445 -0.342 25109
248 1 1 . 1 1 44 44 ALA C C 44 180.924 180.924 178.962 1.962 25109
249 1 1 . 1 1 44 44 ALA CA C 44 55.225 55.225 53.849 1.377 25109
250 1 1 . 1 1 44 44 ALA CB C 44 18.096 18.096 19.589 -1.493 25109
251 1 1 . 1 1 44 44 ALA H H 44 7.774 7.774 7.702 0.072 25109
252 1 1 . 1 1 45 45 THR N N 45 115.017 115.017 116.828 -1.811 25109
253 1 1 . 1 1 45 45 THR HA H 45 3.879 3.879 4.111 -0.232 25109
254 1 1 . 1 1 45 45 THR CA C 45 66.327 66.327 66.326 0.001 25109
255 1 1 . 1 1 45 45 THR CB C 45 68.809 68.809 68.589 0.220 25109
256 1 1 . 1 1 45 45 THR H H 45 8.167 8.167 8.223 -0.056 25109
257 1 1 . 1 1 46 46 CYS N N 46 123.609 123.609 118.229 5.380 25109
258 1 1 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.578 -0.559 25109
259 1 1 . 1 1 46 46 CYS C C 46 178.077 178.077 176.564 1.513 25109
260 1 1 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.816 1.129 25109
261 1 1 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.003 -0.864 25109
262 1 1 . 1 1 46 46 CYS H H 46 8.084 8.084 8.025 0.059 25109
263 1 1 . 1 1 47 47 THR N N 47 115.520 115.520 116.505 -0.985 25109
264 1 1 . 1 1 47 47 THR HA H 47 3.915 3.915 4.157 -0.242 25109
265 1 1 . 1 1 47 47 THR CA C 47 66.063 66.063 65.496 0.567 25109
266 1 1 . 1 1 47 47 THR CB C 47 69.245 69.245 68.555 0.690 25109
267 1 1 . 1 1 47 47 THR H H 47 7.735 7.735 7.548 0.187 25109
268 1 1 . 1 1 48 48 LEU N N 48 120.099 120.099 120.727 -0.628 25109
269 1 1 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.312 -0.086 25109
270 1 1 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.055 0.508 25109
271 1 1 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.621 1.004 25109
272 1 1 . 1 1 48 48 LEU H H 48 7.464 7.464 7.573 -0.109 25109
273 1 1 . 1 1 49 49 SER N N 49 111.979 111.979 111.859 0.120 25109
274 1 1 . 1 1 49 49 SER HA H 49 4.661 4.661 4.485 0.176 25109
275 1 1 . 1 1 49 49 SER C C 49 175.581 175.581 175.169 0.412 25109
276 1 1 . 1 1 49 49 SER CA C 49 59.590 59.590 59.179 0.411 25109
277 1 1 . 1 1 49 49 SER CB C 49 65.335 65.335 65.015 0.320 25109
278 1 1 . 1 1 49 49 SER H H 49 8.781 8.781 8.375 0.406 25109
279 1 1 . 1 1 50 50 GLY N N 50 110.194 110.194 109.540 0.654 25109
280 1 1 . 1 1 50 50 GLY C C 50 175.123 175.123 174.005 1.118 25109
281 1 1 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.447 -0.544 25109
282 1 1 . 1 1 50 50 GLY H H 50 7.955 7.955 7.922 0.033 25109
283 1 1 . 1 1 51 51 ASN N N 51 121.050 121.050 122.108 -1.058 25109
284 1 1 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.697 -0.447 25109
285 1 1 . 1 1 51 51 ASN C C 51 176.403 176.403 176.616 -0.213 25109
286 1 1 . 1 1 51 51 ASN CA C 51 59.303 59.303 54.287 5.016 25109
287 1 1 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.941 2.658 25109
288 1 1 . 1 1 51 51 ASN H H 51 8.898 8.898 8.617 0.281 25109
289 1 1 . 1 1 52 52 ARG N N 52 119.825 119.825 121.809 -1.984 25109
290 1 1 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.134 -0.096 25109
291 1 1 . 1 1 52 52 ARG C C 52 178.850 178.850 178.272 0.578 25109
292 1 1 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.297 0.766 25109
293 1 1 . 1 1 52 52 ARG CB C 52 30.023 30.023 30.124 -0.101 25109
294 1 1 . 1 1 52 52 ARG H H 52 8.696 8.696 8.689 0.007 25109
295 1 1 . 1 1 53 53 ASP N N 53 116.032 116.032 117.975 -1.943 25109
296 1 1 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.698 -0.152 25109
297 1 1 . 1 1 53 53 ASP C C 53 178.996 178.996 178.877 0.119 25109
298 1 1 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.998 -1.919 25109
299 1 1 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.557 -2.186 25109
300 1 1 . 1 1 53 53 ASP H H 53 9.036 9.036 8.057 0.979 25109
301 1 1 . 1 1 54 54 THR N N 54 115.848 115.848 117.722 -1.874 25109
302 1 1 . 1 1 54 54 THR HA H 54 3.746 3.746 4.211 -0.465 25109
303 1 1 . 1 1 54 54 THR CA C 54 67.885 67.885 66.577 1.308 25109
304 1 1 . 1 1 54 54 THR CB C 54 66.953 66.953 68.746 -1.793 25109
305 1 1 . 1 1 54 54 THR H H 54 7.782 7.782 7.532 0.250 25109
306 1 1 . 1 1 55 55 LEU N N 55 125.987 125.987 123.350 2.637 25109
307 1 1 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.166 -0.612 25109
308 1 1 . 1 1 55 55 LEU C C 55 177.901 177.901 178.221 -0.320 25109
309 1 1 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.779 -0.326 25109
310 1 1 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.906 -0.043 25109
311 1 1 . 1 1 55 55 LEU H H 55 8.740 8.740 8.696 0.044 25109
312 1 1 . 1 1 56 56 TRP N N 56 116.672 116.672 120.606 -3.934 25109
313 1 1 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.360 -0.280 25109
314 1 1 . 1 1 56 56 TRP C C 56 179.588 179.588 178.172 1.416 25109
315 1 1 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.388 0.093 25109
316 1 1 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.502 -0.310 25109
317 1 1 . 1 1 56 56 TRP H H 56 7.642 7.642 8.784 -1.142 25109
318 1 1 . 1 1 57 57 HIS N N 57 115.754 115.754 116.862 -1.108 25109
319 1 1 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.137 0.139 25109
320 1 1 . 1 1 57 57 HIS C C 57 177.514 177.514 177.674 -0.160 25109
321 1 1 . 1 1 57 57 HIS CA C 57 58.952 58.952 60.218 -1.266 25109
322 1 1 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.748 -1.746 25109
323 1 1 . 1 1 57 57 HIS H H 57 7.407 7.407 8.100 -0.693 25109
324 1 1 . 1 1 58 58 LEU N N 58 123.934 123.934 123.403 0.531 25109
325 1 1 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.896 -0.109 25109
326 1 1 . 1 1 58 58 LEU C C 58 178.115 178.115 177.871 0.244 25109
327 1 1 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.177 0.732 25109
328 1 1 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.484 -0.669 25109
329 1 1 . 1 1 58 58 LEU H H 58 8.996 8.996 8.320 0.676 25109
330 1 1 . 1 1 59 59 PHE N N 59 117.721 117.721 116.880 0.841 25109
331 1 1 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.637 0.298 25109
332 1 1 . 1 1 59 59 PHE C C 59 176.987 176.987 177.858 -0.871 25109
333 1 1 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.123 -2.010 25109
334 1 1 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.718 -0.758 25109
335 1 1 . 1 1 59 59 PHE H H 59 8.201 8.201 8.267 -0.066 25109
336 1 1 . 1 1 60 60 ASN N N 60 115.695 115.695 116.887 -1.192 25109
337 1 1 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.033 -0.114 25109
338 1 1 . 1 1 60 60 ASN C C 60 176.670 176.670 176.567 0.103 25109
339 1 1 . 1 1 60 60 ASN CA C 60 56.756 56.756 55.740 1.016 25109
340 1 1 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.188 1.130 25109
341 1 1 . 1 1 60 60 ASN H H 60 7.666 7.666 8.053 -0.387 25109
342 1 1 . 1 1 61 61 THR N N 61 115.110 115.110 113.151 1.959 25109
343 1 1 . 1 1 61 61 THR HA H 61 3.733 3.733 4.099 -0.366 25109
344 1 1 . 1 1 61 61 THR CA C 61 66.319 66.319 64.535 1.784 25109
345 1 1 . 1 1 61 61 THR CB C 61 69.174 69.174 69.113 0.061 25109
346 1 1 . 1 1 61 61 THR H H 61 7.782 7.782 7.608 0.174 25109
347 1 1 . 1 1 62 62 LEU N N 62 121.559 121.559 123.963 -2.404 25109
348 1 1 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.808 -0.319 25109
349 1 1 . 1 1 62 62 LEU C C 62 176.600 176.600 178.094 -1.494 25109
350 1 1 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.257 -0.292 25109
351 1 1 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.672 1.663 25109
352 1 1 . 1 1 62 62 LEU H H 62 8.362 8.362 8.335 0.027 25109
353 1 1 . 1 1 63 63 GLN N N 63 109.150 109.150 115.439 -6.289 25109
354 1 1 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.415 -1.338 25109
355 1 1 . 1 1 63 63 GLN C C 63 175.194 175.194 177.102 -1.908 25109
356 1 1 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.392 -1.126 25109
357 1 1 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.797 -2.103 25109
358 1 1 . 1 1 63 63 GLN H H 63 6.458 6.458 7.593 -1.135 25109
359 1 1 . 1 1 64 64 ARG N N 64 116.029 116.029 117.479 -1.450 25109
360 1 1 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.354 -0.256 25109
361 1 1 . 1 1 64 64 ARG C C 64 176.459 176.459 176.218 0.241 25109
362 1 1 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.028 1.115 25109
363 1 1 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.174 0.410 25109
364 1 1 . 1 1 64 64 ARG H H 64 6.596 6.596 7.206 -0.610 25109
365 1 1 . 1 1 65 65 ARG N N 65 120.422 120.422 120.454 -0.032 25109
366 1 1 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.851 -0.017 25109
367 1 1 . 1 1 65 65 ARG C C 65 173.436 173.436 173.627 -0.191 25109
368 1 1 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.780 -0.235 25109
369 1 1 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.542 -0.546 25109
370 1 1 . 1 1 65 65 ARG H H 65 7.932 7.932 7.911 0.021 25109
371 1 1 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.452 0.122 25109
372 1 1 . 1 1 66 66 PRO CB C 66 32.059 32.059 30.873 1.186 25109
373 1 1 . 1 1 67 67 GLY N N 67 111.953 111.953 110.723 1.230 25109
374 1 1 . 1 1 67 67 GLY C C 67 177.057 177.057 175.980 1.077 25109
375 1 1 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.085 1.222 25109
376 1 1 . 1 1 67 67 GLY H H 67 9.198 9.198 7.990 1.208 25109
377 1 1 . 1 1 68 68 TRP N N 68 117.467 117.467 122.225 -4.758 25109
378 1 1 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.419 -0.077 25109
379 1 1 . 1 1 68 68 TRP C C 68 177.690 177.690 176.663 1.027 25109
380 1 1 . 1 1 68 68 TRP CA C 68 60.116 60.116 60.369 -0.253 25109
381 1 1 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.365 0.825 25109
382 1 1 . 1 1 68 68 TRP H H 68 7.647 7.647 8.721 -1.074 25109
383 1 1 . 1 1 69 69 VAL N N 69 121.482 121.482 120.304 1.178 25109
384 1 1 . 1 1 69 69 VAL HA H 69 2.637 2.637 2.938 -0.301 25109
385 1 1 . 1 1 69 69 VAL C C 69 177.993 177.993 178.254 -0.261 25109
386 1 1 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.689 1.777 25109
387 1 1 . 1 1 69 69 VAL CB C 69 30.026 30.026 29.706 0.320 25109
388 1 1 . 1 1 69 69 VAL H H 69 6.666 6.666 7.244 -0.578 25109
389 1 1 . 1 1 70 70 GLU N N 70 116.350 116.350 119.154 -2.804 25109
390 1 1 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.714 0.111 25109
391 1 1 . 1 1 70 70 GLU C C 70 180.362 180.362 179.225 1.137 25109
392 1 1 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.319 -0.098 25109
393 1 1 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.957 -1.652 25109
394 1 1 . 1 1 70 70 GLU H H 70 7.410 7.410 7.496 -0.086 25109
395 1 1 . 1 1 71 71 TYR N N 71 116.750 116.750 117.977 -1.227 25109
396 1 1 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.350 0.100 25109
397 1 1 . 1 1 71 71 TYR C C 71 178.411 178.411 177.970 0.441 25109
398 1 1 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.174 1.428 25109
399 1 1 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.332 0.023 25109
400 1 1 . 1 1 71 71 TYR H H 71 7.159 7.159 7.367 -0.208 25109
401 1 1 . 1 1 72 72 PHE N N 72 121.610 121.610 121.056 0.554 25109
402 1 1 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.299 0.203 25109
403 1 1 . 1 1 72 72 PHE CA C 72 60.820 60.820 60.484 0.336 25109
404 1 1 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.212 0.837 25109
405 1 1 . 1 1 72 72 PHE H H 72 9.007 9.007 8.416 0.591 25109
406 1 1 . 1 1 73 73 ILE N N 73 119.200 119.200 119.367 -0.167 25109
407 1 1 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.583 -0.403 25109
408 1 1 . 1 1 73 73 ILE C C 73 177.620 177.620 177.704 -0.084 25109
409 1 1 . 1 1 73 73 ILE CA C 73 67.197 67.197 63.526 3.671 25109
410 1 1 . 1 1 73 73 ILE CB C 73 39.023 39.023 36.346 2.677 25109
411 1 1 . 1 1 73 73 ILE H H 73 8.644 8.644 8.056 0.588 25109
412 1 1 . 1 1 74 74 ALA N N 74 119.624 119.624 120.377 -0.753 25109
413 1 1 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.081 -0.127 25109
414 1 1 . 1 1 74 74 ALA C C 74 181.030 181.030 178.465 2.565 25109
415 1 1 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.453 0.958 25109
416 1 1 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.158 -0.022 25109
417 1 1 . 1 1 74 74 ALA H H 74 7.476 7.476 7.621 -0.145 25109
418 1 1 . 1 1 75 75 ALA N N 75 123.625 123.625 121.698 1.927 25109
419 1 1 . 1 1 75 75 ALA HA H 75 3.838 3.838 4.299 -0.461 25109
420 1 1 . 1 1 75 75 ALA C C 75 179.272 179.272 179.558 -0.286 25109
421 1 1 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.600 0.502 25109
422 1 1 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.680 0.913 25109
423 1 1 . 1 1 75 75 ALA H H 75 8.524 8.524 7.124 1.400 25109
424 1 1 . 1 1 76 76 LEU N N 76 118.114 118.114 120.208 -2.094 25109
425 1 1 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.108 -0.436 25109
426 1 1 . 1 1 76 76 LEU C C 76 180.001 180.001 179.030 0.971 25109
427 1 1 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.172 1.084 25109
428 1 1 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.413 1.206 25109
429 1 1 . 1 1 76 76 LEU H H 76 8.153 8.153 7.645 0.508 25109
430 1 1 . 1 1 77 77 ARG N N 77 117.830 117.830 119.182 -1.352 25109
431 1 1 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.016 -0.569 25109
432 1 1 . 1 1 77 77 ARG C C 77 180.889 180.889 179.085 1.804 25109
433 1 1 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.205 1.861 25109
434 1 1 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.938 -0.741 25109
435 1 1 . 1 1 77 77 ARG H H 77 7.945 7.945 8.155 -0.210 25109
436 1 1 . 1 1 78 78 GLY N N 78 110.202 110.202 106.085 4.117 25109
437 1 1 . 1 1 78 78 GLY C C 78 174.807 174.807 173.977 0.830 25109
438 1 1 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.114 0.446 25109
439 1 1 . 1 1 78 78 GLY H H 78 8.269 8.269 7.754 0.515 25109
440 1 1 . 1 1 79 79 CYS N N 79 115.567 115.567 115.370 0.197 25109
441 1 1 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.472 -0.083 25109
442 1 1 . 1 1 79 79 CYS C C 79 173.025 173.025 174.235 -1.210 25109
443 1 1 . 1 1 79 79 CYS CA C 79 59.957 59.957 56.823 3.134 25109
444 1 1 . 1 1 79 79 CYS CB C 79 27.805 27.805 26.170 1.635 25109
445 1 1 . 1 1 79 79 CYS H H 79 7.132 7.132 7.230 -0.098 25109
446 1 1 . 1 1 80 80 GLU N N 80 111.759 111.759 116.796 -5.037 25109
447 1 1 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.841 -0.108 25109
448 1 1 . 1 1 80 80 GLU C C 80 175.827 175.827 175.117 0.710 25109
449 1 1 . 1 1 80 80 GLU CA C 80 57.467 57.467 58.162 -0.695 25109
450 1 1 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.984 -2.267 25109
451 1 1 . 1 1 80 80 GLU H H 80 7.772 7.772 8.110 -0.338 25109
452 1 1 . 1 1 81 81 LEU N N 81 124.692 124.692 120.822 3.870 25109
453 1 1 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.434 0.257 25109
454 1 1 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.668 -0.713 25109
455 1 1 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.462 -1.071 25109
456 1 1 . 1 1 81 81 LEU H H 81 8.167 8.167 7.983 0.184 25109
457 1 1 . 1 1 82 82 VAL N N 82 118.320 118.320 122.411 -4.091 25109
458 1 1 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.613 -0.436 25109
459 1 1 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.767 -0.057 25109
460 1 1 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.849 0.099 25109
461 1 1 . 1 1 82 82 VAL H H 82 7.141 7.141 7.536 -0.395 25109
462 1 1 . 1 1 83 83 ASP N N 83 118.733 118.733 119.849 -1.116 25109
463 1 1 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.307 0.025 25109
464 1 1 . 1 1 83 83 ASP C C 83 178.674 178.674 178.216 0.458 25109
465 1 1 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.958 -1.515 25109
466 1 1 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.545 -3.716 25109
467 1 1 . 1 1 83 83 ASP H H 83 8.385 8.385 8.646 -0.261 25109
468 1 1 . 1 1 84 84 LEU N N 84 121.026 121.026 119.228 1.798 25109
469 1 1 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.823 0.156 25109
470 1 1 . 1 1 84 84 LEU C C 84 178.796 178.796 178.794 0.002 25109
471 1 1 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.031 0.491 25109
472 1 1 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.344 1.151 25109
473 1 1 . 1 1 84 84 LEU H H 84 7.770 7.770 7.514 0.256 25109
474 1 1 . 1 1 85 85 ALA N N 85 121.525 121.525 122.869 -1.344 25109
475 1 1 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.925 -0.264 25109
476 1 1 . 1 1 85 85 ALA C C 85 179.322 179.322 178.987 0.335 25109
477 1 1 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.085 0.756 25109
478 1 1 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.149 0.777 25109
479 1 1 . 1 1 85 85 ALA H H 85 8.126 8.126 7.565 0.561 25109
480 1 1 . 1 1 86 86 ASP N N 86 115.349 115.349 118.755 -3.406 25109
481 1 1 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.280 -0.007 25109
482 1 1 . 1 1 86 86 ASP C C 86 178.463 178.463 178.624 -0.161 25109
483 1 1 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.592 -1.881 25109
484 1 1 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.758 -3.596 25109
485 1 1 . 1 1 86 86 ASP H H 86 8.410 8.410 8.366 0.044 25109
486 1 1 . 1 1 87 87 GLU N N 87 122.529 122.529 119.265 3.264 25109
487 1 1 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.108 -0.072 25109
488 1 1 . 1 1 87 87 GLU C C 87 178.508 178.508 179.513 -1.005 25109
489 1 1 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.423 -0.069 25109
490 1 1 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.694 -1.421 25109
491 1 1 . 1 1 87 87 GLU H H 87 8.012 8.012 8.084 -0.072 25109
492 1 1 . 1 1 88 88 VAL N N 88 119.148 119.148 119.437 -0.289 25109
493 1 1 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.753 -0.423 25109
494 1 1 . 1 1 88 88 VAL C C 88 177.240 177.240 178.048 -0.808 25109
495 1 1 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.232 1.017 25109
496 1 1 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.642 -0.113 25109
497 1 1 . 1 1 88 88 VAL H H 88 8.291 8.291 7.660 0.631 25109
498 1 1 . 1 1 89 89 ALA N N 89 120.709 120.709 122.719 -2.010 25109
499 1 1 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.015 -0.100 25109
500 1 1 . 1 1 89 89 ALA C C 89 180.186 180.186 179.643 0.543 25109
501 1 1 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.487 0.572 25109
502 1 1 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.208 0.027 25109
503 1 1 . 1 1 89 89 ALA H H 89 8.548 8.548 8.587 -0.039 25109
504 1 1 . 1 1 90 90 SER N N 90 113.035 113.035 112.713 0.322 25109
505 1 1 . 1 1 90 90 SER HA H 90 4.047 4.047 4.233 -0.186 25109
506 1 1 . 1 1 90 90 SER C C 90 177.564 177.564 175.610 1.954 25109
507 1 1 . 1 1 90 90 SER CA C 90 61.771 61.771 61.381 0.390 25109
508 1 1 . 1 1 90 90 SER CB C 90 62.907 62.907 63.374 -0.467 25109
509 1 1 . 1 1 90 90 SER H H 90 7.969 7.969 8.127 -0.158 25109
510 1 1 . 1 1 91 91 VAL N N 91 123.417 123.417 120.638 2.779 25109
511 1 1 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.581 -0.234 25109
512 1 1 . 1 1 91 91 VAL C C 91 178.428 178.428 176.864 1.564 25109
513 1 1 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.567 0.562 25109
514 1 1 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.878 -0.107 25109
515 1 1 . 1 1 91 91 VAL H H 91 7.713 7.713 7.401 0.312 25109
516 1 1 . 1 1 92 92 TYR N N 92 121.458 121.458 120.993 0.465 25109
517 1 1 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.688 -0.497 25109
518 1 1 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.301 1.693 25109
519 1 1 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.364 0.621 25109
520 1 1 . 1 1 92 92 TYR H H 92 8.395 8.395 8.347 0.048 25109
521 1 1 . 1 1 93 93 GLN N N 93 115.549 115.549 117.975 -2.426 25109
522 1 1 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.066 -0.355 25109
523 1 1 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.563 0.531 25109
524 1 1 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.263 0.035 25109
525 1 1 . 1 1 93 93 GLN H H 93 8.167 8.167 7.761 0.406 25109
526 1 1 . 1 1 94 94 SER N N 94 115.923 115.923 112.561 3.362 25109
527 1 1 . 1 1 94 94 SER HA H 94 4.096 4.096 4.322 -0.226 25109
528 1 1 . 1 1 94 94 SER CA C 94 60.971 60.971 58.677 2.294 25109
529 1 1 . 1 1 94 94 SER CB C 94 62.635 62.635 64.209 -1.574 25109
530 1 1 . 1 1 94 94 SER H H 94 7.642 7.642 7.522 0.120 25109
531 1 1 . 1 1 95 95 TYR N N 95 119.565 119.565 122.017 -2.452 25109
532 1 1 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.469 0.290 25109
533 1 1 . 1 1 95 95 TYR C C 95 175.334 175.334 174.813 0.521 25109
534 1 1 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.975 -0.277 25109
535 1 1 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.203 2.116 25109
536 1 1 . 1 1 95 95 TYR H H 95 7.069 7.069 7.987 -0.918 25109
537 1 1 . 1 1 96 96 GLN N N 96 119.872 119.872 119.193 0.679 25109
538 1 1 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.904 0.461 25109
539 1 1 . 1 1 96 96 GLN C C 96 173.612 173.612 173.784 -0.172 25109
540 1 1 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.735 -1.399 25109
541 1 1 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.086 1.408 25109
542 1 1 . 1 1 96 96 GLN H H 96 7.409 7.409 8.286 -0.877 25109
543 1 1 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.101 0.217 25109
544 1 1 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.914 -0.900 25109
545 1 1 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.604 -0.506 25109
546 1 1 . 1 1 98 98 ARG N N 98 121.759 121.759 117.409 4.350 25109
547 1 1 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.525 -0.183 25109
548 1 1 . 1 1 98 98 ARG C C 98 176.848 176.848 174.342 2.506 25109
549 1 1 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.697 0.524 25109
550 1 1 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.914 0.173 25109
551 1 1 . 1 1 98 98 ARG H H 98 8.423 8.423 7.787 0.636 25109
552 1 1 . 1 1 99 99 THR N N 99 115.292 115.292 119.070 -3.778 25109
553 1 1 . 1 1 99 99 THR HA H 99 4.323 4.323 4.621 -0.298 25109
554 1 1 . 1 1 99 99 THR C C 99 174.350 174.350 174.171 0.179 25109
555 1 1 . 1 1 99 99 THR CA C 99 61.906 61.906 62.483 -0.577 25109
556 1 1 . 1 1 99 99 THR CB C 99 70.180 70.180 68.341 1.839 25109
557 1 1 . 1 1 99 99 THR H H 99 8.179 8.179 8.315 -0.136 25109
558 1 2 . 1 1 0 0 SER N N 0 115.693 115.693 117.158 -1.465 25109
559 1 2 . 1 1 0 0 SER HA H 0 4.531 4.531 4.144 0.387 25109
560 1 2 . 1 1 0 0 SER C C 0 174.557 174.557 174.219 0.338 25109
561 1 2 . 1 1 0 0 SER CA C 0 58.478 58.478 59.186 -0.708 25109
562 1 2 . 1 1 0 0 SER CB C 0 64.380 64.380 63.505 0.875 25109
563 1 2 . 1 1 0 0 SER H H 0 8.631 8.631 8.993 -0.362 25109
564 1 2 . 1 1 1 1 MET N N 1 123.111 123.111 120.236 2.875 25109
565 1 2 . 1 1 1 1 MET HA H 1 4.728 4.728 4.305 0.423 25109
566 1 2 . 1 1 1 1 MET C C 1 174.846 174.846 174.160 0.686 25109
567 1 2 . 1 1 1 1 MET CA C 1 55.655 55.655 55.025 0.630 25109
568 1 2 . 1 1 1 1 MET CB C 1 32.035 32.035 32.079 -0.044 25109
569 1 2 . 1 1 1 1 MET H H 1 8.641 8.641 8.938 -0.297 25109
570 1 2 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.707 -0.230 25109
571 1 2 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.678 0.322 25109
572 1 2 . 1 1 3 3 PHE N N 3 121.126 121.126 125.365 -4.239 25109
573 1 2 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.609 -0.243 25109
574 1 2 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.410 1.452 25109
575 1 2 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.558 -1.190 25109
576 1 2 . 1 1 3 3 PHE H H 3 8.177 8.177 8.814 -0.637 25109
577 1 2 . 1 1 4 4 ALA N N 4 121.170 121.170 122.958 -1.788 25109
578 1 2 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.127 -0.292 25109
579 1 2 . 1 1 4 4 ALA C C 4 181.522 181.522 179.283 2.239 25109
580 1 2 . 1 1 4 4 ALA CA C 4 55.454 55.454 56.013 -0.559 25109
581 1 2 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.398 1.038 25109
582 1 2 . 1 1 4 4 ALA H H 4 8.444 8.444 8.888 -0.444 25109
583 1 2 . 1 1 5 5 GLU N N 5 118.932 118.932 118.342 0.590 25109
584 1 2 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.898 -0.043 25109
585 1 2 . 1 1 5 5 GLU C C 5 177.971 177.971 178.086 -0.115 25109
586 1 2 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.362 0.269 25109
587 1 2 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.513 0.248 25109
588 1 2 . 1 1 5 5 GLU H H 5 8.454 8.454 8.610 -0.156 25109
589 1 2 . 1 1 6 6 ASP N N 6 120.471 120.471 119.307 1.164 25109
590 1 2 . 1 1 6 6 ASP C C 6 178.885 178.885 178.026 0.859 25109
591 1 2 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.539 -0.467 25109
592 1 2 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.653 -1.521 25109
593 1 2 . 1 1 6 6 ASP H H 6 8.316 8.316 8.496 -0.180 25109
594 1 2 . 1 1 7 7 LYS N N 7 118.335 118.335 118.705 -0.370 25109
595 1 2 . 1 1 7 7 LYS HA H 7 3.690 3.690 4.034 -0.344 25109
596 1 2 . 1 1 7 7 LYS C C 7 180.080 180.080 178.968 1.112 25109
597 1 2 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.603 0.117 25109
598 1 2 . 1 1 7 7 LYS CB C 7 31.794 31.794 32.063 -0.269 25109
599 1 2 . 1 1 7 7 LYS H H 7 8.249 8.249 7.749 0.500 25109
600 1 2 . 1 1 8 8 THR N N 8 119.222 119.222 118.141 1.081 25109
601 1 2 . 1 1 8 8 THR HA H 8 3.975 3.975 4.010 -0.035 25109
602 1 2 . 1 1 8 8 THR CA C 8 68.453 68.453 67.257 1.196 25109
603 1 2 . 1 1 8 8 THR CB C 8 67.387 67.387 68.894 -1.507 25109
604 1 2 . 1 1 8 8 THR H H 8 7.897 7.897 7.969 -0.072 25109
605 1 2 . 1 1 9 9 TYR N N 9 123.054 123.054 122.915 0.139 25109
606 1 2 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.186 0.067 25109
607 1 2 . 1 1 9 9 TYR C C 9 177.441 177.441 177.587 -0.146 25109
608 1 2 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.174 -0.276 25109
609 1 2 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.487 -0.638 25109
610 1 2 . 1 1 9 9 TYR H H 9 8.605 8.605 8.682 -0.077 25109
611 1 2 . 1 1 10 10 LYS N N 10 118.366 118.366 118.671 -0.305 25109
612 1 2 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.798 -0.204 25109
613 1 2 . 1 1 10 10 LYS C C 10 178.885 178.885 178.847 0.038 25109
614 1 2 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.279 1.765 25109
615 1 2 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.413 0.632 25109
616 1 2 . 1 1 10 10 LYS H H 10 8.066 8.066 7.979 0.087 25109
617 1 2 . 1 1 11 11 TYR N N 11 120.539 120.539 120.332 0.207 25109
618 1 2 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.212 -0.222 25109
619 1 2 . 1 1 11 11 TYR C C 11 178.233 178.233 177.991 0.242 25109
620 1 2 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.488 1.040 25109
621 1 2 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.914 -0.551 25109
622 1 2 . 1 1 11 11 TYR H H 11 7.875 7.875 7.947 -0.072 25109
623 1 2 . 1 1 12 12 ILE N N 12 121.893 121.893 119.147 2.746 25109
624 1 2 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.989 -0.893 25109
625 1 2 . 1 1 12 12 ILE C C 12 177.015 177.015 178.228 -1.213 25109
626 1 2 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.481 2.282 25109
627 1 2 . 1 1 12 12 ILE CB C 12 37.552 37.552 35.970 1.582 25109
628 1 2 . 1 1 12 12 ILE H H 12 8.154 8.154 8.444 -0.290 25109
629 1 2 . 1 1 13 13 CYS N N 13 113.894 113.894 118.199 -4.305 25109
630 1 2 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.884 0.003 25109
631 1 2 . 1 1 13 13 CYS C C 13 178.288 178.288 176.212 2.076 25109
632 1 2 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.847 2.490 25109
633 1 2 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.499 0.506 25109
634 1 2 . 1 1 13 13 CYS H H 13 7.551 7.551 7.737 -0.186 25109
635 1 2 . 1 1 14 14 ARG N N 14 119.228 119.228 118.354 0.874 25109
636 1 2 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.217 -0.147 25109
637 1 2 . 1 1 14 14 ARG C C 14 177.127 177.127 176.537 0.590 25109
638 1 2 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.282 0.212 25109
639 1 2 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.290 0.132 25109
640 1 2 . 1 1 14 14 ARG H H 14 7.991 7.991 7.744 0.247 25109
641 1 2 . 1 1 15 15 ASN N N 15 117.367 117.367 116.072 1.295 25109
642 1 2 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.875 0.094 25109
643 1 2 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.583 0.180 25109
644 1 2 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.690 -0.105 25109
645 1 2 . 1 1 15 15 ASN H H 15 7.643 7.643 7.728 -0.085 25109
646 1 2 . 1 1 16 16 PHE N N 16 122.356 122.356 123.664 -1.308 25109
647 1 2 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.844 0.372 25109
648 1 2 . 1 1 16 16 PHE C C 16 178.084 178.084 176.619 1.465 25109
649 1 2 . 1 1 16 16 PHE CA C 16 63.177 63.177 62.108 1.069 25109
650 1 2 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.987 1.602 25109
651 1 2 . 1 1 16 16 PHE H H 16 6.992 6.992 7.615 -0.623 25109
652 1 2 . 1 1 17 17 SER N N 17 112.937 112.937 113.782 -0.845 25109
653 1 2 . 1 1 17 17 SER HA H 17 4.199 4.199 4.179 0.020 25109
654 1 2 . 1 1 17 17 SER C C 17 176.726 176.726 174.983 1.743 25109
655 1 2 . 1 1 17 17 SER CA C 17 62.052 62.052 60.231 1.821 25109
656 1 2 . 1 1 17 17 SER CB C 17 62.552 62.552 62.729 -0.177 25109
657 1 2 . 1 1 17 17 SER H H 17 8.840 8.840 8.787 0.053 25109
658 1 2 . 1 1 18 18 ASN N N 18 118.809 118.809 120.188 -1.379 25109
659 1 2 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.696 -0.338 25109
660 1 2 . 1 1 18 18 ASN C C 18 175.967 175.967 175.366 0.601 25109
661 1 2 . 1 1 18 18 ASN CA C 18 54.910 54.910 53.784 1.126 25109
662 1 2 . 1 1 18 18 ASN CB C 18 37.828 37.828 39.233 -1.405 25109
663 1 2 . 1 1 18 18 ASN H H 18 8.130 8.130 8.211 -0.081 25109
664 1 2 . 1 1 19 19 PHE N N 19 115.750 115.750 117.553 -1.803 25109
665 1 2 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.595 -0.310 25109
666 1 2 . 1 1 19 19 PHE C C 19 175.370 175.370 175.621 -0.251 25109
667 1 2 . 1 1 19 19 PHE CA C 19 58.862 58.862 57.514 1.348 25109
668 1 2 . 1 1 19 19 PHE CB C 19 39.878 39.878 40.325 -0.447 25109
669 1 2 . 1 1 19 19 PHE H H 19 8.062 8.062 7.934 0.128 25109
670 1 2 . 1 1 20 20 CYS N N 20 113.958 113.958 115.988 -2.030 25109
671 1 2 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.297 -0.354 25109
672 1 2 . 1 1 20 20 CYS C C 20 173.823 173.823 174.190 -0.367 25109
673 1 2 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.520 3.268 25109
674 1 2 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.030 0.353 25109
675 1 2 . 1 1 20 20 CYS H H 20 6.850 6.850 7.731 -0.881 25109
676 1 2 . 1 1 21 21 ASN N N 21 116.691 116.691 118.612 -1.921 25109
677 1 2 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.740 0.004 25109
678 1 2 . 1 1 21 21 ASN C C 21 175.299 175.299 173.387 1.912 25109
679 1 2 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.232 0.058 25109
680 1 2 . 1 1 21 21 ASN CB C 21 38.313 38.313 40.165 -1.852 25109
681 1 2 . 1 1 21 21 ASN H H 21 8.251 8.251 7.587 0.664 25109
682 1 2 . 1 1 22 22 VAL N N 22 122.431 122.431 120.444 1.987 25109
683 1 2 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.208 -0.658 25109
684 1 2 . 1 1 22 22 VAL C C 22 174.034 174.034 173.773 0.261 25109
685 1 2 . 1 1 22 22 VAL CA C 22 63.937 63.937 59.618 4.319 25109
686 1 2 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.809 -4.286 25109
687 1 2 . 1 1 22 22 VAL H H 22 7.573 7.573 7.998 -0.425 25109
688 1 2 . 1 1 23 23 ASP N N 23 127.219 127.219 124.471 2.748 25109
689 1 2 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.307 -1.121 25109
690 1 2 . 1 1 23 23 ASP CB C 23 38.793 38.793 40.116 -1.323 25109
691 1 2 . 1 1 23 23 ASP H H 23 8.687 8.687 8.659 0.028 25109
692 1 2 . 1 1 24 24 VAL N N 24 127.835 127.835 124.945 2.890 25109
693 1 2 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.840 -0.547 25109
694 1 2 . 1 1 24 24 VAL C C 24 176.867 176.867 177.169 -0.302 25109
695 1 2 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.745 2.418 25109
696 1 2 . 1 1 24 24 VAL CB C 24 32.015 32.015 31.617 0.398 25109
697 1 2 . 1 1 24 24 VAL H H 24 9.409 9.409 8.344 1.065 25109
698 1 2 . 1 1 25 25 VAL N N 25 114.324 114.324 114.143 0.181 25109
699 1 2 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.935 -0.416 25109
700 1 2 . 1 1 25 25 VAL C C 25 178.006 178.006 177.300 0.706 25109
701 1 2 . 1 1 25 25 VAL CA C 25 66.688 66.688 63.914 2.774 25109
702 1 2 . 1 1 25 25 VAL CB C 25 31.532 31.532 30.880 0.652 25109
703 1 2 . 1 1 25 25 VAL H H 25 8.038 8.038 8.090 -0.052 25109
704 1 2 . 1 1 26 26 GLU N N 26 117.009 117.009 120.138 -3.129 25109
705 1 2 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.254 -0.163 25109
706 1 2 . 1 1 26 26 GLU C C 26 177.303 177.303 178.776 -1.473 25109
707 1 2 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.473 -1.041 25109
708 1 2 . 1 1 26 26 GLU CB C 26 28.965 28.965 30.164 -1.199 25109
709 1 2 . 1 1 26 26 GLU H H 26 7.220 7.220 8.402 -1.182 25109
710 1 2 . 1 1 27 27 ILE N N 27 114.080 114.080 119.811 -5.731 25109
711 1 2 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.670 0.691 25109
712 1 2 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.975 -2.243 25109
713 1 2 . 1 1 27 27 ILE CB C 27 39.591 39.591 37.920 1.671 25109
714 1 2 . 1 1 27 27 ILE H H 27 7.647 7.647 7.350 0.297 25109
715 1 2 . 1 1 28 28 LEU N N 28 121.867 121.867 119.314 2.553 25109
716 1 2 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.095 -0.158 25109
717 1 2 . 1 1 28 28 LEU C C 28 175.756 175.756 177.065 -1.309 25109
718 1 2 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.180 -0.213 25109
719 1 2 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.828 0.685 25109
720 1 2 . 1 1 28 28 LEU H H 28 7.434 7.434 7.315 0.119 25109
721 1 2 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.279 -0.069 25109
722 1 2 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.048 0.262 25109
723 1 2 . 1 1 30 30 TYR N N 30 113.832 113.832 116.065 -2.233 25109
724 1 2 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.423 0.079 25109
725 1 2 . 1 1 30 30 TYR C C 30 174.386 174.386 175.314 -0.928 25109
726 1 2 . 1 1 30 30 TYR CA C 30 57.694 57.694 60.316 -2.622 25109
727 1 2 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.319 -0.220 25109
728 1 2 . 1 1 30 30 TYR H H 30 7.628 7.628 7.499 0.129 25109
729 1 2 . 1 1 31 31 LEU N N 31 118.331 118.331 118.975 -0.644 25109
730 1 2 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.727 0.150 25109
731 1 2 . 1 1 31 31 LEU C C 31 173.849 173.849 175.363 -1.514 25109
732 1 2 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.716 -0.024 25109
733 1 2 . 1 1 31 31 LEU CB C 31 42.802 42.802 41.820 0.982 25109
734 1 2 . 1 1 31 31 LEU H H 31 7.619 7.619 7.462 0.157 25109
735 1 2 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.543 -0.188 25109
736 1 2 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.606 -0.196 25109
737 1 2 . 1 1 33 33 CYS N N 33 110.978 110.978 112.488 -1.510 25109
738 1 2 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.199 0.142 25109
739 1 2 . 1 1 33 33 CYS C C 33 174.139 174.139 174.080 0.059 25109
740 1 2 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.450 -2.238 25109
741 1 2 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.424 1.498 25109
742 1 2 . 1 1 33 33 CYS H H 33 6.414 6.414 7.492 -1.078 25109
743 1 2 . 1 1 34 34 LEU N N 34 123.111 123.111 122.068 1.043 25109
744 1 2 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.437 0.169 25109
745 1 2 . 1 1 34 34 LEU C C 34 176.646 176.646 176.467 0.179 25109
746 1 2 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.943 -0.052 25109
747 1 2 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.934 -0.243 25109
748 1 2 . 1 1 34 34 LEU H H 34 7.550 7.550 7.274 0.276 25109
749 1 2 . 1 1 35 35 THR N N 35 113.831 113.831 117.192 -3.361 25109
750 1 2 . 1 1 35 35 THR HA H 35 4.205 4.205 4.253 -0.048 25109
751 1 2 . 1 1 35 35 THR C C 35 175.324 175.324 175.972 -0.648 25109
752 1 2 . 1 1 35 35 THR CA C 35 61.200 61.200 62.092 -0.892 25109
753 1 2 . 1 1 35 35 THR CB C 35 71.318 71.318 69.598 1.720 25109
754 1 2 . 1 1 35 35 THR H H 35 8.586 8.586 8.017 0.569 25109
755 1 2 . 1 1 36 36 ALA N N 36 124.128 124.128 129.255 -5.127 25109
756 1 2 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.270 -0.346 25109
757 1 2 . 1 1 36 36 ALA C C 36 180.397 180.397 179.964 0.433 25109
758 1 2 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.355 0.565 25109
759 1 2 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.799 -0.996 25109
760 1 2 . 1 1 36 36 ALA H H 36 8.836 8.836 8.709 0.128 25109
761 1 2 . 1 1 37 37 ARG N N 37 116.793 116.793 117.760 -0.967 25109
762 1 2 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.107 -0.121 25109
763 1 2 . 1 1 37 37 ARG C C 37 179.272 179.272 178.119 1.153 25109
764 1 2 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.328 -0.096 25109
765 1 2 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.909 -0.004 25109
766 1 2 . 1 1 37 37 ARG H H 37 8.060 8.060 8.606 -0.546 25109
767 1 2 . 1 1 38 38 ASP N N 38 120.030 120.030 119.919 0.111 25109
768 1 2 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.427 -0.179 25109
769 1 2 . 1 1 38 38 ASP C C 38 178.885 178.885 178.433 0.452 25109
770 1 2 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.023 0.164 25109
771 1 2 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.618 0.315 25109
772 1 2 . 1 1 38 38 ASP H H 38 7.782 7.782 7.866 -0.084 25109
773 1 2 . 1 1 39 39 GLN N N 39 118.223 118.223 119.108 -0.885 25109
774 1 2 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.929 -0.264 25109
775 1 2 . 1 1 39 39 GLN C C 39 178.041 178.041 178.110 -0.069 25109
776 1 2 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.880 1.722 25109
777 1 2 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.677 -0.880 25109
778 1 2 . 1 1 39 39 GLN H H 39 8.476 8.476 8.370 0.106 25109
779 1 2 . 1 1 40 40 ASP N N 40 117.908 117.908 120.007 -2.099 25109
780 1 2 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.300 -0.047 25109
781 1 2 . 1 1 40 40 ASP C C 40 178.639 178.639 178.386 0.253 25109
782 1 2 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.441 -1.041 25109
783 1 2 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.745 -2.717 25109
784 1 2 . 1 1 40 40 ASP H H 40 8.386 8.386 8.189 0.197 25109
785 1 2 . 1 1 41 41 ARG N N 41 120.990 120.990 119.244 1.746 25109
786 1 2 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.002 0.040 25109
787 1 2 . 1 1 41 41 ARG C C 41 179.795 179.795 178.858 0.937 25109
788 1 2 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.686 -0.241 25109
789 1 2 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.302 -0.044 25109
790 1 2 . 1 1 41 41 ARG H H 41 8.130 8.130 7.760 0.370 25109
791 1 2 . 1 1 42 42 LEU N N 42 121.219 121.219 119.853 1.366 25109
792 1 2 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.105 -0.170 25109
793 1 2 . 1 1 42 42 LEU C C 42 178.850 178.850 178.917 -0.067 25109
794 1 2 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.831 0.435 25109
795 1 2 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.567 0.466 25109
796 1 2 . 1 1 42 42 LEU H H 42 8.179 8.179 7.754 0.425 25109
797 1 2 . 1 1 43 43 ARG N N 43 119.310 119.310 120.015 -0.705 25109
798 1 2 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.892 -0.168 25109
799 1 2 . 1 1 43 43 ARG C C 43 179.099 179.099 178.425 0.674 25109
800 1 2 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.865 0.949 25109
801 1 2 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.199 -0.020 25109
802 1 2 . 1 1 43 43 ARG H H 43 8.296 8.296 8.530 -0.234 25109
803 1 2 . 1 1 44 44 ALA N N 44 121.305 121.305 120.065 1.240 25109
804 1 2 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.068 0.035 25109
805 1 2 . 1 1 44 44 ALA C C 44 180.924 180.924 179.526 1.398 25109
806 1 2 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.224 0.001 25109
807 1 2 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.502 -0.405 25109
808 1 2 . 1 1 44 44 ALA H H 44 7.774 7.774 8.403 -0.629 25109
809 1 2 . 1 1 45 45 THR N N 45 115.017 115.017 115.868 -0.851 25109
810 1 2 . 1 1 45 45 THR HA H 45 3.879 3.879 4.041 -0.162 25109
811 1 2 . 1 1 45 45 THR CA C 45 66.327 66.327 66.565 -0.238 25109
812 1 2 . 1 1 45 45 THR CB C 45 68.809 68.809 68.807 0.002 25109
813 1 2 . 1 1 45 45 THR H H 45 8.167 8.167 7.701 0.466 25109
814 1 2 . 1 1 46 46 CYS N N 46 123.609 123.609 120.886 2.723 25109
815 1 2 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.543 -0.524 25109
816 1 2 . 1 1 46 46 CYS C C 46 178.077 178.077 176.262 1.815 25109
817 1 2 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.238 0.707 25109
818 1 2 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.179 -1.040 25109
819 1 2 . 1 1 46 46 CYS H H 46 8.084 8.084 8.516 -0.432 25109
820 1 2 . 1 1 47 47 THR N N 47 115.520 115.520 114.726 0.794 25109
821 1 2 . 1 1 47 47 THR HA H 47 3.915 3.915 4.173 -0.258 25109
822 1 2 . 1 1 47 47 THR CA C 47 66.063 66.063 65.072 0.991 25109
823 1 2 . 1 1 47 47 THR CB C 47 69.245 69.245 68.846 0.399 25109
824 1 2 . 1 1 47 47 THR H H 47 7.735 7.735 7.658 0.077 25109
825 1 2 . 1 1 48 48 LEU N N 48 120.099 120.099 121.005 -0.906 25109
826 1 2 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.211 0.015 25109
827 1 2 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.228 0.335 25109
828 1 2 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.594 1.031 25109
829 1 2 . 1 1 48 48 LEU H H 48 7.464 7.464 7.724 -0.260 25109
830 1 2 . 1 1 49 49 SER N N 49 111.979 111.979 111.429 0.550 25109
831 1 2 . 1 1 49 49 SER HA H 49 4.661 4.661 4.562 0.099 25109
832 1 2 . 1 1 49 49 SER C C 49 175.581 175.581 175.110 0.471 25109
833 1 2 . 1 1 49 49 SER CA C 49 59.590 59.590 58.804 0.786 25109
834 1 2 . 1 1 49 49 SER CB C 49 65.335 65.335 65.161 0.174 25109
835 1 2 . 1 1 49 49 SER H H 49 8.781 8.781 8.399 0.382 25109
836 1 2 . 1 1 50 50 GLY N N 50 110.194 110.194 108.851 1.343 25109
837 1 2 . 1 1 50 50 GLY C C 50 175.123 175.123 172.986 2.137 25109
838 1 2 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.511 -0.609 25109
839 1 2 . 1 1 50 50 GLY H H 50 7.955 7.955 7.723 0.232 25109
840 1 2 . 1 1 51 51 ASN N N 51 121.050 121.050 121.805 -0.755 25109
841 1 2 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.783 -0.533 25109
842 1 2 . 1 1 51 51 ASN C C 51 176.403 176.403 176.651 -0.248 25109
843 1 2 . 1 1 51 51 ASN CA C 51 59.303 59.303 54.031 5.272 25109
844 1 2 . 1 1 51 51 ASN CB C 51 41.599 41.599 39.352 2.247 25109
845 1 2 . 1 1 51 51 ASN H H 51 8.898 8.898 8.627 0.271 25109
846 1 2 . 1 1 52 52 ARG N N 52 119.825 119.825 120.902 -1.077 25109
847 1 2 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.055 -0.017 25109
848 1 2 . 1 1 52 52 ARG C C 52 178.850 178.850 176.577 2.273 25109
849 1 2 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.733 1.331 25109
850 1 2 . 1 1 52 52 ARG CB C 52 30.023 30.023 30.099 -0.076 25109
851 1 2 . 1 1 52 52 ARG H H 52 8.696 8.696 8.720 -0.024 25109
852 1 2 . 1 1 53 53 ASP N N 53 116.032 116.032 115.468 0.564 25109
853 1 2 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.793 -0.247 25109
854 1 2 . 1 1 53 53 ASP C C 53 178.996 178.996 178.883 0.113 25109
855 1 2 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.208 -1.129 25109
856 1 2 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.610 -2.239 25109
857 1 2 . 1 1 53 53 ASP H H 53 9.036 9.036 8.687 0.349 25109
858 1 2 . 1 1 54 54 THR N N 54 115.848 115.848 117.857 -2.009 25109
859 1 2 . 1 1 54 54 THR HA H 54 3.746 3.746 4.127 -0.381 25109
860 1 2 . 1 1 54 54 THR CA C 54 67.885 67.885 66.103 1.782 25109
861 1 2 . 1 1 54 54 THR CB C 54 66.953 66.953 68.886 -1.933 25109
862 1 2 . 1 1 54 54 THR H H 54 7.782 7.782 8.041 -0.259 25109
863 1 2 . 1 1 55 55 LEU N N 55 125.987 125.987 122.631 3.356 25109
864 1 2 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.056 -0.502 25109
865 1 2 . 1 1 55 55 LEU C C 55 177.901 177.901 178.207 -0.306 25109
866 1 2 . 1 1 55 55 LEU CA C 55 58.453 58.453 59.072 -0.619 25109
867 1 2 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.721 0.142 25109
868 1 2 . 1 1 55 55 LEU H H 55 8.740 8.740 8.731 0.009 25109
869 1 2 . 1 1 56 56 TRP N N 56 116.672 116.672 118.886 -2.214 25109
870 1 2 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.481 -0.401 25109
871 1 2 . 1 1 56 56 TRP C C 56 179.588 179.588 178.935 0.653 25109
872 1 2 . 1 1 56 56 TRP CA C 56 61.481 61.481 62.126 -0.645 25109
873 1 2 . 1 1 56 56 TRP CB C 56 29.192 29.192 28.988 0.204 25109
874 1 2 . 1 1 56 56 TRP H H 56 7.642 7.642 7.972 -0.330 25109
875 1 2 . 1 1 57 57 HIS N N 57 115.754 115.754 118.618 -2.864 25109
876 1 2 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.335 -0.059 25109
877 1 2 . 1 1 57 57 HIS C C 57 177.514 177.514 177.162 0.352 25109
878 1 2 . 1 1 57 57 HIS CA C 57 58.952 58.952 58.208 0.744 25109
879 1 2 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.383 -2.381 25109
880 1 2 . 1 1 57 57 HIS H H 57 7.407 7.407 7.832 -0.425 25109
881 1 2 . 1 1 58 58 LEU N N 58 123.934 123.934 122.387 1.547 25109
882 1 2 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.847 -0.060 25109
883 1 2 . 1 1 58 58 LEU C C 58 178.115 178.115 177.720 0.395 25109
884 1 2 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.218 0.691 25109
885 1 2 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.575 -0.761 25109
886 1 2 . 1 1 58 58 LEU H H 58 8.996 8.996 8.256 0.740 25109
887 1 2 . 1 1 59 59 PHE N N 59 117.721 117.721 116.701 1.020 25109
888 1 2 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.856 0.079 25109
889 1 2 . 1 1 59 59 PHE C C 59 176.987 176.987 177.998 -1.011 25109
890 1 2 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.384 -2.271 25109
891 1 2 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.179 -1.219 25109
892 1 2 . 1 1 59 59 PHE H H 59 8.201 8.201 8.573 -0.372 25109
893 1 2 . 1 1 60 60 ASN N N 60 115.695 115.695 118.542 -2.847 25109
894 1 2 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.416 -0.497 25109
895 1 2 . 1 1 60 60 ASN C C 60 176.670 176.670 177.324 -0.654 25109
896 1 2 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.549 0.207 25109
897 1 2 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.513 0.805 25109
898 1 2 . 1 1 60 60 ASN H H 60 7.666 7.666 8.059 -0.393 25109
899 1 2 . 1 1 61 61 THR N N 61 115.110 115.110 116.658 -1.548 25109
900 1 2 . 1 1 61 61 THR HA H 61 3.733 3.733 3.997 -0.264 25109
901 1 2 . 1 1 61 61 THR CA C 61 66.319 66.319 66.049 0.270 25109
902 1 2 . 1 1 61 61 THR CB C 61 69.174 69.174 68.495 0.679 25109
903 1 2 . 1 1 61 61 THR H H 61 7.782 7.782 8.122 -0.340 25109
904 1 2 . 1 1 62 62 LEU N N 62 121.559 121.559 122.683 -1.124 25109
905 1 2 . 1 1 62 62 LEU HA H 62 3.489 3.489 4.019 -0.530 25109
906 1 2 . 1 1 62 62 LEU C C 62 176.600 176.600 177.506 -0.906 25109
907 1 2 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.939 0.026 25109
908 1 2 . 1 1 62 62 LEU CB C 62 42.335 42.335 41.361 0.974 25109
909 1 2 . 1 1 62 62 LEU H H 62 8.362 8.362 7.702 0.660 25109
910 1 2 . 1 1 63 63 GLN N N 63 109.150 109.150 115.568 -6.418 25109
911 1 2 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.607 -1.530 25109
912 1 2 . 1 1 63 63 GLN C C 63 175.194 175.194 177.279 -2.085 25109
913 1 2 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.566 -1.300 25109
914 1 2 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.877 -2.183 25109
915 1 2 . 1 1 63 63 GLN H H 63 6.458 6.458 7.629 -1.171 25109
916 1 2 . 1 1 64 64 ARG N N 64 116.029 116.029 117.980 -1.951 25109
917 1 2 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.220 -0.122 25109
918 1 2 . 1 1 64 64 ARG C C 64 176.459 176.459 176.274 0.185 25109
919 1 2 . 1 1 64 64 ARG CA C 64 56.143 56.143 56.435 -0.292 25109
920 1 2 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.458 0.126 25109
921 1 2 . 1 1 64 64 ARG H H 64 6.596 6.596 7.252 -0.656 25109
922 1 2 . 1 1 65 65 ARG N N 65 120.422 120.422 119.842 0.580 25109
923 1 2 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.796 0.038 25109
924 1 2 . 1 1 65 65 ARG C C 65 173.436 173.436 174.948 -1.512 25109
925 1 2 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.248 -0.703 25109
926 1 2 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.096 -1.100 25109
927 1 2 . 1 1 65 65 ARG H H 65 7.932 7.932 7.447 0.485 25109
928 1 2 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.537 0.037 25109
929 1 2 . 1 1 66 66 PRO CB C 66 32.059 32.059 32.165 -0.106 25109
930 1 2 . 1 1 67 67 GLY N N 67 111.953 111.953 106.892 5.061 25109
931 1 2 . 1 1 67 67 GLY C C 67 177.057 177.057 173.909 3.148 25109
932 1 2 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.550 0.757 25109
933 1 2 . 1 1 67 67 GLY H H 67 9.198 9.198 7.918 1.280 25109
934 1 2 . 1 1 68 68 TRP N N 68 117.467 117.467 123.942 -6.475 25109
935 1 2 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.270 -0.928 25109
936 1 2 . 1 1 68 68 TRP C C 68 177.690 177.690 175.698 1.992 25109
937 1 2 . 1 1 68 68 TRP CA C 68 60.116 60.116 57.450 2.666 25109
938 1 2 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.084 0.106 25109
939 1 2 . 1 1 68 68 TRP H H 68 7.647 7.647 7.880 -0.233 25109
940 1 2 . 1 1 69 69 VAL N N 69 121.482 121.482 120.710 0.772 25109
941 1 2 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.362 -0.725 25109
942 1 2 . 1 1 69 69 VAL C C 69 177.993 177.993 177.247 0.746 25109
943 1 2 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.944 1.522 25109
944 1 2 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.430 -0.404 25109
945 1 2 . 1 1 69 69 VAL H H 69 6.666 6.666 7.349 -0.683 25109
946 1 2 . 1 1 70 70 GLU N N 70 116.350 116.350 119.408 -3.058 25109
947 1 2 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.817 0.008 25109
948 1 2 . 1 1 70 70 GLU C C 70 180.362 180.362 179.000 1.362 25109
949 1 2 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.319 -0.098 25109
950 1 2 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.525 -1.220 25109
951 1 2 . 1 1 70 70 GLU H H 70 7.410 7.410 8.439 -1.029 25109
952 1 2 . 1 1 71 71 TYR N N 71 116.750 116.750 118.252 -1.502 25109
953 1 2 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.401 0.049 25109
954 1 2 . 1 1 71 71 TYR C C 71 178.411 178.411 178.544 -0.133 25109
955 1 2 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.393 1.209 25109
956 1 2 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.306 0.049 25109
957 1 2 . 1 1 71 71 TYR H H 71 7.159 7.159 7.227 -0.068 25109
958 1 2 . 1 1 72 72 PHE N N 72 121.610 121.610 121.487 0.123 25109
959 1 2 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.223 0.279 25109
960 1 2 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.613 -0.793 25109
961 1 2 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.291 0.758 25109
962 1 2 . 1 1 72 72 PHE H H 72 9.007 9.007 8.531 0.476 25109
963 1 2 . 1 1 73 73 ILE N N 73 119.200 119.200 118.526 0.674 25109
964 1 2 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.489 -0.309 25109
965 1 2 . 1 1 73 73 ILE C C 73 177.620 177.620 177.574 0.046 25109
966 1 2 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.505 1.692 25109
967 1 2 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.577 1.446 25109
968 1 2 . 1 1 73 73 ILE H H 73 8.644 8.644 8.693 -0.049 25109
969 1 2 . 1 1 74 74 ALA N N 74 119.624 119.624 120.354 -0.730 25109
970 1 2 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.031 -0.077 25109
971 1 2 . 1 1 74 74 ALA C C 74 181.030 181.030 178.900 2.130 25109
972 1 2 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.713 0.698 25109
973 1 2 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.030 0.106 25109
974 1 2 . 1 1 74 74 ALA H H 74 7.476 7.476 7.683 -0.207 25109
975 1 2 . 1 1 75 75 ALA N N 75 123.625 123.625 122.288 1.337 25109
976 1 2 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.526 0.312 25109
977 1 2 . 1 1 75 75 ALA C C 75 179.272 179.272 179.295 -0.023 25109
978 1 2 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.292 0.810 25109
979 1 2 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.409 1.184 25109
980 1 2 . 1 1 75 75 ALA H H 75 8.524 8.524 7.322 1.202 25109
981 1 2 . 1 1 76 76 LEU N N 76 118.114 118.114 120.107 -1.993 25109
982 1 2 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.975 -0.303 25109
983 1 2 . 1 1 76 76 LEU C C 76 180.001 180.001 178.892 1.109 25109
984 1 2 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.120 1.136 25109
985 1 2 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.251 1.368 25109
986 1 2 . 1 1 76 76 LEU H H 76 8.153 8.153 7.573 0.580 25109
987 1 2 . 1 1 77 77 ARG N N 77 117.830 117.830 119.081 -1.251 25109
988 1 2 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.977 -0.530 25109
989 1 2 . 1 1 77 77 ARG C C 77 180.889 180.889 178.795 2.094 25109
990 1 2 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.169 1.897 25109
991 1 2 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.971 -0.774 25109
992 1 2 . 1 1 77 77 ARG H H 77 7.945 7.945 7.930 0.015 25109
993 1 2 . 1 1 78 78 GLY N N 78 110.202 110.202 107.420 2.782 25109
994 1 2 . 1 1 78 78 GLY C C 78 174.807 174.807 175.500 -0.693 25109
995 1 2 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.200 0.360 25109
996 1 2 . 1 1 78 78 GLY H H 78 8.269 8.269 7.543 0.726 25109
997 1 2 . 1 1 79 79 CYS N N 79 115.567 115.567 116.525 -0.958 25109
998 1 2 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.555 -0.166 25109
999 1 2 . 1 1 79 79 CYS C C 79 173.025 173.025 174.570 -1.545 25109
1000 1 2 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.762 2.195 25109
1001 1 2 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.603 0.202 25109
1002 1 2 . 1 1 79 79 CYS H H 79 7.132 7.132 7.407 -0.275 25109
1003 1 2 . 1 1 80 80 GLU N N 80 111.759 111.759 115.860 -4.101 25109
1004 1 2 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.962 -0.229 25109
1005 1 2 . 1 1 80 80 GLU C C 80 175.827 175.827 174.962 0.865 25109
1006 1 2 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.907 -0.440 25109
1007 1 2 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.022 -2.305 25109
1008 1 2 . 1 1 80 80 GLU H H 80 7.772 7.772 7.817 -0.045 25109
1009 1 2 . 1 1 81 81 LEU N N 81 124.692 124.692 120.975 3.717 25109
1010 1 2 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.496 0.195 25109
1011 1 2 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.629 -0.674 25109
1012 1 2 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.422 -1.031 25109
1013 1 2 . 1 1 81 81 LEU H H 81 8.167 8.167 8.065 0.102 25109
1014 1 2 . 1 1 82 82 VAL N N 82 118.320 118.320 123.011 -4.691 25109
1015 1 2 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.523 -0.346 25109
1016 1 2 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.960 -0.250 25109
1017 1 2 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.936 0.012 25109
1018 1 2 . 1 1 82 82 VAL H H 82 7.141 7.141 7.537 -0.396 25109
1019 1 2 . 1 1 83 83 ASP N N 83 118.733 118.733 119.004 -0.271 25109
1020 1 2 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.311 0.021 25109
1021 1 2 . 1 1 83 83 ASP C C 83 178.674 178.674 178.320 0.354 25109
1022 1 2 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.637 -1.194 25109
1023 1 2 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.078 -3.249 25109
1024 1 2 . 1 1 83 83 ASP H H 83 8.385 8.385 8.774 -0.389 25109
1025 1 2 . 1 1 84 84 LEU N N 84 121.026 121.026 118.808 2.218 25109
1026 1 2 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.163 -0.184 25109
1027 1 2 . 1 1 84 84 LEU C C 84 178.796 178.796 178.551 0.245 25109
1028 1 2 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.232 0.290 25109
1029 1 2 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.515 0.980 25109
1030 1 2 . 1 1 84 84 LEU H H 84 7.770 7.770 8.057 -0.287 25109
1031 1 2 . 1 1 85 85 ALA N N 85 121.525 121.525 121.637 -0.112 25109
1032 1 2 . 1 1 85 85 ALA HA H 85 3.661 3.661 4.036 -0.375 25109
1033 1 2 . 1 1 85 85 ALA C C 85 179.322 179.322 178.930 0.392 25109
1034 1 2 . 1 1 85 85 ALA CA C 85 55.841 55.841 54.638 1.203 25109
1035 1 2 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.578 0.350 25109
1036 1 2 . 1 1 85 85 ALA H H 85 8.126 8.126 7.129 0.997 25109
1037 1 2 . 1 1 86 86 ASP N N 86 115.349 115.349 119.389 -4.040 25109
1038 1 2 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.377 -0.104 25109
1039 1 2 . 1 1 86 86 ASP C C 86 178.463 178.463 178.269 0.194 25109
1040 1 2 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.643 -1.932 25109
1041 1 2 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.294 -4.132 25109
1042 1 2 . 1 1 86 86 ASP H H 86 8.410 8.410 8.515 -0.105 25109
1043 1 2 . 1 1 87 87 GLU N N 87 122.529 122.529 118.517 4.012 25109
1044 1 2 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.188 -0.152 25109
1045 1 2 . 1 1 87 87 GLU C C 87 178.508 178.508 179.071 -0.563 25109
1046 1 2 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.002 0.352 25109
1047 1 2 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.527 -1.254 25109
1048 1 2 . 1 1 87 87 GLU H H 87 8.012 8.012 8.531 -0.519 25109
1049 1 2 . 1 1 88 88 VAL N N 88 119.148 119.148 120.078 -0.930 25109
1050 1 2 . 1 1 88 88 VAL HA H 88 3.330 3.330 4.013 -0.683 25109
1051 1 2 . 1 1 88 88 VAL C C 88 177.240 177.240 177.822 -0.582 25109
1052 1 2 . 1 1 88 88 VAL CA C 88 67.249 67.249 64.733 2.516 25109
1053 1 2 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.329 0.200 25109
1054 1 2 . 1 1 88 88 VAL H H 88 8.291 8.291 7.313 0.978 25109
1055 1 2 . 1 1 89 89 ALA N N 89 120.709 120.709 123.691 -2.982 25109
1056 1 2 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.083 -0.168 25109
1057 1 2 . 1 1 89 89 ALA C C 89 180.186 180.186 179.561 0.625 25109
1058 1 2 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.312 0.747 25109
1059 1 2 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.519 -0.284 25109
1060 1 2 . 1 1 89 89 ALA H H 89 8.548 8.548 8.140 0.408 25109
1061 1 2 . 1 1 90 90 SER N N 90 113.035 113.035 114.101 -1.066 25109
1062 1 2 . 1 1 90 90 SER HA H 90 4.047 4.047 4.202 -0.155 25109
1063 1 2 . 1 1 90 90 SER C C 90 177.564 177.564 176.424 1.140 25109
1064 1 2 . 1 1 90 90 SER CA C 90 61.771 61.771 61.142 0.629 25109
1065 1 2 . 1 1 90 90 SER CB C 90 62.907 62.907 63.191 -0.284 25109
1066 1 2 . 1 1 90 90 SER H H 90 7.969 7.969 7.996 -0.027 25109
1067 1 2 . 1 1 91 91 VAL N N 91 123.417 123.417 123.735 -0.318 25109
1068 1 2 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.545 -0.198 25109
1069 1 2 . 1 1 91 91 VAL C C 91 178.428 178.428 177.795 0.633 25109
1070 1 2 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.516 -0.387 25109
1071 1 2 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.218 0.552 25109
1072 1 2 . 1 1 91 91 VAL H H 91 7.713 7.713 7.324 0.389 25109
1073 1 2 . 1 1 92 92 TYR N N 92 121.458 121.458 120.109 1.349 25109
1074 1 2 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.421 -0.230 25109
1075 1 2 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.010 0.984 25109
1076 1 2 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.667 0.318 25109
1077 1 2 . 1 1 92 92 TYR H H 92 8.395 8.395 8.483 -0.088 25109
1078 1 2 . 1 1 93 93 GLN N N 93 115.549 115.549 115.915 -0.366 25109
1079 1 2 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.037 -0.326 25109
1080 1 2 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.224 0.870 25109
1081 1 2 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.829 -0.531 25109
1082 1 2 . 1 1 93 93 GLN H H 93 8.167 8.167 7.754 0.413 25109
1083 1 2 . 1 1 94 94 SER N N 94 115.923 115.923 115.444 0.479 25109
1084 1 2 . 1 1 94 94 SER HA H 94 4.096 4.096 4.247 -0.151 25109
1085 1 2 . 1 1 94 94 SER CA C 94 60.971 60.971 60.368 0.603 25109
1086 1 2 . 1 1 94 94 SER CB C 94 62.635 62.635 64.055 -1.420 25109
1087 1 2 . 1 1 94 94 SER H H 94 7.642 7.642 7.461 0.181 25109
1088 1 2 . 1 1 95 95 TYR N N 95 119.565 119.565 121.415 -1.850 25109
1089 1 2 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.529 0.230 25109
1090 1 2 . 1 1 95 95 TYR C C 95 175.334 175.334 174.059 1.275 25109
1091 1 2 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.023 0.675 25109
1092 1 2 . 1 1 95 95 TYR CB C 95 39.319 39.319 36.674 2.645 25109
1093 1 2 . 1 1 95 95 TYR H H 95 7.069 7.069 7.730 -0.661 25109
1094 1 2 . 1 1 96 96 GLN N N 96 119.872 119.872 119.766 0.106 25109
1095 1 2 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.955 0.410 25109
1096 1 2 . 1 1 96 96 GLN C C 96 173.612 173.612 174.096 -0.484 25109
1097 1 2 . 1 1 96 96 GLN CA C 96 54.336 54.336 56.140 -1.804 25109
1098 1 2 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.183 1.311 25109
1099 1 2 . 1 1 96 96 GLN H H 96 7.409 7.409 7.769 -0.360 25109
1100 1 2 . 1 1 97 97 PRO HA H 97 4.318 4.318 2.879 1.439 25109
1101 1 2 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.608 -0.594 25109
1102 1 2 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.248 -0.150 25109
1103 1 2 . 1 1 98 98 ARG N N 98 121.759 121.759 117.350 4.409 25109
1104 1 2 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.695 -0.353 25109
1105 1 2 . 1 1 98 98 ARG C C 98 176.848 176.848 175.006 1.842 25109
1106 1 2 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.218 1.003 25109
1107 1 2 . 1 1 98 98 ARG CB C 98 31.087 31.087 31.854 -0.767 25109
1108 1 2 . 1 1 98 98 ARG H H 98 8.423 8.423 7.500 0.923 25109
1109 1 2 . 1 1 99 99 THR N N 99 115.292 115.292 113.168 2.124 25109
1110 1 2 . 1 1 99 99 THR HA H 99 4.323 4.323 4.487 -0.164 25109
1111 1 2 . 1 1 99 99 THR C C 99 174.350 174.350 174.695 -0.345 25109
1112 1 2 . 1 1 99 99 THR CA C 99 61.906 61.906 62.860 -0.954 25109
1113 1 2 . 1 1 99 99 THR CB C 99 70.180 70.180 69.306 0.874 25109
1114 1 2 . 1 1 99 99 THR H H 99 8.179 8.179 8.278 -0.099 25109
1115 1 3 . 1 1 0 0 SER N N 0 115.693 115.693 118.676 -2.983 25109
1116 1 3 . 1 1 0 0 SER HA H 0 4.531 4.531 4.782 -0.251 25109
1117 1 3 . 1 1 0 0 SER C C 0 174.557 174.557 173.675 0.882 25109
1118 1 3 . 1 1 0 0 SER CA C 0 58.478 58.478 58.420 0.058 25109
1119 1 3 . 1 1 0 0 SER CB C 0 64.380 64.380 61.915 2.465 25109
1120 1 3 . 1 1 0 0 SER H H 0 8.631 8.631 8.336 0.295 25109
1121 1 3 . 1 1 1 1 MET N N 1 123.111 123.111 120.064 3.047 25109
1122 1 3 . 1 1 1 1 MET HA H 1 4.728 4.728 4.948 -0.220 25109
1123 1 3 . 1 1 1 1 MET C C 1 174.846 174.846 173.331 1.515 25109
1124 1 3 . 1 1 1 1 MET CA C 1 55.655 55.655 53.589 2.066 25109
1125 1 3 . 1 1 1 1 MET CB C 1 32.035 32.035 33.952 -1.917 25109
1126 1 3 . 1 1 1 1 MET H H 1 8.641 8.641 7.860 0.781 25109
1127 1 3 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.767 -0.290 25109
1128 1 3 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.687 0.313 25109
1129 1 3 . 1 1 3 3 PHE N N 3 121.126 121.126 124.953 -3.827 25109
1130 1 3 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.477 -0.111 25109
1131 1 3 . 1 1 3 3 PHE CA C 3 60.862 60.862 60.383 0.479 25109
1132 1 3 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.669 -1.301 25109
1133 1 3 . 1 1 3 3 PHE H H 3 8.177 8.177 9.329 -1.152 25109
1134 1 3 . 1 1 4 4 ALA N N 4 121.170 121.170 120.395 0.775 25109
1135 1 3 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.174 -0.339 25109
1136 1 3 . 1 1 4 4 ALA C C 4 181.522 181.522 178.877 2.645 25109
1137 1 3 . 1 1 4 4 ALA CA C 4 55.454 55.454 54.679 0.774 25109
1138 1 3 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.573 0.863 25109
1139 1 3 . 1 1 4 4 ALA H H 4 8.444 8.444 8.916 -0.472 25109
1140 1 3 . 1 1 5 5 GLU N N 5 118.932 118.932 119.780 -0.848 25109
1141 1 3 . 1 1 5 5 GLU HA H 5 3.855 3.855 4.008 -0.153 25109
1142 1 3 . 1 1 5 5 GLU C C 5 177.971 177.971 178.028 -0.057 25109
1143 1 3 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.906 0.725 25109
1144 1 3 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.547 0.214 25109
1145 1 3 . 1 1 5 5 GLU H H 5 8.454 8.454 8.677 -0.223 25109
1146 1 3 . 1 1 6 6 ASP N N 6 120.471 120.471 118.344 2.127 25109
1147 1 3 . 1 1 6 6 ASP C C 6 178.885 178.885 177.955 0.930 25109
1148 1 3 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.409 -0.337 25109
1149 1 3 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.480 -1.348 25109
1150 1 3 . 1 1 6 6 ASP H H 6 8.316 8.316 8.651 -0.335 25109
1151 1 3 . 1 1 7 7 LYS N N 7 118.335 118.335 118.372 -0.037 25109
1152 1 3 . 1 1 7 7 LYS HA H 7 3.690 3.690 4.027 -0.337 25109
1153 1 3 . 1 1 7 7 LYS C C 7 180.080 180.080 179.019 1.061 25109
1154 1 3 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.262 0.458 25109
1155 1 3 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.222 0.572 25109
1156 1 3 . 1 1 7 7 LYS H H 7 8.249 8.249 7.353 0.896 25109
1157 1 3 . 1 1 8 8 THR N N 8 119.222 119.222 117.922 1.300 25109
1158 1 3 . 1 1 8 8 THR HA H 8 3.975 3.975 4.144 -0.169 25109
1159 1 3 . 1 1 8 8 THR CA C 8 68.453 68.453 67.288 1.165 25109
1160 1 3 . 1 1 8 8 THR CB C 8 67.387 67.387 68.839 -1.452 25109
1161 1 3 . 1 1 8 8 THR H H 8 7.897 7.897 8.166 -0.269 25109
1162 1 3 . 1 1 9 9 TYR N N 9 123.054 123.054 122.737 0.317 25109
1163 1 3 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.227 0.026 25109
1164 1 3 . 1 1 9 9 TYR C C 9 177.441 177.441 177.027 0.414 25109
1165 1 3 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.156 -0.258 25109
1166 1 3 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.599 -0.750 25109
1167 1 3 . 1 1 9 9 TYR H H 9 8.605 8.605 8.727 -0.122 25109
1168 1 3 . 1 1 10 10 LYS N N 10 118.366 118.366 116.531 1.835 25109
1169 1 3 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.774 -0.180 25109
1170 1 3 . 1 1 10 10 LYS C C 10 178.885 178.885 178.249 0.636 25109
1171 1 3 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.705 1.339 25109
1172 1 3 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.233 -0.188 25109
1173 1 3 . 1 1 10 10 LYS H H 10 8.066 8.066 7.948 0.118 25109
1174 1 3 . 1 1 11 11 TYR N N 11 120.539 120.539 119.847 0.692 25109
1175 1 3 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.291 -0.301 25109
1176 1 3 . 1 1 11 11 TYR C C 11 178.233 178.233 177.607 0.626 25109
1177 1 3 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.176 1.352 25109
1178 1 3 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.469 -1.106 25109
1179 1 3 . 1 1 11 11 TYR H H 11 7.875 7.875 7.479 0.396 25109
1180 1 3 . 1 1 12 12 ILE N N 12 121.893 121.893 119.412 2.481 25109
1181 1 3 . 1 1 12 12 ILE HA H 12 3.096 3.096 4.012 -0.916 25109
1182 1 3 . 1 1 12 12 ILE C C 12 177.015 177.015 176.934 0.081 25109
1183 1 3 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.422 2.341 25109
1184 1 3 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.675 0.877 25109
1185 1 3 . 1 1 12 12 ILE H H 12 8.154 8.154 8.290 -0.136 25109
1186 1 3 . 1 1 13 13 CYS N N 13 113.894 113.894 116.264 -2.370 25109
1187 1 3 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.636 0.251 25109
1188 1 3 . 1 1 13 13 CYS C C 13 178.288 178.288 176.074 2.214 25109
1189 1 3 . 1 1 13 13 CYS CA C 13 64.337 64.337 60.551 3.786 25109
1190 1 3 . 1 1 13 13 CYS CB C 13 27.005 27.005 27.041 -0.036 25109
1191 1 3 . 1 1 13 13 CYS H H 13 7.551 7.551 8.114 -0.563 25109
1192 1 3 . 1 1 14 14 ARG N N 14 119.228 119.228 118.442 0.786 25109
1193 1 3 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.099 -0.029 25109
1194 1 3 . 1 1 14 14 ARG C C 14 177.127 177.127 177.508 -0.381 25109
1195 1 3 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.969 -0.475 25109
1196 1 3 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.513 -0.091 25109
1197 1 3 . 1 1 14 14 ARG H H 14 7.991 7.991 7.627 0.364 25109
1198 1 3 . 1 1 15 15 ASN N N 15 117.367 117.367 117.930 -0.563 25109
1199 1 3 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.711 0.258 25109
1200 1 3 . 1 1 15 15 ASN CA C 15 52.763 52.763 53.752 -0.989 25109
1201 1 3 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.755 0.830 25109
1202 1 3 . 1 1 15 15 ASN H H 15 7.643 7.643 7.692 -0.049 25109
1203 1 3 . 1 1 16 16 PHE N N 16 122.356 122.356 122.328 0.028 25109
1204 1 3 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.142 0.074 25109
1205 1 3 . 1 1 16 16 PHE C C 16 178.084 178.084 176.969 1.115 25109
1206 1 3 . 1 1 16 16 PHE CA C 16 63.177 63.177 60.754 2.423 25109
1207 1 3 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.827 1.762 25109
1208 1 3 . 1 1 16 16 PHE H H 16 6.992 6.992 7.481 -0.489 25109
1209 1 3 . 1 1 17 17 SER N N 17 112.937 112.937 115.748 -2.811 25109
1210 1 3 . 1 1 17 17 SER HA H 17 4.199 4.199 3.964 0.235 25109
1211 1 3 . 1 1 17 17 SER C C 17 176.726 176.726 176.611 0.115 25109
1212 1 3 . 1 1 17 17 SER CA C 17 62.052 62.052 61.027 1.025 25109
1213 1 3 . 1 1 17 17 SER CB C 17 62.552 62.552 62.881 -0.329 25109
1214 1 3 . 1 1 17 17 SER H H 17 8.840 8.840 8.285 0.555 25109
1215 1 3 . 1 1 18 18 ASN N N 18 118.809 118.809 120.949 -2.140 25109
1216 1 3 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.525 -0.167 25109
1217 1 3 . 1 1 18 18 ASN C C 18 175.967 175.967 176.880 -0.913 25109
1218 1 3 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.484 -0.574 25109
1219 1 3 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.478 -0.650 25109
1220 1 3 . 1 1 18 18 ASN H H 18 8.130 8.130 8.427 -0.297 25109
1221 1 3 . 1 1 19 19 PHE N N 19 115.750 115.750 116.018 -0.268 25109
1222 1 3 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.566 -0.281 25109
1223 1 3 . 1 1 19 19 PHE C C 19 175.370 175.370 175.552 -0.182 25109
1224 1 3 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.490 0.371 25109
1225 1 3 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.382 1.496 25109
1226 1 3 . 1 1 19 19 PHE H H 19 8.062 8.062 7.406 0.656 25109
1227 1 3 . 1 1 20 20 CYS N N 20 113.958 113.958 116.228 -2.270 25109
1228 1 3 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.305 -0.362 25109
1229 1 3 . 1 1 20 20 CYS C C 20 173.823 173.823 174.017 -0.194 25109
1230 1 3 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.413 3.375 25109
1231 1 3 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.685 -0.302 25109
1232 1 3 . 1 1 20 20 CYS H H 20 6.850 6.850 7.331 -0.481 25109
1233 1 3 . 1 1 21 21 ASN N N 21 116.691 116.691 119.970 -3.279 25109
1234 1 3 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.798 -0.054 25109
1235 1 3 . 1 1 21 21 ASN C C 21 175.299 175.299 173.327 1.972 25109
1236 1 3 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.105 0.185 25109
1237 1 3 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.144 -0.831 25109
1238 1 3 . 1 1 21 21 ASN H H 21 8.251 8.251 7.616 0.635 25109
1239 1 3 . 1 1 22 22 VAL N N 22 122.431 122.431 119.521 2.910 25109
1240 1 3 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.168 -0.618 25109
1241 1 3 . 1 1 22 22 VAL C C 22 174.034 174.034 173.969 0.065 25109
1242 1 3 . 1 1 22 22 VAL CA C 22 63.937 63.937 61.041 2.896 25109
1243 1 3 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.724 -4.201 25109
1244 1 3 . 1 1 22 22 VAL H H 22 7.573 7.573 7.802 -0.229 25109
1245 1 3 . 1 1 23 23 ASP N N 23 127.219 127.219 123.094 4.125 25109
1246 1 3 . 1 1 23 23 ASP CA C 23 52.186 52.186 54.468 -2.282 25109
1247 1 3 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.816 -3.023 25109
1248 1 3 . 1 1 23 23 ASP H H 23 8.687 8.687 8.480 0.207 25109
1249 1 3 . 1 1 24 24 VAL N N 24 127.835 127.835 121.536 6.299 25109
1250 1 3 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.250 -0.957 25109
1251 1 3 . 1 1 24 24 VAL C C 24 176.867 176.867 177.388 -0.521 25109
1252 1 3 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.656 2.507 25109
1253 1 3 . 1 1 24 24 VAL CB C 24 32.015 32.015 33.028 -1.013 25109
1254 1 3 . 1 1 24 24 VAL H H 24 9.409 9.409 8.753 0.656 25109
1255 1 3 . 1 1 25 25 VAL N N 25 114.324 114.324 115.679 -1.355 25109
1256 1 3 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.078 -0.559 25109
1257 1 3 . 1 1 25 25 VAL C C 25 178.006 178.006 177.208 0.798 25109
1258 1 3 . 1 1 25 25 VAL CA C 25 66.688 66.688 64.390 2.298 25109
1259 1 3 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.645 -0.113 25109
1260 1 3 . 1 1 25 25 VAL H H 25 8.038 8.038 8.152 -0.114 25109
1261 1 3 . 1 1 26 26 GLU N N 26 117.009 117.009 118.992 -1.983 25109
1262 1 3 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.247 -0.156 25109
1263 1 3 . 1 1 26 26 GLU C C 26 177.303 177.303 177.872 -0.569 25109
1264 1 3 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.159 -0.727 25109
1265 1 3 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.635 -0.670 25109
1266 1 3 . 1 1 26 26 GLU H H 26 7.220 7.220 9.198 -1.978 25109
1267 1 3 . 1 1 27 27 ILE N N 27 114.080 114.080 117.913 -3.833 25109
1268 1 3 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.843 0.518 25109
1269 1 3 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.383 -0.651 25109
1270 1 3 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.386 1.206 25109
1271 1 3 . 1 1 27 27 ILE H H 27 7.647 7.647 7.908 -0.261 25109
1272 1 3 . 1 1 28 28 LEU N N 28 121.867 121.867 120.936 0.931 25109
1273 1 3 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.145 -0.208 25109
1274 1 3 . 1 1 28 28 LEU C C 28 175.756 175.756 176.658 -0.902 25109
1275 1 3 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.566 -0.598 25109
1276 1 3 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.761 0.751 25109
1277 1 3 . 1 1 28 28 LEU H H 28 7.434 7.434 7.473 -0.039 25109
1278 1 3 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.288 -0.078 25109
1279 1 3 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.264 0.046 25109
1280 1 3 . 1 1 30 30 TYR N N 30 113.832 113.832 115.860 -2.028 25109
1281 1 3 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.447 0.055 25109
1282 1 3 . 1 1 30 30 TYR C C 30 174.386 174.386 175.244 -0.858 25109
1283 1 3 . 1 1 30 30 TYR CA C 30 57.694 57.694 60.499 -2.805 25109
1284 1 3 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.362 -0.263 25109
1285 1 3 . 1 1 30 30 TYR H H 30 7.628 7.628 7.679 -0.051 25109
1286 1 3 . 1 1 31 31 LEU N N 31 118.331 118.331 119.511 -1.180 25109
1287 1 3 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.721 0.156 25109
1288 1 3 . 1 1 31 31 LEU C C 31 173.849 173.849 175.239 -1.390 25109
1289 1 3 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.761 -0.069 25109
1290 1 3 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.014 0.787 25109
1291 1 3 . 1 1 31 31 LEU H H 31 7.619 7.619 7.617 0.002 25109
1292 1 3 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.386 -0.031 25109
1293 1 3 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.646 -0.236 25109
1294 1 3 . 1 1 33 33 CYS N N 33 110.978 110.978 115.628 -4.650 25109
1295 1 3 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.217 0.124 25109
1296 1 3 . 1 1 33 33 CYS C C 33 174.139 174.139 174.334 -0.195 25109
1297 1 3 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.400 -2.188 25109
1298 1 3 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.634 1.288 25109
1299 1 3 . 1 1 33 33 CYS H H 33 6.414 6.414 7.490 -1.076 25109
1300 1 3 . 1 1 34 34 LEU N N 34 123.111 123.111 121.381 1.730 25109
1301 1 3 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.460 0.146 25109
1302 1 3 . 1 1 34 34 LEU C C 34 176.646 176.646 176.154 0.492 25109
1303 1 3 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.715 0.176 25109
1304 1 3 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.081 -0.390 25109
1305 1 3 . 1 1 34 34 LEU H H 34 7.550 7.550 7.261 0.289 25109
1306 1 3 . 1 1 35 35 THR N N 35 113.831 113.831 117.050 -3.219 25109
1307 1 3 . 1 1 35 35 THR HA H 35 4.205 4.205 4.130 0.075 25109
1308 1 3 . 1 1 35 35 THR C C 35 175.324 175.324 176.018 -0.694 25109
1309 1 3 . 1 1 35 35 THR CA C 35 61.200 61.200 62.470 -1.270 25109
1310 1 3 . 1 1 35 35 THR CB C 35 71.318 71.318 69.776 1.542 25109
1311 1 3 . 1 1 35 35 THR H H 35 8.586 8.586 7.948 0.638 25109
1312 1 3 . 1 1 36 36 ALA N N 36 124.128 124.128 125.129 -1.001 25109
1313 1 3 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.040 -0.116 25109
1314 1 3 . 1 1 36 36 ALA C C 36 180.397 180.397 179.899 0.498 25109
1315 1 3 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.595 0.325 25109
1316 1 3 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.426 -0.623 25109
1317 1 3 . 1 1 36 36 ALA H H 36 8.836 8.836 8.741 0.095 25109
1318 1 3 . 1 1 37 37 ARG N N 37 116.793 116.793 118.931 -2.138 25109
1319 1 3 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.175 -0.189 25109
1320 1 3 . 1 1 37 37 ARG C C 37 179.272 179.272 177.865 1.407 25109
1321 1 3 . 1 1 37 37 ARG CA C 37 59.232 59.232 58.613 0.619 25109
1322 1 3 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.086 0.819 25109
1323 1 3 . 1 1 37 37 ARG H H 37 8.060 8.060 8.699 -0.639 25109
1324 1 3 . 1 1 38 38 ASP N N 38 120.030 120.030 118.259 1.771 25109
1325 1 3 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.379 -0.131 25109
1326 1 3 . 1 1 38 38 ASP C C 38 178.885 178.885 178.366 0.519 25109
1327 1 3 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.306 -1.119 25109
1328 1 3 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.349 0.584 25109
1329 1 3 . 1 1 38 38 ASP H H 38 7.782 7.782 8.356 -0.574 25109
1330 1 3 . 1 1 39 39 GLN N N 39 118.223 118.223 118.484 -0.261 25109
1331 1 3 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.971 -0.306 25109
1332 1 3 . 1 1 39 39 GLN C C 39 178.041 178.041 178.063 -0.022 25109
1333 1 3 . 1 1 39 39 GLN CA C 39 60.601 60.601 59.131 1.470 25109
1334 1 3 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.703 -0.906 25109
1335 1 3 . 1 1 39 39 GLN H H 39 8.476 8.476 8.147 0.329 25109
1336 1 3 . 1 1 40 40 ASP N N 40 117.908 117.908 120.759 -2.851 25109
1337 1 3 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.316 -0.063 25109
1338 1 3 . 1 1 40 40 ASP C C 40 178.639 178.639 178.372 0.267 25109
1339 1 3 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.690 -1.290 25109
1340 1 3 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.919 -2.891 25109
1341 1 3 . 1 1 40 40 ASP H H 40 8.386 8.386 8.339 0.047 25109
1342 1 3 . 1 1 41 41 ARG N N 41 120.990 120.990 120.154 0.836 25109
1343 1 3 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.036 0.006 25109
1344 1 3 . 1 1 41 41 ARG C C 41 179.795 179.795 178.501 1.294 25109
1345 1 3 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.757 0.688 25109
1346 1 3 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.606 0.652 25109
1347 1 3 . 1 1 41 41 ARG H H 41 8.130 8.130 8.279 -0.149 25109
1348 1 3 . 1 1 42 42 LEU N N 42 121.219 121.219 120.199 1.020 25109
1349 1 3 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.050 -0.115 25109
1350 1 3 . 1 1 42 42 LEU C C 42 178.850 178.850 179.067 -0.217 25109
1351 1 3 . 1 1 42 42 LEU CA C 42 58.267 58.267 58.090 0.177 25109
1352 1 3 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.591 0.442 25109
1353 1 3 . 1 1 42 42 LEU H H 42 8.179 8.179 7.676 0.503 25109
1354 1 3 . 1 1 43 43 ARG N N 43 119.310 119.310 119.774 -0.464 25109
1355 1 3 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.907 -0.183 25109
1356 1 3 . 1 1 43 43 ARG C C 43 179.099 179.099 178.484 0.615 25109
1357 1 3 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.701 1.113 25109
1358 1 3 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.240 -0.061 25109
1359 1 3 . 1 1 43 43 ARG H H 43 8.296 8.296 8.592 -0.296 25109
1360 1 3 . 1 1 44 44 ALA N N 44 121.305 121.305 120.020 1.285 25109
1361 1 3 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.202 -0.099 25109
1362 1 3 . 1 1 44 44 ALA C C 44 180.924 180.924 179.459 1.465 25109
1363 1 3 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.846 0.379 25109
1364 1 3 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.524 -0.428 25109
1365 1 3 . 1 1 44 44 ALA H H 44 7.774 7.774 8.329 -0.555 25109
1366 1 3 . 1 1 45 45 THR N N 45 115.017 115.017 115.167 -0.150 25109
1367 1 3 . 1 1 45 45 THR HA H 45 3.879 3.879 4.032 -0.153 25109
1368 1 3 . 1 1 45 45 THR CA C 45 66.327 66.327 66.392 -0.065 25109
1369 1 3 . 1 1 45 45 THR CB C 45 68.809 68.809 68.609 0.200 25109
1370 1 3 . 1 1 45 45 THR H H 45 8.167 8.167 7.788 0.379 25109
1371 1 3 . 1 1 46 46 CYS N N 46 123.609 123.609 120.781 2.828 25109
1372 1 3 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.136 -0.117 25109
1373 1 3 . 1 1 46 46 CYS C C 46 178.077 178.077 176.325 1.752 25109
1374 1 3 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.861 0.084 25109
1375 1 3 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.665 -1.526 25109
1376 1 3 . 1 1 46 46 CYS H H 46 8.084 8.084 8.354 -0.270 25109
1377 1 3 . 1 1 47 47 THR N N 47 115.520 115.520 113.321 2.199 25109
1378 1 3 . 1 1 47 47 THR HA H 47 3.915 3.915 4.097 -0.182 25109
1379 1 3 . 1 1 47 47 THR CA C 47 66.063 66.063 65.185 0.878 25109
1380 1 3 . 1 1 47 47 THR CB C 47 69.245 69.245 68.457 0.788 25109
1381 1 3 . 1 1 47 47 THR H H 47 7.735 7.735 7.612 0.123 25109
1382 1 3 . 1 1 48 48 LEU N N 48 120.099 120.099 121.371 -1.272 25109
1383 1 3 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.251 -0.025 25109
1384 1 3 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.042 0.521 25109
1385 1 3 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.404 1.221 25109
1386 1 3 . 1 1 48 48 LEU H H 48 7.464 7.464 7.444 0.020 25109
1387 1 3 . 1 1 49 49 SER N N 49 111.979 111.979 111.097 0.882 25109
1388 1 3 . 1 1 49 49 SER HA H 49 4.661 4.661 4.551 0.110 25109
1389 1 3 . 1 1 49 49 SER C C 49 175.581 175.581 174.209 1.372 25109
1390 1 3 . 1 1 49 49 SER CA C 49 59.590 59.590 58.523 1.067 25109
1391 1 3 . 1 1 49 49 SER CB C 49 65.335 65.335 64.349 0.986 25109
1392 1 3 . 1 1 49 49 SER H H 49 8.781 8.781 8.340 0.441 25109
1393 1 3 . 1 1 50 50 GLY N N 50 110.194 110.194 109.204 0.990 25109
1394 1 3 . 1 1 50 50 GLY C C 50 175.123 175.123 174.573 0.550 25109
1395 1 3 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.510 0.392 25109
1396 1 3 . 1 1 50 50 GLY H H 50 7.955 7.955 7.456 0.499 25109
1397 1 3 . 1 1 51 51 ASN N N 51 121.050 121.050 120.792 0.258 25109
1398 1 3 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.417 -0.167 25109
1399 1 3 . 1 1 51 51 ASN C C 51 176.403 176.403 177.184 -0.781 25109
1400 1 3 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.678 3.625 25109
1401 1 3 . 1 1 51 51 ASN CB C 51 41.599 41.599 37.993 3.606 25109
1402 1 3 . 1 1 51 51 ASN H H 51 8.898 8.898 8.812 0.086 25109
1403 1 3 . 1 1 52 52 ARG N N 52 119.825 119.825 120.768 -0.943 25109
1404 1 3 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.989 0.049 25109
1405 1 3 . 1 1 52 52 ARG C C 52 178.850 178.850 177.740 1.110 25109
1406 1 3 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.151 0.913 25109
1407 1 3 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.879 0.144 25109
1408 1 3 . 1 1 52 52 ARG H H 52 8.696 8.696 8.432 0.264 25109
1409 1 3 . 1 1 53 53 ASP N N 53 116.032 116.032 116.060 -0.028 25109
1410 1 3 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.594 -0.048 25109
1411 1 3 . 1 1 53 53 ASP C C 53 178.996 178.996 178.243 0.753 25109
1412 1 3 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.175 -1.096 25109
1413 1 3 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.839 -2.468 25109
1414 1 3 . 1 1 53 53 ASP H H 53 9.036 9.036 7.892 1.144 25109
1415 1 3 . 1 1 54 54 THR N N 54 115.848 115.848 117.033 -1.185 25109
1416 1 3 . 1 1 54 54 THR HA H 54 3.746 3.746 4.197 -0.451 25109
1417 1 3 . 1 1 54 54 THR CA C 54 67.885 67.885 66.533 1.352 25109
1418 1 3 . 1 1 54 54 THR CB C 54 66.953 66.953 68.792 -1.839 25109
1419 1 3 . 1 1 54 54 THR H H 54 7.782 7.782 7.762 0.020 25109
1420 1 3 . 1 1 55 55 LEU N N 55 125.987 125.987 121.570 4.417 25109
1421 1 3 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.287 -0.733 25109
1422 1 3 . 1 1 55 55 LEU C C 55 177.901 177.901 178.716 -0.815 25109
1423 1 3 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.398 0.055 25109
1424 1 3 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.508 0.355 25109
1425 1 3 . 1 1 55 55 LEU H H 55 8.740 8.740 8.489 0.251 25109
1426 1 3 . 1 1 56 56 TRP N N 56 116.672 116.672 120.069 -3.397 25109
1427 1 3 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.233 -0.153 25109
1428 1 3 . 1 1 56 56 TRP C C 56 179.588 179.588 177.520 2.068 25109
1429 1 3 . 1 1 56 56 TRP CA C 56 61.481 61.481 60.944 0.537 25109
1430 1 3 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.668 -0.476 25109
1431 1 3 . 1 1 56 56 TRP H H 56 7.642 7.642 7.971 -0.329 25109
1432 1 3 . 1 1 57 57 HIS N N 57 115.754 115.754 118.672 -2.918 25109
1433 1 3 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.302 -0.026 25109
1434 1 3 . 1 1 57 57 HIS C C 57 177.514 177.514 176.171 1.343 25109
1435 1 3 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.297 -0.345 25109
1436 1 3 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.731 -2.729 25109
1437 1 3 . 1 1 57 57 HIS H H 57 7.407 7.407 7.675 -0.268 25109
1438 1 3 . 1 1 58 58 LEU N N 58 123.934 123.934 120.661 3.273 25109
1439 1 3 . 1 1 58 58 LEU HA H 58 3.787 3.787 4.061 -0.274 25109
1440 1 3 . 1 1 58 58 LEU C C 58 178.115 178.115 178.039 0.076 25109
1441 1 3 . 1 1 58 58 LEU CA C 58 58.909 58.909 57.141 1.768 25109
1442 1 3 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.707 -0.892 25109
1443 1 3 . 1 1 58 58 LEU H H 58 8.996 8.996 8.040 0.956 25109
1444 1 3 . 1 1 59 59 PHE N N 59 117.721 117.721 115.643 2.078 25109
1445 1 3 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.848 0.087 25109
1446 1 3 . 1 1 59 59 PHE C C 59 176.987 176.987 175.743 1.244 25109
1447 1 3 . 1 1 59 59 PHE CA C 59 60.113 60.113 60.900 -0.787 25109
1448 1 3 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.386 -1.426 25109
1449 1 3 . 1 1 59 59 PHE H H 59 8.201 8.201 7.917 0.284 25109
1450 1 3 . 1 1 60 60 ASN N N 60 115.695 115.695 116.175 -0.480 25109
1451 1 3 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.270 -0.351 25109
1452 1 3 . 1 1 60 60 ASN C C 60 176.670 176.670 176.000 0.670 25109
1453 1 3 . 1 1 60 60 ASN CA C 60 56.756 56.756 54.479 2.277 25109
1454 1 3 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.640 0.678 25109
1455 1 3 . 1 1 60 60 ASN H H 60 7.666 7.666 7.289 0.377 25109
1456 1 3 . 1 1 61 61 THR N N 61 115.110 115.110 115.978 -0.868 25109
1457 1 3 . 1 1 61 61 THR HA H 61 3.733 3.733 3.742 -0.009 25109
1458 1 3 . 1 1 61 61 THR CA C 61 66.319 66.319 65.035 1.284 25109
1459 1 3 . 1 1 61 61 THR CB C 61 69.174 69.174 67.205 1.969 25109
1460 1 3 . 1 1 61 61 THR H H 61 7.782 7.782 8.276 -0.494 25109
1461 1 3 . 1 1 62 62 LEU N N 62 121.559 121.559 122.595 -1.036 25109
1462 1 3 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.896 -0.407 25109
1463 1 3 . 1 1 62 62 LEU C C 62 176.600 176.600 177.097 -0.497 25109
1464 1 3 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.545 0.420 25109
1465 1 3 . 1 1 62 62 LEU CB C 62 42.335 42.335 41.670 0.665 25109
1466 1 3 . 1 1 62 62 LEU H H 62 8.362 8.362 7.517 0.845 25109
1467 1 3 . 1 1 63 63 GLN N N 63 109.150 109.150 113.232 -4.082 25109
1468 1 3 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.659 -1.582 25109
1469 1 3 . 1 1 63 63 GLN C C 63 175.194 175.194 176.587 -1.393 25109
1470 1 3 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.187 -0.921 25109
1471 1 3 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.785 -2.091 25109
1472 1 3 . 1 1 63 63 GLN H H 63 6.458 6.458 7.270 -0.812 25109
1473 1 3 . 1 1 64 64 ARG N N 64 116.029 116.029 118.505 -2.476 25109
1474 1 3 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.327 -0.229 25109
1475 1 3 . 1 1 64 64 ARG C C 64 176.459 176.459 176.208 0.251 25109
1476 1 3 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.909 0.234 25109
1477 1 3 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.853 -0.269 25109
1478 1 3 . 1 1 64 64 ARG H H 64 6.596 6.596 7.334 -0.738 25109
1479 1 3 . 1 1 65 65 ARG N N 65 120.422 120.422 120.002 0.420 25109
1480 1 3 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.678 0.156 25109
1481 1 3 . 1 1 65 65 ARG C C 65 173.436 173.436 175.180 -1.744 25109
1482 1 3 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.529 -0.984 25109
1483 1 3 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.149 -1.153 25109
1484 1 3 . 1 1 65 65 ARG H H 65 7.932 7.932 7.331 0.601 25109
1485 1 3 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.460 0.114 25109
1486 1 3 . 1 1 66 66 PRO CB C 66 32.059 32.059 32.386 -0.327 25109
1487 1 3 . 1 1 67 67 GLY N N 67 111.953 111.953 107.083 4.870 25109
1488 1 3 . 1 1 67 67 GLY C C 67 177.057 177.057 174.099 2.958 25109
1489 1 3 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.659 0.648 25109
1490 1 3 . 1 1 67 67 GLY H H 67 9.198 9.198 7.820 1.378 25109
1491 1 3 . 1 1 68 68 TRP N N 68 117.467 117.467 122.806 -5.339 25109
1492 1 3 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.160 -0.818 25109
1493 1 3 . 1 1 68 68 TRP C C 68 177.690 177.690 175.187 2.503 25109
1494 1 3 . 1 1 68 68 TRP CA C 68 60.116 60.116 58.036 2.080 25109
1495 1 3 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.890 -0.700 25109
1496 1 3 . 1 1 68 68 TRP H H 68 7.647 7.647 8.234 -0.587 25109
1497 1 3 . 1 1 69 69 VAL N N 69 121.482 121.482 123.014 -1.532 25109
1498 1 3 . 1 1 69 69 VAL HA H 69 2.637 2.637 2.989 -0.352 25109
1499 1 3 . 1 1 69 69 VAL C C 69 177.993 177.993 177.169 0.824 25109
1500 1 3 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.546 0.920 25109
1501 1 3 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.550 -0.524 25109
1502 1 3 . 1 1 69 69 VAL H H 69 6.666 6.666 7.347 -0.681 25109
1503 1 3 . 1 1 70 70 GLU N N 70 116.350 116.350 119.810 -3.460 25109
1504 1 3 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.986 -0.161 25109
1505 1 3 . 1 1 70 70 GLU C C 70 180.362 180.362 178.555 1.807 25109
1506 1 3 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.113 0.108 25109
1507 1 3 . 1 1 70 70 GLU CB C 70 27.305 27.305 27.947 -0.642 25109
1508 1 3 . 1 1 70 70 GLU H H 70 7.410 7.410 8.528 -1.118 25109
1509 1 3 . 1 1 71 71 TYR N N 71 116.750 116.750 119.142 -2.392 25109
1510 1 3 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.388 0.062 25109
1511 1 3 . 1 1 71 71 TYR C C 71 178.411 178.411 178.459 -0.048 25109
1512 1 3 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.569 1.033 25109
1513 1 3 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.047 0.307 25109
1514 1 3 . 1 1 71 71 TYR H H 71 7.159 7.159 7.784 -0.625 25109
1515 1 3 . 1 1 72 72 PHE N N 72 121.610 121.610 120.988 0.622 25109
1516 1 3 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.248 0.254 25109
1517 1 3 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.567 -0.747 25109
1518 1 3 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.293 0.756 25109
1519 1 3 . 1 1 72 72 PHE H H 72 9.007 9.007 8.549 0.458 25109
1520 1 3 . 1 1 73 73 ILE N N 73 119.200 119.200 119.289 -0.089 25109
1521 1 3 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.482 -0.302 25109
1522 1 3 . 1 1 73 73 ILE C C 73 177.620 177.620 177.678 -0.058 25109
1523 1 3 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.750 1.447 25109
1524 1 3 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.571 1.452 25109
1525 1 3 . 1 1 73 73 ILE H H 73 8.644 8.644 8.701 -0.057 25109
1526 1 3 . 1 1 74 74 ALA N N 74 119.624 119.624 120.901 -1.277 25109
1527 1 3 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.077 -0.123 25109
1528 1 3 . 1 1 74 74 ALA C C 74 181.030 181.030 179.368 1.662 25109
1529 1 3 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.831 0.580 25109
1530 1 3 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.002 0.134 25109
1531 1 3 . 1 1 74 74 ALA H H 74 7.476 7.476 7.812 -0.336 25109
1532 1 3 . 1 1 75 75 ALA N N 75 123.625 123.625 122.696 0.929 25109
1533 1 3 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.442 0.396 25109
1534 1 3 . 1 1 75 75 ALA C C 75 179.272 179.272 179.005 0.267 25109
1535 1 3 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.802 0.300 25109
1536 1 3 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.240 1.353 25109
1537 1 3 . 1 1 75 75 ALA H H 75 8.524 8.524 7.588 0.936 25109
1538 1 3 . 1 1 76 76 LEU N N 76 118.114 118.114 119.509 -1.395 25109
1539 1 3 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.965 -0.293 25109
1540 1 3 . 1 1 76 76 LEU C C 76 180.001 180.001 179.914 0.087 25109
1541 1 3 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.456 0.800 25109
1542 1 3 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.284 1.335 25109
1543 1 3 . 1 1 76 76 LEU H H 76 8.153 8.153 7.708 0.445 25109
1544 1 3 . 1 1 77 77 ARG N N 77 117.830 117.830 119.843 -2.013 25109
1545 1 3 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.015 -0.568 25109
1546 1 3 . 1 1 77 77 ARG C C 77 180.889 180.889 178.722 2.167 25109
1547 1 3 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.292 1.774 25109
1548 1 3 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.102 -0.904 25109
1549 1 3 . 1 1 77 77 ARG H H 77 7.945 7.945 8.098 -0.153 25109
1550 1 3 . 1 1 78 78 GLY N N 78 110.202 110.202 106.873 3.329 25109
1551 1 3 . 1 1 78 78 GLY C C 78 174.807 174.807 175.976 -1.169 25109
1552 1 3 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.765 -0.205 25109
1553 1 3 . 1 1 78 78 GLY H H 78 8.269 8.269 8.235 0.034 25109
1554 1 3 . 1 1 79 79 CYS N N 79 115.567 115.567 117.521 -1.954 25109
1555 1 3 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.400 -0.011 25109
1556 1 3 . 1 1 79 79 CYS C C 79 173.025 173.025 174.556 -1.531 25109
1557 1 3 . 1 1 79 79 CYS CA C 79 59.957 59.957 56.953 3.004 25109
1558 1 3 . 1 1 79 79 CYS CB C 79 27.805 27.805 25.889 1.916 25109
1559 1 3 . 1 1 79 79 CYS H H 79 7.132 7.132 7.704 -0.572 25109
1560 1 3 . 1 1 80 80 GLU N N 80 111.759 111.759 114.884 -3.125 25109
1561 1 3 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.963 -0.230 25109
1562 1 3 . 1 1 80 80 GLU C C 80 175.827 175.827 175.109 0.718 25109
1563 1 3 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.491 -0.024 25109
1564 1 3 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.093 -2.376 25109
1565 1 3 . 1 1 80 80 GLU H H 80 7.772 7.772 7.800 -0.028 25109
1566 1 3 . 1 1 81 81 LEU N N 81 124.692 124.692 121.328 3.364 25109
1567 1 3 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.492 0.199 25109
1568 1 3 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.974 -1.019 25109
1569 1 3 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.975 -1.584 25109
1570 1 3 . 1 1 81 81 LEU H H 81 8.167 8.167 8.240 -0.073 25109
1571 1 3 . 1 1 82 82 VAL N N 82 118.320 118.320 122.707 -4.387 25109
1572 1 3 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.685 -0.508 25109
1573 1 3 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.150 0.560 25109
1574 1 3 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.646 0.302 25109
1575 1 3 . 1 1 82 82 VAL H H 82 7.141 7.141 7.756 -0.615 25109
1576 1 3 . 1 1 83 83 ASP N N 83 118.733 118.733 119.611 -0.878 25109
1577 1 3 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.309 0.023 25109
1578 1 3 . 1 1 83 83 ASP C C 83 178.674 178.674 178.090 0.584 25109
1579 1 3 . 1 1 83 83 ASP CA C 83 56.443 56.443 56.975 -0.532 25109
1580 1 3 . 1 1 83 83 ASP CB C 83 36.829 36.829 39.977 -3.148 25109
1581 1 3 . 1 1 83 83 ASP H H 83 8.385 8.385 8.770 -0.385 25109
1582 1 3 . 1 1 84 84 LEU N N 84 121.026 121.026 120.082 0.944 25109
1583 1 3 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.288 -0.309 25109
1584 1 3 . 1 1 84 84 LEU C C 84 178.796 178.796 179.374 -0.578 25109
1585 1 3 . 1 1 84 84 LEU CA C 84 57.522 57.522 56.626 0.896 25109
1586 1 3 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.481 1.014 25109
1587 1 3 . 1 1 84 84 LEU H H 84 7.770 7.770 7.843 -0.073 25109
1588 1 3 . 1 1 85 85 ALA N N 85 121.525 121.525 122.328 -0.803 25109
1589 1 3 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.985 -0.324 25109
1590 1 3 . 1 1 85 85 ALA C C 85 179.322 179.322 179.154 0.168 25109
1591 1 3 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.150 0.691 25109
1592 1 3 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.165 0.762 25109
1593 1 3 . 1 1 85 85 ALA H H 85 8.126 8.126 7.488 0.638 25109
1594 1 3 . 1 1 86 86 ASP N N 86 115.349 115.349 118.608 -3.259 25109
1595 1 3 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.369 -0.096 25109
1596 1 3 . 1 1 86 86 ASP C C 86 178.463 178.463 178.431 0.032 25109
1597 1 3 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.628 -1.917 25109
1598 1 3 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.103 -3.941 25109
1599 1 3 . 1 1 86 86 ASP H H 86 8.410 8.410 8.490 -0.080 25109
1600 1 3 . 1 1 87 87 GLU N N 87 122.529 122.529 119.097 3.432 25109
1601 1 3 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.222 -0.186 25109
1602 1 3 . 1 1 87 87 GLU C C 87 178.508 178.508 178.554 -0.046 25109
1603 1 3 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.053 0.301 25109
1604 1 3 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.664 -1.391 25109
1605 1 3 . 1 1 87 87 GLU H H 87 8.012 8.012 7.980 0.032 25109
1606 1 3 . 1 1 88 88 VAL N N 88 119.148 119.148 121.100 -1.952 25109
1607 1 3 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.934 -0.604 25109
1608 1 3 . 1 1 88 88 VAL C C 88 177.240 177.240 177.778 -0.538 25109
1609 1 3 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.379 0.870 25109
1610 1 3 . 1 1 88 88 VAL CB C 88 31.529 31.529 32.024 -0.495 25109
1611 1 3 . 1 1 88 88 VAL H H 88 8.291 8.291 7.616 0.675 25109
1612 1 3 . 1 1 89 89 ALA N N 89 120.709 120.709 122.192 -1.483 25109
1613 1 3 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.005 -0.090 25109
1614 1 3 . 1 1 89 89 ALA C C 89 180.186 180.186 179.793 0.393 25109
1615 1 3 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.433 0.626 25109
1616 1 3 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.174 0.061 25109
1617 1 3 . 1 1 89 89 ALA H H 89 8.548 8.548 8.378 0.170 25109
1618 1 3 . 1 1 90 90 SER N N 90 113.035 113.035 113.121 -0.086 25109
1619 1 3 . 1 1 90 90 SER HA H 90 4.047 4.047 4.195 -0.148 25109
1620 1 3 . 1 1 90 90 SER C C 90 177.564 177.564 176.013 1.551 25109
1621 1 3 . 1 1 90 90 SER CA C 90 61.771 61.771 61.897 -0.126 25109
1622 1 3 . 1 1 90 90 SER CB C 90 62.907 62.907 63.151 -0.244 25109
1623 1 3 . 1 1 90 90 SER H H 90 7.969 7.969 8.370 -0.401 25109
1624 1 3 . 1 1 91 91 VAL N N 91 123.417 123.417 120.072 3.345 25109
1625 1 3 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.830 -0.483 25109
1626 1 3 . 1 1 91 91 VAL C C 91 178.428 178.428 176.953 1.475 25109
1627 1 3 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.645 0.484 25109
1628 1 3 . 1 1 91 91 VAL CB C 91 31.771 31.771 32.009 -0.238 25109
1629 1 3 . 1 1 91 91 VAL H H 91 7.713 7.713 7.433 0.280 25109
1630 1 3 . 1 1 92 92 TYR N N 92 121.458 121.458 120.385 1.073 25109
1631 1 3 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.728 -0.537 25109
1632 1 3 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.575 1.419 25109
1633 1 3 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.462 0.523 25109
1634 1 3 . 1 1 92 92 TYR H H 92 8.395 8.395 7.647 0.748 25109
1635 1 3 . 1 1 93 93 GLN N N 93 115.549 115.549 117.464 -1.915 25109
1636 1 3 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.108 -0.397 25109
1637 1 3 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.134 -0.040 25109
1638 1 3 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.535 -0.237 25109
1639 1 3 . 1 1 93 93 GLN H H 93 8.167 8.167 7.892 0.275 25109
1640 1 3 . 1 1 94 94 SER N N 94 115.923 115.923 114.052 1.871 25109
1641 1 3 . 1 1 94 94 SER HA H 94 4.096 4.096 4.273 -0.177 25109
1642 1 3 . 1 1 94 94 SER CA C 94 60.971 60.971 59.695 1.276 25109
1643 1 3 . 1 1 94 94 SER CB C 94 62.635 62.635 64.316 -1.681 25109
1644 1 3 . 1 1 94 94 SER H H 94 7.642 7.642 7.600 0.042 25109
1645 1 3 . 1 1 95 95 TYR N N 95 119.565 119.565 121.422 -1.857 25109
1646 1 3 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.464 0.295 25109
1647 1 3 . 1 1 95 95 TYR C C 95 175.334 175.334 174.413 0.921 25109
1648 1 3 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.802 -0.104 25109
1649 1 3 . 1 1 95 95 TYR CB C 95 39.319 39.319 38.002 1.317 25109
1650 1 3 . 1 1 95 95 TYR H H 95 7.069 7.069 8.050 -0.981 25109
1651 1 3 . 1 1 96 96 GLN N N 96 119.872 119.872 121.170 -1.298 25109
1652 1 3 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.976 0.389 25109
1653 1 3 . 1 1 96 96 GLN C C 96 173.612 173.612 173.486 0.126 25109
1654 1 3 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.647 -1.311 25109
1655 1 3 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.306 1.188 25109
1656 1 3 . 1 1 96 96 GLN H H 96 7.409 7.409 8.681 -1.272 25109
1657 1 3 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.260 0.058 25109
1658 1 3 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.771 -0.757 25109
1659 1 3 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.164 -0.066 25109
1660 1 3 . 1 1 98 98 ARG N N 98 121.759 121.759 120.746 1.013 25109
1661 1 3 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.555 -0.213 25109
1662 1 3 . 1 1 98 98 ARG C C 98 176.848 176.848 175.096 1.752 25109
1663 1 3 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.157 1.065 25109
1664 1 3 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.339 0.748 25109
1665 1 3 . 1 1 98 98 ARG H H 98 8.423 8.423 7.876 0.547 25109
1666 1 3 . 1 1 99 99 THR N N 99 115.292 115.292 120.626 -5.334 25109
1667 1 3 . 1 1 99 99 THR HA H 99 4.323 4.323 4.486 -0.163 25109
1668 1 3 . 1 1 99 99 THR C C 99 174.350 174.350 174.690 -0.340 25109
1669 1 3 . 1 1 99 99 THR CA C 99 61.906 61.906 62.516 -0.610 25109
1670 1 3 . 1 1 99 99 THR CB C 99 70.180 70.180 68.760 1.420 25109
1671 1 3 . 1 1 99 99 THR H H 99 8.179 8.179 8.537 -0.358 25109
1672 1 4 . 1 1 0 0 SER N N 0 115.693 115.693 115.620 0.073 25109
1673 1 4 . 1 1 0 0 SER HA H 0 4.531 4.531 4.563 -0.032 25109
1674 1 4 . 1 1 0 0 SER C C 0 174.557 174.557 174.204 0.353 25109
1675 1 4 . 1 1 0 0 SER CA C 0 58.478 58.478 59.341 -0.863 25109
1676 1 4 . 1 1 0 0 SER CB C 0 64.380 64.380 63.334 1.046 25109
1677 1 4 . 1 1 0 0 SER H H 0 8.631 8.631 8.462 0.169 25109
1678 1 4 . 1 1 1 1 MET N N 1 123.111 123.111 121.573 1.538 25109
1679 1 4 . 1 1 1 1 MET HA H 1 4.728 4.728 4.785 -0.057 25109
1680 1 4 . 1 1 1 1 MET C C 1 174.846 174.846 173.567 1.279 25109
1681 1 4 . 1 1 1 1 MET CA C 1 55.655 55.655 53.100 2.555 25109
1682 1 4 . 1 1 1 1 MET CB C 1 32.035 32.035 35.070 -3.035 25109
1683 1 4 . 1 1 1 1 MET H H 1 8.641 8.641 7.525 1.116 25109
1684 1 4 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.964 -0.487 25109
1685 1 4 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.052 0.948 25109
1686 1 4 . 1 1 3 3 PHE N N 3 121.126 121.126 125.804 -4.678 25109
1687 1 4 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.622 -0.256 25109
1688 1 4 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.256 1.606 25109
1689 1 4 . 1 1 3 3 PHE CB C 3 39.368 39.368 41.014 -1.647 25109
1690 1 4 . 1 1 3 3 PHE H H 3 8.177 8.177 9.363 -1.186 25109
1691 1 4 . 1 1 4 4 ALA N N 4 121.170 121.170 122.534 -1.364 25109
1692 1 4 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.041 -0.206 25109
1693 1 4 . 1 1 4 4 ALA C C 4 181.522 181.522 178.693 2.829 25109
1694 1 4 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.485 -0.031 25109
1695 1 4 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.452 0.984 25109
1696 1 4 . 1 1 4 4 ALA H H 4 8.444 8.444 8.934 -0.490 25109
1697 1 4 . 1 1 5 5 GLU N N 5 118.932 118.932 118.081 0.851 25109
1698 1 4 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.957 -0.102 25109
1699 1 4 . 1 1 5 5 GLU C C 5 177.971 177.971 178.267 -0.296 25109
1700 1 4 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.438 0.193 25109
1701 1 4 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.992 -0.231 25109
1702 1 4 . 1 1 5 5 GLU H H 5 8.454 8.454 8.860 -0.406 25109
1703 1 4 . 1 1 6 6 ASP N N 6 120.471 120.471 119.060 1.411 25109
