data_18441
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18441
_Entry.PDB_ID 2LSR
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 18441
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.909 -0.379 18441
2 1 1 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.684 1.906 18441
3 1 1 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.478 0.215 18441
4 1 1 . 1 1 3 3 ARG N N 3 121.498 121.498 120.610 0.888 18441
5 1 1 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.235 0.006 18441
6 1 1 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.307 -0.637 18441
7 1 1 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.624 -0.114 18441
8 1 1 . 1 1 3 3 ARG H H 3 8.382 8.382 8.257 0.125 18441
9 1 1 . 1 1 4 4 LYS N N 4 122.257 122.257 119.476 2.781 18441
10 1 1 . 1 1 4 4 LYS HA H 4 4.058 4.058 3.996 0.062 18441
11 1 1 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.400 0.310 18441
12 1 1 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.810 1.466 18441
13 1 1 . 1 1 4 4 LYS H H 4 8.226 8.226 8.409 -0.183 18441
14 1 1 . 1 1 5 5 VAL N N 5 120.494 120.494 118.344 2.150 18441
15 1 1 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.735 -0.014 18441
16 1 1 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.522 1.128 18441
17 1 1 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.364 0.710 18441
18 1 1 . 1 1 5 5 VAL H H 5 8.109 8.109 8.050 0.059 18441
19 1 1 . 1 1 6 6 ALA N N 6 123.149 123.149 123.246 -0.097 18441
20 1 1 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.282 -0.247 18441
21 1 1 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.182 0.708 18441
22 1 1 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.286 0.974 18441
23 1 1 . 1 1 6 6 ALA H H 6 8.374 8.374 7.448 0.926 18441
24 1 1 . 1 1 7 7 ARG N N 7 119.587 119.587 118.223 1.364 18441
25 1 1 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.850 0.151 18441
26 1 1 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.242 0.528 18441
27 1 1 . 1 1 7 7 ARG CB C 7 30.770 30.770 29.864 0.906 18441
28 1 1 . 1 1 7 7 ARG H H 7 7.992 7.992 7.804 0.188 18441
29 1 1 . 1 1 8 8 GLU N N 8 119.745 119.745 119.794 -0.049 18441
30 1 1 . 1 1 8 8 GLU HA H 8 4.058 4.058 3.975 0.083 18441
31 1 1 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.171 0.599 18441
32 1 1 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.453 0.497 18441
33 1 1 . 1 1 8 8 GLU H H 8 8.165 8.165 8.028 0.137 18441
34 1 1 . 1 1 9 9 PHE N N 9 121.436 121.436 120.012 1.424 18441
35 1 1 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.421 -0.294 18441
36 1 1 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.946 3.074 18441
37 1 1 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.561 1.062 18441
38 1 1 . 1 1 9 9 PHE H H 9 8.180 8.180 8.157 0.023 18441
39 1 1 . 1 1 10 10 ARG N N 10 119.028 119.028 120.049 -1.021 18441
40 1 1 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.486 0.375 18441
41 1 1 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.494 0.086 18441
42 1 1 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.463 0.857 18441
43 1 1 . 1 1 10 10 ARG H H 10 7.910 7.910 7.936 -0.026 18441
44 1 1 . 1 1 11 11 HIS N N 11 116.563 116.563 117.525 -0.962 18441
45 1 1 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.291 0.165 18441
46 1 1 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.798 0.382 18441
47 1 1 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.831 0.199 18441
48 1 1 . 1 1 11 11 HIS H H 11 8.001 8.001 8.224 -0.223 18441
49 1 1 . 1 1 12 12 LYS N N 12 120.773 120.773 119.876 0.897 18441
50 1 1 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.124 -0.116 18441
51 1 1 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.667 0.313 18441
52 1 1 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.506 0.187 18441
53 1 1 . 1 1 12 12 LYS H H 12 7.796 7.796 7.811 -0.015 18441
54 1 1 . 1 1 13 13 VAL N N 13 120.125 120.125 120.189 -0.064 18441
55 1 1 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.694 -0.583 18441
56 1 1 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.050 1.130 18441
57 1 1 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.350 0.790 18441
58 1 1 . 1 1 13 13 VAL H H 13 7.821 7.821 8.162 -0.341 18441
59 1 1 . 1 1 14 14 ASP N N 14 117.462 117.462 119.191 -1.729 18441
60 1 1 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.323 -0.061 18441
61 1 1 . 1 1 14 14 ASP CA C 14 57.400 57.400 56.971 0.429 18441
62 1 1 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.728 0.586 18441
63 1 1 . 1 1 14 14 ASP H H 14 8.276 8.276 7.797 0.479 18441
64 1 1 . 1 1 15 15 PHE N N 15 117.914 117.914 118.852 -0.938 18441
65 1 1 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.223 0.139 18441
66 1 1 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.644 -0.454 18441
67 1 1 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.561 1.137 18441
68 1 1 . 1 1 15 15 PHE H H 15 7.664 7.664 7.673 -0.009 18441
69 1 1 . 1 1 16 16 LEU N N 16 116.737 116.737 117.270 -0.533 18441
70 1 1 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.250 -0.016 18441
71 1 1 . 1 1 16 16 LEU CA C 16 56.420 56.420 55.042 1.378 18441
72 1 1 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.554 2.524 18441
73 1 1 . 1 1 16 16 LEU H H 16 7.658 7.658 7.923 -0.265 18441
74 1 1 . 1 1 17 17 ILE N N 17 120.533 120.533 117.636 2.897 18441
75 1 1 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.502 -0.394 18441
76 1 1 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.027 1.513 18441
77 1 1 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.091 1.266 18441
78 1 1 . 1 1 17 17 ILE H H 17 8.336 8.336 7.462 0.874 18441
79 1 1 . 1 1 18 18 GLU N N 18 124.531 124.531 124.124 0.407 18441
80 1 1 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.018 0.192 18441
81 1 1 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.546 0.054 18441
82 1 1 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.871 1.139 18441
83 1 1 . 1 1 18 18 GLU H H 18 8.276 8.276 8.609 -0.333 18441
84 1 1 . 1 1 19 19 ASN N N 19 117.630 117.630 116.128 1.502 18441
85 1 1 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.672 0.133 18441
86 1 1 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.236 -0.498 18441
87 1 1 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.205 1.973 18441
88 1 1 . 1 1 19 19 ASN H H 19 7.700 7.700 8.166 -0.466 18441
89 1 1 . 1 1 20 20 ASP N N 20 127.428 127.428 120.056 7.372 18441
90 1 1 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.591 -0.342 18441
91 1 1 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.515 2.335 18441
92 1 1 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.137 0.177 18441
93 1 1 . 1 1 20 20 ASP H H 20 8.998 8.998 8.653 0.345 18441
94 1 1 . 1 1 21 21 ALA N N 21 122.271 122.271 123.265 -0.994 18441
95 1 1 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.119 0.141 18441
96 1 1 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.188 0.812 18441
97 1 1 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.303 0.347 18441
98 1 1 . 1 1 21 21 ALA H H 21 8.346 8.346 8.152 0.194 18441
99 1 1 . 1 1 22 22 GLU N N 22 118.716 118.716 118.062 0.654 18441
100 1 1 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.957 0.157 18441
101 1 1 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.312 0.048 18441
102 1 1 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.049 2.723 18441
103 1 1 . 1 1 22 22 GLU H H 22 7.724 7.724 8.899 -1.175 18441
104 1 1 . 1 1 23 23 LYS N N 23 121.088 121.088 117.835 3.253 18441
105 1 1 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.713 0.098 18441
106 1 1 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.939 2.731 18441
107 1 1 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.820 1.250 18441
108 1 1 . 1 1 23 23 LYS H H 23 7.618 7.618 7.739 -0.121 18441
109 1 1 . 1 1 24 24 ASP N N 24 119.010 119.010 120.615 -1.605 18441
110 1 1 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.444 0.045 18441
111 1 1 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.297 1.213 18441
112 1 1 . 1 1 24 24 ASP CB C 24 40.837 40.837 41.004 -0.167 18441
113 1 1 . 1 1 24 24 ASP H H 24 8.424 8.424 7.924 0.500 18441
114 1 1 . 1 1 25 25 TYR N N 25 120.417 120.417 121.249 -0.832 18441
115 1 1 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.202 0.041 18441
116 1 1 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.511 0.679 18441
117 1 1 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.571 -0.072 18441
118 1 1 . 1 1 25 25 TYR H H 25 7.676 7.676 8.521 -0.845 18441
119 1 1 . 1 1 26 26 LEU N N 26 120.960 120.960 119.754 1.206 18441
120 1 1 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.892 -0.291 18441
121 1 1 . 1 1 26 26 LEU CA C 26 59.440 59.440 57.983 1.457 18441
122 1 1 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.832 0.319 18441
123 1 1 . 1 1 26 26 LEU H H 26 7.965 7.965 7.808 0.157 18441
124 1 1 . 1 1 27 27 TYR N N 27 116.521 116.521 118.087 -1.566 18441
125 1 1 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.066 -0.290 18441
126 1 1 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.468 4.942 18441
127 1 1 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.115 1.288 18441
128 1 1 . 1 1 27 27 TYR H H 27 8.097 8.097 7.984 0.113 18441
129 1 1 . 1 1 28 28 ASP N N 28 123.384 123.384 119.033 4.351 18441
130 1 1 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.380 0.096 18441
131 1 1 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.894 0.646 18441
132 1 1 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.568 0.826 18441
133 1 1 . 1 1 28 28 ASP H H 28 8.355 8.355 7.892 0.463 18441
134 1 1 . 1 1 29 29 VAL N N 29 121.272 121.272 120.176 1.096 18441
135 1 1 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.679 0.034 18441
136 1 1 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.384 0.266 18441
137 1 1 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.702 0.216 18441
138 1 1 . 1 1 29 29 VAL H H 29 8.252 8.252 7.674 0.578 18441
139 1 1 . 1 1 30 30 LEU N N 30 122.443 122.443 120.299 2.144 18441
140 1 1 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.061 -0.018 18441
141 1 1 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.350 0.530 18441
142 1 1 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.657 0.624 18441
143 1 1 . 1 1 30 30 LEU H H 30 7.987 7.987 8.319 -0.332 18441
144 1 1 . 1 1 31 31 ARG N N 31 122.386 122.386 118.773 3.613 18441
145 1 1 . 1 1 31 31 ARG HA H 31 4.016 4.016 3.998 0.018 18441
146 1 1 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.612 0.768 18441
147 1 1 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.198 0.202 18441
148 1 1 . 1 1 31 31 ARG H H 31 8.637 8.637 8.260 0.377 18441
149 1 1 . 1 1 32 32 MET N N 32 120.006 120.006 118.889 1.117 18441
150 1 1 . 1 1 32 32 MET HA H 32 4.359 4.359 4.389 -0.030 18441
151 1 1 . 1 1 32 32 MET CA C 32 58.490 58.490 58.150 0.340 18441
152 1 1 . 1 1 32 32 MET CB C 32 31.677 31.677 31.815 -0.138 18441
153 1 1 . 1 1 32 32 MET H H 32 8.327 8.327 7.883 0.444 18441
154 1 1 . 1 1 33 33 TYR N N 33 123.220 123.220 121.375 1.845 18441
155 1 1 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.129 0.595 18441
156 1 1 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.802 0.198 18441
157 1 1 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.809 1.879 18441
158 1 1 . 1 1 33 33 TYR H H 33 8.054 8.054 8.129 -0.075 18441
159 1 1 . 1 1 34 34 HIS N N 34 120.860 120.860 117.751 3.109 18441
160 1 1 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.063 -0.287 18441
161 1 1 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.508 1.202 18441
162 1 1 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.325 1.067 18441
163 1 1 . 1 1 34 34 HIS H H 34 8.548 8.548 7.903 0.645 18441
164 1 1 . 1 1 35 35 GLN N N 35 113.582 113.582 118.443 -4.861 18441
165 1 1 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.223 -0.223 18441
166 1 1 . 1 1 35 35 GLN CA C 35 58.680 58.680 57.947 0.733 18441
167 1 1 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.249 1.301 18441
168 1 1 . 1 1 35 35 GLN H H 35 7.542 7.542 8.254 -0.712 18441
169 1 1 . 1 1 36 36 THR N N 36 111.117 111.117 110.945 0.172 18441
170 1 1 . 1 1 36 36 THR HA H 36 4.214 4.214 4.259 -0.045 18441
171 1 1 . 1 1 36 36 THR CA C 36 63.980 63.980 63.316 0.664 18441
172 1 1 . 1 1 36 36 THR CB C 36 71.670 71.670 70.081 1.589 18441
173 1 1 . 1 1 36 36 THR H H 36 8.569 8.569 8.389 0.180 18441
174 1 1 . 1 1 37 37 MET N N 37 120.444 120.444 116.906 3.538 18441
175 1 1 . 1 1 37 37 MET HA H 37 3.740 3.740 4.020 -0.280 18441
176 1 1 . 1 1 37 37 MET CA C 37 56.430 56.430 56.608 -0.178 18441
177 1 1 . 1 1 37 37 MET CB C 37 31.399 31.399 30.451 0.948 18441
178 1 1 . 1 1 37 37 MET H H 37 9.542 9.542 7.919 1.623 18441
179 1 1 . 1 1 38 38 ASP N N 38 117.020 117.020 120.785 -3.765 18441
180 1 1 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.857 0.087 18441
181 1 1 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.275 0.201 18441
182 1 1 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.869 -0.829 18441
183 1 1 . 1 1 38 38 ASP H H 38 7.456 7.456 7.853 -0.397 18441
184 1 1 . 1 1 39 39 VAL N N 39 128.507 128.507 122.570 5.937 18441
185 1 1 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.492 0.339 18441
186 1 1 . 1 1 39 39 VAL CA C 39 64.840 64.840 62.974 1.866 18441
187 1 1 . 1 1 39 39 VAL CB C 39 32.700 32.700 30.930 1.770 18441
188 1 1 . 1 1 39 39 VAL H H 39 8.425 8.425 8.643 -0.218 18441
189 1 1 . 1 1 40 40 ALA N N 40 125.621 125.621 122.563 3.058 18441
190 1 1 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.176 -0.189 18441
191 1 1 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.298 0.562 18441
192 1 1 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.515 -0.045 18441
193 1 1 . 1 1 40 40 ALA H H 40 7.998 7.998 8.233 -0.235 18441
194 1 1 . 1 1 41 41 VAL N N 41 122.132 122.132 118.551 3.581 18441
195 1 1 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.804 -0.233 18441
196 1 1 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.248 1.432 18441
197 1 1 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.111 1.591 18441
198 1 1 . 1 1 41 41 VAL H H 41 7.663 7.663 7.497 0.166 18441
199 1 1 . 1 1 42 42 LEU N N 42 120.190 120.190 120.688 -0.498 18441
200 1 1 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.887 0.373 18441
201 1 1 . 1 1 42 42 LEU CA C 42 58.990 58.990 57.990 1.000 18441
202 1 1 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.594 -0.889 18441
203 1 1 . 1 1 42 42 LEU H H 42 7.361 7.361 7.211 0.150 18441
204 1 1 . 1 1 43 43 VAL N N 43 116.802 116.802 118.103 -1.301 18441
205 1 1 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.938 -0.521 18441
206 1 1 . 1 1 43 43 VAL CA C 43 68.780 68.780 65.522 3.258 18441
207 1 1 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.592 1.388 18441
208 1 1 . 1 1 43 43 VAL H H 43 8.062 8.062 7.789 0.273 18441
209 1 1 . 1 1 44 44 GLY N N 44 106.242 106.242 107.854 -1.612 18441
210 1 1 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.438 0.878 18441
211 1 1 . 1 1 44 44 GLY H H 44 7.901 7.901 7.869 0.032 18441
212 1 1 . 1 1 45 45 ASP N N 45 123.359 123.359 123.357 0.002 18441
213 1 1 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.526 0.139 18441
214 1 1 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.978 -0.218 18441
215 1 1 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.878 -0.010 18441
216 1 1 . 1 1 45 45 ASP H H 45 8.680 8.680 7.859 0.821 18441
217 1 1 . 1 1 46 46 LEU N N 46 123.201 123.201 120.766 2.435 18441
218 1 1 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.628 0.438 18441
219 1 1 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.789 0.331 18441
220 1 1 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.442 1.557 18441
221 1 1 . 1 1 46 46 LEU H H 46 9.018 9.018 8.427 0.591 18441
222 1 1 . 1 1 47 47 LYS N N 47 119.196 119.196 118.571 0.625 18441
223 1 1 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.215 -0.245 18441
224 1 1 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.823 0.467 18441
225 1 1 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.209 0.932 18441
226 1 1 . 1 1 47 47 LYS H H 47 8.017 8.017 7.684 0.334 18441
227 1 1 . 1 1 48 48 LEU N N 48 116.358 116.358 120.088 -3.730 18441
228 1 1 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.982 0.179 18441
229 1 1 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.897 -0.227 18441
230 1 1 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.373 -0.213 18441
231 1 1 . 1 1 48 48 LEU H H 48 7.143 7.143 7.508 -0.365 18441
232 1 1 . 1 1 49 49 VAL N N 49 112.662 112.662 114.261 -1.599 18441
233 1 1 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.941 0.532 18441
234 1 1 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.332 -0.272 18441
235 1 1 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.557 2.608 18441
236 1 1 . 1 1 49 49 VAL H H 49 7.266 7.266 7.390 -0.124 18441