1704 1 4 . 1 1 6 6 ASP C C 6 178.885 178.885 177.902 0.983 25109
1705 1 4 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.768 -0.696 25109
1706 1 4 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.665 -1.533 25109
1707 1 4 . 1 1 6 6 ASP H H 6 8.316 8.316 8.346 -0.030 25109
1708 1 4 . 1 1 7 7 LYS N N 7 118.335 118.335 119.182 -0.847 25109
1709 1 4 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.786 -0.096 25109
1710 1 4 . 1 1 7 7 LYS C C 7 180.080 180.080 179.258 0.822 25109
1711 1 4 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.779 -0.059 25109
1712 1 4 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.287 0.507 25109
1713 1 4 . 1 1 7 7 LYS H H 7 8.249 8.249 7.934 0.315 25109
1714 1 4 . 1 1 8 8 THR N N 8 119.222 119.222 116.074 3.148 25109
1715 1 4 . 1 1 8 8 THR HA H 8 3.975 3.975 4.099 -0.124 25109
1716 1 4 . 1 1 8 8 THR CA C 8 68.453 68.453 66.988 1.465 25109
1717 1 4 . 1 1 8 8 THR CB C 8 67.387 67.387 68.836 -1.449 25109
1718 1 4 . 1 1 8 8 THR H H 8 7.897 7.897 8.220 -0.323 25109
1719 1 4 . 1 1 9 9 TYR N N 9 123.054 123.054 123.277 -0.223 25109
1720 1 4 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.388 -0.135 25109
1721 1 4 . 1 1 9 9 TYR C C 9 177.441 177.441 177.192 0.249 25109
1722 1 4 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.190 -0.292 25109
1723 1 4 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.743 -0.894 25109
1724 1 4 . 1 1 9 9 TYR H H 9 8.605 8.605 8.348 0.257 25109
1725 1 4 . 1 1 10 10 LYS N N 10 118.366 118.366 118.477 -0.111 25109
1726 1 4 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.884 -0.290 25109
1727 1 4 . 1 1 10 10 LYS C C 10 178.885 178.885 178.313 0.572 25109
1728 1 4 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.454 1.590 25109
1729 1 4 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.316 -0.271 25109
1730 1 4 . 1 1 10 10 LYS H H 10 8.066 8.066 8.345 -0.279 25109
1731 1 4 . 1 1 11 11 TYR N N 11 120.539 120.539 119.181 1.358 25109
1732 1 4 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.275 -0.285 25109
1733 1 4 . 1 1 11 11 TYR C C 11 178.233 178.233 177.766 0.467 25109
1734 1 4 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.371 1.157 25109
1735 1 4 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.533 -1.170 25109
1736 1 4 . 1 1 11 11 TYR H H 11 7.875 7.875 7.698 0.177 25109
1737 1 4 . 1 1 12 12 ILE N N 12 121.893 121.893 119.758 2.135 25109
1738 1 4 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.824 -0.728 25109
1739 1 4 . 1 1 12 12 ILE C C 12 177.015 177.015 177.182 -0.167 25109
1740 1 4 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.071 2.692 25109
1741 1 4 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.431 1.121 25109
1742 1 4 . 1 1 12 12 ILE H H 12 8.154 8.154 8.709 -0.555 25109
1743 1 4 . 1 1 13 13 CYS N N 13 113.894 113.894 118.077 -4.183 25109
1744 1 4 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.673 0.214 25109
1745 1 4 . 1 1 13 13 CYS C C 13 178.288 178.288 176.340 1.948 25109
1746 1 4 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.765 2.572 25109
1747 1 4 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.999 0.006 25109
1748 1 4 . 1 1 13 13 CYS H H 13 7.551 7.551 8.167 -0.616 25109
1749 1 4 . 1 1 14 14 ARG N N 14 119.228 119.228 118.234 0.994 25109
1750 1 4 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.049 0.021 25109
1751 1 4 . 1 1 14 14 ARG C C 14 177.127 177.127 177.766 -0.639 25109
1752 1 4 . 1 1 14 14 ARG CA C 14 58.494 58.494 59.108 -0.615 25109
1753 1 4 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.365 0.057 25109
1754 1 4 . 1 1 14 14 ARG H H 14 7.991 7.991 7.433 0.558 25109
1755 1 4 . 1 1 15 15 ASN N N 15 117.367 117.367 116.048 1.319 25109
1756 1 4 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.741 0.228 25109
1757 1 4 . 1 1 15 15 ASN CA C 15 52.763 52.763 53.005 -0.242 25109
1758 1 4 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.041 0.544 25109
1759 1 4 . 1 1 15 15 ASN H H 15 7.643 7.643 7.653 -0.010 25109
1760 1 4 . 1 1 16 16 PHE N N 16 122.356 122.356 122.045 0.311 25109
1761 1 4 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.029 0.187 25109
1762 1 4 . 1 1 16 16 PHE C C 16 178.084 178.084 176.480 1.604 25109
1763 1 4 . 1 1 16 16 PHE CA C 16 63.177 63.177 60.637 2.540 25109
1764 1 4 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.748 1.841 25109
1765 1 4 . 1 1 16 16 PHE H H 16 6.992 6.992 7.561 -0.569 25109
1766 1 4 . 1 1 17 17 SER N N 17 112.937 112.937 115.583 -2.646 25109
1767 1 4 . 1 1 17 17 SER HA H 17 4.199 4.199 3.880 0.319 25109
1768 1 4 . 1 1 17 17 SER C C 17 176.726 176.726 176.471 0.255 25109
1769 1 4 . 1 1 17 17 SER CA C 17 62.052 62.052 60.910 1.143 25109
1770 1 4 . 1 1 17 17 SER CB C 17 62.552 62.552 62.816 -0.264 25109
1771 1 4 . 1 1 17 17 SER H H 17 8.840 8.840 8.216 0.624 25109
1772 1 4 . 1 1 18 18 ASN N N 18 118.809 118.809 121.523 -2.714 25109
1773 1 4 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.471 -0.113 25109
1774 1 4 . 1 1 18 18 ASN C C 18 175.967 175.967 177.141 -1.174 25109
1775 1 4 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.477 -0.567 25109
1776 1 4 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.129 -0.301 25109
1777 1 4 . 1 1 18 18 ASN H H 18 8.130 8.130 7.869 0.261 25109
1778 1 4 . 1 1 19 19 PHE N N 19 115.750 115.750 118.520 -2.770 25109
1779 1 4 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.461 -0.176 25109
1780 1 4 . 1 1 19 19 PHE C C 19 175.370 175.370 176.476 -1.106 25109
1781 1 4 . 1 1 19 19 PHE CA C 19 58.862 58.862 59.764 -0.902 25109
1782 1 4 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.665 1.213 25109
1783 1 4 . 1 1 19 19 PHE H H 19 8.062 8.062 7.648 0.414 25109
1784 1 4 . 1 1 20 20 CYS N N 20 113.958 113.958 116.175 -2.217 25109
1785 1 4 . 1 1 20 20 CYS HA H 20 3.943 3.943 3.964 -0.021 25109
1786 1 4 . 1 1 20 20 CYS C C 20 173.823 173.823 174.765 -0.942 25109
1787 1 4 . 1 1 20 20 CYS CA C 20 61.788 61.788 60.153 1.635 25109
1788 1 4 . 1 1 20 20 CYS CB C 20 27.383 27.383 26.342 1.041 25109
1789 1 4 . 1 1 20 20 CYS H H 20 6.850 6.850 7.236 -0.386 25109
1790 1 4 . 1 1 21 21 ASN N N 21 116.691 116.691 117.303 -0.612 25109
1791 1 4 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.705 0.039 25109
1792 1 4 . 1 1 21 21 ASN C C 21 175.299 175.299 174.616 0.683 25109
1793 1 4 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.341 -0.051 25109
1794 1 4 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.901 -0.588 25109
1795 1 4 . 1 1 21 21 ASN H H 21 8.251 8.251 7.455 0.796 25109
1796 1 4 . 1 1 22 22 VAL N N 22 122.431 122.431 119.107 3.324 25109
1797 1 4 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.141 -0.591 25109
1798 1 4 . 1 1 22 22 VAL C C 22 174.034 174.034 174.192 -0.158 25109
1799 1 4 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.058 3.879 25109
1800 1 4 . 1 1 22 22 VAL CB C 22 31.523 31.523 33.986 -2.463 25109
1801 1 4 . 1 1 22 22 VAL H H 22 7.573 7.573 7.380 0.193 25109
1802 1 4 . 1 1 23 23 ASP N N 23 127.219 127.219 119.686 7.533 25109
1803 1 4 . 1 1 23 23 ASP CA C 23 52.186 52.186 54.360 -2.174 25109
1804 1 4 . 1 1 23 23 ASP CB C 23 38.793 38.793 42.319 -3.526 25109
1805 1 4 . 1 1 23 23 ASP H H 23 8.687 8.687 8.527 0.160 25109
1806 1 4 . 1 1 24 24 VAL N N 24 127.835 127.835 117.260 10.575 25109
1807 1 4 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.392 -1.099 25109
1808 1 4 . 1 1 24 24 VAL C C 24 176.867 176.867 177.341 -0.474 25109
1809 1 4 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.006 3.157 25109
1810 1 4 . 1 1 24 24 VAL CB C 24 32.015 32.015 34.755 -2.740 25109
1811 1 4 . 1 1 24 24 VAL H H 24 9.409 9.409 8.241 1.168 25109
1812 1 4 . 1 1 25 25 VAL N N 25 114.324 114.324 118.443 -4.119 25109
1813 1 4 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.022 -0.503 25109
1814 1 4 . 1 1 25 25 VAL C C 25 178.006 178.006 177.046 0.960 25109
1815 1 4 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.201 1.487 25109
1816 1 4 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.286 0.246 25109
1817 1 4 . 1 1 25 25 VAL H H 25 8.038 8.038 7.927 0.111 25109
1818 1 4 . 1 1 26 26 GLU N N 26 117.009 117.009 118.728 -1.719 25109
1819 1 4 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.615 -0.524 25109
1820 1 4 . 1 1 26 26 GLU C C 26 177.303 177.303 175.690 1.613 25109
1821 1 4 . 1 1 26 26 GLU CA C 26 57.432 57.432 56.795 0.637 25109
1822 1 4 . 1 1 26 26 GLU CB C 26 28.965 28.965 28.997 -0.031 25109
1823 1 4 . 1 1 26 26 GLU H H 26 7.220 7.220 8.967 -1.747 25109
1824 1 4 . 1 1 27 27 ILE N N 27 114.080 114.080 118.862 -4.782 25109
1825 1 4 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.836 0.525 25109
1826 1 4 . 1 1 27 27 ILE CA C 27 62.732 62.732 62.488 0.244 25109
1827 1 4 . 1 1 27 27 ILE CB C 27 39.591 39.591 39.538 0.053 25109
1828 1 4 . 1 1 27 27 ILE H H 27 7.647 7.647 7.799 -0.152 25109
1829 1 4 . 1 1 28 28 LEU N N 28 121.867 121.867 122.684 -0.817 25109
1830 1 4 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.512 -0.575 25109
1831 1 4 . 1 1 28 28 LEU C C 28 175.756 175.756 176.614 -0.858 25109
1832 1 4 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.561 -0.594 25109
1833 1 4 . 1 1 28 28 LEU CB C 28 39.513 39.513 39.327 0.186 25109
1834 1 4 . 1 1 28 28 LEU H H 28 7.434 7.434 8.556 -1.122 25109
1835 1 4 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.421 -0.211 25109
1836 1 4 . 1 1 29 29 PRO CB C 29 31.310 31.310 30.980 0.330 25109
1837 1 4 . 1 1 30 30 TYR N N 30 113.832 113.832 115.432 -1.600 25109
1838 1 4 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.547 -0.045 25109
1839 1 4 . 1 1 30 30 TYR C C 30 174.386 174.386 175.273 -0.887 25109
1840 1 4 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.206 -1.512 25109
1841 1 4 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.284 -0.185 25109
1842 1 4 . 1 1 30 30 TYR H H 30 7.628 7.628 7.871 -0.243 25109
1843 1 4 . 1 1 31 31 LEU N N 31 118.331 118.331 119.661 -1.330 25109
1844 1 4 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.837 0.040 25109
1845 1 4 . 1 1 31 31 LEU C C 31 173.849 173.849 175.686 -1.837 25109
1846 1 4 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.845 -0.153 25109
1847 1 4 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.861 -0.059 25109
1848 1 4 . 1 1 31 31 LEU H H 31 7.619 7.619 7.476 0.143 25109
1849 1 4 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.492 -0.137 25109
1850 1 4 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.693 -0.283 25109
1851 1 4 . 1 1 33 33 CYS N N 33 110.978 110.978 115.720 -4.742 25109
1852 1 4 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.286 0.055 25109
1853 1 4 . 1 1 33 33 CYS C C 33 174.139 174.139 174.719 -0.580 25109
1854 1 4 . 1 1 33 33 CYS CA C 33 56.212 56.212 57.765 -1.553 25109
1855 1 4 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.532 1.390 25109
1856 1 4 . 1 1 33 33 CYS H H 33 6.414 6.414 7.564 -1.150 25109
1857 1 4 . 1 1 34 34 LEU N N 34 123.111 123.111 120.448 2.663 25109
1858 1 4 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.537 0.069 25109
1859 1 4 . 1 1 34 34 LEU C C 34 176.646 176.646 176.825 -0.179 25109
1860 1 4 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.700 0.191 25109
1861 1 4 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.688 -0.997 25109
1862 1 4 . 1 1 34 34 LEU H H 34 7.550 7.550 7.234 0.316 25109
1863 1 4 . 1 1 35 35 THR N N 35 113.831 113.831 111.922 1.909 25109
1864 1 4 . 1 1 35 35 THR HA H 35 4.205 4.205 4.284 -0.079 25109
1865 1 4 . 1 1 35 35 THR C C 35 175.324 175.324 176.120 -0.796 25109
1866 1 4 . 1 1 35 35 THR CA C 35 61.200 61.200 61.025 0.175 25109
1867 1 4 . 1 1 35 35 THR CB C 35 71.318 71.318 70.013 1.305 25109
1868 1 4 . 1 1 35 35 THR H H 35 8.586 8.586 8.275 0.311 25109
1869 1 4 . 1 1 36 36 ALA N N 36 124.128 124.128 127.219 -3.091 25109
1870 1 4 . 1 1 36 36 ALA HA H 36 3.924 3.924 3.967 -0.043 25109
1871 1 4 . 1 1 36 36 ALA C C 36 180.397 180.397 179.931 0.466 25109
1872 1 4 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.192 0.728 25109
1873 1 4 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.629 -0.826 25109
1874 1 4 . 1 1 36 36 ALA H H 36 8.836 8.836 8.785 0.051 25109
1875 1 4 . 1 1 37 37 ARG N N 37 116.793 116.793 118.920 -2.127 25109
1876 1 4 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.150 -0.164 25109
1877 1 4 . 1 1 37 37 ARG C C 37 179.272 179.272 178.018 1.254 25109
1878 1 4 . 1 1 37 37 ARG CA C 37 59.232 59.232 58.616 0.616 25109
1879 1 4 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.374 0.531 25109
1880 1 4 . 1 1 37 37 ARG H H 37 8.060 8.060 8.490 -0.430 25109
1881 1 4 . 1 1 38 38 ASP N N 38 120.030 120.030 118.556 1.474 25109
1882 1 4 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.467 -0.219 25109
1883 1 4 . 1 1 38 38 ASP C C 38 178.885 178.885 178.648 0.237 25109
1884 1 4 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.452 -0.265 25109
1885 1 4 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.441 0.492 25109
1886 1 4 . 1 1 38 38 ASP H H 38 7.782 7.782 7.649 0.133 25109
1887 1 4 . 1 1 39 39 GLN N N 39 118.223 118.223 117.866 0.357 25109
1888 1 4 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.089 -0.424 25109
1889 1 4 . 1 1 39 39 GLN C C 39 178.041 178.041 178.270 -0.229 25109
1890 1 4 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.346 2.255 25109
1891 1 4 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.299 -0.502 25109
1892 1 4 . 1 1 39 39 GLN H H 39 8.476 8.476 7.998 0.478 25109
1893 1 4 . 1 1 40 40 ASP N N 40 117.908 117.908 121.058 -3.150 25109
1894 1 4 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.345 -0.092 25109
1895 1 4 . 1 1 40 40 ASP C C 40 178.639 178.639 178.250 0.389 25109
1896 1 4 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.547 -1.147 25109
1897 1 4 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.968 -2.940 25109
1898 1 4 . 1 1 40 40 ASP H H 40 8.386 8.386 8.411 -0.025 25109
1899 1 4 . 1 1 41 41 ARG N N 41 120.990 120.990 119.749 1.241 25109
1900 1 4 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.048 -0.006 25109
1901 1 4 . 1 1 41 41 ARG C C 41 179.795 179.795 178.684 1.111 25109
1902 1 4 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.326 0.119 25109
1903 1 4 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.142 0.116 25109
1904 1 4 . 1 1 41 41 ARG H H 41 8.130 8.130 8.115 0.015 25109
1905 1 4 . 1 1 42 42 LEU N N 42 121.219 121.219 119.567 1.652 25109
1906 1 4 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.043 -0.108 25109
1907 1 4 . 1 1 42 42 LEU C C 42 178.850 178.850 178.670 0.180 25109
1908 1 4 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.855 0.412 25109
1909 1 4 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.624 0.409 25109
1910 1 4 . 1 1 42 42 LEU H H 42 8.179 8.179 7.552 0.627 25109
1911 1 4 . 1 1 43 43 ARG N N 43 119.310 119.310 119.586 -0.276 25109
1912 1 4 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.829 -0.105 25109
1913 1 4 . 1 1 43 43 ARG C C 43 179.099 179.099 178.372 0.727 25109
1914 1 4 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.749 1.065 25109
1915 1 4 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.174 0.005 25109
1916 1 4 . 1 1 43 43 ARG H H 43 8.296 8.296 8.249 0.047 25109
1917 1 4 . 1 1 44 44 ALA N N 44 121.305 121.305 121.137 0.168 25109
1918 1 4 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.073 0.030 25109
1919 1 4 . 1 1 44 44 ALA C C 44 180.924 180.924 179.734 1.190 25109
1920 1 4 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.315 -0.090 25109
1921 1 4 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.086 0.010 25109
1922 1 4 . 1 1 44 44 ALA H H 44 7.774 7.774 8.433 -0.659 25109
1923 1 4 . 1 1 45 45 THR N N 45 115.017 115.017 115.457 -0.440 25109
1924 1 4 . 1 1 45 45 THR HA H 45 3.879 3.879 3.940 -0.061 25109
1925 1 4 . 1 1 45 45 THR CA C 45 66.327 66.327 66.742 -0.415 25109
1926 1 4 . 1 1 45 45 THR CB C 45 68.809 68.809 68.255 0.554 25109
1927 1 4 . 1 1 45 45 THR H H 45 8.167 8.167 8.249 -0.082 25109
1928 1 4 . 1 1 46 46 CYS N N 46 123.609 123.609 120.257 3.352 25109
1929 1 4 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.429 -0.410 25109
1930 1 4 . 1 1 46 46 CYS C C 46 178.077 178.077 176.392 1.685 25109
1931 1 4 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.663 0.282 25109
1932 1 4 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.807 -1.668 25109
1933 1 4 . 1 1 46 46 CYS H H 46 8.084 8.084 8.096 -0.012 25109
1934 1 4 . 1 1 47 47 THR N N 47 115.520 115.520 114.325 1.195 25109
1935 1 4 . 1 1 47 47 THR HA H 47 3.915 3.915 4.179 -0.264 25109
1936 1 4 . 1 1 47 47 THR CA C 47 66.063 66.063 64.758 1.305 25109
1937 1 4 . 1 1 47 47 THR CB C 47 69.245 69.245 68.917 0.328 25109
1938 1 4 . 1 1 47 47 THR H H 47 7.735 7.735 7.632 0.103 25109
1939 1 4 . 1 1 48 48 LEU N N 48 120.099 120.099 121.454 -1.355 25109
1940 1 4 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.317 -0.091 25109
1941 1 4 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.212 0.351 25109
1942 1 4 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.467 1.158 25109
1943 1 4 . 1 1 48 48 LEU H H 48 7.464 7.464 8.204 -0.740 25109
1944 1 4 . 1 1 49 49 SER N N 49 111.979 111.979 112.380 -0.401 25109
1945 1 4 . 1 1 49 49 SER HA H 49 4.661 4.661 4.523 0.138 25109
1946 1 4 . 1 1 49 49 SER C C 49 175.581 175.581 174.780 0.801 25109
1947 1 4 . 1 1 49 49 SER CA C 49 59.590 59.590 59.194 0.396 25109
1948 1 4 . 1 1 49 49 SER CB C 49 65.335 65.335 65.259 0.076 25109
1949 1 4 . 1 1 49 49 SER H H 49 8.781 8.781 8.078 0.703 25109
1950 1 4 . 1 1 50 50 GLY N N 50 110.194 110.194 108.554 1.640 25109
1951 1 4 . 1 1 50 50 GLY C C 50 175.123 175.123 172.923 2.200 25109
1952 1 4 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.123 -0.221 25109
1953 1 4 . 1 1 50 50 GLY H H 50 7.955 7.955 7.759 0.196 25109
1954 1 4 . 1 1 51 51 ASN N N 51 121.050 121.050 119.707 1.343 25109
1955 1 4 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.496 -0.246 25109
1956 1 4 . 1 1 51 51 ASN C C 51 176.403 176.403 176.964 -0.561 25109
1957 1 4 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.730 3.573 25109
1958 1 4 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.643 2.956 25109
1959 1 4 . 1 1 51 51 ASN H H 51 8.898 8.898 8.824 0.074 25109
1960 1 4 . 1 1 52 52 ARG N N 52 119.825 119.825 120.462 -0.637 25109
1961 1 4 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.053 -0.015 25109
1962 1 4 . 1 1 52 52 ARG C C 52 178.850 178.850 177.262 1.588 25109
1963 1 4 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.834 1.230 25109
1964 1 4 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.763 0.260 25109
1965 1 4 . 1 1 52 52 ARG H H 52 8.696 8.696 8.674 0.022 25109
1966 1 4 . 1 1 53 53 ASP N N 53 116.032 116.032 117.942 -1.910 25109
1967 1 4 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.775 -0.229 25109
1968 1 4 . 1 1 53 53 ASP C C 53 178.996 178.996 178.572 0.424 25109
1969 1 4 . 1 1 53 53 ASP CA C 53 56.079 56.079 58.169 -2.090 25109
1970 1 4 . 1 1 53 53 ASP CB C 53 38.371 38.371 39.835 -1.464 25109
1971 1 4 . 1 1 53 53 ASP H H 53 9.036 9.036 8.874 0.162 25109
1972 1 4 . 1 1 54 54 THR N N 54 115.848 115.848 117.418 -1.570 25109
1973 1 4 . 1 1 54 54 THR HA H 54 3.746 3.746 4.397 -0.651 25109
1974 1 4 . 1 1 54 54 THR CA C 54 67.885 67.885 66.615 1.270 25109
1975 1 4 . 1 1 54 54 THR CB C 54 66.953 66.953 68.988 -2.035 25109
1976 1 4 . 1 1 54 54 THR H H 54 7.782 7.782 7.374 0.408 25109
1977 1 4 . 1 1 55 55 LEU N N 55 125.987 125.987 122.864 3.123 25109
1978 1 4 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.196 -0.642 25109
1979 1 4 . 1 1 55 55 LEU C C 55 177.901 177.901 178.911 -1.010 25109
1980 1 4 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.880 -0.427 25109
1981 1 4 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.543 0.320 25109
1982 1 4 . 1 1 55 55 LEU H H 55 8.740 8.740 8.082 0.658 25109
1983 1 4 . 1 1 56 56 TRP N N 56 116.672 116.672 118.602 -1.930 25109
1984 1 4 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.304 -0.224 25109
1985 1 4 . 1 1 56 56 TRP C C 56 179.588 179.588 178.859 0.729 25109
1986 1 4 . 1 1 56 56 TRP CA C 56 61.481 61.481 62.542 -1.061 25109
1987 1 4 . 1 1 56 56 TRP CB C 56 29.192 29.192 28.995 0.197 25109
1988 1 4 . 1 1 56 56 TRP H H 56 7.642 7.642 7.894 -0.252 25109
1989 1 4 . 1 1 57 57 HIS N N 57 115.754 115.754 117.058 -1.304 25109
1990 1 4 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.352 -0.076 25109
1991 1 4 . 1 1 57 57 HIS C C 57 177.514 177.514 177.751 -0.237 25109
1992 1 4 . 1 1 57 57 HIS CA C 57 58.952 58.952 60.159 -1.207 25109
1993 1 4 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.706 -1.704 25109
1994 1 4 . 1 1 57 57 HIS H H 57 7.407 7.407 7.745 -0.338 25109
1995 1 4 . 1 1 58 58 LEU N N 58 123.934 123.934 123.171 0.763 25109
1996 1 4 . 1 1 58 58 LEU HA H 58 3.787 3.787 4.082 -0.295 25109
1997 1 4 . 1 1 58 58 LEU C C 58 178.115 178.115 178.180 -0.065 25109
1998 1 4 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.234 0.675 25109
1999 1 4 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.832 -1.017 25109
2000 1 4 . 1 1 58 58 LEU H H 58 8.996 8.996 8.721 0.275 25109
2001 1 4 . 1 1 59 59 PHE N N 59 117.721 117.721 116.683 1.038 25109
2002 1 4 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.851 0.084 25109
2003 1 4 . 1 1 59 59 PHE C C 59 176.987 176.987 177.972 -0.985 25109
2004 1 4 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.275 -2.162 25109
2005 1 4 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.050 -1.090 25109
2006 1 4 . 1 1 59 59 PHE H H 59 8.201 8.201 8.723 -0.522 25109
2007 1 4 . 1 1 60 60 ASN N N 60 115.695 115.695 117.842 -2.147 25109
2008 1 4 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.348 -0.429 25109
2009 1 4 . 1 1 60 60 ASN C C 60 176.670 176.670 176.652 0.018 25109
2010 1 4 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.375 0.381 25109
2011 1 4 . 1 1 60 60 ASN CB C 60 39.318 39.318 39.045 0.273 25109
2012 1 4 . 1 1 60 60 ASN H H 60 7.666 7.666 7.826 -0.160 25109
2013 1 4 . 1 1 61 61 THR N N 61 115.110 115.110 114.223 0.887 25109
2014 1 4 . 1 1 61 61 THR HA H 61 3.733 3.733 4.138 -0.405 25109
2015 1 4 . 1 1 61 61 THR CA C 61 66.319 66.319 65.169 1.150 25109
2016 1 4 . 1 1 61 61 THR CB C 61 69.174 69.174 69.006 0.168 25109
2017 1 4 . 1 1 61 61 THR H H 61 7.782 7.782 8.048 -0.266 25109
2018 1 4 . 1 1 62 62 LEU N N 62 121.559 121.559 123.353 -1.794 25109
2019 1 4 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.850 -0.361 25109
2020 1 4 . 1 1 62 62 LEU C C 62 176.600 176.600 178.362 -1.762 25109
2021 1 4 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.370 -0.405 25109
2022 1 4 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.642 1.692 25109
2023 1 4 . 1 1 62 62 LEU H H 62 8.362 8.362 8.260 0.102 25109
2024 1 4 . 1 1 63 63 GLN N N 63 109.150 109.150 114.702 -5.552 25109
2025 1 4 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.626 -1.549 25109
2026 1 4 . 1 1 63 63 GLN C C 63 175.194 175.194 176.704 -1.510 25109
2027 1 4 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.227 -0.962 25109
2028 1 4 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.659 -1.965 25109
2029 1 4 . 1 1 63 63 GLN H H 63 6.458 6.458 7.281 -0.823 25109
2030 1 4 . 1 1 64 64 ARG N N 64 116.029 116.029 117.483 -1.454 25109
2031 1 4 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.326 -0.228 25109
2032 1 4 . 1 1 64 64 ARG C C 64 176.459 176.459 176.032 0.427 25109
2033 1 4 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.233 0.911 25109
2034 1 4 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.578 0.006 25109
2035 1 4 . 1 1 64 64 ARG H H 64 6.596 6.596 7.300 -0.704 25109
2036 1 4 . 1 1 65 65 ARG N N 65 120.422 120.422 120.686 -0.264 25109
2037 1 4 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.852 -0.018 25109
2038 1 4 . 1 1 65 65 ARG C C 65 173.436 173.436 174.122 -0.686 25109
2039 1 4 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.801 -0.256 25109
2040 1 4 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.978 -0.982 25109
2041 1 4 . 1 1 65 65 ARG H H 65 7.932 7.932 7.739 0.193 25109
2042 1 4 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.427 0.147 25109
2043 1 4 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.443 0.616 25109
2044 1 4 . 1 1 67 67 GLY N N 67 111.953 111.953 114.009 -2.056 25109
2045 1 4 . 1 1 67 67 GLY C C 67 177.057 177.057 174.911 2.146 25109
2046 1 4 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.810 1.497 25109
2047 1 4 . 1 1 67 67 GLY H H 67 9.198 9.198 8.099 1.099 25109
2048 1 4 . 1 1 68 68 TRP N N 68 117.467 117.467 118.246 -0.779 25109
2049 1 4 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.948 -0.606 25109
2050 1 4 . 1 1 68 68 TRP C C 68 177.690 177.690 175.706 1.984 25109
2051 1 4 . 1 1 68 68 TRP CA C 68 60.116 60.116 57.439 2.677 25109
2052 1 4 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.302 -0.112 25109
2053 1 4 . 1 1 68 68 TRP H H 68 7.647 7.647 7.773 -0.126 25109
2054 1 4 . 1 1 69 69 VAL N N 69 121.482 121.482 120.103 1.379 25109
2055 1 4 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.126 -0.489 25109
2056 1 4 . 1 1 69 69 VAL C C 69 177.993 177.993 177.496 0.497 25109
2057 1 4 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.828 1.638 25109
2058 1 4 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.188 -0.162 25109
2059 1 4 . 1 1 69 69 VAL H H 69 6.666 6.666 7.413 -0.747 25109
2060 1 4 . 1 1 70 70 GLU N N 70 116.350 116.350 118.834 -2.484 25109
2061 1 4 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.743 0.082 25109
2062 1 4 . 1 1 70 70 GLU C C 70 180.362 180.362 178.916 1.446 25109
2063 1 4 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.794 -0.573 25109
2064 1 4 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.573 -1.268 25109
2065 1 4 . 1 1 70 70 GLU H H 70 7.410 7.410 8.613 -1.203 25109
2066 1 4 . 1 1 71 71 TYR N N 71 116.750 116.750 117.678 -0.928 25109
2067 1 4 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.370 0.080 25109
2068 1 4 . 1 1 71 71 TYR C C 71 178.411 178.411 177.977 0.434 25109
2069 1 4 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.354 1.248 25109
2070 1 4 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.637 -0.282 25109
2071 1 4 . 1 1 71 71 TYR H H 71 7.159 7.159 7.445 -0.286 25109
2072 1 4 . 1 1 72 72 PHE N N 72 121.610 121.610 121.047 0.563 25109
2073 1 4 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.219 0.283 25109
2074 1 4 . 1 1 72 72 PHE CA C 72 60.820 60.820 60.887 -0.067 25109
2075 1 4 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.243 0.806 25109
2076 1 4 . 1 1 72 72 PHE H H 72 9.007 9.007 8.011 0.996 25109
2077 1 4 . 1 1 73 73 ILE N N 73 119.200 119.200 118.993 0.207 25109
2078 1 4 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.538 -0.358 25109
2079 1 4 . 1 1 73 73 ILE C C 73 177.620 177.620 177.595 0.025 25109
2080 1 4 . 1 1 73 73 ILE CA C 73 67.197 67.197 63.486 3.711 25109
2081 1 4 . 1 1 73 73 ILE CB C 73 39.023 39.023 36.213 2.810 25109
2082 1 4 . 1 1 73 73 ILE H H 73 8.644 8.644 8.463 0.181 25109
2083 1 4 . 1 1 74 74 ALA N N 74 119.624 119.624 120.121 -0.497 25109
2084 1 4 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.130 -0.176 25109
2085 1 4 . 1 1 74 74 ALA C C 74 181.030 181.030 178.407 2.623 25109
2086 1 4 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.232 1.179 25109
2087 1 4 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.072 0.064 25109
2088 1 4 . 1 1 74 74 ALA H H 74 7.476 7.476 7.653 -0.177 25109
2089 1 4 . 1 1 75 75 ALA N N 75 123.625 123.625 122.130 1.495 25109
2090 1 4 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.938 -0.100 25109
2091 1 4 . 1 1 75 75 ALA C C 75 179.272 179.272 179.293 -0.021 25109
2092 1 4 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.483 0.620 25109
2093 1 4 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.463 1.130 25109
2094 1 4 . 1 1 75 75 ALA H H 75 8.524 8.524 7.191 1.333 25109
2095 1 4 . 1 1 76 76 LEU N N 76 118.114 118.114 120.205 -2.091 25109
2096 1 4 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.928 -0.256 25109
2097 1 4 . 1 1 76 76 LEU C C 76 180.001 180.001 179.093 0.908 25109
2098 1 4 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.288 0.968 25109
2099 1 4 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.202 1.417 25109
2100 1 4 . 1 1 76 76 LEU H H 76 8.153 8.153 7.411 0.742 25109
2101 1 4 . 1 1 77 77 ARG N N 77 117.830 117.830 118.545 -0.715 25109
2102 1 4 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.898 -0.451 25109
2103 1 4 . 1 1 77 77 ARG C C 77 180.889 180.889 178.788 2.101 25109
2104 1 4 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.417 1.649 25109
2105 1 4 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.098 -0.901 25109
2106 1 4 . 1 1 77 77 ARG H H 77 7.945 7.945 8.120 -0.175 25109
2107 1 4 . 1 1 78 78 GLY N N 78 110.202 110.202 106.377 3.825 25109
2108 1 4 . 1 1 78 78 GLY C C 78 174.807 174.807 175.895 -1.088 25109
2109 1 4 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.721 -0.161 25109
2110 1 4 . 1 1 78 78 GLY H H 78 8.269 8.269 7.534 0.735 25109
2111 1 4 . 1 1 79 79 CYS N N 79 115.567 115.567 118.612 -3.045 25109
2112 1 4 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.410 -0.021 25109
2113 1 4 . 1 1 79 79 CYS C C 79 173.025 173.025 175.621 -2.596 25109
2114 1 4 . 1 1 79 79 CYS CA C 79 59.957 59.957 59.418 0.539 25109
2115 1 4 . 1 1 79 79 CYS CB C 79 27.805 27.805 29.173 -1.368 25109
2116 1 4 . 1 1 79 79 CYS H H 79 7.132 7.132 7.719 -0.587 25109
2117 1 4 . 1 1 80 80 GLU N N 80 111.759 111.759 116.996 -5.237 25109
2118 1 4 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.398 -0.665 25109
2119 1 4 . 1 1 80 80 GLU C C 80 175.827 175.827 175.416 0.411 25109
2120 1 4 . 1 1 80 80 GLU CA C 80 57.467 57.467 56.139 1.328 25109
2121 1 4 . 1 1 80 80 GLU CB C 80 24.717 24.717 30.531 -5.814 25109
2122 1 4 . 1 1 80 80 GLU H H 80 7.772 7.772 7.988 -0.216 25109
2123 1 4 . 1 1 81 81 LEU N N 81 124.692 124.692 123.454 1.238 25109
2124 1 4 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.877 -0.186 25109
2125 1 4 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.860 -0.905 25109
2126 1 4 . 1 1 81 81 LEU CB C 81 39.391 39.391 41.286 -1.895 25109
2127 1 4 . 1 1 81 81 LEU H H 81 8.167 8.167 8.682 -0.515 25109
2128 1 4 . 1 1 82 82 VAL N N 82 118.320 118.320 121.438 -3.118 25109
2129 1 4 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.596 -0.419 25109
2130 1 4 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.760 -0.050 25109
2131 1 4 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.873 0.075 25109
2132 1 4 . 1 1 82 82 VAL H H 82 7.141 7.141 7.660 -0.519 25109
2133 1 4 . 1 1 83 83 ASP N N 83 118.733 118.733 120.215 -1.482 25109
2134 1 4 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.361 -0.029 25109
2135 1 4 . 1 1 83 83 ASP C C 83 178.674 178.674 178.325 0.349 25109
2136 1 4 . 1 1 83 83 ASP CA C 83 56.443 56.443 56.904 -0.461 25109
2137 1 4 . 1 1 83 83 ASP CB C 83 36.829 36.829 39.797 -2.967 25109
2138 1 4 . 1 1 83 83 ASP H H 83 8.385 8.385 8.621 -0.236 25109
2139 1 4 . 1 1 84 84 LEU N N 84 121.026 121.026 120.456 0.570 25109
2140 1 4 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.477 -0.498 25109
2141 1 4 . 1 1 84 84 LEU C C 84 178.796 178.796 179.305 -0.509 25109
2142 1 4 . 1 1 84 84 LEU CA C 84 57.522 57.522 56.863 0.659 25109
2143 1 4 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.768 0.727 25109
2144 1 4 . 1 1 84 84 LEU H H 84 7.770 7.770 7.345 0.425 25109
2145 1 4 . 1 1 85 85 ALA N N 85 121.525 121.525 122.319 -0.794 25109
2146 1 4 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.885 -0.224 25109
2147 1 4 . 1 1 85 85 ALA C C 85 179.322 179.322 179.038 0.284 25109
2148 1 4 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.293 0.548 25109
2149 1 4 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.064 0.863 25109
2150 1 4 . 1 1 85 85 ALA H H 85 8.126 8.126 8.078 0.048 25109
2151 1 4 . 1 1 86 86 ASP N N 86 115.349 115.349 118.354 -3.005 25109
2152 1 4 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.319 -0.046 25109
2153 1 4 . 1 1 86 86 ASP C C 86 178.463 178.463 178.498 -0.035 25109
2154 1 4 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.690 -1.979 25109
2155 1 4 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.083 -3.921 25109
2156 1 4 . 1 1 86 86 ASP H H 86 8.410 8.410 8.370 0.040 25109
2157 1 4 . 1 1 87 87 GLU N N 87 122.529 122.529 119.210 3.319 25109
2158 1 4 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.243 -0.207 25109
2159 1 4 . 1 1 87 87 GLU C C 87 178.508 178.508 178.992 -0.484 25109
2160 1 4 . 1 1 87 87 GLU CA C 87 59.354 59.354 58.871 0.483 25109
2161 1 4 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.745 -1.472 25109
2162 1 4 . 1 1 87 87 GLU H H 87 8.012 8.012 7.903 0.109 25109
2163 1 4 . 1 1 88 88 VAL N N 88 119.148 119.148 121.313 -2.165 25109
2164 1 4 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.840 -0.510 25109
2165 1 4 . 1 1 88 88 VAL C C 88 177.240 177.240 177.896 -0.656 25109
2166 1 4 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.266 0.983 25109
2167 1 4 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.406 0.123 25109
2168 1 4 . 1 1 88 88 VAL H H 88 8.291 8.291 7.797 0.494 25109
2169 1 4 . 1 1 89 89 ALA N N 89 120.709 120.709 121.868 -1.159 25109
2170 1 4 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.116 -0.201 25109
2171 1 4 . 1 1 89 89 ALA C C 89 180.186 180.186 179.780 0.406 25109
2172 1 4 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.420 0.639 25109
2173 1 4 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.232 0.003 25109
2174 1 4 . 1 1 89 89 ALA H H 89 8.548 8.548 8.505 0.043 25109
2175 1 4 . 1 1 90 90 SER N N 90 113.035 113.035 113.668 -0.633 25109
2176 1 4 . 1 1 90 90 SER HA H 90 4.047 4.047 4.215 -0.168 25109
2177 1 4 . 1 1 90 90 SER C C 90 177.564 177.564 176.638 0.926 25109
2178 1 4 . 1 1 90 90 SER CA C 90 61.771 61.771 61.340 0.431 25109
2179 1 4 . 1 1 90 90 SER CB C 90 62.907 62.907 63.148 -0.241 25109
2180 1 4 . 1 1 90 90 SER H H 90 7.969 7.969 8.110 -0.141 25109
2181 1 4 . 1 1 91 91 VAL N N 91 123.417 123.417 122.919 0.498 25109
2182 1 4 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.611 -0.264 25109
2183 1 4 . 1 1 91 91 VAL C C 91 178.428 178.428 178.304 0.124 25109
2184 1 4 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.748 0.381 25109
2185 1 4 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.674 0.097 25109
2186 1 4 . 1 1 91 91 VAL H H 91 7.713 7.713 7.143 0.570 25109
2187 1 4 . 1 1 92 92 TYR N N 92 121.458 121.458 120.401 1.057 25109
2188 1 4 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.380 -0.189 25109
2189 1 4 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.743 1.250 25109
2190 1 4 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.497 0.488 25109
2191 1 4 . 1 1 92 92 TYR H H 92 8.395 8.395 8.389 0.006 25109
2192 1 4 . 1 1 93 93 GLN N N 93 115.549 115.549 117.644 -2.095 25109
2193 1 4 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.047 -0.336 25109
2194 1 4 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.885 0.209 25109
2195 1 4 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.307 -0.009 25109
2196 1 4 . 1 1 93 93 GLN H H 93 8.167 8.167 7.636 0.531 25109
2197 1 4 . 1 1 94 94 SER N N 94 115.923 115.923 114.015 1.908 25109
2198 1 4 . 1 1 94 94 SER HA H 94 4.096 4.096 4.106 -0.010 25109
2199 1 4 . 1 1 94 94 SER CA C 94 60.971 60.971 59.661 1.310 25109
2200 1 4 . 1 1 94 94 SER CB C 94 62.635 62.635 63.574 -0.939 25109
2201 1 4 . 1 1 94 94 SER H H 94 7.642 7.642 7.468 0.174 25109
2202 1 4 . 1 1 95 95 TYR N N 95 119.565 119.565 120.005 -0.440 25109
2203 1 4 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.586 0.173 25109
2204 1 4 . 1 1 95 95 TYR C C 95 175.334 175.334 173.741 1.593 25109
2205 1 4 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.183 1.515 25109
2206 1 4 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.942 1.377 25109
2207 1 4 . 1 1 95 95 TYR H H 95 7.069 7.069 6.960 0.109 25109
2208 1 4 . 1 1 96 96 GLN N N 96 119.872 119.872 118.998 0.874 25109
2209 1 4 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.016 0.349 25109
2210 1 4 . 1 1 96 96 GLN C C 96 173.612 173.612 173.994 -0.382 25109
2211 1 4 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.872 -1.536 25109
2212 1 4 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.799 0.695 25109
2213 1 4 . 1 1 96 96 GLN H H 96 7.409 7.409 8.291 -0.882 25109
2214 1 4 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.099 0.219 25109
2215 1 4 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.764 -0.750 25109
2216 1 4 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.025 0.073 25109
2217 1 4 . 1 1 98 98 ARG N N 98 121.759 121.759 117.399 4.360 25109
2218 1 4 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.594 -0.252 25109
2219 1 4 . 1 1 98 98 ARG C C 98 176.848 176.848 174.923 1.925 25109
2220 1 4 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.350 1.871 25109
2221 1 4 . 1 1 98 98 ARG CB C 98 31.087 31.087 31.680 -0.593 25109
2222 1 4 . 1 1 98 98 ARG H H 98 8.423 8.423 7.316 1.107 25109
2223 1 4 . 1 1 99 99 THR N N 99 115.292 115.292 118.216 -2.924 25109
2224 1 4 . 1 1 99 99 THR HA H 99 4.323 4.323 4.507 -0.184 25109
2225 1 4 . 1 1 99 99 THR C C 99 174.350 174.350 175.038 -0.688 25109
2226 1 4 . 1 1 99 99 THR CA C 99 61.906 61.906 62.462 -0.556 25109
2227 1 4 . 1 1 99 99 THR CB C 99 70.180 70.180 68.879 1.302 25109
2228 1 4 . 1 1 99 99 THR H H 99 8.179 8.179 8.476 -0.297 25109
2229 1 5 . 1 1 0 0 SER N N 0 115.693 115.693 114.581 1.112 25109
2230 1 5 . 1 1 0 0 SER HA H 0 4.531 4.531 4.640 -0.109 25109
2231 1 5 . 1 1 0 0 SER C C 0 174.557 174.557 173.174 1.383 25109
2232 1 5 . 1 1 0 0 SER CA C 0 58.478 58.478 58.038 0.439 25109
2233 1 5 . 1 1 0 0 SER CB C 0 64.380 64.380 64.674 -0.294 25109
2234 1 5 . 1 1 0 0 SER H H 0 8.631 8.631 8.392 0.239 25109
2235 1 5 . 1 1 1 1 MET N N 1 123.111 123.111 120.566 2.545 25109
2236 1 5 . 1 1 1 1 MET HA H 1 4.728 4.728 4.493 0.235 25109
2237 1 5 . 1 1 1 1 MET C C 1 174.846 174.846 173.830 1.016 25109
2238 1 5 . 1 1 1 1 MET CA C 1 55.655 55.655 55.182 0.473 25109
2239 1 5 . 1 1 1 1 MET CB C 1 32.035 32.035 32.234 -0.199 25109
2240 1 5 . 1 1 1 1 MET H H 1 8.641 8.641 8.304 0.337 25109
2241 1 5 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.973 -0.496 25109
2242 1 5 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.855 0.145 25109
2243 1 5 . 1 1 3 3 PHE N N 3 121.126 121.126 126.781 -5.655 25109
2244 1 5 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.590 -0.224 25109
2245 1 5 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.466 1.396 25109
2246 1 5 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.692 -1.324 25109
2247 1 5 . 1 1 3 3 PHE H H 3 8.177 8.177 9.644 -1.467 25109
2248 1 5 . 1 1 4 4 ALA N N 4 121.170 121.170 120.959 0.211 25109
2249 1 5 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.236 -0.401 25109
2250 1 5 . 1 1 4 4 ALA C C 4 181.522 181.522 178.702 2.820 25109
2251 1 5 . 1 1 4 4 ALA CA C 4 55.454 55.454 54.925 0.529 25109
2252 1 5 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.478 0.958 25109
2253 1 5 . 1 1 4 4 ALA H H 4 8.444 8.444 9.101 -0.657 25109
2254 1 5 . 1 1 5 5 GLU N N 5 118.932 118.932 119.417 -0.485 25109
2255 1 5 . 1 1 5 5 GLU HA H 5 3.855 3.855 4.083 -0.228 25109
2256 1 5 . 1 1 5 5 GLU C C 5 177.971 177.971 178.191 -0.220 25109
2257 1 5 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.858 0.773 25109
2258 1 5 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.950 -0.189 25109
2259 1 5 . 1 1 5 5 GLU H H 5 8.454 8.454 8.698 -0.244 25109
2260 1 5 . 1 1 6 6 ASP N N 6 120.471 120.471 119.347 1.124 25109
2261 1 5 . 1 1 6 6 ASP C C 6 178.885 178.885 178.115 0.770 25109
2262 1 5 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.479 -0.407 25109
2263 1 5 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.708 -1.576 25109
2264 1 5 . 1 1 6 6 ASP H H 6 8.316 8.316 8.482 -0.166 25109
2265 1 5 . 1 1 7 7 LYS N N 7 118.335 118.335 119.352 -1.017 25109
2266 1 5 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.928 -0.238 25109
2267 1 5 . 1 1 7 7 LYS C C 7 180.080 180.080 179.373 0.707 25109
2268 1 5 . 1 1 7 7 LYS CA C 7 58.720 58.720 59.039 -0.319 25109
2269 1 5 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.583 0.211 25109
2270 1 5 . 1 1 7 7 LYS H H 7 8.249 8.249 7.633 0.616 25109
2271 1 5 . 1 1 8 8 THR N N 8 119.222 119.222 116.445 2.777 25109
2272 1 5 . 1 1 8 8 THR HA H 8 3.975 3.975 4.133 -0.158 25109
2273 1 5 . 1 1 8 8 THR CA C 8 68.453 68.453 67.054 1.399 25109
2274 1 5 . 1 1 8 8 THR CB C 8 67.387 67.387 68.755 -1.368 25109
2275 1 5 . 1 1 8 8 THR H H 8 7.897 7.897 8.435 -0.538 25109
2276 1 5 . 1 1 9 9 TYR N N 9 123.054 123.054 123.093 -0.039 25109
2277 1 5 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.247 0.006 25109
2278 1 5 . 1 1 9 9 TYR C C 9 177.441 177.441 177.138 0.303 25109
2279 1 5 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.197 -0.299 25109
2280 1 5 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.578 -0.729 25109
2281 1 5 . 1 1 9 9 TYR H H 9 8.605 8.605 8.376 0.229 25109
2282 1 5 . 1 1 10 10 LYS N N 10 118.366 118.366 117.990 0.376 25109
2283 1 5 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.833 -0.239 25109
2284 1 5 . 1 1 10 10 LYS C C 10 178.885 178.885 179.052 -0.167 25109
2285 1 5 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.565 1.480 25109
2286 1 5 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.689 0.356 25109
2287 1 5 . 1 1 10 10 LYS H H 10 8.066 8.066 8.429 -0.363 25109
2288 1 5 . 1 1 11 11 TYR N N 11 120.539 120.539 121.436 -0.897 25109
2289 1 5 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.180 -0.190 25109
2290 1 5 . 1 1 11 11 TYR C C 11 178.233 178.233 177.982 0.251 25109
2291 1 5 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.804 0.724 25109
2292 1 5 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.816 -0.454 25109
2293 1 5 . 1 1 11 11 TYR H H 11 7.875 7.875 7.701 0.174 25109
2294 1 5 . 1 1 12 12 ILE N N 12 121.893 121.893 118.003 3.890 25109
2295 1 5 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.798 -0.702 25109
2296 1 5 . 1 1 12 12 ILE C C 12 177.015 177.015 177.397 -0.382 25109
2297 1 5 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.431 2.332 25109
2298 1 5 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.525 1.027 25109
2299 1 5 . 1 1 12 12 ILE H H 12 8.154 8.154 8.398 -0.244 25109
2300 1 5 . 1 1 13 13 CYS N N 13 113.894 113.894 117.338 -3.444 25109
2301 1 5 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.941 -0.054 25109
2302 1 5 . 1 1 13 13 CYS C C 13 178.288 178.288 176.164 2.124 25109
2303 1 5 . 1 1 13 13 CYS CA C 13 64.337 64.337 60.826 3.511 25109
2304 1 5 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.633 0.372 25109
2305 1 5 . 1 1 13 13 CYS H H 13 7.551 7.551 8.026 -0.475 25109
2306 1 5 . 1 1 14 14 ARG N N 14 119.228 119.228 118.025 1.203 25109
2307 1 5 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.235 -0.165 25109
2308 1 5 . 1 1 14 14 ARG C C 14 177.127 177.127 177.248 -0.121 25109
2309 1 5 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.672 -0.178 25109
2310 1 5 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.568 -0.146 25109
2311 1 5 . 1 1 14 14 ARG H H 14 7.991 7.991 7.527 0.464 25109
2312 1 5 . 1 1 15 15 ASN N N 15 117.367 117.367 117.056 0.311 25109
2313 1 5 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.808 0.161 25109
2314 1 5 . 1 1 15 15 ASN CA C 15 52.763 52.763 53.046 -0.283 25109
2315 1 5 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.017 0.568 25109
2316 1 5 . 1 1 15 15 ASN H H 15 7.643 7.643 7.676 -0.033 25109
2317 1 5 . 1 1 16 16 PHE N N 16 122.356 122.356 122.302 0.054 25109
2318 1 5 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.165 0.051 25109
2319 1 5 . 1 1 16 16 PHE C C 16 178.084 178.084 176.563 1.521 25109
2320 1 5 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.052 2.125 25109
2321 1 5 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.073 1.516 25109
2322 1 5 . 1 1 16 16 PHE H H 16 6.992 6.992 7.636 -0.644 25109
2323 1 5 . 1 1 17 17 SER N N 17 112.937 112.937 113.881 -0.944 25109
2324 1 5 . 1 1 17 17 SER HA H 17 4.199 4.199 4.155 0.044 25109
2325 1 5 . 1 1 17 17 SER C C 17 176.726 176.726 175.403 1.323 25109
2326 1 5 . 1 1 17 17 SER CA C 17 62.052 62.052 60.241 1.811 25109
2327 1 5 . 1 1 17 17 SER CB C 17 62.552 62.552 62.970 -0.418 25109
2328 1 5 . 1 1 17 17 SER H H 17 8.840 8.840 8.582 0.258 25109
2329 1 5 . 1 1 18 18 ASN N N 18 118.809 118.809 120.280 -1.471 25109
2330 1 5 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.613 -0.255 25109
2331 1 5 . 1 1 18 18 ASN C C 18 175.967 175.967 176.093 -0.126 25109
2332 1 5 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.287 -0.377 25109
2333 1 5 . 1 1 18 18 ASN CB C 18 37.828 37.828 39.084 -1.256 25109
2334 1 5 . 1 1 18 18 ASN H H 18 8.130 8.130 8.264 -0.134 25109
2335 1 5 . 1 1 19 19 PHE N N 19 115.750 115.750 116.394 -0.644 25109
2336 1 5 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.625 -0.340 25109
2337 1 5 . 1 1 19 19 PHE C C 19 175.370 175.370 175.666 -0.296 25109
2338 1 5 . 1 1 19 19 PHE CA C 19 58.862 58.862 57.901 0.961 25109
2339 1 5 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.927 0.951 25109
2340 1 5 . 1 1 19 19 PHE H H 19 8.062 8.062 7.402 0.660 25109
2341 1 5 . 1 1 20 20 CYS N N 20 113.958 113.958 118.316 -4.358 25109
2342 1 5 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.045 -0.102 25109
2343 1 5 . 1 1 20 20 CYS C C 20 173.823 173.823 174.313 -0.490 25109
2344 1 5 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.703 3.085 25109
2345 1 5 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.538 -0.155 25109
2346 1 5 . 1 1 20 20 CYS H H 20 6.850 6.850 7.522 -0.672 25109
2347 1 5 . 1 1 21 21 ASN N N 21 116.691 116.691 119.779 -3.088 25109
2348 1 5 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.818 -0.074 25109
2349 1 5 . 1 1 21 21 ASN C C 21 175.299 175.299 173.442 1.857 25109
2350 1 5 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.977 0.313 25109
2351 1 5 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.205 -0.892 25109
2352 1 5 . 1 1 21 21 ASN H H 21 8.251 8.251 7.747 0.504 25109
2353 1 5 . 1 1 22 22 VAL N N 22 122.431 122.431 120.071 2.360 25109
2354 1 5 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.233 -0.683 25109
2355 1 5 . 1 1 22 22 VAL C C 22 174.034 174.034 173.933 0.101 25109
2356 1 5 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.781 3.156 25109
2357 1 5 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.067 -3.544 25109
2358 1 5 . 1 1 22 22 VAL H H 22 7.573 7.573 7.972 -0.399 25109
2359 1 5 . 1 1 23 23 ASP N N 23 127.219 127.219 121.292 5.927 25109
2360 1 5 . 1 1 23 23 ASP CA C 23 52.186 52.186 54.140 -1.954 25109
2361 1 5 . 1 1 23 23 ASP CB C 23 38.793 38.793 42.030 -3.237 25109
2362 1 5 . 1 1 23 23 ASP H H 23 8.687 8.687 8.597 0.090 25109
2363 1 5 . 1 1 24 24 VAL N N 24 127.835 127.835 117.899 9.936 25109
2364 1 5 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.414 -1.121 25109
2365 1 5 . 1 1 24 24 VAL C C 24 176.867 176.867 177.283 -0.416 25109
2366 1 5 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.915 3.248 25109
2367 1 5 . 1 1 24 24 VAL CB C 24 32.015 32.015 34.307 -2.292 25109
2368 1 5 . 1 1 24 24 VAL H H 24 9.409 9.409 8.407 1.002 25109
2369 1 5 . 1 1 25 25 VAL N N 25 114.324 114.324 118.590 -4.266 25109
2370 1 5 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.013 -0.494 25109
2371 1 5 . 1 1 25 25 VAL C C 25 178.006 178.006 177.570 0.436 25109
2372 1 5 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.388 1.300 25109
2373 1 5 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.615 -0.083 25109
2374 1 5 . 1 1 25 25 VAL H H 25 8.038 8.038 8.073 -0.035 25109
2375 1 5 . 1 1 26 26 GLU N N 26 117.009 117.009 118.917 -1.908 25109
2376 1 5 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.303 -0.212 25109
2377 1 5 . 1 1 26 26 GLU C C 26 177.303 177.303 177.699 -0.396 25109
2378 1 5 . 1 1 26 26 GLU CA C 26 57.432 57.432 57.953 -0.521 25109
2379 1 5 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.783 -0.818 25109
2380 1 5 . 1 1 26 26 GLU H H 26 7.220 7.220 9.089 -1.869 25109
2381 1 5 . 1 1 27 27 ILE N N 27 114.080 114.080 118.688 -4.608 25109
2382 1 5 . 1 1 27 27 ILE HA H 27 4.361 4.361 4.002 0.359 25109
2383 1 5 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.289 -0.557 25109
2384 1 5 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.407 1.184 25109
2385 1 5 . 1 1 27 27 ILE H H 27 7.647 7.647 7.159 0.488 25109
2386 1 5 . 1 1 28 28 LEU N N 28 121.867 121.867 121.245 0.622 25109
2387 1 5 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.101 -0.164 25109
2388 1 5 . 1 1 28 28 LEU C C 28 175.756 175.756 176.675 -0.919 25109
2389 1 5 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.713 -0.746 25109
2390 1 5 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.783 0.730 25109
2391 1 5 . 1 1 28 28 LEU H H 28 7.434 7.434 8.258 -0.824 25109
2392 1 5 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.252 -0.042 25109
2393 1 5 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.319 -0.009 25109
2394 1 5 . 1 1 30 30 TYR N N 30 113.832 113.832 115.739 -1.907 25109
2395 1 5 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.463 0.039 25109
2396 1 5 . 1 1 30 30 TYR C C 30 174.386 174.386 175.299 -0.913 25109
2397 1 5 . 1 1 30 30 TYR CA C 30 57.694 57.694 60.025 -2.331 25109
2398 1 5 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.490 -0.392 25109
2399 1 5 . 1 1 30 30 TYR H H 30 7.628 7.628 7.613 0.015 25109
2400 1 5 . 1 1 31 31 LEU N N 31 118.331 118.331 119.513 -1.182 25109
2401 1 5 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.711 0.166 25109
2402 1 5 . 1 1 31 31 LEU C C 31 173.849 173.849 175.410 -1.561 25109
2403 1 5 . 1 1 31 31 LEU CA C 31 51.692 51.692 52.209 -0.517 25109
2404 1 5 . 1 1 31 31 LEU CB C 31 42.802 42.802 41.945 0.857 25109
2405 1 5 . 1 1 31 31 LEU H H 31 7.619 7.619 7.453 0.166 25109
2406 1 5 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.615 -0.260 25109
2407 1 5 . 1 1 32 32 PRO CB C 32 31.410 31.410 32.629 -1.219 25109
2408 1 5 . 1 1 33 33 CYS N N 33 110.978 110.978 113.001 -2.023 25109
2409 1 5 . 1 1 33 33 CYS HA H 33 4.341 4.341 3.996 0.345 25109
2410 1 5 . 1 1 33 33 CYS C C 33 174.139 174.139 173.606 0.533 25109
2411 1 5 . 1 1 33 33 CYS CA C 33 56.212 56.212 60.368 -4.156 25109
2412 1 5 . 1 1 33 33 CYS CB C 33 28.922 28.922 26.830 2.092 25109
2413 1 5 . 1 1 33 33 CYS H H 33 6.414 6.414 8.424 -2.010 25109
2414 1 5 . 1 1 34 34 LEU N N 34 123.111 123.111 122.093 1.018 25109
2415 1 5 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.356 0.250 25109
2416 1 5 . 1 1 34 34 LEU C C 34 176.646 176.646 176.587 0.059 25109
2417 1 5 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.986 -1.095 25109
2418 1 5 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.496 0.195 25109
2419 1 5 . 1 1 34 34 LEU H H 34 7.550 7.550 7.345 0.205 25109
2420 1 5 . 1 1 35 35 THR N N 35 113.831 113.831 115.511 -1.680 25109
2421 1 5 . 1 1 35 35 THR HA H 35 4.205 4.205 4.186 0.019 25109
2422 1 5 . 1 1 35 35 THR C C 35 175.324 175.324 175.592 -0.268 25109
2423 1 5 . 1 1 35 35 THR CA C 35 61.200 61.200 61.730 -0.529 25109
2424 1 5 . 1 1 35 35 THR CB C 35 71.318 71.318 69.938 1.380 25109
2425 1 5 . 1 1 35 35 THR H H 35 8.586 8.586 8.028 0.558 25109
2426 1 5 . 1 1 36 36 ALA N N 36 124.128 124.128 127.867 -3.739 25109
2427 1 5 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.006 -0.082 25109
2428 1 5 . 1 1 36 36 ALA C C 36 180.397 180.397 179.721 0.676 25109
2429 1 5 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.702 0.218 25109
2430 1 5 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.592 -0.789 25109
2431 1 5 . 1 1 36 36 ALA H H 36 8.836 8.836 8.841 -0.005 25109
2432 1 5 . 1 1 37 37 ARG N N 37 116.793 116.793 117.684 -0.891 25109
2433 1 5 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.103 -0.117 25109
2434 1 5 . 1 1 37 37 ARG C C 37 179.272 179.272 178.670 0.602 25109
2435 1 5 . 1 1 37 37 ARG CA C 37 59.232 59.232 58.620 0.612 25109
2436 1 5 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.113 0.793 25109
2437 1 5 . 1 1 37 37 ARG H H 37 8.060 8.060 8.624 -0.564 25109
2438 1 5 . 1 1 38 38 ASP N N 38 120.030 120.030 120.284 -0.254 25109
2439 1 5 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.415 -0.167 25109
2440 1 5 . 1 1 38 38 ASP C C 38 178.885 178.885 178.091 0.794 25109
2441 1 5 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.383 -0.196 25109
2442 1 5 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.865 0.068 25109
2443 1 5 . 1 1 38 38 ASP H H 38 7.782 7.782 7.492 0.290 25109
2444 1 5 . 1 1 39 39 GLN N N 39 118.223 118.223 118.922 -0.699 25109
2445 1 5 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.956 -0.291 25109
2446 1 5 . 1 1 39 39 GLN C C 39 178.041 178.041 178.243 -0.202 25109
2447 1 5 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.933 1.668 25109
2448 1 5 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.797 -1.000 25109
2449 1 5 . 1 1 39 39 GLN H H 39 8.476 8.476 8.074 0.402 25109
2450 1 5 . 1 1 40 40 ASP N N 40 117.908 117.908 120.077 -2.169 25109
2451 1 5 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.288 -0.035 25109
2452 1 5 . 1 1 40 40 ASP C C 40 178.639 178.639 178.199 0.440 25109
2453 1 5 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.676 -1.276 25109
2454 1 5 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.883 -2.855 25109
2455 1 5 . 1 1 40 40 ASP H H 40 8.386 8.386 8.483 -0.097 25109
2456 1 5 . 1 1 41 41 ARG N N 41 120.990 120.990 119.914 1.076 25109
2457 1 5 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.002 0.040 25109
2458 1 5 . 1 1 41 41 ARG C C 41 179.795 179.795 178.495 1.300 25109
2459 1 5 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.111 0.334 25109
2460 1 5 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.795 0.463 25109
2461 1 5 . 1 1 41 41 ARG H H 41 8.130 8.130 7.795 0.335 25109
2462 1 5 . 1 1 42 42 LEU N N 42 121.219 121.219 119.610 1.609 25109
2463 1 5 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.036 -0.101 25109
2464 1 5 . 1 1 42 42 LEU C C 42 178.850 178.850 178.942 -0.092 25109
2465 1 5 . 1 1 42 42 LEU CA C 42 58.267 58.267 58.064 0.203 25109
2466 1 5 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.470 0.563 25109
2467 1 5 . 1 1 42 42 LEU H H 42 8.179 8.179 7.902 0.277 25109
2468 1 5 . 1 1 43 43 ARG N N 43 119.310 119.310 119.574 -0.264 25109
2469 1 5 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.891 -0.167 25109
2470 1 5 . 1 1 43 43 ARG C C 43 179.099 179.099 178.460 0.639 25109
2471 1 5 . 1 1 43 43 ARG CA C 43 60.814 60.814 58.570 2.244 25109
2472 1 5 . 1 1 43 43 ARG CB C 43 30.179 30.179 29.541 0.638 25109
2473 1 5 . 1 1 43 43 ARG H H 43 8.296 8.296 8.486 -0.190 25109
2474 1 5 . 1 1 44 44 ALA N N 44 121.305 121.305 120.732 0.573 25109
2475 1 5 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.184 -0.081 25109
2476 1 5 . 1 1 44 44 ALA C C 44 180.924 180.924 179.603 1.321 25109
2477 1 5 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.191 0.034 25109
2478 1 5 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.320 -0.224 25109
2479 1 5 . 1 1 44 44 ALA H H 44 7.774 7.774 8.350 -0.576 25109
2480 1 5 . 1 1 45 45 THR N N 45 115.017 115.017 116.623 -1.606 25109
2481 1 5 . 1 1 45 45 THR HA H 45 3.879 3.879 3.862 0.017 25109
2482 1 5 . 1 1 45 45 THR CA C 45 66.327 66.327 66.754 -0.427 25109
2483 1 5 . 1 1 45 45 THR CB C 45 68.809 68.809 68.549 0.260 25109
2484 1 5 . 1 1 45 45 THR H H 45 8.167 8.167 8.175 -0.009 25109
2485 1 5 . 1 1 46 46 CYS N N 46 123.609 123.609 119.148 4.461 25109
2486 1 5 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.359 -0.340 25109
2487 1 5 . 1 1 46 46 CYS C C 46 178.077 178.077 175.876 2.201 25109
2488 1 5 . 1 1 46 46 CYS CA C 46 62.945 62.945 63.121 -0.176 25109
2489 1 5 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.808 -1.669 25109
2490 1 5 . 1 1 46 46 CYS H H 46 8.084 8.084 8.408 -0.324 25109
2491 1 5 . 1 1 47 47 THR N N 47 115.520 115.520 113.769 1.751 25109
2492 1 5 . 1 1 47 47 THR HA H 47 3.915 3.915 4.251 -0.336 25109
2493 1 5 . 1 1 47 47 THR CA C 47 66.063 66.063 64.433 1.631 25109
2494 1 5 . 1 1 47 47 THR CB C 47 69.245 69.245 68.814 0.431 25109
2495 1 5 . 1 1 47 47 THR H H 47 7.735 7.735 7.491 0.244 25109
2496 1 5 . 1 1 48 48 LEU N N 48 120.099 120.099 121.650 -1.551 25109
2497 1 5 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.292 -0.066 25109
2498 1 5 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.121 0.442 25109
2499 1 5 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.685 0.940 25109
2500 1 5 . 1 1 48 48 LEU H H 48 7.464 7.464 8.174 -0.710 25109
2501 1 5 . 1 1 49 49 SER N N 49 111.979 111.979 111.996 -0.017 25109
2502 1 5 . 1 1 49 49 SER HA H 49 4.661 4.661 4.629 0.032 25109
2503 1 5 . 1 1 49 49 SER C C 49 175.581 175.581 174.489 1.092 25109
2504 1 5 . 1 1 49 49 SER CA C 49 59.590 59.590 58.864 0.726 25109
2505 1 5 . 1 1 49 49 SER CB C 49 65.335 65.335 65.709 -0.374 25109
2506 1 5 . 1 1 49 49 SER H H 49 8.781 8.781 8.325 0.456 25109
2507 1 5 . 1 1 50 50 GLY N N 50 110.194 110.194 108.269 1.925 25109
2508 1 5 . 1 1 50 50 GLY C C 50 175.123 175.123 172.508 2.615 25109
2509 1 5 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.403 -0.501 25109
2510 1 5 . 1 1 50 50 GLY H H 50 7.955 7.955 7.572 0.383 25109
2511 1 5 . 1 1 51 51 ASN N N 51 121.050 121.050 119.448 1.602 25109
2512 1 5 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.683 -0.433 25109
2513 1 5 . 1 1 51 51 ASN C C 51 176.403 176.403 176.937 -0.534 25109
2514 1 5 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.109 4.194 25109
2515 1 5 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.723 2.876 25109
2516 1 5 . 1 1 51 51 ASN H H 51 8.898 8.898 8.799 0.099 25109
2517 1 5 . 1 1 52 52 ARG N N 52 119.825 119.825 121.073 -1.248 25109
2518 1 5 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.102 -0.064 25109
2519 1 5 . 1 1 52 52 ARG C C 52 178.850 178.850 177.403 1.447 25109
2520 1 5 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.238 0.826 25109
2521 1 5 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.742 0.281 25109
2522 1 5 . 1 1 52 52 ARG H H 52 8.696 8.696 8.716 -0.020 25109
2523 1 5 . 1 1 53 53 ASP N N 53 116.032 116.032 117.913 -1.881 25109
2524 1 5 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.618 -0.072 25109
2525 1 5 . 1 1 53 53 ASP C C 53 178.996 178.996 178.900 0.096 25109
2526 1 5 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.851 -1.772 25109
2527 1 5 . 1 1 53 53 ASP CB C 53 38.371 38.371 39.939 -1.568 25109
2528 1 5 . 1 1 53 53 ASP H H 53 9.036 9.036 8.727 0.309 25109
2529 1 5 . 1 1 54 54 THR N N 54 115.848 115.848 118.448 -2.600 25109
2530 1 5 . 1 1 54 54 THR HA H 54 3.746 3.746 4.297 -0.551 25109
2531 1 5 . 1 1 54 54 THR CA C 54 67.885 67.885 66.668 1.217 25109
2532 1 5 . 1 1 54 54 THR CB C 54 66.953 66.953 68.960 -2.007 25109
2533 1 5 . 1 1 54 54 THR H H 54 7.782 7.782 7.572 0.210 25109
2534 1 5 . 1 1 55 55 LEU N N 55 125.987 125.987 123.530 2.457 25109
2535 1 5 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.071 -0.517 25109
2536 1 5 . 1 1 55 55 LEU C C 55 177.901 177.901 178.550 -0.649 25109
2537 1 5 . 1 1 55 55 LEU CA C 55 58.453 58.453 59.197 -0.744 25109
2538 1 5 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.957 -0.094 25109
2539 1 5 . 1 1 55 55 LEU H H 55 8.740 8.740 8.662 0.078 25109
2540 1 5 . 1 1 56 56 TRP N N 56 116.672 116.672 120.303 -3.631 25109
2541 1 5 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.282 -0.202 25109
2542 1 5 . 1 1 56 56 TRP C C 56 179.588 179.588 178.378 1.210 25109
2543 1 5 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.135 0.346 25109
2544 1 5 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.539 -0.347 25109
2545 1 5 . 1 1 56 56 TRP H H 56 7.642 7.642 8.326 -0.684 25109
2546 1 5 . 1 1 57 57 HIS N N 57 115.754 115.754 117.469 -1.715 25109
2547 1 5 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.070 0.206 25109
2548 1 5 . 1 1 57 57 HIS C C 57 177.514 177.514 177.696 -0.182 25109
2549 1 5 . 1 1 57 57 HIS CA C 57 58.952 58.952 60.667 -1.715 25109
2550 1 5 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.689 -1.687 25109
2551 1 5 . 1 1 57 57 HIS H H 57 7.407 7.407 7.800 -0.393 25109
2552 1 5 . 1 1 58 58 LEU N N 58 123.934 123.934 122.402 1.532 25109
2553 1 5 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.860 -0.073 25109
2554 1 5 . 1 1 58 58 LEU C C 58 178.115 178.115 177.774 0.341 25109
2555 1 5 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.524 0.385 25109
2556 1 5 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.544 -0.729 25109
2557 1 5 . 1 1 58 58 LEU H H 58 8.996 8.996 8.614 0.382 25109
2558 1 5 . 1 1 59 59 PHE N N 59 117.721 117.721 116.797 0.924 25109
2559 1 5 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.643 0.292 25109
2560 1 5 . 1 1 59 59 PHE C C 59 176.987 176.987 177.813 -0.826 25109
2561 1 5 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.444 -2.331 25109
2562 1 5 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.880 -0.920 25109
2563 1 5 . 1 1 59 59 PHE H H 59 8.201 8.201 8.189 0.012 25109
2564 1 5 . 1 1 60 60 ASN N N 60 115.695 115.695 116.035 -0.340 25109
2565 1 5 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.145 -0.226 25109
2566 1 5 . 1 1 60 60 ASN C C 60 176.670 176.670 176.512 0.158 25109
2567 1 5 . 1 1 60 60 ASN CA C 60 56.756 56.756 55.385 1.371 25109
2568 1 5 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.258 1.060 25109
2569 1 5 . 1 1 60 60 ASN H H 60 7.666 7.666 8.154 -0.488 25109
2570 1 5 . 1 1 61 61 THR N N 61 115.110 115.110 115.342 -0.232 25109
2571 1 5 . 1 1 61 61 THR HA H 61 3.733 3.733 4.097 -0.364 25109
2572 1 5 . 1 1 61 61 THR CA C 61 66.319 66.319 65.653 0.666 25109
2573 1 5 . 1 1 61 61 THR CB C 61 69.174 69.174 69.085 0.089 25109
2574 1 5 . 1 1 61 61 THR H H 61 7.782 7.782 7.419 0.363 25109
2575 1 5 . 1 1 62 62 LEU N N 62 121.559 121.559 122.966 -1.407 25109
2576 1 5 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.811 -0.322 25109
2577 1 5 . 1 1 62 62 LEU C C 62 176.600 176.600 178.180 -1.580 25109
2578 1 5 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.565 -0.600 25109
2579 1 5 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.679 1.656 25109
2580 1 5 . 1 1 62 62 LEU H H 62 8.362 8.362 8.470 -0.108 25109
2581 1 5 . 1 1 63 63 GLN N N 63 109.150 109.150 115.705 -6.555 25109
2582 1 5 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.717 -1.640 25109
2583 1 5 . 1 1 63 63 GLN C C 63 175.194 175.194 176.773 -1.579 25109
2584 1 5 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.544 -1.278 25109
2585 1 5 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.862 -2.168 25109
2586 1 5 . 1 1 63 63 GLN H H 63 6.458 6.458 7.371 -0.913 25109
2587 1 5 . 1 1 64 64 ARG N N 64 116.029 116.029 117.792 -1.763 25109
2588 1 5 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.324 -0.226 25109
2589 1 5 . 1 1 64 64 ARG C C 64 176.459 176.459 176.033 0.426 25109
2590 1 5 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.801 0.342 25109
2591 1 5 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.698 -0.114 25109
2592 1 5 . 1 1 64 64 ARG H H 64 6.596 6.596 7.576 -0.980 25109
2593 1 5 . 1 1 65 65 ARG N N 65 120.422 120.422 119.526 0.896 25109
2594 1 5 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.892 -0.058 25109
2595 1 5 . 1 1 65 65 ARG C C 65 173.436 173.436 174.020 -0.584 25109
2596 1 5 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.355 0.189 25109
2597 1 5 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.852 -0.857 25109
2598 1 5 . 1 1 65 65 ARG H H 65 7.932 7.932 7.910 0.022 25109
2599 1 5 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.440 0.134 25109
2600 1 5 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.503 0.556 25109
2601 1 5 . 1 1 67 67 GLY N N 67 111.953 111.953 114.138 -2.185 25109
2602 1 5 . 1 1 67 67 GLY C C 67 177.057 177.057 176.024 1.033 25109
2603 1 5 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.034 1.273 25109
2604 1 5 . 1 1 67 67 GLY H H 67 9.198 9.198 8.492 0.706 25109
2605 1 5 . 1 1 68 68 TRP N N 68 117.467 117.467 119.187 -1.720 25109
2606 1 5 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.496 -0.154 25109
2607 1 5 . 1 1 68 68 TRP C C 68 177.690 177.690 176.193 1.497 25109
2608 1 5 . 1 1 68 68 TRP CA C 68 60.116 60.116 60.077 0.039 25109
2609 1 5 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.204 0.986 25109
2610 1 5 . 1 1 68 68 TRP H H 68 7.647 7.647 7.688 -0.041 25109
2611 1 5 . 1 1 69 69 VAL N N 69 121.482 121.482 121.256 0.226 25109
2612 1 5 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.063 -0.426 25109
2613 1 5 . 1 1 69 69 VAL C C 69 177.993 177.993 178.148 -0.155 25109
2614 1 5 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.581 1.885 25109
2615 1 5 . 1 1 69 69 VAL CB C 69 30.026 30.026 29.915 0.111 25109
2616 1 5 . 1 1 69 69 VAL H H 69 6.666 6.666 6.970 -0.304 25109
2617 1 5 . 1 1 70 70 GLU N N 70 116.350 116.350 118.842 -2.492 25109
2618 1 5 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.858 -0.033 25109
2619 1 5 . 1 1 70 70 GLU C C 70 180.362 180.362 179.240 1.122 25109
2620 1 5 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.178 0.043 25109
2621 1 5 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.009 -1.704 25109
2622 1 5 . 1 1 70 70 GLU H H 70 7.410 7.410 7.586 -0.176 25109
2623 1 5 . 1 1 71 71 TYR N N 71 116.750 116.750 118.467 -1.717 25109
2624 1 5 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.390 0.060 25109
2625 1 5 . 1 1 71 71 TYR C C 71 178.411 178.411 178.094 0.317 25109
2626 1 5 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.144 1.458 25109
2627 1 5 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.323 0.032 25109
2628 1 5 . 1 1 71 71 TYR H H 71 7.159 7.159 7.324 -0.165 25109
2629 1 5 . 1 1 72 72 PHE N N 72 121.610 121.610 121.361 0.249 25109
2630 1 5 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.264 0.238 25109
2631 1 5 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.341 -0.521 25109
2632 1 5 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.457 0.592 25109
2633 1 5 . 1 1 72 72 PHE H H 72 9.007 9.007 8.315 0.692 25109
2634 1 5 . 1 1 73 73 ILE N N 73 119.200 119.200 118.917 0.283 25109
2635 1 5 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.444 -0.264 25109
2636 1 5 . 1 1 73 73 ILE C C 73 177.620 177.620 177.608 0.012 25109
2637 1 5 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.570 1.627 25109
2638 1 5 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.478 1.544 25109
2639 1 5 . 1 1 73 73 ILE H H 73 8.644 8.644 8.658 -0.014 25109
2640 1 5 . 1 1 74 74 ALA N N 74 119.624 119.624 120.394 -0.770 25109
2641 1 5 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.056 -0.102 25109
2642 1 5 . 1 1 74 74 ALA C C 74 181.030 181.030 179.031 1.999 25109
2643 1 5 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.837 0.574 25109
2644 1 5 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.024 0.112 25109
2645 1 5 . 1 1 74 74 ALA H H 74 7.476 7.476 7.758 -0.282 25109
2646 1 5 . 1 1 75 75 ALA N N 75 123.625 123.625 122.295 1.330 25109
2647 1 5 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.786 0.052 25109
2648 1 5 . 1 1 75 75 ALA C C 75 179.272 179.272 179.437 -0.165 25109
2649 1 5 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.472 0.630 25109
2650 1 5 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.391 1.202 25109
2651 1 5 . 1 1 75 75 ALA H H 75 8.524 8.524 7.358 1.166 25109
2652 1 5 . 1 1 76 76 LEU N N 76 118.114 118.114 119.770 -1.656 25109
2653 1 5 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.990 -0.318 25109
2654 1 5 . 1 1 76 76 LEU C C 76 180.001 180.001 179.305 0.696 25109
2655 1 5 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.212 1.044 25109
2656 1 5 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.317 1.302 25109
2657 1 5 . 1 1 76 76 LEU H H 76 8.153 8.153 7.593 0.560 25109
2658 1 5 . 1 1 77 77 ARG N N 77 117.830 117.830 117.934 -0.104 25109
2659 1 5 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.030 -0.583 25109
2660 1 5 . 1 1 77 77 ARG C C 77 180.889 180.889 178.646 2.243 25109
2661 1 5 . 1 1 77 77 ARG CA C 77 61.066 61.066 58.781 2.285 25109
2662 1 5 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.955 -0.758 25109
2663 1 5 . 1 1 77 77 ARG H H 77 7.945 7.945 7.968 -0.023 25109
2664 1 5 . 1 1 78 78 GLY N N 78 110.202 110.202 106.547 3.655 25109
2665 1 5 . 1 1 78 78 GLY C C 78 174.807 174.807 175.196 -0.389 25109
2666 1 5 . 1 1 78 78 GLY CA C 78 46.560 46.560 45.824 0.736 25109
2667 1 5 . 1 1 78 78 GLY H H 78 8.269 8.269 7.535 0.734 25109
2668 1 5 . 1 1 79 79 CYS N N 79 115.567 115.567 118.921 -3.354 25109
2669 1 5 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.245 0.144 25109
2670 1 5 . 1 1 79 79 CYS C C 79 173.025 173.025 175.240 -2.215 25109
2671 1 5 . 1 1 79 79 CYS CA C 79 59.957 59.957 59.361 0.596 25109
2672 1 5 . 1 1 79 79 CYS CB C 79 27.805 27.805 29.006 -1.201 25109
2673 1 5 . 1 1 79 79 CYS H H 79 7.132 7.132 7.670 -0.538 25109
2674 1 5 . 1 1 80 80 GLU N N 80 111.759 111.759 116.869 -5.110 25109
2675 1 5 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.336 -0.603 25109
2676 1 5 . 1 1 80 80 GLU C C 80 175.827 175.827 174.983 0.844 25109
2677 1 5 . 1 1 80 80 GLU CA C 80 57.467 57.467 56.203 1.264 25109
2678 1 5 . 1 1 80 80 GLU CB C 80 24.717 24.717 29.949 -5.232 25109
2679 1 5 . 1 1 80 80 GLU H H 80 7.772 7.772 7.975 -0.203 25109
2680 1 5 . 1 1 81 81 LEU N N 81 124.692 124.692 123.232 1.460 25109
2681 1 5 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.737 -0.046 25109
2682 1 5 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.870 -0.915 25109
2683 1 5 . 1 1 81 81 LEU CB C 81 39.391 39.391 42.671 -3.280 25109
2684 1 5 . 1 1 81 81 LEU H H 81 8.167 8.167 8.587 -0.420 25109
2685 1 5 . 1 1 82 82 VAL N N 82 118.320 118.320 122.558 -4.238 25109
2686 1 5 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.749 -0.572 25109
2687 1 5 . 1 1 82 82 VAL CA C 82 66.710 66.710 65.480 1.230 25109
2688 1 5 . 1 1 82 82 VAL CB C 82 31.948 31.948 32.152 -0.204 25109
2689 1 5 . 1 1 82 82 VAL H H 82 7.141 7.141 8.328 -1.187 25109
2690 1 5 . 1 1 83 83 ASP N N 83 118.733 118.733 121.139 -2.406 25109
2691 1 5 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.437 -0.105 25109
2692 1 5 . 1 1 83 83 ASP C C 83 178.674 178.674 178.698 -0.024 25109
2693 1 5 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.877 -1.434 25109
2694 1 5 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.434 -3.605 25109
2695 1 5 . 1 1 83 83 ASP H H 83 8.385 8.385 8.589 -0.204 25109
2696 1 5 . 1 1 84 84 LEU N N 84 121.026 121.026 119.483 1.543 25109
2697 1 5 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.340 -0.361 25109
2698 1 5 . 1 1 84 84 LEU C C 84 178.796 178.796 179.213 -0.417 25109
2699 1 5 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.163 0.359 25109
2700 1 5 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.712 0.783 25109
2701 1 5 . 1 1 84 84 LEU H H 84 7.770 7.770 8.050 -0.280 25109
2702 1 5 . 1 1 85 85 ALA N N 85 121.525 121.525 121.840 -0.315 25109
2703 1 5 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.930 -0.269 25109
2704 1 5 . 1 1 85 85 ALA C C 85 179.322 179.322 179.074 0.248 25109
2705 1 5 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.081 0.760 25109
2706 1 5 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.285 0.642 25109
2707 1 5 . 1 1 85 85 ALA H H 85 8.126 8.126 7.490 0.636 25109
2708 1 5 . 1 1 86 86 ASP N N 86 115.349 115.349 118.467 -3.118 25109
2709 1 5 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.386 -0.113 25109
2710 1 5 . 1 1 86 86 ASP C C 86 178.463 178.463 178.213 0.250 25109
2711 1 5 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.250 -1.539 25109
2712 1 5 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.175 -4.013 25109
2713 1 5 . 1 1 86 86 ASP H H 86 8.410 8.410 8.151 0.259 25109
2714 1 5 . 1 1 87 87 GLU N N 87 122.529 122.529 119.058 3.471 25109
2715 1 5 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.162 -0.126 25109
2716 1 5 . 1 1 87 87 GLU C C 87 178.508 178.508 178.795 -0.287 25109
2717 1 5 . 1 1 87 87 GLU CA C 87 59.354 59.354 58.989 0.365 25109
2718 1 5 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.559 -1.286 25109
2719 1 5 . 1 1 87 87 GLU H H 87 8.012 8.012 8.142 -0.130 25109
2720 1 5 . 1 1 88 88 VAL N N 88 119.148 119.148 120.418 -1.270 25109
2721 1 5 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.734 -0.404 25109
2722 1 5 . 1 1 88 88 VAL C C 88 177.240 177.240 177.711 -0.471 25109
2723 1 5 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.853 1.396 25109
2724 1 5 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.890 -0.361 25109
2725 1 5 . 1 1 88 88 VAL H H 88 8.291 8.291 7.531 0.760 25109
2726 1 5 . 1 1 89 89 ALA N N 89 120.709 120.709 122.627 -1.918 25109
2727 1 5 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.035 -0.120 25109
2728 1 5 . 1 1 89 89 ALA C C 89 180.186 180.186 179.683 0.503 25109
2729 1 5 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.430 0.629 25109
2730 1 5 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.132 0.103 25109
2731 1 5 . 1 1 89 89 ALA H H 89 8.548 8.548 8.035 0.513 25109
2732 1 5 . 1 1 90 90 SER N N 90 113.035 113.035 112.607 0.428 25109
2733 1 5 . 1 1 90 90 SER HA H 90 4.047 4.047 4.394 -0.347 25109
2734 1 5 . 1 1 90 90 SER C C 90 177.564 177.564 175.684 1.880 25109
2735 1 5 . 1 1 90 90 SER CA C 90 61.771 61.771 61.091 0.680 25109
2736 1 5 . 1 1 90 90 SER CB C 90 62.907 62.907 62.859 0.048 25109
2737 1 5 . 1 1 90 90 SER H H 90 7.969 7.969 8.141 -0.172 25109
2738 1 5 . 1 1 91 91 VAL N N 91 123.417 123.417 120.200 3.217 25109
2739 1 5 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.730 -0.383 25109
2740 1 5 . 1 1 91 91 VAL C C 91 178.428 178.428 177.447 0.981 25109
2741 1 5 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.734 0.395 25109
2742 1 5 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.881 -0.110 25109
2743 1 5 . 1 1 91 91 VAL H H 91 7.713 7.713 7.410 0.303 25109
2744 1 5 . 1 1 92 92 TYR N N 92 121.458 121.458 120.567 0.891 25109
2745 1 5 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.370 -0.179 25109
2746 1 5 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.822 0.172 25109
2747 1 5 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.691 0.294 25109
2748 1 5 . 1 1 92 92 TYR H H 92 8.395 8.395 7.946 0.449 25109
2749 1 5 . 1 1 93 93 GLN N N 93 115.549 115.549 118.335 -2.786 25109
2750 1 5 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.342 -0.631 25109
2751 1 5 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.992 0.102 25109
2752 1 5 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.278 0.020 25109
2753 1 5 . 1 1 93 93 GLN H H 93 8.167 8.167 8.196 -0.029 25109
2754 1 5 . 1 1 94 94 SER N N 94 115.923 115.923 113.991 1.932 25109
2755 1 5 . 1 1 94 94 SER HA H 94 4.096 4.096 4.295 -0.199 25109
2756 1 5 . 1 1 94 94 SER CA C 94 60.971 60.971 58.901 2.070 25109
2757 1 5 . 1 1 94 94 SER CB C 94 62.635 62.635 63.794 -1.159 25109
2758 1 5 . 1 1 94 94 SER H H 94 7.642 7.642 7.706 -0.064 25109
2759 1 5 . 1 1 95 95 TYR N N 95 119.565 119.565 121.084 -1.519 25109
2760 1 5 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.648 0.111 25109
2761 1 5 . 1 1 95 95 TYR C C 95 175.334 175.334 173.546 1.788 25109
2762 1 5 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.483 0.214 25109
2763 1 5 . 1 1 95 95 TYR CB C 95 39.319 39.319 39.448 -0.129 25109
2764 1 5 . 1 1 95 95 TYR H H 95 7.069 7.069 7.302 -0.233 25109
2765 1 5 . 1 1 96 96 GLN N N 96 119.872 119.872 122.187 -2.315 25109
2766 1 5 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.447 -0.082 25109
2767 1 5 . 1 1 96 96 GLN C C 96 173.612 173.612 174.319 -0.707 25109
2768 1 5 . 1 1 96 96 GLN CA C 96 54.336 54.336 53.546 0.790 25109
2769 1 5 . 1 1 96 96 GLN CB C 96 28.494 28.494 29.903 -1.409 25109
2770 1 5 . 1 1 96 96 GLN H H 96 7.409 7.409 8.217 -0.808 25109
2771 1 5 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.181 0.137 25109
2772 1 5 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.462 -0.448 25109
2773 1 5 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.002 0.096 25109
2774 1 5 . 1 1 98 98 ARG N N 98 121.759 121.759 119.312 2.447 25109
2775 1 5 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.608 -0.266 25109
2776 1 5 . 1 1 98 98 ARG C C 98 176.848 176.848 175.530 1.318 25109
2777 1 5 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.638 0.583 25109
2778 1 5 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.093 0.994 25109
2779 1 5 . 1 1 98 98 ARG H H 98 8.423 8.423 7.867 0.556 25109
2780 1 5 . 1 1 99 99 THR N N 99 115.292 115.292 114.268 1.024 25109
2781 1 5 . 1 1 99 99 THR HA H 99 4.323 4.323 4.400 -0.077 25109
2782 1 5 . 1 1 99 99 THR C C 99 174.350 174.350 174.312 0.038 25109
2783 1 5 . 1 1 99 99 THR CA C 99 61.906 61.906 62.074 -0.168 25109
2784 1 5 . 1 1 99 99 THR CB C 99 70.180 70.180 69.963 0.217 25109
2785 1 5 . 1 1 99 99 THR H H 99 8.179 8.179 8.595 -0.416 25109
2786 1 6 . 1 1 0 0 SER N N 0 115.693 115.693 116.392 -0.699 25109
2787 1 6 . 1 1 0 0 SER HA H 0 4.531 4.531 4.670 -0.139 25109
2788 1 6 . 1 1 0 0 SER C C 0 174.557 174.557 173.679 0.878 25109
2789 1 6 . 1 1 0 0 SER CA C 0 58.478 58.478 58.414 0.064 25109
2790 1 6 . 1 1 0 0 SER CB C 0 64.380 64.380 62.466 1.914 25109
2791 1 6 . 1 1 0 0 SER H H 0 8.631 8.631 8.543 0.088 25109
2792 1 6 . 1 1 1 1 MET N N 1 123.111 123.111 115.724 7.387 25109
2793 1 6 . 1 1 1 1 MET HA H 1 4.728 4.728 4.852 -0.124 25109
2794 1 6 . 1 1 1 1 MET C C 1 174.846 174.846 173.029 1.817 25109
2795 1 6 . 1 1 1 1 MET CA C 1 55.655 55.655 54.165 1.490 25109
2796 1 6 . 1 1 1 1 MET CB C 1 32.035 32.035 33.319 -1.284 25109
2797 1 6 . 1 1 1 1 MET H H 1 8.641 8.641 7.496 1.145 25109
2798 1 6 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.992 -0.515 25109
2799 1 6 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.635 0.365 25109
2800 1 6 . 1 1 3 3 PHE N N 3 121.126 121.126 125.201 -4.075 25109
2801 1 6 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.630 -0.264 25109
2802 1 6 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.528 1.334 25109
2803 1 6 . 1 1 3 3 PHE CB C 3 39.368 39.368 41.104 -1.736 25109
2804 1 6 . 1 1 3 3 PHE H H 3 8.177 8.177 9.342 -1.165 25109
2805 1 6 . 1 1 4 4 ALA N N 4 121.170 121.170 121.367 -0.197 25109
2806 1 6 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.117 -0.282 25109
2807 1 6 . 1 1 4 4 ALA C C 4 181.522 181.522 178.444 3.078 25109
2808 1 6 . 1 1 4 4 ALA CA C 4 55.454 55.454 54.164 1.290 25109
2809 1 6 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.931 0.505 25109
2810 1 6 . 1 1 4 4 ALA H H 4 8.444 8.444 8.645 -0.201 25109
2811 1 6 . 1 1 5 5 GLU N N 5 118.932 118.932 118.293 0.639 25109
2812 1 6 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.970 -0.115 25109
2813 1 6 . 1 1 5 5 GLU C C 5 177.971 177.971 178.110 -0.139 25109
2814 1 6 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.805 0.826 25109
2815 1 6 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.784 -0.023 25109
2816 1 6 . 1 1 5 5 GLU H H 5 8.454 8.454 8.768 -0.314 25109
2817 1 6 . 1 1 6 6 ASP N N 6 120.471 120.471 118.419 2.052 25109
2818 1 6 . 1 1 6 6 ASP C C 6 178.885 178.885 177.883 1.002 25109
2819 1 6 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.489 -0.416 25109
2820 1 6 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.722 -1.591 25109
2821 1 6 . 1 1 6 6 ASP H H 6 8.316 8.316 8.662 -0.346 25109
2822 1 6 . 1 1 7 7 LYS N N 7 118.335 118.335 117.826 0.509 25109
2823 1 6 . 1 1 7 7 LYS HA H 7 3.690 3.690 4.068 -0.378 25109
2824 1 6 . 1 1 7 7 LYS C C 7 180.080 180.080 179.033 1.047 25109
2825 1 6 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.050 0.670 25109
2826 1 6 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.220 0.574 25109
2827 1 6 . 1 1 7 7 LYS H H 7 8.249 8.249 7.417 0.832 25109
2828 1 6 . 1 1 8 8 THR N N 8 119.222 119.222 117.860 1.362 25109
2829 1 6 . 1 1 8 8 THR HA H 8 3.975 3.975 4.066 -0.091 25109
2830 1 6 . 1 1 8 8 THR CA C 8 68.453 68.453 67.137 1.316 25109
2831 1 6 . 1 1 8 8 THR CB C 8 67.387 67.387 68.579 -1.192 25109
2832 1 6 . 1 1 8 8 THR H H 8 7.897 7.897 7.482 0.415 25109
2833 1 6 . 1 1 9 9 TYR N N 9 123.054 123.054 122.898 0.156 25109
2834 1 6 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.026 0.227 25109
2835 1 6 . 1 1 9 9 TYR C C 9 177.441 177.441 177.449 -0.008 25109
2836 1 6 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.092 -0.194 25109
2837 1 6 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.504 -0.655 25109
2838 1 6 . 1 1 9 9 TYR H H 9 8.605 8.605 8.285 0.320 25109
2839 1 6 . 1 1 10 10 LYS N N 10 118.366 118.366 117.987 0.379 25109
2840 1 6 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.769 -0.175 25109
2841 1 6 . 1 1 10 10 LYS C C 10 178.885 178.885 179.094 -0.209 25109
2842 1 6 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.428 1.616 25109
2843 1 6 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.493 0.552 25109
2844 1 6 . 1 1 10 10 LYS H H 10 8.066 8.066 8.254 -0.188 25109
2845 1 6 . 1 1 11 11 TYR N N 11 120.539 120.539 120.994 -0.455 25109
2846 1 6 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.172 -0.182 25109
2847 1 6 . 1 1 11 11 TYR C C 11 178.233 178.233 177.874 0.359 25109
2848 1 6 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.674 0.854 25109
2849 1 6 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.886 -0.523 25109
2850 1 6 . 1 1 11 11 TYR H H 11 7.875 7.875 7.668 0.207 25109
2851 1 6 . 1 1 12 12 ILE N N 12 121.893 121.893 118.552 3.341 25109
2852 1 6 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.741 -0.645 25109
2853 1 6 . 1 1 12 12 ILE C C 12 177.015 177.015 177.407 -0.392 25109
2854 1 6 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.244 2.519 25109
2855 1 6 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.319 1.233 25109
2856 1 6 . 1 1 12 12 ILE H H 12 8.154 8.154 8.345 -0.191 25109
2857 1 6 . 1 1 13 13 CYS N N 13 113.894 113.894 116.080 -2.186 25109
2858 1 6 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.977 -0.090 25109
2859 1 6 . 1 1 13 13 CYS C C 13 178.288 178.288 176.664 1.624 25109
2860 1 6 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.782 2.555 25109
2861 1 6 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.734 0.271 25109
2862 1 6 . 1 1 13 13 CYS H H 13 7.551 7.551 7.618 -0.067 25109
2863 1 6 . 1 1 14 14 ARG N N 14 119.228 119.228 120.016 -0.788 25109
2864 1 6 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.098 -0.028 25109
2865 1 6 . 1 1 14 14 ARG C C 14 177.127 177.127 177.107 0.020 25109
2866 1 6 . 1 1 14 14 ARG CA C 14 58.494 58.494 59.183 -0.689 25109
2867 1 6 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.312 0.110 25109
2868 1 6 . 1 1 14 14 ARG H H 14 7.991 7.991 7.644 0.347 25109
2869 1 6 . 1 1 15 15 ASN N N 15 117.367 117.367 116.820 0.547 25109
2870 1 6 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.829 0.140 25109
2871 1 6 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.652 0.111 25109
2872 1 6 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.858 0.726 25109
2873 1 6 . 1 1 15 15 ASN H H 15 7.643 7.643 7.759 -0.116 25109
2874 1 6 . 1 1 16 16 PHE N N 16 122.356 122.356 122.501 -0.145 25109
2875 1 6 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.236 -0.020 25109
2876 1 6 . 1 1 16 16 PHE C C 16 178.084 178.084 177.279 0.805 25109
2877 1 6 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.514 1.663 25109
2878 1 6 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.191 1.398 25109
2879 1 6 . 1 1 16 16 PHE H H 16 6.992 6.992 7.652 -0.660 25109
2880 1 6 . 1 1 17 17 SER N N 17 112.937 112.937 114.840 -1.903 25109
2881 1 6 . 1 1 17 17 SER HA H 17 4.199 4.199 4.231 -0.032 25109
2882 1 6 . 1 1 17 17 SER C C 17 176.726 176.726 176.374 0.352 25109
2883 1 6 . 1 1 17 17 SER CA C 17 62.052 62.052 60.488 1.564 25109
2884 1 6 . 1 1 17 17 SER CB C 17 62.552 62.552 62.985 -0.433 25109
2885 1 6 . 1 1 17 17 SER H H 17 8.840 8.840 8.693 0.147 25109
2886 1 6 . 1 1 18 18 ASN N N 18 118.809 118.809 121.364 -2.555 25109
2887 1 6 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.623 -0.265 25109
2888 1 6 . 1 1 18 18 ASN C C 18 175.967 175.967 176.095 -0.128 25109
2889 1 6 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.191 -0.281 25109
2890 1 6 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.789 -0.962 25109
2891 1 6 . 1 1 18 18 ASN H H 18 8.130 8.130 8.489 -0.359 25109
2892 1 6 . 1 1 19 19 PHE N N 19 115.750 115.750 116.752 -1.002 25109
2893 1 6 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.738 -0.453 25109
2894 1 6 . 1 1 19 19 PHE C C 19 175.370 175.370 175.511 -0.141 25109
2895 1 6 . 1 1 19 19 PHE CA C 19 58.862 58.862 57.421 1.441 25109
2896 1 6 . 1 1 19 19 PHE CB C 19 39.878 39.878 39.187 0.691 25109
2897 1 6 . 1 1 19 19 PHE H H 19 8.062 8.062 7.735 0.327 25109
2898 1 6 . 1 1 20 20 CYS N N 20 113.958 113.958 117.120 -3.162 25109
2899 1 6 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.471 -0.528 25109
2900 1 6 . 1 1 20 20 CYS C C 20 173.823 173.823 174.871 -1.048 25109
2901 1 6 . 1 1 20 20 CYS CA C 20 61.788 61.788 59.528 2.260 25109
2902 1 6 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.183 0.200 25109
2903 1 6 . 1 1 20 20 CYS H H 20 6.850 6.850 7.341 -0.491 25109
2904 1 6 . 1 1 21 21 ASN N N 21 116.691 116.691 117.792 -1.101 25109
2905 1 6 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.829 -0.085 25109
2906 1 6 . 1 1 21 21 ASN C C 21 175.299 175.299 173.828 1.471 25109
2907 1 6 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.699 0.591 25109
2908 1 6 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.191 -0.878 25109
2909 1 6 . 1 1 21 21 ASN H H 21 8.251 8.251 7.955 0.296 25109
2910 1 6 . 1 1 22 22 VAL N N 22 122.431 122.431 119.530 2.901 25109
2911 1 6 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.202 -0.652 25109
2912 1 6 . 1 1 22 22 VAL C C 22 174.034 174.034 173.936 0.098 25109
2913 1 6 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.259 3.678 25109
2914 1 6 . 1 1 22 22 VAL CB C 22 31.523 31.523 36.078 -4.555 25109
2915 1 6 . 1 1 22 22 VAL H H 22 7.573 7.573 7.636 -0.063 25109
2916 1 6 . 1 1 23 23 ASP N N 23 127.219 127.219 129.135 -1.916 25109
2917 1 6 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.441 -1.255 25109
2918 1 6 . 1 1 23 23 ASP CB C 23 38.793 38.793 40.429 -1.636 25109
2919 1 6 . 1 1 23 23 ASP H H 23 8.687 8.687 8.710 -0.023 25109
2920 1 6 . 1 1 24 24 VAL N N 24 127.835 127.835 124.855 2.980 25109
2921 1 6 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.850 -0.557 25109
2922 1 6 . 1 1 24 24 VAL C C 24 176.867 176.867 177.430 -0.563 25109
2923 1 6 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.729 2.434 25109
2924 1 6 . 1 1 24 24 VAL CB C 24 32.015 32.015 31.542 0.473 25109
2925 1 6 . 1 1 24 24 VAL H H 24 9.409 9.409 8.223 1.186 25109
2926 1 6 . 1 1 25 25 VAL N N 25 114.324 114.324 114.712 -0.388 25109
2927 1 6 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.864 -0.345 25109
2928 1 6 . 1 1 25 25 VAL C C 25 178.006 178.006 177.787 0.219 25109
2929 1 6 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.237 1.451 25109
2930 1 6 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.558 -0.026 25109
2931 1 6 . 1 1 25 25 VAL H H 25 8.038 8.038 7.554 0.484 25109
2932 1 6 . 1 1 26 26 GLU N N 26 117.009 117.009 120.254 -3.245 25109
2933 1 6 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.261 -0.170 25109
2934 1 6 . 1 1 26 26 GLU C C 26 177.303 177.303 178.336 -1.033 25109
2935 1 6 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.365 -0.933 25109
2936 1 6 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.774 -0.809 25109
2937 1 6 . 1 1 26 26 GLU H H 26 7.220 7.220 8.037 -0.817 25109
2938 1 6 . 1 1 27 27 ILE N N 27 114.080 114.080 119.676 -5.596 25109
2939 1 6 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.810 0.551 25109
2940 1 6 . 1 1 27 27 ILE CA C 27 62.732 62.732 65.004 -2.272 25109
2941 1 6 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.087 1.504 25109
2942 1 6 . 1 1 27 27 ILE H H 27 7.647 7.647 7.418 0.229 25109
2943 1 6 . 1 1 28 28 LEU N N 28 121.867 121.867 120.721 1.146 25109
2944 1 6 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.171 -0.234 25109
2945 1 6 . 1 1 28 28 LEU C C 28 175.756 175.756 176.726 -0.970 25109
2946 1 6 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.192 -0.225 25109
2947 1 6 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.875 0.638 25109
2948 1 6 . 1 1 28 28 LEU H H 28 7.434 7.434 7.544 -0.110 25109
2949 1 6 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.266 -0.056 25109
2950 1 6 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.081 0.229 25109
2951 1 6 . 1 1 30 30 TYR N N 30 113.832 113.832 114.790 -0.958 25109
2952 1 6 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.538 -0.036 25109
2953 1 6 . 1 1 30 30 TYR C C 30 174.386 174.386 175.321 -0.935 25109
2954 1 6 . 1 1 30 30 TYR CA C 30 57.694 57.694 60.139 -2.445 25109
2955 1 6 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.571 -0.472 25109
2956 1 6 . 1 1 30 30 TYR H H 30 7.628 7.628 7.667 -0.039 25109
2957 1 6 . 1 1 31 31 LEU N N 31 118.331 118.331 118.552 -0.221 25109
2958 1 6 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.762 0.115 25109
2959 1 6 . 1 1 31 31 LEU C C 31 173.849 173.849 174.838 -0.989 25109
2960 1 6 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.958 -0.265 25109
2961 1 6 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.089 0.713 25109
2962 1 6 . 1 1 31 31 LEU H H 31 7.619 7.619 7.567 0.052 25109
2963 1 6 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.491 -0.136 25109
2964 1 6 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.546 -0.136 25109
2965 1 6 . 1 1 33 33 CYS N N 33 110.978 110.978 114.196 -3.218 25109
2966 1 6 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.332 0.009 25109
2967 1 6 . 1 1 33 33 CYS C C 33 174.139 174.139 174.388 -0.249 25109
2968 1 6 . 1 1 33 33 CYS CA C 33 56.212 56.212 57.356 -1.144 25109
2969 1 6 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.255 1.667 25109
2970 1 6 . 1 1 33 33 CYS H H 33 6.414 6.414 7.520 -1.106 25109
2971 1 6 . 1 1 34 34 LEU N N 34 123.111 123.111 120.803 2.308 25109
2972 1 6 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.424 0.182 25109
2973 1 6 . 1 1 34 34 LEU C C 34 176.646 176.646 176.993 -0.347 25109
2974 1 6 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.205 -0.314 25109
2975 1 6 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.212 -0.520 25109
2976 1 6 . 1 1 34 34 LEU H H 34 7.550 7.550 7.138 0.412 25109
2977 1 6 . 1 1 35 35 THR N N 35 113.831 113.831 113.723 0.108 25109
2978 1 6 . 1 1 35 35 THR HA H 35 4.205 4.205 4.261 -0.056 25109
2979 1 6 . 1 1 35 35 THR C C 35 175.324 175.324 175.856 -0.532 25109
2980 1 6 . 1 1 35 35 THR CA C 35 61.200 61.200 61.050 0.150 25109
2981 1 6 . 1 1 35 35 THR CB C 35 71.318 71.318 70.178 1.140 25109
2982 1 6 . 1 1 35 35 THR H H 35 8.586 8.586 8.064 0.522 25109
2983 1 6 . 1 1 36 36 ALA N N 36 124.128 124.128 126.725 -2.597 25109
2984 1 6 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.040 -0.116 25109
2985 1 6 . 1 1 36 36 ALA C C 36 180.397 180.397 180.145 0.252 25109
2986 1 6 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.232 0.688 25109
2987 1 6 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.527 -0.724 25109
2988 1 6 . 1 1 36 36 ALA H H 36 8.836 8.836 8.732 0.104 25109
2989 1 6 . 1 1 37 37 ARG N N 37 116.793 116.793 117.882 -1.089 25109
2990 1 6 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.078 -0.092 25109
2991 1 6 . 1 1 37 37 ARG C C 37 179.272 179.272 178.065 1.207 25109
2992 1 6 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.076 0.156 25109
2993 1 6 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.744 0.161 25109
2994 1 6 . 1 1 37 37 ARG H H 37 8.060 8.060 8.639 -0.579 25109
2995 1 6 . 1 1 38 38 ASP N N 38 120.030 120.030 119.356 0.674 25109
2996 1 6 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.392 -0.144 25109
2997 1 6 . 1 1 38 38 ASP C C 38 178.885 178.885 178.286 0.599 25109
2998 1 6 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.453 -0.266 25109
2999 1 6 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.495 0.438 25109
3000 1 6 . 1 1 38 38 ASP H H 38 7.782 7.782 8.243 -0.462 25109
3001 1 6 . 1 1 39 39 GLN N N 39 118.223 118.223 118.299 -0.076 25109
3002 1 6 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.959 -0.294 25109
3003 1 6 . 1 1 39 39 GLN C C 39 178.041 178.041 178.322 -0.281 25109
3004 1 6 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.948 1.653 25109
3005 1 6 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.789 -0.992 25109
3006 1 6 . 1 1 39 39 GLN H H 39 8.476 8.476 8.250 0.226 25109
3007 1 6 . 1 1 40 40 ASP N N 40 117.908 117.908 120.402 -2.494 25109
3008 1 6 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.354 -0.101 25109
3009 1 6 . 1 1 40 40 ASP C C 40 178.639 178.639 178.327 0.312 25109
3010 1 6 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.327 -0.927 25109
3011 1 6 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.798 -2.770 25109
3012 1 6 . 1 1 40 40 ASP H H 40 8.386 8.386 7.902 0.484 25109
3013 1 6 . 1 1 41 41 ARG N N 41 120.990 120.990 119.611 1.379 25109
3014 1 6 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.909 0.133 25109
3015 1 6 . 1 1 41 41 ARG C C 41 179.795 179.795 178.857 0.938 25109
3016 1 6 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.728 -0.283 25109
3017 1 6 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.187 0.071 25109
3018 1 6 . 1 1 41 41 ARG H H 41 8.130 8.130 8.268 -0.138 25109
3019 1 6 . 1 1 42 42 LEU N N 42 121.219 121.219 119.352 1.867 25109
3020 1 6 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.049 -0.114 25109
3021 1 6 . 1 1 42 42 LEU C C 42 178.850 178.850 178.604 0.246 25109
3022 1 6 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.849 0.418 25109
3023 1 6 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.524 0.509 25109
3024 1 6 . 1 1 42 42 LEU H H 42 8.179 8.179 7.724 0.455 25109
3025 1 6 . 1 1 43 43 ARG N N 43 119.310 119.310 120.015 -0.705 25109
3026 1 6 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.850 -0.126 25109
3027 1 6 . 1 1 43 43 ARG C C 43 179.099 179.099 178.224 0.875 25109
3028 1 6 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.896 0.918 25109
3029 1 6 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.159 0.020 25109
3030 1 6 . 1 1 43 43 ARG H H 43 8.296 8.296 8.491 -0.195 25109
3031 1 6 . 1 1 44 44 ALA N N 44 121.305 121.305 120.709 0.596 25109
3032 1 6 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.149 -0.046 25109
3033 1 6 . 1 1 44 44 ALA C C 44 180.924 180.924 179.788 1.136 25109
3034 1 6 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.333 -0.108 25109
3035 1 6 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.160 -0.064 25109
3036 1 6 . 1 1 44 44 ALA H H 44 7.774 7.774 8.318 -0.544 25109
3037 1 6 . 1 1 45 45 THR N N 45 115.017 115.017 115.872 -0.855 25109
3038 1 6 . 1 1 45 45 THR HA H 45 3.879 3.879 4.008 -0.129 25109
3039 1 6 . 1 1 45 45 THR CA C 45 66.327 66.327 66.712 -0.385 25109
3040 1 6 . 1 1 45 45 THR CB C 45 68.809 68.809 68.433 0.375 25109
3041 1 6 . 1 1 45 45 THR H H 45 8.167 8.167 8.134 0.033 25109
3042 1 6 . 1 1 46 46 CYS N N 46 123.609 123.609 120.433 3.176 25109
3043 1 6 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.376 -0.357 25109
3044 1 6 . 1 1 46 46 CYS C C 46 178.077 178.077 176.113 1.964 25109
3045 1 6 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.779 1.166 25109
3046 1 6 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.498 -0.360 25109
3047 1 6 . 1 1 46 46 CYS H H 46 8.084 8.084 8.680 -0.596 25109
3048 1 6 . 1 1 47 47 THR N N 47 115.520 115.520 115.405 0.115 25109
3049 1 6 . 1 1 47 47 THR HA H 47 3.915 3.915 4.150 -0.235 25109
3050 1 6 . 1 1 47 47 THR CA C 47 66.063 66.063 65.668 0.396 25109
3051 1 6 . 1 1 47 47 THR CB C 47 69.245 69.245 68.825 0.420 25109
3052 1 6 . 1 1 47 47 THR H H 47 7.735 7.735 7.444 0.291 25109
3053 1 6 . 1 1 48 48 LEU N N 48 120.099 120.099 121.169 -1.070 25109
3054 1 6 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.285 -0.059 25109
3055 1 6 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.144 0.419 25109
3056 1 6 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.434 1.191 25109
3057 1 6 . 1 1 48 48 LEU H H 48 7.464 7.464 7.896 -0.432 25109
3058 1 6 . 1 1 49 49 SER N N 49 111.979 111.979 113.024 -1.045 25109
3059 1 6 . 1 1 49 49 SER HA H 49 4.661 4.661 4.407 0.254 25109
3060 1 6 . 1 1 49 49 SER C C 49 175.581 175.581 175.780 -0.199 25109
3061 1 6 . 1 1 49 49 SER CA C 49 59.590 59.590 60.074 -0.484 25109
3062 1 6 . 1 1 49 49 SER CB C 49 65.335 65.335 64.328 1.007 25109
3063 1 6 . 1 1 49 49 SER H H 49 8.781 8.781 8.609 0.172 25109
3064 1 6 . 1 1 50 50 GLY N N 50 110.194 110.194 108.725 1.469 25109
3065 1 6 . 1 1 50 50 GLY C C 50 175.123 175.123 173.742 1.381 25109
3066 1 6 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.253 -0.351 25109
3067 1 6 . 1 1 50 50 GLY H H 50 7.955 7.955 8.556 -0.601 25109
3068 1 6 . 1 1 51 51 ASN N N 51 121.050 121.050 119.364 1.686 25109
3069 1 6 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.819 -0.569 25109
3070 1 6 . 1 1 51 51 ASN C C 51 176.403 176.403 175.543 0.860 25109
3071 1 6 . 1 1 51 51 ASN CA C 51 59.303 59.303 53.784 5.519 25109
3072 1 6 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.777 2.822 25109
3073 1 6 . 1 1 51 51 ASN H H 51 8.898 8.898 8.182 0.716 25109
3074 1 6 . 1 1 52 52 ARG N N 52 119.825 119.825 122.294 -2.469 25109
3075 1 6 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.016 0.022 25109
3076 1 6 . 1 1 52 52 ARG C C 52 178.850 178.850 177.634 1.216 25109
3077 1 6 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.383 0.681 25109
3078 1 6 . 1 1 52 52 ARG CB C 52 30.023 30.023 30.192 -0.169 25109
3079 1 6 . 1 1 52 52 ARG H H 52 8.696 8.696 8.627 0.069 25109
3080 1 6 . 1 1 53 53 ASP N N 53 116.032 116.032 116.111 -0.079 25109
3081 1 6 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.690 -0.144 25109
3082 1 6 . 1 1 53 53 ASP C C 53 178.996 178.996 178.479 0.517 25109
3083 1 6 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.136 -1.057 25109
3084 1 6 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.842 -2.471 25109
3085 1 6 . 1 1 53 53 ASP H H 53 9.036 9.036 8.022 1.014 25109
3086 1 6 . 1 1 54 54 THR N N 54 115.848 115.848 117.763 -1.915 25109
3087 1 6 . 1 1 54 54 THR HA H 54 3.746 3.746 4.318 -0.572 25109
3088 1 6 . 1 1 54 54 THR CA C 54 67.885 67.885 66.238 1.647 25109
3089 1 6 . 1 1 54 54 THR CB C 54 66.953 66.953 68.888 -1.935 25109
3090 1 6 . 1 1 54 54 THR H H 54 7.782 7.782 7.807 -0.025 25109
3091 1 6 . 1 1 55 55 LEU N N 55 125.987 125.987 122.896 3.091 25109
3092 1 6 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.030 -0.476 25109
3093 1 6 . 1 1 55 55 LEU C C 55 177.901 177.901 178.503 -0.602 25109
3094 1 6 . 1 1 55 55 LEU CA C 55 58.453 58.453 59.404 -0.951 25109
3095 1 6 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.378 0.485 25109
3096 1 6 . 1 1 55 55 LEU H H 55 8.740 8.740 8.552 0.188 25109
3097 1 6 . 1 1 56 56 TRP N N 56 116.672 116.672 120.830 -4.158 25109
3098 1 6 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.322 -0.242 25109
3099 1 6 . 1 1 56 56 TRP C C 56 179.588 179.588 177.777 1.811 25109
3100 1 6 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.734 -0.253 25109
3101 1 6 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.364 -0.172 25109
3102 1 6 . 1 1 56 56 TRP H H 56 7.642 7.642 7.879 -0.237 25109
3103 1 6 . 1 1 57 57 HIS N N 57 115.754 115.754 116.586 -0.832 25109
3104 1 6 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.145 0.131 25109
3105 1 6 . 1 1 57 57 HIS C C 57 177.514 177.514 177.741 -0.227 25109
3106 1 6 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.916 -0.964 25109
3107 1 6 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.813 -1.811 25109
3108 1 6 . 1 1 57 57 HIS H H 57 7.407 7.407 7.621 -0.214 25109
3109 1 6 . 1 1 58 58 LEU N N 58 123.934 123.934 122.401 1.533 25109
3110 1 6 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.854 -0.067 25109
3111 1 6 . 1 1 58 58 LEU C C 58 178.115 178.115 177.429 0.686 25109
3112 1 6 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.201 0.708 25109
3113 1 6 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.509 -0.694 25109
3114 1 6 . 1 1 58 58 LEU H H 58 8.996 8.996 8.304 0.692 25109
3115 1 6 . 1 1 59 59 PHE N N 59 117.721 117.721 116.601 1.120 25109
3116 1 6 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.705 0.230 25109
3117 1 6 . 1 1 59 59 PHE C C 59 176.987 176.987 177.864 -0.877 25109
3118 1 6 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.780 -1.667 25109
3119 1 6 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.700 -0.740 25109
3120 1 6 . 1 1 59 59 PHE H H 59 8.201 8.201 8.486 -0.285 25109
3121 1 6 . 1 1 60 60 ASN N N 60 115.695 115.695 117.662 -1.967 25109
3122 1 6 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.095 -0.176 25109
3123 1 6 . 1 1 60 60 ASN C C 60 176.670 176.670 176.464 0.206 25109
3124 1 6 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.099 0.657 25109
3125 1 6 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.322 0.997 25109
3126 1 6 . 1 1 60 60 ASN H H 60 7.666 7.666 7.919 -0.253 25109
3127 1 6 . 1 1 61 61 THR N N 61 115.110 115.110 113.996 1.114 25109
3128 1 6 . 1 1 61 61 THR HA H 61 3.733 3.733 4.239 -0.506 25109
3129 1 6 . 1 1 61 61 THR CA C 61 66.319 66.319 64.838 1.481 25109
3130 1 6 . 1 1 61 61 THR CB C 61 69.174 69.174 69.025 0.149 25109
3131 1 6 . 1 1 61 61 THR H H 61 7.782 7.782 7.458 0.324 25109
3132 1 6 . 1 1 62 62 LEU N N 62 121.559 121.559 123.710 -2.151 25109
3133 1 6 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.860 -0.371 25109
3134 1 6 . 1 1 62 62 LEU C C 62 176.600 176.600 177.868 -1.268 25109
3135 1 6 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.364 -0.399 25109
3136 1 6 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.746 1.589 25109
3137 1 6 . 1 1 62 62 LEU H H 62 8.362 8.362 8.501 -0.139 25109
3138 1 6 . 1 1 63 63 GLN N N 63 109.150 109.150 115.140 -5.990 25109
3139 1 6 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.728 -1.651 25109
3140 1 6 . 1 1 63 63 GLN C C 63 175.194 175.194 176.532 -1.338 25109
3141 1 6 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.400 -1.134 25109
3142 1 6 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.965 -2.271 25109
3143 1 6 . 1 1 63 63 GLN H H 63 6.458 6.458 7.559 -1.101 25109
3144 1 6 . 1 1 64 64 ARG N N 64 116.029 116.029 117.841 -1.812 25109
3145 1 6 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.375 -0.277 25109
3146 1 6 . 1 1 64 64 ARG C C 64 176.459 176.459 175.970 0.489 25109
3147 1 6 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.573 0.570 25109
3148 1 6 . 1 1 64 64 ARG CB C 64 30.584 30.584 31.022 -0.438 25109
3149 1 6 . 1 1 64 64 ARG H H 64 6.596 6.596 7.456 -0.860 25109
3150 1 6 . 1 1 65 65 ARG N N 65 120.422 120.422 120.058 0.364 25109
3151 1 6 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.878 -0.044 25109
3152 1 6 . 1 1 65 65 ARG C C 65 173.436 173.436 173.998 -0.562 25109
3153 1 6 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.580 -0.035 25109
3154 1 6 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.958 -0.962 25109
3155 1 6 . 1 1 65 65 ARG H H 65 7.932 7.932 7.871 0.061 25109
3156 1 6 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.541 0.033 25109
3157 1 6 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.458 0.601 25109
3158 1 6 . 1 1 67 67 GLY N N 67 111.953 111.953 114.796 -2.843 25109
3159 1 6 . 1 1 67 67 GLY C C 67 177.057 177.057 176.181 0.876 25109
3160 1 6 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.143 1.164 25109
3161 1 6 . 1 1 67 67 GLY H H 67 9.198 9.198 8.412 0.786 25109
3162 1 6 . 1 1 68 68 TRP N N 68 117.467 117.467 118.875 -1.408 25109
3163 1 6 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.427 -0.085 25109
3164 1 6 . 1 1 68 68 TRP C C 68 177.690 177.690 176.612 1.078 25109
3165 1 6 . 1 1 68 68 TRP CA C 68 60.116 60.116 59.735 0.381 25109
3166 1 6 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.256 0.934 25109
3167 1 6 . 1 1 68 68 TRP H H 68 7.647 7.647 7.898 -0.251 25109
3168 1 6 . 1 1 69 69 VAL N N 69 121.482 121.482 120.795 0.687 25109
3169 1 6 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.090 -0.453 25109
3170 1 6 . 1 1 69 69 VAL C C 69 177.993 177.993 178.097 -0.104 25109
3171 1 6 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.625 0.841 25109
3172 1 6 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.391 -0.365 25109
3173 1 6 . 1 1 69 69 VAL H H 69 6.666 6.666 7.251 -0.585 25109
3174 1 6 . 1 1 70 70 GLU N N 70 116.350 116.350 118.857 -2.507 25109
3175 1 6 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.757 0.068 25109
3176 1 6 . 1 1 70 70 GLU C C 70 180.362 180.362 179.025 1.337 25109
3177 1 6 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.511 -0.290 25109
3178 1 6 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.231 -1.926 25109
3179 1 6 . 1 1 70 70 GLU H H 70 7.410 7.410 7.766 -0.356 25109
3180 1 6 . 1 1 71 71 TYR N N 71 116.750 116.750 118.524 -1.774 25109
3181 1 6 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.382 0.068 25109
3182 1 6 . 1 1 71 71 TYR C C 71 178.411 178.411 178.526 -0.115 25109
3183 1 6 . 1 1 71 71 TYR CA C 71 61.602 61.602 61.002 0.600 25109
3184 1 6 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.575 -0.220 25109
3185 1 6 . 1 1 71 71 TYR H H 71 7.159 7.159 7.491 -0.332 25109
3186 1 6 . 1 1 72 72 PHE N N 72 121.610 121.610 121.383 0.227 25109
3187 1 6 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.323 0.179 25109
3188 1 6 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.292 -0.472 25109
3189 1 6 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.321 0.728 25109
3190 1 6 . 1 1 72 72 PHE H H 72 9.007 9.007 8.500 0.507 25109
3191 1 6 . 1 1 73 73 ILE N N 73 119.200 119.200 119.655 -0.455 25109
3192 1 6 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.583 -0.403 25109
3193 1 6 . 1 1 73 73 ILE C C 73 177.620 177.620 177.731 -0.111 25109
3194 1 6 . 1 1 73 73 ILE CA C 73 67.197 67.197 63.599 3.598 25109
3195 1 6 . 1 1 73 73 ILE CB C 73 39.023 39.023 36.203 2.820 25109
3196 1 6 . 1 1 73 73 ILE H H 73 8.644 8.644 8.419 0.225 25109
3197 1 6 . 1 1 74 74 ALA N N 74 119.624 119.624 121.513 -1.889 25109
3198 1 6 . 1 1 74 74 ALA HA H 74 3.954 3.954 3.920 0.034 25109
3199 1 6 . 1 1 74 74 ALA C C 74 181.030 181.030 179.334 1.696 25109
3200 1 6 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.797 0.614 25109
3201 1 6 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.119 0.017 25109
3202 1 6 . 1 1 74 74 ALA H H 74 7.476 7.476 7.531 -0.055 25109
3203 1 6 . 1 1 75 75 ALA N N 75 123.625 123.625 122.123 1.502 25109
3204 1 6 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.168 0.670 25109
3205 1 6 . 1 1 75 75 ALA C C 75 179.272 179.272 179.601 -0.329 25109
3206 1 6 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.502 0.600 25109
3207 1 6 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.289 1.304 25109
3208 1 6 . 1 1 75 75 ALA H H 75 8.524 8.524 7.859 0.665 25109
3209 1 6 . 1 1 76 76 LEU N N 76 118.114 118.114 120.719 -2.605 25109
3210 1 6 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.888 -0.216 25109
3211 1 6 . 1 1 76 76 LEU C C 76 180.001 180.001 179.538 0.463 25109
3212 1 6 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.677 0.579 25109
3213 1 6 . 1 1 76 76 LEU CB C 76 41.619 41.619 41.055 0.564 25109
3214 1 6 . 1 1 76 76 LEU H H 76 8.153 8.153 7.612 0.541 25109
3215 1 6 . 1 1 77 77 ARG N N 77 117.830 117.830 119.048 -1.218 25109
3216 1 6 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.053 -0.606 25109
3217 1 6 . 1 1 77 77 ARG C C 77 180.889 180.889 178.002 2.887 25109
3218 1 6 . 1 1 77 77 ARG CA C 77 61.066 61.066 58.548 2.518 25109
3219 1 6 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.196 -0.999 25109
3220 1 6 . 1 1 77 77 ARG H H 77 7.945 7.945 8.096 -0.151 25109
3221 1 6 . 1 1 78 78 GLY N N 78 110.202 110.202 104.683 5.519 25109
3222 1 6 . 1 1 78 78 GLY C C 78 174.807 174.807 173.760 1.047 25109
3223 1 6 . 1 1 78 78 GLY CA C 78 46.560 46.560 44.805 1.755 25109
3224 1 6 . 1 1 78 78 GLY H H 78 8.269 8.269 7.619 0.650 25109
3225 1 6 . 1 1 79 79 CYS N N 79 115.567 115.567 117.278 -1.711 25109
3226 1 6 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.789 -0.400 25109
3227 1 6 . 1 1 79 79 CYS C C 79 173.025 173.025 174.117 -1.092 25109
3228 1 6 . 1 1 79 79 CYS CA C 79 59.957 59.957 56.454 3.503 25109
3229 1 6 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.300 0.505 25109
3230 1 6 . 1 1 79 79 CYS H H 79 7.132 7.132 7.594 -0.462 25109
3231 1 6 . 1 1 80 80 GLU N N 80 111.759 111.759 117.156 -5.397 25109
3232 1 6 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.994 -0.261 25109
3233 1 6 . 1 1 80 80 GLU C C 80 175.827 175.827 175.523 0.304 25109
3234 1 6 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.873 -0.406 25109
3235 1 6 . 1 1 80 80 GLU CB C 80 24.717 24.717 28.449 -3.732 25109
3236 1 6 . 1 1 80 80 GLU H H 80 7.772 7.772 8.598 -0.826 25109
3237 1 6 . 1 1 81 81 LEU N N 81 124.692 124.692 121.195 3.497 25109
3238 1 6 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.483 0.208 25109
3239 1 6 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.736 -0.780 25109
3240 1 6 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.921 -1.530 25109
3241 1 6 . 1 1 81 81 LEU H H 81 8.167 8.167 7.666 0.501 25109
3242 1 6 . 1 1 82 82 VAL N N 82 118.320 118.320 122.569 -4.249 25109
3243 1 6 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.684 -0.507 25109
3244 1 6 . 1 1 82 82 VAL CA C 82 66.710 66.710 65.863 0.847 25109
3245 1 6 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.903 0.045 25109
3246 1 6 . 1 1 82 82 VAL H H 82 7.141 7.141 7.463 -0.322 25109
3247 1 6 . 1 1 83 83 ASP N N 83 118.733 118.733 119.055 -0.322 25109
3248 1 6 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.230 0.102 25109
3249 1 6 . 1 1 83 83 ASP C C 83 178.674 178.674 177.945 0.729 25109
3250 1 6 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.510 -1.067 25109
3251 1 6 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.662 -3.833 25109
3252 1 6 . 1 1 83 83 ASP H H 83 8.385 8.385 8.798 -0.413 25109
3253 1 6 . 1 1 84 84 LEU N N 84 121.026 121.026 120.305 0.721 25109
3254 1 6 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.773 0.206 25109
3255 1 6 . 1 1 84 84 LEU C C 84 178.796 178.796 178.569 0.227 25109
3256 1 6 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.444 0.078 25109
3257 1 6 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.414 1.081 25109
3258 1 6 . 1 1 84 84 LEU H H 84 7.770 7.770 7.789 -0.019 25109
3259 1 6 . 1 1 85 85 ALA N N 85 121.525 121.525 121.956 -0.431 25109
3260 1 6 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.864 -0.203 25109
3261 1 6 . 1 1 85 85 ALA C C 85 179.322 179.322 179.275 0.047 25109
3262 1 6 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.142 0.698 25109
3263 1 6 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.020 0.906 25109
3264 1 6 . 1 1 85 85 ALA H H 85 8.126 8.126 7.556 0.570 25109
3265 1 6 . 1 1 86 86 ASP N N 86 115.349 115.349 118.278 -2.929 25109
3266 1 6 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.366 -0.093 25109
3267 1 6 . 1 1 86 86 ASP C C 86 178.463 178.463 178.593 -0.130 25109
3268 1 6 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.464 -1.753 25109
3269 1 6 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.033 -3.872 25109
3270 1 6 . 1 1 86 86 ASP H H 86 8.410 8.410 8.344 0.066 25109
3271 1 6 . 1 1 87 87 GLU N N 87 122.529 122.529 119.734 2.795 25109
3272 1 6 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.131 -0.095 25109
3273 1 6 . 1 1 87 87 GLU C C 87 178.508 178.508 179.276 -0.768 25109
3274 1 6 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.132 0.223 25109
3275 1 6 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.598 -1.325 25109
3276 1 6 . 1 1 87 87 GLU H H 87 8.012 8.012 8.052 -0.040 25109
3277 1 6 . 1 1 88 88 VAL N N 88 119.148 119.148 119.427 -0.279 25109
3278 1 6 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.862 -0.532 25109
3279 1 6 . 1 1 88 88 VAL C C 88 177.240 177.240 178.137 -0.897 25109
3280 1 6 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.522 1.727 25109
3281 1 6 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.090 0.439 25109
3282 1 6 . 1 1 88 88 VAL H H 88 8.291 8.291 8.272 0.019 25109
3283 1 6 . 1 1 89 89 ALA N N 89 120.709 120.709 122.329 -1.620 25109
3284 1 6 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.058 -0.143 25109
3285 1 6 . 1 1 89 89 ALA C C 89 180.186 180.186 179.888 0.298 25109
3286 1 6 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.511 0.548 25109
3287 1 6 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.375 -0.140 25109
3288 1 6 . 1 1 89 89 ALA H H 89 8.548 8.548 8.464 0.084 25109
3289 1 6 . 1 1 90 90 SER N N 90 113.035 113.035 113.308 -0.273 25109
3290 1 6 . 1 1 90 90 SER HA H 90 4.047 4.047 4.217 -0.170 25109
3291 1 6 . 1 1 90 90 SER C C 90 177.564 177.564 176.298 1.266 25109
3292 1 6 . 1 1 90 90 SER CA C 90 61.771 61.771 61.265 0.506 25109
3293 1 6 . 1 1 90 90 SER CB C 90 62.907 62.907 63.155 -0.248 25109
3294 1 6 . 1 1 90 90 SER H H 90 7.969 7.969 8.110 -0.141 25109
3295 1 6 . 1 1 91 91 VAL N N 91 123.417 123.417 122.069 1.348 25109
3296 1 6 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.725 -0.378 25109
3297 1 6 . 1 1 91 91 VAL C C 91 178.428 178.428 178.111 0.317 25109
3298 1 6 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.231 0.898 25109
3299 1 6 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.207 0.564 25109
3300 1 6 . 1 1 91 91 VAL H H 91 7.713 7.713 7.156 0.557 25109
3301 1 6 . 1 1 92 92 TYR N N 92 121.458 121.458 121.082 0.376 25109
3302 1 6 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.277 -0.086 25109
3303 1 6 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.960 0.034 25109
3304 1 6 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.343 0.642 25109
3305 1 6 . 1 1 92 92 TYR H H 92 8.395 8.395 8.273 0.122 25109
3306 1 6 . 1 1 93 93 GLN N N 93 115.549 115.549 118.940 -3.391 25109
3307 1 6 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.070 -0.359 25109
3308 1 6 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.766 0.328 25109
3309 1 6 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.412 -0.114 25109
3310 1 6 . 1 1 93 93 GLN H H 93 8.167 8.167 7.961 0.206 25109
3311 1 6 . 1 1 94 94 SER N N 94 115.923 115.923 111.771 4.152 25109
3312 1 6 . 1 1 94 94 SER HA H 94 4.096 4.096 4.349 -0.253 25109
3313 1 6 . 1 1 94 94 SER CA C 94 60.971 60.971 57.952 3.019 25109
3314 1 6 . 1 1 94 94 SER CB C 94 62.635 62.635 63.807 -1.172 25109
3315 1 6 . 1 1 94 94 SER H H 94 7.642 7.642 7.613 0.029 25109
3316 1 6 . 1 1 95 95 TYR N N 95 119.565 119.565 121.456 -1.891 25109
3317 1 6 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.491 0.268 25109
3318 1 6 . 1 1 95 95 TYR C C 95 175.334 175.334 174.061 1.273 25109
3319 1 6 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.488 0.210 25109
3320 1 6 . 1 1 95 95 TYR CB C 95 39.319 39.319 39.184 0.135 25109
3321 1 6 . 1 1 95 95 TYR H H 95 7.069 7.069 7.430 -0.361 25109
3322 1 6 . 1 1 96 96 GLN N N 96 119.872 119.872 118.731 1.141 25109
3323 1 6 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.930 0.435 25109
3324 1 6 . 1 1 96 96 GLN C C 96 173.612 173.612 174.687 -1.075 25109
3325 1 6 . 1 1 96 96 GLN CA C 96 54.336 54.336 56.093 -1.757 25109
3326 1 6 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.182 1.312 25109
3327 1 6 . 1 1 96 96 GLN H H 96 7.409 7.409 8.726 -1.317 25109
3328 1 6 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.187 0.131 25109
3329 1 6 . 1 1 97 97 PRO CA C 97 63.014 63.014 65.184 -2.170 25109
3330 1 6 . 1 1 97 97 PRO CB C 97 32.098 32.098 31.964 0.134 25109
3331 1 6 . 1 1 98 98 ARG N N 98 121.759 121.759 112.019 9.740 25109
3332 1 6 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.638 -0.296 25109
3333 1 6 . 1 1 98 98 ARG C C 98 176.848 176.848 175.102 1.746 25109
3334 1 6 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.611 1.609 25109
3335 1 6 . 1 1 98 98 ARG CB C 98 31.087 31.087 29.598 1.489 25109
3336 1 6 . 1 1 98 98 ARG H H 98 8.423 8.423 8.072 0.351 25109
3337 1 6 . 1 1 99 99 THR N N 99 115.292 115.292 119.541 -4.249 25109
3338 1 6 . 1 1 99 99 THR HA H 99 4.323 4.323 4.502 -0.179 25109
3339 1 6 . 1 1 99 99 THR C C 99 174.350 174.350 174.229 0.121 25109
3340 1 6 . 1 1 99 99 THR CA C 99 61.906 61.906 62.381 -0.475 25109
3341 1 6 . 1 1 99 99 THR CB C 99 70.180 70.180 68.249 1.931 25109
3342 1 6 . 1 1 99 99 THR H H 99 8.179 8.179 7.659 0.520 25109
3343 1 7 . 1 1 0 0 SER N N 0 115.693 115.693 117.421 -1.728 25109
3344 1 7 . 1 1 0 0 SER HA H 0 4.531 4.531 4.256 0.275 25109
3345 1 7 . 1 1 0 0 SER C C 0 174.557 174.557 174.888 -0.331 25109
3346 1 7 . 1 1 0 0 SER CA C 0 58.478 58.478 59.520 -1.042 25109
3347 1 7 . 1 1 0 0 SER CB C 0 64.380 64.380 63.554 0.826 25109
3348 1 7 . 1 1 0 0 SER H H 0 8.631 8.631 8.510 0.121 25109
3349 1 7 . 1 1 1 1 MET N N 1 123.111 123.111 119.456 3.655 25109
3350 1 7 . 1 1 1 1 MET HA H 1 4.728 4.728 4.422 0.306 25109
3351 1 7 . 1 1 1 1 MET C C 1 174.846 174.846 173.628 1.218 25109
3352 1 7 . 1 1 1 1 MET CA C 1 55.655 55.655 54.749 0.906 25109
3353 1 7 . 1 1 1 1 MET CB C 1 32.035 32.035 32.446 -0.411 25109
3354 1 7 . 1 1 1 1 MET H H 1 8.641 8.641 8.069 0.572 25109
3355 1 7 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.961 -0.484 25109
3356 1 7 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.699 -0.699 25109
3357 1 7 . 1 1 3 3 PHE N N 3 121.126 121.126 123.801 -2.675 25109
3358 1 7 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.593 -0.227 25109
3359 1 7 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.754 1.108 25109
3360 1 7 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.497 -1.129 25109
3361 1 7 . 1 1 3 3 PHE H H 3 8.177 8.177 9.769 -1.592 25109
3362 1 7 . 1 1 4 4 ALA N N 4 121.170 121.170 122.488 -1.318 25109
3363 1 7 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.254 -0.419 25109
3364 1 7 . 1 1 4 4 ALA C C 4 181.522 181.522 179.209 2.313 25109
3365 1 7 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.322 0.132 25109
3366 1 7 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.408 1.028 25109
3367 1 7 . 1 1 4 4 ALA H H 4 8.444 8.444 8.956 -0.512 25109
3368 1 7 . 1 1 5 5 GLU N N 5 118.932 118.932 119.215 -0.283 25109
3369 1 7 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.860 -0.005 25109
3370 1 7 . 1 1 5 5 GLU C C 5 177.971 177.971 178.078 -0.107 25109
3371 1 7 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.681 0.950 25109
3372 1 7 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.893 -0.132 25109
3373 1 7 . 1 1 5 5 GLU H H 5 8.454 8.454 8.649 -0.195 25109
3374 1 7 . 1 1 6 6 ASP N N 6 120.471 120.471 119.729 0.742 25109
3375 1 7 . 1 1 6 6 ASP C C 6 178.885 178.885 178.187 0.698 25109
3376 1 7 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.466 -0.394 25109
3377 1 7 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.733 -1.601 25109
3378 1 7 . 1 1 6 6 ASP H H 6 8.316 8.316 8.338 -0.022 25109
3379 1 7 . 1 1 7 7 LYS N N 7 118.335 118.335 119.373 -1.038 25109
3380 1 7 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.932 -0.242 25109
3381 1 7 . 1 1 7 7 LYS C C 7 180.080 180.080 179.151 0.929 25109
3382 1 7 . 1 1 7 7 LYS CA C 7 58.720 58.720 59.682 -0.962 25109
3383 1 7 . 1 1 7 7 LYS CB C 7 31.794 31.794 32.198 -0.404 25109
3384 1 7 . 1 1 7 7 LYS H H 7 8.249 8.249 7.827 0.422 25109
3385 1 7 . 1 1 8 8 THR N N 8 119.222 119.222 116.880 2.342 25109
3386 1 7 . 1 1 8 8 THR HA H 8 3.975 3.975 3.928 0.047 25109
3387 1 7 . 1 1 8 8 THR CA C 8 68.453 68.453 67.006 1.447 25109
3388 1 7 . 1 1 8 8 THR CB C 8 67.387 67.387 68.553 -1.166 25109
3389 1 7 . 1 1 8 8 THR H H 8 7.897 7.897 8.201 -0.304 25109
3390 1 7 . 1 1 9 9 TYR N N 9 123.054 123.054 123.042 0.012 25109
3391 1 7 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.431 -0.178 25109
3392 1 7 . 1 1 9 9 TYR C C 9 177.441 177.441 177.351 0.090 25109
3393 1 7 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.676 -0.778 25109
3394 1 7 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.850 -1.001 25109
3395 1 7 . 1 1 9 9 TYR H H 9 8.605 8.605 8.371 0.234 25109
3396 1 7 . 1 1 10 10 LYS N N 10 118.366 118.366 118.172 0.194 25109
3397 1 7 . 1 1 10 10 LYS HA H 10 3.594 3.594 4.066 -0.472 25109
3398 1 7 . 1 1 10 10 LYS C C 10 178.885 178.885 179.258 -0.373 25109
3399 1 7 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.886 1.157 25109
3400 1 7 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.916 0.129 25109
3401 1 7 . 1 1 10 10 LYS H H 10 8.066 8.066 8.573 -0.507 25109
3402 1 7 . 1 1 11 11 TYR N N 11 120.539 120.539 120.877 -0.338 25109
3403 1 7 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.219 -0.229 25109
3404 1 7 . 1 1 11 11 TYR C C 11 178.233 178.233 178.281 -0.048 25109
3405 1 7 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.675 0.853 25109
3406 1 7 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.839 -0.476 25109
3407 1 7 . 1 1 11 11 TYR H H 11 7.875 7.875 8.203 -0.328 25109
3408 1 7 . 1 1 12 12 ILE N N 12 121.893 121.893 118.815 3.078 25109
3409 1 7 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.937 -0.841 25109
3410 1 7 . 1 1 12 12 ILE C C 12 177.015 177.015 178.239 -1.224 25109
3411 1 7 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.195 2.568 25109
3412 1 7 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.603 0.949 25109
3413 1 7 . 1 1 12 12 ILE H H 12 8.154 8.154 8.880 -0.726 25109
3414 1 7 . 1 1 13 13 CYS N N 13 113.894 113.894 118.738 -4.844 25109
3415 1 7 . 1 1 13 13 CYS HA H 13 3.887 3.887 4.342 -0.455 25109
3416 1 7 . 1 1 13 13 CYS C C 13 178.288 178.288 177.287 1.001 25109
3417 1 7 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.356 2.981 25109
3418 1 7 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.520 0.485 25109
3419 1 7 . 1 1 13 13 CYS H H 13 7.551 7.551 8.597 -1.046 25109
3420 1 7 . 1 1 14 14 ARG N N 14 119.228 119.228 119.608 -0.380 25109
3421 1 7 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.088 -0.018 25109
3422 1 7 . 1 1 14 14 ARG C C 14 177.127 177.127 176.768 0.359 25109
3423 1 7 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.909 -0.415 25109
3424 1 7 . 1 1 14 14 ARG CB C 14 30.422 30.422 29.922 0.500 25109
3425 1 7 . 1 1 14 14 ARG H H 14 7.991 7.991 7.535 0.456 25109
3426 1 7 . 1 1 15 15 ASN N N 15 117.367 117.367 116.146 1.221 25109
3427 1 7 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.797 0.172 25109
3428 1 7 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.198 0.565 25109
3429 1 7 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.101 0.484 25109
3430 1 7 . 1 1 15 15 ASN H H 15 7.643 7.643 7.785 -0.142 25109
3431 1 7 . 1 1 16 16 PHE N N 16 122.356 122.356 123.158 -0.802 25109
3432 1 7 . 1 1 16 16 PHE HA H 16 4.216 4.216 2.967 1.249 25109
3433 1 7 . 1 1 16 16 PHE C C 16 178.084 178.084 176.673 1.411 25109
3434 1 7 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.628 1.549 25109
3435 1 7 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.657 1.932 25109
3436 1 7 . 1 1 16 16 PHE H H 16 6.992 6.992 7.382 -0.390 25109
3437 1 7 . 1 1 17 17 SER N N 17 112.937 112.937 113.730 -0.793 25109
3438 1 7 . 1 1 17 17 SER HA H 17 4.199 4.199 3.923 0.276 25109
3439 1 7 . 1 1 17 17 SER C C 17 176.726 176.726 177.024 -0.298 25109
3440 1 7 . 1 1 17 17 SER CA C 17 62.052 62.052 60.741 1.311 25109
3441 1 7 . 1 1 17 17 SER CB C 17 62.552 62.552 62.530 0.022 25109
3442 1 7 . 1 1 17 17 SER H H 17 8.840 8.840 8.236 0.604 25109
3443 1 7 . 1 1 18 18 ASN N N 18 118.809 118.809 121.589 -2.780 25109
3444 1 7 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.450 -0.092 25109
3445 1 7 . 1 1 18 18 ASN C C 18 175.967 175.967 177.496 -1.529 25109
3446 1 7 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.717 -0.807 25109
3447 1 7 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.561 -0.733 25109
3448 1 7 . 1 1 18 18 ASN H H 18 8.130 8.130 8.386 -0.256 25109
3449 1 7 . 1 1 19 19 PHE N N 19 115.750 115.750 112.778 2.972 25109
3450 1 7 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.816 -0.531 25109
3451 1 7 . 1 1 19 19 PHE C C 19 175.370 175.370 175.472 -0.102 25109
3452 1 7 . 1 1 19 19 PHE CA C 19 58.862 58.862 55.720 3.142 25109
3453 1 7 . 1 1 19 19 PHE CB C 19 39.878 39.878 37.589 2.289 25109
3454 1 7 . 1 1 19 19 PHE H H 19 8.062 8.062 7.222 0.840 25109
3455 1 7 . 1 1 20 20 CYS N N 20 113.958 113.958 118.190 -4.232 25109
3456 1 7 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.048 -0.105 25109
3457 1 7 . 1 1 20 20 CYS C C 20 173.823 173.823 174.960 -1.137 25109
3458 1 7 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.719 3.069 25109
3459 1 7 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.736 -0.353 25109
3460 1 7 . 1 1 20 20 CYS H H 20 6.850 6.850 7.275 -0.425 25109
3461 1 7 . 1 1 21 21 ASN N N 21 116.691 116.691 120.314 -3.623 25109
3462 1 7 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.818 -0.074 25109
3463 1 7 . 1 1 21 21 ASN C C 21 175.299 175.299 173.868 1.431 25109
3464 1 7 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.388 0.902 25109
3465 1 7 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.554 -0.241 25109
3466 1 7 . 1 1 21 21 ASN H H 21 8.251 8.251 7.712 0.539 25109
3467 1 7 . 1 1 22 22 VAL N N 22 122.431 122.431 120.508 1.923 25109
3468 1 7 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.281 -0.731 25109
3469 1 7 . 1 1 22 22 VAL C C 22 174.034 174.034 174.138 -0.104 25109
3470 1 7 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.299 3.638 25109
3471 1 7 . 1 1 22 22 VAL CB C 22 31.523 31.523 34.975 -3.452 25109
3472 1 7 . 1 1 22 22 VAL H H 22 7.573 7.573 7.480 0.093 25109
3473 1 7 . 1 1 23 23 ASP N N 23 127.219 127.219 121.465 5.754 25109
3474 1 7 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.767 -1.581 25109
3475 1 7 . 1 1 23 23 ASP CB C 23 38.793 38.793 42.499 -3.706 25109
3476 1 7 . 1 1 23 23 ASP H H 23 8.687 8.687 8.543 0.144 25109
3477 1 7 . 1 1 24 24 VAL N N 24 127.835 127.835 116.597 11.238 25109
3478 1 7 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.304 -1.011 25109
3479 1 7 . 1 1 24 24 VAL C C 24 176.867 176.867 177.053 -0.186 25109
3480 1 7 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.400 3.763 25109
3481 1 7 . 1 1 24 24 VAL CB C 24 32.015 32.015 34.163 -2.148 25109
3482 1 7 . 1 1 24 24 VAL H H 24 9.409 9.409 8.121 1.288 25109
3483 1 7 . 1 1 25 25 VAL N N 25 114.324 114.324 117.878 -3.554 25109
3484 1 7 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.027 -0.508 25109
3485 1 7 . 1 1 25 25 VAL C C 25 178.006 178.006 177.280 0.726 25109
3486 1 7 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.163 1.525 25109
3487 1 7 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.456 0.076 25109
3488 1 7 . 1 1 25 25 VAL H H 25 8.038 8.038 7.874 0.164 25109
3489 1 7 . 1 1 26 26 GLU N N 26 117.009 117.009 118.607 -1.598 25109
3490 1 7 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.373 -0.282 25109
3491 1 7 . 1 1 26 26 GLU C C 26 177.303 177.303 177.051 0.252 25109
3492 1 7 . 1 1 26 26 GLU CA C 26 57.432 57.432 57.799 -0.367 25109
3493 1 7 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.761 -0.796 25109
3494 1 7 . 1 1 26 26 GLU H H 26 7.220 7.220 8.998 -1.778 25109
3495 1 7 . 1 1 27 27 ILE N N 27 114.080 114.080 119.120 -5.040 25109
3496 1 7 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.927 0.434 25109
3497 1 7 . 1 1 27 27 ILE CA C 27 62.732 62.732 62.877 -0.145 25109
3498 1 7 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.967 0.624 25109
3499 1 7 . 1 1 27 27 ILE H H 27 7.647 7.647 7.530 0.117 25109
3500 1 7 . 1 1 28 28 LEU N N 28 121.867 121.867 121.658 0.209 25109
3501 1 7 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.163 -0.226 25109
3502 1 7 . 1 1 28 28 LEU C C 28 175.756 175.756 176.246 -0.490 25109
3503 1 7 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.832 -0.865 25109
3504 1 7 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.931 0.582 25109
3505 1 7 . 1 1 28 28 LEU H H 28 7.434 7.434 7.783 -0.349 25109
3506 1 7 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.365 -0.155 25109
3507 1 7 . 1 1 29 29 PRO CB C 29 31.310 31.310 30.996 0.314 25109
3508 1 7 . 1 1 30 30 TYR N N 30 113.832 113.832 116.844 -3.012 25109
3509 1 7 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.573 -0.071 25109
3510 1 7 . 1 1 30 30 TYR C C 30 174.386 174.386 175.077 -0.691 25109
3511 1 7 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.562 -1.868 25109
3512 1 7 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.930 -0.831 25109
3513 1 7 . 1 1 30 30 TYR H H 30 7.628 7.628 7.676 -0.048 25109
3514 1 7 . 1 1 31 31 LEU N N 31 118.331 118.331 119.358 -1.027 25109
3515 1 7 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.844 0.033 25109
3516 1 7 . 1 1 31 31 LEU C C 31 173.849 173.849 175.270 -1.421 25109
3517 1 7 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.815 -0.123 25109
3518 1 7 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.032 0.770 25109
3519 1 7 . 1 1 31 31 LEU H H 31 7.619 7.619 7.596 0.023 25109
3520 1 7 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.469 -0.114 25109
3521 1 7 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.724 -0.314 25109
3522 1 7 . 1 1 33 33 CYS N N 33 110.978 110.978 115.216 -4.238 25109
3523 1 7 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.135 0.206 25109
3524 1 7 . 1 1 33 33 CYS C C 33 174.139 174.139 173.725 0.414 25109
3525 1 7 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.326 -2.114 25109
3526 1 7 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.496 1.426 25109
3527 1 7 . 1 1 33 33 CYS H H 33 6.414 6.414 7.463 -1.049 25109
3528 1 7 . 1 1 34 34 LEU N N 34 123.111 123.111 120.996 2.115 25109
3529 1 7 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.483 0.123 25109
3530 1 7 . 1 1 34 34 LEU C C 34 176.646 176.646 176.180 0.466 25109
3531 1 7 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.019 -0.128 25109
3532 1 7 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.492 -0.801 25109
3533 1 7 . 1 1 34 34 LEU H H 34 7.550 7.550 7.295 0.255 25109
3534 1 7 . 1 1 35 35 THR N N 35 113.831 113.831 117.765 -3.934 25109
3535 1 7 . 1 1 35 35 THR HA H 35 4.205 4.205 4.228 -0.023 25109
3536 1 7 . 1 1 35 35 THR C C 35 175.324 175.324 175.908 -0.584 25109
3537 1 7 . 1 1 35 35 THR CA C 35 61.200 61.200 62.120 -0.920 25109
3538 1 7 . 1 1 35 35 THR CB C 35 71.318 71.318 69.783 1.535 25109
3539 1 7 . 1 1 35 35 THR H H 35 8.586 8.586 7.960 0.626 25109
3540 1 7 . 1 1 36 36 ALA N N 36 124.128 124.128 127.774 -3.646 25109
3541 1 7 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.018 -0.094 25109
3542 1 7 . 1 1 36 36 ALA C C 36 180.397 180.397 179.813 0.584 25109
3543 1 7 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.745 0.175 25109
3544 1 7 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.540 -0.737 25109
3545 1 7 . 1 1 36 36 ALA H H 36 8.836 8.836 8.820 0.016 25109
3546 1 7 . 1 1 37 37 ARG N N 37 116.793 116.793 117.782 -0.989 25109
3547 1 7 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.013 -0.027 25109
3548 1 7 . 1 1 37 37 ARG C C 37 179.272 179.272 178.631 0.641 25109
3549 1 7 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.820 -0.588 25109
3550 1 7 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.751 0.154 25109
3551 1 7 . 1 1 37 37 ARG H H 37 8.060 8.060 8.648 -0.588 25109
3552 1 7 . 1 1 38 38 ASP N N 38 120.030 120.030 119.287 0.743 25109
3553 1 7 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.446 -0.198 25109
3554 1 7 . 1 1 38 38 ASP C C 38 178.885 178.885 178.398 0.487 25109
3555 1 7 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.134 0.053 25109
3556 1 7 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.699 0.234 25109
3557 1 7 . 1 1 38 38 ASP H H 38 7.782 7.782 7.591 0.191 25109
3558 1 7 . 1 1 39 39 GLN N N 39 118.223 118.223 119.201 -0.978 25109
3559 1 7 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.943 -0.278 25109
3560 1 7 . 1 1 39 39 GLN C C 39 178.041 178.041 178.113 -0.072 25109
3561 1 7 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.818 1.783 25109
3562 1 7 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.704 -0.907 25109
3563 1 7 . 1 1 39 39 GLN H H 39 8.476 8.476 8.444 0.032 25109
3564 1 7 . 1 1 40 40 ASP N N 40 117.908 117.908 119.673 -1.765 25109
3565 1 7 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.274 -0.021 25109
3566 1 7 . 1 1 40 40 ASP C C 40 178.639 178.639 178.390 0.249 25109
3567 1 7 . 1 1 40 40 ASP CA C 40 56.400 56.400 58.176 -1.776 25109
3568 1 7 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.831 -2.803 25109
3569 1 7 . 1 1 40 40 ASP H H 40 8.386 8.386 8.429 -0.043 25109
3570 1 7 . 1 1 41 41 ARG N N 41 120.990 120.990 118.060 2.930 25109
3571 1 7 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.141 -0.099 25109
3572 1 7 . 1 1 41 41 ARG C C 41 179.795 179.795 178.785 1.010 25109
3573 1 7 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.269 1.176 25109
3574 1 7 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.668 0.590 25109
3575 1 7 . 1 1 41 41 ARG H H 41 8.130 8.130 7.656 0.474 25109
3576 1 7 . 1 1 42 42 LEU N N 42 121.219 121.219 121.125 0.094 25109
3577 1 7 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.241 -0.306 25109
3578 1 7 . 1 1 42 42 LEU C C 42 178.850 178.850 179.685 -0.835 25109
3579 1 7 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.585 0.682 25109
3580 1 7 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.554 0.479 25109
3581 1 7 . 1 1 42 42 LEU H H 42 8.179 8.179 7.710 0.469 25109
3582 1 7 . 1 1 43 43 ARG N N 43 119.310 119.310 120.242 -0.932 25109
3583 1 7 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.992 -0.268 25109
3584 1 7 . 1 1 43 43 ARG C C 43 179.099 179.099 178.395 0.704 25109
3585 1 7 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.593 1.221 25109
3586 1 7 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.268 -0.089 25109
3587 1 7 . 1 1 43 43 ARG H H 43 8.296 8.296 8.516 -0.220 25109
3588 1 7 . 1 1 44 44 ALA N N 44 121.305 121.305 120.705 0.600 25109
3589 1 7 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.105 -0.002 25109
3590 1 7 . 1 1 44 44 ALA C C 44 180.924 180.924 179.983 0.941 25109
3591 1 7 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.082 0.143 25109
3592 1 7 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.187 -0.091 25109
3593 1 7 . 1 1 44 44 ALA H H 44 7.774 7.774 8.370 -0.596 25109
3594 1 7 . 1 1 45 45 THR N N 45 115.017 115.017 115.555 -0.538 25109
3595 1 7 . 1 1 45 45 THR HA H 45 3.879 3.879 3.992 -0.113 25109
3596 1 7 . 1 1 45 45 THR CA C 45 66.327 66.327 66.824 -0.497 25109
3597 1 7 . 1 1 45 45 THR CB C 45 68.809 68.809 68.350 0.459 25109
3598 1 7 . 1 1 45 45 THR H H 45 8.167 8.167 8.269 -0.102 25109
3599 1 7 . 1 1 46 46 CYS N N 46 123.609 123.609 119.362 4.247 25109
3600 1 7 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.485 -0.466 25109
3601 1 7 . 1 1 46 46 CYS C C 46 178.077 178.077 175.604 2.473 25109
3602 1 7 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.628 1.317 25109
3603 1 7 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.863 -0.725 25109
3604 1 7 . 1 1 46 46 CYS H H 46 8.084 8.084 7.749 0.335 25109
3605 1 7 . 1 1 47 47 THR N N 47 115.520 115.520 112.741 2.779 25109
3606 1 7 . 1 1 47 47 THR HA H 47 3.915 3.915 4.412 -0.497 25109
3607 1 7 . 1 1 47 47 THR CA C 47 66.063 66.063 62.421 3.642 25109
3608 1 7 . 1 1 47 47 THR CB C 47 69.245 69.245 68.414 0.831 25109
3609 1 7 . 1 1 47 47 THR H H 47 7.735 7.735 7.632 0.103 25109
3610 1 7 . 1 1 48 48 LEU N N 48 120.099 120.099 121.312 -1.213 25109
3611 1 7 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.437 -0.211 25109
3612 1 7 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.703 0.860 25109
3613 1 7 . 1 1 48 48 LEU CB C 48 43.625 43.625 43.033 0.592 25109
3614 1 7 . 1 1 48 48 LEU H H 48 7.464 7.464 7.870 -0.406 25109
3615 1 7 . 1 1 49 49 SER N N 49 111.979 111.979 112.992 -1.013 25109
3616 1 7 . 1 1 49 49 SER HA H 49 4.661 4.661 4.612 0.049 25109
3617 1 7 . 1 1 49 49 SER C C 49 175.581 175.581 175.279 0.302 25109
3618 1 7 . 1 1 49 49 SER CA C 49 59.590 59.590 58.760 0.830 25109
3619 1 7 . 1 1 49 49 SER CB C 49 65.335 65.335 64.745 0.590 25109
3620 1 7 . 1 1 49 49 SER H H 49 8.781 8.781 8.273 0.508 25109
3621 1 7 . 1 1 50 50 GLY N N 50 110.194 110.194 108.695 1.499 25109
3622 1 7 . 1 1 50 50 GLY C C 50 175.123 175.123 173.093 2.030 25109
3623 1 7 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.271 -0.369 25109
3624 1 7 . 1 1 50 50 GLY H H 50 7.955 7.955 7.497 0.458 25109
3625 1 7 . 1 1 51 51 ASN N N 51 121.050 121.050 119.068 1.982 25109
3626 1 7 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.590 -0.340 25109
3627 1 7 . 1 1 51 51 ASN C C 51 176.403 176.403 177.164 -0.761 25109
3628 1 7 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.850 3.453 25109
3629 1 7 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.525 3.074 25109
3630 1 7 . 1 1 51 51 ASN H H 51 8.898 8.898 8.735 0.163 25109
3631 1 7 . 1 1 52 52 ARG N N 52 119.825 119.825 120.093 -0.268 25109
3632 1 7 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.046 -0.008 25109
3633 1 7 . 1 1 52 52 ARG C C 52 178.850 178.850 177.717 1.133 25109
3634 1 7 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.400 0.664 25109
3635 1 7 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.852 0.171 25109
3636 1 7 . 1 1 52 52 ARG H H 52 8.696 8.696 8.685 0.011 25109
3637 1 7 . 1 1 53 53 ASP N N 53 116.032 116.032 116.439 -0.407 25109
3638 1 7 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.663 -0.117 25109
3639 1 7 . 1 1 53 53 ASP C C 53 178.996 178.996 178.885 0.111 25109
3640 1 7 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.648 -1.569 25109
3641 1 7 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.610 -2.239 25109
3642 1 7 . 1 1 53 53 ASP H H 53 9.036 9.036 8.561 0.475 25109
3643 1 7 . 1 1 54 54 THR N N 54 115.848 115.848 116.613 -0.765 25109
3644 1 7 . 1 1 54 54 THR HA H 54 3.746 3.746 4.615 -0.869 25109
3645 1 7 . 1 1 54 54 THR CA C 54 67.885 67.885 64.302 3.583 25109
3646 1 7 . 1 1 54 54 THR CB C 54 66.953 66.953 68.894 -1.942 25109
3647 1 7 . 1 1 54 54 THR H H 54 7.782 7.782 7.678 0.104 25109
3648 1 7 . 1 1 55 55 LEU N N 55 125.987 125.987 123.207 2.780 25109
3649 1 7 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.221 -0.667 25109
3650 1 7 . 1 1 55 55 LEU C C 55 177.901 177.901 178.432 -0.531 25109
3651 1 7 . 1 1 55 55 LEU CA C 55 58.453 58.453 59.047 -0.594 25109
3652 1 7 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.598 0.265 25109
3653 1 7 . 1 1 55 55 LEU H H 55 8.740 8.740 8.715 0.025 25109
3654 1 7 . 1 1 56 56 TRP N N 56 116.672 116.672 121.328 -4.656 25109
3655 1 7 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.457 -0.377 25109
3656 1 7 . 1 1 56 56 TRP C C 56 179.588 179.588 178.241 1.347 25109
3657 1 7 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.096 0.385 25109
3658 1 7 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.750 -0.558 25109
3659 1 7 . 1 1 56 56 TRP H H 56 7.642 7.642 8.210 -0.568 25109
3660 1 7 . 1 1 57 57 HIS N N 57 115.754 115.754 117.727 -1.973 25109
3661 1 7 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.009 0.267 25109
3662 1 7 . 1 1 57 57 HIS C C 57 177.514 177.514 177.679 -0.165 25109
3663 1 7 . 1 1 57 57 HIS CA C 57 58.952 58.952 60.453 -1.501 25109
3664 1 7 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.823 -1.821 25109
3665 1 7 . 1 1 57 57 HIS H H 57 7.407 7.407 7.651 -0.244 25109
3666 1 7 . 1 1 58 58 LEU N N 58 123.934 123.934 122.002 1.932 25109
3667 1 7 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.900 -0.113 25109
3668 1 7 . 1 1 58 58 LEU C C 58 178.115 178.115 177.879 0.236 25109
3669 1 7 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.315 0.594 25109
3670 1 7 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.480 -0.665 25109
3671 1 7 . 1 1 58 58 LEU H H 58 8.996 8.996 8.833 0.163 25109
3672 1 7 . 1 1 59 59 PHE N N 59 117.721 117.721 117.109 0.612 25109
3673 1 7 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.768 0.167 25109
3674 1 7 . 1 1 59 59 PHE C C 59 176.987 176.987 177.881 -0.894 25109
3675 1 7 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.448 -2.335 25109
3676 1 7 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.172 -1.212 25109
3677 1 7 . 1 1 59 59 PHE H H 59 8.201 8.201 8.829 -0.628 25109
3678 1 7 . 1 1 60 60 ASN N N 60 115.695 115.695 116.382 -0.687 25109
3679 1 7 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.153 -0.234 25109
3680 1 7 . 1 1 60 60 ASN C C 60 176.670 176.670 176.719 -0.049 25109
3681 1 7 . 1 1 60 60 ASN CA C 60 56.756 56.756 55.929 0.827 25109
3682 1 7 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.369 0.949 25109
3683 1 7 . 1 1 60 60 ASN H H 60 7.666 7.666 8.227 -0.561 25109
3684 1 7 . 1 1 61 61 THR N N 61 115.110 115.110 117.238 -2.128 25109
3685 1 7 . 1 1 61 61 THR HA H 61 3.733 3.733 4.221 -0.488 25109
3686 1 7 . 1 1 61 61 THR CA C 61 66.319 66.319 66.020 0.299 25109
3687 1 7 . 1 1 61 61 THR CB C 61 69.174 69.174 68.925 0.249 25109
3688 1 7 . 1 1 61 61 THR H H 61 7.782 7.782 7.590 0.192 25109
3689 1 7 . 1 1 62 62 LEU N N 62 121.559 121.559 123.181 -1.622 25109
3690 1 7 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.814 -0.325 25109
3691 1 7 . 1 1 62 62 LEU C C 62 176.600 176.600 178.045 -1.445 25109
3692 1 7 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.946 0.019 25109
3693 1 7 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.918 1.417 25109
3694 1 7 . 1 1 62 62 LEU H H 62 8.362 8.362 8.281 0.081 25109
3695 1 7 . 1 1 63 63 GLN N N 63 109.150 109.150 114.300 -5.150 25109
3696 1 7 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.813 -1.736 25109
3697 1 7 . 1 1 63 63 GLN C C 63 175.194 175.194 176.447 -1.253 25109
3698 1 7 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.470 -1.204 25109
3699 1 7 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.840 -2.146 25109
3700 1 7 . 1 1 63 63 GLN H H 63 6.458 6.458 7.641 -1.183 25109
3701 1 7 . 1 1 64 64 ARG N N 64 116.029 116.029 116.636 -0.607 25109
3702 1 7 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.416 -0.318 25109
3703 1 7 . 1 1 64 64 ARG C C 64 176.459 176.459 175.744 0.715 25109
3704 1 7 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.696 0.447 25109
3705 1 7 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.892 -0.308 25109
3706 1 7 . 1 1 64 64 ARG H H 64 6.596 6.596 7.399 -0.803 25109
3707 1 7 . 1 1 65 65 ARG N N 65 120.422 120.422 119.401 1.021 25109
3708 1 7 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.875 -0.042 25109
3709 1 7 . 1 1 65 65 ARG C C 65 173.436 173.436 173.594 -0.158 25109
3710 1 7 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.470 0.075 25109
3711 1 7 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.183 -1.187 25109
3712 1 7 . 1 1 65 65 ARG H H 65 7.932 7.932 7.853 0.079 25109
3713 1 7 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.588 -0.014 25109
3714 1 7 . 1 1 66 66 PRO CB C 66 32.059 32.059 32.177 -0.118 25109
3715 1 7 . 1 1 67 67 GLY N N 67 111.953 111.953 111.878 0.075 25109
3716 1 7 . 1 1 67 67 GLY C C 67 177.057 177.057 176.097 0.960 25109
3717 1 7 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.737 0.570 25109
3718 1 7 . 1 1 67 67 GLY H H 67 9.198 9.198 9.413 -0.215 25109
3719 1 7 . 1 1 68 68 TRP N N 68 117.467 117.467 118.743 -1.276 25109
3720 1 7 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.425 -0.083 25109
3721 1 7 . 1 1 68 68 TRP C C 68 177.690 177.690 176.363 1.327 25109
3722 1 7 . 1 1 68 68 TRP CA C 68 60.116 60.116 59.770 0.346 25109
3723 1 7 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.011 1.179 25109
3724 1 7 . 1 1 68 68 TRP H H 68 7.647 7.647 7.493 0.154 25109
3725 1 7 . 1 1 69 69 VAL N N 69 121.482 121.482 120.146 1.336 25109
3726 1 7 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.226 -0.589 25109
3727 1 7 . 1 1 69 69 VAL C C 69 177.993 177.993 178.048 -0.055 25109
3728 1 7 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.786 1.680 25109
3729 1 7 . 1 1 69 69 VAL CB C 69 30.026 30.026 29.807 0.219 25109
3730 1 7 . 1 1 69 69 VAL H H 69 6.666 6.666 7.142 -0.476 25109
3731 1 7 . 1 1 70 70 GLU N N 70 116.350 116.350 118.981 -2.631 25109
3732 1 7 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.768 0.057 25109
3733 1 7 . 1 1 70 70 GLU C C 70 180.362 180.362 179.280 1.082 25109
3734 1 7 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.238 -0.017 25109
3735 1 7 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.761 -1.456 25109
3736 1 7 . 1 1 70 70 GLU H H 70 7.410 7.410 7.508 -0.098 25109
3737 1 7 . 1 1 71 71 TYR N N 71 116.750 116.750 118.533 -1.783 25109
3738 1 7 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.338 0.112 25109
3739 1 7 . 1 1 71 71 TYR C C 71 178.411 178.411 178.470 -0.059 25109
3740 1 7 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.743 0.859 25109
3741 1 7 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.355 -0.000 25109
3742 1 7 . 1 1 71 71 TYR H H 71 7.159 7.159 7.264 -0.105 25109
3743 1 7 . 1 1 72 72 PHE N N 72 121.610 121.610 121.447 0.163 25109
3744 1 7 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.212 0.290 25109
3745 1 7 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.278 -0.458 25109
3746 1 7 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.203 0.846 25109
3747 1 7 . 1 1 72 72 PHE H H 72 9.007 9.007 8.500 0.507 25109
3748 1 7 . 1 1 73 73 ILE N N 73 119.200 119.200 118.516 0.684 25109
3749 1 7 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.391 -0.211 25109
3750 1 7 . 1 1 73 73 ILE C C 73 177.620 177.620 177.545 0.075 25109
3751 1 7 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.364 1.833 25109
3752 1 7 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.425 1.598 25109
3753 1 7 . 1 1 73 73 ILE H H 73 8.644 8.644 8.550 0.094 25109
3754 1 7 . 1 1 74 74 ALA N N 74 119.624 119.624 121.248 -1.624 25109
3755 1 7 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.026 -0.072 25109
3756 1 7 . 1 1 74 74 ALA C C 74 181.030 181.030 179.088 1.942 25109
3757 1 7 . 1 1 74 74 ALA CA C 74 55.411 55.411 55.317 0.094 25109
3758 1 7 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.957 0.179 25109
3759 1 7 . 1 1 74 74 ALA H H 74 7.476 7.476 7.638 -0.162 25109
3760 1 7 . 1 1 75 75 ALA N N 75 123.625 123.625 121.870 1.755 25109
3761 1 7 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.610 0.228 25109
3762 1 7 . 1 1 75 75 ALA C C 75 179.272 179.272 179.634 -0.362 25109
3763 1 7 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.718 0.385 25109
3764 1 7 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.099 1.494 25109
3765 1 7 . 1 1 75 75 ALA H H 75 8.524 8.524 7.224 1.300 25109
3766 1 7 . 1 1 76 76 LEU N N 76 118.114 118.114 119.861 -1.747 25109
3767 1 7 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.915 -0.243 25109
3768 1 7 . 1 1 76 76 LEU C C 76 180.001 180.001 179.022 0.979 25109
3769 1 7 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.036 1.220 25109
3770 1 7 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.051 1.568 25109
3771 1 7 . 1 1 76 76 LEU H H 76 8.153 8.153 7.438 0.715 25109
3772 1 7 . 1 1 77 77 ARG N N 77 117.830 117.830 119.418 -1.588 25109
3773 1 7 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.985 -0.538 25109
3774 1 7 . 1 1 77 77 ARG C C 77 180.889 180.889 179.390 1.499 25109
3775 1 7 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.454 1.612 25109
3776 1 7 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.947 -0.750 25109
3777 1 7 . 1 1 77 77 ARG H H 77 7.945 7.945 7.760 0.185 25109
3778 1 7 . 1 1 78 78 GLY N N 78 110.202 110.202 107.661 2.541 25109
3779 1 7 . 1 1 78 78 GLY C C 78 174.807 174.807 175.446 -0.639 25109
3780 1 7 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.651 -0.091 25109
3781 1 7 . 1 1 78 78 GLY H H 78 8.269 8.269 8.413 -0.144 25109
3782 1 7 . 1 1 79 79 CYS N N 79 115.567 115.567 116.361 -0.794 25109
3783 1 7 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.523 -0.134 25109
3784 1 7 . 1 1 79 79 CYS C C 79 173.025 173.025 174.788 -1.763 25109
3785 1 7 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.178 2.779 25109
3786 1 7 . 1 1 79 79 CYS CB C 79 27.805 27.805 26.996 0.809 25109
3787 1 7 . 1 1 79 79 CYS H H 79 7.132 7.132 7.426 -0.294 25109
3788 1 7 . 1 1 80 80 GLU N N 80 111.759 111.759 116.227 -4.468 25109
3789 1 7 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.934 -0.201 25109
3790 1 7 . 1 1 80 80 GLU C C 80 175.827 175.827 175.565 0.262 25109
3791 1 7 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.999 -0.532 25109
3792 1 7 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.923 -2.206 25109
3793 1 7 . 1 1 80 80 GLU H H 80 7.772 7.772 7.972 -0.200 25109
3794 1 7 . 1 1 81 81 LEU N N 81 124.692 124.692 120.954 3.738 25109
3795 1 7 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.616 0.075 25109
3796 1 7 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.755 -0.800 25109
3797 1 7 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.142 -0.751 25109
3798 1 7 . 1 1 81 81 LEU H H 81 8.167 8.167 8.296 -0.129 25109
3799 1 7 . 1 1 82 82 VAL N N 82 118.320 118.320 120.562 -2.242 25109
3800 1 7 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.605 -0.428 25109
3801 1 7 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.976 -0.266 25109
3802 1 7 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.651 0.297 25109
3803 1 7 . 1 1 82 82 VAL H H 82 7.141 7.141 7.499 -0.358 25109
3804 1 7 . 1 1 83 83 ASP N N 83 118.733 118.733 119.832 -1.099 25109
3805 1 7 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.321 0.011 25109
3806 1 7 . 1 1 83 83 ASP C C 83 178.674 178.674 178.336 0.338 25109
3807 1 7 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.023 -0.580 25109
3808 1 7 . 1 1 83 83 ASP CB C 83 36.829 36.829 39.833 -3.004 25109
3809 1 7 . 1 1 83 83 ASP H H 83 8.385 8.385 8.644 -0.259 25109
3810 1 7 . 1 1 84 84 LEU N N 84 121.026 121.026 121.073 -0.047 25109
3811 1 7 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.517 -0.538 25109
3812 1 7 . 1 1 84 84 LEU C C 84 178.796 178.796 179.299 -0.503 25109
3813 1 7 . 1 1 84 84 LEU CA C 84 57.522 57.522 56.853 0.669 25109
3814 1 7 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.826 0.669 25109
3815 1 7 . 1 1 84 84 LEU H H 84 7.770 7.770 7.545 0.225 25109
3816 1 7 . 1 1 85 85 ALA N N 85 121.525 121.525 122.457 -0.932 25109
3817 1 7 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.795 -0.134 25109
3818 1 7 . 1 1 85 85 ALA C C 85 179.322 179.322 178.971 0.351 25109
3819 1 7 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.288 0.553 25109
3820 1 7 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.103 0.824 25109
3821 1 7 . 1 1 85 85 ALA H H 85 8.126 8.126 7.921 0.205 25109
3822 1 7 . 1 1 86 86 ASP N N 86 115.349 115.349 119.159 -3.810 25109
3823 1 7 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.312 -0.039 25109
3824 1 7 . 1 1 86 86 ASP C C 86 178.463 178.463 178.451 0.012 25109
3825 1 7 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.763 -2.052 25109
3826 1 7 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.838 -3.676 25109
3827 1 7 . 1 1 86 86 ASP H H 86 8.410 8.410 8.458 -0.048 25109
3828 1 7 . 1 1 87 87 GLU N N 87 122.529 122.529 118.997 3.532 25109
3829 1 7 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.153 -0.117 25109
3830 1 7 . 1 1 87 87 GLU C C 87 178.508 178.508 178.297 0.211 25109
3831 1 7 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.044 0.310 25109
3832 1 7 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.581 -1.308 25109
3833 1 7 . 1 1 87 87 GLU H H 87 8.012 8.012 7.998 0.014 25109
3834 1 7 . 1 1 88 88 VAL N N 88 119.148 119.148 120.016 -0.868 25109
3835 1 7 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.919 -0.589 25109
3836 1 7 . 1 1 88 88 VAL C C 88 177.240 177.240 177.711 -0.471 25109
3837 1 7 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.740 1.509 25109
3838 1 7 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.817 -0.288 25109
3839 1 7 . 1 1 88 88 VAL H H 88 8.291 8.291 7.637 0.654 25109
3840 1 7 . 1 1 89 89 ALA N N 89 120.709 120.709 123.327 -2.618 25109
3841 1 7 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.019 -0.104 25109
3842 1 7 . 1 1 89 89 ALA C C 89 180.186 180.186 179.507 0.679 25109
3843 1 7 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.287 0.772 25109
3844 1 7 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.236 -0.001 25109
3845 1 7 . 1 1 89 89 ALA H H 89 8.548 8.548 8.507 0.041 25109
3846 1 7 . 1 1 90 90 SER N N 90 113.035 113.035 113.031 0.004 25109
3847 1 7 . 1 1 90 90 SER HA H 90 4.047 4.047 4.606 -0.559 25109
3848 1 7 . 1 1 90 90 SER C C 90 177.564 177.564 175.546 2.018 25109
3849 1 7 . 1 1 90 90 SER CA C 90 61.771 61.771 61.664 0.107 25109
3850 1 7 . 1 1 90 90 SER CB C 90 62.907 62.907 62.972 -0.065 25109
3851 1 7 . 1 1 90 90 SER H H 90 7.969 7.969 8.282 -0.313 25109
3852 1 7 . 1 1 91 91 VAL N N 91 123.417 123.417 120.925 2.492 25109
3853 1 7 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.825 -0.478 25109
3854 1 7 . 1 1 91 91 VAL C C 91 178.428 178.428 177.607 0.821 25109
3855 1 7 . 1 1 91 91 VAL CA C 91 66.129 66.129 64.893 1.236 25109
3856 1 7 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.617 0.154 25109
3857 1 7 . 1 1 91 91 VAL H H 91 7.713 7.713 7.665 0.048 25109
3858 1 7 . 1 1 92 92 TYR N N 92 121.458 121.458 121.303 0.155 25109
3859 1 7 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.368 -0.177 25109
3860 1 7 . 1 1 92 92 TYR CA C 92 60.994 60.994 61.214 -0.220 25109
3861 1 7 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.633 0.353 25109
3862 1 7 . 1 1 92 92 TYR H H 92 8.395 8.395 8.156 0.239 25109
3863 1 7 . 1 1 93 93 GLN N N 93 115.549 115.549 118.092 -2.543 25109
3864 1 7 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.129 -0.418 25109
3865 1 7 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.011 0.083 25109
3866 1 7 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.270 0.028 25109
3867 1 7 . 1 1 93 93 GLN H H 93 8.167 8.167 8.221 -0.054 25109
3868 1 7 . 1 1 94 94 SER N N 94 115.923 115.923 114.259 1.664 25109
3869 1 7 . 1 1 94 94 SER HA H 94 4.096 4.096 4.346 -0.250 25109
3870 1 7 . 1 1 94 94 SER CA C 94 60.971 60.971 58.446 2.525 25109
3871 1 7 . 1 1 94 94 SER CB C 94 62.635 62.635 64.492 -1.857 25109
3872 1 7 . 1 1 94 94 SER H H 94 7.642 7.642 7.705 -0.063 25109
3873 1 7 . 1 1 95 95 TYR N N 95 119.565 119.565 122.065 -2.500 25109
3874 1 7 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.584 0.175 25109
3875 1 7 . 1 1 95 95 TYR C C 95 175.334 175.334 173.751 1.583 25109
3876 1 7 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.142 0.556 25109
3877 1 7 . 1 1 95 95 TYR CB C 95 39.319 39.319 39.004 0.315 25109
3878 1 7 . 1 1 95 95 TYR H H 95 7.069 7.069 7.466 -0.397 25109
3879 1 7 . 1 1 96 96 GLN N N 96 119.872 119.872 122.438 -2.566 25109
3880 1 7 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.503 -0.138 25109
3881 1 7 . 1 1 96 96 GLN C C 96 173.612 173.612 174.264 -0.652 25109
3882 1 7 . 1 1 96 96 GLN CA C 96 54.336 54.336 53.808 0.528 25109
3883 1 7 . 1 1 96 96 GLN CB C 96 28.494 28.494 30.262 -1.768 25109
3884 1 7 . 1 1 96 96 GLN H H 96 7.409 7.409 8.381 -0.972 25109
3885 1 7 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.222 0.096 25109
3886 1 7 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.750 -0.736 25109
3887 1 7 . 1 1 97 97 PRO CB C 97 32.098 32.098 31.926 0.172 25109
3888 1 7 . 1 1 98 98 ARG N N 98 121.759 121.759 118.310 3.449 25109
3889 1 7 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.500 -0.158 25109
3890 1 7 . 1 1 98 98 ARG C C 98 176.848 176.848 174.264 2.584 25109
3891 1 7 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.136 1.085 25109
3892 1 7 . 1 1 98 98 ARG CB C 98 31.087 31.087 31.095 -0.008 25109
3893 1 7 . 1 1 98 98 ARG H H 98 8.423 8.423 7.653 0.770 25109
3894 1 7 . 1 1 99 99 THR N N 99 115.292 115.292 116.881 -1.589 25109
3895 1 7 . 1 1 99 99 THR HA H 99 4.323 4.323 4.552 -0.229 25109
3896 1 7 . 1 1 99 99 THR C C 99 174.350 174.350 173.644 0.706 25109
3897 1 7 . 1 1 99 99 THR CA C 99 61.906 61.906 62.366 -0.460 25109
3898 1 7 . 1 1 99 99 THR CB C 99 70.180 70.180 69.021 1.159 25109
3899 1 7 . 1 1 99 99 THR H H 99 8.179 8.179 8.369 -0.190 25109
3900 1 8 . 1 1 0 0 SER N N 0 115.693 115.693 118.955 -3.262 25109
3901 1 8 . 1 1 0 0 SER HA H 0 4.531 4.531 4.643 -0.112 25109
3902 1 8 . 1 1 0 0 SER C C 0 174.557 174.557 174.069 0.488 25109
3903 1 8 . 1 1 0 0 SER CA C 0 58.478 58.478 58.962 -0.484 25109
3904 1 8 . 1 1 0 0 SER CB C 0 64.380 64.380 61.352 3.028 25109
3905 1 8 . 1 1 0 0 SER H H 0 8.631 8.631 8.546 0.085 25109
3906 1 8 . 1 1 1 1 MET N N 1 123.111 123.111 117.191 5.920 25109
3907 1 8 . 1 1 1 1 MET HA H 1 4.728 4.728 4.800 -0.072 25109
3908 1 8 . 1 1 1 1 MET C C 1 174.846 174.846 173.297 1.549 25109
3909 1 8 . 1 1 1 1 MET CA C 1 55.655 55.655 53.959 1.696 25109
3910 1 8 . 1 1 1 1 MET CB C 1 32.035 32.035 33.779 -1.744 25109
3911 1 8 . 1 1 1 1 MET H H 1 8.641 8.641 8.043 0.598 25109
3912 1 8 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.931 -0.454 25109
3913 1 8 . 1 1 2 2 PRO CB C 2 32.000 32.000 30.643 1.357 25109
3914 1 8 . 1 1 3 3 PHE N N 3 121.126 121.126 125.116 -3.990 25109
3915 1 8 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.650 -0.284 25109
3916 1 8 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.353 1.509 25109
3917 1 8 . 1 1 3 3 PHE CB C 3 39.368 39.368 41.008 -1.640 25109
3918 1 8 . 1 1 3 3 PHE H H 3 8.177 8.177 9.300 -1.123 25109
3919 1 8 . 1 1 4 4 ALA N N 4 121.170 121.170 122.354 -1.184 25109
3920 1 8 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.156 -0.321 25109
3921 1 8 . 1 1 4 4 ALA C C 4 181.522 181.522 179.394 2.128 25109
3922 1 8 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.709 -0.255 25109
3923 1 8 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.203 1.233 25109
3924 1 8 . 1 1 4 4 ALA H H 4 8.444 8.444 8.876 -0.432 25109
3925 1 8 . 1 1 5 5 GLU N N 5 118.932 118.932 118.491 0.441 25109
3926 1 8 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.919 -0.064 25109
3927 1 8 . 1 1 5 5 GLU C C 5 177.971 177.971 178.088 -0.117 25109
3928 1 8 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.674 -0.043 25109
3929 1 8 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.747 0.014 25109
3930 1 8 . 1 1 5 5 GLU H H 5 8.454 8.454 8.759 -0.305 25109
3931 1 8 . 1 1 6 6 ASP N N 6 120.471 120.471 118.672 1.799 25109
3932 1 8 . 1 1 6 6 ASP C C 6 178.885 178.885 177.975 0.910 25109
3933 1 8 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.158 -0.087 25109
3934 1 8 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.708 -1.576 25109
3935 1 8 . 1 1 6 6 ASP H H 6 8.316 8.316 8.352 -0.036 25109
3936 1 8 . 1 1 7 7 LYS N N 7 118.335 118.335 119.125 -0.790 25109
3937 1 8 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.832 -0.142 25109
3938 1 8 . 1 1 7 7 LYS C C 7 180.080 180.080 179.088 0.992 25109
3939 1 8 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.542 0.178 25109
3940 1 8 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.416 0.378 25109
3941 1 8 . 1 1 7 7 LYS H H 7 8.249 8.249 8.191 0.058 25109
3942 1 8 . 1 1 8 8 THR N N 8 119.222 119.222 117.102 2.120 25109
3943 1 8 . 1 1 8 8 THR HA H 8 3.975 3.975 4.090 -0.115 25109
3944 1 8 . 1 1 8 8 THR CA C 8 68.453 68.453 66.697 1.756 25109
3945 1 8 . 1 1 8 8 THR CB C 8 67.387 67.387 68.773 -1.386 25109
3946 1 8 . 1 1 8 8 THR H H 8 7.897 7.897 7.891 0.006 25109
3947 1 8 . 1 1 9 9 TYR N N 9 123.054 123.054 122.893 0.161 25109
3948 1 8 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.058 0.195 25109
3949 1 8 . 1 1 9 9 TYR C C 9 177.441 177.441 177.647 -0.206 25109
3950 1 8 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.225 -0.327 25109
3951 1 8 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.327 -0.478 25109
3952 1 8 . 1 1 9 9 TYR H H 9 8.605 8.605 8.587 0.018 25109
3953 1 8 . 1 1 10 10 LYS N N 10 118.366 118.366 117.787 0.579 25109
3954 1 8 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.692 -0.098 25109
3955 1 8 . 1 1 10 10 LYS C C 10 178.885 178.885 178.553 0.332 25109
3956 1 8 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.915 1.129 25109
3957 1 8 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.183 -0.138 25109
3958 1 8 . 1 1 10 10 LYS H H 10 8.066 8.066 7.831 0.235 25109
3959 1 8 . 1 1 11 11 TYR N N 11 120.539 120.539 120.281 0.258 25109
3960 1 8 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.211 -0.221 25109
3961 1 8 . 1 1 11 11 TYR C C 11 178.233 178.233 177.772 0.461 25109
3962 1 8 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.545 0.983 25109
3963 1 8 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.135 -0.772 25109
3964 1 8 . 1 1 11 11 TYR H H 11 7.875 7.875 7.578 0.297 25109
3965 1 8 . 1 1 12 12 ILE N N 12 121.893 121.893 119.211 2.682 25109
3966 1 8 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.968 -0.872 25109
3967 1 8 . 1 1 12 12 ILE C C 12 177.015 177.015 177.146 -0.131 25109
3968 1 8 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.663 2.100 25109
3969 1 8 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.190 1.362 25109
3970 1 8 . 1 1 12 12 ILE H H 12 8.154 8.154 8.604 -0.450 25109
3971 1 8 . 1 1 13 13 CYS N N 13 113.894 113.894 116.040 -2.146 25109
3972 1 8 . 1 1 13 13 CYS HA H 13 3.887 3.887 4.142 -0.255 25109
3973 1 8 . 1 1 13 13 CYS C C 13 178.288 178.288 175.858 2.430 25109
3974 1 8 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.404 2.933 25109
3975 1 8 . 1 1 13 13 CYS CB C 13 27.005 27.005 27.046 -0.041 25109
3976 1 8 . 1 1 13 13 CYS H H 13 7.551 7.551 7.482 0.069 25109
3977 1 8 . 1 1 14 14 ARG N N 14 119.228 119.228 117.991 1.237 25109
3978 1 8 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.139 -0.069 25109
3979 1 8 . 1 1 14 14 ARG C C 14 177.127 177.127 177.489 -0.362 25109
3980 1 8 . 1 1 14 14 ARG CA C 14 58.494 58.494 59.056 -0.562 25109
3981 1 8 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.615 -0.193 25109
3982 1 8 . 1 1 14 14 ARG H H 14 7.991 7.991 7.846 0.145 25109
3983 1 8 . 1 1 15 15 ASN N N 15 117.367 117.367 116.808 0.559 25109
3984 1 8 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.871 0.098 25109
3985 1 8 . 1 1 15 15 ASN CA C 15 52.763 52.763 53.118 -0.355 25109
3986 1 8 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.012 0.573 25109
3987 1 8 . 1 1 15 15 ASN H H 15 7.643 7.643 7.590 0.053 25109
3988 1 8 . 1 1 16 16 PHE N N 16 122.356 122.356 123.150 -0.794 25109
3989 1 8 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.337 -0.121 25109
3990 1 8 . 1 1 16 16 PHE C C 16 178.084 178.084 176.914 1.170 25109
3991 1 8 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.633 1.544 25109
3992 1 8 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.369 1.220 25109
3993 1 8 . 1 1 16 16 PHE H H 16 6.992 6.992 7.729 -0.737 25109
3994 1 8 . 1 1 17 17 SER N N 17 112.937 112.937 114.336 -1.399 25109
3995 1 8 . 1 1 17 17 SER HA H 17 4.199 4.199 4.311 -0.112 25109
3996 1 8 . 1 1 17 17 SER C C 17 176.726 176.726 176.439 0.287 25109
3997 1 8 . 1 1 17 17 SER CA C 17 62.052 62.052 61.233 0.819 25109
3998 1 8 . 1 1 17 17 SER CB C 17 62.552 62.552 62.859 -0.307 25109
3999 1 8 . 1 1 17 17 SER H H 17 8.840 8.840 8.650 0.190 25109
4000 1 8 . 1 1 18 18 ASN N N 18 118.809 118.809 121.223 -2.414 25109
4001 1 8 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.659 -0.301 25109
4002 1 8 . 1 1 18 18 ASN C C 18 175.967 175.967 176.772 -0.805 25109
4003 1 8 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.600 -0.690 25109
4004 1 8 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.515 -0.687 25109
4005 1 8 . 1 1 18 18 ASN H H 18 8.130 8.130 8.435 -0.305 25109
4006 1 8 . 1 1 19 19 PHE N N 19 115.750 115.750 116.724 -0.974 25109
4007 1 8 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.575 -0.290 25109
4008 1 8 . 1 1 19 19 PHE C C 19 175.370 175.370 176.266 -0.896 25109
4009 1 8 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.487 0.375 25109
4010 1 8 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.781 1.097 25109
4011 1 8 . 1 1 19 19 PHE H H 19 8.062 8.062 7.609 0.453 25109
4012 1 8 . 1 1 20 20 CYS N N 20 113.958 113.958 116.304 -2.346 25109
4013 1 8 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.206 -0.263 25109
4014 1 8 . 1 1 20 20 CYS C C 20 173.823 173.823 174.834 -1.011 25109
4015 1 8 . 1 1 20 20 CYS CA C 20 61.788 61.788 60.238 1.550 25109
4016 1 8 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.710 -0.327 25109
4017 1 8 . 1 1 20 20 CYS H H 20 6.850 6.850 7.340 -0.490 25109
4018 1 8 . 1 1 21 21 ASN N N 21 116.691 116.691 120.017 -3.326 25109
4019 1 8 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.802 -0.058 25109
4020 1 8 . 1 1 21 21 ASN C C 21 175.299 175.299 173.735 1.564 25109
4021 1 8 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.766 0.524 25109
4022 1 8 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.379 -0.066 25109
4023 1 8 . 1 1 21 21 ASN H H 21 8.251 8.251 7.836 0.415 25109
4024 1 8 . 1 1 22 22 VAL N N 22 122.431 122.431 120.506 1.925 25109
4025 1 8 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.285 -0.735 25109
4026 1 8 . 1 1 22 22 VAL C C 22 174.034 174.034 173.764 0.270 25109
4027 1 8 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.725 3.212 25109
4028 1 8 . 1 1 22 22 VAL CB C 22 31.523 31.523 36.170 -4.647 25109
4029 1 8 . 1 1 22 22 VAL H H 22 7.573 7.573 7.476 0.097 25109
4030 1 8 . 1 1 23 23 ASP N N 23 127.219 127.219 122.794 4.425 25109
4031 1 8 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.958 -1.772 25109
4032 1 8 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.639 -2.845 25109
4033 1 8 . 1 1 23 23 ASP H H 23 8.687 8.687 8.631 0.056 25109
4034 1 8 . 1 1 24 24 VAL N N 24 127.835 127.835 123.977 3.858 25109
4035 1 8 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.807 -0.514 25109
4036 1 8 . 1 1 24 24 VAL C C 24 176.867 176.867 177.287 -0.420 25109
4037 1 8 . 1 1 24 24 VAL CA C 24 67.163 67.163 65.794 1.369 25109
4038 1 8 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.131 -0.116 25109
4039 1 8 . 1 1 24 24 VAL H H 24 9.409 9.409 9.212 0.197 25109
4040 1 8 . 1 1 25 25 VAL N N 25 114.324 114.324 115.280 -0.956 25109
4041 1 8 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.742 -0.223 25109
4042 1 8 . 1 1 25 25 VAL C C 25 178.006 178.006 176.849 1.157 25109
4043 1 8 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.662 1.026 25109
4044 1 8 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.191 0.341 25109
4045 1 8 . 1 1 25 25 VAL H H 25 8.038 8.038 7.547 0.491 25109
4046 1 8 . 1 1 26 26 GLU N N 26 117.009 117.009 118.616 -1.607 25109
4047 1 8 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.086 0.005 25109
4048 1 8 . 1 1 26 26 GLU C C 26 177.303 177.303 178.491 -1.188 25109
4049 1 8 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.178 -0.746 25109
4050 1 8 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.723 -0.757 25109
4051 1 8 . 1 1 26 26 GLU H H 26 7.220 7.220 7.530 -0.310 25109
4052 1 8 . 1 1 27 27 ILE N N 27 114.080 114.080 120.336 -6.256 25109
4053 1 8 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.924 0.437 25109
4054 1 8 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.677 -1.945 25109
4055 1 8 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.121 1.470 25109
4056 1 8 . 1 1 27 27 ILE H H 27 7.647 7.647 7.232 0.415 25109
4057 1 8 . 1 1 28 28 LEU N N 28 121.867 121.867 120.333 1.534 25109
4058 1 8 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.093 -0.156 25109
4059 1 8 . 1 1 28 28 LEU C C 28 175.756 175.756 177.007 -1.251 25109
4060 1 8 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.497 -0.530 25109
4061 1 8 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.816 0.697 25109
4062 1 8 . 1 1 28 28 LEU H H 28 7.434 7.434 7.968 -0.534 25109
4063 1 8 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.275 -0.065 25109
4064 1 8 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.024 0.286 25109
4065 1 8 . 1 1 30 30 TYR N N 30 113.832 113.832 115.152 -1.320 25109
4066 1 8 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.461 0.041 25109
4067 1 8 . 1 1 30 30 TYR C C 30 174.386 174.386 175.918 -1.532 25109
4068 1 8 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.011 -1.317 25109
4069 1 8 . 1 1 30 30 TYR CB C 30 39.099 39.099 38.990 0.109 25109
4070 1 8 . 1 1 30 30 TYR H H 30 7.628 7.628 7.354 0.274 25109
4071 1 8 . 1 1 31 31 LEU N N 31 118.331 118.331 118.804 -0.473 25109
4072 1 8 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.759 0.118 25109
4073 1 8 . 1 1 31 31 LEU C C 31 173.849 173.849 175.456 -1.607 25109
4074 1 8 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.910 -0.218 25109
4075 1 8 . 1 1 31 31 LEU CB C 31 42.802 42.802 43.137 -0.335 25109
4076 1 8 . 1 1 31 31 LEU H H 31 7.619 7.619 7.503 0.116 25109
4077 1 8 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.475 -0.120 25109
4078 1 8 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.848 -0.438 25109
4079 1 8 . 1 1 33 33 CYS N N 33 110.978 110.978 117.312 -6.334 25109
4080 1 8 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.474 -0.133 25109
4081 1 8 . 1 1 33 33 CYS C C 33 174.139 174.139 173.271 0.868 25109
4082 1 8 . 1 1 33 33 CYS CA C 33 56.212 56.212 59.105 -2.893 25109
4083 1 8 . 1 1 33 33 CYS CB C 33 28.922 28.922 26.870 2.052 25109
4084 1 8 . 1 1 33 33 CYS H H 33 6.414 6.414 8.291 -1.877 25109
4085 1 8 . 1 1 34 34 LEU N N 34 123.111 123.111 119.010 4.101 25109
4086 1 8 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.639 -0.033 25109
4087 1 8 . 1 1 34 34 LEU C C 34 176.646 176.646 175.864 0.782 25109
4088 1 8 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.701 0.190 25109
4089 1 8 . 1 1 34 34 LEU CB C 34 42.691 42.691 45.212 -2.522 25109
4090 1 8 . 1 1 34 34 LEU H H 34 7.550 7.550 7.194 0.356 25109
4091 1 8 . 1 1 35 35 THR N N 35 113.831 113.831 116.924 -3.093 25109
4092 1 8 . 1 1 35 35 THR HA H 35 4.205 4.205 4.268 -0.063 25109
4093 1 8 . 1 1 35 35 THR C C 35 175.324 175.324 175.702 -0.378 25109
4094 1 8 . 1 1 35 35 THR CA C 35 61.200 61.200 61.842 -0.642 25109
4095 1 8 . 1 1 35 35 THR CB C 35 71.318 71.318 70.007 1.311 25109
4096 1 8 . 1 1 35 35 THR H H 35 8.586 8.586 8.225 0.361 25109
4097 1 8 . 1 1 36 36 ALA N N 36 124.128 124.128 126.039 -1.911 25109
4098 1 8 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.286 -0.362 25109
4099 1 8 . 1 1 36 36 ALA C C 36 180.397 180.397 179.842 0.555 25109
4100 1 8 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.097 0.822 25109
4101 1 8 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.438 -0.635 25109
4102 1 8 . 1 1 36 36 ALA H H 36 8.836 8.836 8.716 0.120 25109
4103 1 8 . 1 1 37 37 ARG N N 37 116.793 116.793 118.680 -1.887 25109
4104 1 8 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.128 -0.142 25109
4105 1 8 . 1 1 37 37 ARG C C 37 179.272 179.272 178.139 1.133 25109
4106 1 8 . 1 1 37 37 ARG CA C 37 59.232 59.232 58.224 1.008 25109
4107 1 8 . 1 1 37 37 ARG CB C 37 29.905 29.905 28.815 1.090 25109
4108 1 8 . 1 1 37 37 ARG H H 37 8.060 8.060 8.745 -0.685 25109
4109 1 8 . 1 1 38 38 ASP N N 38 120.030 120.030 119.405 0.625 25109
4110 1 8 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.380 -0.132 25109
4111 1 8 . 1 1 38 38 ASP C C 38 178.885 178.885 178.475 0.410 25109
4112 1 8 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.906 -0.719 25109
4113 1 8 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.017 0.916 25109
4114 1 8 . 1 1 38 38 ASP H H 38 7.782 7.782 8.507 -0.725 25109
4115 1 8 . 1 1 39 39 GLN N N 39 118.223 118.223 118.651 -0.428 25109
4116 1 8 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.975 -0.310 25109
4117 1 8 . 1 1 39 39 GLN C C 39 178.041 178.041 178.237 -0.196 25109
4118 1 8 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.858 1.743 25109
4119 1 8 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.791 -0.994 25109
4120 1 8 . 1 1 39 39 GLN H H 39 8.476 8.476 8.169 0.307 25109
4121 1 8 . 1 1 40 40 ASP N N 40 117.908 117.908 120.454 -2.546 25109
4122 1 8 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.323 -0.070 25109
4123 1 8 . 1 1 40 40 ASP C C 40 178.639 178.639 178.432 0.207 25109
4124 1 8 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.469 -1.069 25109
4125 1 8 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.809 -2.781 25109
4126 1 8 . 1 1 40 40 ASP H H 40 8.386 8.386 8.251 0.135 25109
4127 1 8 . 1 1 41 41 ARG N N 41 120.990 120.990 119.528 1.462 25109
4128 1 8 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.965 0.077 25109
4129 1 8 . 1 1 41 41 ARG C C 41 179.795 179.795 179.019 0.776 25109
4130 1 8 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.559 -0.114 25109
4131 1 8 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.190 0.068 25109
4132 1 8 . 1 1 41 41 ARG H H 41 8.130 8.130 8.222 -0.092 25109
4133 1 8 . 1 1 42 42 LEU N N 42 121.219 121.219 119.916 1.303 25109
4134 1 8 . 1 1 42 42 LEU HA H 42 3.935 3.935 3.989 -0.054 25109
4135 1 8 . 1 1 42 42 LEU C C 42 178.850 178.850 178.735 0.115 25109
4136 1 8 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.909 0.358 25109
4137 1 8 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.516 0.517 25109
4138 1 8 . 1 1 42 42 LEU H H 42 8.179 8.179 7.745 0.434 25109
4139 1 8 . 1 1 43 43 ARG N N 43 119.310 119.310 119.009 0.301 25109
4140 1 8 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.859 -0.135 25109
4141 1 8 . 1 1 43 43 ARG C C 43 179.099 179.099 178.839 0.260 25109
4142 1 8 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.745 1.069 25109
4143 1 8 . 1 1 43 43 ARG CB C 43 30.179 30.179 29.866 0.313 25109
4144 1 8 . 1 1 43 43 ARG H H 43 8.296 8.296 8.406 -0.110 25109
4145 1 8 . 1 1 44 44 ALA N N 44 121.305 121.305 121.465 -0.160 25109
4146 1 8 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.102 0.001 25109
4147 1 8 . 1 1 44 44 ALA C C 44 180.924 180.924 179.608 1.316 25109
4148 1 8 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.229 -0.004 25109
4149 1 8 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.103 -0.007 25109
4150 1 8 . 1 1 44 44 ALA H H 44 7.774 7.774 8.448 -0.674 25109
4151 1 8 . 1 1 45 45 THR N N 45 115.017 115.017 115.501 -0.484 25109
4152 1 8 . 1 1 45 45 THR HA H 45 3.879 3.879 3.951 -0.072 25109
4153 1 8 . 1 1 45 45 THR CA C 45 66.327 66.327 67.361 -1.034 25109
4154 1 8 . 1 1 45 45 THR CB C 45 68.809 68.809 68.245 0.564 25109
4155 1 8 . 1 1 45 45 THR H H 45 8.167 8.167 8.373 -0.206 25109
4156 1 8 . 1 1 46 46 CYS N N 46 123.609 123.609 120.833 2.776 25109
4157 1 8 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.427 -0.408 25109
4158 1 8 . 1 1 46 46 CYS C C 46 178.077 178.077 176.406 1.671 25109
4159 1 8 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.604 0.341 25109
4160 1 8 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.013 -0.874 25109
4161 1 8 . 1 1 46 46 CYS H H 46 8.084 8.084 8.237 -0.153 25109
4162 1 8 . 1 1 47 47 THR N N 47 115.520 115.520 116.031 -0.511 25109
4163 1 8 . 1 1 47 47 THR HA H 47 3.915 3.915 4.066 -0.151 25109
4164 1 8 . 1 1 47 47 THR CA C 47 66.063 66.063 66.102 -0.039 25109
4165 1 8 . 1 1 47 47 THR CB C 47 69.245 69.245 68.915 0.330 25109
4166 1 8 . 1 1 47 47 THR H H 47 7.735 7.735 7.806 -0.071 25109
4167 1 8 . 1 1 48 48 LEU N N 48 120.099 120.099 121.154 -1.055 25109
4168 1 8 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.160 0.066 25109
4169 1 8 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.590 -0.027 25109
4170 1 8 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.394 1.231 25109
4171 1 8 . 1 1 48 48 LEU H H 48 7.464 7.464 8.151 -0.687 25109
4172 1 8 . 1 1 49 49 SER N N 49 111.979 111.979 111.594 0.385 25109
4173 1 8 . 1 1 49 49 SER HA H 49 4.661 4.661 4.528 0.133 25109
4174 1 8 . 1 1 49 49 SER C C 49 175.581 175.581 174.689 0.892 25109
4175 1 8 . 1 1 49 49 SER CA C 49 59.590 59.590 58.658 0.932 25109
4176 1 8 . 1 1 49 49 SER CB C 49 65.335 65.335 64.919 0.416 25109
4177 1 8 . 1 1 49 49 SER H H 49 8.781 8.781 8.149 0.632 25109
4178 1 8 . 1 1 50 50 GLY N N 50 110.194 110.194 108.180 2.014 25109
4179 1 8 . 1 1 50 50 GLY C C 50 175.123 175.123 173.227 1.896 25109
4180 1 8 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.983 -0.081 25109
4181 1 8 . 1 1 50 50 GLY H H 50 7.955 7.955 7.600 0.355 25109
4182 1 8 . 1 1 51 51 ASN N N 51 121.050 121.050 119.572 1.478 25109
4183 1 8 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.428 -0.178 25109
4184 1 8 . 1 1 51 51 ASN C C 51 176.403 176.403 176.978 -0.575 25109
4185 1 8 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.618 3.685 25109
4186 1 8 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.609 2.990 25109
4187 1 8 . 1 1 51 51 ASN H H 51 8.898 8.898 8.813 0.085 25109
4188 1 8 . 1 1 52 52 ARG N N 52 119.825 119.825 119.664 0.161 25109
4189 1 8 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.033 0.005 25109
4190 1 8 . 1 1 52 52 ARG C C 52 178.850 178.850 177.224 1.626 25109
4191 1 8 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.684 1.380 25109
4192 1 8 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.762 0.261 25109
4193 1 8 . 1 1 52 52 ARG H H 52 8.696 8.696 8.476 0.220 25109
4194 1 8 . 1 1 53 53 ASP N N 53 116.032 116.032 117.897 -1.865 25109
4195 1 8 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.636 -0.089 25109
4196 1 8 . 1 1 53 53 ASP C C 53 178.996 178.996 178.365 0.631 25109
4197 1 8 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.238 -1.159 25109
4198 1 8 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.464 -2.092 25109
4199 1 8 . 1 1 53 53 ASP H H 53 9.036 9.036 8.502 0.534 25109
4200 1 8 . 1 1 54 54 THR N N 54 115.848 115.848 117.605 -1.757 25109
4201 1 8 . 1 1 54 54 THR HA H 54 3.746 3.746 4.219 -0.473 25109
4202 1 8 . 1 1 54 54 THR CA C 54 67.885 67.885 66.177 1.708 25109
4203 1 8 . 1 1 54 54 THR CB C 54 66.953 66.953 68.903 -1.950 25109
4204 1 8 . 1 1 54 54 THR H H 54 7.782 7.782 7.752 0.030 25109
4205 1 8 . 1 1 55 55 LEU N N 55 125.987 125.987 122.075 3.912 25109
4206 1 8 . 1 1 55 55 LEU HA H 55 3.554 3.554 3.789 -0.235 25109
4207 1 8 . 1 1 55 55 LEU C C 55 177.901 177.901 178.185 -0.284 25109
4208 1 8 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.533 -0.080 25109
4209 1 8 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.444 0.419 25109
4210 1 8 . 1 1 55 55 LEU H H 55 8.740 8.740 8.056 0.684 25109
4211 1 8 . 1 1 56 56 TRP N N 56 116.672 116.672 120.210 -3.538 25109
4212 1 8 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.539 -0.459 25109
4213 1 8 . 1 1 56 56 TRP C C 56 179.588 179.588 178.493 1.095 25109
4214 1 8 . 1 1 56 56 TRP CA C 56 61.481 61.481 60.981 0.500 25109
4215 1 8 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.426 -0.234 25109
4216 1 8 . 1 1 56 56 TRP H H 56 7.642 7.642 7.824 -0.182 25109
4217 1 8 . 1 1 57 57 HIS N N 57 115.754 115.754 117.677 -1.923 25109
4218 1 8 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.173 0.103 25109
4219 1 8 . 1 1 57 57 HIS C C 57 177.514 177.514 177.616 -0.102 25109
4220 1 8 . 1 1 57 57 HIS CA C 57 58.952 58.952 60.503 -1.551 25109
4221 1 8 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.848 -1.846 25109
4222 1 8 . 1 1 57 57 HIS H H 57 7.407 7.407 7.773 -0.366 25109
4223 1 8 . 1 1 58 58 LEU N N 58 123.934 123.934 122.311 1.623 25109
4224 1 8 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.835 -0.048 25109
4225 1 8 . 1 1 58 58 LEU C C 58 178.115 178.115 177.393 0.722 25109
4226 1 8 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.202 0.707 25109
4227 1 8 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.270 -0.455 25109
4228 1 8 . 1 1 58 58 LEU H H 58 8.996 8.996 8.457 0.539 25109
4229 1 8 . 1 1 59 59 PHE N N 59 117.721 117.721 116.920 0.801 25109
4230 1 8 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.587 0.348 25109
4231 1 8 . 1 1 59 59 PHE C C 59 176.987 176.987 177.900 -0.913 25109
4232 1 8 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.354 -1.241 25109
4233 1 8 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.321 -0.360 25109
4234 1 8 . 1 1 59 59 PHE H H 59 8.201 8.201 7.940 0.261 25109
4235 1 8 . 1 1 60 60 ASN N N 60 115.695 115.695 117.187 -1.492 25109
4236 1 8 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.024 -0.105 25109
4237 1 8 . 1 1 60 60 ASN C C 60 176.670 176.670 176.643 0.027 25109
4238 1 8 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.302 0.454 25109
4239 1 8 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.476 0.842 25109
4240 1 8 . 1 1 60 60 ASN H H 60 7.666 7.666 8.120 -0.454 25109
4241 1 8 . 1 1 61 61 THR N N 61 115.110 115.110 115.553 -0.443 25109
4242 1 8 . 1 1 61 61 THR HA H 61 3.733 3.733 4.148 -0.415 25109
4243 1 8 . 1 1 61 61 THR CA C 61 66.319 66.319 65.225 1.093 25109
4244 1 8 . 1 1 61 61 THR CB C 61 69.174 69.174 69.244 -0.070 25109
4245 1 8 . 1 1 61 61 THR H H 61 7.782 7.782 7.808 -0.026 25109
4246 1 8 . 1 1 62 62 LEU N N 62 121.559 121.559 123.332 -1.773 25109
4247 1 8 . 1 1 62 62 LEU HA H 62 3.489 3.489 4.107 -0.618 25109
4248 1 8 . 1 1 62 62 LEU C C 62 176.600 176.600 177.527 -0.927 25109
4249 1 8 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.194 0.771 25109
4250 1 8 . 1 1 62 62 LEU CB C 62 42.335 42.335 41.393 0.942 25109
4251 1 8 . 1 1 62 62 LEU H H 62 8.362 8.362 8.333 0.029 25109
4252 1 8 . 1 1 63 63 GLN N N 63 109.150 109.150 115.533 -6.383 25109
4253 1 8 . 1 1 63 63 GLN HA H 63 2.077 2.077 2.803 -0.726 25109
4254 1 8 . 1 1 63 63 GLN C C 63 175.194 175.194 177.114 -1.920 25109
4255 1 8 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.216 -0.950 25109
4256 1 8 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.526 -1.832 25109
4257 1 8 . 1 1 63 63 GLN H H 63 6.458 6.458 7.457 -0.999 25109
4258 1 8 . 1 1 64 64 ARG N N 64 116.029 116.029 118.647 -2.618 25109
4259 1 8 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.063 0.035 25109
4260 1 8 . 1 1 64 64 ARG C C 64 176.459 176.459 176.905 -0.446 25109
4261 1 8 . 1 1 64 64 ARG CA C 64 56.143 56.143 57.578 -1.435 25109
4262 1 8 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.420 0.164 25109
4263 1 8 . 1 1 64 64 ARG H H 64 6.596 6.596 7.250 -0.654 25109
4264 1 8 . 1 1 65 65 ARG N N 65 120.422 120.422 120.085 0.337 25109
4265 1 8 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.700 0.134 25109
4266 1 8 . 1 1 65 65 ARG C C 65 173.436 173.436 173.996 -0.560 25109
4267 1 8 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.995 -1.450 25109
4268 1 8 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.872 -0.876 25109
4269 1 8 . 1 1 65 65 ARG H H 65 7.932 7.932 7.616 0.316 25109
4270 1 8 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.566 0.008 25109
4271 1 8 . 1 1 66 66 PRO CB C 66 32.059 32.059 32.385 -0.326 25109
4272 1 8 . 1 1 67 67 GLY N N 67 111.953 111.953 112.527 -0.574 25109
4273 1 8 . 1 1 67 67 GLY C C 67 177.057 177.057 175.562 1.495 25109
4274 1 8 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.424 0.883 25109
4275 1 8 . 1 1 67 67 GLY H H 67 9.198 9.198 8.756 0.442 25109
4276 1 8 . 1 1 68 68 TRP N N 68 117.467 117.467 117.865 -0.398 25109
4277 1 8 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.851 -0.509 25109
4278 1 8 . 1 1 68 68 TRP C C 68 177.690 177.690 176.522 1.168 25109
4279 1 8 . 1 1 68 68 TRP CA C 68 60.116 60.116 57.468 2.648 25109
4280 1 8 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.449 0.741 25109
4281 1 8 . 1 1 68 68 TRP H H 68 7.647 7.647 7.834 -0.187 25109
4282 1 8 . 1 1 69 69 VAL N N 69 121.482 121.482 121.694 -0.212 25109
4283 1 8 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.247 -0.610 25109
4284 1 8 . 1 1 69 69 VAL C C 69 177.993 177.993 177.376 0.617 25109
4285 1 8 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.070 1.396 25109
4286 1 8 . 1 1 69 69 VAL CB C 69 30.026 30.026 29.959 0.067 25109
4287 1 8 . 1 1 69 69 VAL H H 69 6.666 6.666 7.449 -0.783 25109
4288 1 8 . 1 1 70 70 GLU N N 70 116.350 116.350 119.104 -2.754 25109
4289 1 8 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.984 -0.159 25109
4290 1 8 . 1 1 70 70 GLU C C 70 180.362 180.362 178.825 1.537 25109
4291 1 8 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.730 -0.508 25109
4292 1 8 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.635 -1.330 25109
4293 1 8 . 1 1 70 70 GLU H H 70 7.410 7.410 8.609 -1.199 25109
4294 1 8 . 1 1 71 71 TYR N N 71 116.750 116.750 118.009 -1.259 25109
4295 1 8 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.340 0.110 25109
4296 1 8 . 1 1 71 71 TYR C C 71 178.411 178.411 177.934 0.477 25109
4297 1 8 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.850 0.752 25109
4298 1 8 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.431 -0.076 25109
4299 1 8 . 1 1 71 71 TYR H H 71 7.159 7.159 7.534 -0.375 25109
4300 1 8 . 1 1 72 72 PHE N N 72 121.610 121.610 121.281 0.329 25109
4301 1 8 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.308 0.194 25109
4302 1 8 . 1 1 72 72 PHE CA C 72 60.820 60.820 60.906 -0.085 25109
4303 1 8 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.351 0.698 25109
4304 1 8 . 1 1 72 72 PHE H H 72 9.007 9.007 8.112 0.895 25109
4305 1 8 . 1 1 73 73 ILE N N 73 119.200 119.200 119.432 -0.232 25109
4306 1 8 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.444 -0.264 25109
4307 1 8 . 1 1 73 73 ILE C C 73 177.620 177.620 177.686 -0.066 25109
4308 1 8 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.610 1.587 25109
4309 1 8 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.568 1.455 25109
4310 1 8 . 1 1 73 73 ILE H H 73 8.644 8.644 8.538 0.106 25109
4311 1 8 . 1 1 74 74 ALA N N 74 119.624 119.624 119.931 -0.307 25109
4312 1 8 . 1 1 74 74 ALA HA H 74 3.954 3.954 3.984 -0.030 25109
4313 1 8 . 1 1 74 74 ALA C C 74 181.030 181.030 179.025 2.005 25109
4314 1 8 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.526 0.885 25109
4315 1 8 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.933 0.203 25109
4316 1 8 . 1 1 74 74 ALA H H 74 7.476 7.476 7.962 -0.486 25109
4317 1 8 . 1 1 75 75 ALA N N 75 123.625 123.625 122.141 1.484 25109
4318 1 8 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.810 0.028 25109
4319 1 8 . 1 1 75 75 ALA C C 75 179.272 179.272 179.009 0.263 25109
4320 1 8 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.678 0.424 25109
4321 1 8 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.676 0.917 25109
4322 1 8 . 1 1 75 75 ALA H H 75 8.524 8.524 7.476 1.048 25109
4323 1 8 . 1 1 76 76 LEU N N 76 118.114 118.114 119.617 -1.503 25109
4324 1 8 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.072 -0.400 25109
4325 1 8 . 1 1 76 76 LEU C C 76 180.001 180.001 179.064 0.937 25109
4326 1 8 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.310 0.946 25109
4327 1 8 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.430 1.189 25109
4328 1 8 . 1 1 76 76 LEU H H 76 8.153 8.153 7.459 0.694 25109
4329 1 8 . 1 1 77 77 ARG N N 77 117.830 117.830 119.158 -1.328 25109
4330 1 8 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.007 -0.560 25109
4331 1 8 . 1 1 77 77 ARG C C 77 180.889 180.889 178.999 1.890 25109
4332 1 8 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.265 1.801 25109
4333 1 8 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.960 -0.763 25109
4334 1 8 . 1 1 77 77 ARG H H 77 7.945 7.945 7.809 0.136 25109
4335 1 8 . 1 1 78 78 GLY N N 78 110.202 110.202 105.991 4.211 25109
4336 1 8 . 1 1 78 78 GLY C C 78 174.807 174.807 175.413 -0.606 25109
4337 1 8 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.531 0.029 25109
4338 1 8 . 1 1 78 78 GLY H H 78 8.269 8.269 7.813 0.456 25109
4339 1 8 . 1 1 79 79 CYS N N 79 115.567 115.567 117.122 -1.555 25109
4340 1 8 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.758 -0.369 25109
4341 1 8 . 1 1 79 79 CYS C C 79 173.025 173.025 174.622 -1.597 25109
4342 1 8 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.114 2.843 25109
4343 1 8 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.598 0.207 25109
4344 1 8 . 1 1 79 79 CYS H H 79 7.132 7.132 7.723 -0.591 25109
4345 1 8 . 1 1 80 80 GLU N N 80 111.759 111.759 116.154 -4.395 25109
4346 1 8 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.952 -0.219 25109
4347 1 8 . 1 1 80 80 GLU C C 80 175.827 175.827 175.652 0.175 25109
4348 1 8 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.774 -0.307 25109
4349 1 8 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.178 -2.461 25109
4350 1 8 . 1 1 80 80 GLU H H 80 7.772 7.772 7.879 -0.107 25109
4351 1 8 . 1 1 81 81 LEU N N 81 124.692 124.692 121.094 3.598 25109
4352 1 8 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.435 0.256 25109
4353 1 8 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.834 -0.878 25109
4354 1 8 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.442 -1.051 25109
4355 1 8 . 1 1 81 81 LEU H H 81 8.167 8.167 8.162 0.005 25109
4356 1 8 . 1 1 82 82 VAL N N 82 118.320 118.320 121.359 -3.039 25109
4357 1 8 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.663 -0.486 25109
4358 1 8 . 1 1 82 82 VAL CA C 82 66.710 66.710 65.667 1.043 25109
4359 1 8 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.635 0.313 25109
4360 1 8 . 1 1 82 82 VAL H H 82 7.141 7.141 7.507 -0.366 25109
4361 1 8 . 1 1 83 83 ASP N N 83 118.733 118.733 120.708 -1.975 25109
4362 1 8 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.298 0.034 25109
4363 1 8 . 1 1 83 83 ASP C C 83 178.674 178.674 178.117 0.557 25109
4364 1 8 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.646 -1.203 25109
4365 1 8 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.813 -3.984 25109
4366 1 8 . 1 1 83 83 ASP H H 83 8.385 8.385 8.567 -0.182 25109
4367 1 8 . 1 1 84 84 LEU N N 84 121.026 121.026 118.848 2.178 25109
4368 1 8 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.793 0.186 25109
4369 1 8 . 1 1 84 84 LEU C C 84 178.796 178.796 178.599 0.197 25109
4370 1 8 . 1 1 84 84 LEU CA C 84 57.522 57.522 56.926 0.596 25109
4371 1 8 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.496 0.999 25109
4372 1 8 . 1 1 84 84 LEU H H 84 7.770 7.770 7.409 0.361 25109
4373 1 8 . 1 1 85 85 ALA N N 85 121.525 121.525 122.401 -0.876 25109
4374 1 8 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.921 -0.260 25109
4375 1 8 . 1 1 85 85 ALA C C 85 179.322 179.322 179.153 0.169 25109
4376 1 8 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.178 0.662 25109
4377 1 8 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.127 0.800 25109
4378 1 8 . 1 1 85 85 ALA H H 85 8.126 8.126 7.546 0.580 25109
4379 1 8 . 1 1 86 86 ASP N N 86 115.349 115.349 118.507 -3.158 25109
4380 1 8 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.363 -0.090 25109
4381 1 8 . 1 1 86 86 ASP C C 86 178.463 178.463 178.698 -0.235 25109
4382 1 8 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.393 -1.682 25109
4383 1 8 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.974 -3.812 25109
4384 1 8 . 1 1 86 86 ASP H H 86 8.410 8.410 8.400 0.010 25109
4385 1 8 . 1 1 87 87 GLU N N 87 122.529 122.529 118.102 4.427 25109
4386 1 8 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.166 -0.130 25109
4387 1 8 . 1 1 87 87 GLU C C 87 178.508 178.508 178.809 -0.301 25109
4388 1 8 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.172 0.182 25109
4389 1 8 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.562 -1.289 25109
4390 1 8 . 1 1 87 87 GLU H H 87 8.012 8.012 7.987 0.025 25109
4391 1 8 . 1 1 88 88 VAL N N 88 119.148 119.148 119.366 -0.218 25109
4392 1 8 . 1 1 88 88 VAL HA H 88 3.330 3.330 4.105 -0.775 25109
4393 1 8 . 1 1 88 88 VAL C C 88 177.240 177.240 177.476 -0.236 25109
4394 1 8 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.167 2.082 25109
4395 1 8 . 1 1 88 88 VAL CB C 88 31.529 31.529 32.219 -0.690 25109
4396 1 8 . 1 1 88 88 VAL H H 88 8.291 8.291 7.511 0.780 25109
4397 1 8 . 1 1 89 89 ALA N N 89 120.709 120.709 122.814 -2.105 25109
4398 1 8 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.007 -0.092 25109
4399 1 8 . 1 1 89 89 ALA C C 89 180.186 180.186 179.795 0.391 25109
4400 1 8 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.642 0.417 25109
4401 1 8 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.277 -0.042 25109
4402 1 8 . 1 1 89 89 ALA H H 89 8.548 8.548 8.668 -0.120 25109
4403 1 8 . 1 1 90 90 SER N N 90 113.035 113.035 113.720 -0.685 25109
4404 1 8 . 1 1 90 90 SER HA H 90 4.047 4.047 4.169 -0.122 25109
4405 1 8 . 1 1 90 90 SER C C 90 177.564 177.564 176.554 1.010 25109
4406 1 8 . 1 1 90 90 SER CA C 90 61.771 61.771 61.840 -0.069 25109
4407 1 8 . 1 1 90 90 SER CB C 90 62.907 62.907 62.989 -0.082 25109
4408 1 8 . 1 1 90 90 SER H H 90 7.969 7.969 8.211 -0.242 25109
4409 1 8 . 1 1 91 91 VAL N N 91 123.417 123.417 123.763 -0.346 25109
4410 1 8 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.498 -0.151 25109
4411 1 8 . 1 1 91 91 VAL C C 91 178.428 178.428 177.717 0.711 25109
4412 1 8 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.387 -0.258 25109
4413 1 8 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.573 0.198 25109
4414 1 8 . 1 1 91 91 VAL H H 91 7.713 7.713 7.428 0.285 25109
4415 1 8 . 1 1 92 92 TYR N N 92 121.458 121.458 120.352 1.106 25109
4416 1 8 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.388 -0.197 25109
4417 1 8 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.925 1.069 25109
4418 1 8 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.798 0.187 25109
4419 1 8 . 1 1 92 92 TYR H H 92 8.395 8.395 8.288 0.107 25109
4420 1 8 . 1 1 93 93 GLN N N 93 115.549 115.549 117.662 -2.113 25109
4421 1 8 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.018 -0.307 25109
4422 1 8 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.804 0.290 25109
4423 1 8 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.985 -0.687 25109
4424 1 8 . 1 1 93 93 GLN H H 93 8.167 8.167 7.744 0.423 25109
4425 1 8 . 1 1 94 94 SER N N 94 115.923 115.923 115.946 -0.023 25109
4426 1 8 . 1 1 94 94 SER HA H 94 4.096 4.096 4.133 -0.037 25109
4427 1 8 . 1 1 94 94 SER CA C 94 60.971 60.971 60.691 0.280 25109
4428 1 8 . 1 1 94 94 SER CB C 94 62.635 62.635 63.581 -0.946 25109
4429 1 8 . 1 1 94 94 SER H H 94 7.642 7.642 7.359 0.283 25109
4430 1 8 . 1 1 95 95 TYR N N 95 119.565 119.565 121.929 -2.364 25109
4431 1 8 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.429 0.330 25109
4432 1 8 . 1 1 95 95 TYR C C 95 175.334 175.334 173.889 1.445 25109
4433 1 8 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.695 0.003 25109
4434 1 8 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.454 1.865 25109
4435 1 8 . 1 1 95 95 TYR H H 95 7.069 7.069 7.966 -0.897 25109
4436 1 8 . 1 1 96 96 GLN N N 96 119.872 119.872 121.121 -1.249 25109
4437 1 8 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.554 -0.189 25109
4438 1 8 . 1 1 96 96 GLN C C 96 173.612 173.612 173.776 -0.164 25109
4439 1 8 . 1 1 96 96 GLN CA C 96 54.336 54.336 54.260 0.076 25109
4440 1 8 . 1 1 96 96 GLN CB C 96 28.494 28.494 28.522 -0.028 25109
4441 1 8 . 1 1 96 96 GLN H H 96 7.409 7.409 7.876 -0.467 25109
4442 1 8 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.441 -0.123 25109
4443 1 8 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.642 -0.627 25109
4444 1 8 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.270 -0.173 25109
4445 1 8 . 1 1 98 98 ARG N N 98 121.759 121.759 119.349 2.410 25109
4446 1 8 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.749 -0.407 25109
4447 1 8 . 1 1 98 98 ARG C C 98 176.848 176.848 175.381 1.467 25109
4448 1 8 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.626 1.595 25109
4449 1 8 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.891 0.196 25109
4450 1 8 . 1 1 98 98 ARG H H 98 8.423 8.423 7.778 0.645 25109
4451 1 8 . 1 1 99 99 THR N N 99 115.292 115.292 113.755 1.537 25109
4452 1 8 . 1 1 99 99 THR HA H 99 4.323 4.323 4.491 -0.168 25109
4453 1 8 . 1 1 99 99 THR C C 99 174.350 174.350 173.568 0.782 25109
4454 1 8 . 1 1 99 99 THR CA C 99 61.906 61.906 61.175 0.731 25109
4455 1 8 . 1 1 99 99 THR CB C 99 70.180 70.180 69.627 0.553 25109
4456 1 8 . 1 1 99 99 THR H H 99 8.179 8.179 8.348 -0.169 25109
4457 1 9 . 1 1 0 0 SER N N 0 115.693 115.693 117.924 -2.231 25109
4458 1 9 . 1 1 0 0 SER HA H 0 4.531 4.531 4.734 -0.203 25109
4459 1 9 . 1 1 0 0 SER C C 0 174.557 174.557 173.774 0.783 25109
4460 1 9 . 1 1 0 0 SER CA C 0 58.478 58.478 58.222 0.256 25109
4461 1 9 . 1 1 0 0 SER CB C 0 64.380 64.380 64.182 0.198 25109
4462 1 9 . 1 1 0 0 SER H H 0 8.631 8.631 8.525 0.106 25109
4463 1 9 . 1 1 1 1 MET N N 1 123.111 123.111 121.943 1.168 25109
4464 1 9 . 1 1 1 1 MET HA H 1 4.728 4.728 4.842 -0.114 25109
4465 1 9 . 1 1 1 1 MET C C 1 174.846 174.846 174.085 0.761 25109
4466 1 9 . 1 1 1 1 MET CA C 1 55.655 55.655 52.781 2.874 25109
4467 1 9 . 1 1 1 1 MET CB C 1 32.035 32.035 33.029 -0.994 25109
4468 1 9 . 1 1 1 1 MET H H 1 8.641 8.641 8.485 0.156 25109
4469 1 9 . 1 1 2 2 PRO HA H 2 4.477 4.477 5.211 -0.734 25109
4470 1 9 . 1 1 2 2 PRO CB C 2 32.000 32.000 30.669 1.331 25109
4471 1 9 . 1 1 3 3 PHE N N 3 121.126 121.126 126.050 -4.924 25109
4472 1 9 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.462 -0.096 25109
4473 1 9 . 1 1 3 3 PHE CA C 3 60.862 60.862 60.196 0.666 25109
4474 1 9 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.647 -1.279 25109
4475 1 9 . 1 1 3 3 PHE H H 3 8.177 8.177 8.262 -0.085 25109
4476 1 9 . 1 1 4 4 ALA N N 4 121.170 121.170 121.280 -0.110 25109
4477 1 9 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.058 -0.223 25109
4478 1 9 . 1 1 4 4 ALA C C 4 181.522 181.522 178.971 2.551 25109
4479 1 9 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.351 0.103 25109
4480 1 9 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.260 1.176 25109
4481 1 9 . 1 1 4 4 ALA H H 4 8.444 8.444 8.972 -0.528 25109
4482 1 9 . 1 1 5 5 GLU N N 5 118.932 118.932 118.969 -0.037 25109
4483 1 9 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.960 -0.105 25109
4484 1 9 . 1 1 5 5 GLU C C 5 177.971 177.971 178.022 -0.051 25109
4485 1 9 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.949 0.682 25109
4486 1 9 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.679 0.082 25109
4487 1 9 . 1 1 5 5 GLU H H 5 8.454 8.454 8.623 -0.169 25109
4488 1 9 . 1 1 6 6 ASP N N 6 120.471 120.471 119.261 1.210 25109
4489 1 9 . 1 1 6 6 ASP C C 6 178.885 178.885 177.952 0.933 25109
4490 1 9 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.463 -0.391 25109
4491 1 9 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.533 -1.401 25109
4492 1 9 . 1 1 6 6 ASP H H 6 8.316 8.316 8.461 -0.145 25109
4493 1 9 . 1 1 7 7 LYS N N 7 118.335 118.335 118.684 -0.349 25109
4494 1 9 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.873 -0.183 25109
4495 1 9 . 1 1 7 7 LYS C C 7 180.080 180.080 179.137 0.943 25109
4496 1 9 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.356 0.364 25109
4497 1 9 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.160 0.634 25109
4498 1 9 . 1 1 7 7 LYS H H 7 8.249 8.249 7.433 0.816 25109
4499 1 9 . 1 1 8 8 THR N N 8 119.222 119.222 117.321 1.901 25109
4500 1 9 . 1 1 8 8 THR HA H 8 3.975 3.975 4.034 -0.059 25109
4501 1 9 . 1 1 8 8 THR CA C 8 68.453 68.453 67.282 1.171 25109
4502 1 9 . 1 1 8 8 THR CB C 8 67.387 67.387 68.652 -1.265 25109
4503 1 9 . 1 1 8 8 THR H H 8 7.897 7.897 8.033 -0.136 25109
4504 1 9 . 1 1 9 9 TYR N N 9 123.054 123.054 122.669 0.385 25109
4505 1 9 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.048 0.205 25109
4506 1 9 . 1 1 9 9 TYR C C 9 177.441 177.441 177.011 0.430 25109
4507 1 9 . 1 1 9 9 TYR CA C 9 61.898 61.898 61.977 -0.079 25109
4508 1 9 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.507 -0.658 25109
4509 1 9 . 1 1 9 9 TYR H H 9 8.605 8.605 8.331 0.274 25109
4510 1 9 . 1 1 10 10 LYS N N 10 118.366 118.366 116.401 1.965 25109
4511 1 9 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.856 -0.262 25109
4512 1 9 . 1 1 10 10 LYS C C 10 178.885 178.885 178.398 0.487 25109
4513 1 9 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.139 1.905 25109
4514 1 9 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.776 0.269 25109
4515 1 9 . 1 1 10 10 LYS H H 10 8.066 8.066 8.021 0.045 25109
4516 1 9 . 1 1 11 11 TYR N N 11 120.539 120.539 119.364 1.175 25109
4517 1 9 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.353 -0.363 25109
4518 1 9 . 1 1 11 11 TYR C C 11 178.233 178.233 177.905 0.328 25109
4519 1 9 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.057 1.471 25109
4520 1 9 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.770 -1.407 25109
4521 1 9 . 1 1 11 11 TYR H H 11 7.875 7.875 7.495 0.380 25109
4522 1 9 . 1 1 12 12 ILE N N 12 121.893 121.893 120.427 1.466 25109
4523 1 9 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.943 -0.847 25109
4524 1 9 . 1 1 12 12 ILE C C 12 177.015 177.015 177.476 -0.461 25109
4525 1 9 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.243 2.520 25109
4526 1 9 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.208 1.344 25109
4527 1 9 . 1 1 12 12 ILE H H 12 8.154 8.154 8.661 -0.507 25109
4528 1 9 . 1 1 13 13 CYS N N 13 113.894 113.894 117.646 -3.752 25109
4529 1 9 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.821 0.066 25109
4530 1 9 . 1 1 13 13 CYS C C 13 178.288 178.288 176.286 2.002 25109
4531 1 9 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.962 2.375 25109
4532 1 9 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.491 0.514 25109
4533 1 9 . 1 1 13 13 CYS H H 13 7.551 7.551 7.904 -0.353 25109
4534 1 9 . 1 1 14 14 ARG N N 14 119.228 119.228 119.709 -0.481 25109
4535 1 9 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.122 -0.052 25109
4536 1 9 . 1 1 14 14 ARG C C 14 177.127 177.127 177.409 -0.282 25109
4537 1 9 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.892 -0.398 25109
4538 1 9 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.455 -0.033 25109
4539 1 9 . 1 1 14 14 ARG H H 14 7.991 7.991 7.685 0.306 25109
4540 1 9 . 1 1 15 15 ASN N N 15 117.367 117.367 115.720 1.647 25109
4541 1 9 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.852 0.117 25109
4542 1 9 . 1 1 15 15 ASN CA C 15 52.763 52.763 53.322 -0.559 25109
4543 1 9 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.934 0.651 25109
4544 1 9 . 1 1 15 15 ASN H H 15 7.643 7.643 7.672 -0.029 25109
4545 1 9 . 1 1 16 16 PHE N N 16 122.356 122.356 123.501 -1.145 25109
4546 1 9 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.227 -0.011 25109
4547 1 9 . 1 1 16 16 PHE C C 16 178.084 178.084 177.019 1.065 25109
4548 1 9 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.695 1.482 25109
4549 1 9 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.137 1.452 25109
4550 1 9 . 1 1 16 16 PHE H H 16 6.992 6.992 7.924 -0.932 25109
4551 1 9 . 1 1 17 17 SER N N 17 112.937 112.937 114.562 -1.625 25109
4552 1 9 . 1 1 17 17 SER HA H 17 4.199 4.199 4.131 0.068 25109
4553 1 9 . 1 1 17 17 SER C C 17 176.726 176.726 176.813 -0.087 25109
4554 1 9 . 1 1 17 17 SER CA C 17 62.052 62.052 60.654 1.398 25109
4555 1 9 . 1 1 17 17 SER CB C 17 62.552 62.552 62.680 -0.128 25109
4556 1 9 . 1 1 17 17 SER H H 17 8.840 8.840 8.733 0.107 25109
4557 1 9 . 1 1 18 18 ASN N N 18 118.809 118.809 120.938 -2.129 25109
4558 1 9 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.523 -0.165 25109
4559 1 9 . 1 1 18 18 ASN C C 18 175.967 175.967 177.418 -1.451 25109
4560 1 9 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.844 -0.934 25109
4561 1 9 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.229 -0.401 25109
4562 1 9 . 1 1 18 18 ASN H H 18 8.130 8.130 8.184 -0.054 25109
4563 1 9 . 1 1 19 19 PHE N N 19 115.750 115.750 117.891 -2.141 25109
4564 1 9 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.616 -0.331 25109
4565 1 9 . 1 1 19 19 PHE C C 19 175.370 175.370 176.755 -1.385 25109
4566 1 9 . 1 1 19 19 PHE CA C 19 58.862 58.862 59.660 -0.798 25109
4567 1 9 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.666 1.212 25109
4568 1 9 . 1 1 19 19 PHE H H 19 8.062 8.062 7.604 0.458 25109
4569 1 9 . 1 1 20 20 CYS N N 20 113.958 113.958 116.702 -2.744 25109
4570 1 9 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.660 -0.717 25109
4571 1 9 . 1 1 20 20 CYS C C 20 173.823 173.823 175.299 -1.476 25109
4572 1 9 . 1 1 20 20 CYS CA C 20 61.788 61.788 59.496 2.292 25109
4573 1 9 . 1 1 20 20 CYS CB C 20 27.383 27.383 26.708 0.675 25109
4574 1 9 . 1 1 20 20 CYS H H 20 6.850 6.850 7.471 -0.621 25109
4575 1 9 . 1 1 21 21 ASN N N 21 116.691 116.691 116.803 -0.112 25109
4576 1 9 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.723 0.021 25109
4577 1 9 . 1 1 21 21 ASN C C 21 175.299 175.299 174.821 0.478 25109
4578 1 9 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.067 0.223 25109
4579 1 9 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.514 -1.201 25109
4580 1 9 . 1 1 21 21 ASN H H 21 8.251 8.251 7.517 0.734 25109
4581 1 9 . 1 1 22 22 VAL N N 22 122.431 122.431 119.122 3.309 25109
4582 1 9 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.124 -0.574 25109
4583 1 9 . 1 1 22 22 VAL C C 22 174.034 174.034 174.419 -0.385 25109
4584 1 9 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.450 3.487 25109
4585 1 9 . 1 1 22 22 VAL CB C 22 31.523 31.523 33.617 -2.095 25109
4586 1 9 . 1 1 22 22 VAL H H 22 7.573 7.573 7.364 0.209 25109
4587 1 9 . 1 1 23 23 ASP N N 23 127.219 127.219 121.197 6.022 25109
4588 1 9 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.890 -1.704 25109
4589 1 9 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.946 -3.153 25109
4590 1 9 . 1 1 23 23 ASP H H 23 8.687 8.687 8.433 0.254 25109
4591 1 9 . 1 1 24 24 VAL N N 24 127.835 127.835 121.456 6.379 25109
4592 1 9 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.184 -0.891 25109
4593 1 9 . 1 1 24 24 VAL C C 24 176.867 176.867 177.144 -0.277 25109