237 1 1 . 1 1 50 50 ILE N N 50 124.631 124.631 117.928 6.703 18441
238 1 1 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.336 -0.491 18441
239 1 1 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.493 1.097 18441
240 1 1 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.260 -3.099 18441
241 1 1 . 1 1 50 50 ILE H H 50 8.475 8.475 7.525 0.950 18441
242 1 1 . 1 1 51 51 ASN N N 51 119.027 119.027 118.829 0.198 18441
243 1 1 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.678 0.029 18441
244 1 1 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.356 0.092 18441
245 1 1 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.360 0.601 18441
246 1 1 . 1 1 51 51 ASN H H 51 7.347 7.347 8.074 -0.727 18441
247 1 1 . 1 1 52 52 GLU N N 52 115.889 115.889 118.716 -2.827 18441
248 1 1 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.758 0.130 18441
249 1 1 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.908 1.877 18441
250 1 1 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.867 0.153 18441
251 1 1 . 1 1 52 52 GLU H H 52 7.438 7.438 7.445 -0.007 18441
252 1 1 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.221 -0.011 18441
253 1 1 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.141 1.819 18441
254 1 1 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.838 1.110 18441
255 1 1 . 1 1 54 54 SER N N 54 113.711 113.711 112.140 1.571 18441
256 1 1 . 1 1 54 54 SER HA H 54 4.173 4.173 4.349 -0.176 18441
257 1 1 . 1 1 54 54 SER CA C 54 61.650 61.650 60.798 0.852 18441
258 1 1 . 1 1 54 54 SER CB C 54 62.930 62.930 63.181 -0.251 18441
259 1 1 . 1 1 54 54 SER H H 54 8.946 8.946 8.227 0.719 18441
260 1 1 . 1 1 55 55 ARG N N 55 116.455 116.455 119.608 -3.153 18441
261 1 1 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.408 -0.004 18441
262 1 1 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.879 0.431 18441
263 1 1 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.400 3.212 18441
264 1 1 . 1 1 55 55 ARG H H 55 7.759 7.759 7.698 0.061 18441
265 1 1 . 1 1 56 56 LEU N N 56 121.468 121.468 123.161 -1.693 18441
266 1 1 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.285 -0.150 18441
267 1 1 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.946 -0.046 18441
268 1 1 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.559 1.438 18441
269 1 1 . 1 1 56 56 LEU H H 56 7.472 7.472 8.473 -1.001 18441
270 1 1 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.221 0.475 18441
271 1 1 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.043 0.137 18441
272 1 1 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.181 1.209 18441
273 1 1 . 1 1 58 58 LEU N N 58 119.923 119.923 117.845 2.078 18441
274 1 1 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.140 -0.090 18441
275 1 1 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.601 0.719 18441
276 1 1 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.502 0.527 18441
277 1 1 . 1 1 58 58 LEU H H 58 8.734 8.734 7.789 0.945 18441
278 1 1 . 1 1 59 59 PHE N N 59 116.632 116.632 120.877 -4.245 18441
279 1 1 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.187 0.292 18441
280 1 1 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.590 1.490 18441
281 1 1 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.960 -0.108 18441
282 1 1 . 1 1 59 59 PHE H H 59 8.312 8.312 8.294 0.018 18441
283 1 1 . 1 1 60 60 ASP N N 60 120.603 120.603 118.296 2.307 18441
284 1 1 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.514 0.157 18441
285 1 1 . 1 1 60 60 ASP CA C 60 57.870 57.870 57.035 0.835 18441
286 1 1 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.063 0.478 18441
287 1 1 . 1 1 60 60 ASP H H 60 7.462 7.462 7.802 -0.340 18441
288 1 1 . 1 1 61 61 ALA N N 61 122.470 122.470 123.552 -1.082 18441
289 1 1 . 1 1 61 61 ALA HA H 61 4.261 4.261 4.052 0.209 18441
290 1 1 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.563 -0.017 18441
291 1 1 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.429 0.451 18441
292 1 1 . 1 1 61 61 ALA H H 61 7.664 7.664 7.665 -0.001 18441
293 1 1 . 1 1 62 62 ILE N N 62 115.525 115.525 118.259 -2.734 18441
294 1 1 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.006 0.676 18441
295 1 1 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.568 -0.148 18441
296 1 1 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.944 2.212 18441
297 1 1 . 1 1 62 62 ILE H H 62 7.653 7.653 7.673 -0.020 18441
298 1 1 . 1 1 63 63 ARG N N 63 121.016 121.016 120.900 0.116 18441
299 1 1 . 1 1 63 63 ARG HA H 63 3.474 3.474 4.244 -0.770 18441
300 1 1 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.689 0.681 18441
301 1 1 . 1 1 63 63 ARG H H 63 6.917 6.917 7.511 -0.594 18441
302 1 1 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.213 0.098 18441
303 1 1 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.621 0.119 18441
304 1 1 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.033 1.154 18441
305 1 1 . 1 1 65 65 LEU N N 65 114.713 114.713 115.274 -0.561 18441
306 1 1 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.106 -0.186 18441
307 1 1 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.241 -0.581 18441
308 1 1 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.876 0.232 18441
309 1 1 . 1 1 65 65 LEU H H 65 8.074 8.074 7.490 0.584 18441
310 1 1 . 1 1 66 66 ILE N N 66 120.129 120.129 118.967 1.162 18441
311 1 1 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.070 0.235 18441
312 1 1 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.952 -5.192 18441
313 1 1 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.639 -0.995 18441
314 1 1 . 1 1 66 66 ILE H H 66 7.398 7.398 7.629 -0.231 18441
315 1 1 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.416 -0.111 18441
316 1 1 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.371 1.269 18441
317 1 1 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.549 0.740 18441
318 1 1 . 1 1 68 68 LEU N N 68 124.673 124.673 122.313 2.360 18441
319 1 1 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.976 -0.126 18441
320 1 1 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.375 0.245 18441
321 1 1 . 1 1 68 68 LEU CB C 68 42.467 42.467 42.084 0.383 18441
322 1 1 . 1 1 68 68 LEU H H 68 8.471 8.471 8.469 0.002 18441
323 1 1 . 1 1 69 69 LYS N N 69 115.247 115.247 118.930 -3.683 18441
324 1 1 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.014 0.155 18441
325 1 1 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.099 -0.079 18441
326 1 1 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.807 0.699 18441
327 1 1 . 1 1 69 69 LYS H H 69 8.536 8.536 8.385 0.151 18441
328 1 1 . 1 1 70 70 HIS N N 70 118.849 118.849 117.367 1.482 18441
329 1 1 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.402 0.823 18441
330 1 1 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.302 -3.413 18441
331 1 1 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.604 5.434 18441
332 1 1 . 1 1 70 70 HIS H H 70 8.060 8.060 8.387 -0.327 18441
333 1 1 . 1 1 71 71 GLN N N 71 122.130 122.130 119.760 2.370 18441
334 1 1 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.219 -0.520 18441
335 1 1 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.457 2.233 18441
336 1 1 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.807 0.443 18441
337 1 1 . 1 1 71 71 GLN H H 71 7.732 7.732 8.482 -0.750 18441
338 1 1 . 1 1 72 72 VAL N N 72 119.182 119.182 119.957 -0.775 18441
339 1 1 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.670 0.138 18441
340 1 1 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.571 0.649 18441
341 1 1 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.454 0.360 18441
342 1 1 . 1 1 72 72 VAL H H 72 8.203 8.203 7.979 0.224 18441
343 1 1 . 1 1 73 73 GLU N N 73 121.878 121.878 119.853 2.025 18441
344 1 1 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.091 -0.113 18441
345 1 1 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.436 0.664 18441
346 1 1 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.763 0.897 18441
347 1 1 . 1 1 73 73 GLU H H 73 8.136 8.136 7.926 0.210 18441
348 1 1 . 1 1 74 74 TYR N N 74 119.780 119.780 121.271 -1.491 18441
349 1 1 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.264 -0.587 18441
350 1 1 . 1 1 74 74 TYR CA C 74 63.310 63.310 59.572 3.738 18441
351 1 1 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.397 1.623 18441
352 1 1 . 1 1 74 74 TYR H H 74 8.491 8.491 8.541 -0.050 18441
353 1 1 . 1 1 75 75 ASP N N 75 120.231 120.231 119.376 0.855 18441
354 1 1 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.181 -0.038 18441
355 1 1 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.962 0.598 18441
356 1 1 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.507 0.071 18441
357 1 1 . 1 1 75 75 ASP H H 75 8.566 8.566 8.476 0.090 18441
358 1 1 . 1 1 76 76 GLN N N 76 118.324 118.324 118.940 -0.616 18441
359 1 1 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.065 -0.009 18441
360 1 1 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.784 -0.354 18441
361 1 1 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.968 0.462 18441
362 1 1 . 1 1 76 76 GLN H H 76 7.844 7.844 7.771 0.073 18441
363 1 1 . 1 1 77 77 LEU N N 77 117.932 117.932 117.174 0.758 18441
364 1 1 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.148 0.049 18441
365 1 1 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.367 -0.457 18441
366 1 1 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.588 2.816 18441
367 1 1 . 1 1 77 77 LEU H H 77 7.665 7.665 7.628 0.037 18441
368 1 1 . 1 1 78 78 THR N N 78 110.323 110.323 110.759 -0.436 18441
369 1 1 . 1 1 78 78 THR HA H 78 3.709 3.709 4.349 -0.640 18441
370 1 1 . 1 1 78 78 THR CA C 78 59.750 59.750 59.526 0.224 18441
371 1 1 . 1 1 78 78 THR CB C 78 69.110 69.110 69.513 -0.403 18441
372 1 1 . 1 1 78 78 THR H H 78 7.130 7.130 7.572 -0.442 18441
373 1 1 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.382 -0.136 18441
374 1 1 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.197 0.483 18441
375 1 1 . 1 1 79 79 PRO CB C 79 32.391 32.391 30.121 2.270 18441
376 1 2 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.798 -0.268 18441
377 1 2 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.659 1.931 18441
378 1 2 . 1 1 2 2 ASP CB C 2 41.693 41.693 42.799 -1.106 18441
379 1 2 . 1 1 3 3 ARG N N 3 121.498 121.498 120.900 0.598 18441
380 1 2 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.202 0.039 18441
381 1 2 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.119 -0.449 18441
382 1 2 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.475 0.035 18441
383 1 2 . 1 1 3 3 ARG H H 3 8.382 8.382 8.514 -0.132 18441
384 1 2 . 1 1 4 4 LYS N N 4 122.257 122.257 120.661 1.596 18441
385 1 2 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.081 -0.023 18441
386 1 2 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.098 0.612 18441
387 1 2 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.971 1.305 18441
388 1 2 . 1 1 4 4 LYS H H 4 8.226 8.226 8.369 -0.143 18441
389 1 2 . 1 1 5 5 VAL N N 5 120.494 120.494 117.786 2.708 18441
390 1 2 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.779 -0.058 18441
391 1 2 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.556 1.094 18441
392 1 2 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.593 0.481 18441
393 1 2 . 1 1 5 5 VAL H H 5 8.109 8.109 8.177 -0.068 18441
394 1 2 . 1 1 6 6 ALA N N 6 123.149 123.149 123.049 0.100 18441
395 1 2 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.224 -0.189 18441
396 1 2 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.130 0.760 18441
397 1 2 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.269 0.991 18441
398 1 2 . 1 1 6 6 ALA H H 6 8.374 8.374 7.552 0.822 18441
399 1 2 . 1 1 7 7 ARG N N 7 119.587 119.587 118.683 0.904 18441
400 1 2 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.919 0.082 18441
401 1 2 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.346 0.424 18441
402 1 2 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.037 0.733 18441
403 1 2 . 1 1 7 7 ARG H H 7 7.992 7.992 7.756 0.236 18441
404 1 2 . 1 1 8 8 GLU N N 8 119.745 119.745 120.001 -0.256 18441
405 1 2 . 1 1 8 8 GLU HA H 8 4.058 4.058 3.959 0.099 18441
406 1 2 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.399 0.371 18441
407 1 2 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.763 0.187 18441
408 1 2 . 1 1 8 8 GLU H H 8 8.165 8.165 8.188 -0.023 18441
409 1 2 . 1 1 9 9 PHE N N 9 121.436 121.436 119.712 1.724 18441
410 1 2 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.403 -0.276 18441
411 1 2 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.834 3.186 18441
412 1 2 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.435 1.188 18441
413 1 2 . 1 1 9 9 PHE H H 9 8.180 8.180 8.335 -0.155 18441
414 1 2 . 1 1 10 10 ARG N N 10 119.028 119.028 120.071 -1.043 18441
415 1 2 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.574 0.287 18441
416 1 2 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.515 0.065 18441
417 1 2 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.492 0.828 18441
418 1 2 . 1 1 10 10 ARG H H 10 7.910 7.910 7.890 0.020 18441
419 1 2 . 1 1 11 11 HIS N N 11 116.563 116.563 117.560 -0.997 18441
420 1 2 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.290 0.166 18441
421 1 2 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.195 -0.015 18441
422 1 2 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.824 0.206 18441
423 1 2 . 1 1 11 11 HIS H H 11 8.001 8.001 8.163 -0.162 18441
424 1 2 . 1 1 12 12 LYS N N 12 120.773 120.773 120.147 0.626 18441
425 1 2 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.127 -0.119 18441
426 1 2 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.604 0.376 18441
427 1 2 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.561 0.132 18441
428 1 2 . 1 1 12 12 LYS H H 12 7.796 7.796 7.785 0.011 18441
429 1 2 . 1 1 13 13 VAL N N 13 120.125 120.125 120.368 -0.243 18441
430 1 2 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.567 -0.456 18441
431 1 2 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.034 1.146 18441
432 1 2 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.667 0.473 18441
433 1 2 . 1 1 13 13 VAL H H 13 7.821 7.821 8.130 -0.309 18441
434 1 2 . 1 1 14 14 ASP N N 14 117.462 117.462 119.157 -1.695 18441
435 1 2 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.289 -0.027 18441
436 1 2 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.209 0.191 18441
437 1 2 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.841 0.473 18441
438 1 2 . 1 1 14 14 ASP H H 14 8.276 8.276 7.761 0.515 18441
439 1 2 . 1 1 15 15 PHE N N 15 117.914 117.914 118.938 -1.024 18441
440 1 2 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.230 0.132 18441
441 1 2 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.449 -0.259 18441
442 1 2 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.518 1.180 18441
443 1 2 . 1 1 15 15 PHE H H 15 7.664 7.664 7.705 -0.041 18441
444 1 2 . 1 1 16 16 LEU N N 16 116.737 116.737 116.356 0.381 18441
445 1 2 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.255 -0.021 18441
446 1 2 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.565 1.855 18441
447 1 2 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.337 2.741 18441
448 1 2 . 1 1 16 16 LEU H H 16 7.658 7.658 7.974 -0.316 18441
449 1 2 . 1 1 17 17 ILE N N 17 120.533 120.533 117.472 3.061 18441
450 1 2 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.401 -0.293 18441
451 1 2 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.897 1.643 18441
452 1 2 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.062 1.294 18441
453 1 2 . 1 1 17 17 ILE H H 17 8.336 8.336 7.182 1.154 18441
454 1 2 . 1 1 18 18 GLU N N 18 124.531 124.531 123.747 0.784 18441
455 1 2 . 1 1 18 18 GLU HA H 18 4.210 4.210 3.989 0.221 18441
456 1 2 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.448 0.152 18441
457 1 2 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.843 1.167 18441
458 1 2 . 1 1 18 18 GLU H H 18 8.276 8.276 8.620 -0.344 18441
459 1 2 . 1 1 19 19 ASN N N 19 117.630 117.630 115.705 1.925 18441
460 1 2 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.616 0.189 18441
461 1 2 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.713 0.025 18441
462 1 2 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.240 1.938 18441
463 1 2 . 1 1 19 19 ASN H H 19 7.700 7.700 8.185 -0.485 18441
464 1 2 . 1 1 20 20 ASP N N 20 127.428 127.428 117.173 10.255 18441
465 1 2 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.622 -0.373 18441
466 1 2 . 1 1 20 20 ASP CA C 20 58.850 58.850 55.948 2.902 18441
467 1 2 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.065 0.249 18441
468 1 2 . 1 1 20 20 ASP H H 20 8.998 8.998 8.546 0.452 18441
469 1 2 . 1 1 21 21 ALA N N 21 122.271 122.271 123.351 -1.080 18441
470 1 2 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.125 0.135 18441
471 1 2 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.196 0.804 18441