4594 1 9 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.490 3.673 25109
4595 1 9 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.677 -0.662 25109
4596 1 9 . 1 1 24 24 VAL H H 24 9.409 9.409 8.671 0.738 25109
4597 1 9 . 1 1 25 25 VAL N N 25 114.324 114.324 117.116 -2.792 25109
4598 1 9 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.977 -0.458 25109
4599 1 9 . 1 1 25 25 VAL C C 25 178.006 178.006 178.278 -0.272 25109
4600 1 9 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.188 1.500 25109
4601 1 9 . 1 1 25 25 VAL CB C 25 31.532 31.532 30.826 0.706 25109
4602 1 9 . 1 1 25 25 VAL H H 25 8.038 8.038 8.018 0.020 25109
4603 1 9 . 1 1 26 26 GLU N N 26 117.009 117.009 119.622 -2.613 25109
4604 1 9 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.212 -0.121 25109
4605 1 9 . 1 1 26 26 GLU C C 26 177.303 177.303 177.566 -0.263 25109
4606 1 9 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.517 -1.085 25109
4607 1 9 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.311 -0.345 25109
4608 1 9 . 1 1 26 26 GLU H H 26 7.220 7.220 8.951 -1.731 25109
4609 1 9 . 1 1 27 27 ILE N N 27 114.080 114.080 118.151 -4.071 25109
4610 1 9 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.973 0.388 25109
4611 1 9 . 1 1 27 27 ILE CA C 27 62.732 62.732 62.996 -0.264 25109
4612 1 9 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.758 0.833 25109
4613 1 9 . 1 1 27 27 ILE H H 27 7.647 7.647 7.225 0.422 25109
4614 1 9 . 1 1 28 28 LEU N N 28 121.867 121.867 121.272 0.595 25109
4615 1 9 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.401 -0.464 25109
4616 1 9 . 1 1 28 28 LEU C C 28 175.756 175.756 176.983 -1.227 25109
4617 1 9 . 1 1 28 28 LEU CA C 28 59.967 59.967 59.709 0.258 25109
4618 1 9 . 1 1 28 28 LEU CB C 28 39.513 39.513 39.211 0.302 25109
4619 1 9 . 1 1 28 28 LEU H H 28 7.434 7.434 7.483 -0.049 25109
4620 1 9 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.334 -0.124 25109
4621 1 9 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.067 0.243 25109
4622 1 9 . 1 1 30 30 TYR N N 30 113.832 113.832 115.962 -2.130 25109
4623 1 9 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.534 -0.032 25109
4624 1 9 . 1 1 30 30 TYR C C 30 174.386 174.386 175.115 -0.729 25109
4625 1 9 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.587 -1.893 25109
4626 1 9 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.740 -0.641 25109
4627 1 9 . 1 1 30 30 TYR H H 30 7.628 7.628 7.656 -0.028 25109
4628 1 9 . 1 1 31 31 LEU N N 31 118.331 118.331 120.043 -1.712 25109
4629 1 9 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.877 0.000 25109
4630 1 9 . 1 1 31 31 LEU C C 31 173.849 173.849 175.373 -1.524 25109
4631 1 9 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.724 -0.032 25109
4632 1 9 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.489 0.313 25109
4633 1 9 . 1 1 31 31 LEU H H 31 7.619 7.619 7.347 0.272 25109
4634 1 9 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.567 -0.212 25109
4635 1 9 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.846 -0.436 25109
4636 1 9 . 1 1 33 33 CYS N N 33 110.978 110.978 116.938 -5.960 25109
4637 1 9 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.020 0.321 25109
4638 1 9 . 1 1 33 33 CYS C C 33 174.139 174.139 174.539 -0.400 25109
4639 1 9 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.966 -2.754 25109
4640 1 9 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.271 1.651 25109
4641 1 9 . 1 1 33 33 CYS H H 33 6.414 6.414 7.816 -1.402 25109
4642 1 9 . 1 1 34 34 LEU N N 34 123.111 123.111 120.840 2.271 25109
4643 1 9 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.374 0.232 25109
4644 1 9 . 1 1 34 34 LEU C C 34 176.646 176.646 177.070 -0.424 25109
4645 1 9 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.328 -0.437 25109
4646 1 9 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.933 -0.242 25109
4647 1 9 . 1 1 34 34 LEU H H 34 7.550 7.550 7.362 0.188 25109
4648 1 9 . 1 1 35 35 THR N N 35 113.831 113.831 116.185 -2.354 25109
4649 1 9 . 1 1 35 35 THR HA H 35 4.205 4.205 4.336 -0.131 25109
4650 1 9 . 1 1 35 35 THR C C 35 175.324 175.324 175.850 -0.526 25109
4651 1 9 . 1 1 35 35 THR CA C 35 61.200 61.200 61.481 -0.281 25109
4652 1 9 . 1 1 35 35 THR CB C 35 71.318 71.318 70.111 1.207 25109
4653 1 9 . 1 1 35 35 THR H H 35 8.586 8.586 8.156 0.430 25109
4654 1 9 . 1 1 36 36 ALA N N 36 124.128 124.128 126.946 -2.818 25109
4655 1 9 . 1 1 36 36 ALA HA H 36 3.924 3.924 3.986 -0.062 25109
4656 1 9 . 1 1 36 36 ALA C C 36 180.397 180.397 179.907 0.490 25109
4657 1 9 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.254 0.666 25109
4658 1 9 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.768 -0.965 25109
4659 1 9 . 1 1 36 36 ALA H H 36 8.836 8.836 8.796 0.040 25109
4660 1 9 . 1 1 37 37 ARG N N 37 116.793 116.793 119.144 -2.351 25109
4661 1 9 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.049 -0.063 25109
4662 1 9 . 1 1 37 37 ARG C C 37 179.272 179.272 178.115 1.157 25109
4663 1 9 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.077 0.155 25109
4664 1 9 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.499 0.406 25109
4665 1 9 . 1 1 37 37 ARG H H 37 8.060 8.060 8.470 -0.410 25109
4666 1 9 . 1 1 38 38 ASP N N 38 120.030 120.030 117.742 2.288 25109
4667 1 9 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.361 -0.113 25109
4668 1 9 . 1 1 38 38 ASP C C 38 178.885 178.885 178.551 0.334 25109
4669 1 9 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.183 -0.996 25109
4670 1 9 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.446 0.487 25109
4671 1 9 . 1 1 38 38 ASP H H 38 7.782 7.782 7.651 0.131 25109
4672 1 9 . 1 1 39 39 GLN N N 39 118.223 118.223 117.852 0.371 25109
4673 1 9 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.062 -0.397 25109
4674 1 9 . 1 1 39 39 GLN C C 39 178.041 178.041 178.140 -0.099 25109
4675 1 9 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.220 2.381 25109
4676 1 9 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.733 -0.936 25109
4677 1 9 . 1 1 39 39 GLN H H 39 8.476 8.476 7.982 0.494 25109
4678 1 9 . 1 1 40 40 ASP N N 40 117.908 117.908 120.740 -2.832 25109
4679 1 9 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.354 -0.101 25109
4680 1 9 . 1 1 40 40 ASP C C 40 178.639 178.639 178.162 0.477 25109
4681 1 9 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.846 -1.446 25109
4682 1 9 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.820 -2.792 25109
4683 1 9 . 1 1 40 40 ASP H H 40 8.386 8.386 8.329 0.057 25109
4684 1 9 . 1 1 41 41 ARG N N 41 120.990 120.990 119.005 1.985 25109
4685 1 9 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.076 -0.034 25109
4686 1 9 . 1 1 41 41 ARG C C 41 179.795 179.795 178.625 1.170 25109
4687 1 9 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.306 1.139 25109
4688 1 9 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.596 0.662 25109
4689 1 9 . 1 1 41 41 ARG H H 41 8.130 8.130 7.487 0.643 25109
4690 1 9 . 1 1 42 42 LEU N N 42 121.219 121.219 120.556 0.663 25109
4691 1 9 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.126 -0.191 25109
4692 1 9 . 1 1 42 42 LEU C C 42 178.850 178.850 179.072 -0.222 25109
4693 1 9 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.900 0.367 25109
4694 1 9 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.441 0.592 25109
4695 1 9 . 1 1 42 42 LEU H H 42 8.179 8.179 7.460 0.719 25109
4696 1 9 . 1 1 43 43 ARG N N 43 119.310 119.310 119.659 -0.349 25109
4697 1 9 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.925 -0.201 25109
4698 1 9 . 1 1 43 43 ARG C C 43 179.099 179.099 178.547 0.552 25109
4699 1 9 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.599 1.215 25109
4700 1 9 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.215 -0.036 25109
4701 1 9 . 1 1 43 43 ARG H H 43 8.296 8.296 8.492 -0.196 25109
4702 1 9 . 1 1 44 44 ALA N N 44 121.305 121.305 120.447 0.858 25109
4703 1 9 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.204 -0.101 25109
4704 1 9 . 1 1 44 44 ALA C C 44 180.924 180.924 180.119 0.805 25109
4705 1 9 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.997 0.228 25109
4706 1 9 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.314 -0.218 25109
4707 1 9 . 1 1 44 44 ALA H H 44 7.774 7.774 8.271 -0.497 25109
4708 1 9 . 1 1 45 45 THR N N 45 115.017 115.017 115.094 -0.077 25109
4709 1 9 . 1 1 45 45 THR HA H 45 3.879 3.879 4.099 -0.220 25109
4710 1 9 . 1 1 45 45 THR CA C 45 66.327 66.327 66.366 -0.039 25109
4711 1 9 . 1 1 45 45 THR CB C 45 68.809 68.809 68.231 0.578 25109
4712 1 9 . 1 1 45 45 THR H H 45 8.167 8.167 8.026 0.141 25109
4713 1 9 . 1 1 46 46 CYS N N 46 123.609 123.609 120.302 3.307 25109
4714 1 9 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.559 -0.540 25109
4715 1 9 . 1 1 46 46 CYS C C 46 178.077 178.077 176.327 1.750 25109
4716 1 9 . 1 1 46 46 CYS CA C 46 62.945 62.945 63.175 -0.230 25109
4717 1 9 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.995 -0.856 25109
4718 1 9 . 1 1 46 46 CYS H H 46 8.084 8.084 8.308 -0.224 25109
4719 1 9 . 1 1 47 47 THR N N 47 115.520 115.520 113.626 1.894 25109
4720 1 9 . 1 1 47 47 THR HA H 47 3.915 3.915 4.253 -0.338 25109
4721 1 9 . 1 1 47 47 THR CA C 47 66.063 66.063 64.231 1.832 25109
4722 1 9 . 1 1 47 47 THR CB C 47 69.245 69.245 68.545 0.700 25109
4723 1 9 . 1 1 47 47 THR H H 47 7.735 7.735 7.643 0.092 25109
4724 1 9 . 1 1 48 48 LEU N N 48 120.099 120.099 119.950 0.149 25109
4725 1 9 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.530 -0.304 25109
4726 1 9 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.223 1.340 25109
4727 1 9 . 1 1 48 48 LEU CB C 48 43.625 43.625 43.153 0.472 25109
4728 1 9 . 1 1 48 48 LEU H H 48 7.464 7.464 7.459 0.005 25109
4729 1 9 . 1 1 49 49 SER N N 49 111.979 111.979 111.227 0.752 25109
4730 1 9 . 1 1 49 49 SER HA H 49 4.661 4.661 4.555 0.106 25109
4731 1 9 . 1 1 49 49 SER C C 49 175.581 175.581 174.650 0.931 25109
4732 1 9 . 1 1 49 49 SER CA C 49 59.590 59.590 59.131 0.459 25109
4733 1 9 . 1 1 49 49 SER CB C 49 65.335 65.335 65.633 -0.298 25109
4734 1 9 . 1 1 49 49 SER H H 49 8.781 8.781 8.350 0.431 25109
4735 1 9 . 1 1 50 50 GLY N N 50 110.194 110.194 110.240 -0.046 25109
4736 1 9 . 1 1 50 50 GLY C C 50 175.123 175.123 174.191 0.932 25109
4737 1 9 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.568 -0.666 25109
4738 1 9 . 1 1 50 50 GLY H H 50 7.955 7.955 7.797 0.158 25109
4739 1 9 . 1 1 51 51 ASN N N 51 121.050 121.050 122.407 -1.357 25109
4740 1 9 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.575 -0.325 25109
4741 1 9 . 1 1 51 51 ASN C C 51 176.403 176.403 176.936 -0.533 25109
4742 1 9 . 1 1 51 51 ASN CA C 51 59.303 59.303 54.562 4.741 25109
4743 1 9 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.710 2.889 25109
4744 1 9 . 1 1 51 51 ASN H H 51 8.898 8.898 8.628 0.270 25109
4745 1 9 . 1 1 52 52 ARG N N 52 119.825 119.825 121.213 -1.388 25109
4746 1 9 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.030 0.008 25109
4747 1 9 . 1 1 52 52 ARG C C 52 178.850 178.850 177.888 0.962 25109
4748 1 9 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.155 0.909 25109
4749 1 9 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.951 0.072 25109
4750 1 9 . 1 1 52 52 ARG H H 52 8.696 8.696 8.707 -0.011 25109
4751 1 9 . 1 1 53 53 ASP N N 53 116.032 116.032 117.361 -1.329 25109
4752 1 9 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.473 0.073 25109
4753 1 9 . 1 1 53 53 ASP C C 53 178.996 178.996 178.471 0.525 25109
4754 1 9 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.462 -1.383 25109
4755 1 9 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.367 -1.996 25109
4756 1 9 . 1 1 53 53 ASP H H 53 9.036 9.036 8.771 0.265 25109
4757 1 9 . 1 1 54 54 THR N N 54 115.848 115.848 118.477 -2.629 25109
4758 1 9 . 1 1 54 54 THR HA H 54 3.746 3.746 4.128 -0.382 25109
4759 1 9 . 1 1 54 54 THR CA C 54 67.885 67.885 66.400 1.485 25109
4760 1 9 . 1 1 54 54 THR CB C 54 66.953 66.953 68.952 -1.999 25109
4761 1 9 . 1 1 54 54 THR H H 54 7.782 7.782 7.446 0.336 25109
4762 1 9 . 1 1 55 55 LEU N N 55 125.987 125.987 122.885 3.102 25109
4763 1 9 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.040 -0.486 25109
4764 1 9 . 1 1 55 55 LEU C C 55 177.901 177.901 177.855 0.046 25109
4765 1 9 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.699 -0.246 25109
4766 1 9 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.809 0.054 25109
4767 1 9 . 1 1 55 55 LEU H H 55 8.740 8.740 8.678 0.062 25109
4768 1 9 . 1 1 56 56 TRP N N 56 116.672 116.672 120.603 -3.931 25109
4769 1 9 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.384 -0.304 25109
4770 1 9 . 1 1 56 56 TRP C C 56 179.588 179.588 178.278 1.310 25109
4771 1 9 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.586 -0.105 25109
4772 1 9 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.462 -0.270 25109
4773 1 9 . 1 1 56 56 TRP H H 56 7.642 7.642 8.106 -0.464 25109
4774 1 9 . 1 1 57 57 HIS N N 57 115.754 115.754 117.773 -2.019 25109
4775 1 9 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.115 0.161 25109
4776 1 9 . 1 1 57 57 HIS C C 57 177.514 177.514 177.721 -0.207 25109
4777 1 9 . 1 1 57 57 HIS CA C 57 58.952 58.952 58.701 0.251 25109
4778 1 9 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.982 -1.980 25109
4779 1 9 . 1 1 57 57 HIS H H 57 7.407 7.407 8.351 -0.944 25109
4780 1 9 . 1 1 58 58 LEU N N 58 123.934 123.934 122.000 1.934 25109
4781 1 9 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.762 0.025 25109
4782 1 9 . 1 1 58 58 LEU C C 58 178.115 178.115 177.782 0.333 25109
4783 1 9 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.194 0.715 25109
4784 1 9 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.337 -0.522 25109
4785 1 9 . 1 1 58 58 LEU H H 58 8.996 8.996 8.325 0.671 25109
4786 1 9 . 1 1 59 59 PHE N N 59 117.721 117.721 116.521 1.200 25109
4787 1 9 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.622 0.313 25109
4788 1 9 . 1 1 59 59 PHE C C 59 176.987 176.987 177.936 -0.949 25109
4789 1 9 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.533 -1.420 25109
4790 1 9 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.727 -0.767 25109
4791 1 9 . 1 1 59 59 PHE H H 59 8.201 8.201 8.092 0.109 25109
4792 1 9 . 1 1 60 60 ASN N N 60 115.695 115.695 117.919 -2.224 25109
4793 1 9 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.092 -0.173 25109
4794 1 9 . 1 1 60 60 ASN C C 60 176.670 176.670 177.159 -0.489 25109
4795 1 9 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.542 0.214 25109
4796 1 9 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.635 0.684 25109
4797 1 9 . 1 1 60 60 ASN H H 60 7.666 7.666 8.112 -0.446 25109
4798 1 9 . 1 1 61 61 THR N N 61 115.110 115.110 116.771 -1.661 25109
4799 1 9 . 1 1 61 61 THR HA H 61 3.733 3.733 4.001 -0.268 25109
4800 1 9 . 1 1 61 61 THR CA C 61 66.319 66.319 66.198 0.121 25109
4801 1 9 . 1 1 61 61 THR CB C 61 69.174 69.174 69.045 0.129 25109
4802 1 9 . 1 1 61 61 THR H H 61 7.782 7.782 7.890 -0.108 25109
4803 1 9 . 1 1 62 62 LEU N N 62 121.559 121.559 122.159 -0.600 25109
4804 1 9 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.829 -0.340 25109
4805 1 9 . 1 1 62 62 LEU C C 62 176.600 176.600 178.176 -1.576 25109
4806 1 9 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.853 0.112 25109
4807 1 9 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.938 1.397 25109
4808 1 9 . 1 1 62 62 LEU H H 62 8.362 8.362 8.367 -0.005 25109
4809 1 9 . 1 1 63 63 GLN N N 63 109.150 109.150 115.850 -6.700 25109
4810 1 9 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.840 -1.763 25109
4811 1 9 . 1 1 63 63 GLN C C 63 175.194 175.194 176.734 -1.540 25109
4812 1 9 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.587 -1.321 25109
4813 1 9 . 1 1 63 63 GLN CB C 63 25.694 25.694 28.066 -2.372 25109
4814 1 9 . 1 1 63 63 GLN H H 63 6.458 6.458 7.545 -1.087 25109
4815 1 9 . 1 1 64 64 ARG N N 64 116.029 116.029 117.423 -1.394 25109
4816 1 9 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.361 -0.263 25109
4817 1 9 . 1 1 64 64 ARG C C 64 176.459 176.459 175.911 0.548 25109
4818 1 9 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.187 0.956 25109
4819 1 9 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.462 0.122 25109
4820 1 9 . 1 1 64 64 ARG H H 64 6.596 6.596 7.366 -0.770 25109
4821 1 9 . 1 1 65 65 ARG N N 65 120.422 120.422 120.025 0.397 25109
4822 1 9 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.902 -0.068 25109
4823 1 9 . 1 1 65 65 ARG C C 65 173.436 173.436 173.744 -0.308 25109
4824 1 9 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.508 0.037 25109
4825 1 9 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.709 -1.713 25109
4826 1 9 . 1 1 65 65 ARG H H 65 7.932 7.932 7.933 -0.001 25109
4827 1 9 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.540 0.034 25109
4828 1 9 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.929 0.130 25109
4829 1 9 . 1 1 67 67 GLY N N 67 111.953 111.953 111.984 -0.031 25109
4830 1 9 . 1 1 67 67 GLY C C 67 177.057 177.057 176.397 0.660 25109
4831 1 9 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.477 0.830 25109
4832 1 9 . 1 1 67 67 GLY H H 67 9.198 9.198 9.221 -0.023 25109
4833 1 9 . 1 1 68 68 TRP N N 68 117.467 117.467 119.572 -2.105 25109
4834 1 9 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.328 0.014 25109
4835 1 9 . 1 1 68 68 TRP C C 68 177.690 177.690 176.345 1.345 25109
4836 1 9 . 1 1 68 68 TRP CA C 68 60.116 60.116 60.027 0.089 25109
4837 1 9 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.081 1.109 25109
4838 1 9 . 1 1 68 68 TRP H H 68 7.647 7.647 7.732 -0.085 25109
4839 1 9 . 1 1 69 69 VAL N N 69 121.482 121.482 120.385 1.097 25109
4840 1 9 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.190 -0.553 25109
4841 1 9 . 1 1 69 69 VAL C C 69 177.993 177.993 178.039 -0.046 25109
4842 1 9 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.660 0.806 25109
4843 1 9 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.169 -0.143 25109
4844 1 9 . 1 1 69 69 VAL H H 69 6.666 6.666 7.272 -0.606 25109
4845 1 9 . 1 1 70 70 GLU N N 70 116.350 116.350 118.593 -2.243 25109
4846 1 9 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.913 -0.088 25109
4847 1 9 . 1 1 70 70 GLU C C 70 180.362 180.362 178.949 1.413 25109
4848 1 9 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.038 0.182 25109
4849 1 9 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.118 -1.813 25109
4850 1 9 . 1 1 70 70 GLU H H 70 7.410 7.410 7.699 -0.289 25109
4851 1 9 . 1 1 71 71 TYR N N 71 116.750 116.750 118.280 -1.530 25109
4852 1 9 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.469 -0.019 25109
4853 1 9 . 1 1 71 71 TYR C C 71 178.411 178.411 177.878 0.533 25109
4854 1 9 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.463 1.139 25109
4855 1 9 . 1 1 71 71 TYR CB C 71 38.355 38.355 39.101 -0.746 25109
4856 1 9 . 1 1 71 71 TYR H H 71 7.159 7.159 7.699 -0.540 25109
4857 1 9 . 1 1 72 72 PHE N N 72 121.610 121.610 122.014 -0.404 25109
4858 1 9 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.301 0.201 25109
4859 1 9 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.646 -0.826 25109
4860 1 9 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.418 0.631 25109
4861 1 9 . 1 1 72 72 PHE H H 72 9.007 9.007 8.690 0.317 25109
4862 1 9 . 1 1 73 73 ILE N N 73 119.200 119.200 118.014 1.186 25109
4863 1 9 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.539 -0.359 25109
4864 1 9 . 1 1 73 73 ILE C C 73 177.620 177.620 177.546 0.074 25109
4865 1 9 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.514 1.683 25109
4866 1 9 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.463 1.560 25109
4867 1 9 . 1 1 73 73 ILE H H 73 8.644 8.644 8.756 -0.112 25109
4868 1 9 . 1 1 74 74 ALA N N 74 119.624 119.624 121.328 -1.704 25109
4869 1 9 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.024 -0.070 25109
4870 1 9 . 1 1 74 74 ALA C C 74 181.030 181.030 179.267 1.763 25109
4871 1 9 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.860 0.551 25109
4872 1 9 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.938 0.198 25109
4873 1 9 . 1 1 74 74 ALA H H 74 7.476 7.476 7.966 -0.490 25109
4874 1 9 . 1 1 75 75 ALA N N 75 123.625 123.625 122.394 1.231 25109
4875 1 9 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.759 0.079 25109
4876 1 9 . 1 1 75 75 ALA C C 75 179.272 179.272 179.620 -0.348 25109
4877 1 9 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.853 0.249 25109
4878 1 9 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.259 1.333 25109
4879 1 9 . 1 1 75 75 ALA H H 75 8.524 8.524 7.596 0.928 25109
4880 1 9 . 1 1 76 76 LEU N N 76 118.114 118.114 120.010 -1.896 25109
4881 1 9 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.960 -0.288 25109
4882 1 9 . 1 1 76 76 LEU C C 76 180.001 180.001 178.942 1.059 25109
4883 1 9 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.306 0.950 25109
4884 1 9 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.240 1.379 25109
4885 1 9 . 1 1 76 76 LEU H H 76 8.153 8.153 7.532 0.621 25109
4886 1 9 . 1 1 77 77 ARG N N 77 117.830 117.830 119.291 -1.461 25109
4887 1 9 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.987 -0.540 25109
4888 1 9 . 1 1 77 77 ARG C C 77 180.889 180.889 179.343 1.546 25109
4889 1 9 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.415 1.651 25109
4890 1 9 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.996 -0.799 25109
4891 1 9 . 1 1 77 77 ARG H H 77 7.945 7.945 7.837 0.108 25109
4892 1 9 . 1 1 78 78 GLY N N 78 110.202 110.202 106.741 3.461 25109
4893 1 9 . 1 1 78 78 GLY C C 78 174.807 174.807 175.316 -0.509 25109
4894 1 9 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.415 0.145 25109
4895 1 9 . 1 1 78 78 GLY H H 78 8.269 8.269 8.341 -0.072 25109
4896 1 9 . 1 1 79 79 CYS N N 79 115.567 115.567 116.263 -0.696 25109
4897 1 9 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.440 -0.051 25109
4898 1 9 . 1 1 79 79 CYS C C 79 173.025 173.025 174.573 -1.548 25109
4899 1 9 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.461 2.496 25109
4900 1 9 . 1 1 79 79 CYS CB C 79 27.805 27.805 25.948 1.857 25109
4901 1 9 . 1 1 79 79 CYS H H 79 7.132 7.132 7.512 -0.380 25109
4902 1 9 . 1 1 80 80 GLU N N 80 111.759 111.759 115.986 -4.227 25109
4903 1 9 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.906 -0.173 25109
4904 1 9 . 1 1 80 80 GLU C C 80 175.827 175.827 175.140 0.687 25109
4905 1 9 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.890 -0.423 25109
4906 1 9 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.640 -1.923 25109
4907 1 9 . 1 1 80 80 GLU H H 80 7.772 7.772 7.911 -0.139 25109
4908 1 9 . 1 1 81 81 LEU N N 81 124.692 124.692 119.625 5.067 25109
4909 1 9 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.576 0.115 25109
4910 1 9 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.548 -0.593 25109
4911 1 9 . 1 1 81 81 LEU CB C 81 39.391 39.391 41.682 -2.291 25109
4912 1 9 . 1 1 81 81 LEU H H 81 8.167 8.167 8.067 0.100 25109
4913 1 9 . 1 1 82 82 VAL N N 82 118.320 118.320 119.772 -1.452 25109
4914 1 9 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.596 -0.419 25109
4915 1 9 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.401 0.309 25109
4916 1 9 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.719 0.229 25109
4917 1 9 . 1 1 82 82 VAL H H 82 7.141 7.141 7.420 -0.279 25109
4918 1 9 . 1 1 83 83 ASP N N 83 118.733 118.733 119.247 -0.514 25109
4919 1 9 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.360 -0.028 25109
4920 1 9 . 1 1 83 83 ASP C C 83 178.674 178.674 178.140 0.534 25109
4921 1 9 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.113 -0.670 25109
4922 1 9 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.760 -3.931 25109
4923 1 9 . 1 1 83 83 ASP H H 83 8.385 8.385 8.510 -0.125 25109
4924 1 9 . 1 1 84 84 LEU N N 84 121.026 121.026 119.332 1.694 25109
4925 1 9 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.970 0.009 25109
4926 1 9 . 1 1 84 84 LEU C C 84 178.796 178.796 178.561 0.235 25109
4927 1 9 . 1 1 84 84 LEU CA C 84 57.522 57.522 56.773 0.749 25109
4928 1 9 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.613 0.882 25109
4929 1 9 . 1 1 84 84 LEU H H 84 7.770 7.770 7.528 0.242 25109
4930 1 9 . 1 1 85 85 ALA N N 85 121.525 121.525 122.559 -1.034 25109
4931 1 9 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.953 -0.292 25109
4932 1 9 . 1 1 85 85 ALA C C 85 179.322 179.322 179.077 0.245 25109
4933 1 9 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.162 0.679 25109
4934 1 9 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.137 0.789 25109
4935 1 9 . 1 1 85 85 ALA H H 85 8.126 8.126 7.476 0.650 25109
4936 1 9 . 1 1 86 86 ASP N N 86 115.349 115.349 118.358 -3.009 25109
4937 1 9 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.380 -0.107 25109
4938 1 9 . 1 1 86 86 ASP C C 86 178.463 178.463 178.454 0.009 25109
4939 1 9 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.551 -1.840 25109
4940 1 9 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.984 -3.822 25109
4941 1 9 . 1 1 86 86 ASP H H 86 8.410 8.410 8.164 0.246 25109
4942 1 9 . 1 1 87 87 GLU N N 87 122.529 122.529 117.941 4.588 25109
4943 1 9 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.213 -0.177 25109
4944 1 9 . 1 1 87 87 GLU C C 87 178.508 178.508 178.505 0.003 25109
4945 1 9 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.110 0.244 25109
4946 1 9 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.664 -1.391 25109
4947 1 9 . 1 1 87 87 GLU H H 87 8.012 8.012 7.796 0.216 25109
4948 1 9 . 1 1 88 88 VAL N N 88 119.148 119.148 118.669 0.479 25109
4949 1 9 . 1 1 88 88 VAL HA H 88 3.330 3.330 4.046 -0.716 25109
4950 1 9 . 1 1 88 88 VAL C C 88 177.240 177.240 177.439 -0.199 25109
4951 1 9 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.456 1.793 25109
4952 1 9 . 1 1 88 88 VAL CB C 88 31.529 31.529 32.232 -0.703 25109
4953 1 9 . 1 1 88 88 VAL H H 88 8.291 8.291 7.505 0.786 25109
4954 1 9 . 1 1 89 89 ALA N N 89 120.709 120.709 123.432 -2.723 25109
4955 1 9 . 1 1 89 89 ALA HA H 89 3.915 3.915 3.946 -0.031 25109
4956 1 9 . 1 1 89 89 ALA C C 89 180.186 180.186 179.242 0.944 25109
4957 1 9 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.385 0.674 25109
4958 1 9 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.266 -0.031 25109
4959 1 9 . 1 1 89 89 ALA H H 89 8.548 8.548 8.612 -0.064 25109
4960 1 9 . 1 1 90 90 SER N N 90 113.035 113.035 112.118 0.917 25109
4961 1 9 . 1 1 90 90 SER HA H 90 4.047 4.047 4.182 -0.135 25109
4962 1 9 . 1 1 90 90 SER C C 90 177.564 177.564 176.117 1.447 25109
4963 1 9 . 1 1 90 90 SER CA C 90 61.771 61.771 60.760 1.011 25109
4964 1 9 . 1 1 90 90 SER CB C 90 62.907 62.907 63.225 -0.318 25109
4965 1 9 . 1 1 90 90 SER H H 90 7.969 7.969 8.152 -0.183 25109
4966 1 9 . 1 1 91 91 VAL N N 91 123.417 123.417 120.567 2.850 25109
4967 1 9 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.691 -0.344 25109
4968 1 9 . 1 1 91 91 VAL C C 91 178.428 178.428 177.362 1.066 25109
4969 1 9 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.537 0.592 25109
4970 1 9 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.657 0.114 25109
4971 1 9 . 1 1 91 91 VAL H H 91 7.713 7.713 7.443 0.270 25109
4972 1 9 . 1 1 92 92 TYR N N 92 121.458 121.458 121.110 0.348 25109
4973 1 9 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.523 -0.332 25109
4974 1 9 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.864 1.130 25109
4975 1 9 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.347 0.638 25109
4976 1 9 . 1 1 92 92 TYR H H 92 8.395 8.395 7.981 0.414 25109
4977 1 9 . 1 1 93 93 GLN N N 93 115.549 115.549 118.297 -2.748 25109
4978 1 9 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.003 -0.292 25109
4979 1 9 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.109 -0.015 25109
4980 1 9 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.267 0.031 25109
4981 1 9 . 1 1 93 93 GLN H H 93 8.167 8.167 7.977 0.190 25109
4982 1 9 . 1 1 94 94 SER N N 94 115.923 115.923 112.695 3.228 25109
4983 1 9 . 1 1 94 94 SER HA H 94 4.096 4.096 4.299 -0.203 25109
4984 1 9 . 1 1 94 94 SER CA C 94 60.971 60.971 59.341 1.630 25109
4985 1 9 . 1 1 94 94 SER CB C 94 62.635 62.635 64.084 -1.449 25109
4986 1 9 . 1 1 94 94 SER H H 94 7.642 7.642 7.518 0.124 25109
4987 1 9 . 1 1 95 95 TYR N N 95 119.565 119.565 122.098 -2.533 25109
4988 1 9 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.429 0.330 25109
4989 1 9 . 1 1 95 95 TYR C C 95 175.334 175.334 174.561 0.773 25109
4990 1 9 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.928 -0.230 25109
4991 1 9 . 1 1 95 95 TYR CB C 95 39.319 39.319 36.977 2.342 25109
4992 1 9 . 1 1 95 95 TYR H H 95 7.069 7.069 7.854 -0.785 25109
4993 1 9 . 1 1 96 96 GLN N N 96 119.872 119.872 119.837 0.035 25109
4994 1 9 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.934 0.431 25109
4995 1 9 . 1 1 96 96 GLN C C 96 173.612 173.612 173.678 -0.066 25109
4996 1 9 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.775 -1.439 25109
4997 1 9 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.333 1.161 25109
4998 1 9 . 1 1 96 96 GLN H H 96 7.409 7.409 8.027 -0.618 25109
4999 1 9 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.402 -0.084 25109
5000 1 9 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.543 -0.529 25109
5001 1 9 . 1 1 97 97 PRO CB C 97 32.098 32.098 31.939 0.159 25109
5002 1 9 . 1 1 98 98 ARG N N 98 121.759 121.759 117.341 4.418 25109
5003 1 9 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.564 -0.222 25109
5004 1 9 . 1 1 98 98 ARG C C 98 176.848 176.848 174.576 2.272 25109
5005 1 9 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.676 1.545 25109
5006 1 9 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.641 0.446 25109
5007 1 9 . 1 1 98 98 ARG H H 98 8.423 8.423 7.436 0.987 25109
5008 1 9 . 1 1 99 99 THR N N 99 115.292 115.292 112.665 2.627 25109
5009 1 9 . 1 1 99 99 THR HA H 99 4.323 4.323 4.496 -0.173 25109
5010 1 9 . 1 1 99 99 THR C C 99 174.350 174.350 174.642 -0.292 25109
5011 1 9 . 1 1 99 99 THR CA C 99 61.906 61.906 61.819 0.087 25109
5012 1 9 . 1 1 99 99 THR CB C 99 70.180 70.180 69.419 0.761 25109
5013 1 9 . 1 1 99 99 THR H H 99 8.179 8.179 8.257 -0.078 25109
5014 1 10 . 1 1 0 0 SER N N 0 115.693 115.693 116.692 -0.999 25109
5015 1 10 . 1 1 0 0 SER HA H 0 4.531 4.531 4.412 0.119 25109
5016 1 10 . 1 1 0 0 SER C C 0 174.557 174.557 174.937 -0.380 25109
5017 1 10 . 1 1 0 0 SER CA C 0 58.478 58.478 59.889 -1.411 25109
5018 1 10 . 1 1 0 0 SER CB C 0 64.380 64.380 63.668 0.712 25109
5019 1 10 . 1 1 0 0 SER H H 0 8.631 8.631 8.473 0.158 25109
5020 1 10 . 1 1 1 1 MET N N 1 123.111 123.111 120.242 2.869 25109
5021 1 10 . 1 1 1 1 MET HA H 1 4.728 4.728 4.253 0.475 25109
5022 1 10 . 1 1 1 1 MET C C 1 174.846 174.846 173.926 0.920 25109
5023 1 10 . 1 1 1 1 MET CA C 1 55.655 55.655 54.810 0.845 25109
5024 1 10 . 1 1 1 1 MET CB C 1 32.035 32.035 31.357 0.678 25109
5025 1 10 . 1 1 1 1 MET H H 1 8.641 8.641 8.462 0.179 25109
5026 1 10 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.747 -0.270 25109
5027 1 10 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.045 -0.046 25109
5028 1 10 . 1 1 3 3 PHE N N 3 121.126 121.126 125.072 -3.946 25109
5029 1 10 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.665 -0.299 25109
5030 1 10 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.812 1.050 25109
5031 1 10 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.900 -1.532 25109
5032 1 10 . 1 1 3 3 PHE H H 3 8.177 8.177 9.237 -1.060 25109
5033 1 10 . 1 1 4 4 ALA N N 4 121.170 121.170 122.337 -1.167 25109
5034 1 10 . 1 1 4 4 ALA HA H 4 3.835 3.835 3.982 -0.147 25109
5035 1 10 . 1 1 4 4 ALA C C 4 181.522 181.522 178.917 2.605 25109
5036 1 10 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.196 0.258 25109
5037 1 10 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.325 1.111 25109
5038 1 10 . 1 1 4 4 ALA H H 4 8.444 8.444 8.961 -0.517 25109
5039 1 10 . 1 1 5 5 GLU N N 5 118.932 118.932 119.504 -0.572 25109
5040 1 10 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.920 -0.065 25109
5041 1 10 . 1 1 5 5 GLU C C 5 177.971 177.971 178.237 -0.266 25109
5042 1 10 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.346 0.285 25109
5043 1 10 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.594 0.167 25109
5044 1 10 . 1 1 5 5 GLU H H 5 8.454 8.454 8.787 -0.333 25109
5045 1 10 . 1 1 6 6 ASP N N 6 120.471 120.471 120.059 0.412 25109
5046 1 10 . 1 1 6 6 ASP C C 6 178.885 178.885 178.232 0.653 25109
5047 1 10 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.704 -0.632 25109
5048 1 10 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.718 -1.586 25109
5049 1 10 . 1 1 6 6 ASP H H 6 8.316 8.316 8.531 -0.215 25109
5050 1 10 . 1 1 7 7 LYS N N 7 118.335 118.335 118.417 -0.082 25109
5051 1 10 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.886 -0.196 25109
5052 1 10 . 1 1 7 7 LYS C C 7 180.080 180.080 178.867 1.213 25109
5053 1 10 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.862 -0.142 25109
5054 1 10 . 1 1 7 7 LYS CB C 7 31.794 31.794 32.050 -0.255 25109
5055 1 10 . 1 1 7 7 LYS H H 7 8.249 8.249 8.043 0.206 25109
5056 1 10 . 1 1 8 8 THR N N 8 119.222 119.222 117.276 1.946 25109
5057 1 10 . 1 1 8 8 THR HA H 8 3.975 3.975 3.825 0.150 25109
5058 1 10 . 1 1 8 8 THR CA C 8 68.453 68.453 66.796 1.657 25109
5059 1 10 . 1 1 8 8 THR CB C 8 67.387 67.387 68.997 -1.610 25109
5060 1 10 . 1 1 8 8 THR H H 8 7.897 7.897 7.703 0.194 25109
5061 1 10 . 1 1 9 9 TYR N N 9 123.054 123.054 123.122 -0.068 25109
5062 1 10 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.203 0.050 25109
5063 1 10 . 1 1 9 9 TYR C C 9 177.441 177.441 176.982 0.459 25109
5064 1 10 . 1 1 9 9 TYR CA C 9 61.898 61.898 61.858 0.040 25109
5065 1 10 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.432 -0.584 25109
5066 1 10 . 1 1 9 9 TYR H H 9 8.605 8.605 8.584 0.021 25109
5067 1 10 . 1 1 10 10 LYS N N 10 118.366 118.366 116.491 1.875 25109
5068 1 10 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.693 -0.099 25109
5069 1 10 . 1 1 10 10 LYS C C 10 178.885 178.885 177.993 0.892 25109
5070 1 10 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.831 1.213 25109
5071 1 10 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.152 -0.107 25109
5072 1 10 . 1 1 10 10 LYS H H 10 8.066 8.066 8.348 -0.282 25109
5073 1 10 . 1 1 11 11 TYR N N 11 120.539 120.539 119.573 0.966 25109
5074 1 10 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.233 -0.243 25109
5075 1 10 . 1 1 11 11 TYR C C 11 178.233 178.233 177.650 0.583 25109
5076 1 10 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.185 1.343 25109
5077 1 10 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.055 -0.692 25109
5078 1 10 . 1 1 11 11 TYR H H 11 7.875 7.875 7.306 0.569 25109
5079 1 10 . 1 1 12 12 ILE N N 12 121.893 121.893 119.810 2.083 25109
5080 1 10 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.912 -0.816 25109
5081 1 10 . 1 1 12 12 ILE C C 12 177.015 177.015 178.361 -1.346 25109
5082 1 10 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.440 2.323 25109
5083 1 10 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.021 1.531 25109
5084 1 10 . 1 1 12 12 ILE H H 12 8.154 8.154 8.315 -0.161 25109
5085 1 10 . 1 1 13 13 CYS N N 13 113.894 113.894 118.010 -4.116 25109
5086 1 10 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.917 -0.030 25109
5087 1 10 . 1 1 13 13 CYS C C 13 178.288 178.288 176.538 1.750 25109
5088 1 10 . 1 1 13 13 CYS CA C 13 64.337 64.337 62.311 2.026 25109
5089 1 10 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.325 0.680 25109
5090 1 10 . 1 1 13 13 CYS H H 13 7.551 7.551 7.704 -0.153 25109
5091 1 10 . 1 1 14 14 ARG N N 14 119.228 119.228 116.605 2.623 25109
5092 1 10 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.179 -0.109 25109
5093 1 10 . 1 1 14 14 ARG C C 14 177.127 177.127 175.761 1.366 25109
5094 1 10 . 1 1 14 14 ARG CA C 14 58.494 58.494 57.313 1.181 25109
5095 1 10 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.042 0.380 25109
5096 1 10 . 1 1 14 14 ARG H H 14 7.991 7.991 7.675 0.316 25109
5097 1 10 . 1 1 15 15 ASN N N 15 117.367 117.367 115.395 1.972 25109
5098 1 10 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.857 0.112 25109
5099 1 10 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.377 0.386 25109
5100 1 10 . 1 1 15 15 ASN CB C 15 38.585 38.585 39.251 -0.666 25109
5101 1 10 . 1 1 15 15 ASN H H 15 7.643 7.643 7.672 -0.029 25109
5102 1 10 . 1 1 16 16 PHE N N 16 122.356 122.356 123.005 -0.649 25109
5103 1 10 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.901 0.315 25109
5104 1 10 . 1 1 16 16 PHE C C 16 178.084 178.084 176.789 1.295 25109
5105 1 10 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.609 1.568 25109
5106 1 10 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.987 1.602 25109
5107 1 10 . 1 1 16 16 PHE H H 16 6.992 6.992 7.513 -0.521 25109
5108 1 10 . 1 1 17 17 SER N N 17 112.937 112.937 115.219 -2.282 25109
5109 1 10 . 1 1 17 17 SER HA H 17 4.199 4.199 4.199 0.000 25109
5110 1 10 . 1 1 17 17 SER C C 17 176.726 176.726 175.810 0.916 25109
5111 1 10 . 1 1 17 17 SER CA C 17 62.052 62.052 61.701 0.351 25109
5112 1 10 . 1 1 17 17 SER CB C 17 62.552 62.552 62.702 -0.150 25109
5113 1 10 . 1 1 17 17 SER H H 17 8.840 8.840 8.652 0.188 25109
5114 1 10 . 1 1 18 18 ASN N N 18 118.809 118.809 119.755 -0.946 25109
5115 1 10 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.653 -0.295 25109
5116 1 10 . 1 1 18 18 ASN C C 18 175.967 175.967 175.407 0.560 25109
5117 1 10 . 1 1 18 18 ASN CA C 18 54.910 54.910 54.767 0.143 25109
5118 1 10 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.568 -0.740 25109
5119 1 10 . 1 1 18 18 ASN H H 18 8.130 8.130 8.466 -0.336 25109
5120 1 10 . 1 1 19 19 PHE N N 19 115.750 115.750 117.518 -1.768 25109
5121 1 10 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.729 -0.444 25109
5122 1 10 . 1 1 19 19 PHE C C 19 175.370 175.370 175.463 -0.093 25109
5123 1 10 . 1 1 19 19 PHE CA C 19 58.862 58.862 56.959 1.903 25109
5124 1 10 . 1 1 19 19 PHE CB C 19 39.878 39.878 39.306 0.572 25109
5125 1 10 . 1 1 19 19 PHE H H 19 8.062 8.062 7.714 0.348 25109
5126 1 10 . 1 1 20 20 CYS N N 20 113.958 113.958 116.857 -2.899 25109
5127 1 10 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.247 -0.304 25109
5128 1 10 . 1 1 20 20 CYS C C 20 173.823 173.823 174.781 -0.958 25109
5129 1 10 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.783 3.005 25109
5130 1 10 . 1 1 20 20 CYS CB C 20 27.383 27.383 29.254 -1.871 25109
5131 1 10 . 1 1 20 20 CYS H H 20 6.850 6.850 7.379 -0.529 25109
5132 1 10 . 1 1 21 21 ASN N N 21 116.691 116.691 120.016 -3.325 25109
5133 1 10 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.828 -0.084 25109
5134 1 10 . 1 1 21 21 ASN C C 21 175.299 175.299 174.035 1.264 25109
5135 1 10 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.550 0.740 25109
5136 1 10 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.277 0.036 25109
5137 1 10 . 1 1 21 21 ASN H H 21 8.251 8.251 8.151 0.100 25109
5138 1 10 . 1 1 22 22 VAL N N 22 122.431 122.431 119.616 2.815 25109
5139 1 10 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.269 -0.719 25109
5140 1 10 . 1 1 22 22 VAL C C 22 174.034 174.034 173.463 0.571 25109
5141 1 10 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.054 3.883 25109
5142 1 10 . 1 1 22 22 VAL CB C 22 31.523 31.523 34.779 -3.256 25109
5143 1 10 . 1 1 22 22 VAL H H 22 7.573 7.573 7.421 0.152 25109
5144 1 10 . 1 1 23 23 ASP N N 23 127.219 127.219 120.355 6.864 25109
5145 1 10 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.728 -1.542 25109
5146 1 10 . 1 1 23 23 ASP CB C 23 38.793 38.793 42.569 -3.776 25109
5147 1 10 . 1 1 23 23 ASP H H 23 8.687 8.687 8.518 0.169 25109
5148 1 10 . 1 1 24 24 VAL N N 24 127.835 127.835 118.405 9.430 25109
5149 1 10 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.249 -0.956 25109
5150 1 10 . 1 1 24 24 VAL C C 24 176.867 176.867 176.842 0.025 25109
5151 1 10 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.177 3.986 25109
5152 1 10 . 1 1 24 24 VAL CB C 24 32.015 32.015 34.383 -2.368 25109
5153 1 10 . 1 1 24 24 VAL H H 24 9.409 9.409 7.980 1.429 25109
5154 1 10 . 1 1 25 25 VAL N N 25 114.324 114.324 117.718 -3.394 25109
5155 1 10 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.003 -0.484 25109
5156 1 10 . 1 1 25 25 VAL C C 25 178.006 178.006 177.015 0.991 25109
5157 1 10 . 1 1 25 25 VAL CA C 25 66.688 66.688 64.738 1.950 25109
5158 1 10 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.573 -0.041 25109
5159 1 10 . 1 1 25 25 VAL H H 25 8.038 8.038 8.393 -0.355 25109
5160 1 10 . 1 1 26 26 GLU N N 26 117.009 117.009 118.858 -1.849 25109
5161 1 10 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.271 -0.180 25109
5162 1 10 . 1 1 26 26 GLU C C 26 177.303 177.303 177.706 -0.403 25109
5163 1 10 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.426 -0.994 25109
5164 1 10 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.796 -0.831 25109
5165 1 10 . 1 1 26 26 GLU H H 26 7.220 7.220 8.826 -1.606 25109
5166 1 10 . 1 1 27 27 ILE N N 27 114.080 114.080 117.941 -3.861 25109
5167 1 10 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.855 0.506 25109
5168 1 10 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.467 -0.735 25109
5169 1 10 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.449 1.143 25109
5170 1 10 . 1 1 27 27 ILE H H 27 7.647 7.647 7.774 -0.127 25109
5171 1 10 . 1 1 28 28 LEU N N 28 121.867 121.867 120.913 0.954 25109
5172 1 10 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.161 -0.224 25109
5173 1 10 . 1 1 28 28 LEU C C 28 175.756 175.756 176.835 -1.079 25109
5174 1 10 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.505 -0.538 25109
5175 1 10 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.795 0.718 25109
5176 1 10 . 1 1 28 28 LEU H H 28 7.434 7.434 7.509 -0.075 25109
5177 1 10 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.296 -0.086 25109
5178 1 10 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.162 0.148 25109
5179 1 10 . 1 1 30 30 TYR N N 30 113.832 113.832 115.582 -1.750 25109
5180 1 10 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.482 0.020 25109
5181 1 10 . 1 1 30 30 TYR C C 30 174.386 174.386 175.208 -0.822 25109
5182 1 10 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.764 -2.070 25109
5183 1 10 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.432 -0.333 25109
5184 1 10 . 1 1 30 30 TYR H H 30 7.628 7.628 7.626 0.002 25109
5185 1 10 . 1 1 31 31 LEU N N 31 118.331 118.331 118.608 -0.277 25109
5186 1 10 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.729 0.148 25109
5187 1 10 . 1 1 31 31 LEU C C 31 173.849 173.849 175.497 -1.648 25109
5188 1 10 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.801 -0.109 25109
5189 1 10 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.959 -0.157 25109
5190 1 10 . 1 1 31 31 LEU H H 31 7.619 7.619 7.498 0.121 25109
5191 1 10 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.559 -0.204 25109
5192 1 10 . 1 1 32 32 PRO CB C 32 31.410 31.410 32.093 -0.683 25109
5193 1 10 . 1 1 33 33 CYS N N 33 110.978 110.978 118.477 -7.499 25109
5194 1 10 . 1 1 33 33 CYS HA H 33 4.341 4.341 3.965 0.376 25109
5195 1 10 . 1 1 33 33 CYS C C 33 174.139 174.139 174.415 -0.276 25109
5196 1 10 . 1 1 33 33 CYS CA C 33 56.212 56.212 59.383 -3.171 25109
5197 1 10 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.278 1.644 25109
5198 1 10 . 1 1 33 33 CYS H H 33 6.414 6.414 7.803 -1.389 25109
5199 1 10 . 1 1 34 34 LEU N N 34 123.111 123.111 118.709 4.402 25109
5200 1 10 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.546 0.060 25109
5201 1 10 . 1 1 34 34 LEU C C 34 176.646 176.646 175.516 1.130 25109
5202 1 10 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.947 -0.056 25109
5203 1 10 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.558 -0.867 25109
5204 1 10 . 1 1 34 34 LEU H H 34 7.550 7.550 7.310 0.240 25109
5205 1 10 . 1 1 35 35 THR N N 35 113.831 113.831 114.077 -0.246 25109
5206 1 10 . 1 1 35 35 THR HA H 35 4.205 4.205 4.249 -0.044 25109
5207 1 10 . 1 1 35 35 THR C C 35 175.324 175.324 176.075 -0.751 25109
5208 1 10 . 1 1 35 35 THR CA C 35 61.200 61.200 61.666 -0.466 25109
5209 1 10 . 1 1 35 35 THR CB C 35 71.318 71.318 69.515 1.803 25109
5210 1 10 . 1 1 35 35 THR H H 35 8.586 8.586 7.958 0.628 25109
5211 1 10 . 1 1 36 36 ALA N N 36 124.128 124.128 127.488 -3.360 25109
5212 1 10 . 1 1 36 36 ALA HA H 36 3.924 3.924 3.971 -0.047 25109
5213 1 10 . 1 1 36 36 ALA C C 36 180.397 180.397 179.767 0.630 25109
5214 1 10 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.700 0.220 25109
5215 1 10 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.496 -0.693 25109
5216 1 10 . 1 1 36 36 ALA H H 36 8.836 8.836 8.659 0.177 25109
5217 1 10 . 1 1 37 37 ARG N N 37 116.793 116.793 118.150 -1.357 25109
5218 1 10 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.075 -0.089 25109
5219 1 10 . 1 1 37 37 ARG C C 37 179.272 179.272 178.051 1.221 25109
5220 1 10 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.371 -0.139 25109
5221 1 10 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.607 0.298 25109
5222 1 10 . 1 1 37 37 ARG H H 37 8.060 8.060 8.740 -0.680 25109
5223 1 10 . 1 1 38 38 ASP N N 38 120.030 120.030 119.432 0.598 25109
5224 1 10 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.394 -0.146 25109
5225 1 10 . 1 1 38 38 ASP C C 38 178.885 178.885 178.405 0.480 25109
5226 1 10 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.416 -1.229 25109
5227 1 10 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.260 0.673 25109
5228 1 10 . 1 1 38 38 ASP H H 38 7.782 7.782 8.605 -0.823 25109
5229 1 10 . 1 1 39 39 GLN N N 39 118.223 118.223 117.995 0.228 25109
5230 1 10 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.142 -0.477 25109
5231 1 10 . 1 1 39 39 GLN C C 39 178.041 178.041 178.153 -0.112 25109
5232 1 10 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.356 2.245 25109
5233 1 10 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.982 -1.185 25109
5234 1 10 . 1 1 39 39 GLN H H 39 8.476 8.476 7.739 0.738 25109
5235 1 10 . 1 1 40 40 ASP N N 40 117.908 117.908 121.342 -3.434 25109
5236 1 10 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.352 -0.099 25109
5237 1 10 . 1 1 40 40 ASP C C 40 178.639 178.639 178.023 0.616 25109
5238 1 10 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.461 -1.061 25109
5239 1 10 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.903 -2.875 25109
5240 1 10 . 1 1 40 40 ASP H H 40 8.386 8.386 8.359 0.027 25109
5241 1 10 . 1 1 41 41 ARG N N 41 120.990 120.990 119.970 1.020 25109
5242 1 10 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.971 0.071 25109
5243 1 10 . 1 1 41 41 ARG C C 41 179.795 179.795 178.620 1.175 25109
5244 1 10 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.744 -0.299 25109
5245 1 10 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.200 0.058 25109
5246 1 10 . 1 1 41 41 ARG H H 41 8.130 8.130 8.292 -0.162 25109
5247 1 10 . 1 1 42 42 LEU N N 42 121.219 121.219 119.409 1.810 25109
5248 1 10 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.078 -0.143 25109
5249 1 10 . 1 1 42 42 LEU C C 42 178.850 178.850 178.949 -0.099 25109
5250 1 10 . 1 1 42 42 LEU CA C 42 58.267 58.267 58.032 0.235 25109
5251 1 10 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.709 0.324 25109
5252 1 10 . 1 1 42 42 LEU H H 42 8.179 8.179 7.547 0.632 25109
5253 1 10 . 1 1 43 43 ARG N N 43 119.310 119.310 119.588 -0.278 25109
5254 1 10 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.874 -0.150 25109
5255 1 10 . 1 1 43 43 ARG C C 43 179.099 179.099 178.509 0.590 25109
5256 1 10 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.704 1.110 25109
5257 1 10 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.204 -0.025 25109
5258 1 10 . 1 1 43 43 ARG H H 43 8.296 8.296 8.130 0.166 25109
5259 1 10 . 1 1 44 44 ALA N N 44 121.305 121.305 120.473 0.832 25109
5260 1 10 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.173 -0.070 25109
5261 1 10 . 1 1 44 44 ALA C C 44 180.924 180.924 178.969 1.955 25109
5262 1 10 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.538 0.686 25109
5263 1 10 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.552 -0.456 25109
5264 1 10 . 1 1 44 44 ALA H H 44 7.774 7.774 8.612 -0.838 25109
5265 1 10 . 1 1 45 45 THR N N 45 115.017 115.017 115.311 -0.294 25109
5266 1 10 . 1 1 45 45 THR HA H 45 3.879 3.879 4.224 -0.345 25109
5267 1 10 . 1 1 45 45 THR CA C 45 66.327 66.327 66.162 0.165 25109
5268 1 10 . 1 1 45 45 THR CB C 45 68.809 68.809 69.045 -0.236 25109
5269 1 10 . 1 1 45 45 THR H H 45 8.167 8.167 7.808 0.359 25109
5270 1 10 . 1 1 46 46 CYS N N 46 123.609 123.609 121.580 2.029 25109
5271 1 10 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.444 -0.425 25109
5272 1 10 . 1 1 46 46 CYS C C 46 178.077 178.077 176.023 2.054 25109
5273 1 10 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.376 0.569 25109
5274 1 10 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.905 -1.766 25109
5275 1 10 . 1 1 46 46 CYS H H 46 8.084 8.084 8.257 -0.173 25109
5276 1 10 . 1 1 47 47 THR N N 47 115.520 115.520 112.448 3.072 25109
5277 1 10 . 1 1 47 47 THR HA H 47 3.915 3.915 4.330 -0.415 25109
5278 1 10 . 1 1 47 47 THR CA C 47 66.063 66.063 63.931 2.132 25109
5279 1 10 . 1 1 47 47 THR CB C 47 69.245 69.245 68.390 0.855 25109
5280 1 10 . 1 1 47 47 THR H H 47 7.735 7.735 7.866 -0.131 25109
5281 1 10 . 1 1 48 48 LEU N N 48 120.099 120.099 122.169 -2.070 25109
5282 1 10 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.508 -0.282 25109
5283 1 10 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.317 1.246 25109
5284 1 10 . 1 1 48 48 LEU CB C 48 43.625 43.625 43.323 0.302 25109
5285 1 10 . 1 1 48 48 LEU H H 48 7.464 7.464 7.676 -0.212 25109
5286 1 10 . 1 1 49 49 SER N N 49 111.979 111.979 113.926 -1.947 25109
5287 1 10 . 1 1 49 49 SER HA H 49 4.661 4.661 4.627 0.034 25109
5288 1 10 . 1 1 49 49 SER C C 49 175.581 175.581 175.261 0.320 25109
5289 1 10 . 1 1 49 49 SER CA C 49 59.590 59.590 58.596 0.994 25109
5290 1 10 . 1 1 49 49 SER CB C 49 65.335 65.335 65.099 0.236 25109
5291 1 10 . 1 1 49 49 SER H H 49 8.781 8.781 8.471 0.310 25109
5292 1 10 . 1 1 50 50 GLY N N 50 110.194 110.194 109.181 1.013 25109
5293 1 10 . 1 1 50 50 GLY C C 50 175.123 175.123 173.295 1.828 25109
5294 1 10 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.727 0.175 25109
5295 1 10 . 1 1 50 50 GLY H H 50 7.955 7.955 7.965 -0.010 25109
5296 1 10 . 1 1 51 51 ASN N N 51 121.050 121.050 119.762 1.288 25109
5297 1 10 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.420 -0.170 25109
5298 1 10 . 1 1 51 51 ASN C C 51 176.403 176.403 176.992 -0.589 25109
5299 1 10 . 1 1 51 51 ASN CA C 51 59.303 59.303 56.013 3.290 25109
5300 1 10 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.685 2.914 25109
5301 1 10 . 1 1 51 51 ASN H H 51 8.898 8.898 8.869 0.029 25109
5302 1 10 . 1 1 52 52 ARG N N 52 119.825 119.825 119.049 0.776 25109
5303 1 10 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.121 -0.083 25109
5304 1 10 . 1 1 52 52 ARG C C 52 178.850 178.850 177.352 1.498 25109
5305 1 10 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.370 1.694 25109
5306 1 10 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.904 0.119 25109
5307 1 10 . 1 1 52 52 ARG H H 52 8.696 8.696 8.474 0.222 25109
5308 1 10 . 1 1 53 53 ASP N N 53 116.032 116.032 117.017 -0.985 25109
5309 1 10 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.862 -0.316 25109
5310 1 10 . 1 1 53 53 ASP C C 53 178.996 178.996 178.522 0.474 25109
5311 1 10 . 1 1 53 53 ASP CA C 53 56.079 56.079 56.989 -0.910 25109
5312 1 10 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.619 -2.248 25109
5313 1 10 . 1 1 53 53 ASP H H 53 9.036 9.036 8.322 0.714 25109
5314 1 10 . 1 1 54 54 THR N N 54 115.848 115.848 118.040 -2.192 25109
5315 1 10 . 1 1 54 54 THR HA H 54 3.746 3.746 4.151 -0.405 25109
5316 1 10 . 1 1 54 54 THR CA C 54 67.885 67.885 66.471 1.414 25109
5317 1 10 . 1 1 54 54 THR CB C 54 66.953 66.953 68.899 -1.946 25109
5318 1 10 . 1 1 54 54 THR H H 54 7.782 7.782 7.880 -0.098 25109
5319 1 10 . 1 1 55 55 LEU N N 55 125.987 125.987 122.047 3.940 25109
5320 1 10 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.108 -0.554 25109
5321 1 10 . 1 1 55 55 LEU C C 55 177.901 177.901 178.742 -0.841 25109
5322 1 10 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.671 -0.218 25109
5323 1 10 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.588 0.275 25109
5324 1 10 . 1 1 55 55 LEU H H 55 8.740 8.740 7.929 0.811 25109
5325 1 10 . 1 1 56 56 TRP N N 56 116.672 116.672 118.138 -1.466 25109
5326 1 10 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.624 -0.544 25109
5327 1 10 . 1 1 56 56 TRP C C 56 179.588 179.588 178.486 1.102 25109
5328 1 10 . 1 1 56 56 TRP CA C 56 61.481 61.481 60.954 0.527 25109
5329 1 10 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.089 0.103 25109
5330 1 10 . 1 1 56 56 TRP H H 56 7.642 7.642 7.929 -0.287 25109
5331 1 10 . 1 1 57 57 HIS N N 57 115.754 115.754 118.388 -2.634 25109
5332 1 10 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.445 -0.169 25109
5333 1 10 . 1 1 57 57 HIS C C 57 177.514 177.514 176.727 0.787 25109
5334 1 10 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.388 -0.436 25109
5335 1 10 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.459 -2.457 25109
5336 1 10 . 1 1 57 57 HIS H H 57 7.407 7.407 7.648 -0.241 25109
5337 1 10 . 1 1 58 58 LEU N N 58 123.934 123.934 122.848 1.086 25109
5338 1 10 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.915 -0.128 25109
5339 1 10 . 1 1 58 58 LEU C C 58 178.115 178.115 176.069 2.046 25109
5340 1 10 . 1 1 58 58 LEU CA C 58 58.909 58.909 57.645 1.264 25109
5341 1 10 . 1 1 58 58 LEU CB C 58 40.815 40.815 42.115 -1.300 25109
5342 1 10 . 1 1 58 58 LEU H H 58 8.996 8.996 8.677 0.319 25109
5343 1 10 . 1 1 59 59 PHE N N 59 117.721 117.721 116.031 1.690 25109
5344 1 10 . 1 1 59 59 PHE HA H 59 3.935 3.935 4.229 -0.294 25109
5345 1 10 . 1 1 59 59 PHE C C 59 176.987 176.987 175.405 1.582 25109
5346 1 10 . 1 1 59 59 PHE CA C 59 60.113 60.113 59.470 0.643 25109
5347 1 10 . 1 1 59 59 PHE CB C 59 36.960 36.960 36.911 0.049 25109
5348 1 10 . 1 1 59 59 PHE H H 59 8.201 8.201 8.376 -0.175 25109
5349 1 10 . 1 1 60 60 ASN N N 60 115.695 115.695 118.295 -2.600 25109
5350 1 10 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.635 -0.716 25109
5351 1 10 . 1 1 60 60 ASN C C 60 176.670 176.670 175.427 1.243 25109
5352 1 10 . 1 1 60 60 ASN CA C 60 56.756 56.756 54.335 2.421 25109
5353 1 10 . 1 1 60 60 ASN CB C 60 39.318 39.318 39.869 -0.551 25109
5354 1 10 . 1 1 60 60 ASN H H 60 7.666 7.666 8.229 -0.562 25109
5355 1 10 . 1 1 61 61 THR N N 61 115.110 115.110 116.142 -1.032 25109
5356 1 10 . 1 1 61 61 THR HA H 61 3.733 3.733 4.194 -0.461 25109
5357 1 10 . 1 1 61 61 THR CA C 61 66.319 66.319 65.221 1.098 25109
5358 1 10 . 1 1 61 61 THR CB C 61 69.174 69.174 69.423 -0.249 25109
5359 1 10 . 1 1 61 61 THR H H 61 7.782 7.782 7.876 -0.094 25109
5360 1 10 . 1 1 62 62 LEU N N 62 121.559 121.559 122.929 -1.370 25109
5361 1 10 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.817 -0.328 25109
5362 1 10 . 1 1 62 62 LEU C C 62 176.600 176.600 177.393 -0.793 25109
5363 1 10 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.575 0.390 25109
5364 1 10 . 1 1 62 62 LEU CB C 62 42.335 42.335 41.265 1.070 25109
5365 1 10 . 1 1 62 62 LEU H H 62 8.362 8.362 8.187 0.175 25109
5366 1 10 . 1 1 63 63 GLN N N 63 109.150 109.150 114.381 -5.231 25109
5367 1 10 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.471 -1.394 25109
5368 1 10 . 1 1 63 63 GLN C C 63 175.194 175.194 177.056 -1.862 25109
5369 1 10 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.613 -1.347 25109
5370 1 10 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.491 -1.797 25109
5371 1 10 . 1 1 63 63 GLN H H 63 6.458 6.458 7.997 -1.539 25109
5372 1 10 . 1 1 64 64 ARG N N 64 116.029 116.029 118.173 -2.144 25109
5373 1 10 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.252 -0.154 25109
5374 1 10 . 1 1 64 64 ARG C C 64 176.459 176.459 176.018 0.441 25109
5375 1 10 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.617 0.526 25109
5376 1 10 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.254 0.330 25109
5377 1 10 . 1 1 64 64 ARG H H 64 6.596 6.596 7.265 -0.669 25109
5378 1 10 . 1 1 65 65 ARG N N 65 120.422 120.422 120.343 0.079 25109
5379 1 10 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.903 -0.069 25109
5380 1 10 . 1 1 65 65 ARG C C 65 173.436 173.436 174.754 -1.318 25109
5381 1 10 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.131 -0.586 25109
5382 1 10 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.838 -0.842 25109
5383 1 10 . 1 1 65 65 ARG H H 65 7.932 7.932 7.635 0.297 25109
5384 1 10 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.563 0.011 25109
5385 1 10 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.088 0.971 25109
5386 1 10 . 1 1 67 67 GLY N N 67 111.953 111.953 106.069 5.884 25109
5387 1 10 . 1 1 67 67 GLY C C 67 177.057 177.057 175.546 1.511 25109
5388 1 10 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.406 0.901 25109
5389 1 10 . 1 1 67 67 GLY H H 67 9.198 9.198 8.118 1.080 25109
5390 1 10 . 1 1 68 68 TRP N N 68 117.467 117.467 122.543 -5.076 25109
5391 1 10 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.414 -0.072 25109
5392 1 10 . 1 1 68 68 TRP C C 68 177.690 177.690 176.525 1.165 25109
5393 1 10 . 1 1 68 68 TRP CA C 68 60.116 60.116 60.467 -0.351 25109
5394 1 10 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.207 0.983 25109
5395 1 10 . 1 1 68 68 TRP H H 68 7.647 7.647 8.108 -0.461 25109
5396 1 10 . 1 1 69 69 VAL N N 69 121.482 121.482 120.828 0.654 25109
5397 1 10 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.068 -0.431 25109
5398 1 10 . 1 1 69 69 VAL C C 69 177.993 177.993 178.199 -0.206 25109
5399 1 10 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.044 1.422 25109
5400 1 10 . 1 1 69 69 VAL CB C 69 30.026 30.026 29.620 0.406 25109
5401 1 10 . 1 1 69 69 VAL H H 69 6.666 6.666 7.211 -0.545 25109
5402 1 10 . 1 1 70 70 GLU N N 70 116.350 116.350 118.492 -2.142 25109
5403 1 10 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.896 -0.071 25109
5404 1 10 . 1 1 70 70 GLU C C 70 180.362 180.362 179.311 1.051 25109
5405 1 10 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.063 0.158 25109
5406 1 10 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.041 -1.736 25109
5407 1 10 . 1 1 70 70 GLU H H 70 7.410 7.410 7.914 -0.504 25109
5408 1 10 . 1 1 71 71 TYR N N 71 116.750 116.750 118.959 -2.209 25109
5409 1 10 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.376 0.074 25109
5410 1 10 . 1 1 71 71 TYR C C 71 178.411 178.411 177.954 0.457 25109
5411 1 10 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.890 0.712 25109
5412 1 10 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.708 -0.353 25109
5413 1 10 . 1 1 71 71 TYR H H 71 7.159 7.159 7.641 -0.482 25109
5414 1 10 . 1 1 72 72 PHE N N 72 121.610 121.610 121.716 -0.106 25109
5415 1 10 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.247 0.255 25109
5416 1 10 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.670 -0.850 25109
5417 1 10 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.202 0.847 25109
5418 1 10 . 1 1 72 72 PHE H H 72 9.007 9.007 8.712 0.295 25109
5419 1 10 . 1 1 73 73 ILE N N 73 119.200 119.200 118.473 0.727 25109
5420 1 10 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.501 -0.321 25109
5421 1 10 . 1 1 73 73 ILE C C 73 177.620 177.620 177.496 0.124 25109
5422 1 10 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.663 1.534 25109
5423 1 10 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.521 1.502 25109
5424 1 10 . 1 1 73 73 ILE H H 73 8.644 8.644 8.569 0.075 25109
5425 1 10 . 1 1 74 74 ALA N N 74 119.624 119.624 121.104 -1.480 25109
5426 1 10 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.001 -0.047 25109
5427 1 10 . 1 1 74 74 ALA C C 74 181.030 181.030 179.360 1.670 25109
5428 1 10 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.983 0.428 25109
5429 1 10 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.922 0.214 25109
5430 1 10 . 1 1 74 74 ALA H H 74 7.476 7.476 7.622 -0.146 25109
5431 1 10 . 1 1 75 75 ALA N N 75 123.625 123.625 122.349 1.276 25109
5432 1 10 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.755 0.083 25109
5433 1 10 . 1 1 75 75 ALA C C 75 179.272 179.272 179.643 -0.371 25109
5434 1 10 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.807 0.295 25109
5435 1 10 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.258 1.335 25109
5436 1 10 . 1 1 75 75 ALA H H 75 8.524 8.524 7.666 0.858 25109
5437 1 10 . 1 1 76 76 LEU N N 76 118.114 118.114 120.303 -2.189 25109
5438 1 10 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.952 -0.280 25109
5439 1 10 . 1 1 76 76 LEU C C 76 180.001 180.001 178.995 1.006 25109
5440 1 10 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.138 1.118 25109
5441 1 10 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.204 1.415 25109
5442 1 10 . 1 1 76 76 LEU H H 76 8.153 8.153 7.589 0.564 25109
5443 1 10 . 1 1 77 77 ARG N N 77 117.830 117.830 119.414 -1.584 25109
5444 1 10 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.928 -0.481 25109
5445 1 10 . 1 1 77 77 ARG C C 77 180.889 180.889 178.912 1.977 25109
5446 1 10 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.512 1.554 25109
5447 1 10 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.058 -0.861 25109
5448 1 10 . 1 1 77 77 ARG H H 77 7.945 7.945 8.111 -0.166 25109
5449 1 10 . 1 1 78 78 GLY N N 78 110.202 110.202 107.006 3.196 25109
5450 1 10 . 1 1 78 78 GLY C C 78 174.807 174.807 175.669 -0.862 25109
5451 1 10 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.411 0.149 25109
5452 1 10 . 1 1 78 78 GLY H H 78 8.269 8.269 8.222 0.047 25109
5453 1 10 . 1 1 79 79 CYS N N 79 115.567 115.567 117.139 -1.572 25109
5454 1 10 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.371 0.018 25109
5455 1 10 . 1 1 79 79 CYS C C 79 173.025 173.025 174.875 -1.850 25109
5456 1 10 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.696 2.261 25109
5457 1 10 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.596 0.209 25109
5458 1 10 . 1 1 79 79 CYS H H 79 7.132 7.132 7.486 -0.354 25109
5459 1 10 . 1 1 80 80 GLU N N 80 111.759 111.759 115.363 -3.604 25109
5460 1 10 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.935 -0.202 25109
5461 1 10 . 1 1 80 80 GLU C C 80 175.827 175.827 175.408 0.419 25109
5462 1 10 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.636 -0.169 25109
5463 1 10 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.427 -2.710 25109
5464 1 10 . 1 1 80 80 GLU H H 80 7.772 7.772 7.782 -0.010 25109
5465 1 10 . 1 1 81 81 LEU N N 81 124.692 124.692 121.381 3.311 25109
5466 1 10 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.381 0.310 25109
5467 1 10 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.971 -1.016 25109
5468 1 10 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.209 -0.818 25109
5469 1 10 . 1 1 81 81 LEU H H 81 8.167 8.167 8.085 0.082 25109
5470 1 10 . 1 1 82 82 VAL N N 82 118.320 118.320 122.041 -3.721 25109
5471 1 10 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.615 -0.438 25109
5472 1 10 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.541 0.169 25109
5473 1 10 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.654 0.294 25109
5474 1 10 . 1 1 82 82 VAL H H 82 7.141 7.141 7.626 -0.485 25109
5475 1 10 . 1 1 83 83 ASP N N 83 118.733 118.733 118.808 -0.075 25109
5476 1 10 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.338 -0.006 25109
5477 1 10 . 1 1 83 83 ASP C C 83 178.674 178.674 178.154 0.520 25109
5478 1 10 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.412 -0.969 25109
5479 1 10 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.586 -3.757 25109
5480 1 10 . 1 1 83 83 ASP H H 83 8.385 8.385 8.747 -0.362 25109
5481 1 10 . 1 1 84 84 LEU N N 84 121.026 121.026 120.134 0.892 25109
5482 1 10 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.968 0.011 25109
5483 1 10 . 1 1 84 84 LEU C C 84 178.796 178.796 178.526 0.270 25109
5484 1 10 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.501 0.021 25109
5485 1 10 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.558 0.937 25109
5486 1 10 . 1 1 84 84 LEU H H 84 7.770 7.770 7.657 0.113 25109
5487 1 10 . 1 1 85 85 ALA N N 85 121.525 121.525 122.066 -0.541 25109
5488 1 10 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.908 -0.247 25109
5489 1 10 . 1 1 85 85 ALA C C 85 179.322 179.322 179.145 0.177 25109
5490 1 10 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.269 0.572 25109
5491 1 10 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.071 0.856 25109
5492 1 10 . 1 1 85 85 ALA H H 85 8.126 8.126 7.841 0.285 25109
5493 1 10 . 1 1 86 86 ASP N N 86 115.349 115.349 118.501 -3.152 25109
5494 1 10 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.361 -0.088 25109
5495 1 10 . 1 1 86 86 ASP C C 86 178.463 178.463 178.605 -0.142 25109
5496 1 10 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.311 -1.600 25109
5497 1 10 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.973 -3.811 25109
5498 1 10 . 1 1 86 86 ASP H H 86 8.410 8.410 8.107 0.303 25109
5499 1 10 . 1 1 87 87 GLU N N 87 122.529 122.529 119.683 2.846 25109
5500 1 10 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.101 -0.065 25109
5501 1 10 . 1 1 87 87 GLU C C 87 178.508 178.508 179.429 -0.921 25109
5502 1 10 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.603 -0.249 25109
5503 1 10 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.691 -1.418 25109
5504 1 10 . 1 1 87 87 GLU H H 87 8.012 8.012 8.280 -0.268 25109
5505 1 10 . 1 1 88 88 VAL N N 88 119.148 119.148 119.933 -0.785 25109
5506 1 10 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.875 -0.545 25109
5507 1 10 . 1 1 88 88 VAL C C 88 177.240 177.240 178.066 -0.826 25109
5508 1 10 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.704 0.545 25109
5509 1 10 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.333 0.196 25109
5510 1 10 . 1 1 88 88 VAL H H 88 8.291 8.291 8.137 0.154 25109
5511 1 10 . 1 1 89 89 ALA N N 89 120.709 120.709 121.785 -1.076 25109
5512 1 10 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.081 -0.166 25109
5513 1 10 . 1 1 89 89 ALA C C 89 180.186 180.186 179.894 0.292 25109
5514 1 10 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.446 0.613 25109
5515 1 10 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.091 0.144 25109
5516 1 10 . 1 1 89 89 ALA H H 89 8.548 8.548 8.256 0.292 25109
5517 1 10 . 1 1 90 90 SER N N 90 113.035 113.035 114.136 -1.101 25109
5518 1 10 . 1 1 90 90 SER HA H 90 4.047 4.047 4.182 -0.135 25109
5519 1 10 . 1 1 90 90 SER C C 90 177.564 177.564 176.494 1.070 25109
5520 1 10 . 1 1 90 90 SER CA C 90 61.771 61.771 61.917 -0.146 25109
5521 1 10 . 1 1 90 90 SER CB C 90 62.907 62.907 63.300 -0.393 25109
5522 1 10 . 1 1 90 90 SER H H 90 7.969 7.969 7.842 0.127 25109
5523 1 10 . 1 1 91 91 VAL N N 91 123.417 123.417 122.593 0.824 25109
5524 1 10 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.608 -0.261 25109
5525 1 10 . 1 1 91 91 VAL C C 91 178.428 178.428 177.422 1.006 25109
5526 1 10 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.264 -0.135 25109
5527 1 10 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.476 0.295 25109
5528 1 10 . 1 1 91 91 VAL H H 91 7.713 7.713 8.047 -0.334 25109
5529 1 10 . 1 1 92 92 TYR N N 92 121.458 121.458 120.400 1.058 25109
5530 1 10 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.587 -0.396 25109
5531 1 10 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.333 1.661 25109
5532 1 10 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.587 0.397 25109
5533 1 10 . 1 1 92 92 TYR H H 92 8.395 8.395 8.567 -0.172 25109
5534 1 10 . 1 1 93 93 GLN N N 93 115.549 115.549 119.537 -3.988 25109
5535 1 10 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.086 -0.375 25109
5536 1 10 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.079 0.015 25109
5537 1 10 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.193 0.105 25109
5538 1 10 . 1 1 93 93 GLN H H 93 8.167 8.167 8.146 0.021 25109
5539 1 10 . 1 1 94 94 SER N N 94 115.923 115.923 115.026 0.897 25109
5540 1 10 . 1 1 94 94 SER HA H 94 4.096 4.096 4.162 -0.066 25109
5541 1 10 . 1 1 94 94 SER CA C 94 60.971 60.971 60.294 0.677 25109
5542 1 10 . 1 1 94 94 SER CB C 94 62.635 62.635 63.471 -0.836 25109
5543 1 10 . 1 1 94 94 SER H H 94 7.642 7.642 7.431 0.211 25109
5544 1 10 . 1 1 95 95 TYR N N 95 119.565 119.565 121.276 -1.711 25109
5545 1 10 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.422 0.337 25109
5546 1 10 . 1 1 95 95 TYR C C 95 175.334 175.334 174.554 0.780 25109
5547 1 10 . 1 1 95 95 TYR CA C 95 57.698 57.698 58.434 -0.736 25109
5548 1 10 . 1 1 95 95 TYR CB C 95 39.319 39.319 36.761 2.558 25109
5549 1 10 . 1 1 95 95 TYR H H 95 7.069 7.069 7.430 -0.361 25109
5550 1 10 . 1 1 96 96 GLN N N 96 119.872 119.872 121.223 -1.351 25109
5551 1 10 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.589 -0.224 25109
5552 1 10 . 1 1 96 96 GLN C C 96 173.612 173.612 174.216 -0.604 25109
5553 1 10 . 1 1 96 96 GLN CA C 96 54.336 54.336 53.118 1.218 25109
5554 1 10 . 1 1 96 96 GLN CB C 96 28.494 28.494 30.411 -1.917 25109
5555 1 10 . 1 1 96 96 GLN H H 96 7.409 7.409 7.603 -0.194 25109
5556 1 10 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.486 -0.168 25109
5557 1 10 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.767 -0.753 25109
5558 1 10 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.287 -0.189 25109
5559 1 10 . 1 1 98 98 ARG N N 98 121.759 121.759 116.913 4.846 25109
5560 1 10 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.527 -0.185 25109
5561 1 10 . 1 1 98 98 ARG C C 98 176.848 176.848 175.407 1.441 25109
5562 1 10 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.197 1.024 25109
5563 1 10 . 1 1 98 98 ARG CB C 98 31.087 31.087 31.290 -0.203 25109
5564 1 10 . 1 1 98 98 ARG H H 98 8.423 8.423 7.654 0.769 25109
5565 1 10 . 1 1 99 99 THR N N 99 115.292 115.292 113.907 1.385 25109
5566 1 10 . 1 1 99 99 THR HA H 99 4.323 4.323 4.494 -0.171 25109
5567 1 10 . 1 1 99 99 THR C C 99 174.350 174.350 174.702 -0.352 25109
5568 1 10 . 1 1 99 99 THR CA C 99 61.906 61.906 63.559 -1.653 25109
5569 1 10 . 1 1 99 99 THR CB C 99 70.180 70.180 69.272 0.908 25109
5570 1 10 . 1 1 99 99 THR H H 99 8.179 8.179 8.400 -0.221 25109
5571 1 11 . 1 1 0 0 SER N N 0 115.693 115.693 118.598 -2.905 25109
5572 1 11 . 1 1 0 0 SER HA H 0 4.531 4.531 4.377 0.154 25109
5573 1 11 . 1 1 0 0 SER C C 0 174.557 174.557 174.908 -0.351 25109
5574 1 11 . 1 1 0 0 SER CA C 0 58.478 58.478 59.217 -0.739 25109
5575 1 11 . 1 1 0 0 SER CB C 0 64.380 64.380 63.146 1.234 25109
5576 1 11 . 1 1 0 0 SER H H 0 8.631 8.631 8.621 0.010 25109
5577 1 11 . 1 1 1 1 MET N N 1 123.111 123.111 121.203 1.908 25109
5578 1 11 . 1 1 1 1 MET HA H 1 4.728 4.728 4.274 0.454 25109
5579 1 11 . 1 1 1 1 MET C C 1 174.846 174.846 173.328 1.518 25109
5580 1 11 . 1 1 1 1 MET CA C 1 55.655 55.655 54.992 0.663 25109
5581 1 11 . 1 1 1 1 MET CB C 1 32.035 32.035 31.329 0.706 25109
5582 1 11 . 1 1 1 1 MET H H 1 8.641 8.641 8.450 0.191 25109
5583 1 11 . 1 1 2 2 PRO HA H 2 4.477 4.477 5.167 -0.690 25109
5584 1 11 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.577 -0.577 25109
5585 1 11 . 1 1 3 3 PHE N N 3 121.126 121.126 125.963 -4.837 25109
5586 1 11 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.596 -0.230 25109
5587 1 11 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.657 1.205 25109
5588 1 11 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.452 -1.084 25109
5589 1 11 . 1 1 3 3 PHE H H 3 8.177 8.177 8.971 -0.794 25109
5590 1 11 . 1 1 4 4 ALA N N 4 121.170 121.170 122.178 -1.008 25109
5591 1 11 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.064 -0.230 25109
5592 1 11 . 1 1 4 4 ALA C C 4 181.522 181.522 178.696 2.826 25109
5593 1 11 . 1 1 4 4 ALA CA C 4 55.454 55.454 54.849 0.605 25109
5594 1 11 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.511 0.925 25109
5595 1 11 . 1 1 4 4 ALA H H 4 8.444 8.444 8.900 -0.456 25109
5596 1 11 . 1 1 5 5 GLU N N 5 118.932 118.932 119.214 -0.282 25109
5597 1 11 . 1 1 5 5 GLU HA H 5 3.855 3.855 4.002 -0.147 25109
5598 1 11 . 1 1 5 5 GLU C C 5 177.971 177.971 178.212 -0.241 25109
5599 1 11 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.358 0.273 25109
5600 1 11 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.726 0.035 25109
5601 1 11 . 1 1 5 5 GLU H H 5 8.454 8.454 8.708 -0.254 25109
5602 1 11 . 1 1 6 6 ASP N N 6 120.471 120.471 119.071 1.400 25109
5603 1 11 . 1 1 6 6 ASP C C 6 178.885 178.885 178.059 0.826 25109
5604 1 11 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.398 -0.326 25109
5605 1 11 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.588 -1.456 25109
5606 1 11 . 1 1 6 6 ASP H H 6 8.316 8.316 8.461 -0.145 25109
5607 1 11 . 1 1 7 7 LYS N N 7 118.335 118.335 119.197 -0.862 25109
5608 1 11 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.920 -0.230 25109
5609 1 11 . 1 1 7 7 LYS C C 7 180.080 180.080 179.285 0.795 25109
5610 1 11 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.847 -0.127 25109
5611 1 11 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.579 0.215 25109
5612 1 11 . 1 1 7 7 LYS H H 7 8.249 8.249 7.691 0.558 25109
5613 1 11 . 1 1 8 8 THR N N 8 119.222 119.222 117.209 2.013 25109
5614 1 11 . 1 1 8 8 THR HA H 8 3.975 3.975 3.959 0.016 25109
5615 1 11 . 1 1 8 8 THR CA C 8 68.453 68.453 66.755 1.698 25109
5616 1 11 . 1 1 8 8 THR CB C 8 67.387 67.387 68.965 -1.578 25109
5617 1 11 . 1 1 8 8 THR H H 8 7.897 7.897 7.983 -0.086 25109
5618 1 11 . 1 1 9 9 TYR N N 9 123.054 123.054 122.927 0.127 25109
5619 1 11 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.128 0.125 25109
5620 1 11 . 1 1 9 9 TYR C C 9 177.441 177.441 177.669 -0.228 25109
5621 1 11 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.007 -0.109 25109
5622 1 11 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.432 -0.583 25109
5623 1 11 . 1 1 9 9 TYR H H 9 8.605 8.605 8.562 0.043 25109
5624 1 11 . 1 1 10 10 LYS N N 10 118.366 118.366 118.589 -0.223 25109
5625 1 11 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.708 -0.114 25109
5626 1 11 . 1 1 10 10 LYS C C 10 178.885 178.885 178.777 0.108 25109
5627 1 11 . 1 1 10 10 LYS CA C 10 60.044 60.044 59.347 0.697 25109
5628 1 11 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.203 -0.158 25109
5629 1 11 . 1 1 10 10 LYS H H 10 8.066 8.066 8.316 -0.250 25109
5630 1 11 . 1 1 11 11 TYR N N 11 120.539 120.539 120.451 0.088 25109
5631 1 11 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.127 -0.137 25109
5632 1 11 . 1 1 11 11 TYR C C 11 178.233 178.233 177.603 0.630 25109
5633 1 11 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.674 0.854 25109
5634 1 11 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.687 -0.324 25109
5635 1 11 . 1 1 11 11 TYR H H 11 7.875 7.875 7.680 0.195 25109
5636 1 11 . 1 1 12 12 ILE N N 12 121.893 121.893 118.397 3.496 25109
5637 1 11 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.842 -0.746 25109
5638 1 11 . 1 1 12 12 ILE C C 12 177.015 177.015 178.344 -1.329 25109
5639 1 11 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.227 2.536 25109
5640 1 11 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.291 1.260 25109
5641 1 11 . 1 1 12 12 ILE H H 12 8.154 8.154 8.385 -0.231 25109
5642 1 11 . 1 1 13 13 CYS N N 13 113.894 113.894 118.832 -4.938 25109
5643 1 11 . 1 1 13 13 CYS HA H 13 3.887 3.887 4.072 -0.185 25109
5644 1 11 . 1 1 13 13 CYS C C 13 178.288 178.288 177.178 1.110 25109
5645 1 11 . 1 1 13 13 CYS CA C 13 64.337 64.337 62.929 1.408 25109
5646 1 11 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.706 0.299 25109
5647 1 11 . 1 1 13 13 CYS H H 13 7.551 7.551 7.926 -0.375 25109
5648 1 11 . 1 1 14 14 ARG N N 14 119.228 119.228 119.531 -0.303 25109
5649 1 11 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.021 0.049 25109
5650 1 11 . 1 1 14 14 ARG C C 14 177.127 177.127 176.531 0.596 25109
5651 1 11 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.826 -0.332 25109
5652 1 11 . 1 1 14 14 ARG CB C 14 30.422 30.422 29.927 0.496 25109
5653 1 11 . 1 1 14 14 ARG H H 14 7.991 7.991 7.645 0.346 25109
5654 1 11 . 1 1 15 15 ASN N N 15 117.367 117.367 115.466 1.901 25109
5655 1 11 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.944 0.025 25109
5656 1 11 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.133 0.631 25109
5657 1 11 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.782 -0.197 25109
5658 1 11 . 1 1 15 15 ASN H H 15 7.643 7.643 7.720 -0.077 25109
5659 1 11 . 1 1 16 16 PHE N N 16 122.356 122.356 121.511 0.845 25109
5660 1 11 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.261 -0.045 25109
5661 1 11 . 1 1 16 16 PHE C C 16 178.084 178.084 176.168 1.916 25109
5662 1 11 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.375 1.802 25109
5663 1 11 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.145 1.444 25109
5664 1 11 . 1 1 16 16 PHE H H 16 6.992 6.992 7.361 -0.369 25109
5665 1 11 . 1 1 17 17 SER N N 17 112.937 112.937 113.045 -0.108 25109
5666 1 11 . 1 1 17 17 SER HA H 17 4.199 4.199 4.325 -0.126 25109
5667 1 11 . 1 1 17 17 SER C C 17 176.726 176.726 176.934 -0.208 25109
5668 1 11 . 1 1 17 17 SER CA C 17 62.052 62.052 60.135 1.917 25109
5669 1 11 . 1 1 17 17 SER CB C 17 62.552 62.552 63.143 -0.591 25109
5670 1 11 . 1 1 17 17 SER H H 17 8.840 8.840 8.530 0.310 25109
5671 1 11 . 1 1 18 18 ASN N N 18 118.809 118.809 122.354 -3.545 25109
5672 1 11 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.500 -0.142 25109
5673 1 11 . 1 1 18 18 ASN C C 18 175.967 175.967 177.500 -1.533 25109
5674 1 11 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.712 -0.801 25109
5675 1 11 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.270 -0.442 25109
5676 1 11 . 1 1 18 18 ASN H H 18 8.130 8.130 7.907 0.223 25109
5677 1 11 . 1 1 19 19 PHE N N 19 115.750 115.750 117.305 -1.555 25109
5678 1 11 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.537 -0.252 25109
5679 1 11 . 1 1 19 19 PHE C C 19 175.370 175.370 176.197 -0.827 25109
5680 1 11 . 1 1 19 19 PHE CA C 19 58.862 58.862 59.570 -0.708 25109
5681 1 11 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.542 1.336 25109
5682 1 11 . 1 1 19 19 PHE H H 19 8.062 8.062 7.879 0.183 25109
5683 1 11 . 1 1 20 20 CYS N N 20 113.958 113.958 117.770 -3.812 25109
5684 1 11 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.199 -0.256 25109
5685 1 11 . 1 1 20 20 CYS C C 20 173.823 173.823 175.439 -1.616 25109
5686 1 11 . 1 1 20 20 CYS CA C 20 61.788 61.788 59.984 1.804 25109
5687 1 11 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.590 -0.207 25109
5688 1 11 . 1 1 20 20 CYS H H 20 6.850 6.850 7.582 -0.732 25109
5689 1 11 . 1 1 21 21 ASN N N 21 116.691 116.691 119.930 -3.239 25109
5690 1 11 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.791 -0.047 25109
5691 1 11 . 1 1 21 21 ASN C C 21 175.299 175.299 173.710 1.589 25109
5692 1 11 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.747 0.543 25109
5693 1 11 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.196 0.117 25109
5694 1 11 . 1 1 21 21 ASN H H 21 8.251 8.251 7.649 0.602 25109
5695 1 11 . 1 1 22 22 VAL N N 22 122.431 122.431 119.600 2.831 25109
5696 1 11 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.261 -0.711 25109
5697 1 11 . 1 1 22 22 VAL C C 22 174.034 174.034 173.712 0.322 25109
5698 1 11 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.115 3.822 25109
5699 1 11 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.853 -4.330 25109
5700 1 11 . 1 1 22 22 VAL H H 22 7.573 7.573 7.422 0.151 25109
5701 1 11 . 1 1 23 23 ASP N N 23 127.219 127.219 124.892 2.327 25109
5702 1 11 . 1 1 23 23 ASP CA C 23 52.186 52.186 52.917 -0.731 25109
5703 1 11 . 1 1 23 23 ASP CB C 23 38.793 38.793 40.848 -2.055 25109
5704 1 11 . 1 1 23 23 ASP H H 23 8.687 8.687 8.699 -0.012 25109
5705 1 11 . 1 1 24 24 VAL N N 24 127.835 127.835 124.700 3.135 25109
5706 1 11 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.898 -0.606 25109
5707 1 11 . 1 1 24 24 VAL C C 24 176.867 176.867 177.302 -0.435 25109
5708 1 11 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.510 2.653 25109
5709 1 11 . 1 1 24 24 VAL CB C 24 32.015 32.015 31.751 0.264 25109
5710 1 11 . 1 1 24 24 VAL H H 24 9.409 9.409 8.581 0.828 25109
5711 1 11 . 1 1 25 25 VAL N N 25 114.324 114.324 116.375 -2.051 25109
5712 1 11 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.933 -0.414 25109
5713 1 11 . 1 1 25 25 VAL C C 25 178.006 178.006 177.801 0.205 25109
5714 1 11 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.008 1.679 25109
5715 1 11 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.599 -0.067 25109
5716 1 11 . 1 1 25 25 VAL H H 25 8.038 8.038 7.719 0.319 25109
5717 1 11 . 1 1 26 26 GLU N N 26 117.009 117.009 120.156 -3.147 25109
5718 1 11 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.261 -0.170 25109
5719 1 11 . 1 1 26 26 GLU C C 26 177.303 177.303 178.018 -0.715 25109
5720 1 11 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.164 -0.732 25109
5721 1 11 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.760 -0.795 25109
5722 1 11 . 1 1 26 26 GLU H H 26 7.220 7.220 8.425 -1.205 25109
5723 1 11 . 1 1 27 27 ILE N N 27 114.080 114.080 118.724 -4.644 25109
5724 1 11 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.843 0.518 25109
5725 1 11 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.196 -1.464 25109
5726 1 11 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.071 1.520 25109
5727 1 11 . 1 1 27 27 ILE H H 27 7.647 7.647 7.235 0.412 25109
5728 1 11 . 1 1 28 28 LEU N N 28 121.867 121.867 120.797 1.070 25109
5729 1 11 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.381 -0.444 25109
5730 1 11 . 1 1 28 28 LEU C C 28 175.756 175.756 177.333 -1.577 25109
5731 1 11 . 1 1 28 28 LEU CA C 28 59.967 59.967 59.635 0.332 25109
5732 1 11 . 1 1 28 28 LEU CB C 28 39.513 39.513 39.069 0.444 25109
5733 1 11 . 1 1 28 28 LEU H H 28 7.434 7.434 7.571 -0.137 25109
5734 1 11 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.331 -0.121 25109
5735 1 11 . 1 1 29 29 PRO CB C 29 31.310 31.310 30.974 0.336 25109
5736 1 11 . 1 1 30 30 TYR N N 30 113.832 113.832 116.746 -2.914 25109
5737 1 11 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.516 -0.014 25109
5738 1 11 . 1 1 30 30 TYR C C 30 174.386 174.386 175.182 -0.796 25109
5739 1 11 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.775 -2.081 25109
5740 1 11 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.584 -0.485 25109
5741 1 11 . 1 1 30 30 TYR H H 30 7.628 7.628 7.675 -0.047 25109
5742 1 11 . 1 1 31 31 LEU N N 31 118.331 118.331 118.689 -0.358 25109
5743 1 11 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.750 0.127 25109
5744 1 11 . 1 1 31 31 LEU C C 31 173.849 173.849 175.314 -1.465 25109
5745 1 11 . 1 1 31 31 LEU CA C 31 51.692 51.692 52.051 -0.359 25109
5746 1 11 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.436 0.366 25109
5747 1 11 . 1 1 31 31 LEU H H 31 7.619 7.619 7.358 0.261 25109
5748 1 11 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.563 -0.208 25109
5749 1 11 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.749 -0.339 25109
5750 1 11 . 1 1 33 33 CYS N N 33 110.978 110.978 118.240 -7.262 25109
5751 1 11 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.389 -0.048 25109
5752 1 11 . 1 1 33 33 CYS C C 33 174.139 174.139 173.782 0.357 25109
5753 1 11 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.357 -2.145 25109
5754 1 11 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.638 1.284 25109
5755 1 11 . 1 1 33 33 CYS H H 33 6.414 6.414 7.528 -1.114 25109
5756 1 11 . 1 1 34 34 LEU N N 34 123.111 123.111 119.998 3.113 25109
5757 1 11 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.499 0.107 25109
5758 1 11 . 1 1 34 34 LEU C C 34 176.646 176.646 176.502 0.144 25109
5759 1 11 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.713 0.178 25109
5760 1 11 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.926 -1.235 25109
5761 1 11 . 1 1 34 34 LEU H H 34 7.550 7.550 7.257 0.293 25109
5762 1 11 . 1 1 35 35 THR N N 35 113.831 113.831 116.349 -2.518 25109
5763 1 11 . 1 1 35 35 THR HA H 35 4.205 4.205 4.361 -0.156 25109
5764 1 11 . 1 1 35 35 THR C C 35 175.324 175.324 175.695 -0.371 25109
5765 1 11 . 1 1 35 35 THR CA C 35 61.200 61.200 61.740 -0.540 25109
5766 1 11 . 1 1 35 35 THR CB C 35 71.318 71.318 70.117 1.201 25109
5767 1 11 . 1 1 35 35 THR H H 35 8.586 8.586 8.215 0.371 25109
5768 1 11 . 1 1 36 36 ALA N N 36 124.128 124.128 127.794 -3.666 25109
5769 1 11 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.061 -0.137 25109
5770 1 11 . 1 1 36 36 ALA C C 36 180.397 180.397 179.687 0.710 25109
5771 1 11 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.486 0.434 25109
5772 1 11 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.574 -0.771 25109
5773 1 11 . 1 1 36 36 ALA H H 36 8.836 8.836 8.808 0.028 25109
5774 1 11 . 1 1 37 37 ARG N N 37 116.793 116.793 115.517 1.276 25109
5775 1 11 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.023 -0.037 25109
5776 1 11 . 1 1 37 37 ARG C C 37 179.272 179.272 177.659 1.613 25109
5777 1 11 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.172 0.060 25109
5778 1 11 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.783 0.122 25109
5779 1 11 . 1 1 37 37 ARG H H 37 8.060 8.060 8.473 -0.413 25109
5780 1 11 . 1 1 38 38 ASP N N 38 120.030 120.030 118.214 1.816 25109
5781 1 11 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.524 -0.276 25109
5782 1 11 . 1 1 38 38 ASP C C 38 178.885 178.885 178.329 0.556 25109
5783 1 11 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.068 0.119 25109
5784 1 11 . 1 1 38 38 ASP CB C 38 40.933 40.933 41.072 -0.139 25109
5785 1 11 . 1 1 38 38 ASP H H 38 7.782 7.782 7.585 0.197 25109
5786 1 11 . 1 1 39 39 GLN N N 39 118.223 118.223 117.261 0.962 25109
5787 1 11 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.030 -0.365 25109
5788 1 11 . 1 1 39 39 GLN C C 39 178.041 178.041 178.046 -0.005 25109
5789 1 11 . 1 1 39 39 GLN CA C 39 60.601 60.601 57.797 2.804 25109
5790 1 11 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.661 -0.864 25109
5791 1 11 . 1 1 39 39 GLN H H 39 8.476 8.476 8.036 0.440 25109
5792 1 11 . 1 1 40 40 ASP N N 40 117.908 117.908 120.164 -2.256 25109
5793 1 11 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.410 -0.157 25109
5794 1 11 . 1 1 40 40 ASP C C 40 178.639 178.639 178.378 0.261 25109
5795 1 11 . 1 1 40 40 ASP CA C 40 56.400 56.400 56.792 -0.392 25109
5796 1 11 . 1 1 40 40 ASP CB C 40 38.028 38.028 41.037 -3.009 25109
5797 1 11 . 1 1 40 40 ASP H H 40 8.386 8.386 8.302 0.084 25109
5798 1 11 . 1 1 41 41 ARG N N 41 120.990 120.990 119.541 1.449 25109
5799 1 11 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.182 -0.140 25109
5800 1 11 . 1 1 41 41 ARG C C 41 179.795 179.795 178.324 1.471 25109
5801 1 11 . 1 1 41 41 ARG CA C 41 59.445 59.445 57.947 1.498 25109
5802 1 11 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.683 0.575 25109
5803 1 11 . 1 1 41 41 ARG H H 41 8.130 8.130 7.685 0.445 25109
5804 1 11 . 1 1 42 42 LEU N N 42 121.219 121.219 118.608 2.611 25109
5805 1 11 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.182 -0.247 25109
5806 1 11 . 1 1 42 42 LEU C C 42 178.850 178.850 178.678 0.172 25109
5807 1 11 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.367 0.899 25109
5808 1 11 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.578 0.455 25109
5809 1 11 . 1 1 42 42 LEU H H 42 8.179 8.179 7.550 0.629 25109
5810 1 11 . 1 1 43 43 ARG N N 43 119.310 119.310 119.251 0.059 25109
5811 1 11 . 1 1 43 43 ARG HA H 43 3.724 3.724 4.139 -0.415 25109
5812 1 11 . 1 1 43 43 ARG C C 43 179.099 179.099 178.333 0.766 25109
5813 1 11 . 1 1 43 43 ARG CA C 43 60.814 60.814 58.744 2.070 25109
5814 1 11 . 1 1 43 43 ARG CB C 43 30.179 30.179 29.948 0.231 25109
5815 1 11 . 1 1 43 43 ARG H H 43 8.296 8.296 7.874 0.422 25109
5816 1 11 . 1 1 44 44 ALA N N 44 121.305 121.305 122.688 -1.383 25109
5817 1 11 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.279 -0.176 25109
5818 1 11 . 1 1 44 44 ALA C C 44 180.924 180.924 179.064 1.860 25109
5819 1 11 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.806 0.419 25109
5820 1 11 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.557 -0.461 25109
5821 1 11 . 1 1 44 44 ALA H H 44 7.774 7.774 7.335 0.439 25109
5822 1 11 . 1 1 45 45 THR N N 45 115.017 115.017 115.830 -0.813 25109
5823 1 11 . 1 1 45 45 THR HA H 45 3.879 3.879 4.066 -0.187 25109
5824 1 11 . 1 1 45 45 THR CA C 45 66.327 66.327 67.310 -0.983 25109
5825 1 11 . 1 1 45 45 THR CB C 45 68.809 68.809 68.452 0.357 25109
5826 1 11 . 1 1 45 45 THR H H 45 8.167 8.167 8.359 -0.192 25109
5827 1 11 . 1 1 46 46 CYS N N 46 123.609 123.609 119.193 4.416 25109
5828 1 11 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.265 -0.246 25109
5829 1 11 . 1 1 46 46 CYS C C 46 178.077 178.077 176.635 1.442 25109
5830 1 11 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.369 0.576 25109
5831 1 11 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.450 -0.311 25109
5832 1 11 . 1 1 46 46 CYS H H 46 8.084 8.084 8.356 -0.272 25109
5833 1 11 . 1 1 47 47 THR N N 47 115.520 115.520 114.663 0.857 25109
5834 1 11 . 1 1 47 47 THR HA H 47 3.915 3.915 4.375 -0.460 25109
5835 1 11 . 1 1 47 47 THR CA C 47 66.063 66.063 63.215 2.848 25109
5836 1 11 . 1 1 47 47 THR CB C 47 69.245 69.245 68.249 0.996 25109
5837 1 11 . 1 1 47 47 THR H H 47 7.735 7.735 7.752 -0.017 25109
5838 1 11 . 1 1 48 48 LEU N N 48 120.099 120.099 120.829 -0.730 25109
5839 1 11 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.470 -0.244 25109
5840 1 11 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.255 1.308 25109
5841 1 11 . 1 1 48 48 LEU CB C 48 43.625 43.625 43.373 0.252 25109
5842 1 11 . 1 1 48 48 LEU H H 48 7.464 7.464 7.800 -0.336 25109
5843 1 11 . 1 1 49 49 SER N N 49 111.979 111.979 111.453 0.526 25109
5844 1 11 . 1 1 49 49 SER HA H 49 4.661 4.661 4.682 -0.021 25109
5845 1 11 . 1 1 49 49 SER C C 49 175.581 175.581 174.794 0.787 25109
5846 1 11 . 1 1 49 49 SER CA C 49 59.590 59.590 58.243 1.347 25109
5847 1 11 . 1 1 49 49 SER CB C 49 65.335 65.335 64.966 0.369 25109
5848 1 11 . 1 1 49 49 SER H H 49 8.781 8.781 8.489 0.292 25109
5849 1 11 . 1 1 50 50 GLY N N 50 110.194 110.194 110.442 -0.248 25109
5850 1 11 . 1 1 50 50 GLY C C 50 175.123 175.123 174.121 1.002 25109
5851 1 11 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.574 0.328 25109
5852 1 11 . 1 1 50 50 GLY H H 50 7.955 7.955 7.590 0.365 25109
5853 1 11 . 1 1 51 51 ASN N N 51 121.050 121.050 120.465 0.585 25109
5854 1 11 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.413 -0.163 25109
5855 1 11 . 1 1 51 51 ASN C C 51 176.403 176.403 177.153 -0.750 25109
5856 1 11 . 1 1 51 51 ASN CA C 51 59.303 59.303 56.222 3.081 25109
5857 1 11 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.256 3.343 25109
5858 1 11 . 1 1 51 51 ASN H H 51 8.898 8.898 8.880 0.018 25109
5859 1 11 . 1 1 52 52 ARG N N 52 119.825 119.825 120.963 -1.138 25109
5860 1 11 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.918 0.120 25109
5861 1 11 . 1 1 52 52 ARG C C 52 178.850 178.850 177.836 1.014 25109
5862 1 11 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.191 0.873 25109
5863 1 11 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.875 0.148 25109
5864 1 11 . 1 1 52 52 ARG H H 52 8.696 8.696 8.621 0.075 25109
5865 1 11 . 1 1 53 53 ASP N N 53 116.032 116.032 116.050 -0.018 25109
5866 1 11 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.746 -0.200 25109
5867 1 11 . 1 1 53 53 ASP C C 53 178.996 178.996 178.844 0.152 25109
5868 1 11 . 1 1 53 53 ASP CA C 53 56.079 56.079 56.986 -0.907 25109
5869 1 11 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.847 -2.476 25109
5870 1 11 . 1 1 53 53 ASP H H 53 9.036 9.036 7.993 1.043 25109
5871 1 11 . 1 1 54 54 THR N N 54 115.848 115.848 118.705 -2.857 25109
5872 1 11 . 1 1 54 54 THR HA H 54 3.746 3.746 4.129 -0.383 25109
5873 1 11 . 1 1 54 54 THR CA C 54 67.885 67.885 67.161 0.724 25109
5874 1 11 . 1 1 54 54 THR CB C 54 66.953 66.953 68.804 -1.851 25109
5875 1 11 . 1 1 54 54 THR H H 54 7.782 7.782 7.779 0.003 25109
5876 1 11 . 1 1 55 55 LEU N N 55 125.987 125.987 122.123 3.864 25109
5877 1 11 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.048 -0.494 25109
5878 1 11 . 1 1 55 55 LEU C C 55 177.901 177.901 178.361 -0.460 25109
5879 1 11 . 1 1 55 55 LEU CA C 55 58.453 58.453 59.524 -1.071 25109
5880 1 11 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.526 0.337 25109
5881 1 11 . 1 1 55 55 LEU H H 55 8.740 8.740 8.696 0.044 25109
5882 1 11 . 1 1 56 56 TRP N N 56 116.672 116.672 119.018 -2.346 25109
5883 1 11 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.505 -0.425 25109
5884 1 11 . 1 1 56 56 TRP C C 56 179.588 179.588 177.610 1.978 25109
5885 1 11 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.141 0.340 25109
5886 1 11 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.773 -0.581 25109
5887 1 11 . 1 1 56 56 TRP H H 56 7.642 7.642 8.118 -0.476 25109
5888 1 11 . 1 1 57 57 HIS N N 57 115.754 115.754 119.382 -3.628 25109
5889 1 11 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.243 0.033 25109
5890 1 11 . 1 1 57 57 HIS C C 57 177.514 177.514 177.500 0.014 25109
5891 1 11 . 1 1 57 57 HIS CA C 57 58.952 58.952 58.411 0.541 25109
5892 1 11 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.705 -2.703 25109
5893 1 11 . 1 1 57 57 HIS H H 57 7.407 7.407 7.644 -0.237 25109
5894 1 11 . 1 1 58 58 LEU N N 58 123.934 123.934 122.815 1.119 25109
5895 1 11 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.773 0.014 25109
5896 1 11 . 1 1 58 58 LEU C C 58 178.115 178.115 177.897 0.218 25109
5897 1 11 . 1 1 58 58 LEU CA C 58 58.909 58.909 57.821 1.088 25109
5898 1 11 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.480 -0.665 25109
5899 1 11 . 1 1 58 58 LEU H H 58 8.996 8.996 8.358 0.638 25109
5900 1 11 . 1 1 59 59 PHE N N 59 117.721 117.721 115.785 1.936 25109
5901 1 11 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.798 0.137 25109
5902 1 11 . 1 1 59 59 PHE C C 59 176.987 176.987 177.965 -0.978 25109
5903 1 11 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.650 -1.537 25109
5904 1 11 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.904 -0.944 25109
5905 1 11 . 1 1 59 59 PHE H H 59 8.201 8.201 8.600 -0.399 25109
5906 1 11 . 1 1 60 60 ASN N N 60 115.695 115.695 117.862 -2.167 25109
5907 1 11 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.237 -0.318 25109
5908 1 11 . 1 1 60 60 ASN C C 60 176.670 176.670 176.906 -0.236 25109
5909 1 11 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.004 0.752 25109
5910 1 11 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.786 0.532 25109
5911 1 11 . 1 1 60 60 ASN H H 60 7.666 7.666 7.728 -0.062 25109
5912 1 11 . 1 1 61 61 THR N N 61 115.110 115.110 114.603 0.507 25109
5913 1 11 . 1 1 61 61 THR HA H 61 3.733 3.733 4.126 -0.393 25109
5914 1 11 . 1 1 61 61 THR CA C 61 66.319 66.319 65.230 1.089 25109
5915 1 11 . 1 1 61 61 THR CB C 61 69.174 69.174 69.169 0.005 25109
5916 1 11 . 1 1 61 61 THR H H 61 7.782 7.782 7.612 0.170 25109
5917 1 11 . 1 1 62 62 LEU N N 62 121.559 121.559 123.267 -1.708 25109
5918 1 11 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.768 -0.279 25109
5919 1 11 . 1 1 62 62 LEU C C 62 176.600 176.600 178.159 -1.559 25109
5920 1 11 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.033 -0.068 25109
5921 1 11 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.908 1.427 25109
5922 1 11 . 1 1 62 62 LEU H H 62 8.362 8.362 8.335 0.027 25109
5923 1 11 . 1 1 63 63 GLN N N 63 109.150 109.150 115.312 -6.162 25109
5924 1 11 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.261 -1.184 25109
5925 1 11 . 1 1 63 63 GLN C C 63 175.194 175.194 177.286 -2.092 25109
5926 1 11 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.456 -1.190 25109
5927 1 11 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.621 -1.927 25109
5928 1 11 . 1 1 63 63 GLN H H 63 6.458 6.458 7.146 -0.688 25109
5929 1 11 . 1 1 64 64 ARG N N 64 116.029 116.029 118.474 -2.445 25109
5930 1 11 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.112 -0.014 25109
5931 1 11 . 1 1 64 64 ARG C C 64 176.459 176.459 177.118 -0.659 25109
5932 1 11 . 1 1 64 64 ARG CA C 64 56.143 56.143 57.779 -1.636 25109
5933 1 11 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.684 -0.100 25109
5934 1 11 . 1 1 64 64 ARG H H 64 6.596 6.596 7.273 -0.677 25109
5935 1 11 . 1 1 65 65 ARG N N 65 120.422 120.422 119.439 0.983 25109
5936 1 11 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.711 0.123 25109
5937 1 11 . 1 1 65 65 ARG C C 65 173.436 173.436 173.765 -0.329 25109
5938 1 11 . 1 1 65 65 ARG CA C 65 51.545 51.545 53.047 -1.502 25109
5939 1 11 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.847 -0.851 25109
5940 1 11 . 1 1 65 65 ARG H H 65 7.932 7.932 7.855 0.077 25109
5941 1 11 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.526 0.048 25109
5942 1 11 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.963 0.096 25109
5943 1 11 . 1 1 67 67 GLY N N 67 111.953 111.953 112.299 -0.346 25109
5944 1 11 . 1 1 67 67 GLY C C 67 177.057 177.057 175.805 1.252 25109
5945 1 11 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.847 1.460 25109
5946 1 11 . 1 1 67 67 GLY H H 67 9.198 9.198 8.305 0.893 25109
5947 1 11 . 1 1 68 68 TRP N N 68 117.467 117.467 120.589 -3.122 25109
5948 1 11 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.443 -0.101 25109
5949 1 11 . 1 1 68 68 TRP C C 68 177.690 177.690 176.710 0.980 25109
5950 1 11 . 1 1 68 68 TRP CA C 68 60.116 60.116 60.293 -0.177 25109
5951 1 11 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.382 0.808 25109
5952 1 11 . 1 1 68 68 TRP H H 68 7.647 7.647 7.873 -0.226 25109
5953 1 11 . 1 1 69 69 VAL N N 69 121.482 121.482 121.000 0.482 25109
5954 1 11 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.089 -0.452 25109
5955 1 11 . 1 1 69 69 VAL C C 69 177.993 177.993 177.875 0.118 25109
5956 1 11 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.876 1.590 25109
5957 1 11 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.149 -0.123 25109
5958 1 11 . 1 1 69 69 VAL H H 69 6.666 6.666 7.101 -0.435 25109
5959 1 11 . 1 1 70 70 GLU N N 70 116.350 116.350 119.861 -3.511 25109
5960 1 11 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.849 -0.024 25109
5961 1 11 . 1 1 70 70 GLU C C 70 180.362 180.362 178.974 1.388 25109
5962 1 11 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.681 -0.460 25109
5963 1 11 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.697 -1.392 25109
5964 1 11 . 1 1 70 70 GLU H H 70 7.410 7.410 8.024 -0.614 25109
5965 1 11 . 1 1 71 71 TYR N N 71 116.750 116.750 118.450 -1.700 25109
5966 1 11 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.317 0.133 25109
5967 1 11 . 1 1 71 71 TYR C C 71 178.411 178.411 178.313 0.098 25109
5968 1 11 . 1 1 71 71 TYR CA C 71 61.602 61.602 61.163 0.438 25109
5969 1 11 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.419 -0.064 25109
5970 1 11 . 1 1 71 71 TYR H H 71 7.159 7.159 7.384 -0.225 25109
5971 1 11 . 1 1 72 72 PHE N N 72 121.610 121.610 121.392 0.218 25109
5972 1 11 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.254 0.248 25109
5973 1 11 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.378 -0.558 25109
5974 1 11 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.178 0.871 25109
5975 1 11 . 1 1 72 72 PHE H H 72 9.007 9.007 8.366 0.641 25109
5976 1 11 . 1 1 73 73 ILE N N 73 119.200 119.200 119.481 -0.281 25109
5977 1 11 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.423 -0.243 25109
5978 1 11 . 1 1 73 73 ILE C C 73 177.620 177.620 177.669 -0.049 25109
5979 1 11 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.540 1.657 25109
5980 1 11 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.531 1.492 25109
5981 1 11 . 1 1 73 73 ILE H H 73 8.644 8.644 8.684 -0.040 25109
5982 1 11 . 1 1 74 74 ALA N N 74 119.624 119.624 121.014 -1.390 25109
5983 1 11 . 1 1 74 74 ALA HA H 74 3.954 3.954 3.988 -0.034 25109
5984 1 11 . 1 1 74 74 ALA C C 74 181.030 181.030 179.214 1.816 25109
5985 1 11 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.798 0.612 25109
5986 1 11 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.933 0.203 25109
5987 1 11 . 1 1 74 74 ALA H H 74 7.476 7.476 7.886 -0.410 25109
5988 1 11 . 1 1 75 75 ALA N N 75 123.625 123.625 122.158 1.467 25109
5989 1 11 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.577 0.261 25109
5990 1 11 . 1 1 75 75 ALA C C 75 179.272 179.272 179.489 -0.217 25109
5991 1 11 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.576 0.526 25109
5992 1 11 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.323 1.270 25109
5993 1 11 . 1 1 75 75 ALA H H 75 8.524 8.524 7.517 1.007 25109
5994 1 11 . 1 1 76 76 LEU N N 76 118.114 118.114 120.259 -2.145 25109
5995 1 11 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.941 -0.269 25109
5996 1 11 . 1 1 76 76 LEU C C 76 180.001 180.001 178.928 1.073 25109
5997 1 11 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.349 0.907 25109
5998 1 11 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.291 1.328 25109
5999 1 11 . 1 1 76 76 LEU H H 76 8.153 8.153 7.626 0.527 25109
6000 1 11 . 1 1 77 77 ARG N N 77 117.830 117.830 119.136 -1.306 25109
6001 1 11 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.977 -0.530 25109
6002 1 11 . 1 1 77 77 ARG C C 77 180.889 180.889 178.484 2.405 25109
6003 1 11 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.059 2.007 25109
6004 1 11 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.074 -0.877 25109
6005 1 11 . 1 1 77 77 ARG H H 77 7.945 7.945 7.707 0.238 25109
6006 1 11 . 1 1 78 78 GLY N N 78 110.202 110.202 105.705 4.497 25109
6007 1 11 . 1 1 78 78 GLY C C 78 174.807 174.807 175.700 -0.893 25109
6008 1 11 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.120 0.440 25109
6009 1 11 . 1 1 78 78 GLY H H 78 8.269 8.269 7.669 0.600 25109
6010 1 11 . 1 1 79 79 CYS N N 79 115.567 115.567 119.067 -3.500 25109
6011 1 11 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.376 0.013 25109
6012 1 11 . 1 1 79 79 CYS C C 79 173.025 173.025 175.226 -2.201 25109
6013 1 11 . 1 1 79 79 CYS CA C 79 59.957 59.957 59.923 0.034 25109
6014 1 11 . 1 1 79 79 CYS CB C 79 27.805 27.805 28.591 -0.786 25109
6015 1 11 . 1 1 79 79 CYS H H 79 7.132 7.132 7.587 -0.455 25109
6016 1 11 . 1 1 80 80 GLU N N 80 111.759 111.759 117.227 -5.468 25109
6017 1 11 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.362 -0.629 25109
6018 1 11 . 1 1 80 80 GLU C C 80 175.827 175.827 175.130 0.697 25109
6019 1 11 . 1 1 80 80 GLU CA C 80 57.467 57.467 56.174 1.293 25109
6020 1 11 . 1 1 80 80 GLU CB C 80 24.717 24.717 30.527 -5.810 25109
6021 1 11 . 1 1 80 80 GLU H H 80 7.772 7.772 8.042 -0.270 25109
6022 1 11 . 1 1 81 81 LEU N N 81 124.692 124.692 123.148 1.544 25109
6023 1 11 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.824 -0.133 25109
6024 1 11 . 1 1 81 81 LEU CA C 81 52.955 52.955 54.052 -1.097 25109
6025 1 11 . 1 1 81 81 LEU CB C 81 39.391 39.391 41.870 -2.479 25109
6026 1 11 . 1 1 81 81 LEU H H 81 8.167 8.167 8.477 -0.310 25109
6027 1 11 . 1 1 82 82 VAL N N 82 118.320 118.320 121.965 -3.645 25109
6028 1 11 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.656 -0.479 25109
6029 1 11 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.334 0.376 25109
6030 1 11 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.995 -0.047 25109
6031 1 11 . 1 1 82 82 VAL H H 82 7.141 7.141 8.109 -0.968 25109
6032 1 11 . 1 1 83 83 ASP N N 83 118.733 118.733 119.464 -0.731 25109
6033 1 11 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.325 0.007 25109
6034 1 11 . 1 1 83 83 ASP C C 83 178.674 178.674 178.001 0.673 25109
6035 1 11 . 1 1 83 83 ASP CA C 83 56.443 56.443 56.842 -0.398 25109
6036 1 11 . 1 1 83 83 ASP CB C 83 36.829 36.829 39.375 -2.546 25109
6037 1 11 . 1 1 83 83 ASP H H 83 8.385 8.385 8.787 -0.402 25109
6038 1 11 . 1 1 84 84 LEU N N 84 121.026 121.026 121.679 -0.653 25109
6039 1 11 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.282 -0.303 25109
6040 1 11 . 1 1 84 84 LEU C C 84 178.796 178.796 178.921 -0.125 25109
6041 1 11 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.094 0.428 25109
6042 1 11 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.538 0.957 25109
6043 1 11 . 1 1 84 84 LEU H H 84 7.770 7.770 7.605 0.165 25109
6044 1 11 . 1 1 85 85 ALA N N 85 121.525 121.525 122.057 -0.532 25109
6045 1 11 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.851 -0.190 25109
6046 1 11 . 1 1 85 85 ALA C C 85 179.322 179.322 179.133 0.189 25109
6047 1 11 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.234 0.607 25109
6048 1 11 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.008 0.919 25109
6049 1 11 . 1 1 85 85 ALA H H 85 8.126 8.126 7.825 0.301 25109
6050 1 11 . 1 1 86 86 ASP N N 86 115.349 115.349 118.493 -3.144 25109
6051 1 11 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.331 -0.058 25109
6052 1 11 . 1 1 86 86 ASP C C 86 178.463 178.463 178.505 -0.042 25109
6053 1 11 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.387 -1.676 25109
6054 1 11 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.987 -3.825 25109
6055 1 11 . 1 1 86 86 ASP H H 86 8.410 8.410 8.266 0.144 25109
6056 1 11 . 1 1 87 87 GLU N N 87 122.529 122.529 120.020 2.509 25109
6057 1 11 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.066 -0.030 25109
6058 1 11 . 1 1 87 87 GLU C C 87 178.508 178.508 179.409 -0.901 25109
6059 1 11 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.435 -0.081 25109
6060 1 11 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.900 -1.627 25109
6061 1 11 . 1 1 87 87 GLU H H 87 8.012 8.012 7.756 0.256 25109
6062 1 11 . 1 1 88 88 VAL N N 88 119.148 119.148 119.339 -0.191 25109
6063 1 11 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.902 -0.572 25109
6064 1 11 . 1 1 88 88 VAL C C 88 177.240 177.240 178.121 -0.881 25109
6065 1 11 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.835 1.414 25109
6066 1 11 . 1 1 88 88 VAL CB C 88 31.529 31.529 30.981 0.548 25109
6067 1 11 . 1 1 88 88 VAL H H 88 8.291 8.291 8.151 0.140 25109
6068 1 11 . 1 1 89 89 ALA N N 89 120.709 120.709 122.203 -1.494 25109
6069 1 11 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.048 -0.133 25109
6070 1 11 . 1 1 89 89 ALA C C 89 180.186 180.186 179.900 0.286 25109
6071 1 11 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.311 0.748 25109
6072 1 11 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.031 0.204 25109
6073 1 11 . 1 1 89 89 ALA H H 89 8.548 8.548 8.420 0.128 25109
6074 1 11 . 1 1 90 90 SER N N 90 113.035 113.035 113.748 -0.713 25109
6075 1 11 . 1 1 90 90 SER HA H 90 4.047 4.047 4.159 -0.112 25109
6076 1 11 . 1 1 90 90 SER C C 90 177.564 177.564 176.663 0.901 25109
6077 1 11 . 1 1 90 90 SER CA C 90 61.771 61.771 61.326 0.445 25109
6078 1 11 . 1 1 90 90 SER CB C 90 62.907 62.907 63.219 -0.312 25109
6079 1 11 . 1 1 90 90 SER H H 90 7.969 7.969 7.851 0.118 25109
6080 1 11 . 1 1 91 91 VAL N N 91 123.417 123.417 122.299 1.118 25109
6081 1 11 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.593 -0.246 25109
6082 1 11 . 1 1 91 91 VAL C C 91 178.428 178.428 177.616 0.812 25109
6083 1 11 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.623 -0.494 25109
6084 1 11 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.220 0.551 25109
6085 1 11 . 1 1 91 91 VAL H H 91 7.713 7.713 7.479 0.234 25109
6086 1 11 . 1 1 92 92 TYR N N 92 121.458 121.458 118.755 2.703 25109
6087 1 11 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.525 -0.334 25109
6088 1 11 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.401 1.593 25109
6089 1 11 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.206 0.779 25109
6090 1 11 . 1 1 92 92 TYR H H 92 8.395 8.395 8.263 0.132 25109
6091 1 11 . 1 1 93 93 GLN N N 93 115.549 115.549 117.329 -1.780 25109
6092 1 11 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.183 -0.472 25109
6093 1 11 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.078 1.016 25109
6094 1 11 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.694 -0.396 25109
6095 1 11 . 1 1 93 93 GLN H H 93 8.167 8.167 7.624 0.543 25109
6096 1 11 . 1 1 94 94 SER N N 94 115.923 115.923 114.922 1.001 25109
6097 1 11 . 1 1 94 94 SER HA H 94 4.096 4.096 4.269 -0.173 25109
6098 1 11 . 1 1 94 94 SER CA C 94 60.971 60.971 60.286 0.685 25109
6099 1 11 . 1 1 94 94 SER CB C 94 62.635 62.635 64.327 -1.692 25109
6100 1 11 . 1 1 94 94 SER H H 94 7.642 7.642 7.592 0.050 25109
6101 1 11 . 1 1 95 95 TYR N N 95 119.565 119.565 121.442 -1.877 25109
6102 1 11 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.501 0.258 25109
6103 1 11 . 1 1 95 95 TYR C C 95 175.334 175.334 174.206 1.128 25109
6104 1 11 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.886 0.812 25109
6105 1 11 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.445 1.874 25109
6106 1 11 . 1 1 95 95 TYR H H 95 7.069 7.069 8.061 -0.992 25109
6107 1 11 . 1 1 96 96 GLN N N 96 119.872 119.872 119.671 0.201 25109
6108 1 11 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.001 0.364 25109
6109 1 11 . 1 1 96 96 GLN C C 96 173.612 173.612 173.552 0.060 25109
6110 1 11 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.816 -1.480 25109
6111 1 11 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.237 1.257 25109
6112 1 11 . 1 1 96 96 GLN H H 96 7.409 7.409 8.501 -1.092 25109
6113 1 11 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.500 -0.182 25109
6114 1 11 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.366 -0.352 25109
6115 1 11 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.187 -0.089 25109
6116 1 11 . 1 1 98 98 ARG N N 98 121.759 121.759 119.020 2.739 25109
6117 1 11 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.622 -0.280 25109
6118 1 11 . 1 1 98 98 ARG C C 98 176.848 176.848 176.930 -0.082 25109
6119 1 11 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.883 1.338 25109
6120 1 11 . 1 1 98 98 ARG CB C 98 31.087 31.087 31.335 -0.248 25109
6121 1 11 . 1 1 98 98 ARG H H 98 8.423 8.423 7.454 0.969 25109
6122 1 11 . 1 1 99 99 THR N N 99 115.292 115.292 114.148 1.144 25109
6123 1 11 . 1 1 99 99 THR HA H 99 4.323 4.323 4.292 0.031 25109
6124 1 11 . 1 1 99 99 THR C C 99 174.350 174.350 174.580 -0.230 25109
6125 1 11 . 1 1 99 99 THR CA C 99 61.906 61.906 64.106 -2.200 25109
6126 1 11 . 1 1 99 99 THR CB C 99 70.180 70.180 69.085 1.095 25109
6127 1 11 . 1 1 99 99 THR H H 99 8.179 8.179 8.317 -0.138 25109
6128 1 12 . 1 1 0 0 SER N N 0 115.693 115.693 113.862 1.831 25109
6129 1 12 . 1 1 0 0 SER HA H 0 4.531 4.531 4.465 0.066 25109
6130 1 12 . 1 1 0 0 SER C C 0 174.557 174.557 174.576 -0.019 25109
6131 1 12 . 1 1 0 0 SER CA C 0 58.478 58.478 59.587 -1.109 25109
6132 1 12 . 1 1 0 0 SER CB C 0 64.380 64.380 63.508 0.871 25109
6133 1 12 . 1 1 0 0 SER H H 0 8.631 8.631 8.632 -0.001 25109
6134 1 12 . 1 1 1 1 MET N N 1 123.111 123.111 118.177 4.934 25109
6135 1 12 . 1 1 1 1 MET HA H 1 4.728 4.728 4.887 -0.159 25109
6136 1 12 . 1 1 1 1 MET C C 1 174.846 174.846 173.702 1.144 25109
6137 1 12 . 1 1 1 1 MET CA C 1 55.655 55.655 52.646 3.009 25109
6138 1 12 . 1 1 1 1 MET CB C 1 32.035 32.035 34.144 -2.109 25109
6139 1 12 . 1 1 1 1 MET H H 1 8.641 8.641 7.458 1.183 25109
6140 1 12 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.459 0.018 25109
6141 1 12 . 1 1 2 2 PRO CB C 2 32.000 32.000 30.572 1.428 25109
6142 1 12 . 1 1 3 3 PHE N N 3 121.126 121.126 124.138 -3.012 25109
6143 1 12 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.613 -0.247 25109
6144 1 12 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.271 1.591 25109
6145 1 12 . 1 1 3 3 PHE CB C 3 39.368 39.368 41.181 -1.813 25109
6146 1 12 . 1 1 3 3 PHE H H 3 8.177 8.177 8.053 0.124 25109
6147 1 12 . 1 1 4 4 ALA N N 4 121.170 121.170 122.593 -1.423 25109
6148 1 12 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.042 -0.207 25109
6149 1 12 . 1 1 4 4 ALA C C 4 181.522 181.522 179.556 1.966 25109
6150 1 12 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.868 -0.414 25109
6151 1 12 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.160 1.276 25109
6152 1 12 . 1 1 4 4 ALA H H 4 8.444 8.444 8.798 -0.354 25109
6153 1 12 . 1 1 5 5 GLU N N 5 118.932 118.932 117.656 1.276 25109
6154 1 12 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.811 0.044 25109
6155 1 12 . 1 1 5 5 GLU C C 5 177.971 177.971 177.810 0.161 25109
6156 1 12 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.586 1.045 25109
6157 1 12 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.818 -0.057 25109
6158 1 12 . 1 1 5 5 GLU H H 5 8.454 8.454 8.630 -0.176 25109
6159 1 12 . 1 1 6 6 ASP N N 6 120.471 120.471 119.598 0.873 25109
6160 1 12 . 1 1 6 6 ASP C C 6 178.885 178.885 178.187 0.698 25109
6161 1 12 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.128 -0.056 25109
6162 1 12 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.592 -1.460 25109
6163 1 12 . 1 1 6 6 ASP H H 6 8.316 8.316 8.403 -0.087 25109
6164 1 12 . 1 1 7 7 LYS N N 7 118.335 118.335 117.666 0.669 25109
6165 1 12 . 1 1 7 7 LYS HA H 7 3.690 3.690 4.104 -0.414 25109
6166 1 12 . 1 1 7 7 LYS C C 7 180.080 180.080 178.950 1.130 25109
6167 1 12 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.209 0.511 25109
6168 1 12 . 1 1 7 7 LYS CB C 7 31.794 31.794 32.275 -0.481 25109
6169 1 12 . 1 1 7 7 LYS H H 7 8.249 8.249 7.528 0.721 25109
6170 1 12 . 1 1 8 8 THR N N 8 119.222 119.222 118.008 1.214 25109
6171 1 12 . 1 1 8 8 THR HA H 8 3.975 3.975 3.982 -0.007 25109
6172 1 12 . 1 1 8 8 THR CA C 8 68.453 68.453 66.899 1.554 25109
6173 1 12 . 1 1 8 8 THR CB C 8 67.387 67.387 68.609 -1.222 25109
6174 1 12 . 1 1 8 8 THR H H 8 7.897 7.897 7.913 -0.016 25109
6175 1 12 . 1 1 9 9 TYR N N 9 123.054 123.054 122.355 0.699 25109
6176 1 12 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.280 -0.027 25109
6177 1 12 . 1 1 9 9 TYR C C 9 177.441 177.441 177.618 -0.177 25109
6178 1 12 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.676 -0.778 25109
6179 1 12 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.570 -0.721 25109
6180 1 12 . 1 1 9 9 TYR H H 9 8.605 8.605 8.765 -0.160 25109
6181 1 12 . 1 1 10 10 LYS N N 10 118.366 118.366 118.121 0.245 25109
6182 1 12 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.919 -0.325 25109
6183 1 12 . 1 1 10 10 LYS C C 10 178.885 178.885 178.882 0.003 25109
6184 1 12 . 1 1 10 10 LYS CA C 10 60.044 60.044 59.448 0.596 25109
6185 1 12 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.226 -0.181 25109
6186 1 12 . 1 1 10 10 LYS H H 10 8.066 8.066 7.689 0.377 25109
6187 1 12 . 1 1 11 11 TYR N N 11 120.539 120.539 119.929 0.610 25109
6188 1 12 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.217 -0.227 25109
6189 1 12 . 1 1 11 11 TYR C C 11 178.233 178.233 178.217 0.016 25109
6190 1 12 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.587 0.941 25109
6191 1 12 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.002 -0.639 25109
6192 1 12 . 1 1 11 11 TYR H H 11 7.875 7.875 7.775 0.100 25109
6193 1 12 . 1 1 12 12 ILE N N 12 121.893 121.893 119.785 2.108 25109
6194 1 12 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.793 -0.697 25109
6195 1 12 . 1 1 12 12 ILE C C 12 177.015 177.015 177.860 -0.845 25109
6196 1 12 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.365 2.398 25109
6197 1 12 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.321 1.231 25109
6198 1 12 . 1 1 12 12 ILE H H 12 8.154 8.154 8.623 -0.469 25109
6199 1 12 . 1 1 13 13 CYS N N 13 113.894 113.894 117.229 -3.335 25109
6200 1 12 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.824 0.063 25109
6201 1 12 . 1 1 13 13 CYS C C 13 178.288 178.288 175.295 2.993 25109
6202 1 12 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.825 2.512 25109
6203 1 12 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.872 0.133 25109
6204 1 12 . 1 1 13 13 CYS H H 13 7.551 7.551 7.617 -0.066 25109
6205 1 12 . 1 1 14 14 ARG N N 14 119.228 119.228 117.249 1.979 25109
6206 1 12 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.136 -0.066 25109
6207 1 12 . 1 1 14 14 ARG C C 14 177.127 177.127 176.904 0.223 25109
6208 1 12 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.079 0.415 25109
6209 1 12 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.391 0.031 25109
6210 1 12 . 1 1 14 14 ARG H H 14 7.991 7.991 7.501 0.490 25109
6211 1 12 . 1 1 15 15 ASN N N 15 117.367 117.367 116.026 1.341 25109
6212 1 12 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.850 0.119 25109
6213 1 12 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.649 0.114 25109
6214 1 12 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.358 0.227 25109
6215 1 12 . 1 1 15 15 ASN H H 15 7.643 7.643 7.675 -0.032 25109
6216 1 12 . 1 1 16 16 PHE N N 16 122.356 122.356 122.395 -0.039 25109
6217 1 12 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.977 0.239 25109
6218 1 12 . 1 1 16 16 PHE C C 16 178.084 178.084 176.578 1.506 25109
6219 1 12 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.377 1.800 25109
6220 1 12 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.926 1.663 25109
6221 1 12 . 1 1 16 16 PHE H H 16 6.992 6.992 7.482 -0.490 25109
6222 1 12 . 1 1 17 17 SER N N 17 112.937 112.937 113.538 -0.601 25109
6223 1 12 . 1 1 17 17 SER HA H 17 4.199 4.199 4.028 0.171 25109
6224 1 12 . 1 1 17 17 SER C C 17 176.726 176.726 175.207 1.519 25109
6225 1 12 . 1 1 17 17 SER CA C 17 62.052 62.052 60.438 1.614 25109
6226 1 12 . 1 1 17 17 SER CB C 17 62.552 62.552 62.928 -0.376 25109
6227 1 12 . 1 1 17 17 SER H H 17 8.840 8.840 8.520 0.320 25109
6228 1 12 . 1 1 18 18 ASN N N 18 118.809 118.809 117.415 1.394 25109
6229 1 12 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.613 -0.255 25109
6230 1 12 . 1 1 18 18 ASN C C 18 175.967 175.967 175.940 0.027 25109
6231 1 12 . 1 1 18 18 ASN CA C 18 54.910 54.910 54.927 -0.017 25109
6232 1 12 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.666 -0.838 25109
6233 1 12 . 1 1 18 18 ASN H H 18 8.130 8.130 8.241 -0.111 25109
6234 1 12 . 1 1 19 19 PHE N N 19 115.750 115.750 118.074 -2.324 25109
6235 1 12 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.487 -0.202 25109
6236 1 12 . 1 1 19 19 PHE C C 19 175.370 175.370 176.321 -0.951 25109
6237 1 12 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.982 -0.120 25109
6238 1 12 . 1 1 19 19 PHE CB C 19 39.878 39.878 39.850 0.028 25109
6239 1 12 . 1 1 19 19 PHE H H 19 8.062 8.062 7.614 0.448 25109
6240 1 12 . 1 1 20 20 CYS N N 20 113.958 113.958 118.980 -5.022 25109
6241 1 12 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.122 -0.179 25109
6242 1 12 . 1 1 20 20 CYS C C 20 173.823 173.823 174.590 -0.767 25109
6243 1 12 . 1 1 20 20 CYS CA C 20 61.788 61.788 59.726 2.062 25109
6244 1 12 . 1 1 20 20 CYS CB C 20 27.383 27.383 25.309 2.074 25109
6245 1 12 . 1 1 20 20 CYS H H 20 6.850 6.850 7.684 -0.834 25109
6246 1 12 . 1 1 21 21 ASN N N 21 116.691 116.691 118.333 -1.642 25109
6247 1 12 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.701 0.043 25109
6248 1 12 . 1 1 21 21 ASN C C 21 175.299 175.299 174.604 0.695 25109
6249 1 12 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.010 0.281 25109
6250 1 12 . 1 1 21 21 ASN CB C 21 38.313 38.313 40.466 -2.153 25109
6251 1 12 . 1 1 21 21 ASN H H 21 8.251 8.251 7.729 0.522 25109
6252 1 12 . 1 1 22 22 VAL N N 22 122.431 122.431 122.095 0.336 25109
6253 1 12 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.084 -0.534 25109
6254 1 12 . 1 1 22 22 VAL C C 22 174.034 174.034 174.551 -0.517 25109
6255 1 12 . 1 1 22 22 VAL CA C 22 63.937 63.937 62.006 1.931 25109
6256 1 12 . 1 1 22 22 VAL CB C 22 31.523 31.523 32.733 -1.210 25109
6257 1 12 . 1 1 22 22 VAL H H 22 7.573 7.573 7.529 0.044 25109
6258 1 12 . 1 1 23 23 ASP N N 23 127.219 127.219 121.514 5.705 25109
6259 1 12 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.542 -1.356 25109
6260 1 12 . 1 1 23 23 ASP CB C 23 38.793 38.793 42.566 -3.773 25109
6261 1 12 . 1 1 23 23 ASP H H 23 8.687 8.687 8.604 0.083 25109
6262 1 12 . 1 1 24 24 VAL N N 24 127.835 127.835 121.960 5.875 25109
6263 1 12 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.229 -0.936 25109
6264 1 12 . 1 1 24 24 VAL C C 24 176.867 176.867 176.829 0.038 25109
6265 1 12 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.291 3.872 25109
6266 1 12 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.986 -0.971 25109
6267 1 12 . 1 1 24 24 VAL H H 24 9.409 9.409 8.236 1.173 25109
6268 1 12 . 1 1 25 25 VAL N N 25 114.324 114.324 116.297 -1.973 25109
6269 1 12 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.009 -0.490 25109
6270 1 12 . 1 1 25 25 VAL C C 25 178.006 178.006 178.116 -0.110 25109
6271 1 12 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.054 1.634 25109
6272 1 12 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.717 -0.185 25109
6273 1 12 . 1 1 25 25 VAL H H 25 8.038 8.038 7.516 0.522 25109
6274 1 12 . 1 1 26 26 GLU N N 26 117.009 117.009 121.596 -4.587 25109
6275 1 12 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.187 -0.096 25109
6276 1 12 . 1 1 26 26 GLU C C 26 177.303 177.303 178.429 -1.126 25109
6277 1 12 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.815 -1.383 25109
6278 1 12 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.471 -0.506 25109
6279 1 12 . 1 1 26 26 GLU H H 26 7.220 7.220 8.821 -1.601 25109
6280 1 12 . 1 1 27 27 ILE N N 27 114.080 114.080 118.067 -3.987 25109
6281 1 12 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.963 0.398 25109
6282 1 12 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.106 -1.374 25109
6283 1 12 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.032 1.559 25109
6284 1 12 . 1 1 27 27 ILE H H 27 7.647 7.647 8.142 -0.495 25109
6285 1 12 . 1 1 28 28 LEU N N 28 121.867 121.867 120.232 1.635 25109
6286 1 12 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.148 -0.211 25109
6287 1 12 . 1 1 28 28 LEU C C 28 175.756 175.756 177.046 -1.290 25109
6288 1 12 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.076 -0.109 25109
6289 1 12 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.804 0.709 25109
6290 1 12 . 1 1 28 28 LEU H H 28 7.434 7.434 7.322 0.112 25109
6291 1 12 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.260 -0.050 25109
6292 1 12 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.028 0.282 25109
6293 1 12 . 1 1 30 30 TYR N N 30 113.832 113.832 115.363 -1.531 25109
6294 1 12 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.627 -0.125 25109
6295 1 12 . 1 1 30 30 TYR C C 30 174.386 174.386 174.937 -0.551 25109
6296 1 12 . 1 1 30 30 TYR CA C 30 57.694 57.694 57.993 -0.299 25109
6297 1 12 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.169 -0.070 25109
6298 1 12 . 1 1 30 30 TYR H H 30 7.628 7.628 7.636 -0.008 25109
6299 1 12 . 1 1 31 31 LEU N N 31 118.331 118.331 121.204 -2.873 25109
6300 1 12 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.971 -0.094 25109
6301 1 12 . 1 1 31 31 LEU C C 31 173.849 173.849 174.473 -0.624 25109
6302 1 12 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.496 0.196 25109
6303 1 12 . 1 1 31 31 LEU CB C 31 42.802 42.802 43.539 -0.737 25109
6304 1 12 . 1 1 31 31 LEU H H 31 7.619 7.619 7.385 0.234 25109
6305 1 12 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.644 -0.289 25109
6306 1 12 . 1 1 32 32 PRO CB C 32 31.410 31.410 32.419 -1.009 25109
6307 1 12 . 1 1 33 33 CYS N N 33 110.978 110.978 112.352 -1.374 25109
6308 1 12 . 1 1 33 33 CYS HA H 33 4.341 4.341 3.861 0.480 25109
6309 1 12 . 1 1 33 33 CYS C C 33 174.139 174.139 173.903 0.236 25109
6310 1 12 . 1 1 33 33 CYS CA C 33 56.212 56.212 59.755 -3.543 25109
6311 1 12 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.143 1.779 25109
6312 1 12 . 1 1 33 33 CYS H H 33 6.414 6.414 8.197 -1.783 25109
6313 1 12 . 1 1 34 34 LEU N N 34 123.111 123.111 122.037 1.074 25109
6314 1 12 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.203 0.403 25109
6315 1 12 . 1 1 34 34 LEU C C 34 176.646 176.646 176.864 -0.218 25109
6316 1 12 . 1 1 34 34 LEU CA C 34 53.891 53.891 55.857 -1.966 25109
6317 1 12 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.181 0.510 25109
6318 1 12 . 1 1 34 34 LEU H H 34 7.550 7.550 7.668 -0.118 25109
6319 1 12 . 1 1 35 35 THR N N 35 113.831 113.831 119.380 -5.549 25109
6320 1 12 . 1 1 35 35 THR HA H 35 4.205 4.205 4.264 -0.059 25109
6321 1 12 . 1 1 35 35 THR C C 35 175.324 175.324 175.670 -0.346 25109
6322 1 12 . 1 1 35 35 THR CA C 35 61.200 61.200 61.957 -0.757 25109
6323 1 12 . 1 1 35 35 THR CB C 35 71.318 71.318 69.969 1.349 25109
6324 1 12 . 1 1 35 35 THR H H 35 8.586 8.586 8.277 0.309 25109
6325 1 12 . 1 1 36 36 ALA N N 36 124.128 124.128 125.910 -1.782 25109
6326 1 12 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.021 -0.097 25109
6327 1 12 . 1 1 36 36 ALA C C 36 180.397 180.397 179.980 0.417 25109
6328 1 12 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.439 0.481 25109
6329 1 12 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.476 -0.673 25109
6330 1 12 . 1 1 36 36 ALA H H 36 8.836 8.836 8.729 0.107 25109
6331 1 12 . 1 1 37 37 ARG N N 37 116.793 116.793 118.585 -1.792 25109
6332 1 12 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.170 -0.184 25109
6333 1 12 . 1 1 37 37 ARG C C 37 179.272 179.272 178.185 1.087 25109
6334 1 12 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.015 0.217 25109
6335 1 12 . 1 1 37 37 ARG CB C 37 29.905 29.905 28.818 1.087 25109
6336 1 12 . 1 1 37 37 ARG H H 37 8.060 8.060 8.721 -0.661 25109
6337 1 12 . 1 1 38 38 ASP N N 38 120.030 120.030 119.577 0.453 25109
6338 1 12 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.354 -0.106 25109
6339 1 12 . 1 1 38 38 ASP C C 38 178.885 178.885 178.563 0.322 25109
6340 1 12 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.233 -1.046 25109
6341 1 12 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.291 0.642 25109
6342 1 12 . 1 1 38 38 ASP H H 38 7.782 7.782 8.439 -0.657 25109
6343 1 12 . 1 1 39 39 GLN N N 39 118.223 118.223 117.992 0.231 25109
6344 1 12 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.997 -0.332 25109
6345 1 12 . 1 1 39 39 GLN C C 39 178.041 178.041 178.119 -0.078 25109
6346 1 12 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.805 1.796 25109
6347 1 12 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.707 -0.910 25109
6348 1 12 . 1 1 39 39 GLN H H 39 8.476 8.476 8.188 0.288 25109
6349 1 12 . 1 1 40 40 ASP N N 40 117.908 117.908 120.522 -2.614 25109
6350 1 12 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.332 -0.079 25109
6351 1 12 . 1 1 40 40 ASP C C 40 178.639 178.639 178.423 0.216 25109
6352 1 12 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.436 -1.036 25109
6353 1 12 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.816 -2.788 25109
6354 1 12 . 1 1 40 40 ASP H H 40 8.386 8.386 8.053 0.333 25109
6355 1 12 . 1 1 41 41 ARG N N 41 120.990 120.990 119.029 1.961 25109
6356 1 12 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.907 0.135 25109
6357 1 12 . 1 1 41 41 ARG C C 41 179.795 179.795 178.514 1.281 25109
6358 1 12 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.494 0.951 25109
6359 1 12 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.416 0.842 25109
6360 1 12 . 1 1 41 41 ARG H H 41 8.130 8.130 8.388 -0.258 25109
6361 1 12 . 1 1 42 42 LEU N N 42 121.219 121.219 119.671 1.548 25109
6362 1 12 . 1 1 42 42 LEU HA H 42 3.935 3.935 3.974 -0.039 25109
6363 1 12 . 1 1 42 42 LEU C C 42 178.850 178.850 178.789 0.061 25109
6364 1 12 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.990 0.276 25109
6365 1 12 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.286 0.747 25109
6366 1 12 . 1 1 42 42 LEU H H 42 8.179 8.179 7.378 0.801 25109
6367 1 12 . 1 1 43 43 ARG N N 43 119.310 119.310 119.820 -0.510 25109
6368 1 12 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.800 -0.076 25109
6369 1 12 . 1 1 43 43 ARG C C 43 179.099 179.099 178.508 0.591 25109
6370 1 12 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.852 0.962 25109
6371 1 12 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.170 0.009 25109
6372 1 12 . 1 1 43 43 ARG H H 43 8.296 8.296 8.053 0.243 25109
6373 1 12 . 1 1 44 44 ALA N N 44 121.305 121.305 120.047 1.258 25109
6374 1 12 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.134 -0.031 25109
6375 1 12 . 1 1 44 44 ALA C C 44 180.924 180.924 179.281 1.643 25109
6376 1 12 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.040 0.185 25109
6377 1 12 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.312 -0.216 25109
6378 1 12 . 1 1 44 44 ALA H H 44 7.774 7.774 8.500 -0.726 25109
6379 1 12 . 1 1 45 45 THR N N 45 115.017 115.017 114.270 0.747 25109
6380 1 12 . 1 1 45 45 THR HA H 45 3.879 3.879 4.086 -0.207 25109
6381 1 12 . 1 1 45 45 THR CA C 45 66.327 66.327 67.188 -0.861 25109
6382 1 12 . 1 1 45 45 THR CB C 45 68.809 68.809 68.711 0.098 25109
6383 1 12 . 1 1 45 45 THR H H 45 8.167 8.167 7.718 0.449 25109
6384 1 12 . 1 1 46 46 CYS N N 46 123.609 123.609 121.068 2.541 25109
6385 1 12 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.318 -0.299 25109
6386 1 12 . 1 1 46 46 CYS C C 46 178.077 178.077 175.923 2.154 25109
6387 1 12 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.799 0.146 25109
6388 1 12 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.814 -1.675 25109
6389 1 12 . 1 1 46 46 CYS H H 46 8.084 8.084 8.461 -0.377 25109
6390 1 12 . 1 1 47 47 THR N N 47 115.520 115.520 113.106 2.414 25109
6391 1 12 . 1 1 47 47 THR HA H 47 3.915 3.915 4.236 -0.321 25109
6392 1 12 . 1 1 47 47 THR CA C 47 66.063 66.063 64.227 1.836 25109
6393 1 12 . 1 1 47 47 THR CB C 47 69.245 69.245 68.671 0.574 25109
6394 1 12 . 1 1 47 47 THR H H 47 7.735 7.735 7.572 0.163 25109
6395 1 12 . 1 1 48 48 LEU N N 48 120.099 120.099 120.088 0.011 25109
6396 1 12 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.468 -0.242 25109
6397 1 12 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.290 1.273 25109
6398 1 12 . 1 1 48 48 LEU CB C 48 43.625 43.625 43.567 0.058 25109
6399 1 12 . 1 1 48 48 LEU H H 48 7.464 7.464 7.508 -0.044 25109
6400 1 12 . 1 1 49 49 SER N N 49 111.979 111.979 112.781 -0.802 25109
6401 1 12 . 1 1 49 49 SER HA H 49 4.661 4.661 4.571 0.090 25109
6402 1 12 . 1 1 49 49 SER C C 49 175.581 175.581 174.294 1.287 25109
6403 1 12 . 1 1 49 49 SER CA C 49 59.590 59.590 58.909 0.681 25109
6404 1 12 . 1 1 49 49 SER CB C 49 65.335 65.335 64.277 1.058 25109
6405 1 12 . 1 1 49 49 SER H H 49 8.781 8.781 8.389 0.392 25109
6406 1 12 . 1 1 50 50 GLY N N 50 110.194 110.194 109.336 0.858 25109
6407 1 12 . 1 1 50 50 GLY C C 50 175.123 175.123 173.702 1.421 25109
6408 1 12 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.562 0.341 25109
6409 1 12 . 1 1 50 50 GLY H H 50 7.955 7.955 7.517 0.438 25109
6410 1 12 . 1 1 51 51 ASN N N 51 121.050 121.050 119.960 1.090 25109
6411 1 12 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.477 -0.227 25109
6412 1 12 . 1 1 51 51 ASN C C 51 176.403 176.403 177.026 -0.623 25109
6413 1 12 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.388 3.916 25109
6414 1 12 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.406 3.193 25109
6415 1 12 . 1 1 51 51 ASN H H 51 8.898 8.898 8.783 0.115 25109
6416 1 12 . 1 1 52 52 ARG N N 52 119.825 119.825 119.275 0.550 25109
6417 1 12 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.120 -0.082 25109
6418 1 12 . 1 1 52 52 ARG C C 52 178.850 178.850 177.226 1.624 25109
6419 1 12 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.651 1.413 25109
6420 1 12 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.984 0.039 25109
6421 1 12 . 1 1 52 52 ARG H H 52 8.696 8.696 8.453 0.243 25109
6422 1 12 . 1 1 53 53 ASP N N 53 116.032 116.032 117.899 -1.867 25109
6423 1 12 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.755 -0.209 25109
6424 1 12 . 1 1 53 53 ASP C C 53 178.996 178.996 178.364 0.632 25109
6425 1 12 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.356 -1.278 25109
6426 1 12 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.745 -2.374 25109
6427 1 12 . 1 1 53 53 ASP H H 53 9.036 9.036 8.683 0.353 25109
6428 1 12 . 1 1 54 54 THR N N 54 115.848 115.848 117.170 -1.322 25109
6429 1 12 . 1 1 54 54 THR HA H 54 3.746 3.746 4.178 -0.432 25109
6430 1 12 . 1 1 54 54 THR CA C 54 67.885 67.885 66.254 1.631 25109
6431 1 12 . 1 1 54 54 THR CB C 54 66.953 66.953 68.912 -1.959 25109
6432 1 12 . 1 1 54 54 THR H H 54 7.782 7.782 7.602 0.180 25109
6433 1 12 . 1 1 55 55 LEU N N 55 125.987 125.987 121.690 4.297 25109
6434 1 12 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.081 -0.527 25109
6435 1 12 . 1 1 55 55 LEU C C 55 177.901 177.901 178.746 -0.845 25109
6436 1 12 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.212 0.241 25109
6437 1 12 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.545 0.318 25109
6438 1 12 . 1 1 55 55 LEU H H 55 8.740 8.740 7.991 0.749 25109
6439 1 12 . 1 1 56 56 TRP N N 56 116.672 116.672 117.776 -1.104 25109
6440 1 12 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.451 -0.371 25109
6441 1 12 . 1 1 56 56 TRP C C 56 179.588 179.588 178.777 0.811 25109
6442 1 12 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.645 -0.164 25109
6443 1 12 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.241 -0.049 25109
6444 1 12 . 1 1 56 56 TRP H H 56 7.642 7.642 7.896 -0.254 25109
6445 1 12 . 1 1 57 57 HIS N N 57 115.754 115.754 118.951 -3.197 25109
6446 1 12 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.410 -0.134 25109
6447 1 12 . 1 1 57 57 HIS C C 57 177.514 177.514 177.368 0.146 25109
6448 1 12 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.111 -0.159 25109
6449 1 12 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.601 -2.599 25109
6450 1 12 . 1 1 57 57 HIS H H 57 7.407 7.407 7.663 -0.256 25109
6451 1 12 . 1 1 58 58 LEU N N 58 123.934 123.934 122.929 1.005 25109
6452 1 12 . 1 1 58 58 LEU HA H 58 3.787 3.787 4.017 -0.230 25109
6453 1 12 . 1 1 58 58 LEU C C 58 178.115 178.115 177.864 0.251 25109
6454 1 12 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.062 0.847 25109
6455 1 12 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.640 -0.825 25109
6456 1 12 . 1 1 58 58 LEU H H 58 8.996 8.996 8.719 0.277 25109
6457 1 12 . 1 1 59 59 PHE N N 59 117.721 117.721 115.628 2.093 25109
6458 1 12 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.890 0.045 25109
6459 1 12 . 1 1 59 59 PHE C C 59 176.987 176.987 178.055 -1.068 25109
6460 1 12 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.830 -1.717 25109
6461 1 12 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.981 -1.021 25109
6462 1 12 . 1 1 59 59 PHE H H 59 8.201 8.201 8.308 -0.107 25109
6463 1 12 . 1 1 60 60 ASN N N 60 115.695 115.695 118.040 -2.345 25109
6464 1 12 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.490 -0.571 25109
6465 1 12 . 1 1 60 60 ASN C C 60 176.670 176.670 177.080 -0.410 25109
6466 1 12 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.178 0.578 25109
6467 1 12 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.861 0.457 25109
6468 1 12 . 1 1 60 60 ASN H H 60 7.666 7.666 7.708 -0.042 25109
6469 1 12 . 1 1 61 61 THR N N 61 115.110 115.110 115.493 -0.383 25109
6470 1 12 . 1 1 61 61 THR HA H 61 3.733 3.733 4.048 -0.315 25109
6471 1 12 . 1 1 61 61 THR CA C 61 66.319 66.319 65.509 0.810 25109
6472 1 12 . 1 1 61 61 THR CB C 61 69.174 69.174 68.700 0.474 25109
6473 1 12 . 1 1 61 61 THR H H 61 7.782 7.782 8.283 -0.501 25109
6474 1 12 . 1 1 62 62 LEU N N 62 121.559 121.559 121.745 -0.186 25109
6475 1 12 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.813 -0.324 25109
6476 1 12 . 1 1 62 62 LEU C C 62 176.600 176.600 178.761 -2.161 25109
6477 1 12 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.251 -0.286 25109
6478 1 12 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.575 1.760 25109
6479 1 12 . 1 1 62 62 LEU H H 62 8.362 8.362 8.254 0.108 25109
6480 1 12 . 1 1 63 63 GLN N N 63 109.150 109.150 116.590 -7.440 25109
6481 1 12 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.778 -1.701 25109
6482 1 12 . 1 1 63 63 GLN C C 63 175.194 175.194 177.336 -2.142 25109
6483 1 12 . 1 1 63 63 GLN CA C 63 56.266 56.266 58.002 -1.736 25109
6484 1 12 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.937 -2.243 25109
6485 1 12 . 1 1 63 63 GLN H H 63 6.458 6.458 7.311 -0.853 25109
6486 1 12 . 1 1 64 64 ARG N N 64 116.029 116.029 117.709 -1.680 25109
6487 1 12 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.153 -0.055 25109
6488 1 12 . 1 1 64 64 ARG C C 64 176.459 176.459 176.795 -0.336 25109
6489 1 12 . 1 1 64 64 ARG CA C 64 56.143 56.143 57.245 -1.103 25109
6490 1 12 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.662 -0.078 25109
6491 1 12 . 1 1 64 64 ARG H H 64 6.596 6.596 7.219 -0.623 25109
6492 1 12 . 1 1 65 65 ARG N N 65 120.422 120.422 119.491 0.931 25109
6493 1 12 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.805 0.029 25109
6494 1 12 . 1 1 65 65 ARG C C 65 173.436 173.436 174.035 -0.599 25109
6495 1 12 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.171 -0.626 25109
6496 1 12 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.717 -0.721 25109
6497 1 12 . 1 1 65 65 ARG H H 65 7.932 7.932 7.660 0.272 25109
6498 1 12 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.435 0.139 25109
6499 1 12 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.575 0.484 25109
6500 1 12 . 1 1 67 67 GLY N N 67 111.953 111.953 113.344 -1.391 25109
6501 1 12 . 1 1 67 67 GLY C C 67 177.057 177.057 174.908 2.149 25109
6502 1 12 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.821 1.486 25109
6503 1 12 . 1 1 67 67 GLY H H 67 9.198 9.198 8.195 1.003 25109
6504 1 12 . 1 1 68 68 TRP N N 68 117.467 117.467 121.019 -3.552 25109
6505 1 12 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.245 -0.903 25109
6506 1 12 . 1 1 68 68 TRP C C 68 177.690 177.690 175.997 1.693 25109
6507 1 12 . 1 1 68 68 TRP CA C 68 60.116 60.116 58.050 2.066 25109
6508 1 12 . 1 1 68 68 TRP CB C 68 29.190 29.190 30.393 -1.204 25109
6509 1 12 . 1 1 68 68 TRP H H 68 7.647 7.647 9.271 -1.624 25109
6510 1 12 . 1 1 69 69 VAL N N 69 121.482 121.482 121.766 -0.284 25109
6511 1 12 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.255 -0.618 25109
6512 1 12 . 1 1 69 69 VAL C C 69 177.993 177.993 177.678 0.315 25109
6513 1 12 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.714 0.752 25109
6514 1 12 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.148 -0.122 25109
6515 1 12 . 1 1 69 69 VAL H H 69 6.666 6.666 8.114 -1.448 25109
6516 1 12 . 1 1 70 70 GLU N N 70 116.350 116.350 119.494 -3.144 25109
6517 1 12 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.628 0.197 25109
6518 1 12 . 1 1 70 70 GLU C C 70 180.362 180.362 178.868 1.494 25109
6519 1 12 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.226 -0.005 25109
6520 1 12 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.434 -1.129 25109
6521 1 12 . 1 1 70 70 GLU H H 70 7.410 7.410 8.492 -1.082 25109
6522 1 12 . 1 1 71 71 TYR N N 71 116.750 116.750 118.563 -1.813 25109
6523 1 12 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.358 0.092 25109
6524 1 12 . 1 1 71 71 TYR C C 71 178.411 178.411 178.074 0.337 25109
6525 1 12 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.560 1.042 25109
6526 1 12 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.395 -0.040 25109
6527 1 12 . 1 1 71 71 TYR H H 71 7.159 7.159 7.328 -0.169 25109
6528 1 12 . 1 1 72 72 PHE N N 72 121.610 121.610 121.479 0.131 25109
6529 1 12 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.250 0.252 25109
6530 1 12 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.259 -0.439 25109
6531 1 12 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.133 0.916 25109
6532 1 12 . 1 1 72 72 PHE H H 72 9.007 9.007 8.650 0.357 25109
6533 1 12 . 1 1 73 73 ILE N N 73 119.200 119.200 118.804 0.396 25109
6534 1 12 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.480 -0.300 25109
6535 1 12 . 1 1 73 73 ILE C C 73 177.620 177.620 177.619 0.001 25109
6536 1 12 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.587 1.610 25109
6537 1 12 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.447 1.576 25109
6538 1 12 . 1 1 73 73 ILE H H 73 8.644 8.644 8.233 0.411 25109
6539 1 12 . 1 1 74 74 ALA N N 74 119.624 119.624 120.971 -1.347 25109
6540 1 12 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.072 -0.118 25109
6541 1 12 . 1 1 74 74 ALA C C 74 181.030 181.030 179.419 1.611 25109
6542 1 12 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.680 0.731 25109
6543 1 12 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.002 0.134 25109
6544 1 12 . 1 1 74 74 ALA H H 74 7.476 7.476 7.552 -0.076 25109
6545 1 12 . 1 1 75 75 ALA N N 75 123.625 123.625 122.826 0.799 25109
6546 1 12 . 1 1 75 75 ALA HA H 75 3.838 3.838 4.338 -0.500 25109
6547 1 12 . 1 1 75 75 ALA C C 75 179.272 179.272 179.750 -0.478 25109
6548 1 12 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.569 0.533 25109
6549 1 12 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.603 0.990 25109
6550 1 12 . 1 1 75 75 ALA H H 75 8.524 8.524 7.813 0.711 25109
6551 1 12 . 1 1 76 76 LEU N N 76 118.114 118.114 120.123 -2.009 25109
6552 1 12 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.054 -0.382 25109
6553 1 12 . 1 1 76 76 LEU C C 76 180.001 180.001 178.880 1.121 25109
6554 1 12 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.296 0.960 25109
6555 1 12 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.476 1.143 25109
6556 1 12 . 1 1 76 76 LEU H H 76 8.153 8.153 7.979 0.174 25109
6557 1 12 . 1 1 77 77 ARG N N 77 117.830 117.830 118.951 -1.121 25109
6558 1 12 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.048 -0.601 25109
6559 1 12 . 1 1 77 77 ARG C C 77 180.889 180.889 179.096 1.793 25109
6560 1 12 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.042 2.023 25109
6561 1 12 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.965 -0.768 25109
6562 1 12 . 1 1 77 77 ARG H H 77 7.945 7.945 8.133 -0.188 25109
6563 1 12 . 1 1 78 78 GLY N N 78 110.202 110.202 108.616 1.586 25109
6564 1 12 . 1 1 78 78 GLY C C 78 174.807 174.807 175.030 -0.223 25109
6565 1 12 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.149 0.411 25109
6566 1 12 . 1 1 78 78 GLY H H 78 8.269 8.269 7.893 0.376 25109
6567 1 12 . 1 1 79 79 CYS N N 79 115.567 115.567 117.116 -1.549 25109
6568 1 12 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.194 0.195 25109
6569 1 12 . 1 1 79 79 CYS C C 79 173.025 173.025 174.710 -1.685 25109
6570 1 12 . 1 1 79 79 CYS CA C 79 59.957 59.957 58.470 1.487 25109
6571 1 12 . 1 1 79 79 CYS CB C 79 27.805 27.805 28.746 -0.941 25109
6572 1 12 . 1 1 79 79 CYS H H 79 7.132 7.132 7.606 -0.474 25109
6573 1 12 . 1 1 80 80 GLU N N 80 111.759 111.759 117.192 -5.433 25109
6574 1 12 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.022 -0.289 25109
6575 1 12 . 1 1 80 80 GLU C C 80 175.827 175.827 175.435 0.392 25109
6576 1 12 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.318 0.149 25109
6577 1 12 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.316 -2.599 25109
6578 1 12 . 1 1 80 80 GLU H H 80 7.772 7.772 7.704 0.068 25109
6579 1 12 . 1 1 81 81 LEU N N 81 124.692 124.692 120.816 3.876 25109
6580 1 12 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.471 0.220 25109
6581 1 12 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.777 -0.822 25109
6582 1 12 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.754 -1.363 25109
6583 1 12 . 1 1 81 81 LEU H H 81 8.167 8.167 8.348 -0.181 25109
6584 1 12 . 1 1 82 82 VAL N N 82 118.320 118.320 122.806 -4.486 25109
6585 1 12 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.540 -0.363 25109
6586 1 12 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.641 0.069 25109
6587 1 12 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.863 0.085 25109
6588 1 12 . 1 1 82 82 VAL H H 82 7.141 7.141 7.500 -0.359 25109
6589 1 12 . 1 1 83 83 ASP N N 83 118.733 118.733 120.115 -1.382 25109
6590 1 12 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.298 0.034 25109
6591 1 12 . 1 1 83 83 ASP C C 83 178.674 178.674 178.399 0.275 25109
6592 1 12 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.746 -1.303 25109
6593 1 12 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.214 -3.385 25109
6594 1 12 . 1 1 83 83 ASP H H 83 8.385 8.385 8.569 -0.184 25109
6595 1 12 . 1 1 84 84 LEU N N 84 121.026 121.026 119.751 1.275 25109
6596 1 12 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.741 0.238 25109
6597 1 12 . 1 1 84 84 LEU C C 84 178.796 178.796 178.858 -0.062 25109
6598 1 12 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.269 0.253 25109
6599 1 12 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.203 1.292 25109
6600 1 12 . 1 1 84 84 LEU H H 84 7.770 7.770 7.553 0.217 25109
6601 1 12 . 1 1 85 85 ALA N N 85 121.525 121.525 122.748 -1.223 25109
6602 1 12 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.874 -0.213 25109
6603 1 12 . 1 1 85 85 ALA C C 85 179.322 179.322 179.056 0.266 25109
6604 1 12 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.156 0.685 25109
6605 1 12 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.093 0.834 25109
6606 1 12 . 1 1 85 85 ALA H H 85 8.126 8.126 7.575 0.551 25109
6607 1 12 . 1 1 86 86 ASP N N 86 115.349 115.349 118.632 -3.283 25109
6608 1 12 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.318 -0.045 25109
6609 1 12 . 1 1 86 86 ASP C C 86 178.463 178.463 178.536 -0.073 25109
6610 1 12 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.489 -1.778 25109
6611 1 12 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.914 -3.752 25109
6612 1 12 . 1 1 86 86 ASP H H 86 8.410 8.410 8.458 -0.048 25109
6613 1 12 . 1 1 87 87 GLU N N 87 122.529 122.529 119.352 3.177 25109
6614 1 12 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.095 -0.059 25109
6615 1 12 . 1 1 87 87 GLU C C 87 178.508 178.508 179.574 -1.066 25109
6616 1 12 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.392 -0.038 25109
6617 1 12 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.563 -1.290 25109
6618 1 12 . 1 1 87 87 GLU H H 87 8.012 8.012 8.183 -0.171 25109
6619 1 12 . 1 1 88 88 VAL N N 88 119.148 119.148 119.859 -0.711 25109
6620 1 12 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.912 -0.582 25109
6621 1 12 . 1 1 88 88 VAL C C 88 177.240 177.240 178.008 -0.768 25109
6622 1 12 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.192 1.057 25109
6623 1 12 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.655 -0.126 25109
6624 1 12 . 1 1 88 88 VAL H H 88 8.291 8.291 7.993 0.298 25109
6625 1 12 . 1 1 89 89 ALA N N 89 120.709 120.709 122.532 -1.823 25109
6626 1 12 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.051 -0.136 25109
6627 1 12 . 1 1 89 89 ALA C C 89 180.186 180.186 179.817 0.369 25109
6628 1 12 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.514 0.545 25109
6629 1 12 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.178 0.057 25109
6630 1 12 . 1 1 89 89 ALA H H 89 8.548 8.548 8.516 0.032 25109
6631 1 12 . 1 1 90 90 SER N N 90 113.035 113.035 113.921 -0.886 25109
6632 1 12 . 1 1 90 90 SER HA H 90 4.047 4.047 4.157 -0.110 25109
6633 1 12 . 1 1 90 90 SER C C 90 177.564 177.564 176.429 1.135 25109
6634 1 12 . 1 1 90 90 SER CA C 90 61.771 61.771 62.103 -0.333 25109
6635 1 12 . 1 1 90 90 SER CB C 90 62.907 62.907 63.302 -0.395 25109
6636 1 12 . 1 1 90 90 SER H H 90 7.969 7.969 8.137 -0.168 25109
6637 1 12 . 1 1 91 91 VAL N N 91 123.417 123.417 122.425 0.992 25109
6638 1 12 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.717 -0.370 25109
6639 1 12 . 1 1 91 91 VAL C C 91 178.428 178.428 177.589 0.839 25109
6640 1 12 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.222 0.907 25109
6641 1 12 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.431 0.340 25109
6642 1 12 . 1 1 91 91 VAL H H 91 7.713 7.713 7.485 0.228 25109
6643 1 12 . 1 1 92 92 TYR N N 92 121.458 121.458 120.279 1.179 25109
6644 1 12 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.411 -0.220 25109
6645 1 12 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.685 1.309 25109
6646 1 12 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.302 0.683 25109
6647 1 12 . 1 1 92 92 TYR H H 92 8.395 8.395 8.849 -0.454 25109
6648 1 12 . 1 1 93 93 GLN N N 93 115.549 115.549 118.071 -2.522 25109
6649 1 12 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.021 -0.310 25109
6650 1 12 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.267 -0.173 25109
6651 1 12 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.379 -0.081 25109
6652 1 12 . 1 1 93 93 GLN H H 93 8.167 8.167 7.652 0.515 25109
6653 1 12 . 1 1 94 94 SER N N 94 115.923 115.923 114.790 1.133 25109
6654 1 12 . 1 1 94 94 SER HA H 94 4.096 4.096 4.139 -0.043 25109
6655 1 12 . 1 1 94 94 SER CA C 94 60.971 60.971 60.158 0.813 25109
6656 1 12 . 1 1 94 94 SER CB C 94 62.635 62.635 63.571 -0.936 25109
6657 1 12 . 1 1 94 94 SER H H 94 7.642 7.642 7.442 0.200 25109
6658 1 12 . 1 1 95 95 TYR N N 95 119.565 119.565 120.746 -1.181 25109
6659 1 12 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.545 0.214 25109
6660 1 12 . 1 1 95 95 TYR C C 95 175.334 175.334 174.189 1.145 25109
6661 1 12 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.256 1.442 25109
6662 1 12 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.157 2.162 25109
6663 1 12 . 1 1 95 95 TYR H H 95 7.069 7.069 7.528 -0.459 25109
6664 1 12 . 1 1 96 96 GLN N N 96 119.872 119.872 118.629 1.243 25109
6665 1 12 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.908 0.457 25109
6666 1 12 . 1 1 96 96 GLN C C 96 173.612 173.612 174.348 -0.736 25109
6667 1 12 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.775 -1.439 25109
6668 1 12 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.241 1.253 25109
6669 1 12 . 1 1 96 96 GLN H H 96 7.409 7.409 8.372 -0.963 25109
6670 1 12 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.287 0.031 25109
6671 1 12 . 1 1 97 97 PRO CA C 97 63.014 63.014 64.500 -1.486 25109
6672 1 12 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.017 0.081 25109
6673 1 12 . 1 1 98 98 ARG N N 98 121.759 121.759 115.688 6.071 25109
6674 1 12 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.615 -0.273 25109
6675 1 12 . 1 1 98 98 ARG C C 98 176.848 176.848 175.120 1.728 25109
6676 1 12 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.922 1.299 25109
6677 1 12 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.663 0.424 25109
6678 1 12 . 1 1 98 98 ARG H H 98 8.423 8.423 8.081 0.342 25109
6679 1 12 . 1 1 99 99 THR N N 99 115.292 115.292 115.102 0.190 25109
6680 1 12 . 1 1 99 99 THR HA H 99 4.323 4.323 3.985 0.338 25109
6681 1 12 . 1 1 99 99 THR C C 99 174.350 174.350 174.308 0.042 25109
6682 1 12 . 1 1 99 99 THR CA C 99 61.906 61.906 63.552 -1.646 25109
6683 1 12 . 1 1 99 99 THR CB C 99 70.180 70.180 68.079 2.101 25109
6684 1 12 . 1 1 99 99 THR H H 99 8.179 8.179 7.442 0.737 25109
6685 1 13 . 1 1 0 0 SER N N 0 115.693 115.693 117.089 -1.396 25109
6686 1 13 . 1 1 0 0 SER HA H 0 4.531 4.531 4.186 0.345 25109
6687 1 13 . 1 1 0 0 SER C C 0 174.557 174.557 173.741 0.816 25109
6688 1 13 . 1 1 0 0 SER CA C 0 58.478 58.478 60.463 -1.985 25109
6689 1 13 . 1 1 0 0 SER CB C 0 64.380 64.380 63.282 1.098 25109
6690 1 13 . 1 1 0 0 SER H H 0 8.631 8.631 8.596 0.035 25109
6691 1 13 . 1 1 1 1 MET N N 1 123.111 123.111 120.931 2.180 25109
6692 1 13 . 1 1 1 1 MET HA H 1 4.728 4.728 4.842 -0.114 25109
6693 1 13 . 1 1 1 1 MET C C 1 174.846 174.846 173.705 1.141 25109
6694 1 13 . 1 1 1 1 MET CA C 1 55.655 55.655 53.628 2.027 25109
6695 1 13 . 1 1 1 1 MET CB C 1 32.035 32.035 34.928 -2.893 25109
6696 1 13 . 1 1 1 1 MET H H 1 8.641 8.641 7.806 0.835 25109
6697 1 13 . 1 1 2 2 PRO HA H 2 4.477 4.477 5.014 -0.537 25109
6698 1 13 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.791 -0.791 25109
6699 1 13 . 1 1 3 3 PHE N N 3 121.126 121.126 124.025 -2.899 25109
6700 1 13 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.563 -0.197 25109
6701 1 13 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.618 1.244 25109
6702 1 13 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.488 -1.120 25109
6703 1 13 . 1 1 3 3 PHE H H 3 8.177 8.177 9.582 -1.405 25109
6704 1 13 . 1 1 4 4 ALA N N 4 121.170 121.170 122.681 -1.511 25109
6705 1 13 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.137 -0.302 25109
6706 1 13 . 1 1 4 4 ALA C C 4 181.522 181.522 179.347 2.175 25109
6707 1 13 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.143 0.311 25109
6708 1 13 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.571 0.865 25109
6709 1 13 . 1 1 4 4 ALA H H 4 8.444 8.444 8.872 -0.428 25109
6710 1 13 . 1 1 5 5 GLU N N 5 118.932 118.932 119.660 -0.728 25109
6711 1 13 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.866 -0.011 25109
6712 1 13 . 1 1 5 5 GLU C C 5 177.971 177.971 178.019 -0.048 25109
6713 1 13 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.960 0.671 25109
6714 1 13 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.547 0.214 25109
6715 1 13 . 1 1 5 5 GLU H H 5 8.454 8.454 8.602 -0.148 25109
6716 1 13 . 1 1 6 6 ASP N N 6 120.471 120.471 118.738 1.733 25109
6717 1 13 . 1 1 6 6 ASP C C 6 178.885 178.885 178.200 0.685 25109
6718 1 13 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.286 -0.214 25109
6719 1 13 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.676 -1.544 25109
6720 1 13 . 1 1 6 6 ASP H H 6 8.316 8.316 8.612 -0.296 25109
6721 1 13 . 1 1 7 7 LYS N N 7 118.335 118.335 118.875 -0.540 25109
6722 1 13 . 1 1 7 7 LYS HA H 7 3.690 3.690 4.012 -0.322 25109
6723 1 13 . 1 1 7 7 LYS C C 7 180.080 180.080 179.049 1.031 25109
6724 1 13 . 1 1 7 7 LYS CA C 7 58.720 58.720 59.280 -0.560 25109
6725 1 13 . 1 1 7 7 LYS CB C 7 31.794 31.794 32.241 -0.447 25109
6726 1 13 . 1 1 7 7 LYS H H 7 8.249 8.249 7.326 0.923 25109
6727 1 13 . 1 1 8 8 THR N N 8 119.222 119.222 117.079 2.143 25109
6728 1 13 . 1 1 8 8 THR HA H 8 3.975 3.975 4.056 -0.081 25109
6729 1 13 . 1 1 8 8 THR CA C 8 68.453 68.453 67.358 1.095 25109
6730 1 13 . 1 1 8 8 THR CB C 8 67.387 67.387 68.535 -1.149 25109
6731 1 13 . 1 1 8 8 THR H H 8 7.897 7.897 8.281 -0.384 25109
6732 1 13 . 1 1 9 9 TYR N N 9 123.054 123.054 122.382 0.672 25109
6733 1 13 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.103 0.150 25109
6734 1 13 . 1 1 9 9 TYR C C 9 177.441 177.441 176.988 0.453 25109
6735 1 13 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.278 -0.380 25109
6736 1 13 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.573 -0.724 25109
6737 1 13 . 1 1 9 9 TYR H H 9 8.605 8.605 8.541 0.064 25109
6738 1 13 . 1 1 10 10 LYS N N 10 118.366 118.366 118.621 -0.255 25109
6739 1 13 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.847 -0.253 25109
6740 1 13 . 1 1 10 10 LYS C C 10 178.885 178.885 179.007 -0.122 25109
6741 1 13 . 1 1 10 10 LYS CA C 10 60.044 60.044 59.394 0.650 25109
6742 1 13 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.209 -0.164 25109
6743 1 13 . 1 1 10 10 LYS H H 10 8.066 8.066 7.833 0.233 25109
6744 1 13 . 1 1 11 11 TYR N N 11 120.539 120.539 121.562 -1.023 25109
6745 1 13 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.206 -0.216 25109
6746 1 13 . 1 1 11 11 TYR C C 11 178.233 178.233 176.500 1.733 25109
6747 1 13 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.239 1.289 25109
6748 1 13 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.741 -0.378 25109
6749 1 13 . 1 1 11 11 TYR H H 11 7.875 7.875 7.902 -0.027 25109
6750 1 13 . 1 1 12 12 ILE N N 12 121.893 121.893 116.556 5.337 25109
6751 1 13 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.582 -0.486 25109
6752 1 13 . 1 1 12 12 ILE C C 12 177.015 177.015 177.773 -0.758 25109
6753 1 13 . 1 1 12 12 ILE CA C 12 65.763 65.763 61.941 3.822 25109
6754 1 13 . 1 1 12 12 ILE CB C 12 37.552 37.552 37.230 0.322 25109
6755 1 13 . 1 1 12 12 ILE H H 12 8.154 8.154 7.798 0.356 25109
6756 1 13 . 1 1 13 13 CYS N N 13 113.894 113.894 119.374 -5.480 25109
6757 1 13 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.666 0.221 25109
6758 1 13 . 1 1 13 13 CYS C C 13 178.288 178.288 176.988 1.300 25109
6759 1 13 . 1 1 13 13 CYS CA C 13 64.337 64.337 62.197 2.140 25109
6760 1 13 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.265 0.740 25109
6761 1 13 . 1 1 13 13 CYS H H 13 7.551 7.551 8.316 -0.765 25109
6762 1 13 . 1 1 14 14 ARG N N 14 119.228 119.228 118.577 0.651 25109
6763 1 13 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.115 -0.045 25109
6764 1 13 . 1 1 14 14 ARG C C 14 177.127 177.127 176.491 0.636 25109
6765 1 13 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.034 0.460 25109
6766 1 13 . 1 1 14 14 ARG CB C 14 30.422 30.422 29.636 0.787 25109
6767 1 13 . 1 1 14 14 ARG H H 14 7.991 7.991 7.516 0.475 25109
6768 1 13 . 1 1 15 15 ASN N N 15 117.367 117.367 116.211 1.156 25109
6769 1 13 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.868 0.101 25109
6770 1 13 . 1 1 15 15 ASN CA C 15 52.763 52.763 51.929 0.834 25109
6771 1 13 . 1 1 15 15 ASN CB C 15 38.585 38.585 39.037 -0.452 25109
6772 1 13 . 1 1 15 15 ASN H H 15 7.643 7.643 7.697 -0.054 25109
6773 1 13 . 1 1 16 16 PHE N N 16 122.356 122.356 123.064 -0.708 25109
6774 1 13 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.795 0.421 25109
6775 1 13 . 1 1 16 16 PHE C C 16 178.084 178.084 177.030 1.054 25109
6776 1 13 . 1 1 16 16 PHE CA C 16 63.177 63.177 62.248 0.929 25109
6777 1 13 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.913 1.676 25109
6778 1 13 . 1 1 16 16 PHE H H 16 6.992 6.992 7.422 -0.430 25109
6779 1 13 . 1 1 17 17 SER N N 17 112.937 112.937 114.052 -1.115 25109
6780 1 13 . 1 1 17 17 SER HA H 17 4.199 4.199 4.003 0.196 25109
6781 1 13 . 1 1 17 17 SER C C 17 176.726 176.726 175.600 1.126 25109
6782 1 13 . 1 1 17 17 SER CA C 17 62.052 62.052 60.587 1.465 25109
6783 1 13 . 1 1 17 17 SER CB C 17 62.552 62.552 62.804 -0.252 25109
6784 1 13 . 1 1 17 17 SER H H 17 8.840 8.840 8.289 0.551 25109
6785 1 13 . 1 1 18 18 ASN N N 18 118.809 118.809 119.229 -0.420 25109
6786 1 13 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.524 -0.166 25109
6787 1 13 . 1 1 18 18 ASN C C 18 175.967 175.967 176.784 -0.817 25109
6788 1 13 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.388 -0.478 25109
6789 1 13 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.682 -0.854 25109
6790 1 13 . 1 1 18 18 ASN H H 18 8.130 8.130 8.395 -0.265 25109
6791 1 13 . 1 1 19 19 PHE N N 19 115.750 115.750 117.860 -2.110 25109
6792 1 13 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.526 -0.241 25109
6793 1 13 . 1 1 19 19 PHE C C 19 175.370 175.370 176.315 -0.945 25109
6794 1 13 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.673 0.189 25109
6795 1 13 . 1 1 19 19 PHE CB C 19 39.878 39.878 39.295 0.583 25109
6796 1 13 . 1 1 19 19 PHE H H 19 8.062 8.062 7.665 0.397 25109
6797 1 13 . 1 1 20 20 CYS N N 20 113.958 113.958 118.238 -4.280 25109
6798 1 13 . 1 1 20 20 CYS HA H 20 3.943 3.943 3.861 0.082 25109
6799 1 13 . 1 1 20 20 CYS C C 20 173.823 173.823 174.600 -0.777 25109
6800 1 13 . 1 1 20 20 CYS CA C 20 61.788 61.788 60.455 1.333 25109
6801 1 13 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.043 0.340 25109
6802 1 13 . 1 1 20 20 CYS H H 20 6.850 6.850 7.467 -0.617 25109
6803 1 13 . 1 1 21 21 ASN N N 21 116.691 116.691 119.659 -2.968 25109
6804 1 13 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.749 -0.005 25109
6805 1 13 . 1 1 21 21 ASN C C 21 175.299 175.299 173.655 1.644 25109
6806 1 13 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.526 0.764 25109
6807 1 13 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.292 0.021 25109
6808 1 13 . 1 1 21 21 ASN H H 21 8.251 8.251 7.907 0.344 25109
6809 1 13 . 1 1 22 22 VAL N N 22 122.431 122.431 120.548 1.883 25109
6810 1 13 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.202 -0.652 25109
6811 1 13 . 1 1 22 22 VAL C C 22 174.034 174.034 173.863 0.171 25109
6812 1 13 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.008 3.929 25109
6813 1 13 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.925 -4.402 25109
6814 1 13 . 1 1 22 22 VAL H H 22 7.573 7.573 7.400 0.173 25109
6815 1 13 . 1 1 23 23 ASP N N 23 127.219 127.219 126.745 0.474 25109
6816 1 13 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.688 -1.502 25109
6817 1 13 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.026 -2.233 25109
6818 1 13 . 1 1 23 23 ASP H H 23 8.687 8.687 8.633 0.054 25109
6819 1 13 . 1 1 24 24 VAL N N 24 127.835 127.835 125.050 2.785 25109
6820 1 13 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.857 -0.564 25109
6821 1 13 . 1 1 24 24 VAL C C 24 176.867 176.867 177.263 -0.396 25109
6822 1 13 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.509 2.654 25109
6823 1 13 . 1 1 24 24 VAL CB C 24 32.015 32.015 31.767 0.248 25109
6824 1 13 . 1 1 24 24 VAL H H 24 9.409 9.409 8.387 1.022 25109
6825 1 13 . 1 1 25 25 VAL N N 25 114.324 114.324 115.849 -1.525 25109
6826 1 13 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.940 -0.421 25109
6827 1 13 . 1 1 25 25 VAL C C 25 178.006 178.006 177.751 0.255 25109
6828 1 13 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.049 1.639 25109
6829 1 13 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.327 0.205 25109
6830 1 13 . 1 1 25 25 VAL H H 25 8.038 8.038 7.606 0.432 25109
6831 1 13 . 1 1 26 26 GLU N N 26 117.009 117.009 119.075 -2.066 25109
6832 1 13 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.222 -0.131 25109
6833 1 13 . 1 1 26 26 GLU C C 26 177.303 177.303 178.359 -1.056 25109
6834 1 13 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.364 -0.931 25109
6835 1 13 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.597 -0.632 25109
6836 1 13 . 1 1 26 26 GLU H H 26 7.220 7.220 8.731 -1.511 25109
6837 1 13 . 1 1 27 27 ILE N N 27 114.080 114.080 118.918 -4.838 25109
6838 1 13 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.800 0.561 25109
6839 1 13 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.149 -1.417 25109
6840 1 13 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.248 1.343 25109
6841 1 13 . 1 1 27 27 ILE H H 27 7.647 7.647 7.222 0.425 25109
6842 1 13 . 1 1 28 28 LEU N N 28 121.867 121.867 120.283 1.584 25109
6843 1 13 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.171 -0.234 25109
6844 1 13 . 1 1 28 28 LEU C C 28 175.756 175.756 176.762 -1.006 25109
6845 1 13 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.095 -0.128 25109
6846 1 13 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.908 0.605 25109
6847 1 13 . 1 1 28 28 LEU H H 28 7.434 7.434 7.347 0.087 25109
6848 1 13 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.345 -0.135 25109
6849 1 13 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.164 0.146 25109
6850 1 13 . 1 1 30 30 TYR N N 30 113.832 113.832 116.494 -2.662 25109
6851 1 13 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.538 -0.036 25109
6852 1 13 . 1 1 30 30 TYR C C 30 174.386 174.386 175.206 -0.820 25109
6853 1 13 . 1 1 30 30 TYR CA C 30 57.694 57.694 60.043 -2.349 25109
6854 1 13 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.721 -0.622 25109
6855 1 13 . 1 1 30 30 TYR H H 30 7.628 7.628 7.700 -0.072 25109
6856 1 13 . 1 1 31 31 LEU N N 31 118.331 118.331 118.126 0.205 25109
6857 1 13 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.810 0.067 25109
6858 1 13 . 1 1 31 31 LEU C C 31 173.849 173.849 175.244 -1.395 25109
6859 1 13 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.809 -0.117 25109
6860 1 13 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.366 0.436 25109
6861 1 13 . 1 1 31 31 LEU H H 31 7.619 7.619 7.570 0.049 25109
6862 1 13 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.539 -0.184 25109
6863 1 13 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.745 -0.335 25109
6864 1 13 . 1 1 33 33 CYS N N 33 110.978 110.978 115.750 -4.772 25109
6865 1 13 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.230 0.111 25109
6866 1 13 . 1 1 33 33 CYS C C 33 174.139 174.139 175.036 -0.897 25109
6867 1 13 . 1 1 33 33 CYS CA C 33 56.212 56.212 59.097 -2.885 25109
6868 1 13 . 1 1 33 33 CYS CB C 33 28.922 28.922 26.767 2.155 25109
6869 1 13 . 1 1 33 33 CYS H H 33 6.414 6.414 7.634 -1.220 25109
6870 1 13 . 1 1 34 34 LEU N N 34 123.111 123.111 120.653 2.458 25109
6871 1 13 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.280 0.326 25109
6872 1 13 . 1 1 34 34 LEU C C 34 176.646 176.646 176.516 0.130 25109
6873 1 13 . 1 1 34 34 LEU CA C 34 53.891 53.891 55.038 -1.147 25109
6874 1 13 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.251 0.440 25109
6875 1 13 . 1 1 34 34 LEU H H 34 7.550 7.550 7.312 0.238 25109
6876 1 13 . 1 1 35 35 THR N N 35 113.831 113.831 116.696 -2.865 25109
6877 1 13 . 1 1 35 35 THR HA H 35 4.205 4.205 4.251 -0.046 25109
6878 1 13 . 1 1 35 35 THR C C 35 175.324 175.324 176.009 -0.685 25109
6879 1 13 . 1 1 35 35 THR CA C 35 61.200 61.200 61.540 -0.340 25109
6880 1 13 . 1 1 35 35 THR CB C 35 71.318 71.318 69.994 1.324 25109
6881 1 13 . 1 1 35 35 THR H H 35 8.586 8.586 7.858 0.728 25109
6882 1 13 . 1 1 36 36 ALA N N 36 124.128 124.128 126.205 -2.077 25109
6883 1 13 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.001 -0.077 25109
6884 1 13 . 1 1 36 36 ALA C C 36 180.397 180.397 179.944 0.453 25109
6885 1 13 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.711 0.209 25109
6886 1 13 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.290 -0.487 25109
6887 1 13 . 1 1 36 36 ALA H H 36 8.836 8.836 8.725 0.111 25109
6888 1 13 . 1 1 37 37 ARG N N 37 116.793 116.793 118.388 -1.595 25109
6889 1 13 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.058 -0.072 25109
6890 1 13 . 1 1 37 37 ARG C C 37 179.272 179.272 178.017 1.255 25109
6891 1 13 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.671 -0.439 25109
6892 1 13 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.553 0.352 25109
6893 1 13 . 1 1 37 37 ARG H H 37 8.060 8.060 8.736 -0.676 25109
6894 1 13 . 1 1 38 38 ASP N N 38 120.030 120.030 119.902 0.128 25109
6895 1 13 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.371 -0.123 25109
6896 1 13 . 1 1 38 38 ASP C C 38 178.885 178.885 178.574 0.311 25109
6897 1 13 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.576 -1.389 25109
6898 1 13 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.328 0.605 25109
6899 1 13 . 1 1 38 38 ASP H H 38 7.782 7.782 8.519 -0.737 25109
6900 1 13 . 1 1 39 39 GLN N N 39 118.223 118.223 118.089 0.134 25109
6901 1 13 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.948 -0.283 25109
6902 1 13 . 1 1 39 39 GLN C C 39 178.041 178.041 178.098 -0.057 25109
6903 1 13 . 1 1 39 39 GLN CA C 39 60.601 60.601 59.017 1.584 25109
6904 1 13 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.709 -0.912 25109
6905 1 13 . 1 1 39 39 GLN H H 39 8.476 8.476 8.330 0.146 25109
6906 1 13 . 1 1 40 40 ASP N N 40 117.908 117.908 120.591 -2.683 25109
6907 1 13 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.343 -0.090 25109
6908 1 13 . 1 1 40 40 ASP C C 40 178.639 178.639 178.392 0.247 25109
6909 1 13 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.340 -0.940 25109
6910 1 13 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.760 -2.732 25109
6911 1 13 . 1 1 40 40 ASP H H 40 8.386 8.386 8.394 -0.008 25109
6912 1 13 . 1 1 41 41 ARG N N 41 120.990 120.990 119.524 1.466 25109
6913 1 13 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.890 0.152 25109
6914 1 13 . 1 1 41 41 ARG C C 41 179.795 179.795 178.586 1.209 25109
6915 1 13 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.727 -0.282 25109
6916 1 13 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.214 0.044 25109
6917 1 13 . 1 1 41 41 ARG H H 41 8.130 8.130 8.220 -0.090 25109
6918 1 13 . 1 1 42 42 LEU N N 42 121.219 121.219 119.600 1.619 25109
6919 1 13 . 1 1 42 42 LEU HA H 42 3.935 3.935 3.838 0.097 25109
6920 1 13 . 1 1 42 42 LEU C C 42 178.850 178.850 178.616 0.234 25109
6921 1 13 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.898 0.369 25109
6922 1 13 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.480 0.553 25109
6923 1 13 . 1 1 42 42 LEU H H 42 8.179 8.179 7.579 0.600 25109
6924 1 13 . 1 1 43 43 ARG N N 43 119.310 119.310 119.562 -0.252 25109
6925 1 13 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.818 -0.094 25109
6926 1 13 . 1 1 43 43 ARG C C 43 179.099 179.099 178.382 0.717 25109
6927 1 13 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.748 1.066 25109
6928 1 13 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.207 -0.028 25109
6929 1 13 . 1 1 43 43 ARG H H 43 8.296 8.296 8.589 -0.293 25109
6930 1 13 . 1 1 44 44 ALA N N 44 121.305 121.305 121.046 0.259 25109
6931 1 13 . 1 1 44 44 ALA HA H 44 4.103 4.103 3.982 0.121 25109
6932 1 13 . 1 1 44 44 ALA C C 44 180.924 180.924 179.376 1.548 25109
6933 1 13 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.563 -0.338 25109
6934 1 13 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.326 -0.230 25109
6935 1 13 . 1 1 44 44 ALA H H 44 7.774 7.774 8.494 -0.720 25109
6936 1 13 . 1 1 45 45 THR N N 45 115.017 115.017 115.320 -0.303 25109
6937 1 13 . 1 1 45 45 THR HA H 45 3.879 3.879 3.970 -0.091 25109
6938 1 13 . 1 1 45 45 THR CA C 45 66.327 66.327 66.711 -0.384 25109
6939 1 13 . 1 1 45 45 THR CB C 45 68.809 68.809 68.479 0.330 25109
6940 1 13 . 1 1 45 45 THR H H 45 8.167 8.167 7.714 0.453 25109
6941 1 13 . 1 1 46 46 CYS N N 46 123.609 123.609 120.375 3.234 25109
6942 1 13 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.359 -0.340 25109
6943 1 13 . 1 1 46 46 CYS C C 46 178.077 178.077 176.276 1.801 25109
6944 1 13 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.477 0.468 25109
6945 1 13 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.007 -0.868 25109
6946 1 13 . 1 1 46 46 CYS H H 46 8.084 8.084 8.471 -0.387 25109
6947 1 13 . 1 1 47 47 THR N N 47 115.520 115.520 115.507 0.013 25109
6948 1 13 . 1 1 47 47 THR HA H 47 3.915 3.915 4.178 -0.264 25109
6949 1 13 . 1 1 47 47 THR CA C 47 66.063 66.063 65.651 0.412 25109
6950 1 13 . 1 1 47 47 THR CB C 47 69.245 69.245 69.117 0.128 25109
6951 1 13 . 1 1 47 47 THR H H 47 7.735 7.735 7.549 0.186 25109
6952 1 13 . 1 1 48 48 LEU N N 48 120.099 120.099 121.543 -1.444 25109
6953 1 13 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.182 0.044 25109
6954 1 13 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.753 -0.190 25109
6955 1 13 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.434 1.191 25109
6956 1 13 . 1 1 48 48 LEU H H 48 7.464 7.464 8.359 -0.895 25109
6957 1 13 . 1 1 49 49 SER N N 49 111.979 111.979 111.883 0.096 25109
6958 1 13 . 1 1 49 49 SER HA H 49 4.661 4.661 4.609 0.052 25109
6959 1 13 . 1 1 49 49 SER C C 49 175.581 175.581 174.978 0.603 25109
6960 1 13 . 1 1 49 49 SER CA C 49 59.590 59.590 59.298 0.292 25109
6961 1 13 . 1 1 49 49 SER CB C 49 65.335 65.335 65.377 -0.042 25109
6962 1 13 . 1 1 49 49 SER H H 49 8.781 8.781 8.392 0.389 25109
6963 1 13 . 1 1 50 50 GLY N N 50 110.194 110.194 108.183 2.011 25109
6964 1 13 . 1 1 50 50 GLY C C 50 175.123 175.123 172.945 2.178 25109
6965 1 13 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.742 0.160 25109
6966 1 13 . 1 1 50 50 GLY H H 50 7.955 7.955 8.137 -0.182 25109
6967 1 13 . 1 1 51 51 ASN N N 51 121.050 121.050 119.947 1.103 25109
6968 1 13 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.481 -0.231 25109
6969 1 13 . 1 1 51 51 ASN C C 51 176.403 176.403 177.373 -0.970 25109
6970 1 13 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.248 4.055 25109
6971 1 13 . 1 1 51 51 ASN CB C 51 41.599 41.599 37.924 3.675 25109
6972 1 13 . 1 1 51 51 ASN H H 51 8.898 8.898 8.789 0.109 25109
6973 1 13 . 1 1 52 52 ARG N N 52 119.825 119.825 121.135 -1.310 25109
6974 1 13 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.975 0.063 25109
6975 1 13 . 1 1 52 52 ARG C C 52 178.850 178.850 177.558 1.292 25109
6976 1 13 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.307 0.757 25109
6977 1 13 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.921 0.102 25109
6978 1 13 . 1 1 52 52 ARG H H 52 8.696 8.696 8.475 0.221 25109
6979 1 13 . 1 1 53 53 ASP N N 53 116.032 116.032 115.926 0.106 25109
6980 1 13 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.811 -0.265 25109
6981 1 13 . 1 1 53 53 ASP C C 53 178.996 178.996 177.936 1.060 25109
6982 1 13 . 1 1 53 53 ASP CA C 53 56.079 56.079 56.844 -0.765 25109
6983 1 13 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.515 -2.144 25109
6984 1 13 . 1 1 53 53 ASP H H 53 9.036 9.036 8.779 0.257 25109
6985 1 13 . 1 1 54 54 THR N N 54 115.848 115.848 115.929 -0.081 25109
6986 1 13 . 1 1 54 54 THR HA H 54 3.746 3.746 4.296 -0.550 25109
6987 1 13 . 1 1 54 54 THR CA C 54 67.885 67.885 65.832 2.053 25109
6988 1 13 . 1 1 54 54 THR CB C 54 66.953 66.953 68.933 -1.980 25109
6989 1 13 . 1 1 54 54 THR H H 54 7.782 7.782 7.444 0.338 25109
6990 1 13 . 1 1 55 55 LEU N N 55 125.987 125.987 122.251 3.736 25109
6991 1 13 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.022 -0.468 25109
6992 1 13 . 1 1 55 55 LEU C C 55 177.901 177.901 178.422 -0.521 25109
6993 1 13 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.609 -0.156 25109
6994 1 13 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.603 0.260 25109
6995 1 13 . 1 1 55 55 LEU H H 55 8.740 8.740 7.879 0.861 25109
6996 1 13 . 1 1 56 56 TRP N N 56 116.672 116.672 115.011 1.661 25109
6997 1 13 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.553 -0.473 25109
6998 1 13 . 1 1 56 56 TRP C C 56 179.588 179.588 177.485 2.103 25109
6999 1 13 . 1 1 56 56 TRP CA C 56 61.481 61.481 60.407 1.074 25109
7000 1 13 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.297 -0.105 25109
7001 1 13 . 1 1 56 56 TRP H H 56 7.642 7.642 8.128 -0.486 25109
7002 1 13 . 1 1 57 57 HIS N N 57 115.754 115.754 116.595 -0.841 25109
7003 1 13 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.531 -0.255 25109
7004 1 13 . 1 1 57 57 HIS C C 57 177.514 177.514 177.248 0.266 25109
7005 1 13 . 1 1 57 57 HIS CA C 57 58.952 58.952 58.425 0.527 25109
7006 1 13 . 1 1 57 57 HIS CB C 57 28.002 28.002 31.112 -3.110 25109
7007 1 13 . 1 1 57 57 HIS H H 57 7.407 7.407 7.424 -0.017 25109
7008 1 13 . 1 1 58 58 LEU N N 58 123.934 123.934 123.533 0.401 25109
7009 1 13 . 1 1 58 58 LEU HA H 58 3.787 3.787 4.030 -0.243 25109
7010 1 13 . 1 1 58 58 LEU C C 58 178.115 178.115 177.754 0.361 25109
7011 1 13 . 1 1 58 58 LEU CA C 58 58.909 58.909 57.819 1.090 25109
7012 1 13 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.663 -0.848 25109
7013 1 13 . 1 1 58 58 LEU H H 58 8.996 8.996 8.663 0.333 25109
7014 1 13 . 1 1 59 59 PHE N N 59 117.721 117.721 115.737 1.984 25109
7015 1 13 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.938 -0.003 25109
7016 1 13 . 1 1 59 59 PHE C C 59 176.987 176.987 178.331 -1.344 25109
7017 1 13 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.647 -1.534 25109
7018 1 13 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.835 -0.875 25109
7019 1 13 . 1 1 59 59 PHE H H 59 8.201 8.201 8.377 -0.176 25109
7020 1 13 . 1 1 60 60 ASN N N 60 115.695 115.695 114.969 0.726 25109
7021 1 13 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.644 -0.725 25109
7022 1 13 . 1 1 60 60 ASN C C 60 176.670 176.670 176.031 0.639 25109
7023 1 13 . 1 1 60 60 ASN CA C 60 56.756 56.756 54.781 1.975 25109
7024 1 13 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.924 0.394 25109
7025 1 13 . 1 1 60 60 ASN H H 60 7.666 7.666 8.369 -0.703 25109
7026 1 13 . 1 1 61 61 THR N N 61 115.110 115.110 112.415 2.695 25109
7027 1 13 . 1 1 61 61 THR HA H 61 3.733 3.733 4.448 -0.715 25109
7028 1 13 . 1 1 61 61 THR CA C 61 66.319 66.319 64.254 2.065 25109
7029 1 13 . 1 1 61 61 THR CB C 61 69.174 69.174 70.350 -1.176 25109
7030 1 13 . 1 1 61 61 THR H H 61 7.782 7.782 7.924 -0.142 25109
7031 1 13 . 1 1 62 62 LEU N N 62 121.559 121.559 121.185 0.374 25109
7032 1 13 . 1 1 62 62 LEU HA H 62 3.489 3.489 4.276 -0.787 25109
7033 1 13 . 1 1 62 62 LEU C C 62 176.600 176.600 178.242 -1.642 25109
7034 1 13 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.737 0.228 25109
7035 1 13 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.125 2.210 25109
7036 1 13 . 1 1 62 62 LEU H H 62 8.362 8.362 8.223 0.139 25109
7037 1 13 . 1 1 63 63 GLN N N 63 109.150 109.150 116.288 -7.138 25109
7038 1 13 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.418 -1.341 25109
7039 1 13 . 1 1 63 63 GLN C C 63 175.194 175.194 177.007 -1.813 25109
7040 1 13 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.403 -1.137 25109
7041 1 13 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.854 -2.160 25109
7042 1 13 . 1 1 63 63 GLN H H 63 6.458 6.458 7.470 -1.012 25109
7043 1 13 . 1 1 64 64 ARG N N 64 116.029 116.029 117.944 -1.915 25109
7044 1 13 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.082 0.016 25109
7045 1 13 . 1 1 64 64 ARG C C 64 176.459 176.459 176.949 -0.490 25109
7046 1 13 . 1 1 64 64 ARG CA C 64 56.143 56.143 58.148 -2.005 25109
7047 1 13 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.344 0.240 25109
7048 1 13 . 1 1 64 64 ARG H H 64 6.596 6.596 7.536 -0.940 25109
7049 1 13 . 1 1 65 65 ARG N N 65 120.422 120.422 118.889 1.533 25109
7050 1 13 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.783 0.051 25109
7051 1 13 . 1 1 65 65 ARG C C 65 173.436 173.436 174.016 -0.580 25109
7052 1 13 . 1 1 65 65 ARG CA C 65 51.545 51.545 53.196 -1.651 25109
7053 1 13 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.751 -0.755 25109
7054 1 13 . 1 1 65 65 ARG H H 65 7.932 7.932 7.536 0.396 25109
7055 1 13 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.522 0.052 25109
7056 1 13 . 1 1 66 66 PRO CB C 66 32.059 32.059 32.218 -0.159 25109
7057 1 13 . 1 1 67 67 GLY N N 67 111.953 111.953 112.496 -0.543 25109
7058 1 13 . 1 1 67 67 GLY C C 67 177.057 177.057 176.291 0.766 25109
7059 1 13 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.529 0.778 25109
7060 1 13 . 1 1 67 67 GLY H H 67 9.198 9.198 8.481 0.717 25109
7061 1 13 . 1 1 68 68 TRP N N 68 117.467 117.467 118.600 -1.133 25109
7062 1 13 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.493 -0.151 25109
7063 1 13 . 1 1 68 68 TRP C C 68 177.690 177.690 176.495 1.195 25109
7064 1 13 . 1 1 68 68 TRP CA C 68 60.116 60.116 59.556 0.560 25109
7065 1 13 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.087 1.103 25109
7066 1 13 . 1 1 68 68 TRP H H 68 7.647 7.647 7.730 -0.083 25109
7067 1 13 . 1 1 69 69 VAL N N 69 121.482 121.482 121.068 0.414 25109
7068 1 13 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.304 -0.667 25109
7069 1 13 . 1 1 69 69 VAL C C 69 177.993 177.993 178.092 -0.099 25109
7070 1 13 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.600 1.866 25109
7071 1 13 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.077 -0.051 25109
7072 1 13 . 1 1 69 69 VAL H H 69 6.666 6.666 7.274 -0.608 25109
7073 1 13 . 1 1 70 70 GLU N N 70 116.350 116.350 119.331 -2.981 25109
7074 1 13 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.806 0.019 25109
7075 1 13 . 1 1 70 70 GLU C C 70 180.362 180.362 179.188 1.174 25109
7076 1 13 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.519 -0.298 25109
7077 1 13 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.223 -1.918 25109
7078 1 13 . 1 1 70 70 GLU H H 70 7.410 7.410 7.730 -0.320 25109
7079 1 13 . 1 1 71 71 TYR N N 71 116.750 116.750 118.450 -1.700 25109
7080 1 13 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.415 0.035 25109
7081 1 13 . 1 1 71 71 TYR C C 71 178.411 178.411 178.257 0.154 25109
7082 1 13 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.698 0.904 25109
7083 1 13 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.572 -0.216 25109
7084 1 13 . 1 1 71 71 TYR H H 71 7.159 7.159 7.554 -0.395 25109
7085 1 13 . 1 1 72 72 PHE N N 72 121.610 121.610 121.806 -0.196 25109
7086 1 13 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.257 0.245 25109
7087 1 13 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.645 -0.825 25109
7088 1 13 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.234 0.815 25109
7089 1 13 . 1 1 72 72 PHE H H 72 9.007 9.007 8.747 0.260 25109
7090 1 13 . 1 1 73 73 ILE N N 73 119.200 119.200 118.753 0.447 25109
7091 1 13 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.383 -0.203 25109
7092 1 13 . 1 1 73 73 ILE C C 73 177.620 177.620 177.643 -0.023 25109
7093 1 13 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.541 1.655 25109
7094 1 13 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.480 1.543 25109
7095 1 13 . 1 1 73 73 ILE H H 73 8.644 8.644 8.644 -0.000 25109
7096 1 13 . 1 1 74 74 ALA N N 74 119.624 119.624 120.999 -1.375 25109
7097 1 13 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.016 -0.062 25109
7098 1 13 . 1 1 74 74 ALA C C 74 181.030 181.030 179.306 1.724 25109
7099 1 13 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.868 0.543 25109
7100 1 13 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.018 0.118 25109
7101 1 13 . 1 1 74 74 ALA H H 74 7.476 7.476 7.615 -0.139 25109
7102 1 13 . 1 1 75 75 ALA N N 75 123.625 123.625 122.102 1.523 25109
7103 1 13 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.404 0.434 25109
7104 1 13 . 1 1 75 75 ALA C C 75 179.272 179.272 179.337 -0.065 25109
7105 1 13 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.706 0.396 25109
7106 1 13 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.342 1.251 25109
7107 1 13 . 1 1 75 75 ALA H H 75 8.524 8.524 7.665 0.859 25109
7108 1 13 . 1 1 76 76 LEU N N 76 118.114 118.114 119.594 -1.480 25109
7109 1 13 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.000 -0.328 25109
7110 1 13 . 1 1 76 76 LEU C C 76 180.001 180.001 178.965 1.036 25109
7111 1 13 . 1 1 76 76 LEU CA C 76 58.256 58.256 56.534 1.722 25109
7112 1 13 . 1 1 76 76 LEU CB C 76 41.619 41.619 39.952 1.667 25109
7113 1 13 . 1 1 76 76 LEU H H 76 8.153 8.153 7.601 0.552 25109
7114 1 13 . 1 1 77 77 ARG N N 77 117.830 117.830 119.394 -1.564 25109
7115 1 13 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.054 -0.607 25109
7116 1 13 . 1 1 77 77 ARG C C 77 180.889 180.889 179.363 1.526 25109
7117 1 13 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.038 2.029 25109
7118 1 13 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.031 -0.834 25109
7119 1 13 . 1 1 77 77 ARG H H 77 7.945 7.945 7.907 0.038 25109
7120 1 13 . 1 1 78 78 GLY N N 78 110.202 110.202 106.270 3.932 25109
7121 1 13 . 1 1 78 78 GLY C C 78 174.807 174.807 174.615 0.192 25109
7122 1 13 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.141 0.419 25109
7123 1 13 . 1 1 78 78 GLY H H 78 8.269 8.269 8.150 0.119 25109
7124 1 13 . 1 1 79 79 CYS N N 79 115.567 115.567 116.192 -0.625 25109
7125 1 13 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.731 -0.342 25109
7126 1 13 . 1 1 79 79 CYS C C 79 173.025 173.025 174.428 -1.403 25109
7127 1 13 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.022 2.935 25109
7128 1 13 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.078 0.727 25109
7129 1 13 . 1 1 79 79 CYS H H 79 7.132 7.132 7.295 -0.163 25109
7130 1 13 . 1 1 80 80 GLU N N 80 111.759 111.759 116.154 -4.395 25109
7131 1 13 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.966 -0.233 25109
7132 1 13 . 1 1 80 80 GLU C C 80 175.827 175.827 175.134 0.693 25109
7133 1 13 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.921 -0.454 25109
7134 1 13 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.686 -1.970 25109
7135 1 13 . 1 1 80 80 GLU H H 80 7.772 7.772 7.981 -0.209 25109
7136 1 13 . 1 1 81 81 LEU N N 81 124.692 124.692 121.314 3.378 25109
7137 1 13 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.416 0.275 25109
7138 1 13 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.751 -0.796 25109
7139 1 13 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.078 -0.687 25109
7140 1 13 . 1 1 81 81 LEU H H 81 8.167 8.167 8.058 0.109 25109
7141 1 13 . 1 1 82 82 VAL N N 82 118.320 118.320 123.181 -4.861 25109
7142 1 13 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.598 -0.421 25109
7143 1 13 . 1 1 82 82 VAL CA C 82 66.710 66.710 67.127 -0.417 25109
7144 1 13 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.869 0.079 25109
7145 1 13 . 1 1 82 82 VAL H H 82 7.141 7.141 7.518 -0.377 25109
7146 1 13 . 1 1 83 83 ASP N N 83 118.733 118.733 119.089 -0.356 25109
7147 1 13 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.279 0.053 25109
7148 1 13 . 1 1 83 83 ASP C C 83 178.674 178.674 178.435 0.239 25109
7149 1 13 . 1 1 83 83 ASP CA C 83 56.443 56.443 58.077 -1.634 25109
7150 1 13 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.273 -3.444 25109
7151 1 13 . 1 1 83 83 ASP H H 83 8.385 8.385 8.822 -0.437 25109
7152 1 13 . 1 1 84 84 LEU N N 84 121.026 121.026 120.029 0.997 25109
7153 1 13 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.105 -0.126 25109
7154 1 13 . 1 1 84 84 LEU C C 84 178.796 178.796 178.722 0.074 25109
7155 1 13 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.447 0.075 25109
7156 1 13 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.558 0.937 25109
7157 1 13 . 1 1 84 84 LEU H H 84 7.770 7.770 7.550 0.220 25109
7158 1 13 . 1 1 85 85 ALA N N 85 121.525 121.525 121.725 -0.200 25109
7159 1 13 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.787 -0.126 25109
7160 1 13 . 1 1 85 85 ALA C C 85 179.322 179.322 179.072 0.250 25109
7161 1 13 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.186 0.655 25109
7162 1 13 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.119 0.808 25109
7163 1 13 . 1 1 85 85 ALA H H 85 8.126 8.126 7.716 0.410 25109
7164 1 13 . 1 1 86 86 ASP N N 86 115.349 115.349 118.239 -2.890 25109
7165 1 13 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.324 -0.051 25109
7166 1 13 . 1 1 86 86 ASP C C 86 178.463 178.463 178.150 0.313 25109
7167 1 13 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.638 -1.927 25109
7168 1 13 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.102 -3.940 25109
7169 1 13 . 1 1 86 86 ASP H H 86 8.410 8.410 8.548 -0.138 25109
7170 1 13 . 1 1 87 87 GLU N N 87 122.529 122.529 118.904 3.625 25109
7171 1 13 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.243 -0.207 25109
7172 1 13 . 1 1 87 87 GLU C C 87 178.508 178.508 178.906 -0.398 25109
7173 1 13 . 1 1 87 87 GLU CA C 87 59.354 59.354 58.867 0.487 25109
7174 1 13 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.797 -1.524 25109
7175 1 13 . 1 1 87 87 GLU H H 87 8.012 8.012 7.976 0.036 25109
7176 1 13 . 1 1 88 88 VAL N N 88 119.148 119.148 120.818 -1.670 25109
7177 1 13 . 1 1 88 88 VAL HA H 88 3.330 3.330 4.059 -0.729 25109
7178 1 13 . 1 1 88 88 VAL C C 88 177.240 177.240 178.034 -0.794 25109
7179 1 13 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.123 2.126 25109
7180 1 13 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.455 0.074 25109
7181 1 13 . 1 1 88 88 VAL H H 88 8.291 8.291 7.591 0.700 25109
7182 1 13 . 1 1 89 89 ALA N N 89 120.709 120.709 122.582 -1.873 25109
7183 1 13 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.065 -0.150 25109
7184 1 13 . 1 1 89 89 ALA C C 89 180.186 180.186 179.843 0.343 25109
7185 1 13 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.471 0.588 25109
7186 1 13 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.397 -0.162 25109
7187 1 13 . 1 1 89 89 ALA H H 89 8.548 8.548 8.527 0.021 25109
7188 1 13 . 1 1 90 90 SER N N 90 113.035 113.035 114.053 -1.018 25109
7189 1 13 . 1 1 90 90 SER HA H 90 4.047 4.047 4.156 -0.109 25109
7190 1 13 . 1 1 90 90 SER C C 90 177.564 177.564 176.616 0.948 25109
7191 1 13 . 1 1 90 90 SER CA C 90 61.771 61.771 61.342 0.429 25109
7192 1 13 . 1 1 90 90 SER CB C 90 62.907 62.907 63.011 -0.104 25109
7193 1 13 . 1 1 90 90 SER H H 90 7.969 7.969 8.075 -0.106 25109
7194 1 13 . 1 1 91 91 VAL N N 91 123.417 123.417 121.664 1.753 25109
7195 1 13 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.829 -0.482 25109
7196 1 13 . 1 1 91 91 VAL C C 91 178.428 178.428 177.865 0.563 25109
7197 1 13 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.080 1.049 25109
7198 1 13 . 1 1 91 91 VAL CB C 91 31.771 31.771 30.891 0.880 25109
7199 1 13 . 1 1 91 91 VAL H H 91 7.713 7.713 7.463 0.250 25109
7200 1 13 . 1 1 92 92 TYR N N 92 121.458 121.458 120.399 1.059 25109
7201 1 13 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.502 -0.311 25109
7202 1 13 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.297 0.697 25109
7203 1 13 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.174 0.811 25109
7204 1 13 . 1 1 92 92 TYR H H 92 8.395 8.395 7.960 0.435 25109
7205 1 13 . 1 1 93 93 GLN N N 93 115.549 115.549 117.580 -2.031 25109
7206 1 13 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.009 -0.298 25109
7207 1 13 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.349 -0.255 25109
7208 1 13 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.552 -0.254 25109
7209 1 13 . 1 1 93 93 GLN H H 93 8.167 8.167 7.794 0.373 25109
7210 1 13 . 1 1 94 94 SER N N 94 115.923 115.923 112.917 3.006 25109
7211 1 13 . 1 1 94 94 SER HA H 94 4.096 4.096 4.297 -0.201 25109
7212 1 13 . 1 1 94 94 SER CA C 94 60.971 60.971 60.098 0.873 25109
7213 1 13 . 1 1 94 94 SER CB C 94 62.635 62.635 64.452 -1.817 25109
7214 1 13 . 1 1 94 94 SER H H 94 7.642 7.642 7.544 0.098 25109
7215 1 13 . 1 1 95 95 TYR N N 95 119.565 119.565 121.404 -1.839 25109
7216 1 13 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.537 0.222 25109
7217 1 13 . 1 1 95 95 TYR C C 95 175.334 175.334 174.174 1.160 25109
7218 1 13 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.230 0.468 25109
7219 1 13 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.300 2.019 25109
7220 1 13 . 1 1 95 95 TYR H H 95 7.069 7.069 7.799 -0.730 25109
7221 1 13 . 1 1 96 96 GLN N N 96 119.872 119.872 118.933 0.939 25109
7222 1 13 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.919 0.446 25109
7223 1 13 . 1 1 96 96 GLN C C 96 173.612 173.612 174.390 -0.778 25109
7224 1 13 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.811 -1.475 25109
7225 1 13 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.128 1.366 25109
7226 1 13 . 1 1 96 96 GLN H H 96 7.409 7.409 8.340 -0.931 25109
7227 1 13 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.314 0.004 25109
7228 1 13 . 1 1 97 97 PRO CA C 97 63.014 63.014 64.641 -1.627 25109
7229 1 13 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.007 0.091 25109
7230 1 13 . 1 1 98 98 ARG N N 98 121.759 121.759 116.442 5.317 25109
7231 1 13 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.517 -0.175 25109
7232 1 13 . 1 1 98 98 ARG C C 98 176.848 176.848 175.372 1.476 25109
7233 1 13 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.209 1.012 25109
7234 1 13 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.536 0.551 25109
7235 1 13 . 1 1 98 98 ARG H H 98 8.423 8.423 8.025 0.398 25109
7236 1 13 . 1 1 99 99 THR N N 99 115.292 115.292 113.976 1.316 25109
7237 1 13 . 1 1 99 99 THR HA H 99 4.323 4.323 4.017 0.306 25109
7238 1 13 . 1 1 99 99 THR C C 99 174.350 174.350 173.396 0.954 25109
7239 1 13 . 1 1 99 99 THR CA C 99 61.906 61.906 63.000 -1.094 25109
7240 1 13 . 1 1 99 99 THR CB C 99 70.180 70.180 69.015 1.165 25109
7241 1 13 . 1 1 99 99 THR H H 99 8.179 8.179 7.589 0.590 25109
7242 1 14 . 1 1 0 0 SER N N 0 115.693 115.693 115.700 -0.007 25109
7243 1 14 . 1 1 0 0 SER HA H 0 4.531 4.531 4.755 -0.224 25109
7244 1 14 . 1 1 0 0 SER C C 0 174.557 174.557 173.599 0.958 25109
7245 1 14 . 1 1 0 0 SER CA C 0 58.478 58.478 58.445 0.033 25109
7246 1 14 . 1 1 0 0 SER CB C 0 64.380 64.380 64.087 0.293 25109
7247 1 14 . 1 1 0 0 SER H H 0 8.631 8.631 8.637 -0.006 25109
7248 1 14 . 1 1 1 1 MET N N 1 123.111 123.111 121.293 1.818 25109
7249 1 14 . 1 1 1 1 MET HA H 1 4.728 4.728 4.755 -0.027 25109
7250 1 14 . 1 1 1 1 MET C C 1 174.846 174.846 173.797 1.049 25109
7251 1 14 . 1 1 1 1 MET CA C 1 55.655 55.655 52.943 2.712 25109
7252 1 14 . 1 1 1 1 MET CB C 1 32.035 32.035 35.253 -3.218 25109
7253 1 14 . 1 1 1 1 MET H H 1 8.641 8.641 7.591 1.050 25109
7254 1 14 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.687 -0.210 25109
7255 1 14 . 1 1 2 2 PRO CB C 2 32.000 32.000 30.963 1.037 25109
7256 1 14 . 1 1 3 3 PHE N N 3 121.126 121.126 125.283 -4.157 25109
7257 1 14 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.643 -0.277 25109
7258 1 14 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.359 1.503 25109
7259 1 14 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.668 -1.300 25109
7260 1 14 . 1 1 3 3 PHE H H 3 8.177 8.177 9.605 -1.428 25109
7261 1 14 . 1 1 4 4 ALA N N 4 121.170 121.170 122.666 -1.496 25109
7262 1 14 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.077 -0.242 25109
7263 1 14 . 1 1 4 4 ALA C C 4 181.522 181.522 178.824 2.698 25109
7264 1 14 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.602 -0.149 25109
7265 1 14 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.600 0.836 25109
7266 1 14 . 1 1 4 4 ALA H H 4 8.444 8.444 8.818 -0.374 25109
7267 1 14 . 1 1 5 5 GLU N N 5 118.932 118.932 118.315 0.617 25109
7268 1 14 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.928 -0.073 25109
7269 1 14 . 1 1 5 5 GLU C C 5 177.971 177.971 178.243 -0.272 25109
7270 1 14 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.142 0.489 25109
7271 1 14 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.733 0.028 25109
7272 1 14 . 1 1 5 5 GLU H H 5 8.454 8.454 8.794 -0.340 25109
7273 1 14 . 1 1 6 6 ASP N N 6 120.471 120.471 118.737 1.734 25109
7274 1 14 . 1 1 6 6 ASP C C 6 178.885 178.885 178.002 0.883 25109
7275 1 14 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.574 -0.502 25109
7276 1 14 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.707 -1.575 25109
7277 1 14 . 1 1 6 6 ASP H H 6 8.316 8.316 8.479 -0.163 25109
7278 1 14 . 1 1 7 7 LYS N N 7 118.335 118.335 119.018 -0.683 25109
7279 1 14 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.870 -0.180 25109
7280 1 14 . 1 1 7 7 LYS C C 7 180.080 180.080 179.180 0.900 25109
7281 1 14 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.753 -0.033 25109
7282 1 14 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.389 0.405 25109
7283 1 14 . 1 1 7 7 LYS H H 7 8.249 8.249 7.860 0.389 25109
7284 1 14 . 1 1 8 8 THR N N 8 119.222 119.222 117.004 2.218 25109
7285 1 14 . 1 1 8 8 THR HA H 8 3.975 3.975 3.995 -0.020 25109
7286 1 14 . 1 1 8 8 THR CA C 8 68.453 68.453 66.672 1.780 25109
7287 1 14 . 1 1 8 8 THR CB C 8 67.387 67.387 68.691 -1.304 25109
7288 1 14 . 1 1 8 8 THR H H 8 7.897 7.897 7.898 -0.001 25109
7289 1 14 . 1 1 9 9 TYR N N 9 123.054 123.054 123.115 -0.061 25109
7290 1 14 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.198 0.055 25109
7291 1 14 . 1 1 9 9 TYR C C 9 177.441 177.441 178.032 -0.591 25109
7292 1 14 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.288 -0.390 25109
7293 1 14 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.521 -0.672 25109
7294 1 14 . 1 1 9 9 TYR H H 9 8.605 8.605 8.523 0.082 25109
7295 1 14 . 1 1 10 10 LYS N N 10 118.366 118.366 118.508 -0.142 25109
7296 1 14 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.790 -0.196 25109
7297 1 14 . 1 1 10 10 LYS C C 10 178.885 178.885 178.787 0.098 25109
7298 1 14 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.709 1.335 25109
7299 1 14 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.276 -0.231 25109
7300 1 14 . 1 1 10 10 LYS H H 10 8.066 8.066 8.330 -0.264 25109
7301 1 14 . 1 1 11 11 TYR N N 11 120.539 120.539 121.385 -0.846 25109
7302 1 14 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.148 -0.158 25109
7303 1 14 . 1 1 11 11 TYR C C 11 178.233 178.233 178.016 0.217 25109
7304 1 14 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.677 0.851 25109
7305 1 14 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.802 -0.439 25109
7306 1 14 . 1 1 11 11 TYR H H 11 7.875 7.875 7.824 0.051 25109
7307 1 14 . 1 1 12 12 ILE N N 12 121.893 121.893 119.065 2.828 25109
7308 1 14 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.922 -0.826 25109
7309 1 14 . 1 1 12 12 ILE C C 12 177.015 177.015 177.202 -0.187 25109
7310 1 14 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.254 2.509 25109
7311 1 14 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.148 1.404 25109
7312 1 14 . 1 1 12 12 ILE H H 12 8.154 8.154 8.501 -0.347 25109
7313 1 14 . 1 1 13 13 CYS N N 13 113.894 113.894 116.768 -2.874 25109
7314 1 14 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.958 -0.071 25109
7315 1 14 . 1 1 13 13 CYS C C 13 178.288 178.288 175.730 2.558 25109
7316 1 14 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.074 3.263 25109
7317 1 14 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.718 0.286 25109
7318 1 14 . 1 1 13 13 CYS H H 13 7.551 7.551 7.612 -0.061 25109
7319 1 14 . 1 1 14 14 ARG N N 14 119.228 119.228 119.324 -0.096 25109
7320 1 14 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.162 -0.092 25109
7321 1 14 . 1 1 14 14 ARG C C 14 177.127 177.127 177.376 -0.249 25109
7322 1 14 . 1 1 14 14 ARG CA C 14 58.494 58.494 57.947 0.547 25109
7323 1 14 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.518 -0.096 25109
7324 1 14 . 1 1 14 14 ARG H H 14 7.991 7.991 7.802 0.189 25109
7325 1 14 . 1 1 15 15 ASN N N 15 117.367 117.367 116.206 1.161 25109
7326 1 14 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.740 0.229 25109
7327 1 14 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.763 -0.000 25109
7328 1 14 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.746 0.839 25109
7329 1 14 . 1 1 15 15 ASN H H 15 7.643 7.643 7.732 -0.089 25109
7330 1 14 . 1 1 16 16 PHE N N 16 122.356 122.356 121.225 1.131 25109
7331 1 14 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.209 0.007 25109
7332 1 14 . 1 1 16 16 PHE C C 16 178.084 178.084 176.815 1.269 25109
7333 1 14 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.022 2.155 25109
7334 1 14 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.190 1.399 25109
7335 1 14 . 1 1 16 16 PHE H H 16 6.992 6.992 7.405 -0.413 25109
7336 1 14 . 1 1 17 17 SER N N 17 112.937 112.937 113.877 -0.940 25109
7337 1 14 . 1 1 17 17 SER HA H 17 4.199 4.199 4.080 0.119 25109
7338 1 14 . 1 1 17 17 SER C C 17 176.726 176.726 177.049 -0.323 25109
7339 1 14 . 1 1 17 17 SER CA C 17 62.052 62.052 61.555 0.497 25109
7340 1 14 . 1 1 17 17 SER CB C 17 62.552 62.552 62.646 -0.094 25109
7341 1 14 . 1 1 17 17 SER H H 17 8.840 8.840 8.549 0.291 25109
7342 1 14 . 1 1 18 18 ASN N N 18 118.809 118.809 121.510 -2.701 25109
7343 1 14 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.486 -0.128 25109
7344 1 14 . 1 1 18 18 ASN C C 18 175.967 175.967 177.095 -1.128 25109
7345 1 14 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.561 -0.651 25109
7346 1 14 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.614 -0.786 25109
7347 1 14 . 1 1 18 18 ASN H H 18 8.130 8.130 8.335 -0.205 25109
7348 1 14 . 1 1 19 19 PHE N N 19 115.750 115.750 114.984 0.766 25109
7349 1 14 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.537 -0.252 25109
7350 1 14 . 1 1 19 19 PHE C C 19 175.370 175.370 175.524 -0.154 25109
7351 1 14 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.565 0.297 25109
7352 1 14 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.712 1.165 25109
7353 1 14 . 1 1 19 19 PHE H H 19 8.062 8.062 7.395 0.667 25109
7354 1 14 . 1 1 20 20 CYS N N 20 113.958 113.958 118.330 -4.372 25109
7355 1 14 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.294 -0.351 25109
7356 1 14 . 1 1 20 20 CYS C C 20 173.823 173.823 173.857 -0.034 25109
7357 1 14 . 1 1 20 20 CYS CA C 20 61.788 61.788 57.984 3.804 25109
7358 1 14 . 1 1 20 20 CYS CB C 20 27.383 27.383 28.244 -0.861 25109
7359 1 14 . 1 1 20 20 CYS H H 20 6.850 6.850 7.339 -0.489 25109
7360 1 14 . 1 1 21 21 ASN N N 21 116.691 116.691 119.458 -2.767 25109
7361 1 14 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.829 -0.085 25109
7362 1 14 . 1 1 21 21 ASN C C 21 175.299 175.299 173.546 1.753 25109
7363 1 14 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.900 0.390 25109
7364 1 14 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.889 -0.576 25109
7365 1 14 . 1 1 21 21 ASN H H 21 8.251 8.251 7.515 0.736 25109
7366 1 14 . 1 1 22 22 VAL N N 22 122.431 122.431 119.519 2.912 25109
7367 1 14 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.224 -0.674 25109
7368 1 14 . 1 1 22 22 VAL C C 22 174.034 174.034 173.834 0.200 25109
7369 1 14 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.245 3.692 25109
7370 1 14 . 1 1 22 22 VAL CB C 22 31.523 31.523 34.547 -3.024 25109
7371 1 14 . 1 1 22 22 VAL H H 22 7.573 7.573 7.833 -0.260 25109
7372 1 14 . 1 1 23 23 ASP N N 23 127.219 127.219 120.537 6.682 25109
7373 1 14 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.999 -1.813 25109
7374 1 14 . 1 1 23 23 ASP CB C 23 38.793 38.793 42.073 -3.280 25109
7375 1 14 . 1 1 23 23 ASP H H 23 8.687 8.687 8.488 0.199 25109
7376 1 14 . 1 1 24 24 VAL N N 24 127.835 127.835 116.879 10.956 25109
7377 1 14 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.403 -1.110 25109
7378 1 14 . 1 1 24 24 VAL C C 24 176.867 176.867 177.441 -0.574 25109
7379 1 14 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.112 3.051 25109
7380 1 14 . 1 1 24 24 VAL CB C 24 32.015 32.015 34.157 -2.142 25109
7381 1 14 . 1 1 24 24 VAL H H 24 9.409 9.409 8.442 0.967 25109
7382 1 14 . 1 1 25 25 VAL N N 25 114.324 114.324 116.991 -2.667 25109
7383 1 14 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.007 -0.488 25109
7384 1 14 . 1 1 25 25 VAL C C 25 178.006 178.006 177.456 0.550 25109
7385 1 14 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.344 1.344 25109
7386 1 14 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.665 -0.133 25109
7387 1 14 . 1 1 25 25 VAL H H 25 8.038 8.038 7.985 0.053 25109
7388 1 14 . 1 1 26 26 GLU N N 26 117.009 117.009 118.451 -1.442 25109
7389 1 14 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.400 -0.309 25109
7390 1 14 . 1 1 26 26 GLU C C 26 177.303 177.303 176.762 0.541 25109
7391 1 14 . 1 1 26 26 GLU CA C 26 57.432 57.432 57.745 -0.313 25109
7392 1 14 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.859 -0.894 25109
7393 1 14 . 1 1 26 26 GLU H H 26 7.220 7.220 9.138 -1.918 25109
7394 1 14 . 1 1 27 27 ILE N N 27 114.080 114.080 119.224 -5.144 25109
7395 1 14 . 1 1 27 27 ILE HA H 27 4.361 4.361 4.025 0.336 25109
7396 1 14 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.068 -0.336 25109
7397 1 14 . 1 1 27 27 ILE CB C 27 39.591 39.591 39.154 0.437 25109
7398 1 14 . 1 1 27 27 ILE H H 27 7.647 7.647 7.537 0.110 25109
7399 1 14 . 1 1 28 28 LEU N N 28 121.867 121.867 121.648 0.219 25109
7400 1 14 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.161 -0.224 25109
7401 1 14 . 1 1 28 28 LEU C C 28 175.756 175.756 176.225 -0.469 25109
7402 1 14 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.924 -0.957 25109
7403 1 14 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.992 0.521 25109
7404 1 14 . 1 1 28 28 LEU H H 28 7.434 7.434 8.335 -0.901 25109
7405 1 14 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.349 -0.139 25109
7406 1 14 . 1 1 29 29 PRO CB C 29 31.310 31.310 30.789 0.521 25109
7407 1 14 . 1 1 30 30 TYR N N 30 113.832 113.832 116.931 -3.099 25109
7408 1 14 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.607 -0.105 25109
7409 1 14 . 1 1 30 30 TYR C C 30 174.386 174.386 174.952 -0.566 25109
7410 1 14 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.142 -1.448 25109
7411 1 14 . 1 1 30 30 TYR CB C 30 39.099 39.099 40.124 -1.025 25109
7412 1 14 . 1 1 30 30 TYR H H 30 7.628 7.628 7.723 -0.095 25109
7413 1 14 . 1 1 31 31 LEU N N 31 118.331 118.331 119.304 -0.973 25109
7414 1 14 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.820 0.057 25109
7415 1 14 . 1 1 31 31 LEU C C 31 173.849 173.849 175.441 -1.592 25109
7416 1 14 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.651 0.041 25109
7417 1 14 . 1 1 31 31 LEU CB C 31 42.802 42.802 43.349 -0.547 25109
7418 1 14 . 1 1 31 31 LEU H H 31 7.619 7.619 7.671 -0.052 25109
7419 1 14 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.512 -0.157 25109
7420 1 14 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.330 0.080 25109
7421 1 14 . 1 1 33 33 CYS N N 33 110.978 110.978 115.444 -4.466 25109
7422 1 14 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.380 -0.039 25109
7423 1 14 . 1 1 33 33 CYS C C 33 174.139 174.139 174.081 0.058 25109
7424 1 14 . 1 1 33 33 CYS CA C 33 56.212 56.212 57.589 -1.377 25109
7425 1 14 . 1 1 33 33 CYS CB C 33 28.922 28.922 28.074 0.848 25109
7426 1 14 . 1 1 33 33 CYS H H 33 6.414 6.414 7.812 -1.398 25109
7427 1 14 . 1 1 34 34 LEU N N 34 123.111 123.111 120.194 2.917 25109
7428 1 14 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.481 0.125 25109
7429 1 14 . 1 1 34 34 LEU C C 34 176.646 176.646 176.622 0.024 25109
7430 1 14 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.074 -0.183 25109
7431 1 14 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.567 -0.876 25109
7432 1 14 . 1 1 34 34 LEU H H 34 7.550 7.550 7.296 0.254 25109
7433 1 14 . 1 1 35 35 THR N N 35 113.831 113.831 112.161 1.670 25109
7434 1 14 . 1 1 35 35 THR HA H 35 4.205 4.205 4.360 -0.155 25109
7435 1 14 . 1 1 35 35 THR C C 35 175.324 175.324 175.549 -0.225 25109
7436 1 14 . 1 1 35 35 THR CA C 35 61.200 61.200 60.759 0.441 25109
7437 1 14 . 1 1 35 35 THR CB C 35 71.318 71.318 70.222 1.096 25109
7438 1 14 . 1 1 35 35 THR H H 35 8.586 8.586 8.208 0.378 25109
7439 1 14 . 1 1 36 36 ALA N N 36 124.128 124.128 128.934 -4.806 25109
7440 1 14 . 1 1 36 36 ALA HA H 36 3.924 3.924 3.955 -0.031 25109
7441 1 14 . 1 1 36 36 ALA C C 36 180.397 180.397 179.963 0.434 25109
7442 1 14 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.118 0.802 25109
7443 1 14 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.689 -0.886 25109
7444 1 14 . 1 1 36 36 ALA H H 36 8.836 8.836 8.842 -0.006 25109
7445 1 14 . 1 1 37 37 ARG N N 37 116.793 116.793 117.366 -0.573 25109
7446 1 14 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.051 -0.065 25109
7447 1 14 . 1 1 37 37 ARG C C 37 179.272 179.272 178.503 0.769 25109
7448 1 14 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.404 -0.172 25109
7449 1 14 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.808 0.097 25109
7450 1 14 . 1 1 37 37 ARG H H 37 8.060 8.060 8.550 -0.490 25109