472 1 2 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.164 0.486 18441
473 1 2 . 1 1 21 21 ALA H H 21 8.346 8.346 8.159 0.187 18441
474 1 2 . 1 1 22 22 GLU N N 22 118.716 118.716 118.214 0.502 18441
475 1 2 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.057 0.057 18441
476 1 2 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.032 0.328 18441
477 1 2 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.970 2.802 18441
478 1 2 . 1 1 22 22 GLU H H 22 7.724 7.724 8.888 -1.164 18441
479 1 2 . 1 1 23 23 LYS N N 23 121.088 121.088 117.586 3.502 18441
480 1 2 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.923 -0.112 18441
481 1 2 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.067 2.603 18441
482 1 2 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.940 1.130 18441
483 1 2 . 1 1 23 23 LYS H H 23 7.618 7.618 8.217 -0.599 18441
484 1 2 . 1 1 24 24 ASP N N 24 119.010 119.010 121.217 -2.207 18441
485 1 2 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.709 -0.220 18441
486 1 2 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.634 0.876 18441
487 1 2 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.733 0.104 18441
488 1 2 . 1 1 24 24 ASP H H 24 8.424 8.424 7.991 0.433 18441
489 1 2 . 1 1 25 25 TYR N N 25 120.417 120.417 120.805 -0.388 18441
490 1 2 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.216 0.027 18441
491 1 2 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.276 0.914 18441
492 1 2 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.562 -0.063 18441
493 1 2 . 1 1 25 25 TYR H H 25 7.676 7.676 8.398 -0.722 18441
494 1 2 . 1 1 26 26 LEU N N 26 120.960 120.960 120.127 0.833 18441
495 1 2 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.871 -0.270 18441
496 1 2 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.547 0.893 18441
497 1 2 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.702 0.449 18441
498 1 2 . 1 1 26 26 LEU H H 26 7.965 7.965 7.888 0.077 18441
499 1 2 . 1 1 27 27 TYR N N 27 116.521 116.521 118.241 -1.720 18441
500 1 2 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.062 -0.286 18441
501 1 2 . 1 1 27 27 TYR CA C 27 64.410 64.410 60.632 3.778 18441
502 1 2 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.337 1.066 18441
503 1 2 . 1 1 27 27 TYR H H 27 8.097 8.097 7.972 0.125 18441
504 1 2 . 1 1 28 28 ASP N N 28 123.384 123.384 119.750 3.634 18441
505 1 2 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.399 0.077 18441
506 1 2 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.654 0.886 18441
507 1 2 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.627 0.767 18441
508 1 2 . 1 1 28 28 ASP H H 28 8.355 8.355 7.898 0.457 18441
509 1 2 . 1 1 29 29 VAL N N 29 121.272 121.272 119.669 1.603 18441
510 1 2 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.499 0.214 18441
511 1 2 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.684 -0.034 18441
512 1 2 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.595 0.323 18441
513 1 2 . 1 1 29 29 VAL H H 29 8.252 8.252 7.736 0.516 18441
514 1 2 . 1 1 30 30 LEU N N 30 122.443 122.443 119.814 2.629 18441
515 1 2 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.064 -0.021 18441
516 1 2 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.327 0.553 18441
517 1 2 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.484 0.797 18441
518 1 2 . 1 1 30 30 LEU H H 30 7.987 7.987 8.277 -0.290 18441
519 1 2 . 1 1 31 31 ARG N N 31 122.386 122.386 118.900 3.486 18441
520 1 2 . 1 1 31 31 ARG HA H 31 4.016 4.016 3.992 0.024 18441
521 1 2 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.857 0.523 18441
522 1 2 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.262 0.139 18441
523 1 2 . 1 1 31 31 ARG H H 31 8.637 8.637 8.464 0.173 18441
524 1 2 . 1 1 32 32 MET N N 32 120.006 120.006 119.474 0.532 18441
525 1 2 . 1 1 32 32 MET HA H 32 4.359 4.359 4.251 0.108 18441
526 1 2 . 1 1 32 32 MET CA C 32 58.490 58.490 58.925 -0.435 18441
527 1 2 . 1 1 32 32 MET CB C 32 31.677 31.677 32.172 -0.495 18441
528 1 2 . 1 1 32 32 MET H H 32 8.327 8.327 7.869 0.458 18441
529 1 2 . 1 1 33 33 TYR N N 33 123.220 123.220 119.585 3.635 18441
530 1 2 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.144 0.580 18441
531 1 2 . 1 1 33 33 TYR CA C 33 61.000 61.000 61.299 -0.299 18441
532 1 2 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.884 1.803 18441
533 1 2 . 1 1 33 33 TYR H H 33 8.054 8.054 8.092 -0.038 18441
534 1 2 . 1 1 34 34 HIS N N 34 120.860 120.860 118.046 2.814 18441
535 1 2 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.389 -0.613 18441
536 1 2 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.569 1.141 18441
537 1 2 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.604 0.788 18441
538 1 2 . 1 1 34 34 HIS H H 34 8.548 8.548 8.009 0.539 18441
539 1 2 . 1 1 35 35 GLN N N 35 113.582 113.582 118.656 -5.074 18441
540 1 2 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.271 -0.271 18441
541 1 2 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.474 0.206 18441
542 1 2 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.634 0.916 18441
543 1 2 . 1 1 35 35 GLN H H 35 7.542 7.542 8.479 -0.937 18441
544 1 2 . 1 1 36 36 THR N N 36 111.117 111.117 110.704 0.413 18441
545 1 2 . 1 1 36 36 THR HA H 36 4.214 4.214 4.265 -0.051 18441
546 1 2 . 1 1 36 36 THR CA C 36 63.980 63.980 62.660 1.319 18441
547 1 2 . 1 1 36 36 THR CB C 36 71.670 71.670 69.556 2.114 18441
548 1 2 . 1 1 36 36 THR H H 36 8.569 8.569 8.212 0.357 18441
549 1 2 . 1 1 37 37 MET N N 37 120.444 120.444 118.220 2.224 18441
550 1 2 . 1 1 37 37 MET HA H 37 3.740 3.740 4.444 -0.704 18441
551 1 2 . 1 1 37 37 MET CA C 37 56.430 56.430 56.152 0.278 18441
552 1 2 . 1 1 37 37 MET CB C 37 31.399 31.399 31.042 0.357 18441
553 1 2 . 1 1 37 37 MET H H 37 9.542 9.542 8.242 1.300 18441
554 1 2 . 1 1 38 38 ASP N N 38 117.020 117.020 119.755 -2.735 18441
555 1 2 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.707 0.237 18441
556 1 2 . 1 1 38 38 ASP CA C 38 53.476 53.476 52.671 0.805 18441
557 1 2 . 1 1 38 38 ASP CB C 38 42.040 42.040 41.931 0.109 18441
558 1 2 . 1 1 38 38 ASP H H 38 7.456 7.456 7.849 -0.393 18441
559 1 2 . 1 1 39 39 VAL N N 39 128.507 128.507 126.051 2.456 18441
560 1 2 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.347 0.484 18441
561 1 2 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.349 0.491 18441
562 1 2 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.463 1.237 18441
563 1 2 . 1 1 39 39 VAL H H 39 8.425 8.425 8.538 -0.113 18441
564 1 2 . 1 1 40 40 ALA N N 40 125.621 125.621 121.705 3.916 18441
565 1 2 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.032 -0.045 18441
566 1 2 . 1 1 40 40 ALA CA C 40 55.860 55.860 54.937 0.923 18441
567 1 2 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.479 -0.009 18441
568 1 2 . 1 1 40 40 ALA H H 40 7.998 7.998 7.731 0.267 18441
569 1 2 . 1 1 41 41 VAL N N 41 122.132 122.132 118.353 3.779 18441
570 1 2 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.732 -0.161 18441
571 1 2 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.035 0.645 18441
572 1 2 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.462 1.240 18441
573 1 2 . 1 1 41 41 VAL H H 41 7.663 7.663 7.482 0.181 18441
574 1 2 . 1 1 42 42 LEU N N 42 120.190 120.190 120.443 -0.253 18441
575 1 2 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.975 0.285 18441
576 1 2 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.674 0.316 18441
577 1 2 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.491 -0.786 18441
578 1 2 . 1 1 42 42 LEU H H 42 7.361 7.361 7.258 0.103 18441
579 1 2 . 1 1 43 43 VAL N N 43 116.802 116.802 118.849 -2.047 18441
580 1 2 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.668 -0.251 18441
581 1 2 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.109 2.671 18441
582 1 2 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.564 1.416 18441
583 1 2 . 1 1 43 43 VAL H H 43 8.062 8.062 7.774 0.288 18441
584 1 2 . 1 1 44 44 GLY N N 44 106.242 106.242 107.676 -1.434 18441
585 1 2 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.302 1.014 18441
586 1 2 . 1 1 44 44 GLY H H 44 7.901 7.901 7.742 0.159 18441
587 1 2 . 1 1 45 45 ASP N N 45 123.359 123.359 123.802 -0.443 18441
588 1 2 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.598 0.067 18441
589 1 2 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.810 -0.050 18441
590 1 2 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.373 0.494 18441
591 1 2 . 1 1 45 45 ASP H H 45 8.680 8.680 7.821 0.859 18441
592 1 2 . 1 1 46 46 LEU N N 46 123.201 123.201 120.306 2.895 18441
593 1 2 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.918 0.148 18441
594 1 2 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.363 -0.243 18441
595 1 2 . 1 1 46 46 LEU CB C 46 42.999 42.999 42.170 0.829 18441
596 1 2 . 1 1 46 46 LEU H H 46 9.018 9.018 8.591 0.427 18441
597 1 2 . 1 1 47 47 LYS N N 47 119.196 119.196 118.889 0.307 18441
598 1 2 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.768 0.202 18441
599 1 2 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.602 0.688 18441
600 1 2 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.125 1.016 18441
601 1 2 . 1 1 47 47 LYS H H 47 8.017 8.017 7.653 0.364 18441
602 1 2 . 1 1 48 48 LEU N N 48 116.358 116.358 119.858 -3.500 18441
603 1 2 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.050 0.111 18441
604 1 2 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.836 -0.166 18441
605 1 2 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.524 -0.364 18441
606 1 2 . 1 1 48 48 LEU H H 48 7.143 7.143 7.764 -0.621 18441
607 1 2 . 1 1 49 49 VAL N N 49 112.662 112.662 115.562 -2.900 18441
608 1 2 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.100 0.373 18441
609 1 2 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.619 -0.559 18441
610 1 2 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.824 2.342 18441
611 1 2 . 1 1 49 49 VAL H H 49 7.266 7.266 7.649 -0.383 18441
612 1 2 . 1 1 50 50 ILE N N 50 124.631 124.631 117.779 6.852 18441
613 1 2 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.364 -0.519 18441
614 1 2 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.424 1.166 18441
615 1 2 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.388 -3.227 18441
616 1 2 . 1 1 50 50 ILE H H 50 8.475 8.475 7.610 0.865 18441
617 1 2 . 1 1 51 51 ASN N N 51 119.027 119.027 119.188 -0.161 18441
618 1 2 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.461 0.246 18441
619 1 2 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.153 0.295 18441
620 1 2 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.385 0.576 18441
621 1 2 . 1 1 51 51 ASN H H 51 7.347 7.347 7.997 -0.650 18441
622 1 2 . 1 1 52 52 GLU N N 52 115.889 115.889 117.681 -1.792 18441
623 1 2 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.636 0.252 18441
624 1 2 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.936 1.849 18441
625 1 2 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.931 -0.911 18441
626 1 2 . 1 1 52 52 GLU H H 52 7.438 7.438 7.592 -0.154 18441
627 1 2 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.268 -0.058 18441
628 1 2 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.535 1.425 18441
629 1 2 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.966 0.982 18441
630 1 2 . 1 1 54 54 SER N N 54 113.711 113.711 112.077 1.634 18441
631 1 2 . 1 1 54 54 SER HA H 54 4.173 4.173 4.388 -0.215 18441
632 1 2 . 1 1 54 54 SER CA C 54 61.650 61.650 60.064 1.586 18441
633 1 2 . 1 1 54 54 SER CB C 54 62.930 62.930 63.137 -0.207 18441
634 1 2 . 1 1 54 54 SER H H 54 8.946 8.946 8.227 0.719 18441
635 1 2 . 1 1 55 55 ARG N N 55 116.455 116.455 118.612 -2.157 18441
636 1 2 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.368 0.036 18441
637 1 2 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.524 0.786 18441
638 1 2 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.288 3.324 18441
639 1 2 . 1 1 55 55 ARG H H 55 7.759 7.759 7.545 0.214 18441
640 1 2 . 1 1 56 56 LEU N N 56 121.468 121.468 123.273 -1.805 18441
641 1 2 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.250 -0.115 18441
642 1 2 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.734 0.166 18441
643 1 2 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.514 1.483 18441
644 1 2 . 1 1 56 56 LEU H H 56 7.472 7.472 8.146 -0.674 18441
645 1 2 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.213 0.483 18441
646 1 2 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.233 -0.053 18441
647 1 2 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.130 1.260 18441
648 1 2 . 1 1 58 58 LEU N N 58 119.923 119.923 117.263 2.660 18441
649 1 2 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.165 -0.115 18441
650 1 2 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.407 0.913 18441
651 1 2 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.584 0.444 18441
652 1 2 . 1 1 58 58 LEU H H 58 8.734 8.734 7.516 1.218 18441
653 1 2 . 1 1 59 59 PHE N N 59 116.632 116.632 121.251 -4.619 18441
654 1 2 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.312 0.167 18441
655 1 2 . 1 1 59 59 PHE CA C 59 63.080 63.080 60.493 2.587 18441
656 1 2 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.883 -0.031 18441
657 1 2 . 1 1 59 59 PHE H H 59 8.312 8.312 8.697 -0.385 18441
658 1 2 . 1 1 60 60 ASP N N 60 120.603 120.603 118.686 1.917 18441
659 1 2 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.447 0.224 18441
660 1 2 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.218 1.652 18441
661 1 2 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.022 0.519 18441
662 1 2 . 1 1 60 60 ASP H H 60 7.462 7.462 7.821 -0.359 18441
663 1 2 . 1 1 61 61 ALA N N 61 122.470 122.470 123.452 -0.982 18441
664 1 2 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.925 0.336 18441
665 1 2 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.632 -0.086 18441
666 1 2 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.523 0.357 18441
667 1 2 . 1 1 61 61 ALA H H 61 7.664 7.664 7.554 0.110 18441
668 1 2 . 1 1 62 62 ILE N N 62 115.525 115.525 117.748 -2.223 18441
669 1 2 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.966 0.716 18441
670 1 2 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.234 0.185 18441
671 1 2 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.922 2.233 18441
672 1 2 . 1 1 62 62 ILE H H 62 7.653 7.653 7.458 0.195 18441
673 1 2 . 1 1 63 63 ARG N N 63 121.016 121.016 120.024 0.992 18441
674 1 2 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.495 -0.021 18441
675 1 2 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.511 0.859 18441
676 1 2 . 1 1 63 63 ARG H H 63 6.917 6.917 7.270 -0.353 18441
677 1 2 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.111 0.200 18441
678 1 2 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.559 0.181 18441
679 1 2 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.007 1.180 18441
680 1 2 . 1 1 65 65 LEU N N 65 114.713 114.713 115.829 -1.116 18441
681 1 2 . 1 1 65 65 LEU HA H 65 3.920 3.920 3.985 -0.065 18441
682 1 2 . 1 1 65 65 LEU CA C 65 55.660 55.660 55.911 -0.251 18441
683 1 2 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.795 0.312 18441
684 1 2 . 1 1 65 65 LEU H H 65 8.074 8.074 7.482 0.592 18441
685 1 2 . 1 1 66 66 ILE N N 66 120.129 120.129 118.546 1.583 18441
686 1 2 . 1 1 66 66 ILE HA H 66 4.305 4.305 3.829 0.476 18441
687 1 2 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.376 -4.616 18441
688 1 2 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.265 -0.621 18441
689 1 2 . 1 1 66 66 ILE H H 66 7.398 7.398 7.392 0.006 18441
690 1 2 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.219 0.086 18441
691 1 2 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.449 1.191 18441
692 1 2 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.239 1.050 18441
693 1 2 . 1 1 68 68 LEU N N 68 124.673 124.673 123.102 1.571 18441
694 1 2 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.944 -0.094 18441
695 1 2 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.192 0.428 18441
696 1 2 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.916 0.551 18441
697 1 2 . 1 1 68 68 LEU H H 68 8.471 8.471 8.335 0.136 18441
698 1 2 . 1 1 69 69 LYS N N 69 115.247 115.247 116.900 -1.653 18441
699 1 2 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.074 0.095 18441
700 1 2 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.233 -0.213 18441
701 1 2 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.012 1.494 18441
702 1 2 . 1 1 69 69 LYS H H 69 8.536 8.536 8.684 -0.148 18441
703 1 2 . 1 1 70 70 HIS N N 70 118.849 118.849 118.712 0.137 18441
704 1 2 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.423 0.802 18441
705 1 2 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.432 -3.543 18441
706 1 2 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.613 5.425 18441