7451 1 14 . 1 1 38 38 ASP N N 38 120.030 120.030 119.837 0.193 25109
7452 1 14 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.482 -0.234 25109
7453 1 14 . 1 1 38 38 ASP C C 38 178.885 178.885 178.454 0.431 25109
7454 1 14 . 1 1 38 38 ASP CA C 38 57.187 57.187 56.866 0.321 25109
7455 1 14 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.809 0.124 25109
7456 1 14 . 1 1 38 38 ASP H H 38 7.782 7.782 7.770 0.012 25109
7457 1 14 . 1 1 39 39 GLN N N 39 118.223 118.223 118.142 0.081 25109
7458 1 14 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.026 -0.361 25109
7459 1 14 . 1 1 39 39 GLN C C 39 178.041 178.041 177.881 0.160 25109
7460 1 14 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.671 1.930 25109
7461 1 14 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.752 -0.955 25109
7462 1 14 . 1 1 39 39 GLN H H 39 8.476 8.476 8.040 0.436 25109
7463 1 14 . 1 1 40 40 ASP N N 40 117.908 117.908 120.810 -2.902 25109
7464 1 14 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.338 -0.085 25109
7465 1 14 . 1 1 40 40 ASP C C 40 178.639 178.639 178.484 0.155 25109
7466 1 14 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.620 -1.220 25109
7467 1 14 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.981 -2.953 25109
7468 1 14 . 1 1 40 40 ASP H H 40 8.386 8.386 8.244 0.142 25109
7469 1 14 . 1 1 41 41 ARG N N 41 120.990 120.990 118.970 2.020 25109
7470 1 14 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.099 -0.057 25109
7471 1 14 . 1 1 41 41 ARG C C 41 179.795 179.795 178.965 0.830 25109
7472 1 14 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.270 1.175 25109
7473 1 14 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.678 0.580 25109
7474 1 14 . 1 1 41 41 ARG H H 41 8.130 8.130 7.884 0.246 25109
7475 1 14 . 1 1 42 42 LEU N N 42 121.219 121.219 121.054 0.165 25109
7476 1 14 . 1 1 42 42 LEU HA H 42 3.935 3.935 3.981 -0.046 25109
7477 1 14 . 1 1 42 42 LEU C C 42 178.850 178.850 178.834 0.016 25109
7478 1 14 . 1 1 42 42 LEU CA C 42 58.267 58.267 58.039 0.228 25109
7479 1 14 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.420 0.613 25109
7480 1 14 . 1 1 42 42 LEU H H 42 8.179 8.179 7.520 0.659 25109
7481 1 14 . 1 1 43 43 ARG N N 43 119.310 119.310 119.517 -0.207 25109
7482 1 14 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.926 -0.202 25109
7483 1 14 . 1 1 43 43 ARG C C 43 179.099 179.099 178.312 0.787 25109
7484 1 14 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.636 1.178 25109
7485 1 14 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.171 0.008 25109
7486 1 14 . 1 1 43 43 ARG H H 43 8.296 8.296 8.630 -0.334 25109
7487 1 14 . 1 1 44 44 ALA N N 44 121.305 121.305 121.513 -0.208 25109
7488 1 14 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.088 0.015 25109
7489 1 14 . 1 1 44 44 ALA C C 44 180.924 180.924 179.701 1.223 25109
7490 1 14 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.484 -0.259 25109
7491 1 14 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.046 0.051 25109
7492 1 14 . 1 1 44 44 ALA H H 44 7.774 7.774 8.502 -0.728 25109
7493 1 14 . 1 1 45 45 THR N N 45 115.017 115.017 115.815 -0.798 25109
7494 1 14 . 1 1 45 45 THR HA H 45 3.879 3.879 4.016 -0.137 25109
7495 1 14 . 1 1 45 45 THR CA C 45 66.327 66.327 66.575 -0.248 25109
7496 1 14 . 1 1 45 45 THR CB C 45 68.809 68.809 68.391 0.418 25109
7497 1 14 . 1 1 45 45 THR H H 45 8.167 8.167 8.291 -0.124 25109
7498 1 14 . 1 1 46 46 CYS N N 46 123.609 123.609 120.821 2.788 25109
7499 1 14 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.615 -0.596 25109
7500 1 14 . 1 1 46 46 CYS C C 46 178.077 178.077 176.503 1.574 25109
7501 1 14 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.876 1.069 25109
7502 1 14 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.411 -0.272 25109
7503 1 14 . 1 1 46 46 CYS H H 46 8.084 8.084 8.560 -0.476 25109
7504 1 14 . 1 1 47 47 THR N N 47 115.520 115.520 115.223 0.297 25109
7505 1 14 . 1 1 47 47 THR HA H 47 3.915 3.915 4.238 -0.323 25109
7506 1 14 . 1 1 47 47 THR CA C 47 66.063 66.063 65.668 0.396 25109
7507 1 14 . 1 1 47 47 THR CB C 47 69.245 69.245 69.038 0.207 25109
7508 1 14 . 1 1 47 47 THR H H 47 7.735 7.735 7.635 0.100 25109
7509 1 14 . 1 1 48 48 LEU N N 48 120.099 120.099 120.867 -0.768 25109
7510 1 14 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.185 0.041 25109
7511 1 14 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.303 0.260 25109
7512 1 14 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.253 1.372 25109
7513 1 14 . 1 1 48 48 LEU H H 48 7.464 7.464 8.227 -0.763 25109
7514 1 14 . 1 1 49 49 SER N N 49 111.979 111.979 111.990 -0.011 25109
7515 1 14 . 1 1 49 49 SER HA H 49 4.661 4.661 4.538 0.123 25109
7516 1 14 . 1 1 49 49 SER C C 49 175.581 175.581 175.329 0.252 25109
7517 1 14 . 1 1 49 49 SER CA C 49 59.590 59.590 59.477 0.113 25109
7518 1 14 . 1 1 49 49 SER CB C 49 65.335 65.335 65.346 -0.011 25109
7519 1 14 . 1 1 49 49 SER H H 49 8.781 8.781 8.377 0.404 25109
7520 1 14 . 1 1 50 50 GLY N N 50 110.194 110.194 107.792 2.402 25109
7521 1 14 . 1 1 50 50 GLY C C 50 175.123 175.123 172.793 2.330 25109
7522 1 14 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.872 0.030 25109
7523 1 14 . 1 1 50 50 GLY H H 50 7.955 7.955 7.645 0.310 25109
7524 1 14 . 1 1 51 51 ASN N N 51 121.050 121.050 119.695 1.355 25109
7525 1 14 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.643 -0.393 25109
7526 1 14 . 1 1 51 51 ASN C C 51 176.403 176.403 177.113 -0.710 25109
7527 1 14 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.687 3.616 25109
7528 1 14 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.433 3.166 25109
7529 1 14 . 1 1 51 51 ASN H H 51 8.898 8.898 8.790 0.108 25109
7530 1 14 . 1 1 52 52 ARG N N 52 119.825 119.825 121.124 -1.299 25109
7531 1 14 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.041 -0.003 25109
7532 1 14 . 1 1 52 52 ARG C C 52 178.850 178.850 177.332 1.518 25109
7533 1 14 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.978 1.086 25109
7534 1 14 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.636 0.387 25109
7535 1 14 . 1 1 52 52 ARG H H 52 8.696 8.696 8.568 0.128 25109
7536 1 14 . 1 1 53 53 ASP N N 53 116.032 116.032 116.262 -0.230 25109
7537 1 14 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.617 -0.071 25109
7538 1 14 . 1 1 53 53 ASP C C 53 178.996 178.996 177.982 1.014 25109
7539 1 14 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.520 -1.441 25109
7540 1 14 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.193 -1.822 25109
7541 1 14 . 1 1 53 53 ASP H H 53 9.036 9.036 8.741 0.295 25109
7542 1 14 . 1 1 54 54 THR N N 54 115.848 115.848 117.411 -1.563 25109
7543 1 14 . 1 1 54 54 THR HA H 54 3.746 3.746 4.389 -0.643 25109
7544 1 14 . 1 1 54 54 THR CA C 54 67.885 67.885 66.450 1.435 25109
7545 1 14 . 1 1 54 54 THR CB C 54 66.953 66.953 68.803 -1.850 25109
7546 1 14 . 1 1 54 54 THR H H 54 7.782 7.782 7.458 0.324 25109
7547 1 14 . 1 1 55 55 LEU N N 55 125.987 125.987 121.628 4.359 25109
7548 1 14 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.164 -0.610 25109
7549 1 14 . 1 1 55 55 LEU C C 55 177.901 177.901 178.876 -0.975 25109
7550 1 14 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.834 -0.381 25109
7551 1 14 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.454 0.409 25109
7552 1 14 . 1 1 55 55 LEU H H 55 8.740 8.740 8.808 -0.068 25109
7553 1 14 . 1 1 56 56 TRP N N 56 116.672 116.672 119.895 -3.223 25109
7554 1 14 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.506 -0.426 25109
7555 1 14 . 1 1 56 56 TRP C C 56 179.588 179.588 178.360 1.228 25109
7556 1 14 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.176 0.305 25109
7557 1 14 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.337 -0.145 25109
7558 1 14 . 1 1 56 56 TRP H H 56 7.642 7.642 7.788 -0.146 25109
7559 1 14 . 1 1 57 57 HIS N N 57 115.754 115.754 116.629 -0.875 25109
7560 1 14 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.320 -0.044 25109
7561 1 14 . 1 1 57 57 HIS C C 57 177.514 177.514 177.740 -0.226 25109
7562 1 14 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.384 -0.432 25109
7563 1 14 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.048 -2.046 25109
7564 1 14 . 1 1 57 57 HIS H H 57 7.407 7.407 7.479 -0.072 25109
7565 1 14 . 1 1 58 58 LEU N N 58 123.934 123.934 123.220 0.714 25109
7566 1 14 . 1 1 58 58 LEU HA H 58 3.787 3.787 4.003 -0.216 25109
7567 1 14 . 1 1 58 58 LEU C C 58 178.115 178.115 178.297 -0.182 25109
7568 1 14 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.079 0.830 25109
7569 1 14 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.608 -0.793 25109
7570 1 14 . 1 1 58 58 LEU H H 58 8.996 8.996 8.542 0.454 25109
7571 1 14 . 1 1 59 59 PHE N N 59 117.721 117.721 116.181 1.540 25109
7572 1 14 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.739 0.196 25109
7573 1 14 . 1 1 59 59 PHE C C 59 176.987 176.987 177.846 -0.859 25109
7574 1 14 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.177 -2.064 25109
7575 1 14 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.060 -1.100 25109
7576 1 14 . 1 1 59 59 PHE H H 59 8.201 8.201 8.503 -0.302 25109
7577 1 14 . 1 1 60 60 ASN N N 60 115.695 115.695 117.732 -2.037 25109
7578 1 14 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.120 -0.201 25109
7579 1 14 . 1 1 60 60 ASN C C 60 176.670 176.670 176.698 -0.028 25109
7580 1 14 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.096 0.660 25109
7581 1 14 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.459 0.859 25109
7582 1 14 . 1 1 60 60 ASN H H 60 7.666 7.666 7.636 0.030 25109
7583 1 14 . 1 1 61 61 THR N N 61 115.110 115.110 113.883 1.227 25109
7584 1 14 . 1 1 61 61 THR HA H 61 3.733 3.733 3.997 -0.264 25109
7585 1 14 . 1 1 61 61 THR CA C 61 66.319 66.319 65.123 1.196 25109
7586 1 14 . 1 1 61 61 THR CB C 61 69.174 69.174 69.044 0.130 25109
7587 1 14 . 1 1 61 61 THR H H 61 7.782 7.782 7.981 -0.199 25109
7588 1 14 . 1 1 62 62 LEU N N 62 121.559 121.559 123.037 -1.478 25109
7589 1 14 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.825 -0.336 25109
7590 1 14 . 1 1 62 62 LEU C C 62 176.600 176.600 178.248 -1.648 25109
7591 1 14 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.121 -0.156 25109
7592 1 14 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.888 1.447 25109
7593 1 14 . 1 1 62 62 LEU H H 62 8.362 8.362 8.229 0.133 25109
7594 1 14 . 1 1 63 63 GLN N N 63 109.150 109.150 114.923 -5.773 25109
7595 1 14 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.635 -1.558 25109
7596 1 14 . 1 1 63 63 GLN C C 63 175.194 175.194 176.918 -1.724 25109
7597 1 14 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.359 -1.093 25109
7598 1 14 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.811 -2.117 25109
7599 1 14 . 1 1 63 63 GLN H H 63 6.458 6.458 7.309 -0.851 25109
7600 1 14 . 1 1 64 64 ARG N N 64 116.029 116.029 118.026 -1.997 25109
7601 1 14 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.251 -0.153 25109
7602 1 14 . 1 1 64 64 ARG C C 64 176.459 176.459 176.500 -0.041 25109
7603 1 14 . 1 1 64 64 ARG CA C 64 56.143 56.143 56.289 -0.146 25109
7604 1 14 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.884 -0.300 25109
7605 1 14 . 1 1 64 64 ARG H H 64 6.596 6.596 7.140 -0.544 25109
7606 1 14 . 1 1 65 65 ARG N N 65 120.422 120.422 120.535 -0.113 25109
7607 1 14 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.747 0.087 25109
7608 1 14 . 1 1 65 65 ARG C C 65 173.436 173.436 174.337 -0.901 25109
7609 1 14 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.315 -0.770 25109
7610 1 14 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.276 -0.280 25109
7611 1 14 . 1 1 65 65 ARG H H 65 7.932 7.932 7.709 0.223 25109
7612 1 14 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.389 0.185 25109
7613 1 14 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.084 0.975 25109
7614 1 14 . 1 1 67 67 GLY N N 67 111.953 111.953 113.768 -1.815 25109
7615 1 14 . 1 1 67 67 GLY C C 67 177.057 177.057 174.866 2.191 25109
7616 1 14 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.811 1.496 25109
7617 1 14 . 1 1 67 67 GLY H H 67 9.198 9.198 8.146 1.052 25109
7618 1 14 . 1 1 68 68 TRP N N 68 117.467 117.467 118.334 -0.867 25109
7619 1 14 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.072 -0.730 25109
7620 1 14 . 1 1 68 68 TRP C C 68 177.690 177.690 175.999 1.691 25109
7621 1 14 . 1 1 68 68 TRP CA C 68 60.116 60.116 57.397 2.719 25109
7622 1 14 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.186 0.004 25109
7623 1 14 . 1 1 68 68 TRP H H 68 7.647 7.647 8.204 -0.557 25109
7624 1 14 . 1 1 69 69 VAL N N 69 121.482 121.482 119.559 1.923 25109
7625 1 14 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.163 -0.526 25109
7626 1 14 . 1 1 69 69 VAL C C 69 177.993 177.993 177.532 0.461 25109
7627 1 14 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.679 1.787 25109
7628 1 14 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.005 0.021 25109
7629 1 14 . 1 1 69 69 VAL H H 69 6.666 6.666 7.465 -0.799 25109
7630 1 14 . 1 1 70 70 GLU N N 70 116.350 116.350 118.711 -2.361 25109
7631 1 14 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.859 -0.034 25109
7632 1 14 . 1 1 70 70 GLU C C 70 180.362 180.362 178.980 1.382 25109
7633 1 14 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.505 -0.284 25109
7634 1 14 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.068 -1.763 25109
7635 1 14 . 1 1 70 70 GLU H H 70 7.410 7.410 8.611 -1.201 25109
7636 1 14 . 1 1 71 71 TYR N N 71 116.750 116.750 118.072 -1.322 25109
7637 1 14 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.399 0.051 25109
7638 1 14 . 1 1 71 71 TYR C C 71 178.411 178.411 178.025 0.386 25109
7639 1 14 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.581 1.021 25109
7640 1 14 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.628 -0.273 25109
7641 1 14 . 1 1 71 71 TYR H H 71 7.159 7.159 7.424 -0.265 25109
7642 1 14 . 1 1 72 72 PHE N N 72 121.610 121.610 121.817 -0.207 25109
7643 1 14 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.237 0.265 25109
7644 1 14 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.473 -0.653 25109
7645 1 14 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.185 0.864 25109
7646 1 14 . 1 1 72 72 PHE H H 72 9.007 9.007 8.464 0.543 25109
7647 1 14 . 1 1 73 73 ILE N N 73 119.200 119.200 118.828 0.372 25109
7648 1 14 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.418 -0.238 25109
7649 1 14 . 1 1 73 73 ILE C C 73 177.620 177.620 177.545 0.075 25109
7650 1 14 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.456 1.741 25109
7651 1 14 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.486 1.537 25109
7652 1 14 . 1 1 73 73 ILE H H 73 8.644 8.644 8.705 -0.061 25109
7653 1 14 . 1 1 74 74 ALA N N 74 119.624 119.624 121.156 -1.532 25109
7654 1 14 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.034 -0.080 25109
7655 1 14 . 1 1 74 74 ALA C C 74 181.030 181.030 179.285 1.745 25109
7656 1 14 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.837 0.574 25109
7657 1 14 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.818 0.318 25109
7658 1 14 . 1 1 74 74 ALA H H 74 7.476 7.476 7.572 -0.096 25109
7659 1 14 . 1 1 75 75 ALA N N 75 123.625 123.625 122.882 0.743 25109
7660 1 14 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.786 0.052 25109
7661 1 14 . 1 1 75 75 ALA C C 75 179.272 179.272 179.503 -0.231 25109
7662 1 14 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.720 0.382 25109
7663 1 14 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.344 1.249 25109
7664 1 14 . 1 1 75 75 ALA H H 75 8.524 8.524 7.585 0.939 25109
7665 1 14 . 1 1 76 76 LEU N N 76 118.114 118.114 120.193 -2.079 25109
7666 1 14 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.067 -0.395 25109
7667 1 14 . 1 1 76 76 LEU C C 76 180.001 180.001 179.154 0.847 25109
7668 1 14 . 1 1 76 76 LEU CA C 76 58.256 58.256 56.662 1.594 25109
7669 1 14 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.089 1.530 25109
7670 1 14 . 1 1 76 76 LEU H H 76 8.153 8.153 7.553 0.600 25109
7671 1 14 . 1 1 77 77 ARG N N 77 117.830 117.830 119.639 -1.809 25109
7672 1 14 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.969 -0.522 25109
7673 1 14 . 1 1 77 77 ARG C C 77 180.889 180.889 179.420 1.469 25109
7674 1 14 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.096 1.970 25109
7675 1 14 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.611 -0.414 25109
7676 1 14 . 1 1 77 77 ARG H H 77 7.945 7.945 8.502 -0.557 25109
7677 1 14 . 1 1 78 78 GLY N N 78 110.202 110.202 108.074 2.128 25109
7678 1 14 . 1 1 78 78 GLY C C 78 174.807 174.807 175.471 -0.664 25109
7679 1 14 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.602 -0.042 25109
7680 1 14 . 1 1 78 78 GLY H H 78 8.269 8.269 8.323 -0.054 25109
7681 1 14 . 1 1 79 79 CYS N N 79 115.567 115.567 117.519 -1.952 25109
7682 1 14 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.411 -0.022 25109
7683 1 14 . 1 1 79 79 CYS C C 79 173.025 173.025 174.863 -1.838 25109
7684 1 14 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.703 2.254 25109
7685 1 14 . 1 1 79 79 CYS CB C 79 27.805 27.805 28.078 -0.273 25109
7686 1 14 . 1 1 79 79 CYS H H 79 7.132 7.132 7.554 -0.422 25109
7687 1 14 . 1 1 80 80 GLU N N 80 111.759 111.759 115.977 -4.218 25109
7688 1 14 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.928 -0.195 25109
7689 1 14 . 1 1 80 80 GLU C C 80 175.827 175.827 175.274 0.553 25109
7690 1 14 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.408 0.059 25109
7691 1 14 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.992 -2.275 25109
7692 1 14 . 1 1 80 80 GLU H H 80 7.772 7.772 7.957 -0.185 25109
7693 1 14 . 1 1 81 81 LEU N N 81 124.692 124.692 121.037 3.655 25109
7694 1 14 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.467 0.224 25109
7695 1 14 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.878 -0.923 25109
7696 1 14 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.242 -0.852 25109
7697 1 14 . 1 1 81 81 LEU H H 81 8.167 8.167 8.421 -0.254 25109
7698 1 14 . 1 1 82 82 VAL N N 82 118.320 118.320 123.124 -4.804 25109
7699 1 14 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.512 -0.335 25109
7700 1 14 . 1 1 82 82 VAL CA C 82 66.710 66.710 67.514 -0.804 25109
7701 1 14 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.865 0.083 25109
7702 1 14 . 1 1 82 82 VAL H H 82 7.141 7.141 7.535 -0.394 25109
7703 1 14 . 1 1 83 83 ASP N N 83 118.733 118.733 118.406 0.327 25109
7704 1 14 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.390 -0.058 25109
7705 1 14 . 1 1 83 83 ASP C C 83 178.674 178.674 178.502 0.172 25109
7706 1 14 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.475 -1.032 25109
7707 1 14 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.325 -3.496 25109
7708 1 14 . 1 1 83 83 ASP H H 83 8.385 8.385 8.834 -0.449 25109
7709 1 14 . 1 1 84 84 LEU N N 84 121.026 121.026 120.997 0.029 25109
7710 1 14 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.168 -0.189 25109
7711 1 14 . 1 1 84 84 LEU C C 84 178.796 178.796 178.877 -0.081 25109
7712 1 14 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.647 -0.125 25109
7713 1 14 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.830 0.665 25109
7714 1 14 . 1 1 84 84 LEU H H 84 7.770 7.770 7.700 0.070 25109
7715 1 14 . 1 1 85 85 ALA N N 85 121.525 121.525 122.463 -0.938 25109
7716 1 14 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.879 -0.218 25109
7717 1 14 . 1 1 85 85 ALA C C 85 179.322 179.322 179.162 0.160 25109
7718 1 14 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.320 0.521 25109
7719 1 14 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.064 0.863 25109
7720 1 14 . 1 1 85 85 ALA H H 85 8.126 8.126 8.360 -0.234 25109
7721 1 14 . 1 1 86 86 ASP N N 86 115.349 115.349 118.297 -2.948 25109
7722 1 14 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.313 -0.040 25109
7723 1 14 . 1 1 86 86 ASP C C 86 178.463 178.463 178.301 0.162 25109
7724 1 14 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.684 -1.973 25109
7725 1 14 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.070 -3.908 25109
7726 1 14 . 1 1 86 86 ASP H H 86 8.410 8.410 8.497 -0.087 25109
7727 1 14 . 1 1 87 87 GLU N N 87 122.529 122.529 120.078 2.451 25109
7728 1 14 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.045 -0.009 25109
7729 1 14 . 1 1 87 87 GLU C C 87 178.508 178.508 178.965 -0.457 25109
7730 1 14 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.520 -0.166 25109
7731 1 14 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.874 -1.601 25109
7732 1 14 . 1 1 87 87 GLU H H 87 8.012 8.012 7.686 0.326 25109
7733 1 14 . 1 1 88 88 VAL N N 88 119.148 119.148 120.534 -1.386 25109
7734 1 14 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.692 -0.362 25109
7735 1 14 . 1 1 88 88 VAL C C 88 177.240 177.240 177.947 -0.707 25109
7736 1 14 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.238 1.011 25109
7737 1 14 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.688 -0.159 25109
7738 1 14 . 1 1 88 88 VAL H H 88 8.291 8.291 7.884 0.407 25109
7739 1 14 . 1 1 89 89 ALA N N 89 120.709 120.709 121.536 -0.827 25109
7740 1 14 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.032 -0.117 25109
7741 1 14 . 1 1 89 89 ALA C C 89 180.186 180.186 179.627 0.559 25109
7742 1 14 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.376 0.683 25109
7743 1 14 . 1 1 89 89 ALA CB C 89 18.235 18.235 17.970 0.265 25109
7744 1 14 . 1 1 89 89 ALA H H 89 8.548 8.548 8.490 0.058 25109
7745 1 14 . 1 1 90 90 SER N N 90 113.035 113.035 114.377 -1.342 25109
7746 1 14 . 1 1 90 90 SER HA H 90 4.047 4.047 4.576 -0.529 25109
7747 1 14 . 1 1 90 90 SER C C 90 177.564 177.564 176.482 1.082 25109
7748 1 14 . 1 1 90 90 SER CA C 90 61.771 61.771 61.223 0.548 25109
7749 1 14 . 1 1 90 90 SER CB C 90 62.907 62.907 63.370 -0.463 25109
7750 1 14 . 1 1 90 90 SER H H 90 7.969 7.969 7.939 0.030 25109
7751 1 14 . 1 1 91 91 VAL N N 91 123.417 123.417 120.446 2.971 25109
7752 1 14 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.748 -0.401 25109
7753 1 14 . 1 1 91 91 VAL C C 91 178.428 178.428 178.329 0.099 25109
7754 1 14 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.741 0.388 25109
7755 1 14 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.471 0.299 25109
7756 1 14 . 1 1 91 91 VAL H H 91 7.713 7.713 7.711 0.002 25109
7757 1 14 . 1 1 92 92 TYR N N 92 121.458 121.458 120.701 0.757 25109
7758 1 14 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.355 -0.164 25109
7759 1 14 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.396 0.598 25109
7760 1 14 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.519 0.466 25109
7761 1 14 . 1 1 92 92 TYR H H 92 8.395 8.395 8.501 -0.106 25109
7762 1 14 . 1 1 93 93 GLN N N 93 115.549 115.549 116.621 -1.072 25109
7763 1 14 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.019 -0.308 25109
7764 1 14 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.577 0.517 25109
7765 1 14 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.164 0.134 25109
7766 1 14 . 1 1 93 93 GLN H H 93 8.167 8.167 7.976 0.191 25109
7767 1 14 . 1 1 94 94 SER N N 94 115.923 115.923 114.687 1.236 25109
7768 1 14 . 1 1 94 94 SER HA H 94 4.096 4.096 4.274 -0.178 25109
7769 1 14 . 1 1 94 94 SER CA C 94 60.971 60.971 58.178 2.793 25109
7770 1 14 . 1 1 94 94 SER CB C 94 62.635 62.635 63.938 -1.303 25109
7771 1 14 . 1 1 94 94 SER H H 94 7.642 7.642 7.695 -0.053 25109
7772 1 14 . 1 1 95 95 TYR N N 95 119.565 119.565 120.950 -1.385 25109
7773 1 14 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.604 0.155 25109
7774 1 14 . 1 1 95 95 TYR C C 95 175.334 175.334 173.951 1.383 25109
7775 1 14 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.640 1.058 25109
7776 1 14 . 1 1 95 95 TYR CB C 95 39.319 39.319 38.931 0.388 25109
7777 1 14 . 1 1 95 95 TYR H H 95 7.069 7.069 7.076 -0.007 25109
7778 1 14 . 1 1 96 96 GLN N N 96 119.872 119.872 119.707 0.165 25109
7779 1 14 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.032 0.333 25109
7780 1 14 . 1 1 96 96 GLN C C 96 173.612 173.612 173.730 -0.118 25109
7781 1 14 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.913 -1.577 25109
7782 1 14 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.605 0.889 25109
7783 1 14 . 1 1 96 96 GLN H H 96 7.409 7.409 8.491 -1.082 25109
7784 1 14 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.138 0.180 25109
7785 1 14 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.767 -0.752 25109
7786 1 14 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.172 -0.074 25109
7787 1 14 . 1 1 98 98 ARG N N 98 121.759 121.759 115.976 5.783 25109
7788 1 14 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.602 -0.260 25109
7789 1 14 . 1 1 98 98 ARG C C 98 176.848 176.848 174.693 2.155 25109
7790 1 14 . 1 1 98 98 ARG CA C 98 56.221 56.221 53.521 2.700 25109
7791 1 14 . 1 1 98 98 ARG CB C 98 31.087 31.087 32.339 -1.252 25109
7792 1 14 . 1 1 98 98 ARG H H 98 8.423 8.423 7.222 1.201 25109
7793 1 14 . 1 1 99 99 THR N N 99 115.292 115.292 118.620 -3.328 25109
7794 1 14 . 1 1 99 99 THR HA H 99 4.323 4.323 4.354 -0.031 25109
7795 1 14 . 1 1 99 99 THR C C 99 174.350 174.350 174.269 0.081 25109
7796 1 14 . 1 1 99 99 THR CA C 99 61.906 61.906 64.470 -2.564 25109
7797 1 14 . 1 1 99 99 THR CB C 99 70.180 70.180 69.066 1.114 25109
7798 1 14 . 1 1 99 99 THR H H 99 8.179 8.179 8.378 -0.199 25109
7799 1 15 . 1 1 0 0 SER N N 0 115.693 115.693 118.912 -3.219 25109
7800 1 15 . 1 1 0 0 SER HA H 0 4.531 4.531 4.564 -0.033 25109
7801 1 15 . 1 1 0 0 SER C C 0 174.557 174.557 174.712 -0.155 25109
7802 1 15 . 1 1 0 0 SER CA C 0 58.478 58.478 59.747 -1.269 25109
7803 1 15 . 1 1 0 0 SER CB C 0 64.380 64.380 64.007 0.373 25109
7804 1 15 . 1 1 0 0 SER H H 0 8.631 8.631 8.775 -0.144 25109
7805 1 15 . 1 1 1 1 MET N N 1 123.111 123.111 121.015 2.096 25109
7806 1 15 . 1 1 1 1 MET HA H 1 4.728 4.728 4.804 -0.076 25109
7807 1 15 . 1 1 1 1 MET C C 1 174.846 174.846 173.421 1.425 25109
7808 1 15 . 1 1 1 1 MET CA C 1 55.655 55.655 53.538 2.117 25109
7809 1 15 . 1 1 1 1 MET CB C 1 32.035 32.035 34.299 -2.264 25109
7810 1 15 . 1 1 1 1 MET H H 1 8.641 8.641 7.866 0.775 25109
7811 1 15 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.771 -0.294 25109
7812 1 15 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.275 0.725 25109
7813 1 15 . 1 1 3 3 PHE N N 3 121.126 121.126 125.796 -4.670 25109
7814 1 15 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.602 -0.236 25109
7815 1 15 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.132 1.730 25109
7816 1 15 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.544 -1.176 25109
7817 1 15 . 1 1 3 3 PHE H H 3 8.177 8.177 9.605 -1.428 25109
7818 1 15 . 1 1 4 4 ALA N N 4 121.170 121.170 122.980 -1.810 25109
7819 1 15 . 1 1 4 4 ALA HA H 4 3.835 3.835 3.709 0.126 25109
7820 1 15 . 1 1 4 4 ALA C C 4 181.522 181.522 178.620 2.902 25109
7821 1 15 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.698 -0.244 25109
7822 1 15 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.391 1.045 25109
7823 1 15 . 1 1 4 4 ALA H H 4 8.444 8.444 8.934 -0.490 25109
7824 1 15 . 1 1 5 5 GLU N N 5 118.932 118.932 117.756 1.176 25109
7825 1 15 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.969 -0.114 25109
7826 1 15 . 1 1 5 5 GLU C C 5 177.971 177.971 178.184 -0.213 25109
7827 1 15 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.150 0.481 25109
7828 1 15 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.863 -0.102 25109
7829 1 15 . 1 1 5 5 GLU H H 5 8.454 8.454 8.653 -0.199 25109
7830 1 15 . 1 1 6 6 ASP N N 6 120.471 120.471 119.210 1.261 25109
7831 1 15 . 1 1 6 6 ASP C C 6 178.885 178.885 178.101 0.784 25109
7832 1 15 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.325 -0.253 25109
7833 1 15 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.767 -1.635 25109
7834 1 15 . 1 1 6 6 ASP H H 6 8.316 8.316 8.113 0.203 25109
7835 1 15 . 1 1 7 7 LYS N N 7 118.335 118.335 119.025 -0.690 25109
7836 1 15 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.758 -0.068 25109
7837 1 15 . 1 1 7 7 LYS C C 7 180.080 180.080 179.038 1.042 25109
7838 1 15 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.769 -0.049 25109
7839 1 15 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.132 0.662 25109
7840 1 15 . 1 1 7 7 LYS H H 7 8.249 8.249 8.173 0.076 25109
7841 1 15 . 1 1 8 8 THR N N 8 119.222 119.222 117.093 2.129 25109
7842 1 15 . 1 1 8 8 THR HA H 8 3.975 3.975 4.046 -0.071 25109
7843 1 15 . 1 1 8 8 THR CA C 8 68.453 68.453 66.900 1.553 25109
7844 1 15 . 1 1 8 8 THR CB C 8 67.387 67.387 68.825 -1.438 25109
7845 1 15 . 1 1 8 8 THR H H 8 7.897 7.897 7.856 0.041 25109
7846 1 15 . 1 1 9 9 TYR N N 9 123.054 123.054 122.619 0.435 25109
7847 1 15 . 1 1 9 9 TYR HA H 9 4.253 4.253 3.986 0.267 25109
7848 1 15 . 1 1 9 9 TYR C C 9 177.441 177.441 177.535 -0.094 25109
7849 1 15 . 1 1 9 9 TYR CA C 9 61.898 61.898 61.997 -0.099 25109
7850 1 15 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.321 -0.472 25109
7851 1 15 . 1 1 9 9 TYR H H 9 8.605 8.605 8.015 0.590 25109
7852 1 15 . 1 1 10 10 LYS N N 10 118.366 118.366 118.222 0.144 25109
7853 1 15 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.724 -0.131 25109
7854 1 15 . 1 1 10 10 LYS C C 10 178.885 178.885 178.618 0.267 25109
7855 1 15 . 1 1 10 10 LYS CA C 10 60.044 60.044 59.279 0.765 25109
7856 1 15 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.211 -0.166 25109
7857 1 15 . 1 1 10 10 LYS H H 10 8.066 8.066 8.014 0.052 25109
7858 1 15 . 1 1 11 11 TYR N N 11 120.539 120.539 119.654 0.885 25109
7859 1 15 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.194 -0.204 25109
7860 1 15 . 1 1 11 11 TYR C C 11 178.233 178.233 177.920 0.313 25109
7861 1 15 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.575 0.953 25109
7862 1 15 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.054 -0.691 25109
7863 1 15 . 1 1 11 11 TYR H H 11 7.875 7.875 7.770 0.105 25109
7864 1 15 . 1 1 12 12 ILE N N 12 121.893 121.893 119.076 2.817 25109
7865 1 15 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.844 -0.748 25109
7866 1 15 . 1 1 12 12 ILE C C 12 177.015 177.015 178.005 -0.990 25109
7867 1 15 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.201 2.562 25109
7868 1 15 . 1 1 12 12 ILE CB C 12 37.552 37.552 35.764 1.788 25109
7869 1 15 . 1 1 12 12 ILE H H 12 8.154 8.154 8.516 -0.362 25109
7870 1 15 . 1 1 13 13 CYS N N 13 113.894 113.894 117.893 -3.999 25109
7871 1 15 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.930 -0.043 25109
7872 1 15 . 1 1 13 13 CYS C C 13 178.288 178.288 176.434 1.854 25109
7873 1 15 . 1 1 13 13 CYS CA C 13 64.337 64.337 62.532 1.805 25109
7874 1 15 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.741 0.265 25109
7875 1 15 . 1 1 13 13 CYS H H 13 7.551 7.551 7.547 0.004 25109
7876 1 15 . 1 1 14 14 ARG N N 14 119.228 119.228 120.285 -1.057 25109
7877 1 15 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.277 -0.207 25109
7878 1 15 . 1 1 14 14 ARG C C 14 177.127 177.127 175.969 1.158 25109
7879 1 15 . 1 1 14 14 ARG CA C 14 58.494 58.494 57.611 0.883 25109
7880 1 15 . 1 1 14 14 ARG CB C 14 30.422 30.422 29.878 0.544 25109
7881 1 15 . 1 1 14 14 ARG H H 14 7.991 7.991 7.937 0.054 25109
7882 1 15 . 1 1 15 15 ASN N N 15 117.367 117.367 115.111 2.256 25109
7883 1 15 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.935 0.034 25109
7884 1 15 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.400 0.363 25109
7885 1 15 . 1 1 15 15 ASN CB C 15 38.585 38.585 39.301 -0.716 25109
7886 1 15 . 1 1 15 15 ASN H H 15 7.643 7.643 7.934 -0.291 25109
7887 1 15 . 1 1 16 16 PHE N N 16 122.356 122.356 122.860 -0.504 25109
7888 1 15 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.211 0.005 25109
7889 1 15 . 1 1 16 16 PHE C C 16 178.084 178.084 177.009 1.075 25109
7890 1 15 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.835 1.342 25109
7891 1 15 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.429 1.160 25109
7892 1 15 . 1 1 16 16 PHE H H 16 6.992 6.992 7.402 -0.410 25109
7893 1 15 . 1 1 17 17 SER N N 17 112.937 112.937 114.004 -1.067 25109
7894 1 15 . 1 1 17 17 SER HA H 17 4.199 4.199 4.060 0.139 25109
7895 1 15 . 1 1 17 17 SER C C 17 176.726 176.726 176.737 -0.011 25109
7896 1 15 . 1 1 17 17 SER CA C 17 62.052 62.052 61.050 1.002 25109
7897 1 15 . 1 1 17 17 SER CB C 17 62.552 62.552 62.948 -0.396 25109
7898 1 15 . 1 1 17 17 SER H H 17 8.840 8.840 8.718 0.122 25109
7899 1 15 . 1 1 18 18 ASN N N 18 118.809 118.809 121.905 -3.096 25109
7900 1 15 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.583 -0.225 25109
7901 1 15 . 1 1 18 18 ASN C C 18 175.967 175.967 177.416 -1.449 25109
7902 1 15 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.525 -0.615 25109
7903 1 15 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.172 -0.344 25109
7904 1 15 . 1 1 18 18 ASN H H 18 8.130 8.130 8.011 0.119 25109
7905 1 15 . 1 1 19 19 PHE N N 19 115.750 115.750 119.456 -3.706 25109
7906 1 15 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.567 -0.282 25109
7907 1 15 . 1 1 19 19 PHE C C 19 175.370 175.370 176.866 -1.496 25109
7908 1 15 . 1 1 19 19 PHE CA C 19 58.862 58.862 60.165 -1.303 25109
7909 1 15 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.921 0.957 25109
7910 1 15 . 1 1 19 19 PHE H H 19 8.062 8.062 7.937 0.125 25109
7911 1 15 . 1 1 20 20 CYS N N 20 113.958 113.958 116.315 -2.357 25109
7912 1 15 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.227 -0.284 25109
7913 1 15 . 1 1 20 20 CYS C C 20 173.823 173.823 174.979 -1.156 25109
7914 1 15 . 1 1 20 20 CYS CA C 20 61.788 61.788 60.136 1.651 25109
7915 1 15 . 1 1 20 20 CYS CB C 20 27.383 27.383 26.455 0.928 25109
7916 1 15 . 1 1 20 20 CYS H H 20 6.850 6.850 7.561 -0.711 25109
7917 1 15 . 1 1 21 21 ASN N N 21 116.691 116.691 117.678 -0.987 25109
7918 1 15 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.601 0.143 25109
7919 1 15 . 1 1 21 21 ASN C C 21 175.299 175.299 175.318 -0.019 25109
7920 1 15 . 1 1 21 21 ASN CA C 21 53.290 53.290 54.102 -0.812 25109
7921 1 15 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.628 -1.315 25109
7922 1 15 . 1 1 21 21 ASN H H 21 8.251 8.251 7.494 0.757 25109
7923 1 15 . 1 1 22 22 VAL N N 22 122.431 122.431 119.603 2.828 25109
7924 1 15 . 1 1 22 22 VAL HA H 22 3.550 3.550 3.993 -0.443 25109
7925 1 15 . 1 1 22 22 VAL C C 22 174.034 174.034 174.073 -0.039 25109
7926 1 15 . 1 1 22 22 VAL CA C 22 63.937 63.937 61.897 2.040 25109
7927 1 15 . 1 1 22 22 VAL CB C 22 31.523 31.523 32.866 -1.343 25109
7928 1 15 . 1 1 22 22 VAL H H 22 7.573 7.573 7.427 0.146 25109
7929 1 15 . 1 1 23 23 ASP N N 23 127.219 127.219 124.840 2.379 25109
7930 1 15 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.422 -1.236 25109
7931 1 15 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.335 -2.542 25109
7932 1 15 . 1 1 23 23 ASP H H 23 8.687 8.687 8.566 0.121 25109
7933 1 15 . 1 1 24 24 VAL N N 24 127.835 127.835 123.776 4.059 25109
7934 1 15 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.971 -0.678 25109
7935 1 15 . 1 1 24 24 VAL C C 24 176.867 176.867 177.336 -0.469 25109
7936 1 15 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.839 3.324 25109
7937 1 15 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.168 -0.153 25109
7938 1 15 . 1 1 24 24 VAL H H 24 9.409 9.409 8.695 0.714 25109
7939 1 15 . 1 1 25 25 VAL N N 25 114.324 114.324 113.839 0.485 25109
7940 1 15 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.967 -0.448 25109
7941 1 15 . 1 1 25 25 VAL C C 25 178.006 178.006 176.680 1.326 25109
7942 1 15 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.003 1.685 25109
7943 1 15 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.817 -0.285 25109
7944 1 15 . 1 1 25 25 VAL H H 25 8.038 8.038 7.879 0.159 25109
7945 1 15 . 1 1 26 26 GLU N N 26 117.009 117.009 117.788 -0.779 25109
7946 1 15 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.302 -0.211 25109
7947 1 15 . 1 1 26 26 GLU C C 26 177.303 177.303 177.164 0.139 25109
7948 1 15 . 1 1 26 26 GLU CA C 26 57.432 57.432 57.625 -0.193 25109
7949 1 15 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.838 -0.873 25109
7950 1 15 . 1 1 26 26 GLU H H 26 7.220 7.220 8.027 -0.807 25109
7951 1 15 . 1 1 27 27 ILE N N 27 114.080 114.080 118.338 -4.258 25109
7952 1 15 . 1 1 27 27 ILE HA H 27 4.361 4.361 4.080 0.281 25109
7953 1 15 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.150 -0.418 25109
7954 1 15 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.764 0.827 25109
7955 1 15 . 1 1 27 27 ILE H H 27 7.647 7.647 7.275 0.372 25109
7956 1 15 . 1 1 28 28 LEU N N 28 121.867 121.867 121.518 0.349 25109
7957 1 15 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.450 -0.513 25109
7958 1 15 . 1 1 28 28 LEU C C 28 175.756 175.756 177.248 -1.492 25109
7959 1 15 . 1 1 28 28 LEU CA C 28 59.967 59.967 59.893 0.074 25109
7960 1 15 . 1 1 28 28 LEU CB C 28 39.513 39.513 39.132 0.381 25109
7961 1 15 . 1 1 28 28 LEU H H 28 7.434 7.434 7.535 -0.101 25109
7962 1 15 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.321 -0.111 25109
7963 1 15 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.050 0.260 25109
7964 1 15 . 1 1 30 30 TYR N N 30 113.832 113.832 116.806 -2.974 25109
7965 1 15 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.543 -0.041 25109
7966 1 15 . 1 1 30 30 TYR C C 30 174.386 174.386 175.016 -0.630 25109
7967 1 15 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.801 -2.107 25109
7968 1 15 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.483 -0.384 25109
7969 1 15 . 1 1 30 30 TYR H H 30 7.628 7.628 7.798 -0.170 25109
7970 1 15 . 1 1 31 31 LEU N N 31 118.331 118.331 119.228 -0.897 25109
7971 1 15 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.869 0.008 25109
7972 1 15 . 1 1 31 31 LEU C C 31 173.849 173.849 175.312 -1.463 25109
7973 1 15 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.999 -0.307 25109
7974 1 15 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.086 0.716 25109
7975 1 15 . 1 1 31 31 LEU H H 31 7.619 7.619 7.361 0.258 25109
7976 1 15 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.690 -0.335 25109
7977 1 15 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.701 -0.291 25109
7978 1 15 . 1 1 33 33 CYS N N 33 110.978 110.978 113.795 -2.817 25109
7979 1 15 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.251 0.090 25109
7980 1 15 . 1 1 33 33 CYS C C 33 174.139 174.139 174.537 -0.398 25109
7981 1 15 . 1 1 33 33 CYS CA C 33 56.212 56.212 57.840 -1.627 25109
7982 1 15 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.413 1.509 25109
7983 1 15 . 1 1 33 33 CYS H H 33 6.414 6.414 7.391 -0.977 25109
7984 1 15 . 1 1 34 34 LEU N N 34 123.111 123.111 122.697 0.414 25109
7985 1 15 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.437 0.169 25109
7986 1 15 . 1 1 34 34 LEU C C 34 176.646 176.646 176.337 0.309 25109
7987 1 15 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.841 0.050 25109
7988 1 15 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.514 -0.823 25109
7989 1 15 . 1 1 34 34 LEU H H 34 7.550 7.550 7.194 0.356 25109
7990 1 15 . 1 1 35 35 THR N N 35 113.831 113.831 115.425 -1.594 25109
7991 1 15 . 1 1 35 35 THR HA H 35 4.205 4.205 4.221 -0.016 25109
7992 1 15 . 1 1 35 35 THR C C 35 175.324 175.324 175.871 -0.547 25109
7993 1 15 . 1 1 35 35 THR CA C 35 61.200 61.200 61.891 -0.691 25109
7994 1 15 . 1 1 35 35 THR CB C 35 71.318 71.318 69.527 1.791 25109
7995 1 15 . 1 1 35 35 THR H H 35 8.586 8.586 8.061 0.525 25109
7996 1 15 . 1 1 36 36 ALA N N 36 124.128 124.128 127.528 -3.400 25109
7997 1 15 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.005 -0.081 25109
7998 1 15 . 1 1 36 36 ALA C C 36 180.397 180.397 179.803 0.594 25109
7999 1 15 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.574 0.346 25109
8000 1 15 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.573 -0.770 25109
8001 1 15 . 1 1 36 36 ALA H H 36 8.836 8.836 8.717 0.119 25109
8002 1 15 . 1 1 37 37 ARG N N 37 116.793 116.793 118.949 -2.156 25109
8003 1 15 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.165 -0.179 25109
8004 1 15 . 1 1 37 37 ARG C C 37 179.272 179.272 177.883 1.389 25109
8005 1 15 . 1 1 37 37 ARG CA C 37 59.232 59.232 58.523 0.709 25109
8006 1 15 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.021 0.884 25109
8007 1 15 . 1 1 37 37 ARG H H 37 8.060 8.060 8.680 -0.620 25109
8008 1 15 . 1 1 38 38 ASP N N 38 120.030 120.030 117.610 2.420 25109
8009 1 15 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.382 -0.134 25109
8010 1 15 . 1 1 38 38 ASP C C 38 178.885 178.885 178.059 0.826 25109
8011 1 15 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.744 -0.557 25109
8012 1 15 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.210 0.723 25109
8013 1 15 . 1 1 38 38 ASP H H 38 7.782 7.782 8.507 -0.725 25109
8014 1 15 . 1 1 39 39 GLN N N 39 118.223 118.223 117.244 0.979 25109
8015 1 15 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.245 -0.580 25109
8016 1 15 . 1 1 39 39 GLN C C 39 178.041 178.041 178.164 -0.123 25109
8017 1 15 . 1 1 39 39 GLN CA C 39 60.601 60.601 57.901 2.700 25109
8018 1 15 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.919 -1.123 25109
8019 1 15 . 1 1 39 39 GLN H H 39 8.476 8.476 7.550 0.926 25109
8020 1 15 . 1 1 40 40 ASP N N 40 117.908 117.908 121.120 -3.212 25109
8021 1 15 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.360 -0.107 25109
8022 1 15 . 1 1 40 40 ASP C C 40 178.639 178.639 178.318 0.321 25109
8023 1 15 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.392 -0.992 25109
8024 1 15 . 1 1 40 40 ASP CB C 40 38.028 38.028 41.032 -3.004 25109
8025 1 15 . 1 1 40 40 ASP H H 40 8.386 8.386 8.488 -0.102 25109
8026 1 15 . 1 1 41 41 ARG N N 41 120.990 120.990 119.466 1.524 25109
8027 1 15 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.093 -0.051 25109
8028 1 15 . 1 1 41 41 ARG C C 41 179.795 179.795 178.473 1.322 25109
8029 1 15 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.307 0.138 25109
8030 1 15 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.203 0.055 25109
8031 1 15 . 1 1 41 41 ARG H H 41 8.130 8.130 8.229 -0.099 25109
8032 1 15 . 1 1 42 42 LEU N N 42 121.219 121.219 119.266 1.953 25109
8033 1 15 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.107 -0.172 25109
8034 1 15 . 1 1 42 42 LEU C C 42 178.850 178.850 179.245 -0.395 25109
8035 1 15 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.713 0.554 25109
8036 1 15 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.566 0.467 25109
8037 1 15 . 1 1 42 42 LEU H H 42 8.179 8.179 7.775 0.404 25109
8038 1 15 . 1 1 43 43 ARG N N 43 119.310 119.310 120.482 -1.172 25109
8039 1 15 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.988 -0.264 25109
8040 1 15 . 1 1 43 43 ARG C C 43 179.099 179.099 178.205 0.894 25109
8041 1 15 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.232 1.582 25109
8042 1 15 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.142 0.037 25109
8043 1 15 . 1 1 43 43 ARG H H 43 8.296 8.296 7.858 0.438 25109
8044 1 15 . 1 1 44 44 ALA N N 44 121.305 121.305 120.377 0.928 25109
8045 1 15 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.138 -0.035 25109
8046 1 15 . 1 1 44 44 ALA C C 44 180.924 180.924 180.198 0.726 25109
8047 1 15 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.017 0.208 25109
8048 1 15 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.130 -0.034 25109
8049 1 15 . 1 1 44 44 ALA H H 44 7.774 7.774 8.017 -0.242 25109
8050 1 15 . 1 1 45 45 THR N N 45 115.017 115.017 116.160 -1.143 25109
8051 1 15 . 1 1 45 45 THR HA H 45 3.879 3.879 4.061 -0.182 25109
8052 1 15 . 1 1 45 45 THR CA C 45 66.327 66.327 66.332 -0.005 25109
8053 1 15 . 1 1 45 45 THR CB C 45 68.809 68.809 68.195 0.614 25109
8054 1 15 . 1 1 45 45 THR H H 45 8.167 8.167 8.026 0.141 25109
8055 1 15 . 1 1 46 46 CYS N N 46 123.609 123.609 118.814 4.795 25109
8056 1 15 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.656 -0.637 25109
8057 1 15 . 1 1 46 46 CYS C C 46 178.077 178.077 175.746 2.331 25109
8058 1 15 . 1 1 46 46 CYS CA C 46 62.945 62.945 63.048 -0.103 25109
8059 1 15 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.287 -1.148 25109
8060 1 15 . 1 1 46 46 CYS H H 46 8.084 8.084 8.091 -0.007 25109
8061 1 15 . 1 1 47 47 THR N N 47 115.520 115.520 113.380 2.140 25109
8062 1 15 . 1 1 47 47 THR HA H 47 3.915 3.915 4.285 -0.370 25109
8063 1 15 . 1 1 47 47 THR CA C 47 66.063 66.063 63.009 3.054 25109
8064 1 15 . 1 1 47 47 THR CB C 47 69.245 69.245 68.291 0.954 25109
8065 1 15 . 1 1 47 47 THR H H 47 7.735 7.735 7.442 0.293 25109
8066 1 15 . 1 1 48 48 LEU N N 48 120.099 120.099 120.516 -0.417 25109
8067 1 15 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.374 -0.148 25109
8068 1 15 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.722 0.841 25109
8069 1 15 . 1 1 48 48 LEU CB C 48 43.625 43.625 43.219 0.406 25109
8070 1 15 . 1 1 48 48 LEU H H 48 7.464 7.464 7.573 -0.109 25109
8071 1 15 . 1 1 49 49 SER N N 49 111.979 111.979 112.886 -0.907 25109
8072 1 15 . 1 1 49 49 SER HA H 49 4.661 4.661 4.486 0.175 25109
8073 1 15 . 1 1 49 49 SER C C 49 175.581 175.581 174.392 1.189 25109
8074 1 15 . 1 1 49 49 SER CA C 49 59.590 59.590 59.664 -0.074 25109
8075 1 15 . 1 1 49 49 SER CB C 49 65.335 65.335 64.490 0.845 25109
8076 1 15 . 1 1 49 49 SER H H 49 8.781 8.781 8.363 0.418 25109
8077 1 15 . 1 1 50 50 GLY N N 50 110.194 110.194 107.487 2.707 25109
8078 1 15 . 1 1 50 50 GLY C C 50 175.123 175.123 172.945 2.178 25109
8079 1 15 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.713 0.189 25109
8080 1 15 . 1 1 50 50 GLY H H 50 7.955 7.955 7.428 0.527 25109
8081 1 15 . 1 1 51 51 ASN N N 51 121.050 121.050 119.239 1.811 25109
8082 1 15 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.624 -0.374 25109
8083 1 15 . 1 1 51 51 ASN C C 51 176.403 176.403 177.022 -0.619 25109
8084 1 15 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.346 3.958 25109
8085 1 15 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.420 3.179 25109
8086 1 15 . 1 1 51 51 ASN H H 51 8.898 8.898 8.724 0.174 25109
8087 1 15 . 1 1 52 52 ARG N N 52 119.825 119.825 121.936 -2.111 25109
8088 1 15 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.961 0.077 25109
8089 1 15 . 1 1 52 52 ARG C C 52 178.850 178.850 177.693 1.157 25109
8090 1 15 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.343 0.721 25109
8091 1 15 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.636 0.387 25109
8092 1 15 . 1 1 52 52 ARG H H 52 8.696 8.696 8.544 0.152 25109
8093 1 15 . 1 1 53 53 ASP N N 53 116.032 116.032 116.518 -0.486 25109
8094 1 15 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.664 -0.118 25109
8095 1 15 . 1 1 53 53 ASP C C 53 178.996 178.996 178.044 0.952 25109
8096 1 15 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.479 -1.400 25109
8097 1 15 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.129 -1.758 25109
8098 1 15 . 1 1 53 53 ASP H H 53 9.036 9.036 8.767 0.269 25109
8099 1 15 . 1 1 54 54 THR N N 54 115.848 115.848 116.955 -1.107 25109
8100 1 15 . 1 1 54 54 THR HA H 54 3.746 3.746 4.066 -0.320 25109
8101 1 15 . 1 1 54 54 THR CA C 54 67.885 67.885 65.998 1.887 25109
8102 1 15 . 1 1 54 54 THR CB C 54 66.953 66.953 68.642 -1.689 25109
8103 1 15 . 1 1 54 54 THR H H 54 7.782 7.782 7.690 0.092 25109
8104 1 15 . 1 1 55 55 LEU N N 55 125.987 125.987 124.258 1.729 25109
8105 1 15 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.140 -0.586 25109
8106 1 15 . 1 1 55 55 LEU C C 55 177.901 177.901 177.956 -0.055 25109
8107 1 15 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.554 -0.101 25109
8108 1 15 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.797 0.066 25109
8109 1 15 . 1 1 55 55 LEU H H 55 8.740 8.740 8.597 0.143 25109
8110 1 15 . 1 1 56 56 TRP N N 56 116.672 116.672 120.472 -3.800 25109
8111 1 15 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.566 -0.486 25109
8112 1 15 . 1 1 56 56 TRP C C 56 179.588 179.588 178.246 1.342 25109
8113 1 15 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.814 -0.333 25109
8114 1 15 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.450 -0.258 25109
8115 1 15 . 1 1 56 56 TRP H H 56 7.642 7.642 8.047 -0.405 25109
8116 1 15 . 1 1 57 57 HIS N N 57 115.754 115.754 117.994 -2.240 25109
8117 1 15 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.245 0.031 25109
8118 1 15 . 1 1 57 57 HIS C C 57 177.514 177.514 177.851 -0.337 25109
8119 1 15 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.653 -0.701 25109
8120 1 15 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.198 -2.196 25109
8121 1 15 . 1 1 57 57 HIS H H 57 7.407 7.407 8.376 -0.969 25109
8122 1 15 . 1 1 58 58 LEU N N 58 123.934 123.934 122.236 1.698 25109
8123 1 15 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.901 -0.114 25109
8124 1 15 . 1 1 58 58 LEU C C 58 178.115 178.115 177.750 0.365 25109
8125 1 15 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.300 0.609 25109
8126 1 15 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.465 -0.650 25109
8127 1 15 . 1 1 58 58 LEU H H 58 8.996 8.996 8.622 0.374 25109
8128 1 15 . 1 1 59 59 PHE N N 59 117.721 117.721 116.891 0.830 25109
8129 1 15 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.560 0.375 25109
8130 1 15 . 1 1 59 59 PHE C C 59 176.987 176.987 177.847 -0.860 25109
8131 1 15 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.035 -1.923 25109
8132 1 15 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.633 -0.673 25109
8133 1 15 . 1 1 59 59 PHE H H 59 8.201 8.201 7.959 0.242 25109
8134 1 15 . 1 1 60 60 ASN N N 60 115.695 115.695 117.413 -1.718 25109
8135 1 15 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.169 -0.250 25109
8136 1 15 . 1 1 60 60 ASN C C 60 176.670 176.670 177.227 -0.557 25109
8137 1 15 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.066 0.689 25109
8138 1 15 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.696 0.622 25109
8139 1 15 . 1 1 60 60 ASN H H 60 7.666 7.666 8.311 -0.645 25109
8140 1 15 . 1 1 61 61 THR N N 61 115.110 115.110 116.602 -1.492 25109
8141 1 15 . 1 1 61 61 THR HA H 61 3.733 3.733 4.068 -0.335 25109
8142 1 15 . 1 1 61 61 THR CA C 61 66.319 66.319 66.217 0.102 25109
8143 1 15 . 1 1 61 61 THR CB C 61 69.174 69.174 68.888 0.286 25109
8144 1 15 . 1 1 61 61 THR H H 61 7.782 7.782 7.861 -0.079 25109
8145 1 15 . 1 1 62 62 LEU N N 62 121.559 121.559 122.349 -0.790 25109
8146 1 15 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.902 -0.413 25109
8147 1 15 . 1 1 62 62 LEU C C 62 176.600 176.600 178.140 -1.540 25109
8148 1 15 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.204 -0.239 25109
8149 1 15 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.736 1.599 25109
8150 1 15 . 1 1 62 62 LEU H H 62 8.362 8.362 8.405 -0.043 25109
8151 1 15 . 1 1 63 63 GLN N N 63 109.150 109.150 115.216 -6.066 25109
8152 1 15 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.823 -1.746 25109
8153 1 15 . 1 1 63 63 GLN C C 63 175.194 175.194 176.755 -1.561 25109
8154 1 15 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.490 -1.224 25109
8155 1 15 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.914 -2.220 25109
8156 1 15 . 1 1 63 63 GLN H H 63 6.458 6.458 7.674 -1.216 25109
8157 1 15 . 1 1 64 64 ARG N N 64 116.029 116.029 117.775 -1.746 25109
8158 1 15 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.297 -0.199 25109
8159 1 15 . 1 1 64 64 ARG C C 64 176.459 176.459 175.892 0.567 25109
8160 1 15 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.559 0.584 25109
8161 1 15 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.026 0.558 25109
8162 1 15 . 1 1 64 64 ARG H H 64 6.596 6.596 7.251 -0.655 25109
8163 1 15 . 1 1 65 65 ARG N N 65 120.422 120.422 119.705 0.717 25109
8164 1 15 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.795 0.039 25109
8165 1 15 . 1 1 65 65 ARG C C 65 173.436 173.436 174.407 -0.971 25109
8166 1 15 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.541 -0.997 25109
8167 1 15 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.657 -1.661 25109
8168 1 15 . 1 1 65 65 ARG H H 65 7.932 7.932 7.660 0.272 25109
8169 1 15 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.565 0.009 25109
8170 1 15 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.875 0.184 25109
8171 1 15 . 1 1 67 67 GLY N N 67 111.953 111.953 107.616 4.337 25109
8172 1 15 . 1 1 67 67 GLY C C 67 177.057 177.057 173.454 3.603 25109
8173 1 15 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.861 0.446 25109
8174 1 15 . 1 1 67 67 GLY H H 67 9.198 9.198 7.975 1.223 25109
8175 1 15 . 1 1 68 68 TRP N N 68 117.467 117.467 125.146 -7.679 25109
8176 1 15 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.254 -0.912 25109
8177 1 15 . 1 1 68 68 TRP C C 68 177.690 177.690 175.932 1.758 25109
8178 1 15 . 1 1 68 68 TRP CA C 68 60.116 60.116 57.630 2.486 25109
8179 1 15 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.165 0.025 25109
8180 1 15 . 1 1 68 68 TRP H H 68 7.647 7.647 8.178 -0.531 25109
8181 1 15 . 1 1 69 69 VAL N N 69 121.482 121.482 122.377 -0.895 25109
8182 1 15 . 1 1 69 69 VAL HA H 69 2.637 2.637 2.882 -0.245 25109
8183 1 15 . 1 1 69 69 VAL C C 69 177.993 177.993 177.309 0.684 25109
8184 1 15 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.747 0.719 25109
8185 1 15 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.738 -0.712 25109
8186 1 15 . 1 1 69 69 VAL H H 69 6.666 6.666 7.496 -0.830 25109
8187 1 15 . 1 1 70 70 GLU N N 70 116.350 116.350 118.161 -1.811 25109
8188 1 15 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.882 -0.057 25109
8189 1 15 . 1 1 70 70 GLU C C 70 180.362 180.362 178.894 1.468 25109
8190 1 15 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.332 -0.111 25109
8191 1 15 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.916 -1.611 25109
8192 1 15 . 1 1 70 70 GLU H H 70 7.410 7.410 8.488 -1.078 25109
8193 1 15 . 1 1 71 71 TYR N N 71 116.750 116.750 118.702 -1.952 25109
8194 1 15 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.341 0.109 25109
8195 1 15 . 1 1 71 71 TYR C C 71 178.411 178.411 178.239 0.172 25109
8196 1 15 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.830 0.772 25109
8197 1 15 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.546 -0.191 25109
8198 1 15 . 1 1 71 71 TYR H H 71 7.159 7.159 7.425 -0.266 25109
8199 1 15 . 1 1 72 72 PHE N N 72 121.610 121.610 121.114 0.496 25109
8200 1 15 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.289 0.213 25109
8201 1 15 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.424 -0.604 25109
8202 1 15 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.321 0.728 25109
8203 1 15 . 1 1 72 72 PHE H H 72 9.007 9.007 8.618 0.389 25109
8204 1 15 . 1 1 73 73 ILE N N 73 119.200 119.200 118.793 0.407 25109
8205 1 15 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.492 -0.312 25109
8206 1 15 . 1 1 73 73 ILE C C 73 177.620 177.620 177.550 0.070 25109
8207 1 15 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.507 1.690 25109
8208 1 15 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.502 1.521 25109
8209 1 15 . 1 1 73 73 ILE H H 73 8.644 8.644 8.265 0.379 25109
8210 1 15 . 1 1 74 74 ALA N N 74 119.624 119.624 120.578 -0.954 25109
8211 1 15 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.004 -0.050 25109
8212 1 15 . 1 1 74 74 ALA C C 74 181.030 181.030 179.010 2.020 25109
8213 1 15 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.910 0.501 25109
8214 1 15 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.985 0.151 25109
8215 1 15 . 1 1 74 74 ALA H H 74 7.476 7.476 7.715 -0.239 25109
8216 1 15 . 1 1 75 75 ALA N N 75 123.625 123.625 122.025 1.600 25109
8217 1 15 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.660 0.178 25109
8218 1 15 . 1 1 75 75 ALA C C 75 179.272 179.272 179.408 -0.136 25109
8219 1 15 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.577 0.525 25109
8220 1 15 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.265 1.328 25109
8221 1 15 . 1 1 75 75 ALA H H 75 8.524 8.524 7.212 1.312 25109
8222 1 15 . 1 1 76 76 LEU N N 76 118.114 118.114 120.028 -1.914 25109
8223 1 15 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.992 -0.320 25109
8224 1 15 . 1 1 76 76 LEU C C 76 180.001 180.001 178.879 1.122 25109
8225 1 15 . 1 1 76 76 LEU CA C 76 58.256 58.256 56.639 1.617 25109
8226 1 15 . 1 1 76 76 LEU CB C 76 41.619 41.619 39.954 1.665 25109
8227 1 15 . 1 1 76 76 LEU H H 76 8.153 8.153 7.476 0.677 25109
8228 1 15 . 1 1 77 77 ARG N N 77 117.830 117.830 119.537 -1.707 25109
8229 1 15 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.962 -0.515 25109
8230 1 15 . 1 1 77 77 ARG C C 77 180.889 180.889 179.252 1.637 25109
8231 1 15 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.329 1.737 25109
8232 1 15 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.909 -0.712 25109
8233 1 15 . 1 1 77 77 ARG H H 77 7.945 7.945 7.754 0.191 25109
8234 1 15 . 1 1 78 78 GLY N N 78 110.202 110.202 107.379 2.823 25109
8235 1 15 . 1 1 78 78 GLY C C 78 174.807 174.807 174.802 0.005 25109
8236 1 15 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.020 0.540 25109
8237 1 15 . 1 1 78 78 GLY H H 78 8.269 8.269 8.203 0.066 25109
8238 1 15 . 1 1 79 79 CYS N N 79 115.567 115.567 117.799 -2.232 25109
8239 1 15 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.643 -0.254 25109
8240 1 15 . 1 1 79 79 CYS C C 79 173.025 173.025 174.533 -1.508 25109
8241 1 15 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.092 2.865 25109
8242 1 15 . 1 1 79 79 CYS CB C 79 27.805 27.805 28.433 -0.628 25109
8243 1 15 . 1 1 79 79 CYS H H 79 7.132 7.132 7.127 0.005 25109
8244 1 15 . 1 1 80 80 GLU N N 80 111.759 111.759 116.711 -4.952 25109
8245 1 15 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.973 -0.240 25109
8246 1 15 . 1 1 80 80 GLU C C 80 175.827 175.827 175.442 0.385 25109
8247 1 15 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.732 -0.265 25109
8248 1 15 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.245 -2.528 25109
8249 1 15 . 1 1 80 80 GLU H H 80 7.772 7.772 7.962 -0.190 25109
8250 1 15 . 1 1 81 81 LEU N N 81 124.692 124.692 121.454 3.238 25109
8251 1 15 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.456 0.235 25109
8252 1 15 . 1 1 81 81 LEU CA C 81 52.955 52.955 54.036 -1.081 25109
8253 1 15 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.274 -0.883 25109
8254 1 15 . 1 1 81 81 LEU H H 81 8.167 8.167 7.944 0.223 25109
8255 1 15 . 1 1 82 82 VAL N N 82 118.320 118.320 122.051 -3.731 25109
8256 1 15 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.623 -0.446 25109
8257 1 15 . 1 1 82 82 VAL CA C 82 66.710 66.710 65.932 0.778 25109
8258 1 15 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.377 0.571 25109
8259 1 15 . 1 1 82 82 VAL H H 82 7.141 7.141 7.583 -0.442 25109
8260 1 15 . 1 1 83 83 ASP N N 83 118.733 118.733 119.553 -0.820 25109
8261 1 15 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.331 0.001 25109
8262 1 15 . 1 1 83 83 ASP C C 83 178.674 178.674 178.077 0.597 25109
8263 1 15 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.011 -0.568 25109
8264 1 15 . 1 1 83 83 ASP CB C 83 36.829 36.829 39.958 -3.129 25109
8265 1 15 . 1 1 83 83 ASP H H 83 8.385 8.385 8.660 -0.275 25109
8266 1 15 . 1 1 84 84 LEU N N 84 121.026 121.026 120.435 0.591 25109
8267 1 15 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.884 0.095 25109
8268 1 15 . 1 1 84 84 LEU C C 84 178.796 178.796 178.847 -0.051 25109
8269 1 15 . 1 1 84 84 LEU CA C 84 57.522 57.522 56.609 0.913 25109
8270 1 15 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.130 1.365 25109
8271 1 15 . 1 1 84 84 LEU H H 84 7.770 7.770 7.372 0.398 25109
8272 1 15 . 1 1 85 85 ALA N N 85 121.525 121.525 122.205 -0.680 25109
8273 1 15 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.947 -0.286 25109
8274 1 15 . 1 1 85 85 ALA C C 85 179.322 179.322 179.063 0.259 25109
8275 1 15 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.083 0.758 25109
8276 1 15 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.130 0.798 25109
8277 1 15 . 1 1 85 85 ALA H H 85 8.126 8.126 7.492 0.634 25109
8278 1 15 . 1 1 86 86 ASP N N 86 115.349 115.349 118.585 -3.236 25109
8279 1 15 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.369 -0.096 25109
8280 1 15 . 1 1 86 86 ASP C C 86 178.463 178.463 178.523 -0.060 25109
8281 1 15 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.362 -1.651 25109
8282 1 15 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.978 -3.816 25109
8283 1 15 . 1 1 86 86 ASP H H 86 8.410 8.410 7.985 0.425 25109
8284 1 15 . 1 1 87 87 GLU N N 87 122.529 122.529 119.942 2.587 25109
8285 1 15 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.118 -0.082 25109
8286 1 15 . 1 1 87 87 GLU C C 87 178.508 178.508 179.398 -0.890 25109
8287 1 15 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.593 -0.239 25109
8288 1 15 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.670 -1.397 25109
8289 1 15 . 1 1 87 87 GLU H H 87 8.012 8.012 7.773 0.239 25109
8290 1 15 . 1 1 88 88 VAL N N 88 119.148 119.148 119.659 -0.511 25109
8291 1 15 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.814 -0.484 25109
8292 1 15 . 1 1 88 88 VAL C C 88 177.240 177.240 178.005 -0.765 25109
8293 1 15 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.795 0.454 25109
8294 1 15 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.425 0.104 25109
8295 1 15 . 1 1 88 88 VAL H H 88 8.291 8.291 7.880 0.411 25109
8296 1 15 . 1 1 89 89 ALA N N 89 120.709 120.709 121.738 -1.029 25109
8297 1 15 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.091 -0.176 25109
8298 1 15 . 1 1 89 89 ALA C C 89 180.186 180.186 179.899 0.287 25109
8299 1 15 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.366 0.693 25109
8300 1 15 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.022 0.213 25109
8301 1 15 . 1 1 89 89 ALA H H 89 8.548 8.548 8.132 0.416 25109
8302 1 15 . 1 1 90 90 SER N N 90 113.035 113.035 114.522 -1.487 25109
8303 1 15 . 1 1 90 90 SER HA H 90 4.047 4.047 4.487 -0.440 25109
8304 1 15 . 1 1 90 90 SER C C 90 177.564 177.564 176.229 1.335 25109
8305 1 15 . 1 1 90 90 SER CA C 90 61.771 61.771 61.675 0.096 25109
8306 1 15 . 1 1 90 90 SER CB C 90 62.907 62.907 63.263 -0.356 25109
8307 1 15 . 1 1 90 90 SER H H 90 7.969 7.969 7.958 0.011 25109
8308 1 15 . 1 1 91 91 VAL N N 91 123.417 123.417 122.830 0.587 25109
8309 1 15 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.392 -0.045 25109
8310 1 15 . 1 1 91 91 VAL C C 91 178.428 178.428 178.060 0.368 25109
8311 1 15 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.165 -0.035 25109
8312 1 15 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.114 0.657 25109
8313 1 15 . 1 1 91 91 VAL H H 91 7.713 7.713 7.819 -0.106 25109
8314 1 15 . 1 1 92 92 TYR N N 92 121.458 121.458 120.285 1.173 25109
8315 1 15 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.277 -0.086 25109
8316 1 15 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.350 0.644 25109
8317 1 15 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.342 0.643 25109
8318 1 15 . 1 1 92 92 TYR H H 92 8.395 8.395 8.601 -0.206 25109
8319 1 15 . 1 1 93 93 GLN N N 93 115.549 115.549 117.603 -2.054 25109
8320 1 15 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.007 -0.296 25109
8321 1 15 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.954 0.140 25109
8322 1 15 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.484 -0.186 25109
8323 1 15 . 1 1 93 93 GLN H H 93 8.167 8.167 7.612 0.555 25109
8324 1 15 . 1 1 94 94 SER N N 94 115.923 115.923 113.455 2.468 25109
8325 1 15 . 1 1 94 94 SER HA H 94 4.096 4.096 4.211 -0.115 25109
8326 1 15 . 1 1 94 94 SER CA C 94 60.971 60.971 59.394 1.577 25109
8327 1 15 . 1 1 94 94 SER CB C 94 62.635 62.635 63.707 -1.072 25109
8328 1 15 . 1 1 94 94 SER H H 94 7.642 7.642 7.388 0.254 25109
8329 1 15 . 1 1 95 95 TYR N N 95 119.565 119.565 120.438 -0.873 25109
8330 1 15 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.558 0.201 25109
8331 1 15 . 1 1 95 95 TYR C C 95 175.334 175.334 174.156 1.178 25109
8332 1 15 . 1 1 95 95 TYR CA C 95 57.698 57.698 55.703 1.996 25109
8333 1 15 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.904 1.415 25109
8334 1 15 . 1 1 95 95 TYR H H 95 7.069 7.069 6.867 0.202 25109
8335 1 15 . 1 1 96 96 GLN N N 96 119.872 119.872 118.840 1.032 25109
8336 1 15 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.999 0.366 25109
8337 1 15 . 1 1 96 96 GLN C C 96 173.612 173.612 173.927 -0.315 25109
8338 1 15 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.874 -1.538 25109
8339 1 15 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.143 1.351 25109
8340 1 15 . 1 1 96 96 GLN H H 96 7.409 7.409 8.609 -1.200 25109
8341 1 15 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.186 0.132 25109
8342 1 15 . 1 1 97 97 PRO CA C 97 63.014 63.014 64.063 -1.049 25109
8343 1 15 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.224 -0.126 25109
8344 1 15 . 1 1 98 98 ARG N N 98 121.759 121.759 120.224 1.535 25109
8345 1 15 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.561 -0.219 25109
8346 1 15 . 1 1 98 98 ARG C C 98 176.848 176.848 175.208 1.640 25109
8347 1 15 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.855 1.366 25109
8348 1 15 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.754 0.333 25109
8349 1 15 . 1 1 98 98 ARG H H 98 8.423 8.423 7.951 0.472 25109
8350 1 15 . 1 1 99 99 THR N N 99 115.292 115.292 122.374 -7.082 25109
8351 1 15 . 1 1 99 99 THR HA H 99 4.323 4.323 4.351 -0.028 25109
8352 1 15 . 1 1 99 99 THR C C 99 174.350 174.350 174.382 -0.032 25109
8353 1 15 . 1 1 99 99 THR CA C 99 61.906 61.906 63.557 -1.651 25109
8354 1 15 . 1 1 99 99 THR CB C 99 70.180 70.180 68.521 1.659 25109
8355 1 15 . 1 1 99 99 THR H H 99 8.179 8.179 8.607 -0.428 25109
8356 1 16 . 1 1 0 0 SER N N 0 115.693 115.693 117.248 -1.555 25109
8357 1 16 . 1 1 0 0 SER HA H 0 4.531 4.531 4.670 -0.139 25109
8358 1 16 . 1 1 0 0 SER C C 0 174.557 174.557 173.858 0.699 25109
8359 1 16 . 1 1 0 0 SER CA C 0 58.478 58.478 58.130 0.348 25109
8360 1 16 . 1 1 0 0 SER CB C 0 64.380 64.380 62.338 2.042 25109
8361 1 16 . 1 1 0 0 SER H H 0 8.631 8.631 8.609 0.022 25109
8362 1 16 . 1 1 1 1 MET N N 1 123.111 123.111 116.538 6.573 25109
8363 1 16 . 1 1 1 1 MET HA H 1 4.728 4.728 4.751 -0.023 25109
8364 1 16 . 1 1 1 1 MET C C 1 174.846 174.846 173.275 1.571 25109
8365 1 16 . 1 1 1 1 MET CA C 1 55.655 55.655 53.255 2.400 25109
8366 1 16 . 1 1 1 1 MET CB C 1 32.035 32.035 33.948 -1.913 25109
8367 1 16 . 1 1 1 1 MET H H 1 8.641 8.641 7.844 0.797 25109
8368 1 16 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.679 -0.202 25109
8369 1 16 . 1 1 2 2 PRO CB C 2 32.000 32.000 30.899 1.101 25109
8370 1 16 . 1 1 3 3 PHE N N 3 121.126 121.126 126.314 -5.188 25109
8371 1 16 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.579 -0.213 25109
8372 1 16 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.582 1.280 25109
8373 1 16 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.545 -1.177 25109
8374 1 16 . 1 1 3 3 PHE H H 3 8.177 8.177 9.755 -1.578 25109
8375 1 16 . 1 1 4 4 ALA N N 4 121.170 121.170 121.587 -0.417 25109
8376 1 16 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.204 -0.369 25109
8377 1 16 . 1 1 4 4 ALA C C 4 181.522 181.522 178.936 2.586 25109
8378 1 16 . 1 1 4 4 ALA CA C 4 55.454 55.454 54.735 0.719 25109
8379 1 16 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.580 0.856 25109
8380 1 16 . 1 1 4 4 ALA H H 4 8.444 8.444 8.795 -0.351 25109
8381 1 16 . 1 1 5 5 GLU N N 5 118.932 118.932 118.657 0.275 25109
8382 1 16 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.955 -0.100 25109
8383 1 16 . 1 1 5 5 GLU C C 5 177.971 177.971 177.993 -0.022 25109
8384 1 16 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.018 0.613 25109
8385 1 16 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.639 0.122 25109
8386 1 16 . 1 1 5 5 GLU H H 5 8.454 8.454 8.743 -0.289 25109
8387 1 16 . 1 1 6 6 ASP N N 6 120.471 120.471 118.389 2.082 25109
8388 1 16 . 1 1 6 6 ASP C C 6 178.885 178.885 178.116 0.769 25109
8389 1 16 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.438 -0.366 25109
8390 1 16 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.755 -1.623 25109
8391 1 16 . 1 1 6 6 ASP H H 6 8.316 8.316 8.515 -0.199 25109
8392 1 16 . 1 1 7 7 LYS N N 7 118.335 118.335 118.421 -0.086 25109
8393 1 16 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.948 -0.258 25109
8394 1 16 . 1 1 7 7 LYS C C 7 180.080 180.080 178.983 1.097 25109
8395 1 16 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.526 0.194 25109
8396 1 16 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.275 0.519 25109
8397 1 16 . 1 1 7 7 LYS H H 7 8.249 8.249 7.365 0.884 25109
8398 1 16 . 1 1 8 8 THR N N 8 119.222 119.222 117.131 2.091 25109
8399 1 16 . 1 1 8 8 THR HA H 8 3.975 3.975 4.105 -0.130 25109
8400 1 16 . 1 1 8 8 THR CA C 8 68.453 68.453 66.929 1.524 25109
8401 1 16 . 1 1 8 8 THR CB C 8 67.387 67.387 68.729 -1.342 25109
8402 1 16 . 1 1 8 8 THR H H 8 7.897 7.897 8.059 -0.162 25109
8403 1 16 . 1 1 9 9 TYR N N 9 123.054 123.054 123.244 -0.190 25109
8404 1 16 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.147 0.106 25109
8405 1 16 . 1 1 9 9 TYR C C 9 177.441 177.441 177.363 0.078 25109
8406 1 16 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.125 -0.227 25109
8407 1 16 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.409 -0.560 25109
8408 1 16 . 1 1 9 9 TYR H H 9 8.605 8.605 8.248 0.357 25109
8409 1 16 . 1 1 10 10 LYS N N 10 118.366 118.366 118.031 0.335 25109
8410 1 16 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.771 -0.177 25109
8411 1 16 . 1 1 10 10 LYS C C 10 178.885 178.885 178.999 -0.114 25109
8412 1 16 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.892 1.152 25109
8413 1 16 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.718 0.327 25109
8414 1 16 . 1 1 10 10 LYS H H 10 8.066 8.066 8.098 -0.032 25109
8415 1 16 . 1 1 11 11 TYR N N 11 120.539 120.539 120.114 0.425 25109
8416 1 16 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.239 -0.249 25109
8417 1 16 . 1 1 11 11 TYR C C 11 178.233 178.233 178.180 0.053 25109
8418 1 16 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.511 1.017 25109
8419 1 16 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.990 -0.627 25109
8420 1 16 . 1 1 11 11 TYR H H 11 7.875 7.875 7.741 0.134 25109
8421 1 16 . 1 1 12 12 ILE N N 12 121.893 121.893 119.379 2.514 25109
8422 1 16 . 1 1 12 12 ILE HA H 12 3.096 3.096 4.279 -1.183 25109
8423 1 16 . 1 1 12 12 ILE C C 12 177.015 177.015 177.884 -0.869 25109
8424 1 16 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.107 2.656 25109
8425 1 16 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.351 1.201 25109
8426 1 16 . 1 1 12 12 ILE H H 12 8.154 8.154 8.888 -0.734 25109
8427 1 16 . 1 1 13 13 CYS N N 13 113.894 113.894 117.845 -3.951 25109
8428 1 16 . 1 1 13 13 CYS HA H 13 3.887 3.887 4.016 -0.129 25109
8429 1 16 . 1 1 13 13 CYS C C 13 178.288 178.288 176.278 2.010 25109
8430 1 16 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.269 3.068 25109
8431 1 16 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.559 0.446 25109
8432 1 16 . 1 1 13 13 CYS H H 13 7.551 7.551 7.914 -0.363 25109
8433 1 16 . 1 1 14 14 ARG N N 14 119.228 119.228 118.920 0.308 25109
8434 1 16 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.208 -0.138 25109
8435 1 16 . 1 1 14 14 ARG C C 14 177.127 177.127 176.633 0.494 25109
8436 1 16 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.627 -0.133 25109
8437 1 16 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.646 -0.224 25109
8438 1 16 . 1 1 14 14 ARG H H 14 7.991 7.991 7.752 0.239 25109
8439 1 16 . 1 1 15 15 ASN N N 15 117.367 117.367 115.501 1.866 25109
8440 1 16 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.859 0.110 25109
8441 1 16 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.767 -0.004 25109
8442 1 16 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.104 0.481 25109
8443 1 16 . 1 1 15 15 ASN H H 15 7.643 7.643 7.632 0.011 25109
8444 1 16 . 1 1 16 16 PHE N N 16 122.356 122.356 123.866 -1.510 25109
8445 1 16 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.386 -0.170 25109
8446 1 16 . 1 1 16 16 PHE C C 16 178.084 178.084 176.624 1.460 25109
8447 1 16 . 1 1 16 16 PHE CA C 16 63.177 63.177 62.078 1.099 25109
8448 1 16 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.303 1.286 25109
8449 1 16 . 1 1 16 16 PHE H H 16 6.992 6.992 7.914 -0.922 25109
8450 1 16 . 1 1 17 17 SER N N 17 112.937 112.937 113.063 -0.126 25109
8451 1 16 . 1 1 17 17 SER HA H 17 4.199 4.199 4.136 0.063 25109
8452 1 16 . 1 1 17 17 SER C C 17 176.726 176.726 175.754 0.972 25109
8453 1 16 . 1 1 17 17 SER CA C 17 62.052 62.052 59.858 2.194 25109
8454 1 16 . 1 1 17 17 SER CB C 17 62.552 62.552 62.813 -0.261 25109
8455 1 16 . 1 1 17 17 SER H H 17 8.840 8.840 8.730 0.110 25109
8456 1 16 . 1 1 18 18 ASN N N 18 118.809 118.809 121.002 -2.193 25109
8457 1 16 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.571 -0.213 25109
8458 1 16 . 1 1 18 18 ASN C C 18 175.967 175.967 175.957 0.010 25109
8459 1 16 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.312 -0.402 25109
8460 1 16 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.424 -0.596 25109
8461 1 16 . 1 1 18 18 ASN H H 18 8.130 8.130 8.217 -0.087 25109
8462 1 16 . 1 1 19 19 PHE N N 19 115.750 115.750 116.664 -0.914 25109
8463 1 16 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.794 -0.509 25109
8464 1 16 . 1 1 19 19 PHE C C 19 175.370 175.370 176.363 -0.993 25109
8465 1 16 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.221 0.641 25109
8466 1 16 . 1 1 19 19 PHE CB C 19 39.878 39.878 39.712 0.165 25109
8467 1 16 . 1 1 19 19 PHE H H 19 8.062 8.062 7.651 0.411 25109
8468 1 16 . 1 1 20 20 CYS N N 20 113.958 113.958 117.368 -3.410 25109
8469 1 16 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.187 -0.244 25109
8470 1 16 . 1 1 20 20 CYS C C 20 173.823 173.823 174.377 -0.554 25109
8471 1 16 . 1 1 20 20 CYS CA C 20 61.788 61.788 60.731 1.057 25109
8472 1 16 . 1 1 20 20 CYS CB C 20 27.383 27.383 26.753 0.630 25109
8473 1 16 . 1 1 20 20 CYS H H 20 6.850 6.850 7.582 -0.732 25109
8474 1 16 . 1 1 21 21 ASN N N 21 116.691 116.691 116.747 -0.056 25109
8475 1 16 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.766 -0.022 25109
8476 1 16 . 1 1 21 21 ASN C C 21 175.299 175.299 175.009 0.290 25109
8477 1 16 . 1 1 21 21 ASN CA C 21 53.290 53.290 52.831 0.459 25109
8478 1 16 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.620 -1.307 25109
8479 1 16 . 1 1 21 21 ASN H H 21 8.251 8.251 7.811 0.440 25109
8480 1 16 . 1 1 22 22 VAL N N 22 122.431 122.431 121.176 1.255 25109
8481 1 16 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.165 -0.615 25109
8482 1 16 . 1 1 22 22 VAL C C 22 174.034 174.034 174.528 -0.494 25109
8483 1 16 . 1 1 22 22 VAL CA C 22 63.937 63.937 62.254 1.683 25109
8484 1 16 . 1 1 22 22 VAL CB C 22 31.523 31.523 33.335 -1.812 25109
8485 1 16 . 1 1 22 22 VAL H H 22 7.573 7.573 7.572 0.001 25109
8486 1 16 . 1 1 23 23 ASP N N 23 127.219 127.219 121.531 5.688 25109
8487 1 16 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.307 -1.121 25109
8488 1 16 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.898 -3.104 25109
8489 1 16 . 1 1 23 23 ASP H H 23 8.687 8.687 8.673 0.014 25109
8490 1 16 . 1 1 24 24 VAL N N 24 127.835 127.835 126.133 1.702 25109
8491 1 16 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.905 -0.612 25109
8492 1 16 . 1 1 24 24 VAL C C 24 176.867 176.867 176.995 -0.128 25109
8493 1 16 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.517 2.646 25109
8494 1 16 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.367 -0.352 25109
8495 1 16 . 1 1 24 24 VAL H H 24 9.409 9.409 8.783 0.626 25109
8496 1 16 . 1 1 25 25 VAL N N 25 114.324 114.324 115.909 -1.585 25109
8497 1 16 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.771 -0.252 25109
8498 1 16 . 1 1 25 25 VAL C C 25 178.006 178.006 177.499 0.507 25109
8499 1 16 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.305 1.383 25109
8500 1 16 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.504 0.028 25109
8501 1 16 . 1 1 25 25 VAL H H 25 8.038 8.038 7.834 0.204 25109
8502 1 16 . 1 1 26 26 GLU N N 26 117.009 117.009 120.486 -3.477 25109
8503 1 16 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.147 -0.056 25109
8504 1 16 . 1 1 26 26 GLU C C 26 177.303 177.303 178.209 -0.906 25109
8505 1 16 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.699 -1.267 25109
8506 1 16 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.721 -0.756 25109
8507 1 16 . 1 1 26 26 GLU H H 26 7.220 7.220 8.554 -1.334 25109
8508 1 16 . 1 1 27 27 ILE N N 27 114.080 114.080 119.405 -5.325 25109
8509 1 16 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.792 0.569 25109
8510 1 16 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.924 -2.192 25109
8511 1 16 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.084 1.507 25109
8512 1 16 . 1 1 27 27 ILE H H 27 7.647 7.647 7.271 0.376 25109
8513 1 16 . 1 1 28 28 LEU N N 28 121.867 121.867 120.309 1.558 25109
8514 1 16 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.080 -0.143 25109
8515 1 16 . 1 1 28 28 LEU C C 28 175.756 175.756 176.210 -0.454 25109
8516 1 16 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.029 -0.062 25109
8517 1 16 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.922 0.591 25109
8518 1 16 . 1 1 28 28 LEU H H 28 7.434 7.434 7.920 -0.486 25109
8519 1 16 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.280 -0.070 25109
8520 1 16 . 1 1 29 29 PRO CB C 29 31.310 31.310 30.930 0.380 25109
8521 1 16 . 1 1 30 30 TYR N N 30 113.832 113.832 115.497 -1.665 25109
8522 1 16 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.578 -0.076 25109
8523 1 16 . 1 1 30 30 TYR C C 30 174.386 174.386 175.533 -1.147 25109
8524 1 16 . 1 1 30 30 TYR CA C 30 57.694 57.694 58.483 -0.789 25109
8525 1 16 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.264 -0.165 25109
8526 1 16 . 1 1 30 30 TYR H H 30 7.628 7.628 7.521 0.107 25109
8527 1 16 . 1 1 31 31 LEU N N 31 118.331 118.331 120.524 -2.193 25109
8528 1 16 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.774 0.103 25109
8529 1 16 . 1 1 31 31 LEU C C 31 173.849 173.849 174.722 -0.873 25109
8530 1 16 . 1 1 31 31 LEU CA C 31 51.692 51.692 52.051 -0.359 25109
8531 1 16 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.643 0.159 25109
8532 1 16 . 1 1 31 31 LEU H H 31 7.619 7.619 7.404 0.215 25109
8533 1 16 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.572 -0.217 25109
8534 1 16 . 1 1 32 32 PRO CB C 32 31.410 31.410 30.165 1.245 25109
8535 1 16 . 1 1 33 33 CYS N N 33 110.978 110.978 118.326 -7.348 25109
8536 1 16 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.624 -0.283 25109
8537 1 16 . 1 1 33 33 CYS C C 33 174.139 174.139 173.487 0.652 25109
8538 1 16 . 1 1 33 33 CYS CA C 33 56.212 56.212 57.919 -1.707 25109
8539 1 16 . 1 1 33 33 CYS CB C 33 28.922 28.922 29.675 -0.753 25109
8540 1 16 . 1 1 33 33 CYS H H 33 6.414 6.414 7.715 -1.301 25109
8541 1 16 . 1 1 34 34 LEU N N 34 123.111 123.111 119.399 3.712 25109
8542 1 16 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.600 0.006 25109
8543 1 16 . 1 1 34 34 LEU C C 34 176.646 176.646 176.077 0.569 25109
8544 1 16 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.480 0.411 25109
8545 1 16 . 1 1 34 34 LEU CB C 34 42.691 42.691 44.790 -2.099 25109
8546 1 16 . 1 1 34 34 LEU H H 34 7.550 7.550 7.195 0.355 25109
8547 1 16 . 1 1 35 35 THR N N 35 113.831 113.831 115.903 -2.072 25109
8548 1 16 . 1 1 35 35 THR HA H 35 4.205 4.205 4.327 -0.122 25109
8549 1 16 . 1 1 35 35 THR C C 35 175.324 175.324 175.689 -0.365 25109
8550 1 16 . 1 1 35 35 THR CA C 35 61.200 61.200 61.688 -0.488 25109
8551 1 16 . 1 1 35 35 THR CB C 35 71.318 71.318 70.146 1.172 25109
8552 1 16 . 1 1 35 35 THR H H 35 8.586 8.586 8.276 0.310 25109
8553 1 16 . 1 1 36 36 ALA N N 36 124.128 124.128 127.292 -3.164 25109
8554 1 16 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.048 -0.124 25109
8555 1 16 . 1 1 36 36 ALA C C 36 180.397 180.397 179.293 1.104 25109
8556 1 16 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.606 0.314 25109
8557 1 16 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.500 -0.697 25109
8558 1 16 . 1 1 36 36 ALA H H 36 8.836 8.836 8.688 0.148 25109
8559 1 16 . 1 1 37 37 ARG N N 37 116.793 116.793 116.832 -0.039 25109
8560 1 16 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.026 -0.040 25109
8561 1 16 . 1 1 37 37 ARG C C 37 179.272 179.272 178.184 1.088 25109
8562 1 16 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.143 0.089 25109
8563 1 16 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.390 0.516 25109
8564 1 16 . 1 1 37 37 ARG H H 37 8.060 8.060 8.685 -0.625 25109
8565 1 16 . 1 1 38 38 ASP N N 38 120.030 120.030 120.355 -0.325 25109
8566 1 16 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.467 -0.219 25109
8567 1 16 . 1 1 38 38 ASP C C 38 178.885 178.885 178.504 0.381 25109
8568 1 16 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.025 -0.838 25109
8569 1 16 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.697 0.236 25109
8570 1 16 . 1 1 38 38 ASP H H 38 7.782 7.782 7.613 0.169 25109
8571 1 16 . 1 1 39 39 GLN N N 39 118.223 118.223 118.152 0.071 25109
8572 1 16 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.001 -0.336 25109
8573 1 16 . 1 1 39 39 GLN C C 39 178.041 178.041 178.437 -0.396 25109
8574 1 16 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.396 2.205 25109
8575 1 16 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.211 -0.414 25109
8576 1 16 . 1 1 39 39 GLN H H 39 8.476 8.476 7.909 0.567 25109
8577 1 16 . 1 1 40 40 ASP N N 40 117.908 117.908 121.114 -3.206 25109
8578 1 16 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.331 -0.078 25109
8579 1 16 . 1 1 40 40 ASP C C 40 178.639 178.639 178.085 0.554 25109
8580 1 16 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.685 -1.285 25109
8581 1 16 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.973 -2.945 25109
8582 1 16 . 1 1 40 40 ASP H H 40 8.386 8.386 8.296 0.090 25109
8583 1 16 . 1 1 41 41 ARG N N 41 120.990 120.990 120.118 0.872 25109
8584 1 16 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.039 0.003 25109
8585 1 16 . 1 1 41 41 ARG C C 41 179.795 179.795 178.833 0.962 25109
8586 1 16 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.560 -0.116 25109
8587 1 16 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.243 0.015 25109
8588 1 16 . 1 1 41 41 ARG H H 41 8.130 8.130 7.940 0.190 25109
8589 1 16 . 1 1 42 42 LEU N N 42 121.219 121.219 119.676 1.543 25109
8590 1 16 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.182 -0.247 25109
8591 1 16 . 1 1 42 42 LEU C C 42 178.850 178.850 179.108 -0.258 25109
8592 1 16 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.967 0.300 25109
8593 1 16 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.606 0.427 25109
8594 1 16 . 1 1 42 42 LEU H H 42 8.179 8.179 8.245 -0.066 25109
8595 1 16 . 1 1 43 43 ARG N N 43 119.310 119.310 119.368 -0.058 25109
8596 1 16 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.793 -0.069 25109
8597 1 16 . 1 1 43 43 ARG C C 43 179.099 179.099 178.460 0.639 25109
8598 1 16 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.749 1.065 25109
8599 1 16 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.209 -0.030 25109
8600 1 16 . 1 1 43 43 ARG H H 43 8.296 8.296 8.186 0.110 25109
8601 1 16 . 1 1 44 44 ALA N N 44 121.305 121.305 119.961 1.344 25109
8602 1 16 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.114 -0.011 25109
8603 1 16 . 1 1 44 44 ALA C C 44 180.924 180.924 179.709 1.215 25109
8604 1 16 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.059 0.166 25109
8605 1 16 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.481 -0.385 25109
8606 1 16 . 1 1 44 44 ALA H H 44 7.774 7.774 8.411 -0.637 25109
8607 1 16 . 1 1 45 45 THR N N 45 115.017 115.017 114.840 0.177 25109
8608 1 16 . 1 1 45 45 THR HA H 45 3.879 3.879 4.096 -0.217 25109
8609 1 16 . 1 1 45 45 THR CA C 45 66.327 66.327 65.884 0.443 25109
8610 1 16 . 1 1 45 45 THR CB C 45 68.809 68.809 68.415 0.394 25109
8611 1 16 . 1 1 45 45 THR H H 45 8.167 8.167 8.167 0.000 25109
8612 1 16 . 1 1 46 46 CYS N N 46 123.609 123.609 122.059 1.550 25109
8613 1 16 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.292 -0.273 25109
8614 1 16 . 1 1 46 46 CYS C C 46 178.077 178.077 176.241 1.836 25109
8615 1 16 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.468 0.478 25109
8616 1 16 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.316 -1.177 25109
8617 1 16 . 1 1 46 46 CYS H H 46 8.084 8.084 7.909 0.175 25109
8618 1 16 . 1 1 47 47 THR N N 47 115.520 115.520 113.960 1.560 25109
8619 1 16 . 1 1 47 47 THR HA H 47 3.915 3.915 4.035 -0.120 25109
8620 1 16 . 1 1 47 47 THR CA C 47 66.063 66.063 65.707 0.356 25109
8621 1 16 . 1 1 47 47 THR CB C 47 69.245 69.245 68.761 0.484 25109
8622 1 16 . 1 1 47 47 THR H H 47 7.735 7.735 7.511 0.224 25109
8623 1 16 . 1 1 48 48 LEU N N 48 120.099 120.099 119.633 0.466 25109
8624 1 16 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.343 -0.117 25109
8625 1 16 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.416 1.147 25109
8626 1 16 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.664 0.961 25109
8627 1 16 . 1 1 48 48 LEU H H 48 7.464 7.464 7.422 0.042 25109
8628 1 16 . 1 1 49 49 SER N N 49 111.979 111.979 111.136 0.843 25109
8629 1 16 . 1 1 49 49 SER HA H 49 4.661 4.661 4.637 0.024 25109
8630 1 16 . 1 1 49 49 SER C C 49 175.581 175.581 175.808 -0.227 25109
8631 1 16 . 1 1 49 49 SER CA C 49 59.590 59.590 57.888 1.702 25109
8632 1 16 . 1 1 49 49 SER CB C 49 65.335 65.335 65.501 -0.166 25109
8633 1 16 . 1 1 49 49 SER H H 49 8.781 8.781 8.048 0.733 25109
8634 1 16 . 1 1 50 50 GLY N N 50 110.194 110.194 112.715 -2.521 25109
8635 1 16 . 1 1 50 50 GLY C C 50 175.123 175.123 173.842 1.281 25109
8636 1 16 . 1 1 50 50 GLY CA C 50 44.902 44.902 46.430 -1.528 25109
8637 1 16 . 1 1 50 50 GLY H H 50 7.955 7.955 8.314 -0.359 25109
8638 1 16 . 1 1 51 51 ASN N N 51 121.050 121.050 118.234 2.816 25109
8639 1 16 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.813 -0.563 25109
8640 1 16 . 1 1 51 51 ASN C C 51 176.403 176.403 176.297 0.106 25109
8641 1 16 . 1 1 51 51 ASN CA C 51 59.303 59.303 53.624 5.679 25109
8642 1 16 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.850 2.749 25109
8643 1 16 . 1 1 51 51 ASN H H 51 8.898 8.898 8.147 0.751 25109
8644 1 16 . 1 1 52 52 ARG N N 52 119.825 119.825 121.790 -1.965 25109
8645 1 16 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.932 0.106 25109
8646 1 16 . 1 1 52 52 ARG C C 52 178.850 178.850 177.451 1.399 25109
8647 1 16 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.539 0.525 25109
8648 1 16 . 1 1 52 52 ARG CB C 52 30.023 30.023 30.188 -0.165 25109
8649 1 16 . 1 1 52 52 ARG H H 52 8.696 8.696 8.558 0.138 25109
8650 1 16 . 1 1 53 53 ASP N N 53 116.032 116.032 116.024 0.008 25109
8651 1 16 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.664 -0.118 25109
8652 1 16 . 1 1 53 53 ASP C C 53 178.996 178.996 178.242 0.754 25109
8653 1 16 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.455 -1.376 25109
8654 1 16 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.639 -2.268 25109
8655 1 16 . 1 1 53 53 ASP H H 53 9.036 9.036 8.282 0.754 25109
8656 1 16 . 1 1 54 54 THR N N 54 115.848 115.848 117.502 -1.654 25109
8657 1 16 . 1 1 54 54 THR HA H 54 3.746 3.746 4.205 -0.459 25109
8658 1 16 . 1 1 54 54 THR CA C 54 67.885 67.885 67.012 0.873 25109
8659 1 16 . 1 1 54 54 THR CB C 54 66.953 66.953 68.762 -1.809 25109
8660 1 16 . 1 1 54 54 THR H H 54 7.782 7.782 7.898 -0.116 25109
8661 1 16 . 1 1 55 55 LEU N N 55 125.987 125.987 122.484 3.503 25109
8662 1 16 . 1 1 55 55 LEU HA H 55 3.554 3.554 3.990 -0.436 25109
8663 1 16 . 1 1 55 55 LEU C C 55 177.901 177.901 178.439 -0.538 25109
8664 1 16 . 1 1 55 55 LEU CA C 55 58.453 58.453 60.125 -1.672 25109
8665 1 16 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.553 0.310 25109
8666 1 16 . 1 1 55 55 LEU H H 55 8.740 8.740 8.704 0.036 25109
8667 1 16 . 1 1 56 56 TRP N N 56 116.672 116.672 119.994 -3.322 25109
8668 1 16 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.464 -0.384 25109
8669 1 16 . 1 1 56 56 TRP C C 56 179.588 179.588 178.441 1.147 25109
8670 1 16 . 1 1 56 56 TRP CA C 56 61.481 61.481 60.593 0.888 25109
8671 1 16 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.587 -0.395 25109
8672 1 16 . 1 1 56 56 TRP H H 56 7.642 7.642 7.957 -0.315 25109
8673 1 16 . 1 1 57 57 HIS N N 57 115.754 115.754 119.873 -4.119 25109
8674 1 16 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.129 0.147 25109
8675 1 16 . 1 1 57 57 HIS C C 57 177.514 177.514 177.475 0.039 25109
8676 1 16 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.555 -0.603 25109
8677 1 16 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.702 -2.700 25109
8678 1 16 . 1 1 57 57 HIS H H 57 7.407 7.407 8.620 -1.213 25109
8679 1 16 . 1 1 58 58 LEU N N 58 123.934 123.934 121.794 2.140 25109
8680 1 16 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.689 0.098 25109
8681 1 16 . 1 1 58 58 LEU C C 58 178.115 178.115 177.648 0.467 25109
8682 1 16 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.053 0.856 25109
8683 1 16 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.371 -0.556 25109
8684 1 16 . 1 1 58 58 LEU H H 58 8.996 8.996 8.506 0.490 25109
8685 1 16 . 1 1 59 59 PHE N N 59 117.721 117.721 116.930 0.791 25109
8686 1 16 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.511 0.424 25109
8687 1 16 . 1 1 59 59 PHE C C 59 176.987 176.987 177.885 -0.898 25109
8688 1 16 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.659 -1.546 25109
8689 1 16 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.629 -0.669 25109
8690 1 16 . 1 1 59 59 PHE H H 59 8.201 8.201 8.523 -0.322 25109
8691 1 16 . 1 1 60 60 ASN N N 60 115.695 115.695 117.230 -1.535 25109
8692 1 16 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.120 -0.201 25109
8693 1 16 . 1 1 60 60 ASN C C 60 176.670 176.670 176.366 0.304 25109
8694 1 16 . 1 1 60 60 ASN CA C 60 56.756 56.756 55.765 0.991 25109
8695 1 16 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.297 1.021 25109
8696 1 16 . 1 1 60 60 ASN H H 60 7.666 7.666 7.647 0.019 25109
8697 1 16 . 1 1 61 61 THR N N 61 115.110 115.110 115.556 -0.446 25109
8698 1 16 . 1 1 61 61 THR HA H 61 3.733 3.733 3.942 -0.209 25109
8699 1 16 . 1 1 61 61 THR CA C 61 66.319 66.319 66.189 0.130 25109
8700 1 16 . 1 1 61 61 THR CB C 61 69.174 69.174 68.747 0.427 25109
8701 1 16 . 1 1 61 61 THR H H 61 7.782 7.782 7.720 0.062 25109
8702 1 16 . 1 1 62 62 LEU N N 62 121.559 121.559 121.791 -0.232 25109
8703 1 16 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.828 -0.339 25109
8704 1 16 . 1 1 62 62 LEU C C 62 176.600 176.600 177.959 -1.359 25109
8705 1 16 . 1 1 62 62 LEU CA C 62 57.965 57.965 58.276 -0.311 25109
8706 1 16 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.690 1.645 25109
8707 1 16 . 1 1 62 62 LEU H H 62 8.362 8.362 8.453 -0.091 25109
8708 1 16 . 1 1 63 63 GLN N N 63 109.150 109.150 114.733 -5.583 25109
8709 1 16 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.923 -1.846 25109
8710 1 16 . 1 1 63 63 GLN C C 63 175.194 175.194 176.521 -1.327 25109
8711 1 16 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.191 -0.925 25109
8712 1 16 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.873 -2.179 25109
8713 1 16 . 1 1 63 63 GLN H H 63 6.458 6.458 7.319 -0.861 25109
8714 1 16 . 1 1 64 64 ARG N N 64 116.029 116.029 117.329 -1.300 25109
8715 1 16 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.347 -0.249 25109
8716 1 16 . 1 1 64 64 ARG C C 64 176.459 176.459 176.123 0.336 25109
8717 1 16 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.628 0.515 25109
8718 1 16 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.871 -0.287 25109
8719 1 16 . 1 1 64 64 ARG H H 64 6.596 6.596 7.334 -0.738 25109
8720 1 16 . 1 1 65 65 ARG N N 65 120.422 120.422 120.565 -0.143 25109
8721 1 16 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.837 -0.003 25109
8722 1 16 . 1 1 65 65 ARG C C 65 173.436 173.436 174.798 -1.362 25109
8723 1 16 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.439 -0.894 25109
8724 1 16 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.115 -1.119 25109
8725 1 16 . 1 1 65 65 ARG H H 65 7.932 7.932 7.923 0.009 25109
8726 1 16 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.466 0.108 25109
8727 1 16 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.503 0.556 25109
8728 1 16 . 1 1 67 67 GLY N N 67 111.953 111.953 106.362 5.591 25109
8729 1 16 . 1 1 67 67 GLY C C 67 177.057 177.057 175.106 1.951 25109
8730 1 16 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.245 1.062 25109
8731 1 16 . 1 1 67 67 GLY H H 67 9.198 9.198 7.764 1.434 25109
8732 1 16 . 1 1 68 68 TRP N N 68 117.467 117.467 121.070 -3.603 25109
8733 1 16 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.570 -0.228 25109
8734 1 16 . 1 1 68 68 TRP C C 68 177.690 177.690 176.529 1.161 25109
8735 1 16 . 1 1 68 68 TRP CA C 68 60.116 60.116 59.943 0.173 25109
8736 1 16 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.290 0.900 25109
8737 1 16 . 1 1 68 68 TRP H H 68 7.647 7.647 7.458 0.189 25109
8738 1 16 . 1 1 69 69 VAL N N 69 121.482 121.482 120.027 1.455 25109
8739 1 16 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.166 -0.529 25109
8740 1 16 . 1 1 69 69 VAL C C 69 177.993 177.993 177.826 0.167 25109
8741 1 16 . 1 1 69 69 VAL CA C 69 67.466 67.466 67.032 0.434 25109
8742 1 16 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.534 -0.508 25109
8743 1 16 . 1 1 69 69 VAL H H 69 6.666 6.666 7.284 -0.618 25109
8744 1 16 . 1 1 70 70 GLU N N 70 116.350 116.350 118.342 -1.992 25109
8745 1 16 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.769 0.056 25109
8746 1 16 . 1 1 70 70 GLU C C 70 180.362 180.362 178.455 1.907 25109
8747 1 16 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.100 0.121 25109
8748 1 16 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.621 -1.316 25109
8749 1 16 . 1 1 70 70 GLU H H 70 7.410 7.410 8.381 -0.971 25109
8750 1 16 . 1 1 71 71 TYR N N 71 116.750 116.750 118.827 -2.077 25109
8751 1 16 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.344 0.106 25109
8752 1 16 . 1 1 71 71 TYR C C 71 178.411 178.411 178.063 0.348 25109
8753 1 16 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.219 1.383 25109
8754 1 16 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.391 -0.036 25109
8755 1 16 . 1 1 71 71 TYR H H 71 7.159 7.159 7.313 -0.154 25109
8756 1 16 . 1 1 72 72 PHE N N 72 121.610 121.610 121.178 0.432 25109
8757 1 16 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.237 0.265 25109
8758 1 16 . 1 1 72 72 PHE CA C 72 60.820 60.820 60.960 -0.140 25109
8759 1 16 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.265 0.784 25109
8760 1 16 . 1 1 72 72 PHE H H 72 9.007 9.007 8.431 0.576 25109
8761 1 16 . 1 1 73 73 ILE N N 73 119.200 119.200 119.127 0.073 25109
8762 1 16 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.625 -0.445 25109
8763 1 16 . 1 1 73 73 ILE C C 73 177.620 177.620 177.802 -0.182 25109
8764 1 16 . 1 1 73 73 ILE CA C 73 67.197 67.197 64.075 3.122 25109
8765 1 16 . 1 1 73 73 ILE CB C 73 39.023 39.023 36.477 2.546 25109
8766 1 16 . 1 1 73 73 ILE H H 73 8.644 8.644 8.052 0.592 25109
8767 1 16 . 1 1 74 74 ALA N N 74 119.624 119.624 119.826 -0.202 25109
8768 1 16 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.135 -0.181 25109
8769 1 16 . 1 1 74 74 ALA C C 74 181.030 181.030 177.960 3.070 25109
8770 1 16 . 1 1 74 74 ALA CA C 74 55.411 55.411 53.714 1.697 25109
8771 1 16 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.962 0.174 25109
8772 1 16 . 1 1 74 74 ALA H H 74 7.476 7.476 7.665 -0.189 25109
8773 1 16 . 1 1 75 75 ALA N N 75 123.625 123.625 122.071 1.554 25109
8774 1 16 . 1 1 75 75 ALA HA H 75 3.838 3.838 4.077 -0.239 25109
8775 1 16 . 1 1 75 75 ALA C C 75 179.272 179.272 179.296 -0.024 25109
8776 1 16 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.559 0.543 25109
8777 1 16 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.736 0.857 25109
8778 1 16 . 1 1 75 75 ALA H H 75 8.524 8.524 7.364 1.160 25109
8779 1 16 . 1 1 76 76 LEU N N 76 118.114 118.114 120.077 -1.963 25109
8780 1 16 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.068 -0.396 25109
8781 1 16 . 1 1 76 76 LEU C C 76 180.001 180.001 178.838 1.163 25109
8782 1 16 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.452 0.804 25109
8783 1 16 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.568 1.051 25109
8784 1 16 . 1 1 76 76 LEU H H 76 8.153 8.153 7.646 0.507 25109
8785 1 16 . 1 1 77 77 ARG N N 77 117.830 117.830 118.871 -1.041 25109
8786 1 16 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.100 -0.653 25109
8787 1 16 . 1 1 77 77 ARG C C 77 180.889 180.889 179.323 1.566 25109
8788 1 16 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.111 1.955 25109
8789 1 16 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.902 -0.705 25109
8790 1 16 . 1 1 77 77 ARG H H 77 7.945 7.945 7.723 0.222 25109
8791 1 16 . 1 1 78 78 GLY N N 78 110.202 110.202 107.604 2.598 25109
8792 1 16 . 1 1 78 78 GLY C C 78 174.807 174.807 175.340 -0.533 25109
8793 1 16 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.522 0.038 25109
8794 1 16 . 1 1 78 78 GLY H H 78 8.269 8.269 7.469 0.800 25109
8795 1 16 . 1 1 79 79 CYS N N 79 115.567 115.567 116.328 -0.761 25109
8796 1 16 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.643 -0.254 25109
8797 1 16 . 1 1 79 79 CYS C C 79 173.025 173.025 174.424 -1.399 25109
8798 1 16 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.487 2.470 25109
8799 1 16 . 1 1 79 79 CYS CB C 79 27.805 27.805 26.804 1.001 25109
8800 1 16 . 1 1 79 79 CYS H H 79 7.132 7.132 7.472 -0.340 25109
8801 1 16 . 1 1 80 80 GLU N N 80 111.759 111.759 116.693 -4.934 25109
8802 1 16 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.066 -0.334 25109
8803 1 16 . 1 1 80 80 GLU C C 80 175.827 175.827 175.680 0.147 25109
8804 1 16 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.871 -0.404 25109
8805 1 16 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.347 -2.630 25109
8806 1 16 . 1 1 80 80 GLU H H 80 7.772 7.772 8.000 -0.228 25109
8807 1 16 . 1 1 81 81 LEU N N 81 124.692 124.692 121.537 3.155 25109
8808 1 16 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.408 0.283 25109
8809 1 16 . 1 1 81 81 LEU CA C 81 52.955 52.955 54.064 -1.109 25109
8810 1 16 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.268 -0.877 25109
8811 1 16 . 1 1 81 81 LEU H H 81 8.167 8.167 7.586 0.581 25109
8812 1 16 . 1 1 82 82 VAL N N 82 118.320 118.320 123.644 -5.324 25109
8813 1 16 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.618 -0.441 25109
8814 1 16 . 1 1 82 82 VAL CA C 82 66.710 66.710 67.105 -0.395 25109
8815 1 16 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.827 0.121 25109
8816 1 16 . 1 1 82 82 VAL H H 82 7.141 7.141 7.756 -0.615 25109
8817 1 16 . 1 1 83 83 ASP N N 83 118.733 118.733 118.640 0.093 25109
8818 1 16 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.306 0.026 25109
8819 1 16 . 1 1 83 83 ASP C C 83 178.674 178.674 178.187 0.487 25109
8820 1 16 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.896 -1.453 25109
8821 1 16 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.472 -3.643 25109
8822 1 16 . 1 1 83 83 ASP H H 83 8.385 8.385 8.876 -0.491 25109
8823 1 16 . 1 1 84 84 LEU N N 84 121.026 121.026 120.436 0.590 25109
8824 1 16 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.166 -0.187 25109
8825 1 16 . 1 1 84 84 LEU C C 84 178.796 178.796 178.653 0.143 25109
8826 1 16 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.763 -0.241 25109
8827 1 16 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.632 0.863 25109
8828 1 16 . 1 1 84 84 LEU H H 84 7.770 7.770 8.013 -0.243 25109
8829 1 16 . 1 1 85 85 ALA N N 85 121.525 121.525 122.324 -0.799 25109
8830 1 16 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.957 -0.296 25109
8831 1 16 . 1 1 85 85 ALA C C 85 179.322 179.322 179.096 0.226 25109
8832 1 16 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.052 0.789 25109
8833 1 16 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.218 0.709 25109
8834 1 16 . 1 1 85 85 ALA H H 85 8.126 8.126 7.697 0.429 25109
8835 1 16 . 1 1 86 86 ASP N N 86 115.349 115.349 118.835 -3.486 25109
8836 1 16 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.361 -0.088 25109
8837 1 16 . 1 1 86 86 ASP C C 86 178.463 178.463 178.549 -0.086 25109
8838 1 16 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.604 -1.893 25109
8839 1 16 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.991 -3.829 25109
8840 1 16 . 1 1 86 86 ASP H H 86 8.410 8.410 8.426 -0.016 25109
8841 1 16 . 1 1 87 87 GLU N N 87 122.529 122.529 119.286 3.243 25109
8842 1 16 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.130 -0.094 25109
8843 1 16 . 1 1 87 87 GLU C C 87 178.508 178.508 179.591 -1.083 25109
8844 1 16 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.557 -0.203 25109
8845 1 16 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.693 -1.420 25109
8846 1 16 . 1 1 87 87 GLU H H 87 8.012 8.012 8.286 -0.274 25109
8847 1 16 . 1 1 88 88 VAL N N 88 119.148 119.148 119.541 -0.393 25109
8848 1 16 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.840 -0.510 25109
8849 1 16 . 1 1 88 88 VAL C C 88 177.240 177.240 178.058 -0.818 25109
8850 1 16 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.244 1.005 25109
8851 1 16 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.687 -0.158 25109
8852 1 16 . 1 1 88 88 VAL H H 88 8.291 8.291 7.652 0.639 25109
8853 1 16 . 1 1 89 89 ALA N N 89 120.709 120.709 123.180 -2.471 25109
8854 1 16 . 1 1 89 89 ALA HA H 89 3.915 3.915 3.970 -0.055 25109
8855 1 16 . 1 1 89 89 ALA C C 89 180.186 180.186 179.193 0.993 25109
8856 1 16 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.203 0.856 25109
8857 1 16 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.178 0.057 25109
8858 1 16 . 1 1 89 89 ALA H H 89 8.548 8.548 8.689 -0.141 25109
8859 1 16 . 1 1 90 90 SER N N 90 113.035 113.035 113.539 -0.504 25109
8860 1 16 . 1 1 90 90 SER HA H 90 4.047 4.047 4.104 -0.057 25109
8861 1 16 . 1 1 90 90 SER C C 90 177.564 177.564 176.456 1.108 25109
8862 1 16 . 1 1 90 90 SER CA C 90 61.771 61.771 61.427 0.344 25109
8863 1 16 . 1 1 90 90 SER CB C 90 62.907 62.907 63.247 -0.340 25109
8864 1 16 . 1 1 90 90 SER H H 90 7.969 7.969 8.324 -0.355 25109
8865 1 16 . 1 1 91 91 VAL N N 91 123.417 123.417 121.370 2.047 25109
8866 1 16 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.574 -0.227 25109
8867 1 16 . 1 1 91 91 VAL C C 91 178.428 178.428 178.244 0.184 25109
8868 1 16 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.658 0.471 25109
8869 1 16 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.251 0.520 25109
8870 1 16 . 1 1 91 91 VAL H H 91 7.713 7.713 7.182 0.531 25109
8871 1 16 . 1 1 92 92 TYR N N 92 121.458 121.458 120.302 1.156 25109
8872 1 16 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.362 -0.171 25109