707 1 2 . 1 1 70 70 HIS H H 70 8.060 8.060 8.396 -0.336 18441
708 1 2 . 1 1 71 71 GLN N N 71 122.130 122.130 119.387 2.743 18441
709 1 2 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.000 -0.301 18441
710 1 2 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.502 2.188 18441
711 1 2 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.733 0.517 18441
712 1 2 . 1 1 71 71 GLN H H 71 7.732 7.732 8.566 -0.834 18441
713 1 2 . 1 1 72 72 VAL N N 72 119.182 119.182 119.440 -0.258 18441
714 1 2 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.717 0.091 18441
715 1 2 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.521 0.699 18441
716 1 2 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.118 0.696 18441
717 1 2 . 1 1 72 72 VAL H H 72 8.203 8.203 7.574 0.629 18441
718 1 2 . 1 1 73 73 GLU N N 73 121.878 121.878 120.204 1.674 18441
719 1 2 . 1 1 73 73 GLU HA H 73 3.978 3.978 3.998 -0.020 18441
720 1 2 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.347 0.753 18441
721 1 2 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.663 0.997 18441
722 1 2 . 1 1 73 73 GLU H H 73 8.136 8.136 7.837 0.299 18441
723 1 2 . 1 1 74 74 TYR N N 74 119.780 119.780 120.904 -1.124 18441
724 1 2 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.107 -0.430 18441
725 1 2 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.781 1.529 18441
726 1 2 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.426 1.594 18441
727 1 2 . 1 1 74 74 TYR H H 74 8.491 8.491 8.598 -0.107 18441
728 1 2 . 1 1 75 75 ASP N N 75 120.231 120.231 119.157 1.074 18441
729 1 2 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.465 -0.322 18441
730 1 2 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.350 1.210 18441
731 1 2 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.877 -0.299 18441
732 1 2 . 1 1 75 75 ASP H H 75 8.566 8.566 8.004 0.562 18441
733 1 2 . 1 1 76 76 GLN N N 76 118.324 118.324 117.495 0.829 18441
734 1 2 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.099 -0.043 18441
735 1 2 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.275 0.155 18441
736 1 2 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.320 0.110 18441
737 1 2 . 1 1 76 76 GLN H H 76 7.844 7.844 7.614 0.230 18441
738 1 2 . 1 1 77 77 LEU N N 77 117.932 117.932 116.682 1.250 18441
739 1 2 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.344 -0.147 18441
740 1 2 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.688 0.222 18441
741 1 2 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.413 2.991 18441
742 1 2 . 1 1 77 77 LEU H H 77 7.665 7.665 7.558 0.107 18441
743 1 2 . 1 1 78 78 THR N N 78 110.323 110.323 111.077 -0.754 18441
744 1 2 . 1 1 78 78 THR HA H 78 3.709 3.709 4.117 -0.408 18441
745 1 2 . 1 1 78 78 THR CA C 78 59.750 59.750 64.077 -4.327 18441
746 1 2 . 1 1 78 78 THR CB C 78 69.110 69.110 67.289 1.821 18441
747 1 2 . 1 1 78 78 THR H H 78 7.130 7.130 7.757 -0.627 18441
748 1 2 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.385 -0.139 18441
749 1 2 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.857 0.823 18441
750 1 2 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.236 0.155 18441
751 1 3 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.420 0.110 18441
752 1 3 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.939 0.651 18441
753 1 3 . 1 1 2 2 ASP CB C 2 41.693 41.693 40.836 0.857 18441
754 1 3 . 1 1 3 3 ARG N N 3 121.498 121.498 118.460 3.038 18441
755 1 3 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.283 -0.042 18441
756 1 3 . 1 1 3 3 ARG CA C 3 57.670 57.670 56.581 1.089 18441
757 1 3 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.677 -0.167 18441
758 1 3 . 1 1 3 3 ARG H H 3 8.382 8.382 8.120 0.262 18441
759 1 3 . 1 1 4 4 LYS N N 4 122.257 122.257 121.455 0.802 18441
760 1 3 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.109 -0.051 18441
761 1 3 . 1 1 4 4 LYS CA C 4 59.710 59.710 58.687 1.023 18441
762 1 3 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.470 1.806 18441
763 1 3 . 1 1 4 4 LYS H H 4 8.226 8.226 8.322 -0.096 18441
764 1 3 . 1 1 5 5 VAL N N 5 120.494 120.494 117.258 3.236 18441
765 1 3 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.792 -0.071 18441
766 1 3 . 1 1 5 5 VAL CA C 5 66.650 66.650 66.076 0.574 18441
767 1 3 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.425 0.649 18441
768 1 3 . 1 1 5 5 VAL H H 5 8.109 8.109 8.128 -0.019 18441
769 1 3 . 1 1 6 6 ALA N N 6 123.149 123.149 123.017 0.132 18441
770 1 3 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.292 -0.257 18441
771 1 3 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.261 0.629 18441
772 1 3 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.373 0.887 18441
773 1 3 . 1 1 6 6 ALA H H 6 8.374 8.374 7.370 1.004 18441
774 1 3 . 1 1 7 7 ARG N N 7 119.587 119.587 118.515 1.072 18441
775 1 3 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.844 0.157 18441
776 1 3 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.134 0.636 18441
777 1 3 . 1 1 7 7 ARG CB C 7 30.770 30.770 29.903 0.867 18441
778 1 3 . 1 1 7 7 ARG H H 7 7.992 7.992 7.941 0.050 18441
779 1 3 . 1 1 8 8 GLU N N 8 119.745 119.745 120.071 -0.326 18441
780 1 3 . 1 1 8 8 GLU HA H 8 4.058 4.058 3.903 0.155 18441
781 1 3 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.463 0.307 18441
782 1 3 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.754 0.196 18441
783 1 3 . 1 1 8 8 GLU H H 8 8.165 8.165 8.084 0.081 18441
784 1 3 . 1 1 9 9 PHE N N 9 121.436 121.436 119.495 1.941 18441
785 1 3 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.384 -0.257 18441
786 1 3 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.017 3.003 18441
787 1 3 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.625 0.998 18441
788 1 3 . 1 1 9 9 PHE H H 9 8.180 8.180 8.218 -0.038 18441
789 1 3 . 1 1 10 10 ARG N N 10 119.028 119.028 119.995 -0.967 18441
790 1 3 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.436 0.425 18441
791 1 3 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.396 0.184 18441
792 1 3 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.397 0.923 18441
793 1 3 . 1 1 10 10 ARG H H 10 7.910 7.910 7.926 -0.016 18441
794 1 3 . 1 1 11 11 HIS N N 11 116.563 116.563 117.703 -1.140 18441
795 1 3 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.267 0.189 18441
796 1 3 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.770 0.410 18441
797 1 3 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.827 0.203 18441
798 1 3 . 1 1 11 11 HIS H H 11 8.001 8.001 8.192 -0.191 18441
799 1 3 . 1 1 12 12 LYS N N 12 120.773 120.773 119.584 1.189 18441
800 1 3 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.161 -0.153 18441
801 1 3 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.659 0.321 18441
802 1 3 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.377 0.316 18441
803 1 3 . 1 1 12 12 LYS H H 12 7.796 7.796 7.799 -0.003 18441
804 1 3 . 1 1 13 13 VAL N N 13 120.125 120.125 120.030 0.095 18441
805 1 3 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.698 -0.587 18441
806 1 3 . 1 1 13 13 VAL CA C 13 68.180 68.180 65.977 2.203 18441
807 1 3 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.115 1.025 18441
808 1 3 . 1 1 13 13 VAL H H 13 7.821 7.821 7.917 -0.096 18441
809 1 3 . 1 1 14 14 ASP N N 14 117.462 117.462 119.527 -2.065 18441
810 1 3 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.378 -0.116 18441
811 1 3 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.074 0.326 18441
812 1 3 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.683 0.631 18441
813 1 3 . 1 1 14 14 ASP H H 14 8.276 8.276 7.852 0.424 18441
814 1 3 . 1 1 15 15 PHE N N 15 117.914 117.914 121.007 -3.093 18441
815 1 3 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.367 -0.005 18441
816 1 3 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.190 0.000 18441
817 1 3 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.547 1.151 18441
818 1 3 . 1 1 15 15 PHE H H 15 7.664 7.664 7.803 -0.139 18441
819 1 3 . 1 1 16 16 LEU N N 16 116.737 116.737 115.971 0.766 18441
820 1 3 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.199 0.035 18441
821 1 3 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.199 2.221 18441
822 1 3 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.167 2.911 18441
823 1 3 . 1 1 16 16 LEU H H 16 7.658 7.658 7.566 0.092 18441
824 1 3 . 1 1 17 17 ILE N N 17 120.533 120.533 117.644 2.889 18441
825 1 3 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.401 -0.293 18441
826 1 3 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.285 1.255 18441
827 1 3 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.364 0.993 18441
828 1 3 . 1 1 17 17 ILE H H 17 8.336 8.336 7.175 1.161 18441
829 1 3 . 1 1 18 18 GLU N N 18 124.531 124.531 123.767 0.764 18441
830 1 3 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.174 0.036 18441
831 1 3 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.192 0.408 18441
832 1 3 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.447 1.563 18441
833 1 3 . 1 1 18 18 GLU H H 18 8.276 8.276 8.609 -0.333 18441
834 1 3 . 1 1 19 19 ASN N N 19 117.630 117.630 117.449 0.181 18441
835 1 3 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.509 0.296 18441
836 1 3 . 1 1 19 19 ASN CA C 19 53.738 53.738 55.775 -2.037 18441
837 1 3 . 1 1 19 19 ASN CB C 19 41.178 41.178 38.792 2.386 18441
838 1 3 . 1 1 19 19 ASN H H 19 7.700 7.700 8.351 -0.651 18441
839 1 3 . 1 1 20 20 ASP N N 20 127.428 127.428 116.957 10.471 18441
840 1 3 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.213 0.036 18441
841 1 3 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.976 1.874 18441
842 1 3 . 1 1 20 20 ASP CB C 20 41.314 41.314 39.240 2.074 18441
843 1 3 . 1 1 20 20 ASP H H 20 8.998 8.998 7.815 1.183 18441
844 1 3 . 1 1 21 21 ALA N N 21 122.271 122.271 121.918 0.353 18441
845 1 3 . 1 1 21 21 ALA HA H 21 4.260 4.260 3.961 0.299 18441
846 1 3 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.224 0.776 18441
847 1 3 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.490 0.160 18441
848 1 3 . 1 1 21 21 ALA H H 21 8.346 8.346 7.795 0.551 18441
849 1 3 . 1 1 22 22 GLU N N 22 118.716 118.716 117.695 1.021 18441
850 1 3 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.982 0.133 18441
851 1 3 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.862 0.498 18441
852 1 3 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.065 2.707 18441
853 1 3 . 1 1 22 22 GLU H H 22 7.724 7.724 8.858 -1.134 18441
854 1 3 . 1 1 23 23 LYS N N 23 121.088 121.088 118.047 3.041 18441
855 1 3 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.809 0.002 18441
856 1 3 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.075 2.595 18441
857 1 3 . 1 1 23 23 LYS CB C 23 33.070 33.070 32.064 1.006 18441
858 1 3 . 1 1 23 23 LYS H H 23 7.618 7.618 7.378 0.240 18441
859 1 3 . 1 1 24 24 ASP N N 24 119.010 119.010 120.381 -1.371 18441
860 1 3 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.259 0.230 18441
861 1 3 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.162 1.348 18441
862 1 3 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.678 0.159 18441
863 1 3 . 1 1 24 24 ASP H H 24 8.424 8.424 7.754 0.670 18441
864 1 3 . 1 1 25 25 TYR N N 25 120.417 120.417 120.890 -0.473 18441
865 1 3 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.122 0.121 18441
866 1 3 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.365 0.825 18441
867 1 3 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.378 0.121 18441
868 1 3 . 1 1 25 25 TYR H H 25 7.676 7.676 8.060 -0.384 18441
869 1 3 . 1 1 26 26 LEU N N 26 120.960 120.960 119.646 1.314 18441
870 1 3 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.824 -0.223 18441
871 1 3 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.960 0.480 18441
872 1 3 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.611 0.540 18441
873 1 3 . 1 1 26 26 LEU H H 26 7.965 7.965 7.698 0.267 18441
874 1 3 . 1 1 27 27 TYR N N 27 116.521 116.521 117.775 -1.254 18441
875 1 3 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.059 -0.283 18441
876 1 3 . 1 1 27 27 TYR CA C 27 64.410 64.410 58.945 5.465 18441
877 1 3 . 1 1 27 27 TYR CB C 27 38.403 38.403 36.941 1.462 18441
878 1 3 . 1 1 27 27 TYR H H 27 8.097 8.097 7.620 0.477 18441
879 1 3 . 1 1 28 28 ASP N N 28 123.384 123.384 119.876 3.508 18441
880 1 3 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.379 0.097 18441
881 1 3 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.985 0.555 18441
882 1 3 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.898 0.496 18441
883 1 3 . 1 1 28 28 ASP H H 28 8.355 8.355 7.808 0.547 18441
884 1 3 . 1 1 29 29 VAL N N 29 121.272 121.272 119.604 1.668 18441
885 1 3 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.532 0.181 18441
886 1 3 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.689 -0.039 18441
887 1 3 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.557 0.361 18441
888 1 3 . 1 1 29 29 VAL H H 29 8.252 8.252 7.790 0.462 18441
889 1 3 . 1 1 30 30 LEU N N 30 122.443 122.443 120.184 2.259 18441
890 1 3 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.008 0.035 18441
891 1 3 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.447 0.433 18441
892 1 3 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.584 0.697 18441
893 1 3 . 1 1 30 30 LEU H H 30 7.987 7.987 7.981 0.006 18441
894 1 3 . 1 1 31 31 ARG N N 31 122.386 122.386 118.527 3.859 18441
895 1 3 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.009 0.007 18441
896 1 3 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.739 0.641 18441
897 1 3 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.245 0.155 18441
898 1 3 . 1 1 31 31 ARG H H 31 8.637 8.637 8.225 0.412 18441
899 1 3 . 1 1 32 32 MET N N 32 120.006 120.006 119.632 0.374 18441
900 1 3 . 1 1 32 32 MET HA H 32 4.359 4.359 4.177 0.182 18441
901 1 3 . 1 1 32 32 MET CA C 32 58.490 58.490 59.050 -0.560 18441
902 1 3 . 1 1 32 32 MET CB C 32 31.677 31.677 32.417 -0.740 18441
903 1 3 . 1 1 32 32 MET H H 32 8.327 8.327 8.064 0.263 18441
904 1 3 . 1 1 33 33 TYR N N 33 123.220 123.220 120.772 2.448 18441
905 1 3 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.124 0.600 18441
906 1 3 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.873 0.127 18441
907 1 3 . 1 1 33 33 TYR CB C 33 39.687 39.687 38.022 1.665 18441
908 1 3 . 1 1 33 33 TYR H H 33 8.054 8.054 8.242 -0.188 18441
909 1 3 . 1 1 34 34 HIS N N 34 120.860 120.860 117.367 3.493 18441
910 1 3 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.253 -0.477 18441
911 1 3 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.621 1.089 18441
912 1 3 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.408 0.984 18441
913 1 3 . 1 1 34 34 HIS H H 34 8.548 8.548 7.939 0.609 18441
914 1 3 . 1 1 35 35 GLN N N 35 113.582 113.582 118.189 -4.607 18441
915 1 3 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.202 -0.202 18441
916 1 3 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.471 0.209 18441
917 1 3 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.515 1.035 18441
918 1 3 . 1 1 35 35 GLN H H 35 7.542 7.542 8.360 -0.818 18441
919 1 3 . 1 1 36 36 THR N N 36 111.117 111.117 111.320 -0.203 18441
920 1 3 . 1 1 36 36 THR HA H 36 4.214 4.214 4.127 0.087 18441
921 1 3 . 1 1 36 36 THR CA C 36 63.980 63.980 63.583 0.397 18441
922 1 3 . 1 1 36 36 THR CB C 36 71.670 71.670 69.824 1.846 18441
923 1 3 . 1 1 36 36 THR H H 36 8.569 8.569 8.196 0.373 18441
924 1 3 . 1 1 37 37 MET N N 37 120.444 120.444 115.077 5.367 18441
925 1 3 . 1 1 37 37 MET HA H 37 3.740 3.740 4.070 -0.330 18441
926 1 3 . 1 1 37 37 MET CA C 37 56.430 56.430 56.331 0.099 18441
927 1 3 . 1 1 37 37 MET CB C 37 31.399 31.399 30.425 0.974 18441
928 1 3 . 1 1 37 37 MET H H 37 9.542 9.542 7.449 2.093 18441
929 1 3 . 1 1 38 38 ASP N N 38 117.020 117.020 120.892 -3.872 18441
930 1 3 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.878 0.066 18441
931 1 3 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.446 0.030 18441
932 1 3 . 1 1 38 38 ASP CB C 38 42.040 42.040 43.108 -1.068 18441
933 1 3 . 1 1 38 38 ASP H H 38 7.456 7.456 7.815 -0.359 18441
934 1 3 . 1 1 39 39 VAL N N 39 128.507 128.507 124.964 3.543 18441
935 1 3 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.967 -0.136 18441
936 1 3 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.229 0.611 18441
937 1 3 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.508 1.192 18441
938 1 3 . 1 1 39 39 VAL H H 39 8.425 8.425 8.706 -0.281 18441
939 1 3 . 1 1 40 40 ALA N N 40 125.621 125.621 122.900 2.721 18441
940 1 3 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.201 -0.214 18441
941 1 3 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.183 0.677 18441
942 1 3 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.482 -0.012 18441
943 1 3 . 1 1 40 40 ALA H H 40 7.998 7.998 8.162 -0.164 18441
944 1 3 . 1 1 41 41 VAL N N 41 122.132 122.132 118.253 3.879 18441