8873 1 16 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.310 0.684 25109
8874 1 16 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.428 0.557 25109
8875 1 16 . 1 1 92 92 TYR H H 92 8.395 8.395 8.328 0.067 25109
8876 1 16 . 1 1 93 93 GLN N N 93 115.549 115.549 116.722 -1.173 25109
8877 1 16 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.095 -0.384 25109
8878 1 16 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.815 0.279 25109
8879 1 16 . 1 1 93 93 GLN CB C 93 28.298 28.298 29.052 -0.754 25109
8880 1 16 . 1 1 93 93 GLN H H 93 8.167 8.167 7.891 0.276 25109
8881 1 16 . 1 1 94 94 SER N N 94 115.923 115.923 113.714 2.209 25109
8882 1 16 . 1 1 94 94 SER HA H 94 4.096 4.096 4.258 -0.162 25109
8883 1 16 . 1 1 94 94 SER CA C 94 60.971 60.971 59.266 1.705 25109
8884 1 16 . 1 1 94 94 SER CB C 94 62.635 62.635 64.268 -1.633 25109
8885 1 16 . 1 1 94 94 SER H H 94 7.642 7.642 7.664 -0.022 25109
8886 1 16 . 1 1 95 95 TYR N N 95 119.565 119.565 122.948 -3.383 25109
8887 1 16 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.536 0.223 25109
8888 1 16 . 1 1 95 95 TYR C C 95 175.334 175.334 173.882 1.452 25109
8889 1 16 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.882 0.816 25109
8890 1 16 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.145 2.174 25109
8891 1 16 . 1 1 95 95 TYR H H 95 7.069 7.069 7.371 -0.302 25109
8892 1 16 . 1 1 96 96 GLN N N 96 119.872 119.872 119.163 0.709 25109
8893 1 16 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.907 0.458 25109
8894 1 16 . 1 1 96 96 GLN C C 96 173.612 173.612 173.811 -0.199 25109
8895 1 16 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.211 -0.875 25109
8896 1 16 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.279 1.215 25109
8897 1 16 . 1 1 96 96 GLN H H 96 7.409 7.409 8.169 -0.760 25109
8898 1 16 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.255 0.063 25109
8899 1 16 . 1 1 97 97 PRO CA C 97 63.014 63.014 64.272 -1.258 25109
8900 1 16 . 1 1 97 97 PRO CB C 97 32.098 32.098 31.984 0.114 25109
8901 1 16 . 1 1 98 98 ARG N N 98 121.759 121.759 120.296 1.463 25109
8902 1 16 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.619 -0.277 25109
8903 1 16 . 1 1 98 98 ARG C C 98 176.848 176.848 176.536 0.312 25109
8904 1 16 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.772 1.449 25109
8905 1 16 . 1 1 98 98 ARG CB C 98 31.087 31.087 29.757 1.330 25109
8906 1 16 . 1 1 98 98 ARG H H 98 8.423 8.423 7.881 0.542 25109
8907 1 16 . 1 1 99 99 THR N N 99 115.292 115.292 117.674 -2.382 25109
8908 1 16 . 1 1 99 99 THR HA H 99 4.323 4.323 4.284 0.039 25109
8909 1 16 . 1 1 99 99 THR C C 99 174.350 174.350 174.133 0.217 25109
8910 1 16 . 1 1 99 99 THR CA C 99 61.906 61.906 64.845 -2.939 25109
8911 1 16 . 1 1 99 99 THR CB C 99 70.180 70.180 69.631 0.549 25109
8912 1 16 . 1 1 99 99 THR H H 99 8.179 8.179 8.628 -0.449 25109
8913 1 17 . 1 1 0 0 SER N N 0 115.693 115.693 115.834 -0.141 25109
8914 1 17 . 1 1 0 0 SER HA H 0 4.531 4.531 4.877 -0.346 25109
8915 1 17 . 1 1 0 0 SER C C 0 174.557 174.557 174.101 0.456 25109
8916 1 17 . 1 1 0 0 SER CA C 0 58.478 58.478 57.997 0.481 25109
8917 1 17 . 1 1 0 0 SER CB C 0 64.380 64.380 64.374 0.006 25109
8918 1 17 . 1 1 0 0 SER H H 0 8.631 8.631 8.550 0.081 25109
8919 1 17 . 1 1 1 1 MET N N 1 123.111 123.111 121.651 1.460 25109
8920 1 17 . 1 1 1 1 MET HA H 1 4.728 4.728 4.765 -0.037 25109
8921 1 17 . 1 1 1 1 MET C C 1 174.846 174.846 173.892 0.954 25109
8922 1 17 . 1 1 1 1 MET CA C 1 55.655 55.655 53.454 2.201 25109
8923 1 17 . 1 1 1 1 MET CB C 1 32.035 32.035 33.165 -1.130 25109
8924 1 17 . 1 1 1 1 MET H H 1 8.641 8.641 8.308 0.333 25109
8925 1 17 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.768 -0.291 25109
8926 1 17 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.446 -0.446 25109
8927 1 17 . 1 1 3 3 PHE N N 3 121.126 121.126 121.939 -0.813 25109
8928 1 17 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.496 -0.130 25109
8929 1 17 . 1 1 3 3 PHE CA C 3 60.862 60.862 60.528 0.334 25109
8930 1 17 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.886 -1.518 25109
8931 1 17 . 1 1 3 3 PHE H H 3 8.177 8.177 8.640 -0.463 25109
8932 1 17 . 1 1 4 4 ALA N N 4 121.170 121.170 121.298 -0.128 25109
8933 1 17 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.071 -0.236 25109
8934 1 17 . 1 1 4 4 ALA C C 4 181.522 181.522 178.704 2.818 25109
8935 1 17 . 1 1 4 4 ALA CA C 4 55.454 55.454 54.972 0.482 25109
8936 1 17 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.584 0.852 25109
8937 1 17 . 1 1 4 4 ALA H H 4 8.444 8.444 8.790 -0.346 25109
8938 1 17 . 1 1 5 5 GLU N N 5 118.932 118.932 118.937 -0.005 25109
8939 1 17 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.767 0.088 25109
8940 1 17 . 1 1 5 5 GLU C C 5 177.971 177.971 178.250 -0.279 25109
8941 1 17 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.902 0.729 25109
8942 1 17 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.690 0.071 25109
8943 1 17 . 1 1 5 5 GLU H H 5 8.454 8.454 8.743 -0.289 25109
8944 1 17 . 1 1 6 6 ASP N N 6 120.471 120.471 118.251 2.220 25109
8945 1 17 . 1 1 6 6 ASP C C 6 178.885 178.885 178.093 0.792 25109
8946 1 17 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.231 -0.159 25109
8947 1 17 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.603 -1.471 25109
8948 1 17 . 1 1 6 6 ASP H H 6 8.316 8.316 8.409 -0.093 25109
8949 1 17 . 1 1 7 7 LYS N N 7 118.335 118.335 118.497 -0.162 25109
8950 1 17 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.973 -0.283 25109
8951 1 17 . 1 1 7 7 LYS C C 7 180.080 180.080 178.935 1.145 25109
8952 1 17 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.504 0.216 25109
8953 1 17 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.206 0.588 25109
8954 1 17 . 1 1 7 7 LYS H H 7 8.249 8.249 7.280 0.969 25109
8955 1 17 . 1 1 8 8 THR N N 8 119.222 119.222 115.763 3.459 25109
8956 1 17 . 1 1 8 8 THR HA H 8 3.975 3.975 4.049 -0.074 25109
8957 1 17 . 1 1 8 8 THR CA C 8 68.453 68.453 65.836 2.617 25109
8958 1 17 . 1 1 8 8 THR CB C 8 67.387 67.387 68.907 -1.520 25109
8959 1 17 . 1 1 8 8 THR H H 8 7.897 7.897 8.107 -0.210 25109
8960 1 17 . 1 1 9 9 TYR N N 9 123.054 123.054 122.688 0.366 25109
8961 1 17 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.159 0.094 25109
8962 1 17 . 1 1 9 9 TYR C C 9 177.441 177.441 177.009 0.432 25109
8963 1 17 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.191 -0.293 25109
8964 1 17 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.369 -0.520 25109
8965 1 17 . 1 1 9 9 TYR H H 9 8.605 8.605 8.115 0.490 25109
8966 1 17 . 1 1 10 10 LYS N N 10 118.366 118.366 118.692 -0.326 25109
8967 1 17 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.617 -0.023 25109
8968 1 17 . 1 1 10 10 LYS C C 10 178.885 178.885 178.749 0.136 25109
8969 1 17 . 1 1 10 10 LYS CA C 10 60.044 60.044 59.575 0.469 25109
8970 1 17 . 1 1 10 10 LYS CB C 10 32.045 32.045 32.193 -0.148 25109
8971 1 17 . 1 1 10 10 LYS H H 10 8.066 8.066 7.725 0.341 25109
8972 1 17 . 1 1 11 11 TYR N N 11 120.539 120.539 120.573 -0.034 25109
8973 1 17 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.138 -0.148 25109
8974 1 17 . 1 1 11 11 TYR C C 11 178.233 178.233 177.123 1.110 25109
8975 1 17 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.391 1.137 25109
8976 1 17 . 1 1 11 11 TYR CB C 11 38.363 38.363 38.713 -0.350 25109
8977 1 17 . 1 1 11 11 TYR H H 11 7.875 7.875 7.987 -0.112 25109
8978 1 17 . 1 1 12 12 ILE N N 12 121.893 121.893 116.304 5.589 25109
8979 1 17 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.818 -0.722 25109
8980 1 17 . 1 1 12 12 ILE C C 12 177.015 177.015 177.996 -0.981 25109
8981 1 17 . 1 1 12 12 ILE CA C 12 65.763 65.763 61.979 3.784 25109
8982 1 17 . 1 1 12 12 ILE CB C 12 37.552 37.552 37.141 0.411 25109
8983 1 17 . 1 1 12 12 ILE H H 12 8.154 8.154 7.955 0.199 25109
8984 1 17 . 1 1 13 13 CYS N N 13 113.894 113.894 120.149 -6.255 25109
8985 1 17 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.891 -0.004 25109
8986 1 17 . 1 1 13 13 CYS C C 13 178.288 178.288 177.267 1.021 25109
8987 1 17 . 1 1 13 13 CYS CA C 13 64.337 64.337 62.042 2.295 25109
8988 1 17 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.288 0.717 25109
8989 1 17 . 1 1 13 13 CYS H H 13 7.551 7.551 8.356 -0.805 25109
8990 1 17 . 1 1 14 14 ARG N N 14 119.228 119.228 119.158 0.070 25109
8991 1 17 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.090 -0.020 25109
8992 1 17 . 1 1 14 14 ARG C C 14 177.127 177.127 176.477 0.650 25109
8993 1 17 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.273 0.221 25109
8994 1 17 . 1 1 14 14 ARG CB C 14 30.422 30.422 29.572 0.850 25109
8995 1 17 . 1 1 14 14 ARG H H 14 7.991 7.991 7.723 0.268 25109
8996 1 17 . 1 1 15 15 ASN N N 15 117.367 117.367 115.615 1.752 25109
8997 1 17 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.941 0.028 25109
8998 1 17 . 1 1 15 15 ASN CA C 15 52.763 52.763 51.810 0.953 25109
8999 1 17 . 1 1 15 15 ASN CB C 15 38.585 38.585 39.262 -0.677 25109
9000 1 17 . 1 1 15 15 ASN H H 15 7.643 7.643 7.772 -0.129 25109
9001 1 17 . 1 1 16 16 PHE N N 16 122.356 122.356 123.339 -0.983 25109
9002 1 17 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.984 0.232 25109
9003 1 17 . 1 1 16 16 PHE C C 16 178.084 178.084 177.021 1.063 25109
9004 1 17 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.731 1.446 25109
9005 1 17 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.206 1.383 25109
9006 1 17 . 1 1 16 16 PHE H H 16 6.992 6.992 7.555 -0.563 25109
9007 1 17 . 1 1 17 17 SER N N 17 112.937 112.937 112.260 0.677 25109
9008 1 17 . 1 1 17 17 SER HA H 17 4.199 4.199 3.992 0.207 25109
9009 1 17 . 1 1 17 17 SER C C 17 176.726 176.726 176.234 0.492 25109
9010 1 17 . 1 1 17 17 SER CA C 17 62.052 62.052 60.324 1.728 25109
9011 1 17 . 1 1 17 17 SER CB C 17 62.552 62.552 62.994 -0.442 25109
9012 1 17 . 1 1 17 17 SER H H 17 8.840 8.840 8.455 0.385 25109
9013 1 17 . 1 1 18 18 ASN N N 18 118.809 118.809 121.446 -2.637 25109
9014 1 17 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.611 -0.253 25109
9015 1 17 . 1 1 18 18 ASN C C 18 175.967 175.967 176.057 -0.090 25109
9016 1 17 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.316 -0.406 25109
9017 1 17 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.763 -0.935 25109
9018 1 17 . 1 1 18 18 ASN H H 18 8.130 8.130 8.597 -0.467 25109
9019 1 17 . 1 1 19 19 PHE N N 19 115.750 115.750 117.287 -1.537 25109
9020 1 17 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.652 -0.367 25109
9021 1 17 . 1 1 19 19 PHE C C 19 175.370 175.370 176.118 -0.748 25109
9022 1 17 . 1 1 19 19 PHE CA C 19 58.862 58.862 57.947 0.915 25109
9023 1 17 . 1 1 19 19 PHE CB C 19 39.878 39.878 39.029 0.848 25109
9024 1 17 . 1 1 19 19 PHE H H 19 8.062 8.062 7.799 0.263 25109
9025 1 17 . 1 1 20 20 CYS N N 20 113.958 113.958 118.314 -4.356 25109
9026 1 17 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.665 -0.722 25109
9027 1 17 . 1 1 20 20 CYS C C 20 173.823 173.823 174.922 -1.099 25109
9028 1 17 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.327 3.461 25109
9029 1 17 . 1 1 20 20 CYS CB C 20 27.383 27.383 26.951 0.432 25109
9030 1 17 . 1 1 20 20 CYS H H 20 6.850 6.850 7.404 -0.554 25109
9031 1 17 . 1 1 21 21 ASN N N 21 116.691 116.691 117.173 -0.482 25109
9032 1 17 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.766 -0.022 25109
9033 1 17 . 1 1 21 21 ASN C C 21 175.299 175.299 174.647 0.652 25109
9034 1 17 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.372 -0.082 25109
9035 1 17 . 1 1 21 21 ASN CB C 21 38.313 38.313 38.792 -0.479 25109
9036 1 17 . 1 1 21 21 ASN H H 21 8.251 8.251 7.765 0.486 25109
9037 1 17 . 1 1 22 22 VAL N N 22 122.431 122.431 119.042 3.389 25109
9038 1 17 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.157 -0.607 25109
9039 1 17 . 1 1 22 22 VAL C C 22 174.034 174.034 174.268 -0.234 25109
9040 1 17 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.782 3.155 25109
9041 1 17 . 1 1 22 22 VAL CB C 22 31.523 31.523 34.165 -2.642 25109
9042 1 17 . 1 1 22 22 VAL H H 22 7.573 7.573 7.335 0.238 25109
9043 1 17 . 1 1 23 23 ASP N N 23 127.219 127.219 124.472 2.747 25109
9044 1 17 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.836 -1.650 25109
9045 1 17 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.506 -2.713 25109
9046 1 17 . 1 1 23 23 ASP H H 23 8.687 8.687 8.616 0.071 25109
9047 1 17 . 1 1 24 24 VAL N N 24 127.835 127.835 125.720 2.115 25109
9048 1 17 . 1 1 24 24 VAL HA H 24 3.293 3.293 3.915 -0.622 25109
9049 1 17 . 1 1 24 24 VAL C C 24 176.867 176.867 177.417 -0.550 25109
9050 1 17 . 1 1 24 24 VAL CA C 24 67.163 67.163 65.550 1.613 25109
9051 1 17 . 1 1 24 24 VAL CB C 24 32.015 32.015 31.392 0.623 25109
9052 1 17 . 1 1 24 24 VAL H H 24 9.409 9.409 8.642 0.767 25109
9053 1 17 . 1 1 25 25 VAL N N 25 114.324 114.324 115.569 -1.245 25109
9054 1 17 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.915 -0.396 25109
9055 1 17 . 1 1 25 25 VAL C C 25 178.006 178.006 177.487 0.519 25109
9056 1 17 . 1 1 25 25 VAL CA C 25 66.688 66.688 64.481 2.207 25109
9057 1 17 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.299 0.233 25109
9058 1 17 . 1 1 25 25 VAL H H 25 8.038 8.038 7.625 0.413 25109
9059 1 17 . 1 1 26 26 GLU N N 26 117.009 117.009 119.353 -2.344 25109
9060 1 17 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.207 -0.117 25109
9061 1 17 . 1 1 26 26 GLU C C 26 177.303 177.303 178.328 -1.025 25109
9062 1 17 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.578 -1.147 25109
9063 1 17 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.839 -0.874 25109
9064 1 17 . 1 1 26 26 GLU H H 26 7.220 7.220 8.491 -1.271 25109
9065 1 17 . 1 1 27 27 ILE N N 27 114.080 114.080 118.832 -4.752 25109
9066 1 17 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.795 0.566 25109
9067 1 17 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.810 -2.078 25109
9068 1 17 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.097 1.494 25109
9069 1 17 . 1 1 27 27 ILE H H 27 7.647 7.647 7.345 0.302 25109
9070 1 17 . 1 1 28 28 LEU N N 28 121.867 121.867 119.931 1.936 25109
9071 1 17 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.136 -0.199 25109
9072 1 17 . 1 1 28 28 LEU C C 28 175.756 175.756 176.713 -0.957 25109
9073 1 17 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.205 -0.237 25109
9074 1 17 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.816 0.697 25109
9075 1 17 . 1 1 28 28 LEU H H 28 7.434 7.434 7.430 0.004 25109
9076 1 17 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.323 -0.113 25109
9077 1 17 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.095 0.215 25109
9078 1 17 . 1 1 30 30 TYR N N 30 113.832 113.832 116.967 -3.135 25109
9079 1 17 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.467 0.035 25109
9080 1 17 . 1 1 30 30 TYR C C 30 174.386 174.386 175.356 -0.970 25109
9081 1 17 . 1 1 30 30 TYR CA C 30 57.694 57.694 60.202 -2.508 25109
9082 1 17 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.605 -0.506 25109
9083 1 17 . 1 1 30 30 TYR H H 30 7.628 7.628 7.619 0.009 25109
9084 1 17 . 1 1 31 31 LEU N N 31 118.331 118.331 119.295 -0.964 25109
9085 1 17 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.748 0.129 25109
9086 1 17 . 1 1 31 31 LEU C C 31 173.849 173.849 175.547 -1.698 25109
9087 1 17 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.793 -0.101 25109
9088 1 17 . 1 1 31 31 LEU CB C 31 42.802 42.802 41.956 0.846 25109
9089 1 17 . 1 1 31 31 LEU H H 31 7.619 7.619 7.402 0.217 25109
9090 1 17 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.388 -0.033 25109
9091 1 17 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.729 -0.319 25109
9092 1 17 . 1 1 33 33 CYS N N 33 110.978 110.978 114.238 -3.260 25109
9093 1 17 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.190 0.151 25109
9094 1 17 . 1 1 33 33 CYS C C 33 174.139 174.139 174.435 -0.296 25109
9095 1 17 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.071 -1.859 25109
9096 1 17 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.850 1.072 25109
9097 1 17 . 1 1 33 33 CYS H H 33 6.414 6.414 7.409 -0.995 25109
9098 1 17 . 1 1 34 34 LEU N N 34 123.111 123.111 122.196 0.915 25109
9099 1 17 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.413 0.193 25109
9100 1 17 . 1 1 34 34 LEU C C 34 176.646 176.646 175.941 0.705 25109
9101 1 17 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.126 -0.235 25109
9102 1 17 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.851 -0.160 25109
9103 1 17 . 1 1 34 34 LEU H H 34 7.550 7.550 7.196 0.354 25109
9104 1 17 . 1 1 35 35 THR N N 35 113.831 113.831 116.881 -3.050 25109
9105 1 17 . 1 1 35 35 THR HA H 35 4.205 4.205 4.266 -0.061 25109
9106 1 17 . 1 1 35 35 THR C C 35 175.324 175.324 175.849 -0.525 25109
9107 1 17 . 1 1 35 35 THR CA C 35 61.200 61.200 61.858 -0.658 25109
9108 1 17 . 1 1 35 35 THR CB C 35 71.318 71.318 70.057 1.261 25109
9109 1 17 . 1 1 35 35 THR H H 35 8.586 8.586 8.005 0.581 25109
9110 1 17 . 1 1 36 36 ALA N N 36 124.128 124.128 127.793 -3.665 25109
9111 1 17 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.017 -0.093 25109
9112 1 17 . 1 1 36 36 ALA C C 36 180.397 180.397 179.840 0.557 25109
9113 1 17 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.841 0.079 25109
9114 1 17 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.567 -0.764 25109
9115 1 17 . 1 1 36 36 ALA H H 36 8.836 8.836 8.817 0.019 25109
9116 1 17 . 1 1 37 37 ARG N N 37 116.793 116.793 118.298 -1.505 25109
9117 1 17 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.076 -0.090 25109
9118 1 17 . 1 1 37 37 ARG C C 37 179.272 179.272 177.998 1.274 25109
9119 1 17 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.477 -0.245 25109
9120 1 17 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.648 0.257 25109
9121 1 17 . 1 1 37 37 ARG H H 37 8.060 8.060 8.740 -0.680 25109
9122 1 17 . 1 1 38 38 ASP N N 38 120.030 120.030 119.264 0.766 25109
9123 1 17 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.382 -0.134 25109
9124 1 17 . 1 1 38 38 ASP C C 38 178.885 178.885 178.432 0.453 25109
9125 1 17 . 1 1 38 38 ASP CA C 38 57.187 57.187 58.068 -0.881 25109
9126 1 17 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.236 0.697 25109
9127 1 17 . 1 1 38 38 ASP H H 38 7.782 7.782 8.334 -0.552 25109
9128 1 17 . 1 1 39 39 GLN N N 39 118.223 118.223 118.774 -0.551 25109
9129 1 17 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.915 -0.250 25109
9130 1 17 . 1 1 39 39 GLN C C 39 178.041 178.041 177.967 0.074 25109
9131 1 17 . 1 1 39 39 GLN CA C 39 60.601 60.601 59.108 1.493 25109
9132 1 17 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.696 -0.899 25109
9133 1 17 . 1 1 39 39 GLN H H 39 8.476 8.476 8.380 0.096 25109
9134 1 17 . 1 1 40 40 ASP N N 40 117.908 117.908 120.190 -2.282 25109
9135 1 17 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.260 -0.007 25109
9136 1 17 . 1 1 40 40 ASP C C 40 178.639 178.639 178.099 0.540 25109
9137 1 17 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.533 -1.133 25109
9138 1 17 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.769 -2.741 25109
9139 1 17 . 1 1 40 40 ASP H H 40 8.386 8.386 8.380 0.006 25109
9140 1 17 . 1 1 41 41 ARG N N 41 120.990 120.990 119.239 1.751 25109
9141 1 17 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.929 0.113 25109
9142 1 17 . 1 1 41 41 ARG C C 41 179.795 179.795 178.154 1.641 25109
9143 1 17 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.803 -0.358 25109
9144 1 17 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.175 0.083 25109
9145 1 17 . 1 1 41 41 ARG H H 41 8.130 8.130 7.877 0.253 25109
9146 1 17 . 1 1 42 42 LEU N N 42 121.219 121.219 118.771 2.448 25109
9147 1 17 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.120 -0.185 25109
9148 1 17 . 1 1 42 42 LEU C C 42 178.850 178.850 178.849 0.001 25109
9149 1 17 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.324 0.943 25109
9150 1 17 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.564 0.469 25109
9151 1 17 . 1 1 42 42 LEU H H 42 8.179 8.179 7.360 0.819 25109
9152 1 17 . 1 1 43 43 ARG N N 43 119.310 119.310 120.106 -0.796 25109
9153 1 17 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.788 -0.064 25109
9154 1 17 . 1 1 43 43 ARG C C 43 179.099 179.099 178.430 0.669 25109
9155 1 17 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.922 0.892 25109
9156 1 17 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.256 -0.077 25109
9157 1 17 . 1 1 43 43 ARG H H 43 8.296 8.296 8.640 -0.344 25109
9158 1 17 . 1 1 44 44 ALA N N 44 121.305 121.305 118.531 2.774 25109
9159 1 17 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.200 -0.097 25109
9160 1 17 . 1 1 44 44 ALA C C 44 180.924 180.924 178.987 1.937 25109
9161 1 17 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.694 0.531 25109
9162 1 17 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.508 -0.412 25109
9163 1 17 . 1 1 44 44 ALA H H 44 7.774 7.774 7.668 0.106 25109
9164 1 17 . 1 1 45 45 THR N N 45 115.017 115.017 114.468 0.549 25109
9165 1 17 . 1 1 45 45 THR HA H 45 3.879 3.879 4.159 -0.280 25109
9166 1 17 . 1 1 45 45 THR CA C 45 66.327 66.327 65.672 0.655 25109
9167 1 17 . 1 1 45 45 THR CB C 45 68.809 68.809 68.729 0.080 25109
9168 1 17 . 1 1 45 45 THR H H 45 8.167 8.167 7.311 0.856 25109
9169 1 17 . 1 1 46 46 CYS N N 46 123.609 123.609 120.691 2.918 25109
9170 1 17 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.368 -0.349 25109
9171 1 17 . 1 1 46 46 CYS C C 46 178.077 178.077 175.518 2.559 25109
9172 1 17 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.881 1.064 25109
9173 1 17 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.597 -0.458 25109
9174 1 17 . 1 1 46 46 CYS H H 46 8.084 8.084 8.361 -0.277 25109
9175 1 17 . 1 1 47 47 THR N N 47 115.520 115.520 114.973 0.547 25109
9176 1 17 . 1 1 47 47 THR HA H 47 3.915 3.915 4.147 -0.232 25109
9177 1 17 . 1 1 47 47 THR CA C 47 66.063 66.063 65.779 0.284 25109
9178 1 17 . 1 1 47 47 THR CB C 47 69.245 69.245 68.742 0.503 25109
9179 1 17 . 1 1 47 47 THR H H 47 7.735 7.735 7.564 0.171 25109
9180 1 17 . 1 1 48 48 LEU N N 48 120.099 120.099 120.825 -0.726 25109
9181 1 17 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.355 -0.129 25109
9182 1 17 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.842 0.721 25109
9183 1 17 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.700 0.925 25109
9184 1 17 . 1 1 48 48 LEU H H 48 7.464 7.464 7.430 0.034 25109
9185 1 17 . 1 1 49 49 SER N N 49 111.979 111.979 111.731 0.248 25109
9186 1 17 . 1 1 49 49 SER HA H 49 4.661 4.661 4.525 0.136 25109
9187 1 17 . 1 1 49 49 SER C C 49 175.581 175.581 175.772 -0.191 25109
9188 1 17 . 1 1 49 49 SER CA C 49 59.590 59.590 58.978 0.612 25109
9189 1 17 . 1 1 49 49 SER CB C 49 65.335 65.335 64.382 0.953 25109
9190 1 17 . 1 1 49 49 SER H H 49 8.781 8.781 8.489 0.291 25109
9191 1 17 . 1 1 50 50 GLY N N 50 110.194 110.194 110.413 -0.219 25109
9192 1 17 . 1 1 50 50 GLY C C 50 175.123 175.123 174.128 0.995 25109
9193 1 17 . 1 1 50 50 GLY CA C 50 44.902 44.902 46.312 -1.410 25109
9194 1 17 . 1 1 50 50 GLY H H 50 7.955 7.955 8.127 -0.172 25109
9195 1 17 . 1 1 51 51 ASN N N 51 121.050 121.050 120.893 0.157 25109
9196 1 17 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.901 -0.651 25109
9197 1 17 . 1 1 51 51 ASN C C 51 176.403 176.403 176.266 0.137 25109
9198 1 17 . 1 1 51 51 ASN CA C 51 59.303 59.303 53.572 5.731 25109
9199 1 17 . 1 1 51 51 ASN CB C 51 41.599 41.599 39.532 2.067 25109
9200 1 17 . 1 1 51 51 ASN H H 51 8.898 8.898 7.933 0.965 25109
9201 1 17 . 1 1 52 52 ARG N N 52 119.825 119.825 122.122 -2.297 25109
9202 1 17 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.927 0.111 25109
9203 1 17 . 1 1 52 52 ARG C C 52 178.850 178.850 177.635 1.215 25109
9204 1 17 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.389 0.675 25109
9205 1 17 . 1 1 52 52 ARG CB C 52 30.023 30.023 30.048 -0.025 25109
9206 1 17 . 1 1 52 52 ARG H H 52 8.696 8.696 8.603 0.093 25109
9207 1 17 . 1 1 53 53 ASP N N 53 116.032 116.032 117.255 -1.223 25109
9208 1 17 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.606 -0.060 25109
9209 1 17 . 1 1 53 53 ASP C C 53 178.996 178.996 178.864 0.132 25109
9210 1 17 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.370 -1.291 25109
9211 1 17 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.900 -2.529 25109
9212 1 17 . 1 1 53 53 ASP H H 53 9.036 9.036 8.049 0.987 25109
9213 1 17 . 1 1 54 54 THR N N 54 115.848 115.848 117.511 -1.663 25109
9214 1 17 . 1 1 54 54 THR HA H 54 3.746 3.746 4.311 -0.565 25109
9215 1 17 . 1 1 54 54 THR CA C 54 67.885 67.885 65.992 1.893 25109
9216 1 17 . 1 1 54 54 THR CB C 54 66.953 66.953 69.220 -2.267 25109
9217 1 17 . 1 1 54 54 THR H H 54 7.782 7.782 7.926 -0.144 25109
9218 1 17 . 1 1 55 55 LEU N N 55 125.987 125.987 123.698 2.289 25109
9219 1 17 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.196 -0.642 25109
9220 1 17 . 1 1 55 55 LEU C C 55 177.901 177.901 177.963 -0.062 25109
9221 1 17 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.794 -0.341 25109
9222 1 17 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.866 -0.003 25109
9223 1 17 . 1 1 55 55 LEU H H 55 8.740 8.740 8.525 0.215 25109
9224 1 17 . 1 1 56 56 TRP N N 56 116.672 116.672 120.696 -4.024 25109
9225 1 17 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.284 -0.204 25109
9226 1 17 . 1 1 56 56 TRP C C 56 179.588 179.588 178.083 1.505 25109
9227 1 17 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.609 -0.129 25109
9228 1 17 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.308 -0.116 25109
9229 1 17 . 1 1 56 56 TRP H H 56 7.642 7.642 8.490 -0.848 25109
9230 1 17 . 1 1 57 57 HIS N N 57 115.754 115.754 117.680 -1.926 25109
9231 1 17 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.115 0.161 25109
9232 1 17 . 1 1 57 57 HIS C C 57 177.514 177.514 177.595 -0.081 25109
9233 1 17 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.802 -0.850 25109
9234 1 17 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.802 -1.800 25109
9235 1 17 . 1 1 57 57 HIS H H 57 7.407 7.407 7.784 -0.377 25109
9236 1 17 . 1 1 58 58 LEU N N 58 123.934 123.934 122.560 1.374 25109
9237 1 17 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.861 -0.074 25109
9238 1 17 . 1 1 58 58 LEU C C 58 178.115 178.115 177.451 0.664 25109
9239 1 17 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.493 0.416 25109
9240 1 17 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.551 -0.736 25109
9241 1 17 . 1 1 58 58 LEU H H 58 8.996 8.996 8.374 0.622 25109
9242 1 17 . 1 1 59 59 PHE N N 59 117.721 117.721 116.853 0.868 25109
9243 1 17 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.708 0.227 25109
9244 1 17 . 1 1 59 59 PHE C C 59 176.987 176.987 177.999 -1.012 25109
9245 1 17 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.075 -1.962 25109
9246 1 17 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.946 -0.986 25109
9247 1 17 . 1 1 59 59 PHE H H 59 8.201 8.201 8.268 -0.067 25109
9248 1 17 . 1 1 60 60 ASN N N 60 115.695 115.695 117.446 -1.751 25109
9249 1 17 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.251 -0.332 25109
9250 1 17 . 1 1 60 60 ASN C C 60 176.670 176.670 176.803 -0.133 25109
9251 1 17 . 1 1 60 60 ASN CA C 60 56.756 56.756 55.797 0.959 25109
9252 1 17 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.284 1.034 25109
9253 1 17 . 1 1 60 60 ASN H H 60 7.666 7.666 7.975 -0.309 25109
9254 1 17 . 1 1 61 61 THR N N 61 115.110 115.110 116.414 -1.304 25109
9255 1 17 . 1 1 61 61 THR HA H 61 3.733 3.733 4.035 -0.302 25109
9256 1 17 . 1 1 61 61 THR CA C 61 66.319 66.319 65.994 0.325 25109
9257 1 17 . 1 1 61 61 THR CB C 61 69.174 69.174 69.163 0.011 25109
9258 1 17 . 1 1 61 61 THR H H 61 7.782 7.782 7.709 0.073 25109
9259 1 17 . 1 1 62 62 LEU N N 62 121.559 121.559 121.901 -0.342 25109
9260 1 17 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.800 -0.311 25109
9261 1 17 . 1 1 62 62 LEU C C 62 176.600 176.600 178.184 -1.584 25109
9262 1 17 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.906 0.059 25109
9263 1 17 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.862 1.473 25109
9264 1 17 . 1 1 62 62 LEU H H 62 8.362 8.362 8.310 0.052 25109
9265 1 17 . 1 1 63 63 GLN N N 63 109.150 109.150 115.935 -6.785 25109
9266 1 17 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.907 -1.830 25109
9267 1 17 . 1 1 63 63 GLN C C 63 175.194 175.194 176.873 -1.679 25109
9268 1 17 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.666 -1.400 25109
9269 1 17 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.947 -2.253 25109
9270 1 17 . 1 1 63 63 GLN H H 63 6.458 6.458 7.389 -0.931 25109
9271 1 17 . 1 1 64 64 ARG N N 64 116.029 116.029 117.792 -1.763 25109
9272 1 17 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.298 -0.200 25109
9273 1 17 . 1 1 64 64 ARG C C 64 176.459 176.459 176.208 0.251 25109
9274 1 17 . 1 1 64 64 ARG CA C 64 56.143 56.143 56.265 -0.122 25109
9275 1 17 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.811 -0.227 25109
9276 1 17 . 1 1 64 64 ARG H H 64 6.596 6.596 7.304 -0.708 25109
9277 1 17 . 1 1 65 65 ARG N N 65 120.422 120.422 119.526 0.896 25109
9278 1 17 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.869 -0.035 25109
9279 1 17 . 1 1 65 65 ARG C C 65 173.436 173.436 173.897 -0.461 25109
9280 1 17 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.676 -0.131 25109
9281 1 17 . 1 1 65 65 ARG CB C 65 28.996 28.996 30.354 -1.358 25109
9282 1 17 . 1 1 65 65 ARG H H 65 7.932 7.932 7.707 0.225 25109
9283 1 17 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.447 0.127 25109
9284 1 17 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.404 0.654 25109
9285 1 17 . 1 1 67 67 GLY N N 67 111.953 111.953 114.348 -2.395 25109
9286 1 17 . 1 1 67 67 GLY C C 67 177.057 177.057 175.093 1.964 25109
9287 1 17 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.762 1.545 25109
9288 1 17 . 1 1 67 67 GLY H H 67 9.198 9.198 8.237 0.961 25109
9289 1 17 . 1 1 68 68 TRP N N 68 117.467 117.467 119.420 -1.953 25109
9290 1 17 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.151 -0.809 25109
9291 1 17 . 1 1 68 68 TRP C C 68 177.690 177.690 175.557 2.133 25109
9292 1 17 . 1 1 68 68 TRP CA C 68 60.116 60.116 58.387 1.729 25109
9293 1 17 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.663 -0.473 25109
9294 1 17 . 1 1 68 68 TRP H H 68 7.647 7.647 8.035 -0.388 25109
9295 1 17 . 1 1 69 69 VAL N N 69 121.482 121.482 119.506 1.976 25109
9296 1 17 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.333 -0.696 25109
9297 1 17 . 1 1 69 69 VAL C C 69 177.993 177.993 177.419 0.574 25109
9298 1 17 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.814 1.652 25109
9299 1 17 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.233 -0.207 25109
9300 1 17 . 1 1 69 69 VAL H H 69 6.666 6.666 7.482 -0.816 25109
9301 1 17 . 1 1 70 70 GLU N N 70 116.350 116.350 119.185 -2.835 25109
9302 1 17 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.801 0.024 25109
9303 1 17 . 1 1 70 70 GLU C C 70 180.362 180.362 178.830 1.532 25109
9304 1 17 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.512 -0.291 25109
9305 1 17 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.595 -1.290 25109
9306 1 17 . 1 1 70 70 GLU H H 70 7.410 7.410 8.571 -1.161 25109
9307 1 17 . 1 1 71 71 TYR N N 71 116.750 116.750 117.716 -0.966 25109
9308 1 17 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.441 0.009 25109
9309 1 17 . 1 1 71 71 TYR C C 71 178.411 178.411 177.840 0.571 25109
9310 1 17 . 1 1 71 71 TYR CA C 71 61.602 61.602 59.966 1.636 25109
9311 1 17 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.653 -0.298 25109
9312 1 17 . 1 1 71 71 TYR H H 71 7.159 7.159 7.272 -0.113 25109
9313 1 17 . 1 1 72 72 PHE N N 72 121.610 121.610 121.732 -0.122 25109
9314 1 17 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.231 0.271 25109
9315 1 17 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.307 -0.487 25109
9316 1 17 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.369 0.680 25109
9317 1 17 . 1 1 72 72 PHE H H 72 9.007 9.007 8.264 0.743 25109
9318 1 17 . 1 1 73 73 ILE N N 73 119.200 119.200 117.982 1.218 25109
9319 1 17 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.530 -0.350 25109
9320 1 17 . 1 1 73 73 ILE C C 73 177.620 177.620 177.635 -0.015 25109
9321 1 17 . 1 1 73 73 ILE CA C 73 67.197 67.197 63.817 3.380 25109
9322 1 17 . 1 1 73 73 ILE CB C 73 39.023 39.023 36.073 2.950 25109
9323 1 17 . 1 1 73 73 ILE H H 73 8.644 8.644 8.692 -0.048 25109
9324 1 17 . 1 1 74 74 ALA N N 74 119.624 119.624 120.386 -0.762 25109
9325 1 17 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.012 -0.058 25109
9326 1 17 . 1 1 74 74 ALA C C 74 181.030 181.030 179.065 1.965 25109
9327 1 17 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.535 0.876 25109
9328 1 17 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.012 0.124 25109
9329 1 17 . 1 1 74 74 ALA H H 74 7.476 7.476 7.900 -0.424 25109
9330 1 17 . 1 1 75 75 ALA N N 75 123.625 123.625 122.521 1.104 25109
9331 1 17 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.476 0.362 25109
9332 1 17 . 1 1 75 75 ALA C C 75 179.272 179.272 179.134 0.138 25109
9333 1 17 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.540 0.562 25109
9334 1 17 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.349 1.244 25109
9335 1 17 . 1 1 75 75 ALA H H 75 8.524 8.524 7.240 1.284 25109
9336 1 17 . 1 1 76 76 LEU N N 76 118.114 118.114 119.541 -1.427 25109
9337 1 17 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.048 -0.376 25109
9338 1 17 . 1 1 76 76 LEU C C 76 180.001 180.001 178.925 1.076 25109
9339 1 17 . 1 1 76 76 LEU CA C 76 58.256 58.256 56.515 1.741 25109
9340 1 17 . 1 1 76 76 LEU CB C 76 41.619 41.619 39.898 1.721 25109
9341 1 17 . 1 1 76 76 LEU H H 76 8.153 8.153 7.468 0.685 25109
9342 1 17 . 1 1 77 77 ARG N N 77 117.830 117.830 119.625 -1.795 25109
9343 1 17 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.977 -0.530 25109
9344 1 17 . 1 1 77 77 ARG C C 77 180.889 180.889 178.634 2.255 25109
9345 1 17 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.241 1.825 25109
9346 1 17 . 1 1 77 77 ARG CB C 77 29.197 29.197 30.104 -0.907 25109
9347 1 17 . 1 1 77 77 ARG H H 77 7.945 7.945 7.914 0.031 25109
9348 1 17 . 1 1 78 78 GLY N N 78 110.202 110.202 105.776 4.426 25109
9349 1 17 . 1 1 78 78 GLY C C 78 174.807 174.807 176.028 -1.221 25109
9350 1 17 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.407 0.153 25109
9351 1 17 . 1 1 78 78 GLY H H 78 8.269 8.269 7.977 0.292 25109
9352 1 17 . 1 1 79 79 CYS N N 79 115.567 115.567 119.241 -3.674 25109
9353 1 17 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.470 -0.081 25109
9354 1 17 . 1 1 79 79 CYS C C 79 173.025 173.025 175.147 -2.122 25109
9355 1 17 . 1 1 79 79 CYS CA C 79 59.957 59.957 59.707 0.250 25109
9356 1 17 . 1 1 79 79 CYS CB C 79 27.805 27.805 28.626 -0.821 25109
9357 1 17 . 1 1 79 79 CYS H H 79 7.132 7.132 7.445 -0.313 25109
9358 1 17 . 1 1 80 80 GLU N N 80 111.759 111.759 117.610 -5.851 25109
9359 1 17 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.397 -0.664 25109
9360 1 17 . 1 1 80 80 GLU C C 80 175.827 175.827 175.506 0.321 25109
9361 1 17 . 1 1 80 80 GLU CA C 80 57.467 57.467 56.080 1.387 25109
9362 1 17 . 1 1 80 80 GLU CB C 80 24.717 24.717 30.540 -5.822 25109
9363 1 17 . 1 1 80 80 GLU H H 80 7.772 7.772 8.273 -0.501 25109
9364 1 17 . 1 1 81 81 LEU N N 81 124.692 124.692 123.372 1.320 25109
9365 1 17 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.734 -0.043 25109
9366 1 17 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.824 -0.869 25109
9367 1 17 . 1 1 81 81 LEU CB C 81 39.391 39.391 41.379 -1.988 25109
9368 1 17 . 1 1 81 81 LEU H H 81 8.167 8.167 8.431 -0.264 25109
9369 1 17 . 1 1 82 82 VAL N N 82 118.320 118.320 121.427 -3.107 25109
9370 1 17 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.573 -0.396 25109
9371 1 17 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.376 0.334 25109
9372 1 17 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.950 -0.002 25109
9373 1 17 . 1 1 82 82 VAL H H 82 7.141 7.141 7.503 -0.362 25109
9374 1 17 . 1 1 83 83 ASP N N 83 118.733 118.733 120.629 -1.896 25109
9375 1 17 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.351 -0.019 25109
9376 1 17 . 1 1 83 83 ASP C C 83 178.674 178.674 178.566 0.108 25109
9377 1 17 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.857 -1.414 25109
9378 1 17 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.445 -3.616 25109
9379 1 17 . 1 1 83 83 ASP H H 83 8.385 8.385 8.447 -0.062 25109
9380 1 17 . 1 1 84 84 LEU N N 84 121.026 121.026 120.061 0.965 25109
9381 1 17 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.949 0.030 25109
9382 1 17 . 1 1 84 84 LEU C C 84 178.796 178.796 178.949 -0.153 25109
9383 1 17 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.399 0.123 25109
9384 1 17 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.537 0.958 25109
9385 1 17 . 1 1 84 84 LEU H H 84 7.770 7.770 7.464 0.306 25109
9386 1 17 . 1 1 85 85 ALA N N 85 121.525 121.525 121.617 -0.092 25109
9387 1 17 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.836 -0.175 25109
9388 1 17 . 1 1 85 85 ALA C C 85 179.322 179.322 178.960 0.362 25109
9389 1 17 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.167 0.674 25109
9390 1 17 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.115 0.812 25109
9391 1 17 . 1 1 85 85 ALA H H 85 8.126 8.126 7.580 0.546 25109
9392 1 17 . 1 1 86 86 ASP N N 86 115.349 115.349 118.908 -3.559 25109
9393 1 17 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.320 -0.047 25109
9394 1 17 . 1 1 86 86 ASP C C 86 178.463 178.463 178.615 -0.152 25109
9395 1 17 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.910 -2.199 25109
9396 1 17 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.988 -3.826 25109
9397 1 17 . 1 1 86 86 ASP H H 86 8.410 8.410 8.135 0.275 25109
9398 1 17 . 1 1 87 87 GLU N N 87 122.529 122.529 119.583 2.946 25109
9399 1 17 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.099 -0.063 25109
9400 1 17 . 1 1 87 87 GLU C C 87 178.508 178.508 179.138 -0.630 25109
9401 1 17 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.232 0.122 25109
9402 1 17 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.642 -1.369 25109
9403 1 17 . 1 1 87 87 GLU H H 87 8.012 8.012 8.243 -0.231 25109
9404 1 17 . 1 1 88 88 VAL N N 88 119.148 119.148 121.324 -2.176 25109
9405 1 17 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.883 -0.553 25109
9406 1 17 . 1 1 88 88 VAL C C 88 177.240 177.240 178.189 -0.949 25109
9407 1 17 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.340 0.909 25109
9408 1 17 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.744 -0.215 25109
9409 1 17 . 1 1 88 88 VAL H H 88 8.291 8.291 7.839 0.452 25109
9410 1 17 . 1 1 89 89 ALA N N 89 120.709 120.709 122.382 -1.673 25109
9411 1 17 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.077 -0.162 25109
9412 1 17 . 1 1 89 89 ALA C C 89 180.186 180.186 179.647 0.539 25109
9413 1 17 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.365 0.694 25109
9414 1 17 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.118 0.117 25109
9415 1 17 . 1 1 89 89 ALA H H 89 8.548 8.548 8.368 0.180 25109
9416 1 17 . 1 1 90 90 SER N N 90 113.035 113.035 113.268 -0.233 25109
9417 1 17 . 1 1 90 90 SER HA H 90 4.047 4.047 4.230 -0.183 25109
9418 1 17 . 1 1 90 90 SER C C 90 177.564 177.564 176.199 1.365 25109
9419 1 17 . 1 1 90 90 SER CA C 90 61.771 61.771 61.953 -0.182 25109
9420 1 17 . 1 1 90 90 SER CB C 90 62.907 62.907 63.238 -0.331 25109
9421 1 17 . 1 1 90 90 SER H H 90 7.969 7.969 8.051 -0.082 25109
9422 1 17 . 1 1 91 91 VAL N N 91 123.417 123.417 121.790 1.627 25109
9423 1 17 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.746 -0.399 25109
9424 1 17 . 1 1 91 91 VAL C C 91 178.428 178.428 176.820 1.608 25109
9425 1 17 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.568 0.561 25109
9426 1 17 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.949 -0.178 25109
9427 1 17 . 1 1 91 91 VAL H H 91 7.713 7.713 7.542 0.171 25109
9428 1 17 . 1 1 92 92 TYR N N 92 121.458 121.458 118.936 2.522 25109
9429 1 17 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.527 -0.336 25109
9430 1 17 . 1 1 92 92 TYR CA C 92 60.994 60.994 59.225 1.769 25109
9431 1 17 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.481 0.504 25109
9432 1 17 . 1 1 92 92 TYR H H 92 8.395 8.395 8.354 0.041 25109
9433 1 17 . 1 1 93 93 GLN N N 93 115.549 115.549 117.886 -2.337 25109
9434 1 17 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.299 -0.588 25109
9435 1 17 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.698 0.396 25109
9436 1 17 . 1 1 93 93 GLN CB C 93 28.298 28.298 29.154 -0.856 25109
9437 1 17 . 1 1 93 93 GLN H H 93 8.167 8.167 7.560 0.607 25109
9438 1 17 . 1 1 94 94 SER N N 94 115.923 115.923 114.303 1.620 25109
9439 1 17 . 1 1 94 94 SER HA H 94 4.096 4.096 4.300 -0.204 25109
9440 1 17 . 1 1 94 94 SER CA C 94 60.971 60.971 60.516 0.455 25109
9441 1 17 . 1 1 94 94 SER CB C 94 62.635 62.635 64.231 -1.596 25109
9442 1 17 . 1 1 94 94 SER H H 94 7.642 7.642 7.573 0.069 25109
9443 1 17 . 1 1 95 95 TYR N N 95 119.565 119.565 121.830 -2.265 25109
9444 1 17 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.471 0.288 25109
9445 1 17 . 1 1 95 95 TYR C C 95 175.334 175.334 173.997 1.337 25109
9446 1 17 . 1 1 95 95 TYR CA C 95 57.698 57.698 58.060 -0.362 25109
9447 1 17 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.150 2.169 25109
9448 1 17 . 1 1 95 95 TYR H H 95 7.069 7.069 7.744 -0.675 25109
9449 1 17 . 1 1 96 96 GLN N N 96 119.872 119.872 122.243 -2.371 25109
9450 1 17 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.462 -0.097 25109
9451 1 17 . 1 1 96 96 GLN C C 96 173.612 173.612 173.838 -0.226 25109
9452 1 17 . 1 1 96 96 GLN CA C 96 54.336 54.336 53.369 0.967 25109
9453 1 17 . 1 1 96 96 GLN CB C 96 28.494 28.494 29.951 -1.457 25109
9454 1 17 . 1 1 96 96 GLN H H 96 7.409 7.409 7.905 -0.496 25109
9455 1 17 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.272 0.046 25109
9456 1 17 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.480 -0.466 25109
9457 1 17 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.093 0.005 25109
9458 1 17 . 1 1 98 98 ARG N N 98 121.759 121.759 119.852 1.907 25109
9459 1 17 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.634 -0.292 25109
9460 1 17 . 1 1 98 98 ARG C C 98 176.848 176.848 175.322 1.526 25109
9461 1 17 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.442 0.779 25109
9462 1 17 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.418 0.669 25109
9463 1 17 . 1 1 98 98 ARG H H 98 8.423 8.423 8.021 0.402 25109
9464 1 17 . 1 1 99 99 THR N N 99 115.292 115.292 116.656 -1.364 25109
9465 1 17 . 1 1 99 99 THR HA H 99 4.323 4.323 4.334 -0.011 25109
9466 1 17 . 1 1 99 99 THR C C 99 174.350 174.350 174.693 -0.343 25109
9467 1 17 . 1 1 99 99 THR CA C 99 61.906 61.906 63.323 -1.417 25109
9468 1 17 . 1 1 99 99 THR CB C 99 70.180 70.180 69.361 0.819 25109
9469 1 17 . 1 1 99 99 THR H H 99 8.179 8.179 8.580 -0.401 25109
9470 1 18 . 1 1 0 0 SER N N 0 115.693 115.693 118.281 -2.588 25109
9471 1 18 . 1 1 0 0 SER HA H 0 4.531 4.531 4.776 -0.245 25109
9472 1 18 . 1 1 0 0 SER C C 0 174.557 174.557 174.419 0.138 25109
9473 1 18 . 1 1 0 0 SER CA C 0 58.478 58.478 58.642 -0.164 25109
9474 1 18 . 1 1 0 0 SER CB C 0 64.380 64.380 63.702 0.678 25109
9475 1 18 . 1 1 0 0 SER H H 0 8.631 8.631 8.445 0.186 25109
9476 1 18 . 1 1 1 1 MET N N 1 123.111 123.111 121.363 1.748 25109
9477 1 18 . 1 1 1 1 MET HA H 1 4.728 4.728 4.344 0.384 25109
9478 1 18 . 1 1 1 1 MET C C 1 174.846 174.846 173.673 1.173 25109
9479 1 18 . 1 1 1 1 MET CA C 1 55.655 55.655 54.548 1.107 25109
9480 1 18 . 1 1 1 1 MET CB C 1 32.035 32.035 32.076 -0.041 25109
9481 1 18 . 1 1 1 1 MET H H 1 8.641 8.641 8.529 0.112 25109
9482 1 18 . 1 1 2 2 PRO HA H 2 4.477 4.477 5.001 -0.524 25109
9483 1 18 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.279 -0.279 25109
9484 1 18 . 1 1 3 3 PHE N N 3 121.126 121.126 126.109 -4.983 25109
9485 1 18 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.605 -0.239 25109
9486 1 18 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.909 0.953 25109
9487 1 18 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.190 -0.821 25109
9488 1 18 . 1 1 3 3 PHE H H 3 8.177 8.177 9.026 -0.849 25109
9489 1 18 . 1 1 4 4 ALA N N 4 121.170 121.170 122.975 -1.805 25109
9490 1 18 . 1 1 4 4 ALA HA H 4 3.835 3.835 3.830 0.005 25109
9491 1 18 . 1 1 4 4 ALA C C 4 181.522 181.522 178.895 2.627 25109
9492 1 18 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.237 0.217 25109
9493 1 18 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.457 0.979 25109
9494 1 18 . 1 1 4 4 ALA H H 4 8.444 8.444 8.808 -0.364 25109
9495 1 18 . 1 1 5 5 GLU N N 5 118.932 118.932 118.964 -0.032 25109
9496 1 18 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.973 -0.118 25109
9497 1 18 . 1 1 5 5 GLU C C 5 177.971 177.971 178.229 -0.258 25109
9498 1 18 . 1 1 5 5 GLU CA C 5 60.631 60.631 59.974 0.657 25109
9499 1 18 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.551 0.210 25109
9500 1 18 . 1 1 5 5 GLU H H 5 8.454 8.454 8.675 -0.221 25109
9501 1 18 . 1 1 6 6 ASP N N 6 120.471 120.471 119.369 1.102 25109
9502 1 18 . 1 1 6 6 ASP C C 6 178.885 178.885 178.349 0.536 25109
9503 1 18 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.333 -0.261 25109
9504 1 18 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.700 -1.568 25109
9505 1 18 . 1 1 6 6 ASP H H 6 8.316 8.316 8.217 0.099 25109
9506 1 18 . 1 1 7 7 LYS N N 7 118.335 118.335 118.550 -0.215 25109
9507 1 18 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.772 -0.082 25109
9508 1 18 . 1 1 7 7 LYS C C 7 180.080 180.080 179.072 1.008 25109
9509 1 18 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.555 0.165 25109
9510 1 18 . 1 1 7 7 LYS CB C 7 31.794 31.794 30.985 0.809 25109
9511 1 18 . 1 1 7 7 LYS H H 7 8.249 8.249 7.960 0.289 25109
9512 1 18 . 1 1 8 8 THR N N 8 119.222 119.222 116.777 2.445 25109
9513 1 18 . 1 1 8 8 THR HA H 8 3.975 3.975 4.162 -0.187 25109
9514 1 18 . 1 1 8 8 THR CA C 8 68.453 68.453 66.774 1.679 25109
9515 1 18 . 1 1 8 8 THR CB C 8 67.387 67.387 68.883 -1.496 25109
9516 1 18 . 1 1 8 8 THR H H 8 7.897 7.897 7.796 0.101 25109
9517 1 18 . 1 1 9 9 TYR N N 9 123.054 123.054 123.347 -0.293 25109
9518 1 18 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.289 -0.036 25109
9519 1 18 . 1 1 9 9 TYR C C 9 177.441 177.441 177.265 0.176 25109
9520 1 18 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.117 -0.219 25109
9521 1 18 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.418 -0.569 25109
9522 1 18 . 1 1 9 9 TYR H H 9 8.605 8.605 8.324 0.281 25109
9523 1 18 . 1 1 10 10 LYS N N 10 118.366 118.366 117.319 1.047 25109
9524 1 18 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.684 -0.090 25109
9525 1 18 . 1 1 10 10 LYS C C 10 178.885 178.885 178.500 0.385 25109
9526 1 18 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.669 1.375 25109
9527 1 18 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.743 0.302 25109
9528 1 18 . 1 1 10 10 LYS H H 10 8.066 8.066 8.425 -0.359 25109
9529 1 18 . 1 1 11 11 TYR N N 11 120.539 120.539 119.560 0.979 25109
9530 1 18 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.289 -0.299 25109
9531 1 18 . 1 1 11 11 TYR C C 11 178.233 178.233 178.092 0.141 25109
9532 1 18 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.259 1.269 25109
9533 1 18 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.120 -0.757 25109
9534 1 18 . 1 1 11 11 TYR H H 11 7.875 7.875 7.518 0.357 25109
9535 1 18 . 1 1 12 12 ILE N N 12 121.893 121.893 120.643 1.250 25109
9536 1 18 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.839 -0.743 25109
9537 1 18 . 1 1 12 12 ILE C C 12 177.015 177.015 178.257 -1.242 25109
9538 1 18 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.758 2.005 25109
9539 1 18 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.664 0.888 25109
9540 1 18 . 1 1 12 12 ILE H H 12 8.154 8.154 8.683 -0.529 25109
9541 1 18 . 1 1 13 13 CYS N N 13 113.894 113.894 118.041 -4.147 25109
9542 1 18 . 1 1 13 13 CYS HA H 13 3.887 3.887 4.106 -0.219 25109
9543 1 18 . 1 1 13 13 CYS C C 13 178.288 178.288 176.182 2.106 25109
9544 1 18 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.438 2.899 25109
9545 1 18 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.765 0.240 25109
9546 1 18 . 1 1 13 13 CYS H H 13 7.551 7.551 8.298 -0.747 25109
9547 1 18 . 1 1 14 14 ARG N N 14 119.228 119.228 118.574 0.654 25109
9548 1 18 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.210 -0.140 25109
9549 1 18 . 1 1 14 14 ARG C C 14 177.127 177.127 176.589 0.538 25109
9550 1 18 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.472 0.022 25109
9551 1 18 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.257 0.165 25109
9552 1 18 . 1 1 14 14 ARG H H 14 7.991 7.991 7.553 0.438 25109
9553 1 18 . 1 1 15 15 ASN N N 15 117.367 117.367 116.823 0.544 25109
9554 1 18 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.705 0.264 25109
9555 1 18 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.273 0.490 25109
9556 1 18 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.671 0.914 25109
9557 1 18 . 1 1 15 15 ASN H H 15 7.643 7.643 7.659 -0.016 25109
9558 1 18 . 1 1 16 16 PHE N N 16 122.356 122.356 122.188 0.168 25109
9559 1 18 . 1 1 16 16 PHE HA H 16 4.216 4.216 2.522 1.694 25109
9560 1 18 . 1 1 16 16 PHE C C 16 178.084 178.084 176.162 1.922 25109
9561 1 18 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.220 1.957 25109
9562 1 18 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.658 1.931 25109
9563 1 18 . 1 1 16 16 PHE H H 16 6.992 6.992 7.620 -0.628 25109
9564 1 18 . 1 1 17 17 SER N N 17 112.937 112.937 113.479 -0.542 25109
9565 1 18 . 1 1 17 17 SER HA H 17 4.199 4.199 3.697 0.502 25109
9566 1 18 . 1 1 17 17 SER C C 17 176.726 176.726 175.501 1.225 25109
9567 1 18 . 1 1 17 17 SER CA C 17 62.052 62.052 60.537 1.515 25109
9568 1 18 . 1 1 17 17 SER CB C 17 62.552 62.552 62.690 -0.138 25109
9569 1 18 . 1 1 17 17 SER H H 17 8.840 8.840 8.346 0.494 25109
9570 1 18 . 1 1 18 18 ASN N N 18 118.809 118.809 119.022 -0.213 25109
9571 1 18 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.457 -0.099 25109
9572 1 18 . 1 1 18 18 ASN C C 18 175.967 175.967 177.334 -1.367 25109
9573 1 18 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.471 -0.561 25109
9574 1 18 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.589 -0.761 25109
9575 1 18 . 1 1 18 18 ASN H H 18 8.130 8.130 8.164 -0.034 25109
9576 1 18 . 1 1 19 19 PHE N N 19 115.750 115.750 114.276 1.474 25109
9577 1 18 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.707 -0.422 25109
9578 1 18 . 1 1 19 19 PHE C C 19 175.370 175.370 176.357 -0.987 25109
9579 1 18 . 1 1 19 19 PHE CA C 19 58.862 58.862 57.063 1.799 25109
9580 1 18 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.031 1.847 25109
9581 1 18 . 1 1 19 19 PHE H H 19 8.062 8.062 6.930 1.132 25109
9582 1 18 . 1 1 20 20 CYS N N 20 113.958 113.958 120.406 -6.448 25109
9583 1 18 . 1 1 20 20 CYS HA H 20 3.943 3.943 3.802 0.141 25109
9584 1 18 . 1 1 20 20 CYS C C 20 173.823 173.823 174.920 -1.097 25109
9585 1 18 . 1 1 20 20 CYS CA C 20 61.788 61.788 59.534 2.254 25109
9586 1 18 . 1 1 20 20 CYS CB C 20 27.383 27.383 25.963 1.420 25109
9587 1 18 . 1 1 20 20 CYS H H 20 6.850 6.850 7.315 -0.465 25109
9588 1 18 . 1 1 21 21 ASN N N 21 116.691 116.691 118.652 -1.961 25109
9589 1 18 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.668 0.076 25109
9590 1 18 . 1 1 21 21 ASN C C 21 175.299 175.299 175.028 0.271 25109
9591 1 18 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.256 0.034 25109
9592 1 18 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.593 -1.280 25109
9593 1 18 . 1 1 21 21 ASN H H 21 8.251 8.251 7.628 0.623 25109
9594 1 18 . 1 1 22 22 VAL N N 22 122.431 122.431 120.227 2.204 25109
9595 1 18 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.050 -0.500 25109
9596 1 18 . 1 1 22 22 VAL C C 22 174.034 174.034 174.453 -0.419 25109
9597 1 18 . 1 1 22 22 VAL CA C 22 63.937 63.937 61.848 2.089 25109
9598 1 18 . 1 1 22 22 VAL CB C 22 31.523 31.523 33.269 -1.746 25109
9599 1 18 . 1 1 22 22 VAL H H 22 7.573 7.573 7.424 0.149 25109
9600 1 18 . 1 1 23 23 ASP N N 23 127.219 127.219 122.795 4.424 25109
9601 1 18 . 1 1 23 23 ASP CA C 23 52.186 52.186 54.001 -1.815 25109
9602 1 18 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.776 -2.983 25109
9603 1 18 . 1 1 23 23 ASP H H 23 8.687 8.687 8.465 0.222 25109
9604 1 18 . 1 1 24 24 VAL N N 24 127.835 127.835 123.291 4.544 25109
9605 1 18 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.021 -0.728 25109
9606 1 18 . 1 1 24 24 VAL C C 24 176.867 176.867 177.146 -0.279 25109
9607 1 18 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.451 2.712 25109
9608 1 18 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.539 -0.524 25109
9609 1 18 . 1 1 24 24 VAL H H 24 9.409 9.409 8.750 0.659 25109
9610 1 18 . 1 1 25 25 VAL N N 25 114.324 114.324 116.454 -2.130 25109
9611 1 18 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.976 -0.457 25109
9612 1 18 . 1 1 25 25 VAL C C 25 178.006 178.006 177.268 0.738 25109
9613 1 18 . 1 1 25 25 VAL CA C 25 66.688 66.688 64.280 2.408 25109
9614 1 18 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.669 -0.137 25109
9615 1 18 . 1 1 25 25 VAL H H 25 8.038 8.038 7.877 0.161 25109
9616 1 18 . 1 1 26 26 GLU N N 26 117.009 117.009 119.459 -2.450 25109
9617 1 18 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.251 -0.160 25109
9618 1 18 . 1 1 26 26 GLU C C 26 177.303 177.303 178.011 -0.708 25109
9619 1 18 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.259 -0.827 25109
9620 1 18 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.867 -0.902 25109
9621 1 18 . 1 1 26 26 GLU H H 26 7.220 7.220 8.956 -1.736 25109
9622 1 18 . 1 1 27 27 ILE N N 27 114.080 114.080 118.786 -4.706 25109
9623 1 18 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.733 0.628 25109
9624 1 18 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.367 -1.635 25109
9625 1 18 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.108 1.483 25109
9626 1 18 . 1 1 27 27 ILE H H 27 7.647 7.647 7.884 -0.237 25109
9627 1 18 . 1 1 28 28 LEU N N 28 121.867 121.867 120.606 1.261 25109
9628 1 18 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.110 -0.173 25109
9629 1 18 . 1 1 28 28 LEU C C 28 175.756 175.756 176.662 -0.906 25109
9630 1 18 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.439 -0.472 25109
9631 1 18 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.784 0.729 25109
9632 1 18 . 1 1 28 28 LEU H H 28 7.434 7.434 7.452 -0.018 25109
9633 1 18 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.336 -0.126 25109
9634 1 18 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.441 -0.131 25109
9635 1 18 . 1 1 30 30 TYR N N 30 113.832 113.832 116.301 -2.469 25109
9636 1 18 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.468 0.034 25109
9637 1 18 . 1 1 30 30 TYR C C 30 174.386 174.386 175.318 -0.932 25109
9638 1 18 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.903 -2.209 25109
9639 1 18 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.500 -0.401 25109
9640 1 18 . 1 1 30 30 TYR H H 30 7.628 7.628 7.657 -0.029 25109
9641 1 18 . 1 1 31 31 LEU N N 31 118.331 118.331 118.361 -0.030 25109
9642 1 18 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.791 0.086 25109
9643 1 18 . 1 1 31 31 LEU C C 31 173.849 173.849 175.460 -1.611 25109
9644 1 18 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.565 0.127 25109
9645 1 18 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.883 -0.081 25109
9646 1 18 . 1 1 31 31 LEU H H 31 7.619 7.619 7.441 0.178 25109
9647 1 18 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.393 -0.038 25109
9648 1 18 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.826 -0.416 25109
9649 1 18 . 1 1 33 33 CYS N N 33 110.978 110.978 116.317 -5.339 25109
9650 1 18 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.252 0.089 25109
9651 1 18 . 1 1 33 33 CYS C C 33 174.139 174.139 174.768 -0.629 25109
9652 1 18 . 1 1 33 33 CYS CA C 33 56.212 56.212 59.236 -3.024 25109
9653 1 18 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.646 1.276 25109
9654 1 18 . 1 1 33 33 CYS H H 33 6.414 6.414 7.775 -1.361 25109
9655 1 18 . 1 1 34 34 LEU N N 34 123.111 123.111 121.381 1.730 25109
9656 1 18 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.346 0.260 25109
9657 1 18 . 1 1 34 34 LEU C C 34 176.646 176.646 176.508 0.138 25109
9658 1 18 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.621 -0.730 25109
9659 1 18 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.510 0.181 25109
9660 1 18 . 1 1 34 34 LEU H H 34 7.550 7.550 7.268 0.282 25109
9661 1 18 . 1 1 35 35 THR N N 35 113.831 113.831 117.282 -3.451 25109
9662 1 18 . 1 1 35 35 THR HA H 35 4.205 4.205 4.267 -0.062 25109
9663 1 18 . 1 1 35 35 THR C C 35 175.324 175.324 175.830 -0.506 25109
9664 1 18 . 1 1 35 35 THR CA C 35 61.200 61.200 62.040 -0.840 25109
9665 1 18 . 1 1 35 35 THR CB C 35 71.318 71.318 70.101 1.217 25109
9666 1 18 . 1 1 35 35 THR H H 35 8.586 8.586 9.007 -0.421 25109
9667 1 18 . 1 1 36 36 ALA N N 36 124.128 124.128 126.268 -2.140 25109
9668 1 18 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.013 -0.089 25109
9669 1 18 . 1 1 36 36 ALA C C 36 180.397 180.397 179.809 0.588 25109
9670 1 18 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.763 0.157 25109
9671 1 18 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.427 -0.624 25109
9672 1 18 . 1 1 36 36 ALA H H 36 8.836 8.836 8.745 0.091 25109
9673 1 18 . 1 1 37 37 ARG N N 37 116.793 116.793 118.335 -1.542 25109
9674 1 18 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.121 -0.135 25109
9675 1 18 . 1 1 37 37 ARG C C 37 179.272 179.272 177.544 1.728 25109
9676 1 18 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.493 -0.261 25109
9677 1 18 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.453 0.453 25109
9678 1 18 . 1 1 37 37 ARG H H 37 8.060 8.060 8.707 -0.647 25109
9679 1 18 . 1 1 38 38 ASP N N 38 120.030 120.030 118.829 1.201 25109
9680 1 18 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.357 -0.109 25109
9681 1 18 . 1 1 38 38 ASP C C 38 178.885 178.885 178.603 0.282 25109
9682 1 18 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.635 -0.448 25109
9683 1 18 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.119 0.814 25109
9684 1 18 . 1 1 38 38 ASP H H 38 7.782 7.782 8.364 -0.582 25109
9685 1 18 . 1 1 39 39 GLN N N 39 118.223 118.223 118.709 -0.486 25109
9686 1 18 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.920 -0.255 25109
9687 1 18 . 1 1 39 39 GLN C C 39 178.041 178.041 178.359 -0.318 25109
9688 1 18 . 1 1 39 39 GLN CA C 39 60.601 60.601 59.174 1.427 25109
9689 1 18 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.552 -0.755 25109
9690 1 18 . 1 1 39 39 GLN H H 39 8.476 8.476 8.227 0.249 25109
9691 1 18 . 1 1 40 40 ASP N N 40 117.908 117.908 120.202 -2.294 25109
9692 1 18 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.355 -0.102 25109
9693 1 18 . 1 1 40 40 ASP C C 40 178.639 178.639 178.228 0.411 25109
9694 1 18 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.478 -1.078 25109
9695 1 18 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.945 -2.917 25109
9696 1 18 . 1 1 40 40 ASP H H 40 8.386 8.386 8.181 0.205 25109
9697 1 18 . 1 1 41 41 ARG N N 41 120.990 120.990 120.320 0.670 25109
9698 1 18 . 1 1 41 41 ARG HA H 41 4.042 4.042 3.975 0.067 25109
9699 1 18 . 1 1 41 41 ARG C C 41 179.795 179.795 178.813 0.982 25109
9700 1 18 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.586 -0.140 25109
9701 1 18 . 1 1 41 41 ARG CB C 41 30.258 30.258 30.193 0.065 25109
9702 1 18 . 1 1 41 41 ARG H H 41 8.130 8.130 8.236 -0.106 25109
9703 1 18 . 1 1 42 42 LEU N N 42 121.219 121.219 119.381 1.838 25109
9704 1 18 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.007 -0.072 25109
9705 1 18 . 1 1 42 42 LEU C C 42 178.850 178.850 178.707 0.143 25109
9706 1 18 . 1 1 42 42 LEU CA C 42 58.267 58.267 58.075 0.192 25109
9707 1 18 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.650 0.383 25109
9708 1 18 . 1 1 42 42 LEU H H 42 8.179 8.179 8.522 -0.343 25109
9709 1 18 . 1 1 43 43 ARG N N 43 119.310 119.310 119.547 -0.237 25109
9710 1 18 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.905 -0.181 25109
9711 1 18 . 1 1 43 43 ARG C C 43 179.099 179.099 178.240 0.859 25109
9712 1 18 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.656 1.158 25109
9713 1 18 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.154 0.026 25109
9714 1 18 . 1 1 43 43 ARG H H 43 8.296 8.296 8.374 -0.078 25109
9715 1 18 . 1 1 44 44 ALA N N 44 121.305 121.305 121.585 -0.280 25109
9716 1 18 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.051 0.052 25109
9717 1 18 . 1 1 44 44 ALA C C 44 180.924 180.924 179.632 1.292 25109
9718 1 18 . 1 1 44 44 ALA CA C 44 55.225 55.225 55.363 -0.138 25109
9719 1 18 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.093 0.003 25109
9720 1 18 . 1 1 44 44 ALA H H 44 7.774 7.774 8.309 -0.535 25109
9721 1 18 . 1 1 45 45 THR N N 45 115.017 115.017 114.990 0.027 25109
9722 1 18 . 1 1 45 45 THR HA H 45 3.879 3.879 3.884 -0.005 25109
9723 1 18 . 1 1 45 45 THR CA C 45 66.327 66.327 67.150 -0.823 25109
9724 1 18 . 1 1 45 45 THR CB C 45 68.809 68.809 68.691 0.118 25109
9725 1 18 . 1 1 45 45 THR H H 45 8.167 8.167 8.313 -0.146 25109
9726 1 18 . 1 1 46 46 CYS N N 46 123.609 123.609 120.162 3.447 25109
9727 1 18 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.382 -0.363 25109
9728 1 18 . 1 1 46 46 CYS C C 46 178.077 178.077 176.490 1.587 25109
9729 1 18 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.324 0.621 25109
9730 1 18 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.388 -0.249 25109
9731 1 18 . 1 1 46 46 CYS H H 46 8.084 8.084 8.492 -0.408 25109
9732 1 18 . 1 1 47 47 THR N N 47 115.520 115.520 115.370 0.150 25109
9733 1 18 . 1 1 47 47 THR HA H 47 3.915 3.915 4.252 -0.337 25109
9734 1 18 . 1 1 47 47 THR CA C 47 66.063 66.063 65.445 0.618 25109
9735 1 18 . 1 1 47 47 THR CB C 47 69.245 69.245 69.003 0.242 25109
9736 1 18 . 1 1 47 47 THR H H 47 7.735 7.735 7.732 0.003 25109
9737 1 18 . 1 1 48 48 LEU N N 48 120.099 120.099 121.447 -1.348 25109
9738 1 18 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.329 -0.103 25109
9739 1 18 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.065 0.498 25109
9740 1 18 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.551 1.074 25109
9741 1 18 . 1 1 48 48 LEU H H 48 7.464 7.464 7.756 -0.292 25109
9742 1 18 . 1 1 49 49 SER N N 49 111.979 111.979 113.219 -1.240 25109
9743 1 18 . 1 1 49 49 SER HA H 49 4.661 4.661 4.489 0.172 25109
9744 1 18 . 1 1 49 49 SER C C 49 175.581 175.581 175.700 -0.119 25109
9745 1 18 . 1 1 49 49 SER CA C 49 59.590 59.590 58.878 0.712 25109
9746 1 18 . 1 1 49 49 SER CB C 49 65.335 65.335 64.994 0.341 25109
9747 1 18 . 1 1 49 49 SER H H 49 8.781 8.781 8.414 0.367 25109
9748 1 18 . 1 1 50 50 GLY N N 50 110.194 110.194 110.398 -0.204 25109
9749 1 18 . 1 1 50 50 GLY C C 50 175.123 175.123 173.508 1.615 25109
9750 1 18 . 1 1 50 50 GLY CA C 50 44.902 44.902 44.628 0.274 25109
9751 1 18 . 1 1 50 50 GLY H H 50 7.955 7.955 7.797 0.158 25109
9752 1 18 . 1 1 51 51 ASN N N 51 121.050 121.050 119.939 1.111 25109
9753 1 18 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.513 -0.263 25109
9754 1 18 . 1 1 51 51 ASN C C 51 176.403 176.403 177.279 -0.876 25109
9755 1 18 . 1 1 51 51 ASN CA C 51 59.303 59.303 56.367 2.936 25109
9756 1 18 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.415 3.184 25109
9757 1 18 . 1 1 51 51 ASN H H 51 8.898 8.898 8.741 0.157 25109
9758 1 18 . 1 1 52 52 ARG N N 52 119.825 119.825 120.279 -0.454 25109
9759 1 18 . 1 1 52 52 ARG HA H 52 4.038 4.038 3.986 0.052 25109
9760 1 18 . 1 1 52 52 ARG C C 52 178.850 178.850 177.530 1.320 25109
9761 1 18 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.215 0.849 25109
9762 1 18 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.974 0.050 25109
9763 1 18 . 1 1 52 52 ARG H H 52 8.696 8.696 8.563 0.133 25109
9764 1 18 . 1 1 53 53 ASP N N 53 116.032 116.032 116.079 -0.047 25109
9765 1 18 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.801 -0.255 25109
9766 1 18 . 1 1 53 53 ASP C C 53 178.996 178.996 178.766 0.230 25109
9767 1 18 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.262 -1.183 25109
9768 1 18 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.291 -1.920 25109
9769 1 18 . 1 1 53 53 ASP H H 53 9.036 9.036 8.532 0.504 25109
9770 1 18 . 1 1 54 54 THR N N 54 115.848 115.848 118.080 -2.232 25109
9771 1 18 . 1 1 54 54 THR HA H 54 3.746 3.746 4.321 -0.575 25109
9772 1 18 . 1 1 54 54 THR CA C 54 67.885 67.885 66.486 1.399 25109
9773 1 18 . 1 1 54 54 THR CB C 54 66.953 66.953 68.800 -1.847 25109
9774 1 18 . 1 1 54 54 THR H H 54 7.782 7.782 7.628 0.154 25109
9775 1 18 . 1 1 55 55 LEU N N 55 125.987 125.987 122.369 3.618 25109
9776 1 18 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.159 -0.605 25109
9777 1 18 . 1 1 55 55 LEU C C 55 177.901 177.901 178.790 -0.889 25109
9778 1 18 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.658 -0.205 25109
9779 1 18 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.422 0.441 25109
9780 1 18 . 1 1 55 55 LEU H H 55 8.740 8.740 8.530 0.210 25109
9781 1 18 . 1 1 56 56 TRP N N 56 116.672 116.672 118.868 -2.196 25109
9782 1 18 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.383 -0.303 25109
9783 1 18 . 1 1 56 56 TRP C C 56 179.588 179.588 178.961 0.627 25109
9784 1 18 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.535 -0.054 25109
9785 1 18 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.194 -0.002 25109
9786 1 18 . 1 1 56 56 TRP H H 56 7.642 7.642 7.694 -0.052 25109
9787 1 18 . 1 1 57 57 HIS N N 57 115.754 115.754 117.357 -1.603 25109
9788 1 18 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.293 -0.017 25109
9789 1 18 . 1 1 57 57 HIS C C 57 177.514 177.514 177.736 -0.222 25109
9790 1 18 . 1 1 57 57 HIS CA C 57 58.952 58.952 60.620 -1.668 25109
9791 1 18 . 1 1 57 57 HIS CB C 57 28.002 28.002 29.770 -1.768 25109
9792 1 18 . 1 1 57 57 HIS H H 57 7.407 7.407 7.749 -0.342 25109
9793 1 18 . 1 1 58 58 LEU N N 58 123.934 123.934 122.054 1.880 25109
9794 1 18 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.883 -0.096 25109
9795 1 18 . 1 1 58 58 LEU C C 58 178.115 178.115 178.068 0.047 25109
9796 1 18 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.450 0.459 25109
9797 1 18 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.554 -0.739 25109
9798 1 18 . 1 1 58 58 LEU H H 58 8.996 8.996 8.805 0.191 25109
9799 1 18 . 1 1 59 59 PHE N N 59 117.721 117.721 116.495 1.226 25109
9800 1 18 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.742 0.193 25109
9801 1 18 . 1 1 59 59 PHE C C 59 176.987 176.987 178.004 -1.017 25109
9802 1 18 . 1 1 59 59 PHE CA C 59 60.113 60.113 62.214 -2.101 25109
9803 1 18 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.089 -1.129 25109
9804 1 18 . 1 1 59 59 PHE H H 59 8.201 8.201 8.467 -0.266 25109
9805 1 18 . 1 1 60 60 ASN N N 60 115.695 115.695 117.439 -1.744 25109
9806 1 18 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.333 -0.414 25109
9807 1 18 . 1 1 60 60 ASN C C 60 176.670 176.670 176.739 -0.069 25109
9808 1 18 . 1 1 60 60 ASN CA C 60 56.756 56.756 56.108 0.648 25109
9809 1 18 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.638 0.680 25109
9810 1 18 . 1 1 60 60 ASN H H 60 7.666 7.666 8.226 -0.560 25109
9811 1 18 . 1 1 61 61 THR N N 61 115.110 115.110 114.873 0.237 25109
9812 1 18 . 1 1 61 61 THR HA H 61 3.733 3.733 4.198 -0.465 25109
9813 1 18 . 1 1 61 61 THR CA C 61 66.319 66.319 65.418 0.901 25109
9814 1 18 . 1 1 61 61 THR CB C 61 69.174 69.174 69.183 -0.009 25109
9815 1 18 . 1 1 61 61 THR H H 61 7.782 7.782 7.795 -0.013 25109
9816 1 18 . 1 1 62 62 LEU N N 62 121.559 121.559 123.670 -2.111 25109
9817 1 18 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.843 -0.354 25109
9818 1 18 . 1 1 62 62 LEU C C 62 176.600 176.600 177.277 -0.677 25109
9819 1 18 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.582 0.383 25109
9820 1 18 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.996 1.339 25109
9821 1 18 . 1 1 62 62 LEU H H 62 8.362 8.362 8.263 0.099 25109
9822 1 18 . 1 1 63 63 GLN N N 63 109.150 109.150 115.278 -6.128 25109
9823 1 18 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.631 -1.554 25109
9824 1 18 . 1 1 63 63 GLN C C 63 175.194 175.194 177.084 -1.890 25109
9825 1 18 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.803 -1.537 25109
9826 1 18 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.943 -2.249 25109
9827 1 18 . 1 1 63 63 GLN H H 63 6.458 6.458 7.536 -1.078 25109
9828 1 18 . 1 1 64 64 ARG N N 64 116.029 116.029 118.194 -2.165 25109
9829 1 18 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.313 -0.215 25109
9830 1 18 . 1 1 64 64 ARG C C 64 176.459 176.459 176.046 0.413 25109
9831 1 18 . 1 1 64 64 ARG CA C 64 56.143 56.143 55.901 0.242 25109
9832 1 18 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.662 -0.078 25109
9833 1 18 . 1 1 64 64 ARG H H 64 6.596 6.596 7.225 -0.629 25109
9834 1 18 . 1 1 65 65 ARG N N 65 120.422 120.422 119.604 0.818 25109
9835 1 18 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.770 0.064 25109
9836 1 18 . 1 1 65 65 ARG C C 65 173.436 173.436 174.122 -0.686 25109
9837 1 18 . 1 1 65 65 ARG CA C 65 51.545 51.545 51.495 0.050 25109
9838 1 18 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.344 -0.348 25109
9839 1 18 . 1 1 65 65 ARG H H 65 7.932 7.932 7.457 0.475 25109
9840 1 18 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.459 0.115 25109
9841 1 18 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.990 0.069 25109
9842 1 18 . 1 1 67 67 GLY N N 67 111.953 111.953 114.585 -2.632 25109
9843 1 18 . 1 1 67 67 GLY C C 67 177.057 177.057 175.176 1.881 25109
9844 1 18 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.965 1.342 25109
9845 1 18 . 1 1 67 67 GLY H H 67 9.198 9.198 8.784 0.414 25109
9846 1 18 . 1 1 68 68 TRP N N 68 117.467 117.467 120.300 -2.833 25109
9847 1 18 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.182 -0.840 25109
9848 1 18 . 1 1 68 68 TRP C C 68 177.690 177.690 175.724 1.966 25109
9849 1 18 . 1 1 68 68 TRP CA C 68 60.116 60.116 56.808 3.308 25109
9850 1 18 . 1 1 68 68 TRP CB C 68 29.190 29.190 29.195 -0.005 25109
9851 1 18 . 1 1 68 68 TRP H H 68 7.647 7.647 7.914 -0.267 25109
9852 1 18 . 1 1 69 69 VAL N N 69 121.482 121.482 122.649 -1.167 25109
9853 1 18 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.391 -0.754 25109
9854 1 18 . 1 1 69 69 VAL C C 69 177.993 177.993 177.197 0.796 25109
9855 1 18 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.467 0.999 25109
9856 1 18 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.619 -0.593 25109
9857 1 18 . 1 1 69 69 VAL H H 69 6.666 6.666 7.607 -0.941 25109
9858 1 18 . 1 1 70 70 GLU N N 70 116.350 116.350 119.487 -3.137 25109
9859 1 18 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.902 -0.077 25109
9860 1 18 . 1 1 70 70 GLU C C 70 180.362 180.362 178.635 1.727 25109
9861 1 18 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.733 -0.512 25109
9862 1 18 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.539 -1.234 25109
9863 1 18 . 1 1 70 70 GLU H H 70 7.410 7.410 8.568 -1.158 25109
9864 1 18 . 1 1 71 71 TYR N N 71 116.750 116.750 118.249 -1.499 25109
9865 1 18 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.326 0.124 25109
9866 1 18 . 1 1 71 71 TYR C C 71 178.411 178.411 178.096 0.315 25109
9867 1 18 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.740 0.862 25109
9868 1 18 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.298 0.057 25109
9869 1 18 . 1 1 71 71 TYR H H 71 7.159 7.159 7.906 -0.747 25109
9870 1 18 . 1 1 72 72 PHE N N 72 121.610 121.610 120.865 0.745 25109
9871 1 18 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.245 0.257 25109
9872 1 18 . 1 1 72 72 PHE CA C 72 60.820 60.820 60.818 0.002 25109
9873 1 18 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.376 0.673 25109
9874 1 18 . 1 1 72 72 PHE H H 72 9.007 9.007 8.359 0.648 25109
9875 1 18 . 1 1 73 73 ILE N N 73 119.200 119.200 119.487 -0.287 25109
9876 1 18 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.482 -0.302 25109
9877 1 18 . 1 1 73 73 ILE C C 73 177.620 177.620 177.837 -0.217 25109
9878 1 18 . 1 1 73 73 ILE CA C 73 67.197 67.197 63.566 3.631 25109
9879 1 18 . 1 1 73 73 ILE CB C 73 39.023 39.023 36.096 2.926 25109
9880 1 18 . 1 1 73 73 ILE H H 73 8.644 8.644 8.588 0.056 25109
9881 1 18 . 1 1 74 74 ALA N N 74 119.624 119.624 121.328 -1.704 25109
9882 1 18 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.008 -0.054 25109
9883 1 18 . 1 1 74 74 ALA C C 74 181.030 181.030 179.446 1.584 25109
9884 1 18 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.914 0.497 25109
9885 1 18 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.039 0.097 25109
9886 1 18 . 1 1 74 74 ALA H H 74 7.476 7.476 7.809 -0.333 25109
9887 1 18 . 1 1 75 75 ALA N N 75 123.625 123.625 122.535 1.090 25109
9888 1 18 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.425 0.413 25109
9889 1 18 . 1 1 75 75 ALA C C 75 179.272 179.272 179.377 -0.105 25109
9890 1 18 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.544 0.558 25109
9891 1 18 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.231 1.362 25109
9892 1 18 . 1 1 75 75 ALA H H 75 8.524 8.524 7.465 1.059 25109
9893 1 18 . 1 1 76 76 LEU N N 76 118.114 118.114 120.270 -2.156 25109
9894 1 18 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.912 -0.240 25109
9895 1 18 . 1 1 76 76 LEU C C 76 180.001 180.001 179.002 0.999 25109
9896 1 18 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.254 1.002 25109
9897 1 18 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.203 1.416 25109
9898 1 18 . 1 1 76 76 LEU H H 76 8.153 8.153 7.546 0.607 25109
9899 1 18 . 1 1 77 77 ARG N N 77 117.830 117.830 119.012 -1.182 25109
9900 1 18 . 1 1 77 77 ARG HA H 77 3.447 3.447 4.006 -0.559 25109
9901 1 18 . 1 1 77 77 ARG C C 77 180.889 180.889 179.429 1.460 25109
9902 1 18 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.277 1.789 25109
9903 1 18 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.971 -0.774 25109
9904 1 18 . 1 1 77 77 ARG H H 77 7.945 7.945 8.047 -0.102 25109
9905 1 18 . 1 1 78 78 GLY N N 78 110.202 110.202 107.141 3.061 25109
9906 1 18 . 1 1 78 78 GLY C C 78 174.807 174.807 175.437 -0.630 25109
9907 1 18 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.550 0.010 25109
9908 1 18 . 1 1 78 78 GLY H H 78 8.269 8.269 8.168 0.101 25109
9909 1 18 . 1 1 79 79 CYS N N 79 115.567 115.567 116.132 -0.565 25109
9910 1 18 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.535 -0.146 25109
9911 1 18 . 1 1 79 79 CYS C C 79 173.025 173.025 174.473 -1.448 25109
9912 1 18 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.641 2.317 25109
9913 1 18 . 1 1 79 79 CYS CB C 79 27.805 27.805 26.374 1.431 25109
9914 1 18 . 1 1 79 79 CYS H H 79 7.132 7.132 7.451 -0.319 25109
9915 1 18 . 1 1 80 80 GLU N N 80 111.759 111.759 115.906 -4.147 25109
9916 1 18 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.901 -0.168 25109
9917 1 18 . 1 1 80 80 GLU C C 80 175.827 175.827 175.101 0.726 25109
9918 1 18 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.935 -0.468 25109
9919 1 18 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.946 -2.229 25109
9920 1 18 . 1 1 80 80 GLU H H 80 7.772 7.772 7.870 -0.098 25109
9921 1 18 . 1 1 81 81 LEU N N 81 124.692 124.692 121.228 3.464 25109
9922 1 18 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.474 0.217 25109
9923 1 18 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.895 -0.940 25109
9924 1 18 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.214 -0.823 25109
9925 1 18 . 1 1 81 81 LEU H H 81 8.167 8.167 8.248 -0.081 25109
9926 1 18 . 1 1 82 82 VAL N N 82 118.320 118.320 122.472 -4.152 25109
9927 1 18 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.674 -0.497 25109
9928 1 18 . 1 1 82 82 VAL CA C 82 66.710 66.710 65.655 1.055 25109
9929 1 18 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.687 0.261 25109
9930 1 18 . 1 1 82 82 VAL H H 82 7.141 7.141 7.559 -0.418 25109
9931 1 18 . 1 1 83 83 ASP N N 83 118.733 118.733 119.102 -0.369 25109
9932 1 18 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.303 0.029 25109
9933 1 18 . 1 1 83 83 ASP C C 83 178.674 178.674 178.346 0.328 25109
9934 1 18 . 1 1 83 83 ASP CA C 83 56.443 56.443 58.211 -1.768 25109
9935 1 18 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.461 -3.632 25109
9936 1 18 . 1 1 83 83 ASP H H 83 8.385 8.385 8.868 -0.483 25109
9937 1 18 . 1 1 84 84 LEU N N 84 121.026 121.026 120.834 0.192 25109
9938 1 18 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.084 -0.105 25109
9939 1 18 . 1 1 84 84 LEU C C 84 178.796 178.796 178.640 0.156 25109
9940 1 18 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.675 -0.153 25109
9941 1 18 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.726 0.769 25109
9942 1 18 . 1 1 84 84 LEU H H 84 7.770 7.770 7.935 -0.165 25109
9943 1 18 . 1 1 85 85 ALA N N 85 121.525 121.525 122.554 -1.029 25109
9944 1 18 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.819 -0.158 25109
9945 1 18 . 1 1 85 85 ALA C C 85 179.322 179.322 179.165 0.157 25109
9946 1 18 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.230 0.611 25109
9947 1 18 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.026 0.902 25109
9948 1 18 . 1 1 85 85 ALA H H 85 8.126 8.126 7.594 0.532 25109
9949 1 18 . 1 1 86 86 ASP N N 86 115.349 115.349 118.382 -3.033 25109
9950 1 18 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.320 -0.047 25109
9951 1 18 . 1 1 86 86 ASP C C 86 178.463 178.463 178.289 0.174 25109
9952 1 18 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.534 -1.823 25109
9953 1 18 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.098 -3.936 25109
9954 1 18 . 1 1 86 86 ASP H H 86 8.410 8.410 8.516 -0.106 25109
9955 1 18 . 1 1 87 87 GLU N N 87 122.529 122.529 119.738 2.791 25109
9956 1 18 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.226 -0.190 25109
9957 1 18 . 1 1 87 87 GLU C C 87 178.508 178.508 179.196 -0.688 25109
9958 1 18 . 1 1 87 87 GLU CA C 87 59.354 59.354 58.903 0.451 25109
9959 1 18 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.811 -1.538 25109
9960 1 18 . 1 1 87 87 GLU H H 87 8.012 8.012 8.185 -0.173 25109
9961 1 18 . 1 1 88 88 VAL N N 88 119.148 119.148 120.879 -1.731 25109
9962 1 18 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.851 -0.521 25109
9963 1 18 . 1 1 88 88 VAL C C 88 177.240 177.240 178.164 -0.924 25109
9964 1 18 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.636 1.613 25109
9965 1 18 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.101 0.428 25109
9966 1 18 . 1 1 88 88 VAL H H 88 8.291 8.291 8.046 0.245 25109
9967 1 18 . 1 1 89 89 ALA N N 89 120.709 120.709 122.413 -1.704 25109
9968 1 18 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.109 -0.194 25109
9969 1 18 . 1 1 89 89 ALA C C 89 180.186 180.186 179.901 0.285 25109
9970 1 18 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.581 0.478 25109
9971 1 18 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.352 -0.117 25109
9972 1 18 . 1 1 89 89 ALA H H 89 8.548 8.548 8.280 0.268 25109
9973 1 18 . 1 1 90 90 SER N N 90 113.035 113.035 113.929 -0.894 25109
9974 1 18 . 1 1 90 90 SER HA H 90 4.047 4.047 4.231 -0.184 25109
9975 1 18 . 1 1 90 90 SER C C 90 177.564 177.564 176.383 1.181 25109
9976 1 18 . 1 1 90 90 SER CA C 90 61.771 61.771 61.106 0.665 25109
9977 1 18 . 1 1 90 90 SER CB C 90 62.907 62.907 63.417 -0.510 25109
9978 1 18 . 1 1 90 90 SER H H 90 7.969 7.969 8.041 -0.072 25109
9979 1 18 . 1 1 91 91 VAL N N 91 123.417 123.417 121.718 1.699 25109
9980 1 18 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.621 -0.274 25109
9981 1 18 . 1 1 91 91 VAL C C 91 178.428 178.428 178.116 0.312 25109
9982 1 18 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.059 0.070 25109
9983 1 18 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.734 0.037 25109
9984 1 18 . 1 1 91 91 VAL H H 91 7.713 7.713 7.754 -0.041 25109
9985 1 18 . 1 1 92 92 TYR N N 92 121.458 121.458 121.286 0.172 25109
9986 1 18 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.469 -0.278 25109
9987 1 18 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.624 0.370 25109
9988 1 18 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.579 0.406 25109
9989 1 18 . 1 1 92 92 TYR H H 92 8.395 8.395 8.687 -0.292 25109
9990 1 18 . 1 1 93 93 GLN N N 93 115.549 115.549 116.399 -0.850 25109
9991 1 18 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.017 -0.306 25109
9992 1 18 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.821 0.273 25109
9993 1 18 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.396 -0.098 25109
9994 1 18 . 1 1 93 93 GLN H H 93 8.167 8.167 7.738 0.429 25109
9995 1 18 . 1 1 94 94 SER N N 94 115.923 115.923 113.630 2.293 25109
9996 1 18 . 1 1 94 94 SER HA H 94 4.096 4.096 4.174 -0.078 25109
9997 1 18 . 1 1 94 94 SER CA C 94 60.971 60.971 58.619 2.352 25109
9998 1 18 . 1 1 94 94 SER CB C 94 62.635 62.635 63.678 -1.044 25109
9999 1 18 . 1 1 94 94 SER H H 94 7.642 7.642 7.317 0.325 25109
10000 1 18 . 1 1 95 95 TYR N N 95 119.565 119.565 120.401 -0.836 25109
10001 1 18 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.556 0.203 25109
10002 1 18 . 1 1 95 95 TYR C C 95 175.334 175.334 173.726 1.608 25109
10003 1 18 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.346 1.351 25109
10004 1 18 . 1 1 95 95 TYR CB C 95 39.319 39.319 38.457 0.862 25109
10005 1 18 . 1 1 95 95 TYR H H 95 7.069 7.069 7.483 -0.414 25109
10006 1 18 . 1 1 96 96 GLN N N 96 119.872 119.872 119.408 0.464 25109
10007 1 18 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.993 0.372 25109
10008 1 18 . 1 1 96 96 GLN C C 96 173.612 173.612 174.648 -1.036 25109
10009 1 18 . 1 1 96 96 GLN CA C 96 54.336 54.336 56.024 -1.688 25109
10010 1 18 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.433 1.061 25109
10011 1 18 . 1 1 96 96 GLN H H 96 7.409 7.409 8.703 -1.294 25109
10012 1 18 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.258 0.060 25109
10013 1 18 . 1 1 97 97 PRO CA C 97 63.014 63.014 64.801 -1.787 25109
10014 1 18 . 1 1 97 97 PRO CB C 97 32.098 32.098 31.860 0.238 25109
10015 1 18 . 1 1 98 98 ARG N N 98 121.759 121.759 119.514 2.245 25109
10016 1 18 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.562 -0.220 25109
10017 1 18 . 1 1 98 98 ARG C C 98 176.848 176.848 175.563 1.285 25109
10018 1 18 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.662 0.559 25109
10019 1 18 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.178 0.909 25109
10020 1 18 . 1 1 98 98 ARG H H 98 8.423 8.423 7.935 0.488 25109
10021 1 18 . 1 1 99 99 THR N N 99 115.292 115.292 118.283 -2.991 25109
10022 1 18 . 1 1 99 99 THR HA H 99 4.323 4.323 4.613 -0.290 25109
10023 1 18 . 1 1 99 99 THR C C 99 174.350 174.350 173.553 0.797 25109
10024 1 18 . 1 1 99 99 THR CA C 99 61.906 61.906 61.015 0.891 25109
10025 1 18 . 1 1 99 99 THR CB C 99 70.180 70.180 69.996 0.184 25109
10026 1 18 . 1 1 99 99 THR H H 99 8.179 8.179 8.433 -0.254 25109
10027 1 19 . 1 1 0 0 SER N N 0 115.693 115.693 120.915 -5.222 25109
10028 1 19 . 1 1 0 0 SER HA H 0 4.531 4.531 4.428 0.103 25109
10029 1 19 . 1 1 0 0 SER C C 0 174.557 174.557 174.535 0.022 25109
10030 1 19 . 1 1 0 0 SER CA C 0 58.478 58.478 59.576 -1.098 25109
10031 1 19 . 1 1 0 0 SER CB C 0 64.380 64.380 62.306 2.074 25109
10032 1 19 . 1 1 0 0 SER H H 0 8.631 8.631 8.100 0.531 25109
10033 1 19 . 1 1 1 1 MET N N 1 123.111 123.111 120.208 2.903 25109
10034 1 19 . 1 1 1 1 MET HA H 1 4.728 4.728 4.254 0.474 25109
10035 1 19 . 1 1 1 1 MET C C 1 174.846 174.846 173.322 1.524 25109
10036 1 19 . 1 1 1 1 MET CA C 1 55.655 55.655 55.016 0.639 25109
10037 1 19 . 1 1 1 1 MET CB C 1 32.035 32.035 31.234 0.801 25109
10038 1 19 . 1 1 1 1 MET H H 1 8.641 8.641 8.206 0.435 25109
10039 1 19 . 1 1 2 2 PRO HA H 2 4.477 4.477 5.038 -0.561 25109
10040 1 19 . 1 1 2 2 PRO CB C 2 32.000 32.000 32.145 -0.145 25109
10041 1 19 . 1 1 3 3 PHE N N 3 121.126 121.126 125.683 -4.557 25109
10042 1 19 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.638 -0.272 25109
10043 1 19 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.420 1.442 25109
10044 1 19 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.425 -1.058 25109
10045 1 19 . 1 1 3 3 PHE H H 3 8.177 8.177 9.609 -1.432 25109
10046 1 19 . 1 1 4 4 ALA N N 4 121.170 121.170 123.003 -1.833 25109
10047 1 19 . 1 1 4 4 ALA HA H 4 3.835 3.835 3.935 -0.100 25109
10048 1 19 . 1 1 4 4 ALA C C 4 181.522 181.522 178.807 2.715 25109
10049 1 19 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.745 -0.291 25109
10050 1 19 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.538 0.898 25109
10051 1 19 . 1 1 4 4 ALA H H 4 8.444 8.444 8.941 -0.497 25109
10052 1 19 . 1 1 5 5 GLU N N 5 118.932 118.932 118.452 0.480 25109
10053 1 19 . 1 1 5 5 GLU HA H 5 3.855 3.855 4.056 -0.201 25109
10054 1 19 . 1 1 5 5 GLU C C 5 177.971 177.971 177.981 -0.010 25109
10055 1 19 . 1 1 5 5 GLU CA C 5 60.631 60.631 58.889 1.742 25109
10056 1 19 . 1 1 5 5 GLU CB C 5 28.761 28.761 27.819 0.942 25109
10057 1 19 . 1 1 5 5 GLU H H 5 8.454 8.454 8.713 -0.259 25109
10058 1 19 . 1 1 6 6 ASP N N 6 120.471 120.471 120.924 -0.453 25109
10059 1 19 . 1 1 6 6 ASP C C 6 178.885 178.885 177.930 0.955 25109
10060 1 19 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.707 -0.635 25109
10061 1 19 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.621 -1.489 25109
10062 1 19 . 1 1 6 6 ASP H H 6 8.316 8.316 8.588 -0.272 25109
10063 1 19 . 1 1 7 7 LYS N N 7 118.335 118.335 117.826 0.509 25109
10064 1 19 . 1 1 7 7 LYS HA H 7 3.690 3.690 4.070 -0.380 25109
10065 1 19 . 1 1 7 7 LYS C C 7 180.080 180.080 178.822 1.258 25109
10066 1 19 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.625 0.095 25109
10067 1 19 . 1 1 7 7 LYS CB C 7 31.794 31.794 32.031 -0.237 25109
10068 1 19 . 1 1 7 7 LYS H H 7 8.249 8.249 7.520 0.729 25109
10069 1 19 . 1 1 8 8 THR N N 8 119.222 119.222 117.385 1.837 25109
10070 1 19 . 1 1 8 8 THR HA H 8 3.975 3.975 4.089 -0.114 25109
10071 1 19 . 1 1 8 8 THR CA C 8 68.453 68.453 66.839 1.614 25109
10072 1 19 . 1 1 8 8 THR CB C 8 67.387 67.387 68.763 -1.376 25109
10073 1 19 . 1 1 8 8 THR H H 8 7.897 7.897 7.834 0.063 25109
10074 1 19 . 1 1 9 9 TYR N N 9 123.054 123.054 123.140 -0.086 25109
10075 1 19 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.401 -0.148 25109
10076 1 19 . 1 1 9 9 TYR C C 9 177.441 177.441 177.651 -0.210 25109
10077 1 19 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.491 -0.593 25109
10078 1 19 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.702 -0.853 25109
10079 1 19 . 1 1 9 9 TYR H H 9 8.605 8.605 8.573 0.032 25109
10080 1 19 . 1 1 10 10 LYS N N 10 118.366 118.366 118.055 0.311 25109
10081 1 19 . 1 1 10 10 LYS HA H 10 3.594 3.594 4.161 -0.567 25109
10082 1 19 . 1 1 10 10 LYS C C 10 178.885 178.885 178.285 0.600 25109
10083 1 19 . 1 1 10 10 LYS CA C 10 60.044 60.044 57.683 2.361 25109
10084 1 19 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.481 0.564 25109
10085 1 19 . 1 1 10 10 LYS H H 10 8.066 8.066 8.185 -0.119 25109
10086 1 19 . 1 1 11 11 TYR N N 11 120.539 120.539 119.969 0.570 25109
10087 1 19 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.333 -0.343 25109
10088 1 19 . 1 1 11 11 TYR C C 11 178.233 178.233 177.714 0.519 25109
10089 1 19 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.220 1.308 25109
10090 1 19 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.386 -1.023 25109
10091 1 19 . 1 1 11 11 TYR H H 11 7.875 7.875 7.631 0.244 25109
10092 1 19 . 1 1 12 12 ILE N N 12 121.893 121.893 120.046 1.847 25109
10093 1 19 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.983 -0.887 25109
10094 1 19 . 1 1 12 12 ILE C C 12 177.015 177.015 177.295 -0.280 25109
10095 1 19 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.668 2.095 25109
10096 1 19 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.347 1.205 25109
10097 1 19 . 1 1 12 12 ILE H H 12 8.154 8.154 8.428 -0.274 25109
10098 1 19 . 1 1 13 13 CYS N N 13 113.894 113.894 116.849 -2.955 25109
10099 1 19 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.996 -0.109 25109
10100 1 19 . 1 1 13 13 CYS C C 13 178.288 178.288 176.202 2.086 25109
10101 1 19 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.680 2.657 25109
10102 1 19 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.528 0.477 25109
10103 1 19 . 1 1 13 13 CYS H H 13 7.551 7.551 7.901 -0.350 25109
10104 1 19 . 1 1 14 14 ARG N N 14 119.228 119.228 118.182 1.046 25109
10105 1 19 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.094 -0.024 25109
10106 1 19 . 1 1 14 14 ARG C C 14 177.127 177.127 176.994 0.133 25109
10107 1 19 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.803 -0.309 25109
10108 1 19 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.399 0.023 25109
10109 1 19 . 1 1 14 14 ARG H H 14 7.991 7.991 7.670 0.321 25109
10110 1 19 . 1 1 15 15 ASN N N 15 117.367 117.367 115.628 1.739 25109
10111 1 19 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.610 0.359 25109
10112 1 19 . 1 1 15 15 ASN CA C 15 52.763 52.763 53.136 -0.374 25109
10113 1 19 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.661 0.924 25109
10114 1 19 . 1 1 15 15 ASN H H 15 7.643 7.643 7.409 0.234 25109
10115 1 19 . 1 1 16 16 PHE N N 16 122.356 122.356 123.129 -0.773 25109
10116 1 19 . 1 1 16 16 PHE HA H 16 4.216 4.216 4.144 0.072 25109
10117 1 19 . 1 1 16 16 PHE C C 16 178.084 178.084 176.720 1.364 25109
10118 1 19 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.440 1.737 25109
10119 1 19 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.035 1.554 25109
10120 1 19 . 1 1 16 16 PHE H H 16 6.992 6.992 8.047 -1.055 25109
10121 1 19 . 1 1 17 17 SER N N 17 112.937 112.937 114.293 -1.356 25109
10122 1 19 . 1 1 17 17 SER HA H 17 4.199 4.199 4.198 0.001 25109
10123 1 19 . 1 1 17 17 SER C C 17 176.726 176.726 176.565 0.161 25109
10124 1 19 . 1 1 17 17 SER CA C 17 62.052 62.052 61.424 0.628 25109
10125 1 19 . 1 1 17 17 SER CB C 17 62.552 62.552 62.585 -0.033 25109
10126 1 19 . 1 1 17 17 SER H H 17 8.840 8.840 8.671 0.169 25109
10127 1 19 . 1 1 18 18 ASN N N 18 118.809 118.809 120.929 -2.120 25109
10128 1 19 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.516 -0.158 25109
10129 1 19 . 1 1 18 18 ASN C C 18 175.967 175.967 175.540 0.427 25109
10130 1 19 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.204 -0.294 25109
10131 1 19 . 1 1 18 18 ASN CB C 18 37.828 37.828 39.061 -1.233 25109
10132 1 19 . 1 1 18 18 ASN H H 18 8.130 8.130 7.774 0.356 25109
10133 1 19 . 1 1 19 19 PHE N N 19 115.750 115.750 113.448 2.302 25109
10134 1 19 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.940 -0.655 25109
10135 1 19 . 1 1 19 19 PHE C C 19 175.370 175.370 174.751 0.619 25109
10136 1 19 . 1 1 19 19 PHE CA C 19 58.862 58.862 53.746 5.116 25109
10137 1 19 . 1 1 19 19 PHE CB C 19 39.878 39.878 37.394 2.484 25109
10138 1 19 . 1 1 19 19 PHE H H 19 8.062 8.062 7.277 0.785 25109
10139 1 19 . 1 1 20 20 CYS N N 20 113.958 113.958 119.109 -5.151 25109
10140 1 19 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.479 -0.536 25109
10141 1 19 . 1 1 20 20 CYS C C 20 173.823 173.823 173.626 0.197 25109
10142 1 19 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.970 2.818 25109
10143 1 19 . 1 1 20 20 CYS CB C 20 27.383 27.383 28.107 -0.724 25109
10144 1 19 . 1 1 20 20 CYS H H 20 6.850 6.850 7.751 -0.901 25109
10145 1 19 . 1 1 21 21 ASN N N 21 116.691 116.691 118.075 -1.384 25109
10146 1 19 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.852 -0.108 25109
10147 1 19 . 1 1 21 21 ASN C C 21 175.299 175.299 173.670 1.629 25109
10148 1 19 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.514 -0.224 25109
10149 1 19 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.826 -1.513 25109
10150 1 19 . 1 1 21 21 ASN H H 21 8.251 8.251 7.976 0.275 25109
10151 1 19 . 1 1 22 22 VAL N N 22 122.431 122.431 122.107 0.324 25109
10152 1 19 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.215 -0.665 25109
10153 1 19 . 1 1 22 22 VAL C C 22 174.034 174.034 173.576 0.458 25109
10154 1 19 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.538 3.399 25109
10155 1 19 . 1 1 22 22 VAL CB C 22 31.523 31.523 35.524 -4.001 25109
10156 1 19 . 1 1 22 22 VAL H H 22 7.573 7.573 8.030 -0.457 25109
10157 1 19 . 1 1 23 23 ASP N N 23 127.219 127.219 122.779 4.440 25109
10158 1 19 . 1 1 23 23 ASP CA C 23 52.186 52.186 54.123 -1.938 25109
10159 1 19 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.877 -3.084 25109
10160 1 19 . 1 1 23 23 ASP H H 23 8.687 8.687 8.411 0.276 25109
10161 1 19 . 1 1 24 24 VAL N N 24 127.835 127.835 119.499 8.336 25109
10162 1 19 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.241 -0.948 25109
10163 1 19 . 1 1 24 24 VAL C C 24 176.867 176.867 176.804 0.063 25109
10164 1 19 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.342 3.821 25109
10165 1 19 . 1 1 24 24 VAL CB C 24 32.015 32.015 34.117 -2.102 25109
10166 1 19 . 1 1 24 24 VAL H H 24 9.409 9.409 8.269 1.140 25109
10167 1 19 . 1 1 25 25 VAL N N 25 114.324 114.324 117.881 -3.557 25109
10168 1 19 . 1 1 25 25 VAL HA H 25 3.519 3.519 4.063 -0.544 25109
10169 1 19 . 1 1 25 25 VAL C C 25 178.006 178.006 177.975 0.031 25109
10170 1 19 . 1 1 25 25 VAL CA C 25 66.688 66.688 64.902 1.786 25109
10171 1 19 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.338 0.194 25109
10172 1 19 . 1 1 25 25 VAL H H 25 8.038 8.038 7.698 0.340 25109
10173 1 19 . 1 1 26 26 GLU N N 26 117.009 117.009 121.013 -4.004 25109
10174 1 19 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.207 -0.116 25109
10175 1 19 . 1 1 26 26 GLU C C 26 177.303 177.303 178.561 -1.258 25109
10176 1 19 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.843 -1.411 25109
10177 1 19 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.641 -0.676 25109
10178 1 19 . 1 1 26 26 GLU H H 26 7.220 7.220 9.074 -1.854 25109
10179 1 19 . 1 1 27 27 ILE N N 27 114.080 114.080 118.769 -4.689 25109
10180 1 19 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.880 0.481 25109
10181 1 19 . 1 1 27 27 ILE CA C 27 62.732 62.732 64.501 -1.769 25109
10182 1 19 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.048 1.543 25109
10183 1 19 . 1 1 27 27 ILE H H 27 7.647 7.647 7.894 -0.247 25109
10184 1 19 . 1 1 28 28 LEU N N 28 121.867 121.867 120.214 1.653 25109
10185 1 19 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.121 -0.184 25109
10186 1 19 . 1 1 28 28 LEU C C 28 175.756 175.756 177.131 -1.375 25109
10187 1 19 . 1 1 28 28 LEU CA C 28 59.967 59.967 59.922 0.045 25109
10188 1 19 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.873 0.640 25109
10189 1 19 . 1 1 28 28 LEU H H 28 7.434 7.434 7.218 0.216 25109
10190 1 19 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.257 -0.047 25109
10191 1 19 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.180 0.130 25109
10192 1 19 . 1 1 30 30 TYR N N 30 113.832 113.832 115.296 -1.464 25109
10193 1 19 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.618 -0.116 25109
10194 1 19 . 1 1 30 30 TYR C C 30 174.386 174.386 174.965 -0.579 25109
10195 1 19 . 1 1 30 30 TYR CA C 30 57.694 57.694 57.987 -0.293 25109
10196 1 19 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.366 -0.267 25109
10197 1 19 . 1 1 30 30 TYR H H 30 7.628 7.628 7.623 0.005 25109
10198 1 19 . 1 1 31 31 LEU N N 31 118.331 118.331 121.723 -3.392 25109
10199 1 19 . 1 1 31 31 LEU HA H 31 4.877 4.877 5.001 -0.124 25109
10200 1 19 . 1 1 31 31 LEU C C 31 173.849 173.849 174.722 -0.873 25109
10201 1 19 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.681 0.011 25109
10202 1 19 . 1 1 31 31 LEU CB C 31 42.802 42.802 44.676 -1.875 25109
10203 1 19 . 1 1 31 31 LEU H H 31 7.619 7.619 7.391 0.228 25109
10204 1 19 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.620 -0.265 25109
10205 1 19 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.124 0.286 25109
10206 1 19 . 1 1 33 33 CYS N N 33 110.978 110.978 117.158 -6.180 25109
10207 1 19 . 1 1 33 33 CYS HA H 33 4.341 4.341 3.960 0.381 25109
10208 1 19 . 1 1 33 33 CYS C C 33 174.139 174.139 174.098 0.041 25109
10209 1 19 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.789 -2.577 25109
10210 1 19 . 1 1 33 33 CYS CB C 33 28.922 28.922 28.034 0.888 25109
10211 1 19 . 1 1 33 33 CYS H H 33 6.414 6.414 8.217 -1.803 25109
10212 1 19 . 1 1 34 34 LEU N N 34 123.111 123.111 118.269 4.842 25109
10213 1 19 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.473 0.133 25109
10214 1 19 . 1 1 34 34 LEU C C 34 176.646 176.646 176.984 -0.338 25109
10215 1 19 . 1 1 34 34 LEU CA C 34 53.891 53.891 53.874 0.017 25109
10216 1 19 . 1 1 34 34 LEU CB C 34 42.691 42.691 42.688 0.003 25109
10217 1 19 . 1 1 34 34 LEU H H 34 7.550 7.550 7.250 0.300 25109
10218 1 19 . 1 1 35 35 THR N N 35 113.831 113.831 114.226 -0.395 25109
10219 1 19 . 1 1 35 35 THR HA H 35 4.205 4.205 4.427 -0.222 25109
10220 1 19 . 1 1 35 35 THR C C 35 175.324 175.324 175.746 -0.422 25109
10221 1 19 . 1 1 35 35 THR CA C 35 61.200 61.200 61.461 -0.261 25109
10222 1 19 . 1 1 35 35 THR CB C 35 71.318 71.318 69.735 1.583 25109
10223 1 19 . 1 1 35 35 THR H H 35 8.586 8.586 9.111 -0.525 25109
10224 1 19 . 1 1 36 36 ALA N N 36 124.128 124.128 126.801 -2.673 25109
10225 1 19 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.012 -0.088 25109
10226 1 19 . 1 1 36 36 ALA C C 36 180.397 180.397 179.656 0.741 25109
10227 1 19 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.654 0.266 25109
10228 1 19 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.343 -0.540 25109
10229 1 19 . 1 1 36 36 ALA H H 36 8.836 8.836 8.705 0.131 25109
10230 1 19 . 1 1 37 37 ARG N N 37 116.793 116.793 118.503 -1.710 25109
10231 1 19 . 1 1 37 37 ARG HA H 37 3.986 3.986 3.997 -0.011 25109
10232 1 19 . 1 1 37 37 ARG C C 37 179.272 179.272 178.300 0.972 25109
10233 1 19 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.884 -0.652 25109
10234 1 19 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.464 0.441 25109
10235 1 19 . 1 1 37 37 ARG H H 37 8.060 8.060 8.656 -0.596 25109
10236 1 19 . 1 1 38 38 ASP N N 38 120.030 120.030 118.546 1.484 25109
10237 1 19 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.407 -0.159 25109
10238 1 19 . 1 1 38 38 ASP C C 38 178.885 178.885 178.514 0.371 25109
10239 1 19 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.391 -0.204 25109
10240 1 19 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.094 0.839 25109
10241 1 19 . 1 1 38 38 ASP H H 38 7.782 7.782 7.641 0.141 25109
10242 1 19 . 1 1 39 39 GLN N N 39 118.223 118.223 119.012 -0.789 25109
10243 1 19 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.892 -0.227 25109
10244 1 19 . 1 1 39 39 GLN C C 39 178.041 178.041 178.151 -0.110 25109
10245 1 19 . 1 1 39 39 GLN CA C 39 60.601 60.601 59.047 1.554 25109
10246 1 19 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.514 -0.717 25109
10247 1 19 . 1 1 39 39 GLN H H 39 8.476 8.476 7.971 0.505 25109
10248 1 19 . 1 1 40 40 ASP N N 40 117.908 117.908 120.251 -2.343 25109
10249 1 19 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.273 -0.020 25109
10250 1 19 . 1 1 40 40 ASP C C 40 178.639 178.639 178.583 0.056 25109
10251 1 19 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.493 -1.093 25109
10252 1 19 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.874 -2.846 25109
10253 1 19 . 1 1 40 40 ASP H H 40 8.386 8.386 8.487 -0.101 25109
10254 1 19 . 1 1 41 41 ARG N N 41 120.990 120.990 118.684 2.306 25109
10255 1 19 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.014 0.028 25109
10256 1 19 . 1 1 41 41 ARG C C 41 179.795 179.795 178.867 0.928 25109
10257 1 19 . 1 1 41 41 ARG CA C 41 59.445 59.445 58.045 1.400 25109
10258 1 19 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.535 0.723 25109
10259 1 19 . 1 1 41 41 ARG H H 41 8.130 8.130 7.797 0.333 25109
10260 1 19 . 1 1 42 42 LEU N N 42 121.219 121.219 120.453 0.766 25109
10261 1 19 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.027 -0.092 25109
10262 1 19 . 1 1 42 42 LEU C C 42 178.850 178.850 178.840 0.010 25109
10263 1 19 . 1 1 42 42 LEU CA C 42 58.267 58.267 58.188 0.079 25109
10264 1 19 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.472 0.561 25109
10265 1 19 . 1 1 42 42 LEU H H 42 8.179 8.179 7.924 0.255 25109
10266 1 19 . 1 1 43 43 ARG N N 43 119.310 119.310 118.272 1.038 25109
10267 1 19 . 1 1 43 43 ARG HA H 43 3.724 3.724 4.202 -0.478 25109
10268 1 19 . 1 1 43 43 ARG C C 43 179.099 179.099 176.996 2.103 25109
10269 1 19 . 1 1 43 43 ARG CA C 43 60.814 60.814 56.648 4.165 25109
10270 1 19 . 1 1 43 43 ARG CB C 43 30.179 30.179 29.444 0.735 25109
10271 1 19 . 1 1 43 43 ARG H H 43 8.296 8.296 8.436 -0.140 25109
10272 1 19 . 1 1 44 44 ALA N N 44 121.305 121.305 121.082 0.223 25109
10273 1 19 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.298 -0.195 25109
10274 1 19 . 1 1 44 44 ALA C C 44 180.924 180.924 179.468 1.456 25109
10275 1 19 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.449 0.776 25109
10276 1 19 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.696 -0.600 25109
10277 1 19 . 1 1 44 44 ALA H H 44 7.774 7.774 7.466 0.308 25109
10278 1 19 . 1 1 45 45 THR N N 45 115.017 115.017 117.156 -2.139 25109
10279 1 19 . 1 1 45 45 THR HA H 45 3.879 3.879 3.983 -0.104 25109
10280 1 19 . 1 1 45 45 THR CA C 45 66.327 66.327 67.051 -0.724 25109
10281 1 19 . 1 1 45 45 THR CB C 45 68.809 68.809 68.490 0.319 25109
10282 1 19 . 1 1 45 45 THR H H 45 8.167 8.167 8.437 -0.270 25109
10283 1 19 . 1 1 46 46 CYS N N 46 123.609 123.609 118.316 5.293 25109
10284 1 19 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.334 -0.315 25109
10285 1 19 . 1 1 46 46 CYS C C 46 178.077 178.077 175.894 2.183 25109
10286 1 19 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.463 1.482 25109
10287 1 19 . 1 1 46 46 CYS CB C 46 26.139 26.139 26.698 -0.558 25109
10288 1 19 . 1 1 46 46 CYS H H 46 8.084 8.084 8.192 -0.108 25109
10289 1 19 . 1 1 47 47 THR N N 47 115.520 115.520 115.519 0.001 25109
10290 1 19 . 1 1 47 47 THR HA H 47 3.915 3.915 4.287 -0.372 25109
10291 1 19 . 1 1 47 47 THR CA C 47 66.063 66.063 64.826 1.237 25109
10292 1 19 . 1 1 47 47 THR CB C 47 69.245 69.245 68.977 0.268 25109
10293 1 19 . 1 1 47 47 THR H H 47 7.735 7.735 7.492 0.243 25109
10294 1 19 . 1 1 48 48 LEU N N 48 120.099 120.099 121.965 -1.866 25109
10295 1 19 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.220 0.006 25109
10296 1 19 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.222 0.341 25109
10297 1 19 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.362 1.263 25109
10298 1 19 . 1 1 48 48 LEU H H 48 7.464 7.464 7.338 0.126 25109
10299 1 19 . 1 1 49 49 SER N N 49 111.979 111.979 112.870 -0.891 25109
10300 1 19 . 1 1 49 49 SER HA H 49 4.661 4.661 4.535 0.126 25109
10301 1 19 . 1 1 49 49 SER C C 49 175.581 175.581 175.166 0.415 25109
10302 1 19 . 1 1 49 49 SER CA C 49 59.590 59.590 58.808 0.782 25109
10303 1 19 . 1 1 49 49 SER CB C 49 65.335 65.335 64.371 0.964 25109
10304 1 19 . 1 1 49 49 SER H H 49 8.781 8.781 8.122 0.659 25109
10305 1 19 . 1 1 50 50 GLY N N 50 110.194 110.194 107.934 2.260 25109
10306 1 19 . 1 1 50 50 GLY C C 50 175.123 175.123 172.877 2.246 25109
10307 1 19 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.128 -0.226 25109
10308 1 19 . 1 1 50 50 GLY H H 50 7.955 7.955 7.472 0.483 25109
10309 1 19 . 1 1 51 51 ASN N N 51 121.050 121.050 119.577 1.473 25109
10310 1 19 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.591 -0.341 25109
10311 1 19 . 1 1 51 51 ASN C C 51 176.403 176.403 176.922 -0.519 25109
10312 1 19 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.444 3.859 25109
10313 1 19 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.695 2.904 25109
10314 1 19 . 1 1 51 51 ASN H H 51 8.898 8.898 8.831 0.067 25109
10315 1 19 . 1 1 52 52 ARG N N 52 119.825 119.825 119.266 0.559 25109
10316 1 19 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.134 -0.096 25109
10317 1 19 . 1 1 52 52 ARG C C 52 178.850 178.850 177.354 1.496 25109
10318 1 19 . 1 1 52 52 ARG CA C 52 61.064 61.064 59.556 1.508 25109
10319 1 19 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.930 0.093 25109
10320 1 19 . 1 1 52 52 ARG H H 52 8.696 8.696 8.495 0.201 25109
10321 1 19 . 1 1 53 53 ASP N N 53 116.032 116.032 117.136 -1.104 25109
10322 1 19 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.782 -0.236 25109
10323 1 19 . 1 1 53 53 ASP C C 53 178.996 178.996 178.589 0.407 25109
10324 1 19 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.265 -1.186 25109
10325 1 19 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.584 -2.213 25109
10326 1 19 . 1 1 53 53 ASP H H 53 9.036 9.036 8.500 0.536 25109
10327 1 19 . 1 1 54 54 THR N N 54 115.848 115.848 117.467 -1.619 25109
10328 1 19 . 1 1 54 54 THR HA H 54 3.746 3.746 4.467 -0.721 25109
10329 1 19 . 1 1 54 54 THR CA C 54 67.885 67.885 66.217 1.668 25109
10330 1 19 . 1 1 54 54 THR CB C 54 66.953 66.953 68.898 -1.945 25109
10331 1 19 . 1 1 54 54 THR H H 54 7.782 7.782 7.847 -0.065 25109
10332 1 19 . 1 1 55 55 LEU N N 55 125.987 125.987 122.762 3.225 25109
10333 1 19 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.070 -0.516 25109
10334 1 19 . 1 1 55 55 LEU C C 55 177.901 177.901 177.923 -0.022 25109
10335 1 19 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.157 0.296 25109
10336 1 19 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.615 0.248 25109
10337 1 19 . 1 1 55 55 LEU H H 55 8.740 8.740 7.865 0.875 25109
10338 1 19 . 1 1 56 56 TRP N N 56 116.672 116.672 116.067 0.605 25109
10339 1 19 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.757 -0.677 25109
10340 1 19 . 1 1 56 56 TRP C C 56 179.588 179.588 177.603 1.985 25109
10341 1 19 . 1 1 56 56 TRP CA C 56 61.481 61.481 60.056 1.425 25109
10342 1 19 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.245 -0.053 25109
10343 1 19 . 1 1 56 56 TRP H H 56 7.642 7.642 8.126 -0.484 25109
10344 1 19 . 1 1 57 57 HIS N N 57 115.754 115.754 114.816 0.938 25109
10345 1 19 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.645 -0.369 25109
10346 1 19 . 1 1 57 57 HIS C C 57 177.514 177.514 175.801 1.713 25109
10347 1 19 . 1 1 57 57 HIS CA C 57 58.952 58.952 58.399 0.553 25109
10348 1 19 . 1 1 57 57 HIS CB C 57 28.002 28.002 31.234 -3.232 25109
10349 1 19 . 1 1 57 57 HIS H H 57 7.407 7.407 7.987 -0.580 25109
10350 1 19 . 1 1 58 58 LEU N N 58 123.934 123.934 121.449 2.485 25109
10351 1 19 . 1 1 58 58 LEU HA H 58 3.787 3.787 4.130 -0.343 25109
10352 1 19 . 1 1 58 58 LEU C C 58 178.115 178.115 177.459 0.656 25109
10353 1 19 . 1 1 58 58 LEU CA C 58 58.909 58.909 56.921 1.988 25109
10354 1 19 . 1 1 58 58 LEU CB C 58 40.815 40.815 42.064 -1.249 25109
10355 1 19 . 1 1 58 58 LEU H H 58 8.996 8.996 7.679 1.317 25109
10356 1 19 . 1 1 59 59 PHE N N 59 117.721 117.721 115.692 2.029 25109
10357 1 19 . 1 1 59 59 PHE HA H 59 3.935 3.935 4.024 -0.089 25109
10358 1 19 . 1 1 59 59 PHE C C 59 176.987 176.987 176.013 0.974 25109
10359 1 19 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.542 -1.429 25109
10360 1 19 . 1 1 59 59 PHE CB C 59 36.960 36.960 38.660 -1.700 25109
10361 1 19 . 1 1 59 59 PHE H H 59 8.201 8.201 7.967 0.234 25109
10362 1 19 . 1 1 60 60 ASN N N 60 115.695 115.695 116.126 -0.431 25109
10363 1 19 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.598 -0.679 25109
10364 1 19 . 1 1 60 60 ASN C C 60 176.670 176.670 176.084 0.586 25109
10365 1 19 . 1 1 60 60 ASN CA C 60 56.756 56.756 54.878 1.878 25109
10366 1 19 . 1 1 60 60 ASN CB C 60 39.318 39.318 39.238 0.080 25109
10367 1 19 . 1 1 60 60 ASN H H 60 7.666 7.666 8.093 -0.427 25109
10368 1 19 . 1 1 61 61 THR N N 61 115.110 115.110 116.867 -1.757 25109
10369 1 19 . 1 1 61 61 THR HA H 61 3.733 3.733 3.867 -0.134 25109
10370 1 19 . 1 1 61 61 THR CA C 61 66.319 66.319 65.169 1.150 25109
10371 1 19 . 1 1 61 61 THR CB C 61 69.174 69.174 67.443 1.731 25109
10372 1 19 . 1 1 61 61 THR H H 61 7.782 7.782 8.527 -0.745 25109
10373 1 19 . 1 1 62 62 LEU N N 62 121.559 121.559 122.981 -1.422 25109
10374 1 19 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.906 -0.417 25109
10375 1 19 . 1 1 62 62 LEU C C 62 176.600 176.600 176.704 -0.104 25109
10376 1 19 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.739 0.226 25109
10377 1 19 . 1 1 62 62 LEU CB C 62 42.335 42.335 41.550 0.784 25109
10378 1 19 . 1 1 62 62 LEU H H 62 8.362 8.362 7.610 0.752 25109
10379 1 19 . 1 1 63 63 GLN N N 63 109.150 109.150 114.771 -5.621 25109
10380 1 19 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.303 -1.226 25109
10381 1 19 . 1 1 63 63 GLN C C 63 175.194 175.194 177.661 -2.467 25109
10382 1 19 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.623 -1.357 25109
10383 1 19 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.674 -1.980 25109
10384 1 19 . 1 1 63 63 GLN H H 63 6.458 6.458 7.462 -1.004 25109
10385 1 19 . 1 1 64 64 ARG N N 64 116.029 116.029 118.078 -2.049 25109
10386 1 19 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.204 -0.106 25109
10387 1 19 . 1 1 64 64 ARG C C 64 176.459 176.459 176.488 -0.029 25109
10388 1 19 . 1 1 64 64 ARG CA C 64 56.143 56.143 57.320 -1.177 25109
10389 1 19 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.788 -0.204 25109
10390 1 19 . 1 1 64 64 ARG H H 64 6.596 6.596 7.434 -0.838 25109
10391 1 19 . 1 1 65 65 ARG N N 65 120.422 120.422 119.377 1.045 25109
10392 1 19 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.506 0.328 25109
10393 1 19 . 1 1 65 65 ARG C C 65 173.436 173.436 174.522 -1.086 25109
10394 1 19 . 1 1 65 65 ARG CA C 65 51.545 51.545 53.373 -1.828 25109
10395 1 19 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.050 -0.054 25109
10396 1 19 . 1 1 65 65 ARG H H 65 7.932 7.932 7.520 0.412 25109
10397 1 19 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.585 -0.011 25109
10398 1 19 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.989 0.070 25109
10399 1 19 . 1 1 67 67 GLY N N 67 111.953 111.953 114.725 -2.772 25109
10400 1 19 . 1 1 67 67 GLY C C 67 177.057 177.057 175.931 1.126 25109
10401 1 19 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.314 0.993 25109
10402 1 19 . 1 1 67 67 GLY H H 67 9.198 9.198 8.712 0.486 25109
10403 1 19 . 1 1 68 68 TRP N N 68 117.467 117.467 117.411 0.056 25109
10404 1 19 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.454 -0.112 25109
10405 1 19 . 1 1 68 68 TRP C C 68 177.690 177.690 176.637 1.053 25109
10406 1 19 . 1 1 68 68 TRP CA C 68 60.116 60.116 59.106 1.010 25109
10407 1 19 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.190 1.000 25109
10408 1 19 . 1 1 68 68 TRP H H 68 7.647 7.647 7.616 0.031 25109
10409 1 19 . 1 1 69 69 VAL N N 69 121.482 121.482 121.442 0.040 25109
10410 1 19 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.312 -0.675 25109
10411 1 19 . 1 1 69 69 VAL C C 69 177.993 177.993 177.808 0.185 25109
10412 1 19 . 1 1 69 69 VAL CA C 69 67.466 67.466 65.984 1.483 25109
10413 1 19 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.488 -0.462 25109
10414 1 19 . 1 1 69 69 VAL H H 69 6.666 6.666 6.869 -0.203 25109
10415 1 19 . 1 1 70 70 GLU N N 70 116.350 116.350 119.183 -2.833 25109
10416 1 19 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.913 -0.088 25109
10417 1 19 . 1 1 70 70 GLU C C 70 180.362 180.362 179.309 1.053 25109
10418 1 19 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.365 -0.144 25109
10419 1 19 . 1 1 70 70 GLU CB C 70 27.305 27.305 29.142 -1.837 25109
10420 1 19 . 1 1 70 70 GLU H H 70 7.410 7.410 7.660 -0.250 25109
10421 1 19 . 1 1 71 71 TYR N N 71 116.750 116.750 118.652 -1.902 25109
10422 1 19 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.308 0.142 25109
10423 1 19 . 1 1 71 71 TYR C C 71 178.411 178.411 178.087 0.324 25109
10424 1 19 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.724 0.878 25109
10425 1 19 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.425 -0.070 25109
10426 1 19 . 1 1 71 71 TYR H H 71 7.159 7.159 7.459 -0.300 25109
10427 1 19 . 1 1 72 72 PHE N N 72 121.610 121.610 120.987 0.623 25109
10428 1 19 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.188 0.314 25109
10429 1 19 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.552 -0.732 25109
10430 1 19 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.320 0.729 25109
10431 1 19 . 1 1 72 72 PHE H H 72 9.007 9.007 8.389 0.618 25109
10432 1 19 . 1 1 73 73 ILE N N 73 119.200 119.200 119.084 0.116 25109
10433 1 19 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.459 -0.279 25109
10434 1 19 . 1 1 73 73 ILE C C 73 177.620 177.620 177.536 0.084 25109
10435 1 19 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.677 1.520 25109
10436 1 19 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.573 1.450 25109
10437 1 19 . 1 1 73 73 ILE H H 73 8.644 8.644 8.736 -0.092 25109
10438 1 19 . 1 1 74 74 ALA N N 74 119.624 119.624 120.089 -0.465 25109
10439 1 19 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.131 -0.177 25109
10440 1 19 . 1 1 74 74 ALA C C 74 181.030 181.030 178.959 2.071 25109
10441 1 19 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.329 1.082 25109
10442 1 19 . 1 1 74 74 ALA CB C 74 18.136 18.136 18.017 0.119 25109
10443 1 19 . 1 1 74 74 ALA H H 74 7.476 7.476 7.729 -0.253 25109
10444 1 19 . 1 1 75 75 ALA N N 75 123.625 123.625 122.928 0.697 25109
10445 1 19 . 1 1 75 75 ALA HA H 75 3.838 3.838 4.272 -0.434 25109
10446 1 19 . 1 1 75 75 ALA C C 75 179.272 179.272 179.334 -0.062 25109
10447 1 19 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.470 0.632 25109
10448 1 19 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.547 1.046 25109
10449 1 19 . 1 1 75 75 ALA H H 75 8.524 8.524 7.153 1.371 25109
10450 1 19 . 1 1 76 76 LEU N N 76 118.114 118.114 120.505 -2.391 25109
10451 1 19 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.018 -0.346 25109
10452 1 19 . 1 1 76 76 LEU C C 76 180.001 180.001 179.060 0.941 25109
10453 1 19 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.190 1.066 25109
10454 1 19 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.359 1.260 25109
10455 1 19 . 1 1 76 76 LEU H H 76 8.153 8.153 7.808 0.345 25109
10456 1 19 . 1 1 77 77 ARG N N 77 117.830 117.830 119.223 -1.393 25109
10457 1 19 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.994 -0.547 25109
10458 1 19 . 1 1 77 77 ARG C C 77 180.889 180.889 179.206 1.683 25109
10459 1 19 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.317 1.749 25109
10460 1 19 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.862 -0.665 25109
10461 1 19 . 1 1 77 77 ARG H H 77 7.945 7.945 8.170 -0.225 25109
10462 1 19 . 1 1 78 78 GLY N N 78 110.202 110.202 108.306 1.896 25109
10463 1 19 . 1 1 78 78 GLY C C 78 174.807 174.807 174.492 0.315 25109
10464 1 19 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.068 0.492 25109
10465 1 19 . 1 1 78 78 GLY H H 78 8.269 8.269 7.990 0.279 25109
10466 1 19 . 1 1 79 79 CYS N N 79 115.567 115.567 117.727 -2.160 25109
10467 1 19 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.616 -0.227 25109
10468 1 19 . 1 1 79 79 CYS C C 79 173.025 173.025 174.320 -1.295 25109
10469 1 19 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.499 2.458 25109
10470 1 19 . 1 1 79 79 CYS CB C 79 27.805 27.805 28.155 -0.350 25109
10471 1 19 . 1 1 79 79 CYS H H 79 7.132 7.132 7.230 -0.098 25109
10472 1 19 . 1 1 80 80 GLU N N 80 111.759 111.759 115.642 -3.883 25109
10473 1 19 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.923 -0.190 25109
10474 1 19 . 1 1 80 80 GLU C C 80 175.827 175.827 175.091 0.736 25109
10475 1 19 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.828 -0.361 25109
10476 1 19 . 1 1 80 80 GLU CB C 80 24.717 24.717 26.530 -1.813 25109
10477 1 19 . 1 1 80 80 GLU H H 80 7.772 7.772 7.992 -0.220 25109
10478 1 19 . 1 1 81 81 LEU N N 81 124.692 124.692 121.300 3.392 25109
10479 1 19 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.472 0.219 25109
10480 1 19 . 1 1 81 81 LEU CA C 81 52.955 52.955 54.040 -1.085 25109
10481 1 19 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.272 -0.881 25109
10482 1 19 . 1 1 81 81 LEU H H 81 8.167 8.167 8.339 -0.172 25109
10483 1 19 . 1 1 82 82 VAL N N 82 118.320 118.320 122.410 -4.090 25109
10484 1 19 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.657 -0.480 25109
10485 1 19 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.396 0.314 25109
10486 1 19 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.527 0.421 25109
10487 1 19 . 1 1 82 82 VAL H H 82 7.141 7.141 7.592 -0.451 25109
10488 1 19 . 1 1 83 83 ASP N N 83 118.733 118.733 120.470 -1.737 25109
10489 1 19 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.395 -0.063 25109
10490 1 19 . 1 1 83 83 ASP C C 83 178.674 178.674 178.447 0.227 25109
10491 1 19 . 1 1 83 83 ASP CA C 83 56.443 56.443 56.968 -0.525 25109
10492 1 19 . 1 1 83 83 ASP CB C 83 36.829 36.829 39.743 -2.914 25109
10493 1 19 . 1 1 83 83 ASP H H 83 8.385 8.385 8.656 -0.271 25109
10494 1 19 . 1 1 84 84 LEU N N 84 121.026 121.026 120.588 0.438 25109
10495 1 19 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.204 -0.225 25109
10496 1 19 . 1 1 84 84 LEU C C 84 178.796 178.796 179.412 -0.616 25109
10497 1 19 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.043 0.479 25109
10498 1 19 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.739 0.756 25109
10499 1 19 . 1 1 84 84 LEU H H 84 7.770 7.770 7.933 -0.163 25109
10500 1 19 . 1 1 85 85 ALA N N 85 121.525 121.525 121.518 0.007 25109
10501 1 19 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.866 -0.205 25109
10502 1 19 . 1 1 85 85 ALA C C 85 179.322 179.322 179.230 0.092 25109
10503 1 19 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.088 0.753 25109
10504 1 19 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.093 0.834 25109
10505 1 19 . 1 1 85 85 ALA H H 85 8.126 8.126 7.728 0.398 25109
10506 1 19 . 1 1 86 86 ASP N N 86 115.349 115.349 118.426 -3.077 25109
10507 1 19 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.323 -0.050 25109
10508 1 19 . 1 1 86 86 ASP C C 86 178.463 178.463 178.114 0.349 25109
10509 1 19 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.615 -1.904 25109
10510 1 19 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.114 -3.952 25109
10511 1 19 . 1 1 86 86 ASP H H 86 8.410 8.410 8.069 0.341 25109
10512 1 19 . 1 1 87 87 GLU N N 87 122.529 122.529 118.932 3.597 25109
10513 1 19 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.103 -0.067 25109
10514 1 19 . 1 1 87 87 GLU C C 87 178.508 178.508 179.088 -0.580 25109
10515 1 19 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.077 0.277 25109
10516 1 19 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.612 -1.339 25109
10517 1 19 . 1 1 87 87 GLU H H 87 8.012 8.012 7.969 0.043 25109
10518 1 19 . 1 1 88 88 VAL N N 88 119.148 119.148 120.345 -1.197 25109
10519 1 19 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.787 -0.457 25109
10520 1 19 . 1 1 88 88 VAL C C 88 177.240 177.240 177.574 -0.334 25109
10521 1 19 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.441 1.808 25109
10522 1 19 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.908 -0.379 25109
10523 1 19 . 1 1 88 88 VAL H H 88 8.291 8.291 7.551 0.740 25109
10524 1 19 . 1 1 89 89 ALA N N 89 120.709 120.709 123.191 -2.482 25109
10525 1 19 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.002 -0.087 25109
10526 1 19 . 1 1 89 89 ALA C C 89 180.186 180.186 179.788 0.398 25109
10527 1 19 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.513 0.546 25109
10528 1 19 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.232 0.003 25109
10529 1 19 . 1 1 89 89 ALA H H 89 8.548 8.548 8.030 0.518 25109
10530 1 19 . 1 1 90 90 SER N N 90 113.035 113.035 112.808 0.227 25109
10531 1 19 . 1 1 90 90 SER HA H 90 4.047 4.047 4.376 -0.329 25109
10532 1 19 . 1 1 90 90 SER C C 90 177.564 177.564 176.350 1.214 25109
10533 1 19 . 1 1 90 90 SER CA C 90 61.771 61.771 61.240 0.531 25109
10534 1 19 . 1 1 90 90 SER CB C 90 62.907 62.907 62.786 0.121 25109
10535 1 19 . 1 1 90 90 SER H H 90 7.969 7.969 7.878 0.091 25109
10536 1 19 . 1 1 91 91 VAL N N 91 123.417 123.417 122.176 1.241 25109
10537 1 19 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.521 -0.174 25109
10538 1 19 . 1 1 91 91 VAL C C 91 178.428 178.428 177.565 0.863 25109
10539 1 19 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.061 0.068 25109
10540 1 19 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.850 -0.079 25109
10541 1 19 . 1 1 91 91 VAL H H 91 7.713 7.713 7.196 0.517 25109
10542 1 19 . 1 1 92 92 TYR N N 92 121.458 121.458 118.965 2.493 25109
10543 1 19 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.423 -0.232 25109
10544 1 19 . 1 1 92 92 TYR CA C 92 60.994 60.994 58.843 2.151 25109
10545 1 19 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.286 0.699 25109
10546 1 19 . 1 1 92 92 TYR H H 92 8.395 8.395 7.799 0.596 25109
10547 1 19 . 1 1 93 93 GLN N N 93 115.549 115.549 118.650 -3.101 25109
10548 1 19 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.006 -0.295 25109
10549 1 19 . 1 1 93 93 GLN CA C 93 58.094 58.094 58.409 -0.315 25109
10550 1 19 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.769 -0.471 25109
10551 1 19 . 1 1 93 93 GLN H H 93 8.167 8.167 7.588 0.579 25109
10552 1 19 . 1 1 94 94 SER N N 94 115.923 115.923 112.896 3.027 25109
10553 1 19 . 1 1 94 94 SER HA H 94 4.096 4.096 4.232 -0.136 25109
10554 1 19 . 1 1 94 94 SER CA C 94 60.971 60.971 59.704 1.267 25109
10555 1 19 . 1 1 94 94 SER CB C 94 62.635 62.635 63.814 -1.179 25109
10556 1 19 . 1 1 94 94 SER H H 94 7.642 7.642 7.359 0.283 25109
10557 1 19 . 1 1 95 95 TYR N N 95 119.565 119.565 122.931 -3.366 25109
10558 1 19 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.310 0.449 25109
10559 1 19 . 1 1 95 95 TYR C C 95 175.334 175.334 174.472 0.862 25109
10560 1 19 . 1 1 95 95 TYR CA C 95 57.698 57.698 58.018 -0.320 25109
10561 1 19 . 1 1 95 95 TYR CB C 95 39.319 39.319 36.271 3.048 25109
10562 1 19 . 1 1 95 95 TYR H H 95 7.069 7.069 7.259 -0.190 25109
10563 1 19 . 1 1 96 96 GLN N N 96 119.872 119.872 119.560 0.312 25109
10564 1 19 . 1 1 96 96 GLN HA H 96 4.365 4.365 3.968 0.397 25109
10565 1 19 . 1 1 96 96 GLN C C 96 173.612 173.612 174.031 -0.419 25109
10566 1 19 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.672 -1.335 25109
10567 1 19 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.611 0.883 25109
10568 1 19 . 1 1 96 96 GLN H H 96 7.409 7.409 7.899 -0.490 25109
10569 1 19 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.387 -0.069 25109
10570 1 19 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.847 -0.833 25109
10571 1 19 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.087 0.012 25109
10572 1 19 . 1 1 98 98 ARG N N 98 121.759 121.759 115.979 5.780 25109
10573 1 19 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.605 -0.263 25109
10574 1 19 . 1 1 98 98 ARG C C 98 176.848 176.848 174.936 1.912 25109
10575 1 19 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.760 1.461 25109
10576 1 19 . 1 1 98 98 ARG CB C 98 31.087 31.087 31.575 -0.488 25109
10577 1 19 . 1 1 98 98 ARG H H 98 8.423 8.423 7.425 0.998 25109
10578 1 19 . 1 1 99 99 THR N N 99 115.292 115.292 118.531 -3.239 25109
10579 1 19 . 1 1 99 99 THR HA H 99 4.323 4.323 4.523 -0.200 25109
10580 1 19 . 1 1 99 99 THR C C 99 174.350 174.350 174.141 0.209 25109
10581 1 19 . 1 1 99 99 THR CA C 99 61.906 61.906 63.429 -1.523 25109
10582 1 19 . 1 1 99 99 THR CB C 99 70.180 70.180 67.646 2.534 25109
10583 1 19 . 1 1 99 99 THR H H 99 8.179 8.179 8.473 -0.294 25109
10584 1 20 . 1 1 0 0 SER N N 0 115.693 115.693 116.249 -0.556 25109
10585 1 20 . 1 1 0 0 SER HA H 0 4.531 4.531 4.799 -0.268 25109
10586 1 20 . 1 1 0 0 SER C C 0 174.557 174.557 173.983 0.574 25109
10587 1 20 . 1 1 0 0 SER CA C 0 58.478 58.478 57.942 0.536 25109
10588 1 20 . 1 1 0 0 SER CB C 0 64.380 64.380 65.890 -1.510 25109
10589 1 20 . 1 1 0 0 SER H H 0 8.631 8.631 8.310 0.321 25109
10590 1 20 . 1 1 1 1 MET N N 1 123.111 123.111 120.224 2.887 25109
10591 1 20 . 1 1 1 1 MET HA H 1 4.728 4.728 4.382 0.346 25109
10592 1 20 . 1 1 1 1 MET C C 1 174.846 174.846 173.986 0.860 25109
10593 1 20 . 1 1 1 1 MET CA C 1 55.655 55.655 55.081 0.574 25109
10594 1 20 . 1 1 1 1 MET CB C 1 32.035 32.035 32.221 -0.186 25109
10595 1 20 . 1 1 1 1 MET H H 1 8.641 8.641 8.508 0.133 25109
10596 1 20 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.762 -0.285 25109
10597 1 20 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.846 0.154 25109
10598 1 20 . 1 1 3 3 PHE N N 3 121.126 121.126 126.313 -5.187 25109
10599 1 20 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.653 -0.287 25109
10600 1 20 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.172 1.690 25109
10601 1 20 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.694 -1.327 25109
10602 1 20 . 1 1 3 3 PHE H H 3 8.177 8.177 9.782 -1.605 25109
10603 1 20 . 1 1 4 4 ALA N N 4 121.170 121.170 122.760 -1.590 25109
10604 1 20 . 1 1 4 4 ALA HA H 4 3.835 3.835 3.888 -0.053 25109
10605 1 20 . 1 1 4 4 ALA C C 4 181.522 181.522 178.815 2.707 25109
10606 1 20 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.455 -0.001 25109
10607 1 20 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.463 0.973 25109
10608 1 20 . 1 1 4 4 ALA H H 4 8.444 8.444 9.054 -0.610 25109
10609 1 20 . 1 1 5 5 GLU N N 5 118.932 118.932 118.515 0.417 25109
10610 1 20 . 1 1 5 5 GLU HA H 5 3.855 3.855 4.067 -0.212 25109
10611 1 20 . 1 1 5 5 GLU C C 5 177.971 177.971 178.350 -0.379 25109
10612 1 20 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.558 0.073 25109
10613 1 20 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.855 -0.094 25109
10614 1 20 . 1 1 5 5 GLU H H 5 8.454 8.454 8.784 -0.330 25109
10615 1 20 . 1 1 6 6 ASP N N 6 120.471 120.471 119.396 1.075 25109
10616 1 20 . 1 1 6 6 ASP C C 6 178.885 178.885 178.188 0.697 25109
10617 1 20 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.870 -0.798 25109
10618 1 20 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.752 -1.620 25109
10619 1 20 . 1 1 6 6 ASP H H 6 8.316 8.316 8.574 -0.258 25109
10620 1 20 . 1 1 7 7 LYS N N 7 118.335 118.335 118.710 -0.375 25109
10621 1 20 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.810 -0.120 25109
10622 1 20 . 1 1 7 7 LYS C C 7 180.080 180.080 178.936 1.144 25109
10623 1 20 . 1 1 7 7 LYS CA C 7 58.720 58.720 59.091 -0.371 25109
10624 1 20 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.819 -0.025 25109
10625 1 20 . 1 1 7 7 LYS H H 7 8.249 8.249 7.811 0.438 25109
10626 1 20 . 1 1 8 8 THR N N 8 119.222 119.222 116.940 2.282 25109
10627 1 20 . 1 1 8 8 THR HA H 8 3.975 3.975 4.074 -0.099 25109
10628 1 20 . 1 1 8 8 THR CA C 8 68.453 68.453 66.863 1.590 25109
10629 1 20 . 1 1 8 8 THR CB C 8 67.387 67.387 69.121 -1.734 25109
10630 1 20 . 1 1 8 8 THR H H 8 7.897 7.897 7.776 0.121 25109
10631 1 20 . 1 1 9 9 TYR N N 9 123.054 123.054 123.179 -0.125 25109
10632 1 20 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.302 -0.049 25109
10633 1 20 . 1 1 9 9 TYR C C 9 177.441 177.441 177.050 0.391 25109
10634 1 20 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.050 -0.152 25109
10635 1 20 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.477 -0.628 25109
10636 1 20 . 1 1 9 9 TYR H H 9 8.605 8.605 8.606 -0.001 25109
10637 1 20 . 1 1 10 10 LYS N N 10 118.366 118.366 117.351 1.015 25109
10638 1 20 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.802 -0.208 25109
10639 1 20 . 1 1 10 10 LYS C C 10 178.885 178.885 178.402 0.483 25109
10640 1 20 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.161 1.883 25109
10641 1 20 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.601 0.444 25109
10642 1 20 . 1 1 10 10 LYS H H 10 8.066 8.066 8.358 -0.292 25109
10643 1 20 . 1 1 11 11 TYR N N 11 120.539 120.539 120.929 -0.390 25109
10644 1 20 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.377 -0.387 25109
10645 1 20 . 1 1 11 11 TYR C C 11 178.233 178.233 177.635 0.598 25109
10646 1 20 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.677 0.851 25109
10647 1 20 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.797 -1.434 25109
10648 1 20 . 1 1 11 11 TYR H H 11 7.875 7.875 7.718 0.157 25109
10649 1 20 . 1 1 12 12 ILE N N 12 121.893 121.893 119.607 2.286 25109
10650 1 20 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.904 -0.808 25109
10651 1 20 . 1 1 12 12 ILE C C 12 177.015 177.015 177.070 -0.055 25109
10652 1 20 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.634 2.129 25109
10653 1 20 . 1 1 12 12 ILE CB C 12 37.552 37.552 37.269 0.283 25109
10654 1 20 . 1 1 12 12 ILE H H 12 8.154 8.154 8.371 -0.217 25109
10655 1 20 . 1 1 13 13 CYS N N 13 113.894 113.894 116.060 -2.166 25109
10656 1 20 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.768 0.119 25109
10657 1 20 . 1 1 13 13 CYS C C 13 178.288 178.288 176.466 1.822 25109
10658 1 20 . 1 1 13 13 CYS CA C 13 64.337 64.337 60.458 3.880 25109
10659 1 20 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.964 0.041 25109
10660 1 20 . 1 1 13 13 CYS H H 13 7.551 7.551 8.103 -0.552 25109
10661 1 20 . 1 1 14 14 ARG N N 14 119.228 119.228 119.091 0.137 25109
10662 1 20 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.036 0.034 25109
10663 1 20 . 1 1 14 14 ARG C C 14 177.127 177.127 177.134 -0.007 25109
10664 1 20 . 1 1 14 14 ARG CA C 14 58.494 58.494 59.114 -0.620 25109
10665 1 20 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.273 0.149 25109
10666 1 20 . 1 1 14 14 ARG H H 14 7.991 7.991 7.426 0.565 25109
10667 1 20 . 1 1 15 15 ASN N N 15 117.367 117.367 116.673 0.694 25109
10668 1 20 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.778 0.191 25109
10669 1 20 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.377 0.386 25109
10670 1 20 . 1 1 15 15 ASN CB C 15 38.585 38.585 37.906 0.679 25109
10671 1 20 . 1 1 15 15 ASN H H 15 7.643 7.643 7.571 0.072 25109
10672 1 20 . 1 1 16 16 PHE N N 16 122.356 122.356 122.134 0.222 25109
10673 1 20 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.910 0.306 25109
10674 1 20 . 1 1 16 16 PHE C C 16 178.084 178.084 176.769 1.315 25109
10675 1 20 . 1 1 16 16 PHE CA C 16 63.177 63.177 60.885 2.292 25109
10676 1 20 . 1 1 16 16 PHE CB C 16 40.589 40.589 38.983 1.606 25109
10677 1 20 . 1 1 16 16 PHE H H 16 6.992 6.992 7.342 -0.350 25109
10678 1 20 . 1 1 17 17 SER N N 17 112.937 112.937 114.848 -1.911 25109
10679 1 20 . 1 1 17 17 SER HA H 17 4.199 4.199 4.243 -0.044 25109
10680 1 20 . 1 1 17 17 SER C C 17 176.726 176.726 176.799 -0.073 25109
10681 1 20 . 1 1 17 17 SER CA C 17 62.052 62.052 60.707 1.345 25109
10682 1 20 . 1 1 17 17 SER CB C 17 62.552 62.552 63.060 -0.508 25109
10683 1 20 . 1 1 17 17 SER H H 17 8.840 8.840 8.326 0.514 25109
10684 1 20 . 1 1 18 18 ASN N N 18 118.809 118.809 121.942 -3.133 25109
10685 1 20 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.525 -0.167 25109
10686 1 20 . 1 1 18 18 ASN C C 18 175.967 175.967 176.765 -0.798 25109
10687 1 20 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.559 -0.649 25109
10688 1 20 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.242 -0.414 25109
10689 1 20 . 1 1 18 18 ASN H H 18 8.130 8.130 8.472 -0.342 25109
10690 1 20 . 1 1 19 19 PHE N N 19 115.750 115.750 115.909 -0.159 25109
10691 1 20 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.540 -0.255 25109
10692 1 20 . 1 1 19 19 PHE C C 19 175.370 175.370 175.603 -0.233 25109
10693 1 20 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.641 0.221 25109
10694 1 20 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.413 1.466 25109
10695 1 20 . 1 1 19 19 PHE H H 19 8.062 8.062 7.391 0.671 25109
10696 1 20 . 1 1 20 20 CYS N N 20 113.958 113.958 115.919 -1.961 25109
10697 1 20 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.512 -0.569 25109
10698 1 20 . 1 1 20 20 CYS C C 20 173.823 173.823 174.641 -0.818 25109
10699 1 20 . 1 1 20 20 CYS CA C 20 61.788 61.788 58.850 2.938 25109
10700 1 20 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.348 0.035 25109
10701 1 20 . 1 1 20 20 CYS H H 20 6.850 6.850 7.294 -0.444 25109
10702 1 20 . 1 1 21 21 ASN N N 21 116.691 116.691 119.468 -2.777 25109
10703 1 20 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.787 -0.043 25109
10704 1 20 . 1 1 21 21 ASN C C 21 175.299 175.299 173.314 1.985 25109
10705 1 20 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.124 0.166 25109
10706 1 20 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.715 -1.402 25109
10707 1 20 . 1 1 21 21 ASN H H 21 8.251 8.251 7.657 0.594 25109
10708 1 20 . 1 1 22 22 VAL N N 22 122.431 122.431 119.572 2.859 25109
10709 1 20 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.229 -0.679 25109
10710 1 20 . 1 1 22 22 VAL C C 22 174.034 174.034 173.498 0.536 25109
10711 1 20 . 1 1 22 22 VAL CA C 22 63.937 63.937 61.084 2.853 25109
10712 1 20 . 1 1 22 22 VAL CB C 22 31.523 31.523 36.507 -4.984 25109
10713 1 20 . 1 1 22 22 VAL H H 22 7.573 7.573 7.898 -0.325 25109
10714 1 20 . 1 1 23 23 ASP N N 23 127.219 127.219 123.970 3.249 25109
10715 1 20 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.380 -1.194 25109
10716 1 20 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.448 -2.655 25109
10717 1 20 . 1 1 23 23 ASP H H 23 8.687 8.687 8.636 0.051 25109
10718 1 20 . 1 1 24 24 VAL N N 24 127.835 127.835 123.629 4.206 25109
10719 1 20 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.132 -0.839 25109
10720 1 20 . 1 1 24 24 VAL C C 24 176.867 176.867 177.223 -0.356 25109
10721 1 20 . 1 1 24 24 VAL CA C 24 67.163 67.163 63.342 3.821 25109
10722 1 20 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.436 -0.421 25109
10723 1 20 . 1 1 24 24 VAL H H 24 9.409 9.409 8.695 0.714 25109
10724 1 20 . 1 1 25 25 VAL N N 25 114.324 114.324 116.051 -1.727 25109
10725 1 20 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.852 -0.333 25109
10726 1 20 . 1 1 25 25 VAL C C 25 178.006 178.006 177.369 0.637 25109
10727 1 20 . 1 1 25 25 VAL CA C 25 66.688 66.688 65.290 1.398 25109
10728 1 20 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.541 -0.009 25109
10729 1 20 . 1 1 25 25 VAL H H 25 8.038 8.038 7.811 0.227 25109
10730 1 20 . 1 1 26 26 GLU N N 26 117.009 117.009 118.819 -1.810 25109
10731 1 20 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.094 -0.003 25109
10732 1 20 . 1 1 26 26 GLU C C 26 177.303 177.303 178.452 -1.149 25109
10733 1 20 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.373 -0.941 25109
10734 1 20 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.520 -0.555 25109
10735 1 20 . 1 1 26 26 GLU H H 26 7.220 7.220 9.035 -1.815 25109
10736 1 20 . 1 1 27 27 ILE N N 27 114.080 114.080 118.165 -4.085 25109
10737 1 20 . 1 1 27 27 ILE HA H 27 4.361 4.361 4.063 0.298 25109
10738 1 20 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.994 -1.262 25109
10739 1 20 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.316 1.275 25109
10740 1 20 . 1 1 27 27 ILE H H 27 7.647 7.647 8.039 -0.392 25109
10741 1 20 . 1 1 28 28 LEU N N 28 121.867 121.867 120.377 1.490 25109
10742 1 20 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.183 -0.246 25109
10743 1 20 . 1 1 28 28 LEU C C 28 175.756 175.756 176.938 -1.182 25109
10744 1 20 . 1 1 28 28 LEU CA C 28 59.967 59.967 59.939 0.028 25109
10745 1 20 . 1 1 28 28 LEU CB C 28 39.513 39.513 39.018 0.495 25109
10746 1 20 . 1 1 28 28 LEU H H 28 7.434 7.434 7.279 0.155 25109
10747 1 20 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.251 -0.041 25109
10748 1 20 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.009 0.300 25109
10749 1 20 . 1 1 30 30 TYR N N 30 113.832 113.832 115.867 -2.035 25109
10750 1 20 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.584 -0.082 25109
10751 1 20 . 1 1 30 30 TYR C C 30 174.386 174.386 175.044 -0.658 25109
10752 1 20 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.167 -1.473 25109
10753 1 20 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.480 -0.381 25109
10754 1 20 . 1 1 30 30 TYR H H 30 7.628 7.628 7.630 -0.002 25109
10755 1 20 . 1 1 31 31 LEU N N 31 118.331 118.331 118.729 -0.398 25109
10756 1 20 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.731 0.146 25109
10757 1 20 . 1 1 31 31 LEU C C 31 173.849 173.849 175.231 -1.382 25109
10758 1 20 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.946 -0.254 25109
10759 1 20 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.791 0.011 25109
10760 1 20 . 1 1 31 31 LEU H H 31 7.619 7.619 7.395 0.224 25109
10761 1 20 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.512 -0.157 25109
10762 1 20 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.775 -0.365 25109
10763 1 20 . 1 1 33 33 CYS N N 33 110.978 110.978 115.778 -4.800 25109
10764 1 20 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.374 -0.033 25109
10765 1 20 . 1 1 33 33 CYS C C 33 174.139 174.139 175.016 -0.877 25109
10766 1 20 . 1 1 33 33 CYS CA C 33 56.212 56.212 57.847 -1.635 25109
10767 1 20 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.347 1.575 25109
10768 1 20 . 1 1 33 33 CYS H H 33 6.414 6.414 7.385 -0.971 25109
10769 1 20 . 1 1 34 34 LEU N N 34 123.111 123.111 121.594 1.517 25109
10770 1 20 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.442 0.164 25109
10771 1 20 . 1 1 34 34 LEU C C 34 176.646 176.646 176.735 -0.089 25109
10772 1 20 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.248 -0.357 25109
10773 1 20 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.538 -0.847 25109
10774 1 20 . 1 1 34 34 LEU H H 34 7.550 7.550 7.287 0.263 25109
10775 1 20 . 1 1 35 35 THR N N 35 113.831 113.831 115.240 -1.409 25109
10776 1 20 . 1 1 35 35 THR HA H 35 4.205 4.205 4.380 -0.175 25109
10777 1 20 . 1 1 35 35 THR C C 35 175.324 175.324 175.756 -0.432 25109
10778 1 20 . 1 1 35 35 THR CA C 35 61.200 61.200 61.472 -0.272 25109
10779 1 20 . 1 1 35 35 THR CB C 35 71.318 71.318 70.099 1.219 25109
10780 1 20 . 1 1 35 35 THR H H 35 8.586 8.586 8.759 -0.173 25109
10781 1 20 . 1 1 36 36 ALA N N 36 124.128 124.128 126.818 -2.690 25109
10782 1 20 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.143 -0.219 25109
10783 1 20 . 1 1 36 36 ALA C C 36 180.397 180.397 179.827 0.570 25109
10784 1 20 . 1 1 36 36 ALA CA C 36 55.920 55.920 54.846 1.074 25109
10785 1 20 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.692 -0.889 25109
10786 1 20 . 1 1 36 36 ALA H H 36 8.836 8.836 8.713 0.123 25109
10787 1 20 . 1 1 37 37 ARG N N 37 116.793 116.793 118.313 -1.520 25109
10788 1 20 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.085 -0.099 25109
10789 1 20 . 1 1 37 37 ARG C C 37 179.272 179.272 177.548 1.724 25109
10790 1 20 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.468 -0.236 25109
10791 1 20 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.459 0.446 25109
10792 1 20 . 1 1 37 37 ARG H H 37 8.060 8.060 8.642 -0.582 25109
10793 1 20 . 1 1 38 38 ASP N N 38 120.030 120.030 119.767 0.263 25109
10794 1 20 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.384 -0.136 25109
10795 1 20 . 1 1 38 38 ASP C C 38 178.885 178.885 178.830 0.055 25109
10796 1 20 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.380 -0.193 25109
10797 1 20 . 1 1 38 38 ASP CB C 38 40.933 40.933 39.814 1.119 25109
10798 1 20 . 1 1 38 38 ASP H H 38 7.782 7.782 8.281 -0.499 25109
10799 1 20 . 1 1 39 39 GLN N N 39 118.223 118.223 117.953 0.270 25109
10800 1 20 . 1 1 39 39 GLN HA H 39 3.665 3.665 3.936 -0.271 25109
10801 1 20 . 1 1 39 39 GLN C C 39 178.041 178.041 178.088 -0.047 25109
10802 1 20 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.809 1.792 25109
10803 1 20 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.522 -0.725 25109
10804 1 20 . 1 1 39 39 GLN H H 39 8.476 8.476 7.796 0.680 25109
10805 1 20 . 1 1 40 40 ASP N N 40 117.908 117.908 120.378 -2.470 25109
10806 1 20 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.335 -0.082 25109
10807 1 20 . 1 1 40 40 ASP C C 40 178.639 178.639 178.586 0.053 25109
10808 1 20 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.239 -0.839 25109
10809 1 20 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.861 -2.833 25109
10810 1 20 . 1 1 40 40 ASP H H 40 8.386 8.386 7.823 0.563 25109
10811 1 20 . 1 1 41 41 ARG N N 41 120.990 120.990 118.537 2.453 25109
10812 1 20 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.010 0.032 25109
10813 1 20 . 1 1 41 41 ARG C C 41 179.795 179.795 178.730 1.065 25109
10814 1 20 . 1 1 41 41 ARG CA C 41 59.445 59.445 57.952 1.493 25109
10815 1 20 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.640 0.618 25109
10816 1 20 . 1 1 41 41 ARG H H 41 8.130 8.130 8.094 0.036 25109
10817 1 20 . 1 1 42 42 LEU N N 42 121.219 121.219 119.503 1.716 25109
10818 1 20 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.139 -0.204 25109
10819 1 20 . 1 1 42 42 LEU C C 42 178.850 178.850 178.792 0.058 25109
10820 1 20 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.627 0.640 25109
10821 1 20 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.480 0.553 25109
10822 1 20 . 1 1 42 42 LEU H H 42 8.179 8.179 7.596 0.583 25109
10823 1 20 . 1 1 43 43 ARG N N 43 119.310 119.310 117.310 2.000 25109
10824 1 20 . 1 1 43 43 ARG HA H 43 3.724 3.724 4.245 -0.521 25109
10825 1 20 . 1 1 43 43 ARG C C 43 179.099 179.099 177.322 1.777 25109
10826 1 20 . 1 1 43 43 ARG CA C 43 60.814 60.814 58.129 2.685 25109
10827 1 20 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.034 0.145 25109
10828 1 20 . 1 1 43 43 ARG H H 43 8.296 8.296 8.004 0.292 25109
10829 1 20 . 1 1 44 44 ALA N N 44 121.305 121.305 121.615 -0.310 25109
10830 1 20 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.445 -0.342 25109
10831 1 20 . 1 1 44 44 ALA C C 44 180.924 180.924 178.448 2.476 25109
10832 1 20 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.366 0.859 25109
10833 1 20 . 1 1 44 44 ALA CB C 44 18.096 18.096 19.452 -1.356 25109
10834 1 20 . 1 1 44 44 ALA H H 44 7.774 7.774 7.470 0.304 25109
10835 1 20 . 1 1 45 45 THR N N 45 115.017 115.017 116.661 -1.644 25109
10836 1 20 . 1 1 45 45 THR HA H 45 3.879 3.879 4.130 -0.251 25109
10837 1 20 . 1 1 45 45 THR CA C 45 66.327 66.327 66.879 -0.552 25109
10838 1 20 . 1 1 45 45 THR CB C 45 68.809 68.809 68.436 0.373 25109
10839 1 20 . 1 1 45 45 THR H H 45 8.167 8.167 8.290 -0.123 25109
10840 1 20 . 1 1 46 46 CYS N N 46 123.609 123.609 118.216 5.393 25109
10841 1 20 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.683 -0.664 25109
10842 1 20 . 1 1 46 46 CYS C C 46 178.077 178.077 176.523 1.554 25109
10843 1 20 . 1 1 46 46 CYS CA C 46 62.945 62.945 61.798 1.147 25109
10844 1 20 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.340 -1.201 25109
10845 1 20 . 1 1 46 46 CYS H H 46 8.084 8.084 8.047 0.037 25109
10846 1 20 . 1 1 47 47 THR N N 47 115.520 115.520 117.389 -1.869 25109
10847 1 20 . 1 1 47 47 THR HA H 47 3.915 3.915 4.161 -0.246 25109
10848 1 20 . 1 1 47 47 THR CA C 47 66.063 66.063 65.952 0.111 25109
10849 1 20 . 1 1 47 47 THR CB C 47 69.245 69.245 68.834 0.411 25109
10850 1 20 . 1 1 47 47 THR H H 47 7.735 7.735 7.581 0.154 25109
10851 1 20 . 1 1 48 48 LEU N N 48 120.099 120.099 121.219 -1.120 25109
10852 1 20 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.237 -0.011 25109
10853 1 20 . 1 1 48 48 LEU CA C 48 57.563 57.563 57.557 0.006 25109
10854 1 20 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.396 1.229 25109
10855 1 20 . 1 1 48 48 LEU H H 48 7.464 7.464 7.625 -0.161 25109
10856 1 20 . 1 1 49 49 SER N N 49 111.979 111.979 110.936 1.043 25109
10857 1 20 . 1 1 49 49 SER HA H 49 4.661 4.661 4.461 0.200 25109
10858 1 20 . 1 1 49 49 SER C C 49 175.581 175.581 175.492 0.089 25109
10859 1 20 . 1 1 49 49 SER CA C 49 59.590 59.590 59.614 -0.024 25109
10860 1 20 . 1 1 49 49 SER CB C 49 65.335 65.335 65.037 0.298 25109
10861 1 20 . 1 1 49 49 SER H H 49 8.781 8.781 8.396 0.385 25109
10862 1 20 . 1 1 50 50 GLY N N 50 110.194 110.194 109.756 0.438 25109
10863 1 20 . 1 1 50 50 GLY C C 50 175.123 175.123 174.360 0.763 25109
10864 1 20 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.783 -0.881 25109
10865 1 20 . 1 1 50 50 GLY H H 50 7.955 7.955 8.313 -0.358 25109
10866 1 20 . 1 1 51 51 ASN N N 51 121.050 121.050 122.265 -1.215 25109
10867 1 20 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.750 -0.500 25109
10868 1 20 . 1 1 51 51 ASN C C 51 176.403 176.403 176.767 -0.364 25109
10869 1 20 . 1 1 51 51 ASN CA C 51 59.303 59.303 54.140 5.163 25109
10870 1 20 . 1 1 51 51 ASN CB C 51 41.599 41.599 39.300 2.299 25109
10871 1 20 . 1 1 51 51 ASN H H 51 8.898 8.898 8.314 0.584 25109
10872 1 20 . 1 1 52 52 ARG N N 52 119.825 119.825 121.482 -1.657 25109
10873 1 20 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.214 -0.176 25109
10874 1 20 . 1 1 52 52 ARG C C 52 178.850 178.850 178.184 0.666 25109
10875 1 20 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.209 0.855 25109
10876 1 20 . 1 1 52 52 ARG CB C 52 30.023 30.023 30.327 -0.304 25109
10877 1 20 . 1 1 52 52 ARG H H 52 8.696 8.696 8.719 -0.023 25109
10878 1 20 . 1 1 53 53 ASP N N 53 116.032 116.032 117.763 -1.731 25109
10879 1 20 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.797 -0.251 25109
10880 1 20 . 1 1 53 53 ASP C C 53 178.996 178.996 178.731 0.265 25109
10881 1 20 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.764 -1.685 25109
10882 1 20 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.544 -2.173 25109
10883 1 20 . 1 1 53 53 ASP H H 53 9.036 9.036 8.154 0.882 25109
10884 1 20 . 1 1 54 54 THR N N 54 115.848 115.848 118.031 -2.183 25109
10885 1 20 . 1 1 54 54 THR HA H 54 3.746 3.746 4.328 -0.582 25109
10886 1 20 . 1 1 54 54 THR CA C 54 67.885 67.885 66.417 1.468 25109
10887 1 20 . 1 1 54 54 THR CB C 54 66.953 66.953 68.773 -1.821 25109
10888 1 20 . 1 1 54 54 THR H H 54 7.782 7.782 7.472 0.310 25109
10889 1 20 . 1 1 55 55 LEU N N 55 125.987 125.987 122.944 3.043 25109
10890 1 20 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.169 -0.615 25109
10891 1 20 . 1 1 55 55 LEU C C 55 177.901 177.901 178.850 -0.949 25109
10892 1 20 . 1 1 55 55 LEU CA C 55 58.453 58.453 59.241 -0.788 25109
10893 1 20 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.306 0.557 25109
10894 1 20 . 1 1 55 55 LEU H H 55 8.740 8.740 8.543 0.197 25109
10895 1 20 . 1 1 56 56 TRP N N 56 116.672 116.672 117.764 -1.092 25109
10896 1 20 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.533 -0.453 25109
10897 1 20 . 1 1 56 56 TRP C C 56 179.588 179.588 177.781 1.807 25109
10898 1 20 . 1 1 56 56 TRP CA C 56 61.481 61.481 62.560 -1.079 25109
10899 1 20 . 1 1 56 56 TRP CB C 56 29.192 29.192 28.990 0.202 25109
10900 1 20 . 1 1 56 56 TRP H H 56 7.642 7.642 8.056 -0.414 25109
10901 1 20 . 1 1 57 57 HIS N N 57 115.754 115.754 114.455 1.299 25109
10902 1 20 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.566 -0.290 25109
10903 1 20 . 1 1 57 57 HIS C C 57 177.514 177.514 177.198 0.316 25109
10904 1 20 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.003 -0.051 25109
10905 1 20 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.494 -2.492 25109
10906 1 20 . 1 1 57 57 HIS H H 57 7.407 7.407 7.572 -0.165 25109
10907 1 20 . 1 1 58 58 LEU N N 58 123.934 123.934 122.958 0.976 25109
10908 1 20 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.979 -0.192 25109
10909 1 20 . 1 1 58 58 LEU C C 58 178.115 178.115 176.998 1.117 25109
10910 1 20 . 1 1 58 58 LEU CA C 58 58.909 58.909 57.990 0.919 25109
10911 1 20 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.998 -1.183 25109
10912 1 20 . 1 1 58 58 LEU H H 58 8.996 8.996 8.504 0.492 25109
10913 1 20 . 1 1 59 59 PHE N N 59 117.721 117.721 115.644 2.077 25109
10914 1 20 . 1 1 59 59 PHE HA H 59 3.935 3.935 4.297 -0.362 25109
10915 1 20 . 1 1 59 59 PHE C C 59 176.987 176.987 175.302 1.685 25109
10916 1 20 . 1 1 59 59 PHE CA C 59 60.113 60.113 59.527 0.586 25109
10917 1 20 . 1 1 59 59 PHE CB C 59 36.960 36.960 36.800 0.160 25109
10918 1 20 . 1 1 59 59 PHE H H 59 8.201 8.201 8.856 -0.655 25109
10919 1 20 . 1 1 60 60 ASN N N 60 115.695 115.695 118.525 -2.830 25109
10920 1 20 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.717 -0.798 25109
10921 1 20 . 1 1 60 60 ASN C C 60 176.670 176.670 176.045 0.625 25109
10922 1 20 . 1 1 60 60 ASN CA C 60 56.756 56.756 54.998 1.758 25109
10923 1 20 . 1 1 60 60 ASN CB C 60 39.318 39.318 40.546 -1.228 25109
10924 1 20 . 1 1 60 60 ASN H H 60 7.666 7.666 8.109 -0.443 25109
10925 1 20 . 1 1 61 61 THR N N 61 115.110 115.110 117.114 -2.004 25109
10926 1 20 . 1 1 61 61 THR HA H 61 3.733 3.733 4.186 -0.453 25109
10927 1 20 . 1 1 61 61 THR CA C 61 66.319 66.319 66.168 0.151 25109
10928 1 20 . 1 1 61 61 THR CB C 61 69.174 69.174 69.649 -0.475 25109
10929 1 20 . 1 1 61 61 THR H H 61 7.782 7.782 8.289 -0.507 25109
10930 1 20 . 1 1 62 62 LEU N N 62 121.559 121.559 123.141 -1.582 25109
10931 1 20 . 1 1 62 62 LEU HA H 62 3.489 3.489 4.059 -0.570 25109
10932 1 20 . 1 1 62 62 LEU C C 62 176.600 176.600 177.086 -0.486 25109
10933 1 20 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.645 0.320 25109
10934 1 20 . 1 1 62 62 LEU CB C 62 42.335 42.335 41.641 0.695 25109
10935 1 20 . 1 1 62 62 LEU H H 62 8.362 8.362 8.259 0.103 25109
10936 1 20 . 1 1 63 63 GLN N N 63 109.150 109.150 114.321 -5.171 25109
10937 1 20 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.086 -1.009 25109
10938 1 20 . 1 1 63 63 GLN C C 63 175.194 175.194 176.938 -1.744 25109
10939 1 20 . 1 1 63 63 GLN CA C 63 56.266 56.266 56.824 -0.558 25109
10940 1 20 . 1 1 63 63 GLN CB C 63 25.694 25.694 26.602 -0.908 25109
10941 1 20 . 1 1 63 63 GLN H H 63 6.458 6.458 7.938 -1.480 25109
10942 1 20 . 1 1 64 64 ARG N N 64 116.029 116.029 118.900 -2.871 25109
10943 1 20 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.161 -0.063 25109
10944 1 20 . 1 1 64 64 ARG C C 64 176.459 176.459 176.599 -0.140 25109
10945 1 20 . 1 1 64 64 ARG CA C 64 56.143 56.143 56.633 -0.490 25109
10946 1 20 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.600 -0.016 25109
10947 1 20 . 1 1 64 64 ARG H H 64 6.596 6.596 7.181 -0.585 25109
10948 1 20 . 1 1 65 65 ARG N N 65 120.422 120.422 120.652 -0.230 25109
10949 1 20 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.733 0.101 25109
10950 1 20 . 1 1 65 65 ARG C C 65 173.436 173.436 175.027 -1.591 25109
10951 1 20 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.889 -1.344 25109
10952 1 20 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.592 -0.596 25109
10953 1 20 . 1 1 65 65 ARG H H 65 7.932 7.932 7.633 0.299 25109
10954 1 20 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.510 0.064 25109
10955 1 20 . 1 1 66 66 PRO CB C 66 32.059 32.059 32.082 -0.023 25109
10956 1 20 . 1 1 67 67 GLY N N 67 111.953 111.953 105.952 6.001 25109
10957 1 20 . 1 1 67 67 GLY C C 67 177.057 177.057 174.904 2.153 25109
10958 1 20 . 1 1 67 67 GLY CA C 67 46.307 46.307 44.786 1.521 25109
10959 1 20 . 1 1 67 67 GLY H H 67 9.198 9.198 8.094 1.104 25109
10960 1 20 . 1 1 68 68 TRP N N 68 117.467 117.467 121.639 -4.172 25109
10961 1 20 . 1 1 68 68 TRP HA H 68 4.342 4.342 5.040 -0.698 25109
10962 1 20 . 1 1 68 68 TRP C C 68 177.690 177.690 175.806 1.884 25109
10963 1 20 . 1 1 68 68 TRP CA C 68 60.116 60.116 58.428 1.688 25109
10964 1 20 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.807 0.383 25109
10965 1 20 . 1 1 68 68 TRP H H 68 7.647 7.647 7.597 0.050 25109
10966 1 20 . 1 1 69 69 VAL N N 69 121.482 121.482 122.141 -0.659 25109
10967 1 20 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.100 -0.463 25109
10968 1 20 . 1 1 69 69 VAL C C 69 177.993 177.993 177.554 0.439 25109
10969 1 20 . 1 1 69 69 VAL CA C 69 67.466 67.466 67.260 0.206 25109
10970 1 20 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.209 -0.183 25109
10971 1 20 . 1 1 69 69 VAL H H 69 6.666 6.666 7.531 -0.865 25109
10972 1 20 . 1 1 70 70 GLU N N 70 116.350 116.350 119.365 -3.015 25109
10973 1 20 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.841 -0.016 25109
10974 1 20 . 1 1 70 70 GLU C C 70 180.362 180.362 178.799 1.563 25109
10975 1 20 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.458 -0.237 25109
10976 1 20 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.151 -0.846 25109
10977 1 20 . 1 1 70 70 GLU H H 70 7.410 7.410 8.637 -1.227 25109
10978 1 20 . 1 1 71 71 TYR N N 71 116.750 116.750 119.669 -2.919 25109
10979 1 20 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.322 0.128 25109
10980 1 20 . 1 1 71 71 TYR C C 71 178.411 178.411 178.410 0.001 25109
10981 1 20 . 1 1 71 71 TYR CA C 71 61.602 61.602 61.035 0.567 25109
10982 1 20 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.395 -0.040 25109
10983 1 20 . 1 1 71 71 TYR H H 71 7.159 7.159 7.791 -0.632 25109
10984 1 20 . 1 1 72 72 PHE N N 72 121.610 121.610 121.027 0.583 25109
10985 1 20 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.216 0.286 25109
10986 1 20 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.544 -0.724 25109
10987 1 20 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.081 0.968 25109
10988 1 20 . 1 1 72 72 PHE H H 72 9.007 9.007 8.645 0.362 25109
10989 1 20 . 1 1 73 73 ILE N N 73 119.200 119.200 118.907 0.293 25109
10990 1 20 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.446 -0.266 25109
10991 1 20 . 1 1 73 73 ILE C C 73 177.620 177.620 177.566 0.054 25109
10992 1 20 . 1 1 73 73 ILE CA C 73 67.197 67.197 65.585 1.612 25109
10993 1 20 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.454 1.569 25109
10994 1 20 . 1 1 73 73 ILE H H 73 8.644 8.644 8.716 -0.072 25109
10995 1 20 . 1 1 74 74 ALA N N 74 119.624 119.624 121.070 -1.446 25109
10996 1 20 . 1 1 74 74 ALA HA H 74 3.954 3.954 3.915 0.039 25109
10997 1 20 . 1 1 74 74 ALA C C 74 181.030 181.030 179.168 1.862 25109
10998 1 20 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.687 0.724 25109
10999 1 20 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.782 0.354 25109
11000 1 20 . 1 1 74 74 ALA H H 74 7.476 7.476 7.572 -0.096 25109
11001 1 20 . 1 1 75 75 ALA N N 75 123.625 123.625 122.414 1.211 25109
11002 1 20 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.581 0.257 25109
11003 1 20 . 1 1 75 75 ALA C C 75 179.272 179.272 179.543 -0.271 25109
11004 1 20 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.677 0.425 25109
11005 1 20 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.411 1.182 25109
11006 1 20 . 1 1 75 75 ALA H H 75 8.524 8.524 7.590 0.934 25109
11007 1 20 . 1 1 76 76 LEU N N 76 118.114 118.114 120.645 -2.531 25109
11008 1 20 . 1 1 76 76 LEU HA H 76 3.672 3.672 4.010 -0.338 25109
11009 1 20 . 1 1 76 76 LEU C C 76 180.001 180.001 179.075 0.926 25109
11010 1 20 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.435 0.821 25109
11011 1 20 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.275 1.344 25109
11012 1 20 . 1 1 76 76 LEU H H 76 8.153 8.153 7.734 0.419 25109
11013 1 20 . 1 1 77 77 ARG N N 77 117.830 117.830 119.129 -1.299 25109
11014 1 20 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.996 -0.549 25109
11015 1 20 . 1 1 77 77 ARG C C 77 180.889 180.889 179.313 1.576 25109
11016 1 20 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.371 1.695 25109
11017 1 20 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.943 -0.746 25109
11018 1 20 . 1 1 77 77 ARG H H 77 7.945 7.945 8.184 -0.239 25109
11019 1 20 . 1 1 78 78 GLY N N 78 110.202 110.202 105.680 4.522 25109
11020 1 20 . 1 1 78 78 GLY C C 78 174.807 174.807 174.949 -0.142 25109
11021 1 20 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.200 0.360 25109
11022 1 20 . 1 1 78 78 GLY H H 78 8.269 8.269 8.080 0.189 25109
11023 1 20 . 1 1 79 79 CYS N N 79 115.567 115.567 117.006 -1.439 25109
11024 1 20 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.759 -0.370 25109
11025 1 20 . 1 1 79 79 CYS C C 79 173.025 173.025 174.577 -1.552 25109
11026 1 20 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.032 2.925 25109
11027 1 20 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.483 0.322 25109
11028 1 20 . 1 1 79 79 CYS H H 79 7.132 7.132 7.518 -0.386 25109
11029 1 20 . 1 1 80 80 GLU N N 80 111.759 111.759 116.662 -4.903 25109
11030 1 20 . 1 1 80 80 GLU HA H 80 3.733 3.733 3.880 -0.147 25109
11031 1 20 . 1 1 80 80 GLU C C 80 175.827 175.827 175.456 0.371 25109
11032 1 20 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.727 -0.260 25109
11033 1 20 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.286 -2.569 25109
11034 1 20 . 1 1 80 80 GLU H H 80 7.772 7.772 7.988 -0.216 25109
11035 1 20 . 1 1 81 81 LEU N N 81 124.692 124.692 120.914 3.778 25109
11036 1 20 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.462 0.229 25109
11037 1 20 . 1 1 81 81 LEU CA C 81 52.955 52.955 54.001 -1.046 25109
11038 1 20 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.115 -0.724 25109
11039 1 20 . 1 1 81 81 LEU H H 81 8.167 8.167 8.331 -0.164 25109
11040 1 20 . 1 1 82 82 VAL N N 82 118.320 118.320 121.683 -3.363 25109
11041 1 20 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.558 -0.381 25109
11042 1 20 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.791 -0.081 25109
11043 1 20 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.928 0.020 25109
11044 1 20 . 1 1 82 82 VAL H H 82 7.141 7.141 7.524 -0.383 25109
11045 1 20 . 1 1 83 83 ASP N N 83 118.733 118.733 120.308 -1.575 25109
11046 1 20 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.299 0.033 25109
11047 1 20 . 1 1 83 83 ASP C C 83 178.674 178.674 178.429 0.245 25109
11048 1 20 . 1 1 83 83 ASP CA C 83 56.443 56.443 58.244 -1.801 25109
11049 1 20 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.075 -3.246 25109
11050 1 20 . 1 1 83 83 ASP H H 83 8.385 8.385 8.595 -0.210 25109
11051 1 20 . 1 1 84 84 LEU N N 84 121.026 121.026 119.807 1.219 25109
11052 1 20 . 1 1 84 84 LEU HA H 84 3.979 3.979 3.754 0.225 25109
11053 1 20 . 1 1 84 84 LEU C C 84 178.796 178.796 178.836 -0.040 25109
11054 1 20 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.603 -0.081 25109
11055 1 20 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.451 1.044 25109
11056 1 20 . 1 1 84 84 LEU H H 84 7.770 7.770 7.484 0.286 25109
11057 1 20 . 1 1 85 85 ALA N N 85 121.525 121.525 122.298 -0.773 25109
11058 1 20 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.888 -0.227 25109
11059 1 20 . 1 1 85 85 ALA C C 85 179.322 179.322 179.208 0.114 25109
11060 1 20 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.245 0.596 25109
11061 1 20 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.041 0.886 25109
11062 1 20 . 1 1 85 85 ALA H H 85 8.126 8.126 7.830 0.296 25109
11063 1 20 . 1 1 86 86 ASP N N 86 115.349 115.349 118.342 -2.993 25109
11064 1 20 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.281 -0.008 25109
11065 1 20 . 1 1 86 86 ASP C C 86 178.463 178.463 178.390 0.073 25109
11066 1 20 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.773 -2.062 25109
11067 1 20 . 1 1 86 86 ASP CB C 86 37.162 37.162 40.808 -3.646 25109
11068 1 20 . 1 1 86 86 ASP H H 86 8.410 8.410 8.508 -0.098 25109
11069 1 20 . 1 1 87 87 GLU N N 87 122.529 122.529 119.819 2.710 25109
11070 1 20 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.097 -0.061 25109
11071 1 20 . 1 1 87 87 GLU C C 87 178.508 178.508 179.487 -0.979 25109
11072 1 20 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.454 -0.100 25109
11073 1 20 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.565 -1.292 25109
11074 1 20 . 1 1 87 87 GLU H H 87 8.012 8.012 8.136 -0.124 25109
11075 1 20 . 1 1 88 88 VAL N N 88 119.148 119.148 119.820 -0.672 25109
11076 1 20 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.803 -0.472 25109
11077 1 20 . 1 1 88 88 VAL C C 88 177.240 177.240 178.144 -0.904 25109
11078 1 20 . 1 1 88 88 VAL CA C 88 67.249 67.249 66.742 0.507 25109
11079 1 20 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.676 -0.147 25109
11080 1 20 . 1 1 88 88 VAL H H 88 8.291 8.291 7.989 0.302 25109
11081 1 20 . 1 1 89 89 ALA N N 89 120.709 120.709 122.114 -1.405 25109
11082 1 20 . 1 1 89 89 ALA HA H 89 3.915 3.915 3.980 -0.065 25109
11083 1 20 . 1 1 89 89 ALA C C 89 180.186 180.186 179.621 0.565 25109
11084 1 20 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.500 0.559 25109
11085 1 20 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.035 0.200 25109
11086 1 20 . 1 1 89 89 ALA H H 89 8.548 8.548 8.434 0.114 25109
11087 1 20 . 1 1 90 90 SER N N 90 113.035 113.035 114.226 -1.191 25109
11088 1 20 . 1 1 90 90 SER HA H 90 4.047 4.047 4.311 -0.264 25109
11089 1 20 . 1 1 90 90 SER C C 90 177.564 177.564 176.591 0.973 25109
11090 1 20 . 1 1 90 90 SER CA C 90 61.771 61.771 60.974 0.797 25109
11091 1 20 . 1 1 90 90 SER CB C 90 62.907 62.907 63.235 -0.328 25109
11092 1 20 . 1 1 90 90 SER H H 90 7.969 7.969 8.279 -0.310 25109
11093 1 20 . 1 1 91 91 VAL N N 91 123.417 123.417 121.020 2.397 25109
11094 1 20 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.516 -0.169 25109
11095 1 20 . 1 1 91 91 VAL C C 91 178.428 178.428 178.276 0.152 25109
11096 1 20 . 1 1 91 91 VAL CA C 91 66.129 66.129 66.421 -0.292 25109
11097 1 20 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.838 -0.067 25109
11098 1 20 . 1 1 91 91 VAL H H 91 7.713 7.713 7.622 0.091 25109
11099 1 20 . 1 1 92 92 TYR N N 92 121.458 121.458 121.234 0.224 25109
11100 1 20 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.433 -0.242 25109
11101 1 20 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.323 0.671 25109
11102 1 20 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.593 0.392 25109
11103 1 20 . 1 1 92 92 TYR H H 92 8.395 8.395 8.667 -0.272 25109
11104 1 20 . 1 1 93 93 GLN N N 93 115.549 115.549 118.359 -2.810 25109
11105 1 20 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.029 -0.318 25109
11106 1 20 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.888 0.207 25109
11107 1 20 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.391 -0.093 25109
11108 1 20 . 1 1 93 93 GLN H H 93 8.167 8.167 8.117 0.050 25109
11109 1 20 . 1 1 94 94 SER N N 94 115.923 115.923 112.918 3.005 25109
11110 1 20 . 1 1 94 94 SER HA H 94 4.096 4.096 4.271 -0.175 25109
11111 1 20 . 1 1 94 94 SER CA C 94 60.971 60.971 58.993 1.978 25109
11112 1 20 . 1 1 94 94 SER CB C 94 62.635 62.635 64.056 -1.421 25109
11113 1 20 . 1 1 94 94 SER H H 94 7.642 7.642 7.515 0.127 25109
11114 1 20 . 1 1 95 95 TYR N N 95 119.565 119.565 121.012 -1.447 25109
11115 1 20 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.485 0.274 25109
11116 1 20 . 1 1 95 95 TYR C C 95 175.334 175.334 174.162 1.172 25109
11117 1 20 . 1 1 95 95 TYR CA C 95 57.698 57.698 56.314 1.384 25109
11118 1 20 . 1 1 95 95 TYR CB C 95 39.319 39.319 38.317 1.002 25109
11119 1 20 . 1 1 95 95 TYR H H 95 7.069 7.069 7.396 -0.327 25109
11120 1 20 . 1 1 96 96 GLN N N 96 119.872 119.872 119.810 0.062 25109
11121 1 20 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.019 0.346 25109
11122 1 20 . 1 1 96 96 GLN C C 96 173.612 173.612 174.367 -0.755 25109
11123 1 20 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.878 -1.542 25109
11124 1 20 . 1 1 96 96 GLN CB C 96 28.494 28.494 26.828 1.666 25109
11125 1 20 . 1 1 96 96 GLN H H 96 7.409 7.409 8.798 -1.389 25109
11126 1 20 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.268 0.050 25109
11127 1 20 . 1 1 97 97 PRO CA C 97 63.014 63.014 64.215 -1.200 25109
11128 1 20 . 1 1 97 97 PRO CB C 97 32.098 32.098 31.938 0.160 25109
11129 1 20 . 1 1 98 98 ARG N N 98 121.759 121.759 118.004 3.755 25109
11130 1 20 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.682 -0.340 25109
11131 1 20 . 1 1 98 98 ARG C C 98 176.848 176.848 175.460 1.388 25109
11132 1 20 . 1 1 98 98 ARG CA C 98 56.221 56.221 55.258 0.963 25109
11133 1 20 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.707 0.380 25109
11134 1 20 . 1 1 98 98 ARG H H 98 8.423 8.423 7.751 0.672 25109
11135 1 20 . 1 1 99 99 THR N N 99 115.292 115.292 116.858 -1.566 25109
11136 1 20 . 1 1 99 99 THR HA H 99 4.323 4.323 4.456 -0.133 25109
11137 1 20 . 1 1 99 99 THR C C 99 174.350 174.350 174.242 0.108 25109
11138 1 20 . 1 1 99 99 THR CA C 99 61.906 61.906 63.486 -1.580 25109
11139 1 20 . 1 1 99 99 THR CB C 99 70.180 70.180 69.411 0.769 25109
11140 1 20 . 1 1 99 99 THR H H 99 8.179 8.179 8.713 -0.534 25109
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 95 2.485 0.387 2.467 25109
2 1 1 "Average Difference" HA 101 0.320 0.160 0.278 25109
3 1 1 "Average Difference" C 79 1.090 -0.377 1.029 25109
4 1 1 "Average Difference" CA 96 1.429 -0.546 1.328 25109
5 1 1 "Average Difference" CB 97 1.318 0.175 1.313 25109
6 1 1 "Average Difference" HN 95 0.552 -0.004 0.555 25109
7 1 2 "Average Difference" N 95 2.378 0.431 2.351 25109
8 1 2 "Average Difference" HA 101 0.378 0.144 0.351 25109
9 1 2 "Average Difference" C 79 1.114 -0.373 1.056 25109
10 1 2 "Average Difference" CA 96 1.414 -0.426 1.355 25109
11 1 2 "Average Difference" CB 97 1.250 0.185 1.243 25109
12 1 2 "Average Difference" HN 95 0.499 0.010 0.502 25109
13 1 3 "Average Difference" N 95 2.411 0.364 2.396 25109
14 1 3 "Average Difference" HA 101 0.358 0.163 0.320 25109
15 1 3 "Average Difference" C 79 1.117 -0.458 1.026 25109
16 1 3 "Average Difference" CA 96 1.329 -0.455 1.256 25109
17 1 3 "Average Difference" CB 97 1.366 0.163 1.363 25109
18 1 3 "Average Difference" HN 95 0.569 0.015 0.571 25109
19 1 4 "Average Difference" N 95 2.556 0.293 2.553 25109
20 1 4 "Average Difference" HA 101 0.355 0.183 0.305 25109
21 1 4 "Average Difference" C 79 1.114 -0.286 1.084 25109
22 1 4 "Average Difference" CA 96 1.361 -0.468 1.284 25109
23 1 4 "Average Difference" CB 97 1.404 0.255 1.387 25109
24 1 4 "Average Difference" HN 95 0.561 0.003 0.564 25109
25 1 5 "Average Difference" N 95 2.550 0.387 2.534 25109
26 1 5 "Average Difference" HA 101 0.342 0.163 0.302 25109
27 1 5 "Average Difference" C 79 1.065 -0.380 1.001 25109
28 1 5 "Average Difference" CA 96 1.379 -0.412 1.323 25109
29 1 5 "Average Difference" CB 97 1.384 0.311 1.355 25109
30 1 5 "Average Difference" HN 95 0.557 0.056 0.557 25109
31 1 6 "Average Difference" N 95 2.562 0.325 2.555 25109
32 1 6 "Average Difference" HA 101 0.352 0.150 0.320 25109
33 1 6 "Average Difference" C 79 0.987 -0.323 0.939 25109
34 1 6 "Average Difference" CA 96 1.428 -0.468 1.356 25109
35 1 6 "Average Difference" CB 97 1.340 0.126 1.341 25109
36 1 6 "Average Difference" HN 95 0.494 0.003 0.497 25109
37 1 7 "Average Difference" N 95 2.627 0.369 2.615 25109
38 1 7 "Average Difference" HA 101 0.396 0.169 0.360 25109
39 1 7 "Average Difference" C 79 0.988 -0.284 0.952 25109
40 1 7 "Average Difference" CA 96 1.434 -0.479 1.359 25109
41 1 7 "Average Difference" CB 97 1.266 0.198 1.257 25109
42 1 7 "Average Difference" HN 95 0.514 0.048 0.515 25109
43 1 8 "Average Difference" N 95 2.372 0.379 2.354 25109
44 1 8 "Average Difference" HA 101 0.293 0.143 0.256 25109
45 1 8 "Average Difference" C 79 1.009 -0.342 0.956 25109
46 1 8 "Average Difference" CA 96 1.234 -0.346 1.191 25109
47 1 8 "Average Difference" CB 97 1.328 0.161 1.325 25109
48 1 8 "Average Difference" HN 95 0.492 0.020 0.494 25109
49 1 9 "Average Difference" N 95 2.488 0.272 2.486 25109
50 1 9 "Average Difference" HA 101 0.361 0.159 0.326 25109
51 1 9 "Average Difference" C 79 0.947 -0.247 0.920 25109
52 1 9 "Average Difference" CA 96 1.332 -0.450 1.260 25109
53 1 9 "Average Difference" CB 97 1.266 0.141 1.264 25109
54 1 9 "Average Difference" HN 95 0.479 0.001 0.481 25109
55 1 10 "Average Difference" N 95 2.684 0.264 2.685 25109
56 1 10 "Average Difference" HA 101 0.339 0.177 0.290 25109
57 1 10 "Average Difference" C 79 1.073 -0.410 0.998 25109
58 1 10 "Average Difference" CA 96 1.321 -0.453 1.247 25109
59 1 10 "Average Difference" CB 97 1.333 0.254 1.316 25109
60 1 10 "Average Difference" HN 95 0.497 0.044 0.498 25109
61 1 11 "Average Difference" N 95 2.469 0.555 2.419 25109
62 1 11 "Average Difference" HA 101 0.323 0.159 0.282 25109
63 1 11 "Average Difference" C 79 1.051 -0.208 1.037 25109
64 1 11 "Average Difference" CA 96 1.272 -0.411 1.211 25109
65 1 11 "Average Difference" CB 97 1.374 0.202 1.366 25109
66 1 11 "Average Difference" HN 95 0.466 -0.012 0.468 25109
67 1 12 "Average Difference" N 95 2.480 0.291 2.476 25109
68 1 12 "Average Difference" HA 101 0.355 0.140 0.328 25109
69 1 12 "Average Difference" C 79 1.049 -0.280 1.018 25109
70 1 12 "Average Difference" CA 96 1.334 -0.370 1.289 25109
71 1 12 "Average Difference" CB 97 1.332 0.162 1.329 25109
72 1 12 "Average Difference" HN 95 0.551 0.018 0.554 25109
73 1 13 "Average Difference" N 95 2.314 0.235 2.315 25109
74 1 13 "Average Difference" HA 101 0.341 0.136 0.314 25109
75 1 13 "Average Difference" C 79 1.003 -0.313 0.959 25109
76 1 13 "Average Difference" CA 96 1.384 -0.330 1.351 25109
77 1 13 "Average Difference" CB 97 1.343 0.153 1.341 25109
78 1 13 "Average Difference" HN 95 0.514 0.017 0.516 25109
79 1 14 "Average Difference" N 95 2.595 0.281 2.593 25109
80 1 14 "Average Difference" HA 101 0.335 0.169 0.291 25109
81 1 14 "Average Difference" C 79 1.022 -0.321 0.976 25109
82 1 14 "Average Difference" CA 96 1.403 -0.483 1.324 25109
83 1 14 "Average Difference" CB 97 1.266 0.247 1.248 25109
84 1 14 "Average Difference" HN 95 0.528 0.064 0.527 25109
85 1 15 "Average Difference" N 95 2.485 0.518 2.443 25109
86 1 15 "Average Difference" HA 101 0.341 0.157 0.305 25109
87 1 15 "Average Difference" C 79 1.120 -0.328 1.078 25109
88 1 15 "Average Difference" CA 96 1.288 -0.395 1.232 25109
89 1 15 "Average Difference" CB 97 1.226 0.120 1.227 25109
90 1 15 "Average Difference" HN 95 0.507 -0.014 0.509 25109
91 1 16 "Average Difference" N 95 2.546 0.368 2.532 25109
92 1 16 "Average Difference" HA 101 0.365 0.158 0.330 25109
93 1 16 "Average Difference" C 79 0.996 -0.334 0.944 25109
94 1 16 "Average Difference" CA 96 1.355 -0.379 1.308 25109
95 1 16 "Average Difference" CB 97 1.280 0.154 1.277 25109
96 1 16 "Average Difference" HN 95 0.540 0.013 0.543 25109
97 1 17 "Average Difference" N 95 2.361 0.488 2.322 25109
98 1 17 "Average Difference" HA 101 0.369 0.157 0.335 25109
99 1 17 "Average Difference" C 79 1.077 -0.335 1.031 25109
100 1 17 "Average Difference" CA 96 1.428 -0.447 1.363 25109
101 1 17 "Average Difference" CB 97 1.359 0.260 1.341 25109
102 1 17 "Average Difference" HN 95 0.504 -0.017 0.506 25109
103 1 18 "Average Difference" N 95 2.301 0.538 2.249 25109
104 1 18 "Average Difference" HA 101 0.381 0.124 0.363 25109
105 1 18 "Average Difference" C 79 1.021 -0.256 0.994 25109
106 1 18 "Average Difference" CA 96 1.341 -0.383 1.292 25109
107 1 18 "Average Difference" CB 97 1.213 0.079 1.217 25109
108 1 18 "Average Difference" HN 95 0.500 0.083 0.495 25109
109 1 19 "Average Difference" N 95 2.660 0.350 2.651 25109
110 1 19 "Average Difference" HA 101 0.361 0.171 0.320 25109
111 1 19 "Average Difference" C 79 1.050 -0.466 0.947 25109
112 1 19 "Average Difference" CA 96 1.532 -0.541 1.441 25109
113 1 19 "Average Difference" CB 97 1.380 0.127 1.382 25109
114 1 19 "Average Difference" HN 95 0.570 -0.036 0.572 25109
115 1 20 "Average Difference" N 95 2.389 0.378 2.371 25109
116 1 20 "Average Difference" HA 101 0.349 0.184 0.298 25109
117 1 20 "Average Difference" C 79 1.053 -0.349 0.999 25109
118 1 20 "Average Difference" CA 96 1.391 -0.419 1.333 25109
119 1 20 "Average Difference" CB 97 1.250 0.229 1.235 25109
120 1 20 "Average Difference" HN 95 0.536 0.063 0.535 25109
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 25109
_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 0 0 SER N N 0 115.693 115.693 117.087 -1.394 25109
2 1 . 1 1 0 0 SER HA H 0 4.531 4.531 4.576 -0.045 25109
3 1 . 1 1 0 0 SER C C 0 174.557 174.557 174.160 0.397 25109
4 1 . 1 1 0 0 SER CA C 0 58.478 58.478 58.867 -0.389 25109
5 1 . 1 1 0 0 SER CB C 0 64.380 64.380 63.521 0.859 25109
6 1 . 1 1 0 0 SER H H 0 8.631 8.631 8.519 0.112 25109
7 1 . 1 1 1 1 MET N N 1 123.111 123.111 119.992 3.119 25109
8 1 . 1 1 1 1 MET HA H 1 4.728 4.728 4.607 0.121 25109
9 1 . 1 1 1 1 MET C C 1 174.846 174.846 173.646 1.200 25109
10 1 . 1 1 1 1 MET CA C 1 55.655 55.655 54.056 1.599 25109
11 1 . 1 1 1 1 MET CB C 1 32.035 32.035 33.050 -1.015 25109
12 1 . 1 1 1 1 MET H H 1 8.641 8.641 8.110 0.531 25109
13 1 . 1 1 2 2 PRO HA H 2 4.477 4.477 4.882 -0.405 25109
14 1 . 1 1 2 2 PRO CB C 2 32.000 32.000 31.678 0.322 25109
15 1 . 1 1 3 3 PHE N N 3 121.126 121.126 125.237 -4.111 25109
16 1 . 1 1 3 3 PHE HA H 3 4.366 4.366 4.594 -0.228 25109
17 1 . 1 1 3 3 PHE CA C 3 60.862 60.862 59.647 1.215 25109
18 1 . 1 1 3 3 PHE CB C 3 39.368 39.368 40.716 -1.348 25109
19 1 . 1 1 3 3 PHE H H 3 8.177 8.177 9.259 -1.082 25109
20 1 . 1 1 4 4 ALA N N 4 121.170 121.170 122.198 -1.028 25109
21 1 . 1 1 4 4 ALA HA H 4 3.835 3.835 4.056 -0.221 25109
22 1 . 1 1 4 4 ALA C C 4 181.522 181.522 178.939 2.583 25109
23 1 . 1 1 4 4 ALA CA C 4 55.454 55.454 55.280 0.174 25109
24 1 . 1 1 4 4 ALA CB C 4 19.436 19.436 18.464 0.972 25109
25 1 . 1 1 4 4 ALA H H 4 8.444 8.444 8.893 -0.449 25109
26 1 . 1 1 5 5 GLU N N 5 118.932 118.932 118.720 0.212 25109
27 1 . 1 1 5 5 GLU HA H 5 3.855 3.855 3.948 -0.093 25109
28 1 . 1 1 5 5 GLU C C 5 177.971 177.971 178.115 -0.144 25109
29 1 . 1 1 5 5 GLU CA C 5 60.631 60.631 60.012 0.619 25109
30 1 . 1 1 5 5 GLU CB C 5 28.761 28.761 28.697 0.063 25109
31 1 . 1 1 5 5 GLU H H 5 8.454 8.454 8.703 -0.249 25109
32 1 . 1 1 6 6 ASP N N 6 120.471 120.471 119.183 1.288 25109
33 1 . 1 1 6 6 ASP C C 6 178.885 178.885 178.075 0.810 25109
34 1 . 1 1 6 6 ASP CA C 6 57.072 57.072 57.444 -0.372 25109
35 1 . 1 1 6 6 ASP CB C 6 39.132 39.132 40.669 -1.537 25109
36 1 . 1 1 6 6 ASP H H 6 8.316 8.316 8.451 -0.135 25109
37 1 . 1 1 7 7 LYS N N 7 118.335 118.335 118.729 -0.394 25109
38 1 . 1 1 7 7 LYS HA H 7 3.690 3.690 3.926 -0.236 25109
39 1 . 1 1 7 7 LYS C C 7 180.080 180.080 179.056 1.024 25109
40 1 . 1 1 7 7 LYS CA C 7 58.720 58.720 58.728 -0.008 25109
41 1 . 1 1 7 7 LYS CB C 7 31.794 31.794 31.606 0.189 25109
42 1 . 1 1 7 7 LYS H H 7 8.249 8.249 7.704 0.545 25109
43 1 . 1 1 8 8 THR N N 8 119.222 119.222 117.103 2.119 25109
44 1 . 1 1 8 8 THR HA H 8 3.975 3.975 4.040 -0.065 25109
45 1 . 1 1 8 8 THR CA C 8 68.453 68.453 66.915 1.538 25109
46 1 . 1 1 8 8 THR CB C 8 67.387 67.387 68.780 -1.393 25109
47 1 . 1 1 8 8 THR H H 8 7.897 7.897 7.992 -0.095 25109
48 1 . 1 1 9 9 TYR N N 9 123.054 123.054 122.916 0.139 25109
49 1 . 1 1 9 9 TYR HA H 9 4.253 4.253 4.196 0.057 25109
50 1 . 1 1 9 9 TYR C C 9 177.441 177.441 177.332 0.109 25109
51 1 . 1 1 9 9 TYR CA C 9 61.898 61.898 62.184 -0.286 25109
52 1 . 1 1 9 9 TYR CB C 9 37.849 37.849 38.502 -0.653 25109
53 1 . 1 1 9 9 TYR H H 9 8.605 8.605 8.415 0.190 25109
54 1 . 1 1 10 10 LYS N N 10 118.366 118.366 117.924 0.442 25109
55 1 . 1 1 10 10 LYS HA H 10 3.594 3.594 3.807 -0.213 25109
56 1 . 1 1 10 10 LYS C C 10 178.885 178.885 178.690 0.195 25109
57 1 . 1 1 10 10 LYS CA C 10 60.044 60.044 58.784 1.260 25109
58 1 . 1 1 10 10 LYS CB C 10 32.045 32.045 31.967 0.078 25109
59 1 . 1 1 10 10 LYS H H 10 8.066 8.066 8.117 -0.051 25109
60 1 . 1 1 11 11 TYR N N 11 120.539 120.539 120.328 0.211 25109
61 1 . 1 1 11 11 TYR HA H 11 3.990 3.990 4.230 -0.240 25109
62 1 . 1 1 11 11 TYR C C 11 178.233 178.233 177.795 0.438 25109
63 1 . 1 1 11 11 TYR CA C 11 62.528 62.528 61.460 1.068 25109
64 1 . 1 1 11 11 TYR CB C 11 38.363 38.363 39.079 -0.716 25109
65 1 . 1 1 11 11 TYR H H 11 7.875 7.875 7.741 0.134 25109
66 1 . 1 1 12 12 ILE N N 12 121.893 121.893 119.060 2.833 25109
67 1 . 1 1 12 12 ILE HA H 12 3.096 3.096 3.885 -0.789 25109
68 1 . 1 1 12 12 ILE C C 12 177.015 177.015 177.699 -0.684 25109
69 1 . 1 1 12 12 ILE CA C 12 65.763 65.763 63.215 2.548 25109
70 1 . 1 1 12 12 ILE CB C 12 37.552 37.552 36.428 1.124 25109
71 1 . 1 1 12 12 ILE H H 12 8.154 8.154 8.472 -0.318 25109
72 1 . 1 1 13 13 CYS N N 13 113.894 113.894 117.716 -3.822 25109
73 1 . 1 1 13 13 CYS HA H 13 3.887 3.887 3.926 -0.039 25109
74 1 . 1 1 13 13 CYS C C 13 178.288 178.288 176.407 1.881 25109
75 1 . 1 1 13 13 CYS CA C 13 64.337 64.337 61.667 2.670 25109
76 1 . 1 1 13 13 CYS CB C 13 27.005 27.005 26.665 0.340 25109
77 1 . 1 1 13 13 CYS H H 13 7.551 7.551 7.955 -0.404 25109
78 1 . 1 1 14 14 ARG N N 14 119.228 119.228 118.686 0.542 25109
79 1 . 1 1 14 14 ARG HA H 14 4.070 4.070 4.138 -0.068 25109
80 1 . 1 1 14 14 ARG C C 14 177.127 177.127 176.870 0.257 25109
81 1 . 1 1 14 14 ARG CA C 14 58.494 58.494 58.518 -0.024 25109
82 1 . 1 1 14 14 ARG CB C 14 30.422 30.422 30.249 0.173 25109
83 1 . 1 1 14 14 ARG H H 14 7.991 7.991 7.631 0.360 25109
84 1 . 1 1 15 15 ASN N N 15 117.367 117.367 116.150 1.217 25109
85 1 . 1 1 15 15 ASN HA H 15 4.969 4.969 4.825 0.144 25109
86 1 . 1 1 15 15 ASN CA C 15 52.763 52.763 52.646 0.117 25109
87 1 . 1 1 15 15 ASN CB C 15 38.585 38.585 38.324 0.261 25109
88 1 . 1 1 15 15 ASN H H 15 7.643 7.643 7.701 -0.058 25109
89 1 . 1 1 16 16 PHE N N 16 122.356 122.356 122.706 -0.350 25109
90 1 . 1 1 16 16 PHE HA H 16 4.216 4.216 3.969 0.247 25109
91 1 . 1 1 16 16 PHE C C 16 178.084 178.084 176.733 1.351 25109
92 1 . 1 1 16 16 PHE CA C 16 63.177 63.177 61.467 1.710 25109
93 1 . 1 1 16 16 PHE CB C 16 40.589 40.589 39.055 1.534 25109
94 1 . 1 1 16 16 PHE H H 16 6.992 6.992 7.582 -0.590 25109
95 1 . 1 1 17 17 SER N N 17 112.937 112.937 114.073 -1.136 25109
96 1 . 1 1 17 17 SER HA H 17 4.199 4.199 4.093 0.106 25109
97 1 . 1 1 17 17 SER C C 17 176.726 176.726 176.191 0.535 25109
98 1 . 1 1 17 17 SER CA C 17 62.052 62.052 60.736 1.316 25109
99 1 . 1 1 17 17 SER CB C 17 62.552 62.552 62.843 -0.291 25109
100 1 . 1 1 17 17 SER H H 17 8.840 8.840 8.521 0.319 25109
101 1 . 1 1 18 18 ASN N N 18 118.809 118.809 120.761 -1.952 25109
102 1 . 1 1 18 18 ASN HA H 18 4.358 4.358 4.562 -0.204 25109
103 1 . 1 1 18 18 ASN C C 18 175.967 175.967 176.592 -0.625 25109
104 1 . 1 1 18 18 ASN CA C 18 54.910 54.910 55.314 -0.404 25109
105 1 . 1 1 18 18 ASN CB C 18 37.828 37.828 38.592 -0.764 25109
106 1 . 1 1 18 18 ASN H H 18 8.130 8.130 8.255 -0.125 25109
107 1 . 1 1 19 19 PHE N N 19 115.750 115.750 116.601 -0.851 25109
108 1 . 1 1 19 19 PHE HA H 19 4.285 4.285 4.628 -0.343 25109
109 1 . 1 1 19 19 PHE C C 19 175.370 175.370 175.968 -0.598 25109
110 1 . 1 1 19 19 PHE CA C 19 58.862 58.862 58.146 0.716 25109
111 1 . 1 1 19 19 PHE CB C 19 39.878 39.878 38.833 1.045 25109
112 1 . 1 1 19 19 PHE H H 19 8.062 8.062 7.567 0.495 25109
113 1 . 1 1 20 20 CYS N N 20 113.958 113.958 117.486 -3.528 25109
114 1 . 1 1 20 20 CYS HA H 20 3.943 3.943 4.251 -0.308 25109
115 1 . 1 1 20 20 CYS C C 20 173.823 173.823 174.628 -0.805 25109
116 1 . 1 1 20 20 CYS CA C 20 61.788 61.788 59.267 2.521 25109
117 1 . 1 1 20 20 CYS CB C 20 27.383 27.383 27.199 0.184 25109
118 1 . 1 1 20 20 CYS H H 20 6.850 6.850 7.454 -0.604 25109
119 1 . 1 1 21 21 ASN N N 21 116.691 116.691 118.777 -2.086 25109
120 1 . 1 1 21 21 ASN HA H 21 4.744 4.744 4.770 -0.026 25109
121 1 . 1 1 21 21 ASN C C 21 175.299 175.299 174.046 1.253 25109
122 1 . 1 1 21 21 ASN CA C 21 53.290 53.290 53.021 0.269 25109
123 1 . 1 1 21 21 ASN CB C 21 38.313 38.313 39.151 -0.838 25109
124 1 . 1 1 21 21 ASN H H 21 8.251 8.251 7.711 0.540 25109
125 1 . 1 1 22 22 VAL N N 22 122.431 122.431 120.049 2.382 25109
126 1 . 1 1 22 22 VAL HA H 22 3.550 3.550 4.183 -0.633 25109
127 1 . 1 1 22 22 VAL C C 22 174.034 174.034 173.984 0.050 25109
128 1 . 1 1 22 22 VAL CA C 22 63.937 63.937 60.717 3.220 25109
129 1 . 1 1 22 22 VAL CB C 22 31.523 31.523 34.840 -3.317 25109
130 1 . 1 1 22 22 VAL H H 22 7.573 7.573 7.598 -0.025 25109
131 1 . 1 1 23 23 ASP N N 23 127.219 127.219 123.030 4.189 25109
132 1 . 1 1 23 23 ASP CA C 23 52.186 52.186 53.723 -1.537 25109
133 1 . 1 1 23 23 ASP CB C 23 38.793 38.793 41.659 -2.866 25109
134 1 . 1 1 23 23 ASP H H 23 8.687 8.687 8.572 0.115 25109
135 1 . 1 1 24 24 VAL N N 24 127.835 127.835 122.113 5.722 25109
136 1 . 1 1 24 24 VAL HA H 24 3.293 3.293 4.088 -0.795 25109
137 1 . 1 1 24 24 VAL C C 24 176.867 176.867 177.195 -0.328 25109
138 1 . 1 1 24 24 VAL CA C 24 67.163 67.163 64.193 2.970 25109
139 1 . 1 1 24 24 VAL CB C 24 32.015 32.015 32.819 -0.804 25109
140 1 . 1 1 24 24 VAL H H 24 9.409 9.409 8.513 0.896 25109
141 1 . 1 1 25 25 VAL N N 25 114.324 114.324 116.329 -2.005 25109
142 1 . 1 1 25 25 VAL HA H 25 3.519 3.519 3.955 -0.436 25109
143 1 . 1 1 25 25 VAL C C 25 178.006 178.006 177.464 0.542 25109
144 1 . 1 1 25 25 VAL CA C 25 66.688 66.688 64.981 1.707 25109
145 1 . 1 1 25 25 VAL CB C 25 31.532 31.532 31.432 0.100 25109
146 1 . 1 1 25 25 VAL H H 25 8.038 8.038 7.851 0.187 25109
147 1 . 1 1 26 26 GLU N N 26 117.009 117.009 119.436 -2.427 25109
148 1 . 1 1 26 26 GLU HA H 26 4.091 4.091 4.255 -0.164 25109
149 1 . 1 1 26 26 GLU C C 26 177.303 177.303 177.897 -0.594 25109
150 1 . 1 1 26 26 GLU CA C 26 57.432 57.432 58.240 -0.808 25109
151 1 . 1 1 26 26 GLU CB C 26 28.965 28.965 29.683 -0.718 25109
152 1 . 1 1 26 26 GLU H H 26 7.220 7.220 8.705 -1.485 25109
153 1 . 1 1 27 27 ILE N N 27 114.080 114.080 118.812 -4.732 25109
154 1 . 1 1 27 27 ILE HA H 27 4.361 4.361 3.892 0.469 25109
155 1 . 1 1 27 27 ILE CA C 27 62.732 62.732 63.940 -1.208 25109
156 1 . 1 1 27 27 ILE CB C 27 39.591 39.591 38.398 1.193 25109
157 1 . 1 1 27 27 ILE H H 27 7.647 7.647 7.526 0.121 25109
158 1 . 1 1 28 28 LEU N N 28 121.867 121.867 120.753 1.114 25109
159 1 . 1 1 28 28 LEU HA H 28 3.937 3.937 4.208 -0.271 25109
160 1 . 1 1 28 28 LEU C C 28 175.756 175.756 176.838 -1.082 25109
161 1 . 1 1 28 28 LEU CA C 28 59.967 59.967 60.219 -0.252 25109
162 1 . 1 1 28 28 LEU CB C 28 39.513 39.513 38.936 0.577 25109
163 1 . 1 1 28 28 LEU H H 28 7.434 7.434 7.635 -0.201 25109
164 1 . 1 1 29 29 PRO HA H 29 4.210 4.210 4.307 -0.097 25109
165 1 . 1 1 29 29 PRO CB C 29 31.310 31.310 31.082 0.228 25109
166 1 . 1 1 30 30 TYR N N 30 113.832 113.832 115.984 -2.152 25109
167 1 . 1 1 30 30 TYR HA H 30 4.502 4.502 4.534 -0.032 25109
168 1 . 1 1 30 30 TYR C C 30 174.386 174.386 175.206 -0.820 25109
169 1 . 1 1 30 30 TYR CA C 30 57.694 57.694 59.430 -1.736 25109
170 1 . 1 1 30 30 TYR CB C 30 39.099 39.099 39.495 -0.396 25109
171 1 . 1 1 30 30 TYR H H 30 7.628 7.628 7.655 -0.027 25109
172 1 . 1 1 31 31 LEU N N 31 118.331 118.331 119.498 -1.167 25109
173 1 . 1 1 31 31 LEU HA H 31 4.877 4.877 4.811 0.066 25109
174 1 . 1 1 31 31 LEU C C 31 173.849 173.849 175.215 -1.366 25109
175 1 . 1 1 31 31 LEU CA C 31 51.692 51.692 51.840 -0.148 25109
176 1 . 1 1 31 31 LEU CB C 31 42.802 42.802 42.751 0.051 25109
177 1 . 1 1 31 31 LEU H H 31 7.619 7.619 7.464 0.155 25109
178 1 . 1 1 32 32 PRO HA H 32 4.355 4.355 4.533 -0.178 25109
179 1 . 1 1 32 32 PRO CB C 32 31.410 31.410 31.660 -0.250 25109
180 1 . 1 1 33 33 CYS N N 33 110.978 110.978 115.551 -4.573 25109
181 1 . 1 1 33 33 CYS HA H 33 4.341 4.341 4.228 0.113 25109
182 1 . 1 1 33 33 CYS C C 33 174.139 174.139 174.226 -0.087 25109
183 1 . 1 1 33 33 CYS CA C 33 56.212 56.212 58.471 -2.259 25109
184 1 . 1 1 33 33 CYS CB C 33 28.922 28.922 27.564 1.358 25109
185 1 . 1 1 33 33 CYS H H 33 6.414 6.414 7.750 -1.336 25109
186 1 . 1 1 34 34 LEU N N 34 123.111 123.111 120.759 2.352 25109
187 1 . 1 1 34 34 LEU HA H 34 4.606 4.606 4.450 0.156 25109
188 1 . 1 1 34 34 LEU C C 34 176.646 176.646 176.476 0.170 25109
189 1 . 1 1 34 34 LEU CA C 34 53.891 53.891 54.153 -0.262 25109
190 1 . 1 1 34 34 LEU CB C 34 42.691 42.691 43.352 -0.661 25109
191 1 . 1 1 34 34 LEU H H 34 7.550 7.550 7.289 0.261 25109
192 1 . 1 1 35 35 THR N N 35 113.831 113.831 115.772 -1.941 25109
193 1 . 1 1 35 35 THR HA H 35 4.205 4.205 4.284 -0.079 25109
194 1 . 1 1 35 35 THR C C 35 175.324 175.324 175.836 -0.512 25109
195 1 . 1 1 35 35 THR CA C 35 61.200 61.200 61.665 -0.465 25109
196 1 . 1 1 35 35 THR CB C 35 71.318 71.318 69.934 1.384 25109
197 1 . 1 1 35 35 THR H H 35 8.586 8.586 8.236 0.350 25109
198 1 . 1 1 36 36 ALA N N 36 124.128 124.128 127.171 -3.043 25109
199 1 . 1 1 36 36 ALA HA H 36 3.924 3.924 4.040 -0.116 25109
200 1 . 1 1 36 36 ALA C C 36 180.397 180.397 179.829 0.568 25109
201 1 . 1 1 36 36 ALA CA C 36 55.920 55.920 55.457 0.463 25109
202 1 . 1 1 36 36 ALA CB C 36 17.803 17.803 18.552 -0.749 25109
203 1 . 1 1 36 36 ALA H H 36 8.836 8.836 8.753 0.084 25109
204 1 . 1 1 37 37 ARG N N 37 116.793 116.793 118.127 -1.334 25109
205 1 . 1 1 37 37 ARG HA H 37 3.986 3.986 4.083 -0.097 25109
206 1 . 1 1 37 37 ARG C C 37 179.272 179.272 178.081 1.191 25109
207 1 . 1 1 37 37 ARG CA C 37 59.232 59.232 59.187 0.045 25109
208 1 . 1 1 37 37 ARG CB C 37 29.905 29.905 29.454 0.452 25109
209 1 . 1 1 37 37 ARG H H 37 8.060 8.060 8.644 -0.584 25109
210 1 . 1 1 38 38 ASP N N 38 120.030 120.030 119.175 0.855 25109
211 1 . 1 1 38 38 ASP HA H 38 4.248 4.248 4.406 -0.158 25109
212 1 . 1 1 38 38 ASP C C 38 178.885 178.885 178.475 0.410 25109
213 1 . 1 1 38 38 ASP CA C 38 57.187 57.187 57.713 -0.526 25109
214 1 . 1 1 38 38 ASP CB C 38 40.933 40.933 40.408 0.525 25109
215 1 . 1 1 38 38 ASP H H 38 7.782 7.782 8.033 -0.251 25109
216 1 . 1 1 39 39 GLN N N 39 118.223 118.223 118.264 -0.041 25109
217 1 . 1 1 39 39 GLN HA H 39 3.665 3.665 4.000 -0.335 25109
218 1 . 1 1 39 39 GLN C C 39 178.041 178.041 178.155 -0.114 25109
219 1 . 1 1 39 39 GLN CA C 39 60.601 60.601 58.666 1.935 25109
220 1 . 1 1 39 39 GLN CB C 39 27.797 27.797 28.650 -0.853 25109
221 1 . 1 1 39 39 GLN H H 39 8.476 8.476 8.068 0.408 25109
222 1 . 1 1 40 40 ASP N N 40 117.908 117.908 120.512 -2.604 25109
223 1 . 1 1 40 40 ASP HA H 40 4.253 4.253 4.330 -0.077 25109
224 1 . 1 1 40 40 ASP C C 40 178.639 178.639 178.278 0.361 25109
225 1 . 1 1 40 40 ASP CA C 40 56.400 56.400 57.486 -1.086 25109
226 1 . 1 1 40 40 ASP CB C 40 38.028 38.028 40.887 -2.859 25109
227 1 . 1 1 40 40 ASP H H 40 8.386 8.386 8.291 0.095 25109
228 1 . 1 1 41 41 ARG N N 41 120.990 120.990 119.360 1.630 25109
229 1 . 1 1 41 41 ARG HA H 41 4.042 4.042 4.017 0.025 25109
230 1 . 1 1 41 41 ARG C C 41 179.795 179.795 178.641 1.154 25109
231 1 . 1 1 41 41 ARG CA C 41 59.445 59.445 59.000 0.445 25109
232 1 . 1 1 41 41 ARG CB C 41 30.258 30.258 29.957 0.301 25109
233 1 . 1 1 41 41 ARG H H 41 8.130 8.130 8.008 0.122 25109
234 1 . 1 1 42 42 LEU N N 42 121.219 121.219 119.701 1.518 25109
235 1 . 1 1 42 42 LEU HA H 42 3.935 3.935 4.068 -0.133 25109
236 1 . 1 1 42 42 LEU C C 42 178.850 178.850 178.874 -0.024 25109
237 1 . 1 1 42 42 LEU CA C 42 58.267 58.267 57.835 0.432 25109
238 1 . 1 1 42 42 LEU CB C 42 42.033 42.033 41.544 0.489 25109
239 1 . 1 1 42 42 LEU H H 42 8.179 8.179 7.704 0.475 25109
240 1 . 1 1 43 43 ARG N N 43 119.310 119.310 119.431 -0.121 25109
241 1 . 1 1 43 43 ARG HA H 43 3.724 3.724 3.938 -0.214 25109
242 1 . 1 1 43 43 ARG C C 43 179.099 179.099 178.174 0.925 25109
243 1 . 1 1 43 43 ARG CA C 43 60.814 60.814 59.250 1.564 25109
244 1 . 1 1 43 43 ARG CB C 43 30.179 30.179 30.074 0.105 25109
245 1 . 1 1 43 43 ARG H H 43 8.296 8.296 8.319 -0.023 25109
246 1 . 1 1 44 44 ALA N N 44 121.305 121.305 120.796 0.509 25109
247 1 . 1 1 44 44 ALA HA H 44 4.103 4.103 4.172 -0.069 25109
248 1 . 1 1 44 44 ALA C C 44 180.924 180.924 179.481 1.443 25109
249 1 . 1 1 44 44 ALA CA C 44 55.225 55.225 54.972 0.253 25109
250 1 . 1 1 44 44 ALA CB C 44 18.096 18.096 18.447 -0.351 25109
251 1 . 1 1 44 44 ALA H H 44 7.774 7.774 8.170 -0.396 25109
252 1 . 1 1 45 45 THR N N 45 115.017 115.017 115.639 -0.622 25109
253 1 . 1 1 45 45 THR HA H 45 3.879 3.879 4.036 -0.157 25109
254 1 . 1 1 45 45 THR CA C 45 66.327 66.327 66.648 -0.321 25109
255 1 . 1 1 45 45 THR CB C 45 68.809 68.809 68.505 0.304 25109
256 1 . 1 1 45 45 THR H H 45 8.167 8.167 8.069 0.098 25109
257 1 . 1 1 46 46 CYS N N 46 123.609 123.609 120.076 3.533 25109
258 1 . 1 1 46 46 CYS HA H 46 4.019 4.019 4.430 -0.411 25109
259 1 . 1 1 46 46 CYS C C 46 178.077 178.077 176.182 1.895 25109
260 1 . 1 1 46 46 CYS CA C 46 62.945 62.945 62.338 0.607 25109
261 1 . 1 1 46 46 CYS CB C 46 26.139 26.139 27.102 -0.963 25109
262 1 . 1 1 46 46 CYS H H 46 8.084 8.084 8.278 -0.195 25109
263 1 . 1 1 47 47 THR N N 47 115.520 115.520 114.599 0.921 25109
264 1 . 1 1 47 47 THR HA H 47 3.915 3.915 4.213 -0.298 25109
265 1 . 1 1 47 47 THR CA C 47 66.063 66.063 64.839 1.224 25109
266 1 . 1 1 47 47 THR CB C 47 69.245 69.245 68.718 0.527 25109
267 1 . 1 1 47 47 THR H H 47 7.735 7.735 7.608 0.127 25109
268 1 . 1 1 48 48 LEU N N 48 120.099 120.099 121.045 -0.946 25109
269 1 . 1 1 48 48 LEU HA H 48 4.226 4.226 4.323 -0.097 25109
270 1 . 1 1 48 48 LEU CA C 48 57.563 57.563 56.953 0.610 25109
271 1 . 1 1 48 48 LEU CB C 48 43.625 43.625 42.731 0.894 25109
272 1 . 1 1 48 48 LEU H H 48 7.464 7.464 7.760 -0.296 25109
273 1 . 1 1 49 49 SER N N 49 111.979 111.979 112.120 -0.141 25109
274 1 . 1 1 49 49 SER HA H 49 4.661 4.661 4.551 0.110 25109
275 1 . 1 1 49 49 SER C C 49 175.581 175.581 175.057 0.524 25109
276 1 . 1 1 49 49 SER CA C 49 59.590 59.590 58.977 0.613 25109
277 1 . 1 1 49 49 SER CB C 49 65.335 65.335 64.948 0.387 25109
278 1 . 1 1 49 49 SER H H 49 8.781 8.781 8.342 0.439 25109
279 1 . 1 1 50 50 GLY N N 50 110.194 110.194 109.195 0.999 25109
280 1 . 1 1 50 50 GLY C C 50 175.123 175.123 173.488 1.635 25109
281 1 . 1 1 50 50 GLY CA C 50 44.902 44.902 45.177 -0.275 25109
282 1 . 1 1 50 50 GLY H H 50 7.955 7.955 7.809 0.146 25109
283 1 . 1 1 51 51 ASN N N 51 121.050 121.050 120.212 0.838 25109
284 1 . 1 1 51 51 ASN HA H 51 4.250 4.250 4.606 -0.356 25109
285 1 . 1 1 51 51 ASN C C 51 176.403 176.403 176.859 -0.456 25109
286 1 . 1 1 51 51 ASN CA C 51 59.303 59.303 55.085 4.218 25109
287 1 . 1 1 51 51 ASN CB C 51 41.599 41.599 38.659 2.940 25109
288 1 . 1 1 51 51 ASN H H 51 8.898 8.898 8.642 0.256 25109
289 1 . 1 1 52 52 ARG N N 52 119.825 119.825 120.835 -1.010 25109
290 1 . 1 1 52 52 ARG HA H 52 4.038 4.038 4.039 -0.001 25109
291 1 . 1 1 52 52 ARG C C 52 178.850 178.850 177.543 1.307 25109
292 1 . 1 1 52 52 ARG CA C 52 61.064 61.064 60.081 0.983 25109
293 1 . 1 1 52 52 ARG CB C 52 30.023 30.023 29.939 0.084 25109
294 1 . 1 1 52 52 ARG H H 52 8.696 8.696 8.590 0.106 25109
295 1 . 1 1 53 53 ASP N N 53 116.032 116.032 116.855 -0.823 25109
296 1 . 1 1 53 53 ASP HA H 53 4.546 4.546 4.702 -0.156 25109
297 1 . 1 1 53 53 ASP C C 53 178.996 178.996 178.528 0.468 25109
298 1 . 1 1 53 53 ASP CA C 53 56.079 56.079 57.409 -1.330 25109
299 1 . 1 1 53 53 ASP CB C 53 38.371 38.371 40.503 -2.132 25109
300 1 . 1 1 53 53 ASP H H 53 9.036 9.036 8.445 0.591 25109
301 1 . 1 1 54 54 THR N N 54 115.848 115.848 117.587 -1.739 25109
302 1 . 1 1 54 54 THR HA H 54 3.746 3.746 4.268 -0.521 25109
303 1 . 1 1 54 54 THR CA C 54 67.885 67.885 66.295 1.590 25109
304 1 . 1 1 54 54 THR CB C 54 66.953 66.953 68.873 -1.920 25109
305 1 . 1 1 54 54 THR H H 54 7.782 7.782 7.679 0.103 25109
306 1 . 1 1 55 55 LEU N N 55 125.987 125.987 122.663 3.324 25109
307 1 . 1 1 55 55 LEU HA H 55 3.554 3.554 4.100 -0.546 25109
308 1 . 1 1 55 55 LEU C C 55 177.901 177.901 178.432 -0.531 25109
309 1 . 1 1 55 55 LEU CA C 55 58.453 58.453 58.869 -0.416 25109
310 1 . 1 1 55 55 LEU CB C 55 41.863 41.863 41.607 0.256 25109
311 1 . 1 1 55 55 LEU H H 55 8.740 8.740 8.436 0.304 25109
312 1 . 1 1 56 56 TRP N N 56 116.672 116.672 119.257 -2.585 25109
313 1 . 1 1 56 56 TRP HA H 56 4.080 4.080 4.449 -0.369 25109
314 1 . 1 1 56 56 TRP C C 56 179.588 179.588 178.224 1.364 25109
315 1 . 1 1 56 56 TRP CA C 56 61.481 61.481 61.351 0.130 25109
316 1 . 1 1 56 56 TRP CB C 56 29.192 29.192 29.360 -0.168 25109
317 1 . 1 1 56 56 TRP H H 56 7.642 7.642 8.060 -0.418 25109
318 1 . 1 1 57 57 HIS N N 57 115.754 115.754 117.528 -1.774 25109
319 1 . 1 1 57 57 HIS HA H 57 4.276 4.276 4.279 -0.003 25109
320 1 . 1 1 57 57 HIS C C 57 177.514 177.514 177.373 0.142 25109
321 1 . 1 1 57 57 HIS CA C 57 58.952 58.952 59.494 -0.542 25109
322 1 . 1 1 57 57 HIS CB C 57 28.002 28.002 30.242 -2.240 25109
323 1 . 1 1 57 57 HIS H H 57 7.407 7.407 7.825 -0.418 25109
324 1 . 1 1 58 58 LEU N N 58 123.934 123.934 122.457 1.477 25109
325 1 . 1 1 58 58 LEU HA H 58 3.787 3.787 3.914 -0.127 25109
326 1 . 1 1 58 58 LEU C C 58 178.115 178.115 177.666 0.449 25109
327 1 . 1 1 58 58 LEU CA C 58 58.909 58.909 58.042 0.867 25109
328 1 . 1 1 58 58 LEU CB C 58 40.815 40.815 41.612 -0.797 25109
329 1 . 1 1 58 58 LEU H H 58 8.996 8.996 8.466 0.530 25109
330 1 . 1 1 59 59 PHE N N 59 117.721 117.721 116.386 1.335 25109
331 1 . 1 1 59 59 PHE HA H 59 3.935 3.935 3.798 0.137 25109
332 1 . 1 1 59 59 PHE C C 59 176.987 176.987 177.481 -0.494 25109
333 1 . 1 1 59 59 PHE CA C 59 60.113 60.113 61.653 -1.540 25109
334 1 . 1 1 59 59 PHE CB C 59 36.960 36.960 37.829 -0.869 25109
335 1 . 1 1 59 59 PHE H H 59 8.201 8.201 8.361 -0.160 25109
336 1 . 1 1 60 60 ASN N N 60 115.695 115.695 117.285 -1.590 25109
337 1 . 1 1 60 60 ASN HA H 60 3.919 3.919 4.294 -0.375 25109
338 1 . 1 1 60 60 ASN C C 60 176.670 176.670 176.572 0.098 25109
339 1 . 1 1 60 60 ASN CA C 60 56.756 56.756 55.720 1.036 25109
340 1 . 1 1 60 60 ASN CB C 60 39.318 39.318 38.752 0.566 25109
341 1 . 1 1 60 60 ASN H H 60 7.666 7.666 7.989 -0.323 25109
342 1 . 1 1 61 61 THR N N 61 115.110 115.110 115.444 -0.334 25109
343 1 . 1 1 61 61 THR HA H 61 3.733 3.733 4.090 -0.357 25109
344 1 . 1 1 61 61 THR CA C 61 66.319 66.319 65.461 0.858 25109
345 1 . 1 1 61 61 THR CB C 61 69.174 69.174 68.945 0.229 25109
346 1 . 1 1 61 61 THR H H 61 7.782 7.782 7.890 -0.108 25109
347 1 . 1 1 62 62 LEU N N 62 121.559 121.559 122.797 -1.238 25109
348 1 . 1 1 62 62 LEU HA H 62 3.489 3.489 3.892 -0.403 25109
349 1 . 1 1 62 62 LEU C C 62 176.600 176.600 177.850 -1.250 25109
350 1 . 1 1 62 62 LEU CA C 62 57.965 57.965 57.955 0.010 25109
351 1 . 1 1 62 62 LEU CB C 62 42.335 42.335 40.963 1.372 25109
352 1 . 1 1 62 62 LEU H H 62 8.362 8.362 8.215 0.147 25109
353 1 . 1 1 63 63 GLN N N 63 109.150 109.150 115.161 -6.011 25109
354 1 . 1 1 63 63 GLN HA H 63 2.077 2.077 3.572 -1.495 25109
355 1 . 1 1 63 63 GLN C C 63 175.194 175.194 176.935 -1.741 25109
356 1 . 1 1 63 63 GLN CA C 63 56.266 56.266 57.451 -1.185 25109
357 1 . 1 1 63 63 GLN CB C 63 25.694 25.694 27.752 -2.058 25109
358 1 . 1 1 63 63 GLN H H 63 6.458 6.458 7.495 -1.037 25109
359 1 . 1 1 64 64 ARG N N 64 116.029 116.029 117.909 -1.880 25109
360 1 . 1 1 64 64 ARG HA H 64 4.098 4.098 4.262 -0.164 25109
361 1 . 1 1 64 64 ARG C C 64 176.459 176.459 176.302 0.157 25109
362 1 . 1 1 64 64 ARG CA C 64 56.143 56.143 56.241 -0.098 25109
363 1 . 1 1 64 64 ARG CB C 64 30.584 30.584 30.607 -0.023 25109
364 1 . 1 1 64 64 ARG H H 64 6.596 6.596 7.315 -0.719 25109
365 1 . 1 1 65 65 ARG N N 65 120.422 120.422 119.910 0.512 25109
366 1 . 1 1 65 65 ARG HA H 65 4.834 4.834 4.794 0.040 25109
367 1 . 1 1 65 65 ARG C C 65 173.436 173.436 174.245 -0.809 25109
368 1 . 1 1 65 65 ARG CA C 65 51.545 51.545 52.227 -0.682 25109
369 1 . 1 1 65 65 ARG CB C 65 28.996 28.996 29.894 -0.898 25109
370 1 . 1 1 65 65 ARG H H 65 7.932 7.932 7.695 0.237 25109
371 1 . 1 1 66 66 PRO HA H 66 4.574 4.574 4.501 0.073 25109
372 1 . 1 1 66 66 PRO CB C 66 32.059 32.059 31.755 0.304 25109
373 1 . 1 1 67 67 GLY N N 67 111.953 111.953 111.280 0.673 25109
374 1 . 1 1 67 67 GLY C C 67 177.057 177.057 175.312 1.745 25109
375 1 . 1 1 67 67 GLY CA C 67 46.307 46.307 45.213 1.094 25109
376 1 . 1 1 67 67 GLY H H 67 9.198 9.198 8.347 0.851 25109
377 1 . 1 1 68 68 TRP N N 68 117.467 117.467 120.377 -2.910 25109
378 1 . 1 1 68 68 TRP HA H 68 4.342 4.342 4.782 -0.440 25109
379 1 . 1 1 68 68 TRP C C 68 177.690 177.690 176.160 1.530 25109
380 1 . 1 1 68 68 TRP CA C 68 60.116 60.116 58.822 1.294 25109
381 1 . 1 1 68 68 TRP CB C 68 29.190 29.190 28.760 0.430 25109
382 1 . 1 1 68 68 TRP H H 68 7.647 7.647 7.962 -0.315 25109
383 1 . 1 1 69 69 VAL N N 69 121.482 121.482 121.038 0.444 25109
384 1 . 1 1 69 69 VAL HA H 69 2.637 2.637 3.165 -0.528 25109
385 1 . 1 1 69 69 VAL C C 69 177.993 177.993 177.718 0.275 25109
386 1 . 1 1 69 69 VAL CA C 69 67.466 67.466 66.197 1.269 25109
387 1 . 1 1 69 69 VAL CB C 69 30.026 30.026 30.197 -0.171 25109
388 1 . 1 1 69 69 VAL H H 69 6.666 6.666 7.344 -0.678 25109
389 1 . 1 1 70 70 GLU N N 70 116.350 116.350 119.060 -2.710 25109
390 1 . 1 1 70 70 GLU HA H 70 3.825 3.825 3.834 -0.009 25109
391 1 . 1 1 70 70 GLU C C 70 180.362 180.362 178.963 1.399 25109
392 1 . 1 1 70 70 GLU CA C 70 59.221 59.221 59.387 -0.166 25109
393 1 . 1 1 70 70 GLU CB C 70 27.305 27.305 28.759 -1.454 25109
394 1 . 1 1 70 70 GLU H H 70 7.410 7.410 8.166 -0.756 25109
395 1 . 1 1 71 71 TYR N N 71 116.750 116.750 118.459 -1.709 25109
396 1 . 1 1 71 71 TYR HA H 71 4.450 4.450 4.369 0.081 25109
397 1 . 1 1 71 71 TYR C C 71 178.411 178.411 178.161 0.251 25109
398 1 . 1 1 71 71 TYR CA C 71 61.602 61.602 60.605 0.997 25109
399 1 . 1 1 71 71 TYR CB C 71 38.355 38.355 38.477 -0.122 25109
400 1 . 1 1 71 71 TYR H H 71 7.159 7.159 7.482 -0.323 25109
401 1 . 1 1 72 72 PHE N N 72 121.610 121.610 121.359 0.251 25109
402 1 . 1 1 72 72 PHE HA H 72 4.502 4.502 4.252 0.250 25109
403 1 . 1 1 72 72 PHE CA C 72 60.820 60.820 61.302 -0.482 25109
404 1 . 1 1 72 72 PHE CB C 72 40.049 40.049 39.273 0.776 25109
405 1 . 1 1 72 72 PHE H H 72 9.007 9.007 8.463 0.544 25109
406 1 . 1 1 73 73 ILE N N 73 119.200 119.200 118.921 0.279 25109
407 1 . 1 1 73 73 ILE HA H 73 3.180 3.180 3.487 -0.307 25109
408 1 . 1 1 73 73 ILE C C 73 177.620 177.620 177.628 -0.008 25109
409 1 . 1 1 73 73 ILE CA C 73 67.197 67.197 64.997 2.200 25109
410 1 . 1 1 73 73 ILE CB C 73 39.023 39.023 37.124 1.899 25109
411 1 . 1 1 73 73 ILE H H 73 8.644 8.644 8.536 0.108 25109
412 1 . 1 1 74 74 ALA N N 74 119.624 119.624 120.734 -1.110 25109
413 1 . 1 1 74 74 ALA HA H 74 3.954 3.954 4.032 -0.078 25109
414 1 . 1 1 74 74 ALA C C 74 181.030 181.030 179.054 1.976 25109
415 1 . 1 1 74 74 ALA CA C 74 55.411 55.411 54.691 0.720 25109
416 1 . 1 1 74 74 ALA CB C 74 18.136 18.136 17.986 0.150 25109
417 1 . 1 1 74 74 ALA H H 74 7.476 7.476 7.713 -0.237 25109
418 1 . 1 1 75 75 ALA N N 75 123.625 123.625 122.322 1.303 25109
419 1 . 1 1 75 75 ALA HA H 75 3.838 3.838 3.734 0.104 25109
420 1 . 1 1 75 75 ALA C C 75 179.272 179.272 179.413 -0.141 25109
421 1 . 1 1 75 75 ALA CA C 75 55.102 55.102 54.607 0.495 25109
422 1 . 1 1 75 75 ALA CB C 75 19.593 19.593 18.396 1.197 25109
423 1 . 1 1 75 75 ALA H H 75 8.524 8.524 7.450 1.074 25109
424 1 . 1 1 76 76 LEU N N 76 118.114 118.114 120.077 -1.963 25109
425 1 . 1 1 76 76 LEU HA H 76 3.672 3.672 3.993 -0.321 25109
426 1 . 1 1 76 76 LEU C C 76 180.001 180.001 179.075 0.926 25109
427 1 . 1 1 76 76 LEU CA C 76 58.256 58.256 57.152 1.104 25109
428 1 . 1 1 76 76 LEU CB C 76 41.619 41.619 40.276 1.343 25109
429 1 . 1 1 76 76 LEU H H 76 8.153 8.153 7.600 0.553 25109
430 1 . 1 1 77 77 ARG N N 77 117.830 117.830 119.172 -1.342 25109
431 1 . 1 1 77 77 ARG HA H 77 3.447 3.447 3.999 -0.552 25109
432 1 . 1 1 77 77 ARG C C 77 180.889 180.889 179.010 1.879 25109
433 1 . 1 1 77 77 ARG CA C 77 61.066 61.066 59.197 1.869 25109
434 1 . 1 1 77 77 ARG CB C 77 29.197 29.197 29.980 -0.783 25109
435 1 . 1 1 77 77 ARG H H 77 7.945 7.945 7.996 -0.051 25109
436 1 . 1 1 78 78 GLY N N 78 110.202 110.202 106.797 3.405 25109
437 1 . 1 1 78 78 GLY C C 78 174.807 174.807 175.201 -0.394 25109
438 1 . 1 1 78 78 GLY CA C 78 46.560 46.560 46.261 0.299 25109
439 1 . 1 1 78 78 GLY H H 78 8.269 8.269 7.947 0.322 25109
440 1 . 1 1 79 79 CYS N N 79 115.567 115.567 117.262 -1.695 25109
441 1 . 1 1 79 79 CYS HA H 79 4.389 4.389 4.517 -0.128 25109
442 1 . 1 1 79 79 CYS C C 79 173.025 173.025 174.695 -1.670 25109
443 1 . 1 1 79 79 CYS CA C 79 59.957 59.957 57.790 2.167 25109
444 1 . 1 1 79 79 CYS CB C 79 27.805 27.805 27.582 0.223 25109
445 1 . 1 1 79 79 CYS H H 79 7.132 7.132 7.488 -0.356 25109
446 1 . 1 1 80 80 GLU N N 80 111.759 111.759 116.403 -4.644 25109
447 1 . 1 1 80 80 GLU HA H 80 3.733 3.733 4.032 -0.299 25109
448 1 . 1 1 80 80 GLU C C 80 175.827 175.827 175.306 0.521 25109
449 1 . 1 1 80 80 GLU CA C 80 57.467 57.467 57.453 0.014 25109
450 1 . 1 1 80 80 GLU CB C 80 24.717 24.717 27.781 -3.064 25109
451 1 . 1 1 80 80 GLU H H 80 7.772 7.772 7.980 -0.208 25109
452 1 . 1 1 81 81 LEU N N 81 124.692 124.692 121.509 3.183 25109
453 1 . 1 1 81 81 LEU HA H 81 4.691 4.691 4.536 0.155 25109
454 1 . 1 1 81 81 LEU CA C 81 52.955 52.955 53.858 -0.903 25109
455 1 . 1 1 81 81 LEU CB C 81 39.391 39.391 40.734 -1.343 25109
456 1 . 1 1 81 81 LEU H H 81 8.167 8.167 8.201 -0.034 25109
457 1 . 1 1 82 82 VAL N N 82 118.320 118.320 122.160 -3.840 25109
458 1 . 1 1 82 82 VAL HA H 82 3.177 3.177 3.617 -0.440 25109
459 1 . 1 1 82 82 VAL CA C 82 66.710 66.710 66.472 0.238 25109
460 1 . 1 1 82 82 VAL CB C 82 31.948 31.948 31.795 0.153 25109
461 1 . 1 1 82 82 VAL H H 82 7.141 7.141 7.626 -0.485 25109
462 1 . 1 1 83 83 ASP N N 83 118.733 118.733 119.662 -0.929 25109
463 1 . 1 1 83 83 ASP HA H 83 4.332 4.332 4.327 0.005 25109
464 1 . 1 1 83 83 ASP C C 83 178.674 178.674 178.286 0.387 25109
465 1 . 1 1 83 83 ASP CA C 83 56.443 56.443 57.519 -1.076 25109
466 1 . 1 1 83 83 ASP CB C 83 36.829 36.829 40.241 -3.412 25109
467 1 . 1 1 83 83 ASP H H 83 8.385 8.385 8.689 -0.304 25109
468 1 . 1 1 84 84 LEU N N 84 121.026 121.026 120.118 0.908 25109
469 1 . 1 1 84 84 LEU HA H 84 3.979 3.979 4.072 -0.093 25109
470 1 . 1 1 84 84 LEU C C 84 178.796 178.796 178.875 -0.079 25109
471 1 . 1 1 84 84 LEU CA C 84 57.522 57.522 57.198 0.324 25109
472 1 . 1 1 84 84 LEU CB C 84 42.495 42.495 41.554 0.941 25109
473 1 . 1 1 84 84 LEU H H 84 7.770 7.770 7.667 0.103 25109
474 1 . 1 1 85 85 ALA N N 85 121.525 121.525 122.197 -0.672 25109
475 1 . 1 1 85 85 ALA HA H 85 3.661 3.661 3.895 -0.234 25109
476 1 . 1 1 85 85 ALA C C 85 179.322 179.322 179.097 0.225 25109
477 1 . 1 1 85 85 ALA CA C 85 55.841 55.841 55.152 0.689 25109
478 1 . 1 1 85 85 ALA CB C 85 18.927 18.927 18.130 0.797 25109
479 1 . 1 1 85 85 ALA H H 85 8.126 8.126 7.674 0.452 25109
480 1 . 1 1 86 86 ASP N N 86 115.349 115.349 118.576 -3.227 25109
481 1 . 1 1 86 86 ASP HA H 86 4.273 4.273 4.339 -0.066 25109
482 1 . 1 1 86 86 ASP C C 86 178.463 178.463 178.440 0.023 25109
483 1 . 1 1 86 86 ASP CA C 86 55.711 55.711 57.564 -1.853 25109
484 1 . 1 1 86 86 ASP CB C 86 37.162 37.162 41.013 -3.851 25109
485 1 . 1 1 86 86 ASP H H 86 8.410 8.410 8.339 0.071 25109
486 1 . 1 1 87 87 GLU N N 87 122.529 122.529 119.263 3.266 25109
487 1 . 1 1 87 87 GLU HA H 87 4.036 4.036 4.145 -0.109 25109
488 1 . 1 1 87 87 GLU C C 87 178.508 178.508 179.100 -0.592 25109
489 1 . 1 1 87 87 GLU CA C 87 59.354 59.354 59.221 0.133 25109
490 1 . 1 1 87 87 GLU CB C 87 28.273 28.273 29.671 -1.398 25109
491 1 . 1 1 87 87 GLU H H 87 8.012 8.012 8.047 -0.035 25109
492 1 . 1 1 88 88 VAL N N 88 119.148 119.148 120.094 -0.946 25109
493 1 . 1 1 88 88 VAL HA H 88 3.330 3.330 3.881 -0.551 25109
494 1 . 1 1 88 88 VAL C C 88 177.240 177.240 177.916 -0.676 25109
495 1 . 1 1 88 88 VAL CA C 88 67.249 67.249 65.932 1.317 25109
496 1 . 1 1 88 88 VAL CB C 88 31.529 31.529 31.615 -0.086 25109
497 1 . 1 1 88 88 VAL H H 88 8.291 8.291 7.778 0.513 25109
498 1 . 1 1 89 89 ALA N N 89 120.709 120.709 122.533 -1.824 25109
499 1 . 1 1 89 89 ALA HA H 89 3.915 3.915 4.039 -0.124 25109
500 1 . 1 1 89 89 ALA C C 89 180.186 180.186 179.701 0.485 25109
501 1 . 1 1 89 89 ALA CA C 89 56.059 56.059 55.428 0.631 25109
502 1 . 1 1 89 89 ALA CB C 89 18.235 18.235 18.201 0.034 25109
503 1 . 1 1 89 89 ALA H H 89 8.548 8.548 8.402 0.146 25109
504 1 . 1 1 90 90 SER N N 90 113.035 113.035 113.546 -0.511 25109
505 1 . 1 1 90 90 SER HA H 90 4.047 4.047 4.269 -0.222 25109
506 1 . 1 1 90 90 SER C C 90 177.564 177.564 176.289 1.275 25109
507 1 . 1 1 90 90 SER CA C 90 61.771 61.771 61.433 0.338 25109
508 1 . 1 1 90 90 SER CB C 90 62.907 62.907 63.173 -0.266 25109
509 1 . 1 1 90 90 SER H H 90 7.969 7.969 8.094 -0.125 25109
510 1 . 1 1 91 91 VAL N N 91 123.417 123.417 121.761 1.656 25109
511 1 . 1 1 91 91 VAL HA H 91 3.347 3.347 3.645 -0.298 25109
512 1 . 1 1 91 91 VAL C C 91 178.428 178.428 177.703 0.725 25109
513 1 . 1 1 91 91 VAL CA C 91 66.129 66.129 65.806 0.323 25109
514 1 . 1 1 91 91 VAL CB C 91 31.771 31.771 31.547 0.224 25109
515 1 . 1 1 91 91 VAL H H 91 7.713 7.713 7.485 0.228 25109
516 1 . 1 1 92 92 TYR N N 92 121.458 121.458 120.392 1.066 25109
517 1 . 1 1 92 92 TYR HA H 92 4.191 4.191 4.451 -0.260 25109
518 1 . 1 1 92 92 TYR CA C 92 60.994 60.994 60.010 0.984 25109
519 1 . 1 1 92 92 TYR CB C 92 38.985 38.985 38.465 0.520 25109
520 1 . 1 1 92 92 TYR H H 92 8.395 8.395 8.304 0.091 25109
521 1 . 1 1 93 93 GLN N N 93 115.549 115.549 117.754 -2.205 25109
522 1 . 1 1 93 93 GLN HA H 93 3.711 3.711 4.080 -0.369 25109
523 1 . 1 1 93 93 GLN CA C 93 58.094 58.094 57.871 0.223 25109
524 1 . 1 1 93 93 GLN CB C 93 28.298 28.298 28.519 -0.221 25109
525 1 . 1 1 93 93 GLN H H 93 8.167 8.167 7.842 0.325 25109
526 1 . 1 1 94 94 SER N N 94 115.923 115.923 113.900 2.023 25109
527 1 . 1 1 94 94 SER HA H 94 4.096 4.096 4.248 -0.152 25109
528 1 . 1 1 94 94 SER CA C 94 60.971 60.971 59.462 1.509 25109
529 1 . 1 1 94 94 SER CB C 94 62.635 62.635 63.971 -1.336 25109
530 1 . 1 1 94 94 SER H H 94 7.642 7.642 7.524 0.118 25109
531 1 . 1 1 95 95 TYR N N 95 119.565 119.565 121.443 -1.878 25109
532 1 . 1 1 95 95 TYR HA H 95 4.759 4.759 4.508 0.251 25109
533 1 . 1 1 95 95 TYR C C 95 175.334 175.334 174.115 1.219 25109
534 1 . 1 1 95 95 TYR CA C 95 57.698 57.698 57.174 0.524 25109
535 1 . 1 1 95 95 TYR CB C 95 39.319 39.319 37.736 1.583 25109
536 1 . 1 1 95 95 TYR H H 95 7.069 7.069 7.538 -0.469 25109
537 1 . 1 1 96 96 GLN N N 96 119.872 119.872 120.031 -0.159 25109
538 1 . 1 1 96 96 GLN HA H 96 4.365 4.365 4.101 0.264 25109
539 1 . 1 1 96 96 GLN C C 96 173.612 173.612 174.047 -0.435 25109
540 1 . 1 1 96 96 GLN CA C 96 54.336 54.336 55.267 -0.931 25109
541 1 . 1 1 96 96 GLN CB C 96 28.494 28.494 27.922 0.572 25109
542 1 . 1 1 96 96 GLN H H 96 7.409 7.409 8.282 -0.873 25109
543 1 . 1 1 97 97 PRO HA H 97 4.318 4.318 4.206 0.112 25109
544 1 . 1 1 97 97 PRO CA C 97 63.014 63.014 63.968 -0.954 25109
545 1 . 1 1 97 97 PRO CB C 97 32.098 32.098 32.100 -0.002 25109
546 1 . 1 1 98 98 ARG N N 98 121.759 121.759 117.857 3.902 25109
547 1 . 1 1 98 98 ARG HA H 98 4.342 4.342 4.599 -0.257 25109
548 1 . 1 1 98 98 ARG C C 98 176.848 176.848 175.238 1.610 25109
549 1 . 1 1 98 98 ARG CA C 98 56.221 56.221 54.980 1.242 25109
550 1 . 1 1 98 98 ARG CB C 98 31.087 31.087 30.833 0.254 25109
551 1 . 1 1 98 98 ARG H H 98 8.423 8.423 7.734 0.689 25109
552 1 . 1 1 99 99 THR N N 99 115.292 115.292 116.716 -1.424 25109
553 1 . 1 1 99 99 THR HA H 99 4.323 4.323 4.412 -0.089 25109
554 1 . 1 1 99 99 THR C C 99 174.350 174.350 174.269 0.081 25109
555 1 . 1 1 99 99 THR CA C 99 61.906 61.906 62.924 -1.018 25109
556 1 . 1 1 99 99 THR CB C 99 70.180 70.180 69.032 1.148 25109
557 1 . 1 1 99 99 THR H H 99 8.179 8.179 8.320 -0.141 25109
stop_
save_