945 1 3 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.788 -0.217 18441
946 1 3 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.785 0.895 18441
947 1 3 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.342 1.360 18441
948 1 3 . 1 1 41 41 VAL H H 41 7.663 7.663 7.513 0.150 18441
949 1 3 . 1 1 42 42 LEU N N 42 120.190 120.190 119.937 0.253 18441
950 1 3 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.972 0.288 18441
951 1 3 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.045 0.945 18441
952 1 3 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.067 -0.362 18441
953 1 3 . 1 1 42 42 LEU H H 42 7.361 7.361 7.396 -0.035 18441
954 1 3 . 1 1 43 43 VAL N N 43 116.802 116.802 118.268 -1.466 18441
955 1 3 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.641 -0.224 18441
956 1 3 . 1 1 43 43 VAL CA C 43 68.780 68.780 65.396 3.384 18441
957 1 3 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.305 1.675 18441
958 1 3 . 1 1 43 43 VAL H H 43 8.062 8.062 7.818 0.244 18441
959 1 3 . 1 1 44 44 GLY N N 44 106.242 106.242 108.001 -1.759 18441
960 1 3 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.362 0.954 18441
961 1 3 . 1 1 44 44 GLY H H 44 7.901 7.901 7.941 -0.040 18441
962 1 3 . 1 1 45 45 ASP N N 45 123.359 123.359 123.877 -0.518 18441
963 1 3 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.655 0.010 18441
964 1 3 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.516 0.244 18441
965 1 3 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.428 0.440 18441
966 1 3 . 1 1 45 45 ASP H H 45 8.680 8.680 7.858 0.822 18441
967 1 3 . 1 1 46 46 LEU N N 46 123.201 123.201 120.493 2.708 18441
968 1 3 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.864 0.202 18441
969 1 3 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.754 -0.634 18441
970 1 3 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.924 1.075 18441
971 1 3 . 1 1 46 46 LEU H H 46 9.018 9.018 8.575 0.443 18441
972 1 3 . 1 1 47 47 LYS N N 47 119.196 119.196 118.989 0.207 18441
973 1 3 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.136 -0.166 18441
974 1 3 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.862 0.428 18441
975 1 3 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.241 0.900 18441
976 1 3 . 1 1 47 47 LYS H H 47 8.017 8.017 7.815 0.202 18441
977 1 3 . 1 1 48 48 LEU N N 48 116.358 116.358 119.759 -3.401 18441
978 1 3 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.997 0.164 18441
979 1 3 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.743 -0.073 18441
980 1 3 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.544 -0.384 18441
981 1 3 . 1 1 48 48 LEU H H 48 7.143 7.143 7.786 -0.643 18441
982 1 3 . 1 1 49 49 VAL N N 49 112.662 112.662 114.564 -1.902 18441
983 1 3 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.140 0.333 18441
984 1 3 . 1 1 49 49 VAL CA C 49 62.060 62.060 63.025 -0.965 18441
985 1 3 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.946 2.220 18441
986 1 3 . 1 1 49 49 VAL H H 49 7.266 7.266 7.685 -0.419 18441
987 1 3 . 1 1 50 50 ILE N N 50 124.631 124.631 118.996 5.635 18441
988 1 3 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.344 -0.499 18441
989 1 3 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.969 0.621 18441
990 1 3 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.963 -3.802 18441
991 1 3 . 1 1 50 50 ILE H H 50 8.475 8.475 7.810 0.665 18441
992 1 3 . 1 1 51 51 ASN N N 51 119.027 119.027 119.328 -0.301 18441
993 1 3 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.608 0.099 18441
994 1 3 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.974 -0.525 18441
995 1 3 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.564 0.397 18441
996 1 3 . 1 1 51 51 ASN H H 51 7.347 7.347 8.053 -0.706 18441
997 1 3 . 1 1 52 52 GLU N N 52 115.889 115.889 118.512 -2.623 18441
998 1 3 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.800 0.088 18441
999 1 3 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.140 1.645 18441
1000 1 3 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.349 0.671 18441
1001 1 3 . 1 1 52 52 GLU H H 52 7.438 7.438 7.553 -0.115 18441
1002 1 3 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.202 0.008 18441
1003 1 3 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.471 1.489 18441
1004 1 3 . 1 1 53 53 PRO CB C 53 32.948 32.948 32.003 0.945 18441
1005 1 3 . 1 1 54 54 SER N N 54 113.711 113.711 109.891 3.820 18441
1006 1 3 . 1 1 54 54 SER HA H 54 4.173 4.173 4.330 -0.157 18441
1007 1 3 . 1 1 54 54 SER CA C 54 61.650 61.650 60.377 1.272 18441
1008 1 3 . 1 1 54 54 SER CB C 54 62.930 62.930 63.329 -0.399 18441
1009 1 3 . 1 1 54 54 SER H H 54 8.946 8.946 8.144 0.802 18441
1010 1 3 . 1 1 55 55 ARG N N 55 116.455 116.455 118.966 -2.511 18441
1011 1 3 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.348 0.056 18441
1012 1 3 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.132 0.178 18441
1013 1 3 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.509 3.103 18441
1014 1 3 . 1 1 55 55 ARG H H 55 7.759 7.759 7.816 -0.057 18441
1015 1 3 . 1 1 56 56 LEU N N 56 121.468 121.468 123.285 -1.817 18441
1016 1 3 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.249 -0.114 18441
1017 1 3 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.910 -0.010 18441
1018 1 3 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.556 1.441 18441
1019 1 3 . 1 1 56 56 LEU H H 56 7.472 7.472 8.444 -0.972 18441
1020 1 3 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.216 0.480 18441
1021 1 3 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.115 0.065 18441
1022 1 3 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.151 1.239 18441
1023 1 3 . 1 1 58 58 LEU N N 58 119.923 119.923 117.811 2.112 18441
1024 1 3 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.151 -0.101 18441
1025 1 3 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.640 0.680 18441
1026 1 3 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.566 0.462 18441
1027 1 3 . 1 1 58 58 LEU H H 58 8.734 8.734 7.686 1.048 18441
1028 1 3 . 1 1 59 59 PHE N N 59 116.632 116.632 120.971 -4.339 18441
1029 1 3 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.189 0.290 18441
1030 1 3 . 1 1 59 59 PHE CA C 59 63.080 63.080 62.268 0.812 18441
1031 1 3 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.175 -0.323 18441
1032 1 3 . 1 1 59 59 PHE H H 59 8.312 8.312 8.559 -0.247 18441
1033 1 3 . 1 1 60 60 ASP N N 60 120.603 120.603 118.324 2.279 18441
1034 1 3 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.466 0.205 18441
1035 1 3 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.347 1.523 18441
1036 1 3 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.880 0.661 18441
1037 1 3 . 1 1 60 60 ASP H H 60 7.462 7.462 7.830 -0.368 18441
1038 1 3 . 1 1 61 61 ALA N N 61 122.470 122.470 122.780 -0.310 18441
1039 1 3 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.946 0.315 18441
1040 1 3 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.408 0.138 18441
1041 1 3 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.691 0.189 18441
1042 1 3 . 1 1 61 61 ALA H H 61 7.664 7.664 7.629 0.035 18441
1043 1 3 . 1 1 62 62 ILE N N 62 115.525 115.525 117.660 -2.135 18441
1044 1 3 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.871 0.811 18441
1045 1 3 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.068 0.352 18441
1046 1 3 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.863 2.292 18441
1047 1 3 . 1 1 62 62 ILE H H 62 7.653 7.653 7.682 -0.029 18441
1048 1 3 . 1 1 63 63 ARG N N 63 121.016 121.016 120.107 0.909 18441
1049 1 3 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.458 0.016 18441
1050 1 3 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.712 0.658 18441
1051 1 3 . 1 1 63 63 ARG H H 63 6.917 6.917 7.229 -0.312 18441
1052 1 3 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.117 0.194 18441
1053 1 3 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.553 0.187 18441
1054 1 3 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.039 1.148 18441
1055 1 3 . 1 1 65 65 LEU N N 65 114.713 114.713 115.067 -0.354 18441
1056 1 3 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.041 -0.121 18441
1057 1 3 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.130 -0.470 18441
1058 1 3 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.816 0.292 18441
1059 1 3 . 1 1 65 65 LEU H H 65 8.074 8.074 7.457 0.617 18441
1060 1 3 . 1 1 66 66 ILE N N 66 120.129 120.129 118.489 1.640 18441
1061 1 3 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.095 0.210 18441
1062 1 3 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.406 -4.646 18441
1063 1 3 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.383 -0.739 18441
1064 1 3 . 1 1 66 66 ILE H H 66 7.398 7.398 7.473 -0.075 18441
1065 1 3 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.303 0.002 18441
1066 1 3 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.782 0.858 18441
1067 1 3 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.293 0.996 18441
1068 1 3 . 1 1 68 68 LEU N N 68 124.673 124.673 123.184 1.489 18441
1069 1 3 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.961 -0.111 18441
1070 1 3 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.165 0.455 18441
1071 1 3 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.485 0.982 18441
1072 1 3 . 1 1 68 68 LEU H H 68 8.471 8.471 8.360 0.111 18441
1073 1 3 . 1 1 69 69 LYS N N 69 115.247 115.247 117.365 -2.118 18441
1074 1 3 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.041 0.128 18441
1075 1 3 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.416 -0.396 18441
1076 1 3 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.191 1.315 18441
1077 1 3 . 1 1 69 69 LYS H H 69 8.536 8.536 8.581 -0.045 18441
1078 1 3 . 1 1 70 70 HIS N N 70 118.849 118.849 118.532 0.317 18441
1079 1 3 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.418 0.807 18441
1080 1 3 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.495 -3.606 18441
1081 1 3 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.585 5.453 18441
1082 1 3 . 1 1 70 70 HIS H H 70 8.060 8.060 8.323 -0.263 18441
1083 1 3 . 1 1 71 71 GLN N N 71 122.130 122.130 119.817 2.313 18441
1084 1 3 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.036 -0.337 18441
1085 1 3 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.559 2.131 18441
1086 1 3 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.812 0.438 18441
1087 1 3 . 1 1 71 71 GLN H H 71 7.732 7.732 8.401 -0.669 18441
1088 1 3 . 1 1 72 72 VAL N N 72 119.182 119.182 120.174 -0.992 18441
1089 1 3 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.591 0.217 18441
1090 1 3 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.968 0.252 18441
1091 1 3 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.529 0.285 18441
1092 1 3 . 1 1 72 72 VAL H H 72 8.203 8.203 7.827 0.376 18441
1093 1 3 . 1 1 73 73 GLU N N 73 121.878 121.878 120.280 1.598 18441
1094 1 3 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.016 -0.038 18441
1095 1 3 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.576 0.524 18441
1096 1 3 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.798 0.862 18441
1097 1 3 . 1 1 73 73 GLU H H 73 8.136 8.136 7.836 0.300 18441
1098 1 3 . 1 1 74 74 TYR N N 74 119.780 119.780 120.508 -0.728 18441
1099 1 3 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.157 -0.480 18441
1100 1 3 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.572 1.738 18441
1101 1 3 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.459 1.561 18441
1102 1 3 . 1 1 74 74 TYR H H 74 8.491 8.491 8.673 -0.182 18441
1103 1 3 . 1 1 75 75 ASP N N 75 120.231 120.231 119.221 1.010 18441
1104 1 3 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.456 -0.313 18441
1105 1 3 . 1 1 75 75 ASP CA C 75 57.560 57.560 58.029 -0.469 18441
1106 1 3 . 1 1 75 75 ASP CB C 75 40.578 40.578 41.012 -0.434 18441
1107 1 3 . 1 1 75 75 ASP H H 75 8.566 8.566 8.466 0.100 18441
1108 1 3 . 1 1 76 76 GLN N N 76 118.324 118.324 118.497 -0.173 18441
1109 1 3 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.114 -0.058 18441
1110 1 3 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.558 -0.128 18441
1111 1 3 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.933 0.497 18441
1112 1 3 . 1 1 76 76 GLN H H 76 7.844 7.844 7.945 -0.101 18441
1113 1 3 . 1 1 77 77 LEU N N 77 117.932 117.932 117.906 0.026 18441
1114 1 3 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.305 -0.108 18441
1115 1 3 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.204 -0.294 18441
1116 1 3 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.347 3.057 18441
1117 1 3 . 1 1 77 77 LEU H H 77 7.665 7.665 7.645 0.020 18441
1118 1 3 . 1 1 78 78 THR N N 78 110.323 110.323 112.146 -1.823 18441
1119 1 3 . 1 1 78 78 THR HA H 78 3.709 3.709 4.092 -0.383 18441
1120 1 3 . 1 1 78 78 THR CA C 78 59.750 59.750 65.648 -5.898 18441
1121 1 3 . 1 1 78 78 THR CB C 78 69.110 69.110 67.390 1.720 18441
1122 1 3 . 1 1 78 78 THR H H 78 7.130 7.130 7.847 -0.717 18441
1123 1 3 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.494 -0.248 18441
1124 1 3 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.223 1.457 18441
1125 1 3 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.103 0.288 18441
1126 1 4 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.715 -0.185 18441
1127 1 4 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.560 1.030 18441
1128 1 4 . 1 1 2 2 ASP CB C 2 41.693 41.693 40.817 0.876 18441
1129 1 4 . 1 1 3 3 ARG N N 3 121.498 121.498 120.728 0.770 18441
1130 1 4 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.317 -0.076 18441
1131 1 4 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.550 0.120 18441
1132 1 4 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.653 -0.143 18441
1133 1 4 . 1 1 3 3 ARG H H 3 8.382 8.382 8.255 0.127 18441
1134 1 4 . 1 1 4 4 LYS N N 4 122.257 122.257 119.727 2.530 18441
1135 1 4 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.101 -0.043 18441
1136 1 4 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.186 0.524 18441
1137 1 4 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.228 1.048 18441
1138 1 4 . 1 1 4 4 LYS H H 4 8.226 8.226 8.333 -0.107 18441
1139 1 4 . 1 1 5 5 VAL N N 5 120.494 120.494 118.115 2.379 18441
1140 1 4 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.781 -0.060 18441
1141 1 4 . 1 1 5 5 VAL CA C 5 66.650 66.650 66.032 0.618 18441
1142 1 4 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.616 0.458 18441
1143 1 4 . 1 1 5 5 VAL H H 5 8.109 8.109 7.990 0.119 18441
1144 1 4 . 1 1 6 6 ALA N N 6 123.149 123.149 122.792 0.357 18441
1145 1 4 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.236 -0.201 18441
1146 1 4 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.114 0.776 18441
1147 1 4 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.345 0.916 18441
1148 1 4 . 1 1 6 6 ALA H H 6 8.374 8.374 7.819 0.555 18441
1149 1 4 . 1 1 7 7 ARG N N 7 119.587 119.587 118.684 0.903 18441
1150 1 4 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.895 0.106 18441
1151 1 4 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.221 0.549 18441
1152 1 4 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.244 0.527 18441
1153 1 4 . 1 1 7 7 ARG H H 7 7.992 7.992 7.842 0.150 18441
1154 1 4 . 1 1 8 8 GLU N N 8 119.745 119.745 120.471 -0.726 18441
1155 1 4 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.173 -0.115 18441
1156 1 4 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.237 0.533 18441
1157 1 4 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.362 0.588 18441
1158 1 4 . 1 1 8 8 GLU H H 8 8.165 8.165 8.231 -0.066 18441
1159 1 4 . 1 1 9 9 PHE N N 9 121.436 121.436 119.737 1.699 18441
1160 1 4 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.420 -0.293 18441
1161 1 4 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.765 3.255 18441
1162 1 4 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.488 1.135 18441
1163 1 4 . 1 1 9 9 PHE H H 9 8.180 8.180 8.118 0.062 18441
1164 1 4 . 1 1 10 10 ARG N N 10 119.028 119.028 119.778 -0.750 18441
1165 1 4 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.590 0.271 18441
1166 1 4 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.985 0.595 18441
1167 1 4 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.287 1.033 18441
1168 1 4 . 1 1 10 10 ARG H H 10 7.910 7.910 7.967 -0.057 18441
1169 1 4 . 1 1 11 11 HIS N N 11 116.563 116.563 118.275 -1.712 18441
1170 1 4 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.243 0.213 18441
1171 1 4 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.913 0.267 18441
1172 1 4 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.953 0.077 18441
1173 1 4 . 1 1 11 11 HIS H H 11 8.001 8.001 8.242 -0.241 18441
1174 1 4 . 1 1 12 12 LYS N N 12 120.773 120.773 119.121 1.652 18441
1175 1 4 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.024 -0.016 18441
1176 1 4 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.663 0.317 18441
1177 1 4 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.408 0.285 18441
1178 1 4 . 1 1 12 12 LYS H H 12 7.796 7.796 7.778 0.018 18441
1179 1 4 . 1 1 13 13 VAL N N 13 120.125 120.125 120.318 -0.193 18441
1180 1 4 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.689 -0.578 18441
1181 1 4 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.160 2.020 18441
1182 1 4 . 1 1 13 13 VAL CB C 13 32.140 32.140 30.985 1.155 18441
1183 1 4 . 1 1 13 13 VAL H H 13 7.821 7.821 8.082 -0.261 18441
1184 1 4 . 1 1 14 14 ASP N N 14 117.462 117.462 119.228 -1.766 18441
1185 1 4 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.363 -0.101 18441
1186 1 4 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.143 0.257 18441
1187 1 4 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.805 0.509 18441
1188 1 4 . 1 1 14 14 ASP H H 14 8.276 8.276 7.811 0.465 18441
1189 1 4 . 1 1 15 15 PHE N N 15 117.914 117.914 119.245 -1.331 18441
1190 1 4 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.339 0.023 18441
1191 1 4 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.348 -0.158 18441
1192 1 4 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.522 1.176 18441
1193 1 4 . 1 1 15 15 PHE H H 15 7.664 7.664 7.733 -0.069 18441
1194 1 4 . 1 1 16 16 LEU N N 16 116.737 116.737 116.409 0.328 18441
1195 1 4 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.134 0.100 18441
1196 1 4 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.471 1.949 18441
1197 1 4 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.173 2.905 18441
1198 1 4 . 1 1 16 16 LEU H H 16 7.658 7.658 8.026 -0.368 18441
1199 1 4 . 1 1 17 17 ILE N N 17 120.533 120.533 116.919 3.614 18441
1200 1 4 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.321 -0.213 18441
1201 1 4 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.245 1.295 18441
1202 1 4 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.602 0.755 18441
1203 1 4 . 1 1 17 17 ILE H H 17 8.336 8.336 7.171 1.165 18441
1204 1 4 . 1 1 18 18 GLU N N 18 124.531 124.531 122.966 1.565 18441
1205 1 4 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.042 0.168 18441
1206 1 4 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.283 0.317 18441
1207 1 4 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.479 1.531 18441
1208 1 4 . 1 1 18 18 GLU H H 18 8.276 8.276 8.605 -0.329 18441
1209 1 4 . 1 1 19 19 ASN N N 19 117.630 117.630 118.333 -0.703 18441
1210 1 4 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.617 0.188 18441
1211 1 4 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.855 -0.117 18441
1212 1 4 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.280 1.898 18441
1213 1 4 . 1 1 19 19 ASN H H 19 7.700 7.700 8.114 -0.414 18441
1214 1 4 . 1 1 20 20 ASP N N 20 127.428 127.428 118.964 8.464 18441
1215 1 4 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.716 -0.467 18441
1216 1 4 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.140 2.710 18441
1217 1 4 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.590 -0.276 18441
1218 1 4 . 1 1 20 20 ASP H H 20 8.998 8.998 8.708 0.290 18441
1219 1 4 . 1 1 21 21 ALA N N 21 122.271 122.271 123.176 -0.905 18441
1220 1 4 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.062 0.198 18441
1221 1 4 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.793 0.207 18441
1222 1 4 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.198 0.452 18441
1223 1 4 . 1 1 21 21 ALA H H 21 8.346 8.346 7.784 0.562 18441
1224 1 4 . 1 1 22 22 GLU N N 22 118.716 118.716 117.932 0.784 18441
1225 1 4 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.033 0.081 18441
1226 1 4 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.190 0.170 18441
1227 1 4 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.053 2.719 18441
1228 1 4 . 1 1 22 22 GLU H H 22 7.724 7.724 8.899 -1.175 18441
1229 1 4 . 1 1 23 23 LYS N N 23 121.088 121.088 117.462 3.626 18441
1230 1 4 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.752 0.059 18441
1231 1 4 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.140 2.530 18441
1232 1 4 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.749 1.321 18441
1233 1 4 . 1 1 23 23 LYS H H 23 7.618 7.618 8.102 -0.484 18441
1234 1 4 . 1 1 24 24 ASP N N 24 119.010 119.010 121.035 -2.025 18441
1235 1 4 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.542 -0.053 18441
1236 1 4 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.399 1.111 18441
1237 1 4 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.227 0.610 18441
1238 1 4 . 1 1 24 24 ASP H H 24 8.424 8.424 7.552 0.872 18441
1239 1 4 . 1 1 25 25 TYR N N 25 120.417 120.417 120.758 -0.341 18441
1240 1 4 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.189 0.054 18441
1241 1 4 . 1 1 25 25 TYR CA C 25 62.190 62.190 60.990 1.200 18441
1242 1 4 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.440 0.060 18441
1243 1 4 . 1 1 25 25 TYR H H 25 7.676 7.676 8.271 -0.595 18441
1244 1 4 . 1 1 26 26 LEU N N 26 120.960 120.960 119.959 1.001 18441
1245 1 4 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.883 -0.282 18441
1246 1 4 . 1 1 26 26 LEU CA C 26 59.440 59.440 59.252 0.188 18441
1247 1 4 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.627 0.524 18441
1248 1 4 . 1 1 26 26 LEU H H 26 7.965 7.965 7.975 -0.010 18441
1249 1 4 . 1 1 27 27 TYR N N 27 116.521 116.521 117.969 -1.448 18441
1250 1 4 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.130 -0.354 18441
1251 1 4 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.208 5.202 18441
1252 1 4 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.141 1.262 18441
1253 1 4 . 1 1 27 27 TYR H H 27 8.097 8.097 8.176 -0.079 18441
1254 1 4 . 1 1 28 28 ASP N N 28 123.384 123.384 119.895 3.489 18441
1255 1 4 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.488 -0.012 18441
1256 1 4 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.444 1.096 18441
1257 1 4 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.873 0.521 18441
1258 1 4 . 1 1 28 28 ASP H H 28 8.355 8.355 7.947 0.408 18441
1259 1 4 . 1 1 29 29 VAL N N 29 121.272 121.272 120.905 0.367 18441
1260 1 4 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.685 0.028 18441
1261 1 4 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.428 -0.778 18441
1262 1 4 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.992 -0.075 18441
1263 1 4 . 1 1 29 29 VAL H H 29 8.252 8.252 8.207 0.045 18441
1264 1 4 . 1 1 30 30 LEU N N 30 122.443 122.443 119.402 3.041 18441
1265 1 4 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.088 -0.045 18441
1266 1 4 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.459 0.421 18441
1267 1 4 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.538 0.743 18441
1268 1 4 . 1 1 30 30 LEU H H 30 7.987 7.987 8.350 -0.363 18441
1269 1 4 . 1 1 31 31 ARG N N 31 122.386 122.386 119.028 3.358 18441
1270 1 4 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.067 -0.051 18441
1271 1 4 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.839 0.541 18441
1272 1 4 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.234 0.166 18441
1273 1 4 . 1 1 31 31 ARG H H 31 8.637 8.637 8.056 0.581 18441
1274 1 4 . 1 1 32 32 MET N N 32 120.006 120.006 119.362 0.644 18441
1275 1 4 . 1 1 32 32 MET HA H 32 4.359 4.359 4.168 0.191 18441
1276 1 4 . 1 1 32 32 MET CA C 32 58.490 58.490 59.490 -1.000 18441
1277 1 4 . 1 1 32 32 MET CB C 32 31.677 31.677 32.312 -0.635 18441
1278 1 4 . 1 1 32 32 MET H H 32 8.327 8.327 8.444 -0.117 18441
1279 1 4 . 1 1 33 33 TYR N N 33 123.220 123.220 121.494 1.726 18441
1280 1 4 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.373 0.351 18441
1281 1 4 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.250 0.750 18441
1282 1 4 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.858 1.829 18441
1283 1 4 . 1 1 33 33 TYR H H 33 8.054 8.054 8.574 -0.520 18441
1284 1 4 . 1 1 34 34 HIS N N 34 120.860 120.860 117.183 3.677 18441
1285 1 4 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.133 -0.357 18441
1286 1 4 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.265 1.445 18441
1287 1 4 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.334 1.058 18441
1288 1 4 . 1 1 34 34 HIS H H 34 8.548 8.548 8.149 0.399 18441
1289 1 4 . 1 1 35 35 GLN N N 35 113.582 113.582 118.942 -5.360 18441
1290 1 4 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.249 -0.249 18441
1291 1 4 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.554 0.126 18441
1292 1 4 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.723 0.827 18441
1293 1 4 . 1 1 35 35 GLN H H 35 7.542 7.542 8.562 -1.020 18441
1294 1 4 . 1 1 36 36 THR N N 36 111.117 111.117 108.795 2.322 18441
1295 1 4 . 1 1 36 36 THR HA H 36 4.214 4.214 4.367 -0.153 18441
1296 1 4 . 1 1 36 36 THR CA C 36 63.980 63.980 61.957 2.023 18441
1297 1 4 . 1 1 36 36 THR CB C 36 71.670 71.670 69.779 1.891 18441
1298 1 4 . 1 1 36 36 THR H H 36 8.569 8.569 8.390 0.179 18441
1299 1 4 . 1 1 37 37 MET N N 37 120.444 120.444 117.565 2.879 18441
1300 1 4 . 1 1 37 37 MET HA H 37 3.740 3.740 4.198 -0.458 18441
1301 1 4 . 1 1 37 37 MET CA C 37 56.430 56.430 56.377 0.053 18441
1302 1 4 . 1 1 37 37 MET CB C 37 31.399 31.399 30.681 0.718 18441
1303 1 4 . 1 1 37 37 MET H H 37 9.542 9.542 7.593 1.949 18441
1304 1 4 . 1 1 38 38 ASP N N 38 117.020 117.020 120.750 -3.730 18441
1305 1 4 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.854 0.090 18441
1306 1 4 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.417 0.059 18441
1307 1 4 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.172 -0.132 18441
1308 1 4 . 1 1 38 38 ASP H H 38 7.456 7.456 7.831 -0.375 18441
1309 1 4 . 1 1 39 39 VAL N N 39 128.507 128.507 125.187 3.320 18441
1310 1 4 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.702 0.129 18441
1311 1 4 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.468 0.372 18441
1312 1 4 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.662 1.038 18441
1313 1 4 . 1 1 39 39 VAL H H 39 8.425 8.425 8.809 -0.384 18441
1314 1 4 . 1 1 40 40 ALA N N 40 125.621 125.621 122.637 2.984 18441
1315 1 4 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.119 -0.132 18441
1316 1 4 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.290 0.570 18441
1317 1 4 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.387 0.083 18441
1318 1 4 . 1 1 40 40 ALA H H 40 7.998 7.998 7.732 0.266 18441
1319 1 4 . 1 1 41 41 VAL N N 41 122.132 122.132 118.796 3.336 18441
1320 1 4 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.734 -0.163 18441
1321 1 4 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.149 0.531 18441
1322 1 4 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.982 0.720 18441
1323 1 4 . 1 1 41 41 VAL H H 41 7.663 7.663 7.640 0.023 18441
1324 1 4 . 1 1 42 42 LEU N N 42 120.190 120.190 119.164 1.026 18441
1325 1 4 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.171 0.089 18441
1326 1 4 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.268 0.722 18441
1327 1 4 . 1 1 42 42 LEU CB C 42 40.705 40.705 40.691 0.014 18441
1328 1 4 . 1 1 42 42 LEU H H 42 7.361 7.361 7.339 0.022 18441
1329 1 4 . 1 1 43 43 VAL N N 43 116.802 116.802 120.026 -3.224 18441
1330 1 4 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.622 -0.205 18441
1331 1 4 . 1 1 43 43 VAL CA C 43 68.780 68.780 65.615 3.165 18441
1332 1 4 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.559 1.421 18441
1333 1 4 . 1 1 43 43 VAL H H 43 8.062 8.062 7.742 0.321 18441
1334 1 4 . 1 1 44 44 GLY N N 44 106.242 106.242 108.052 -1.810 18441
1335 1 4 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.325 0.991 18441
1336 1 4 . 1 1 44 44 GLY H H 44 7.901 7.901 7.814 0.087 18441
1337 1 4 . 1 1 45 45 ASP N N 45 123.359 123.359 123.417 -0.058 18441
1338 1 4 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.340 0.325 18441
1339 1 4 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.277 0.483 18441
1340 1 4 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.426 0.442 18441
1341 1 4 . 1 1 45 45 ASP H H 45 8.680 8.680 7.812 0.868 18441
1342 1 4 . 1 1 46 46 LEU N N 46 123.201 123.201 120.305 2.896 18441
1343 1 4 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.830 0.236 18441
1344 1 4 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.088 0.032 18441
1345 1 4 . 1 1 46 46 LEU CB C 46 42.999 42.999 42.007 0.992 18441
1346 1 4 . 1 1 46 46 LEU H H 46 9.018 9.018 8.568 0.450 18441
1347 1 4 . 1 1 47 47 LYS N N 47 119.196 119.196 119.159 0.037 18441
1348 1 4 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.853 0.117 18441
1349 1 4 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.595 0.695 18441
1350 1 4 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.075 1.066 18441
1351 1 4 . 1 1 47 47 LYS H H 47 8.017 8.017 7.722 0.295 18441
1352 1 4 . 1 1 48 48 LEU N N 48 116.358 116.358 119.988 -3.630 18441
1353 1 4 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.932 0.229 18441
1354 1 4 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.613 0.057 18441
1355 1 4 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.295 -0.135 18441
1356 1 4 . 1 1 48 48 LEU H H 48 7.143 7.143 7.432 -0.289 18441
1357 1 4 . 1 1 49 49 VAL N N 49 112.662 112.662 113.805 -1.143 18441
1358 1 4 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.937 0.536 18441
1359 1 4 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.385 -0.325 18441
1360 1 4 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.274 2.892 18441
1361 1 4 . 1 1 49 49 VAL H H 49 7.266 7.266 7.210 0.056 18441
1362 1 4 . 1 1 50 50 ILE N N 50 124.631 124.631 117.880 6.751 18441
1363 1 4 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.335 -0.490 18441
1364 1 4 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.252 1.337 18441
1365 1 4 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.817 -3.656 18441
1366 1 4 . 1 1 50 50 ILE H H 50 8.475 8.475 7.559 0.916 18441
1367 1 4 . 1 1 51 51 ASN N N 51 119.027 119.027 119.037 -0.010 18441
1368 1 4 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.433 0.274 18441
1369 1 4 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.305 0.143 18441
1370 1 4 . 1 1 51 51 ASN CB C 51 38.961 38.961 37.937 1.024 18441
1371 1 4 . 1 1 51 51 ASN H H 51 7.347 7.347 8.144 -0.797 18441
1372 1 4 . 1 1 52 52 GLU N N 52 115.889 115.889 116.984 -1.095 18441
1373 1 4 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.757 0.131 18441
1374 1 4 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.500 2.285 18441
1375 1 4 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.205 -0.185 18441
1376 1 4 . 1 1 52 52 GLU H H 52 7.438 7.438 7.419 0.019 18441
1377 1 4 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.190 0.020 18441
1378 1 4 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.181 1.778 18441
1379 1 4 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.926 1.022 18441
1380 1 4 . 1 1 54 54 SER N N 54 113.711 113.711 111.482 2.229 18441
1381 1 4 . 1 1 54 54 SER HA H 54 4.173 4.173 4.333 -0.160 18441
1382 1 4 . 1 1 54 54 SER CA C 54 61.650 61.650 60.190 1.460 18441
1383 1 4 . 1 1 54 54 SER CB C 54 62.930 62.930 63.366 -0.436 18441
1384 1 4 . 1 1 54 54 SER H H 54 8.946 8.946 8.087 0.859 18441
1385 1 4 . 1 1 55 55 ARG N N 55 116.455 116.455 118.513 -2.058 18441
1386 1 4 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.354 0.050 18441
1387 1 4 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.534 0.776 18441
1388 1 4 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.459 3.153 18441
1389 1 4 . 1 1 55 55 ARG H H 55 7.759 7.759 7.688 0.071 18441
1390 1 4 . 1 1 56 56 LEU N N 56 121.468 121.468 123.305 -1.837 18441
1391 1 4 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.199 -0.064 18441
1392 1 4 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.849 0.051 18441
1393 1 4 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.536 1.461 18441
1394 1 4 . 1 1 56 56 LEU H H 56 7.472 7.472 8.223 -0.751 18441
1395 1 4 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.189 0.507 18441
1396 1 4 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.226 -0.046 18441
1397 1 4 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.108 1.282 18441
1398 1 4 . 1 1 58 58 LEU N N 58 119.923 119.923 117.115 2.808 18441
1399 1 4 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.144 -0.094 18441
1400 1 4 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.280 1.040 18441
1401 1 4 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.531 0.497 18441
1402 1 4 . 1 1 58 58 LEU H H 58 8.734 8.734 7.490 1.244 18441
1403 1 4 . 1 1 59 59 PHE N N 59 116.632 116.632 121.247 -4.615 18441
1404 1 4 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.237 0.242 18441
1405 1 4 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.380 1.700 18441
1406 1 4 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.944 -0.092 18441
1407 1 4 . 1 1 59 59 PHE H H 59 8.312 8.312 8.703 -0.391 18441
1408 1 4 . 1 1 60 60 ASP N N 60 120.603 120.603 118.732 1.871 18441
1409 1 4 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.476 0.195 18441
1410 1 4 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.265 1.605 18441
1411 1 4 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.008 0.533 18441
1412 1 4 . 1 1 60 60 ASP H H 60 7.462 7.462 7.826 -0.364 18441
1413 1 4 . 1 1 61 61 ALA N N 61 122.470 122.470 122.899 -0.429 18441
1414 1 4 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.983 0.278 18441
1415 1 4 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.420 0.126 18441
1416 1 4 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.346 0.534 18441
1417 1 4 . 1 1 61 61 ALA H H 61 7.664 7.664 7.511 0.153 18441
1418 1 4 . 1 1 62 62 ILE N N 62 115.525 115.525 117.978 -2.453 18441
1419 1 4 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.002 0.680 18441
1420 1 4 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.554 -0.134 18441
1421 1 4 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.871 2.284 18441
1422 1 4 . 1 1 62 62 ILE H H 62 7.653 7.653 7.426 0.227 18441
1423 1 4 . 1 1 63 63 ARG N N 63 121.016 121.016 119.873 1.143 18441
1424 1 4 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.461 0.013 18441
1425 1 4 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.532 0.838 18441
1426 1 4 . 1 1 63 63 ARG H H 63 6.917 6.917 7.208 -0.291 18441
1427 1 4 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.123 0.188 18441
1428 1 4 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.564 0.176 18441
1429 1 4 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.057 1.130 18441
1430 1 4 . 1 1 65 65 LEU N N 65 114.713 114.713 115.103 -0.390 18441
1431 1 4 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.050 -0.130 18441
1432 1 4 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.166 -0.506 18441
1433 1 4 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.846 0.263 18441
1434 1 4 . 1 1 65 65 LEU H H 65 8.074 8.074 7.519 0.555 18441
1435 1 4 . 1 1 66 66 ILE N N 66 120.129 120.129 118.899 1.230 18441
1436 1 4 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.105 0.200 18441
1437 1 4 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.828 -5.068 18441
1438 1 4 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.518 -0.874 18441
1439 1 4 . 1 1 66 66 ILE H H 66 7.398 7.398 7.505 -0.107 18441
1440 1 4 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.318 -0.013 18441
1441 1 4 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.695 0.945 18441
1442 1 4 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.334 0.955 18441
1443 1 4 . 1 1 68 68 LEU N N 68 124.673 124.673 123.352 1.321 18441
1444 1 4 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.984 -0.134 18441
1445 1 4 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.575 0.045 18441
1446 1 4 . 1 1 68 68 LEU CB C 68 42.467 42.467 42.074 0.393 18441
1447 1 4 . 1 1 68 68 LEU H H 68 8.471 8.471 8.331 0.140 18441
1448 1 4 . 1 1 69 69 LYS N N 69 115.247 115.247 118.794 -3.547 18441
1449 1 4 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.055 0.114 18441
1450 1 4 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.761 -0.741 18441
1451 1 4 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.928 0.578 18441
1452 1 4 . 1 1 69 69 LYS H H 69 8.536 8.536 8.451 0.085 18441
1453 1 4 . 1 1 70 70 HIS N N 70 118.849 118.849 117.153 1.696 18441
1454 1 4 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.308 0.917 18441
1455 1 4 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.566 -3.677 18441
1456 1 4 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.685 5.353 18441
1457 1 4 . 1 1 70 70 HIS H H 70 8.060 8.060 8.477 -0.417 18441
1458 1 4 . 1 1 71 71 GLN N N 71 122.130 122.130 119.690 2.440 18441
1459 1 4 . 1 1 71 71 GLN HA H 71 3.699 3.699 3.997 -0.298 18441
1460 1 4 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.539 2.151 18441
1461 1 4 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.747 0.503 18441
1462 1 4 . 1 1 71 71 GLN H H 71 7.732 7.732 8.363 -0.631 18441
1463 1 4 . 1 1 72 72 VAL N N 72 119.182 119.182 119.862 -0.680 18441
1464 1 4 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.575 0.233 18441
1465 1 4 . 1 1 72 72 VAL CA C 72 67.220 67.220 67.341 -0.120 18441
1466 1 4 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.680 0.134 18441
1467 1 4 . 1 1 72 72 VAL H H 72 8.203 8.203 7.730 0.473 18441
1468 1 4 . 1 1 73 73 GLU N N 73 121.878 121.878 119.964 1.914 18441
1469 1 4 . 1 1 73 73 GLU HA H 73 3.978 3.978 3.971 0.007 18441
1470 1 4 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.489 0.611 18441
1471 1 4 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.670 0.990 18441
1472 1 4 . 1 1 73 73 GLU H H 73 8.136 8.136 7.846 0.290 18441
1473 1 4 . 1 1 74 74 TYR N N 74 119.780 119.780 120.722 -0.942 18441
1474 1 4 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.062 -0.385 18441
1475 1 4 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.830 1.480 18441
1476 1 4 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.456 1.564 18441
1477 1 4 . 1 1 74 74 TYR H H 74 8.491 8.491 8.510 -0.019 18441
1478 1 4 . 1 1 75 75 ASP N N 75 120.231 120.231 117.851 2.380 18441
1479 1 4 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.385 -0.242 18441
1480 1 4 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.616 -0.056 18441
1481 1 4 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.953 -0.375 18441
1482 1 4 . 1 1 75 75 ASP H H 75 8.566 8.566 8.311 0.255 18441
1483 1 4 . 1 1 76 76 GLN N N 76 118.324 118.324 116.362 1.962 18441
1484 1 4 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.039 0.017 18441
1485 1 4 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.121 0.309 18441
1486 1 4 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.233 0.197 18441
1487 1 4 . 1 1 76 76 GLN H H 76 7.844 7.844 7.726 0.118 18441
1488 1 4 . 1 1 77 77 LEU N N 77 117.932 117.932 116.910 1.022 18441
1489 1 4 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.096 0.101 18441
1490 1 4 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.052 -0.142 18441
1491 1 4 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.492 2.913 18441
1492 1 4 . 1 1 77 77 LEU H H 77 7.665 7.665 7.487 0.178 18441
1493 1 4 . 1 1 78 78 THR N N 78 110.323 110.323 110.019 0.304 18441
1494 1 4 . 1 1 78 78 THR HA H 78 3.709 3.709 4.607 -0.898 18441
1495 1 4 . 1 1 78 78 THR CA C 78 59.750 59.750 59.300 0.451 18441
1496 1 4 . 1 1 78 78 THR CB C 78 69.110 69.110 69.723 -0.613 18441
1497 1 4 . 1 1 78 78 THR H H 78 7.130 7.130 7.365 -0.235 18441
1498 1 4 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.439 -0.193 18441
1499 1 4 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.032 0.648 18441
1500 1 4 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.453 0.938 18441
1501 1 5 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.938 -0.408 18441
1502 1 5 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.182 2.408 18441
1503 1 5 . 1 1 2 2 ASP CB C 2 41.693 41.693 42.731 -1.038 18441
1504 1 5 . 1 1 3 3 ARG N N 3 121.498 121.498 120.312 1.186 18441
1505 1 5 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.127 0.114 18441
1506 1 5 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.594 -0.924 18441
1507 1 5 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.436 0.074 18441
1508 1 5 . 1 1 3 3 ARG H H 3 8.382 8.382 8.628 -0.246 18441
1509 1 5 . 1 1 4 4 LYS N N 4 122.257 122.257 119.601 2.656 18441
1510 1 5 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.056 0.002 18441
1511 1 5 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.027 0.683 18441
1512 1 5 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.570 1.706 18441
1513 1 5 . 1 1 4 4 LYS H H 4 8.226 8.226 8.239 -0.013 18441
1514 1 5 . 1 1 5 5 VAL N N 5 120.494 120.494 119.004 1.490 18441
1515 1 5 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.807 -0.086 18441
1516 1 5 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.226 1.424 18441
1517 1 5 . 1 1 5 5 VAL CB C 5 32.074 32.074 30.744 1.330 18441
1518 1 5 . 1 1 5 5 VAL H H 5 8.109 8.109 7.970 0.139 18441
1519 1 5 . 1 1 6 6 ALA N N 6 123.149 123.149 122.852 0.297 18441
1520 1 5 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.195 -0.160 18441
1521 1 5 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.344 0.546 18441
1522 1 5 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.307 0.953 18441
1523 1 5 . 1 1 6 6 ALA H H 6 8.374 8.374 7.447 0.927 18441
1524 1 5 . 1 1 7 7 ARG N N 7 119.587 119.587 118.414 1.173 18441
1525 1 5 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.793 0.208 18441
1526 1 5 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.349 0.421 18441
1527 1 5 . 1 1 7 7 ARG CB C 7 30.770 30.770 29.911 0.859 18441
1528 1 5 . 1 1 7 7 ARG H H 7 7.992 7.992 7.677 0.315 18441
1529 1 5 . 1 1 8 8 GLU N N 8 119.745 119.745 119.838 -0.093 18441
1530 1 5 . 1 1 8 8 GLU HA H 8 4.058 4.058 3.903 0.155 18441
1531 1 5 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.489 0.281 18441
1532 1 5 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.824 0.126 18441
1533 1 5 . 1 1 8 8 GLU H H 8 8.165 8.165 7.856 0.309 18441
1534 1 5 . 1 1 9 9 PHE N N 9 121.436 121.436 119.255 2.181 18441
1535 1 5 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.355 -0.228 18441
1536 1 5 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.000 3.020 18441
1537 1 5 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.419 1.204 18441
1538 1 5 . 1 1 9 9 PHE H H 9 8.180 8.180 8.183 -0.003 18441
1539 1 5 . 1 1 10 10 ARG N N 10 119.028 119.028 119.772 -0.744 18441
1540 1 5 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.647 0.214 18441
1541 1 5 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.425 0.155 18441
1542 1 5 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.591 0.729 18441
1543 1 5 . 1 1 10 10 ARG H H 10 7.910 7.910 7.844 0.066 18441
1544 1 5 . 1 1 11 11 HIS N N 11 116.563 116.563 118.065 -1.502 18441
1545 1 5 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.244 0.212 18441
1546 1 5 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.859 0.321 18441
1547 1 5 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.808 0.222 18441
1548 1 5 . 1 1 11 11 HIS H H 11 8.001 8.001 8.134 -0.133 18441
1549 1 5 . 1 1 12 12 LYS N N 12 120.773 120.773 119.401 1.372 18441
1550 1 5 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.136 -0.128 18441
1551 1 5 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.789 0.191 18441
1552 1 5 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.339 0.354 18441
1553 1 5 . 1 1 12 12 LYS H H 12 7.796 7.796 7.802 -0.006 18441
1554 1 5 . 1 1 13 13 VAL N N 13 120.125 120.125 119.386 0.739 18441
1555 1 5 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.612 -0.501 18441
1556 1 5 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.211 0.969 18441
1557 1 5 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.725 0.415 18441
1558 1 5 . 1 1 13 13 VAL H H 13 7.821 7.821 7.306 0.514 18441
1559 1 5 . 1 1 14 14 ASP N N 14 117.462 117.462 119.129 -1.667 18441
1560 1 5 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.295 -0.033 18441
1561 1 5 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.048 0.352 18441
1562 1 5 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.848 0.466 18441
1563 1 5 . 1 1 14 14 ASP H H 14 8.276 8.276 7.819 0.457 18441
1564 1 5 . 1 1 15 15 PHE N N 15 117.914 117.914 119.001 -1.087 18441
1565 1 5 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.222 0.140 18441
1566 1 5 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.429 -0.239 18441
1567 1 5 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.520 1.178 18441
1568 1 5 . 1 1 15 15 PHE H H 15 7.664 7.664 7.668 -0.004 18441
1569 1 5 . 1 1 16 16 LEU N N 16 116.737 116.737 117.469 -0.732 18441
1570 1 5 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.344 -0.110 18441
1571 1 5 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.535 1.885 18441
1572 1 5 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.813 2.265 18441
1573 1 5 . 1 1 16 16 LEU H H 16 7.658 7.658 7.782 -0.124 18441
1574 1 5 . 1 1 17 17 ILE N N 17 120.533 120.533 117.488 3.045 18441
1575 1 5 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.315 -0.207 18441
1576 1 5 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.589 0.951 18441
1577 1 5 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.733 0.624 18441
1578 1 5 . 1 1 17 17 ILE H H 17 8.336 8.336 7.200 1.136 18441
1579 1 5 . 1 1 18 18 GLU N N 18 124.531 124.531 123.162 1.369 18441
1580 1 5 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.025 0.185 18441
1581 1 5 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.293 0.307 18441
1582 1 5 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.451 1.559 18441
1583 1 5 . 1 1 18 18 GLU H H 18 8.276 8.276 8.544 -0.268 18441
1584 1 5 . 1 1 19 19 ASN N N 19 117.630 117.630 118.093 -0.463 18441
1585 1 5 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.611 0.194 18441
1586 1 5 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.755 -0.017 18441
1587 1 5 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.394 1.784 18441
1588 1 5 . 1 1 19 19 ASN H H 19 7.700 7.700 8.122 -0.422 18441
1589 1 5 . 1 1 20 20 ASP N N 20 127.428 127.428 119.718 7.710 18441
1590 1 5 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.712 -0.463 18441
1591 1 5 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.348 2.502 18441
1592 1 5 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.446 -0.132 18441
1593 1 5 . 1 1 20 20 ASP H H 20 8.998 8.998 8.759 0.239 18441
1594 1 5 . 1 1 21 21 ALA N N 21 122.271 122.271 123.136 -0.865 18441
1595 1 5 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.098 0.162 18441
1596 1 5 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.649 0.351 18441
1597 1 5 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.274 0.376 18441
1598 1 5 . 1 1 21 21 ALA H H 21 8.346 8.346 7.761 0.585 18441
1599 1 5 . 1 1 22 22 GLU N N 22 118.716 118.716 118.105 0.611 18441
1600 1 5 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.008 0.106 18441
1601 1 5 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.193 0.167 18441
1602 1 5 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.088 2.683 18441
1603 1 5 . 1 1 22 22 GLU H H 22 7.724 7.724 8.861 -1.137 18441
1604 1 5 . 1 1 23 23 LYS N N 23 121.088 121.088 117.434 3.654 18441
1605 1 5 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.865 -0.054 18441
1606 1 5 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.300 2.370 18441
1607 1 5 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.932 1.138 18441
1608 1 5 . 1 1 23 23 LYS H H 23 7.618 7.618 7.998 -0.380 18441
1609 1 5 . 1 1 24 24 ASP N N 24 119.010 119.010 120.893 -1.883 18441
1610 1 5 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.705 -0.216 18441
1611 1 5 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.256 1.254 18441
1612 1 5 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.681 0.156 18441
1613 1 5 . 1 1 24 24 ASP H H 24 8.424 8.424 7.707 0.717 18441
1614 1 5 . 1 1 25 25 TYR N N 25 120.417 120.417 120.375 0.042 18441
1615 1 5 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.221 0.022 18441
1616 1 5 . 1 1 25 25 TYR CA C 25 62.190 62.190 60.961 1.229 18441
1617 1 5 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.596 -0.097 18441
1618 1 5 . 1 1 25 25 TYR H H 25 7.676 7.676 8.245 -0.569 18441
1619 1 5 . 1 1 26 26 LEU N N 26 120.960 120.960 121.078 -0.118 18441
1620 1 5 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.823 -0.222 18441
1621 1 5 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.556 0.884 18441
1622 1 5 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.794 0.357 18441
1623 1 5 . 1 1 26 26 LEU H H 26 7.965 7.965 7.984 -0.019 18441
1624 1 5 . 1 1 27 27 TYR N N 27 116.521 116.521 118.030 -1.509 18441
1625 1 5 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.083 -0.307 18441
1626 1 5 . 1 1 27 27 TYR CA C 27 64.410 64.410 60.669 3.741 18441
1627 1 5 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.425 0.978 18441
1628 1 5 . 1 1 27 27 TYR H H 27 8.097 8.097 8.405 -0.308 18441
1629 1 5 . 1 1 28 28 ASP N N 28 123.384 123.384 119.531 3.853 18441
1630 1 5 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.512 -0.036 18441
1631 1 5 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.337 1.203 18441
1632 1 5 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.711 0.683 18441
1633 1 5 . 1 1 28 28 ASP H H 28 8.355 8.355 7.876 0.479 18441
1634 1 5 . 1 1 29 29 VAL N N 29 121.272 121.272 120.638 0.634 18441
1635 1 5 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.564 0.149 18441
1636 1 5 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.984 -0.334 18441
1637 1 5 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.606 0.312 18441
1638 1 5 . 1 1 29 29 VAL H H 29 8.252 8.252 8.101 0.151 18441
1639 1 5 . 1 1 30 30 LEU N N 30 122.443 122.443 119.683 2.760 18441
1640 1 5 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.074 -0.031 18441
1641 1 5 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.296 0.584 18441
1642 1 5 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.550 0.730 18441
1643 1 5 . 1 1 30 30 LEU H H 30 7.987 7.987 8.480 -0.493 18441
1644 1 5 . 1 1 31 31 ARG N N 31 122.386 122.386 118.868 3.518 18441
1645 1 5 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.065 -0.049 18441
1646 1 5 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.560 0.820 18441
1647 1 5 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.211 0.189 18441
1648 1 5 . 1 1 31 31 ARG H H 31 8.637 8.637 8.021 0.616 18441
1649 1 5 . 1 1 32 32 MET N N 32 120.006 120.006 119.520 0.486 18441
1650 1 5 . 1 1 32 32 MET HA H 32 4.359 4.359 4.179 0.179 18441
1651 1 5 . 1 1 32 32 MET CA C 32 58.490 58.490 58.249 0.241 18441
1652 1 5 . 1 1 32 32 MET CB C 32 31.677 31.677 32.210 -0.533 18441
1653 1 5 . 1 1 32 32 MET H H 32 8.327 8.327 8.520 -0.193 18441
1654 1 5 . 1 1 33 33 TYR N N 33 123.220 123.220 121.113 2.107 18441
1655 1 5 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.182 0.542 18441
1656 1 5 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.268 0.732 18441
1657 1 5 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.711 1.976 18441
1658 1 5 . 1 1 33 33 TYR H H 33 8.054 8.054 8.841 -0.787 18441
1659 1 5 . 1 1 34 34 HIS N N 34 120.860 120.860 117.566 3.294 18441
1660 1 5 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.111 -0.335 18441
1661 1 5 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.100 1.610 18441
1662 1 5 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.183 1.209 18441
1663 1 5 . 1 1 34 34 HIS H H 34 8.548 8.548 7.949 0.599 18441
1664 1 5 . 1 1 35 35 GLN N N 35 113.582 113.582 118.737 -5.155 18441
1665 1 5 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.156 -0.156 18441
1666 1 5 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.404 0.276 18441
1667 1 5 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.697 0.853 18441
1668 1 5 . 1 1 35 35 GLN H H 35 7.542 7.542 8.320 -0.778 18441
1669 1 5 . 1 1 36 36 THR N N 36 111.117 111.117 108.650 2.467 18441
1670 1 5 . 1 1 36 36 THR HA H 36 4.214 4.214 4.289 -0.075 18441
1671 1 5 . 1 1 36 36 THR CA C 36 63.980 63.980 62.748 1.232 18441
1672 1 5 . 1 1 36 36 THR CB C 36 71.670 71.670 69.614 2.056 18441
1673 1 5 . 1 1 36 36 THR H H 36 8.569 8.569 8.410 0.159 18441
1674 1 5 . 1 1 37 37 MET N N 37 120.444 120.444 116.737 3.707 18441
1675 1 5 . 1 1 37 37 MET HA H 37 3.740 3.740 4.229 -0.489 18441
1676 1 5 . 1 1 37 37 MET CA C 37 56.430 56.430 56.494 -0.064 18441
1677 1 5 . 1 1 37 37 MET CB C 37 31.399 31.399 30.246 1.153 18441
1678 1 5 . 1 1 37 37 MET H H 37 9.542 9.542 7.610 1.932 18441
1679 1 5 . 1 1 38 38 ASP N N 38 117.020 117.020 120.866 -3.846 18441
1680 1 5 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.825 0.119 18441
1681 1 5 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.325 0.151 18441
1682 1 5 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.508 -0.468 18441
1683 1 5 . 1 1 38 38 ASP H H 38 7.456 7.456 7.645 -0.189 18441
1684 1 5 . 1 1 39 39 VAL N N 39 128.507 128.507 125.936 2.571 18441
1685 1 5 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.556 0.275 18441
1686 1 5 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.095 0.745 18441
1687 1 5 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.488 1.212 18441
1688 1 5 . 1 1 39 39 VAL H H 39 8.425 8.425 8.709 -0.284 18441
1689 1 5 . 1 1 40 40 ALA N N 40 125.621 125.621 122.356 3.265 18441
1690 1 5 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.010 -0.023 18441
1691 1 5 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.013 0.847 18441
1692 1 5 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.341 0.129 18441
1693 1 5 . 1 1 40 40 ALA H H 40 7.998 7.998 7.676 0.322 18441
1694 1 5 . 1 1 41 41 VAL N N 41 122.132 122.132 118.982 3.150 18441
1695 1 5 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.719 -0.148 18441
1696 1 5 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.645 0.035 18441
1697 1 5 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.855 0.847 18441
1698 1 5 . 1 1 41 41 VAL H H 41 7.663 7.663 7.601 0.062 18441
1699 1 5 . 1 1 42 42 LEU N N 42 120.190 120.190 118.734 1.456 18441
1700 1 5 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.063 0.197 18441
1701 1 5 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.357 0.633 18441
1702 1 5 . 1 1 42 42 LEU CB C 42 40.705 40.705 40.862 -0.157 18441
1703 1 5 . 1 1 42 42 LEU H H 42 7.361 7.361 7.288 0.073 18441
1704 1 5 . 1 1 43 43 VAL N N 43 116.802 116.802 119.334 -2.532 18441
1705 1 5 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.522 -0.105 18441
1706 1 5 . 1 1 43 43 VAL CA C 43 68.780 68.780 65.727 3.054 18441
1707 1 5 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.394 1.586 18441
1708 1 5 . 1 1 43 43 VAL H H 43 8.062 8.062 7.661 0.401 18441
1709 1 5 . 1 1 44 44 GLY N N 44 106.242 106.242 108.544 -2.302 18441
1710 1 5 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.340 0.976 18441
1711 1 5 . 1 1 44 44 GLY H H 44 7.901 7.901 7.964 -0.063 18441
1712 1 5 . 1 1 45 45 ASP N N 45 123.359 123.359 123.214 0.145 18441
1713 1 5 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.544 0.121 18441
1714 1 5 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.408 0.352 18441
1715 1 5 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.459 0.409 18441
1716 1 5 . 1 1 45 45 ASP H H 45 8.680 8.680 7.768 0.912 18441
1717 1 5 . 1 1 46 46 LEU N N 46 123.201 123.201 120.281 2.920 18441
1718 1 5 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.907 0.159 18441
1719 1 5 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.177 -0.057 18441
1720 1 5 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.920 1.079 18441
1721 1 5 . 1 1 46 46 LEU H H 46 9.018 9.018 8.493 0.525 18441
1722 1 5 . 1 1 47 47 LYS N N 47 119.196 119.196 119.391 -0.195 18441
1723 1 5 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.991 -0.021 18441
1724 1 5 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.910 0.380 18441
1725 1 5 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.052 1.089 18441
1726 1 5 . 1 1 47 47 LYS H H 47 8.017 8.017 7.787 0.230 18441
1727 1 5 . 1 1 48 48 LEU N N 48 116.358 116.358 118.970 -2.612 18441
1728 1 5 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.085 0.076 18441
1729 1 5 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.661 0.009 18441
1730 1 5 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.265 -0.105 18441
1731 1 5 . 1 1 48 48 LEU H H 48 7.143 7.143 7.498 -0.355 18441
1732 1 5 . 1 1 49 49 VAL N N 49 112.662 112.662 115.368 -2.706 18441
1733 1 5 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.183 0.290 18441
1734 1 5 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.566 -0.506 18441
1735 1 5 . 1 1 49 49 VAL CB C 49 35.166 35.166 33.061 2.105 18441
1736 1 5 . 1 1 49 49 VAL H H 49 7.266 7.266 7.669 -0.403 18441
1737 1 5 . 1 1 50 50 ILE N N 50 124.631 124.631 119.058 5.573 18441
1738 1 5 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.342 -0.497 18441
1739 1 5 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.607 0.983 18441
1740 1 5 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.981 -3.820 18441
1741 1 5 . 1 1 50 50 ILE H H 50 8.475 8.475 7.586 0.889 18441
1742 1 5 . 1 1 51 51 ASN N N 51 119.027 119.027 118.805 0.222 18441
1743 1 5 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.558 0.149 18441
1744 1 5 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.304 0.144 18441
1745 1 5 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.221 0.740 18441
1746 1 5 . 1 1 51 51 ASN H H 51 7.347 7.347 8.109 -0.762 18441
1747 1 5 . 1 1 52 52 GLU N N 52 115.889 115.889 118.654 -2.765 18441
1748 1 5 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.744 0.144 18441
1749 1 5 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.902 1.883 18441
1750 1 5 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.060 -0.040 18441
1751 1 5 . 1 1 52 52 GLU H H 52 7.438 7.438 7.616 -0.178 18441
1752 1 5 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.189 0.021 18441
1753 1 5 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.230 1.730 18441
1754 1 5 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.832 1.116 18441
1755 1 5 . 1 1 54 54 SER N N 54 113.711 113.711 111.774 1.937 18441
1756 1 5 . 1 1 54 54 SER HA H 54 4.173 4.173 4.338 -0.165 18441
1757 1 5 . 1 1 54 54 SER CA C 54 61.650 61.650 60.152 1.498 18441
1758 1 5 . 1 1 54 54 SER CB C 54 62.930 62.930 63.214 -0.284 18441
1759 1 5 . 1 1 54 54 SER H H 54 8.946 8.946 8.111 0.835 18441
1760 1 5 . 1 1 55 55 ARG N N 55 116.455 116.455 120.023 -3.568 18441
1761 1 5 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.447 -0.043 18441
1762 1 5 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.807 0.503 18441
1763 1 5 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.553 3.059 18441
1764 1 5 . 1 1 55 55 ARG H H 55 7.759 7.759 7.703 0.056 18441
1765 1 5 . 1 1 56 56 LEU N N 56 121.468 121.468 123.270 -1.802 18441
1766 1 5 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.252 -0.117 18441
1767 1 5 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.947 -0.047 18441
1768 1 5 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.579 1.418 18441
1769 1 5 . 1 1 56 56 LEU H H 56 7.472 7.472 8.466 -0.994 18441
1770 1 5 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.204 0.492 18441
1771 1 5 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.194 -0.014 18441
1772 1 5 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.144 1.246 18441
1773 1 5 . 1 1 58 58 LEU N N 58 119.923 119.923 117.404 2.519 18441
1774 1 5 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.177 -0.127 18441
1775 1 5 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.630 0.690 18441
1776 1 5 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.627 0.401 18441
1777 1 5 . 1 1 58 58 LEU H H 58 8.734 8.734 7.624 1.110 18441
1778 1 5 . 1 1 59 59 PHE N N 59 116.632 116.632 120.948 -4.316 18441
1779 1 5 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.288 0.191 18441
1780 1 5 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.933 1.147 18441
1781 1 5 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.373 -0.521 18441
1782 1 5 . 1 1 59 59 PHE H H 59 8.312 8.312 8.745 -0.433 18441
1783 1 5 . 1 1 60 60 ASP N N 60 120.603 120.603 119.247 1.356 18441
1784 1 5 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.405 0.266 18441
1785 1 5 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.758 1.112 18441
1786 1 5 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.030 0.511 18441
1787 1 5 . 1 1 60 60 ASP H H 60 7.462 7.462 7.852 -0.390 18441
1788 1 5 . 1 1 61 61 ALA N N 61 122.470 122.470 122.551 -0.081 18441
1789 1 5 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.968 0.293 18441
1790 1 5 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.474 0.072 18441
1791 1 5 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.390 0.490 18441
1792 1 5 . 1 1 61 61 ALA H H 61 7.664 7.664 7.412 0.252 18441
1793 1 5 . 1 1 62 62 ILE N N 62 115.525 115.525 118.032 -2.507 18441
1794 1 5 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.032 0.650 18441
1795 1 5 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.634 -0.214 18441
1796 1 5 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.948 2.207 18441
1797 1 5 . 1 1 62 62 ILE H H 62 7.653 7.653 7.540 0.113 18441
1798 1 5 . 1 1 63 63 ARG N N 63 121.016 121.016 119.909 1.107 18441
1799 1 5 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.386 0.088 18441
1800 1 5 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.594 0.776 18441
1801 1 5 . 1 1 63 63 ARG H H 63 6.917 6.917 7.252 -0.335 18441
1802 1 5 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.089 0.222 18441
1803 1 5 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.583 0.157 18441
1804 1 5 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.015 1.172 18441
1805 1 5 . 1 1 65 65 LEU N N 65 114.713 114.713 115.746 -1.033 18441
1806 1 5 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.048 -0.128 18441
1807 1 5 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.040 -0.380 18441
1808 1 5 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.835 0.273 18441
1809 1 5 . 1 1 65 65 LEU H H 65 8.074 8.074 7.426 0.648 18441
1810 1 5 . 1 1 66 66 ILE N N 66 120.129 120.129 119.065 1.064 18441
1811 1 5 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.131 0.174 18441
1812 1 5 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.600 -4.840 18441
1813 1 5 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.283 -0.639 18441
1814 1 5 . 1 1 66 66 ILE H H 66 7.398 7.398 7.505 -0.107 18441
1815 1 5 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.351 -0.046 18441
1816 1 5 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.568 1.072 18441
1817 1 5 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.460 0.829 18441
1818 1 5 . 1 1 68 68 LEU N N 68 124.673 124.673 123.180 1.493 18441
1819 1 5 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.957 -0.107 18441
1820 1 5 . 1 1 68 68 LEU CA C 68 59.620 59.620 58.989 0.631 18441
1821 1 5 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.434 1.033 18441
1822 1 5 . 1 1 68 68 LEU H H 68 8.471 8.471 8.406 0.065 18441
1823 1 5 . 1 1 69 69 LYS N N 69 115.247 115.247 118.766 -3.519 18441
1824 1 5 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.021 0.148 18441
1825 1 5 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.136 -0.116 18441
1826 1 5 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.511 0.995 18441
1827 1 5 . 1 1 69 69 LYS H H 69 8.536 8.536 8.415 0.121 18441
1828 1 5 . 1 1 70 70 HIS N N 70 118.849 118.849 118.415 0.434 18441
1829 1 5 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.419 0.806 18441
1830 1 5 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.191 -3.302 18441
1831 1 5 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.492 5.546 18441
1832 1 5 . 1 1 70 70 HIS H H 70 8.060 8.060 8.247 -0.187 18441
1833 1 5 . 1 1 71 71 GLN N N 71 122.130 122.130 120.077 2.053 18441
1834 1 5 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.086 -0.387 18441
1835 1 5 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.021 2.669 18441
1836 1 5 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.351 0.899 18441
1837 1 5 . 1 1 71 71 GLN H H 71 7.732 7.732 8.379 -0.647 18441
1838 1 5 . 1 1 72 72 VAL N N 72 119.182 119.182 120.533 -1.351 18441
1839 1 5 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.688 0.120 18441
1840 1 5 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.097 1.123 18441
1841 1 5 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.789 0.025 18441
1842 1 5 . 1 1 72 72 VAL H H 72 8.203 8.203 7.864 0.339 18441
1843 1 5 . 1 1 73 73 GLU N N 73 121.878 121.878 119.868 2.010 18441
1844 1 5 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.044 -0.066 18441
1845 1 5 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.461 0.639 18441
1846 1 5 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.682 0.978 18441
1847 1 5 . 1 1 73 73 GLU H H 73 8.136 8.136 7.824 0.312 18441
1848 1 5 . 1 1 74 74 TYR N N 74 119.780 119.780 121.571 -1.791 18441
1849 1 5 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.108 -0.431 18441
1850 1 5 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.438 1.872 18441
1851 1 5 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.285 1.735 18441
1852 1 5 . 1 1 74 74 TYR H H 74 8.491 8.491 8.555 -0.064 18441
1853 1 5 . 1 1 75 75 ASP N N 75 120.231 120.231 118.013 2.218 18441
1854 1 5 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.565 -0.422 18441
1855 1 5 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.500 1.060 18441
1856 1 5 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.793 -0.215 18441
1857 1 5 . 1 1 75 75 ASP H H 75 8.566 8.566 8.157 0.409 18441
1858 1 5 . 1 1 76 76 GLN N N 76 118.324 118.324 117.779 0.545 18441
1859 1 5 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.078 -0.022 18441
1860 1 5 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.367 0.063 18441
1861 1 5 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.230 0.200 18441
1862 1 5 . 1 1 76 76 GLN H H 76 7.844 7.844 7.781 0.063 18441
1863 1 5 . 1 1 77 77 LEU N N 77 117.932 117.932 115.758 2.174 18441
1864 1 5 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.206 -0.009 18441
1865 1 5 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.778 0.133 18441
1866 1 5 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.303 3.101 18441
1867 1 5 . 1 1 77 77 LEU H H 77 7.665 7.665 7.611 0.054 18441
1868 1 5 . 1 1 78 78 THR N N 78 110.323 110.323 114.014 -3.691 18441
1869 1 5 . 1 1 78 78 THR HA H 78 3.709 3.709 4.344 -0.635 18441
1870 1 5 . 1 1 78 78 THR CA C 78 59.750 59.750 59.690 0.060 18441
1871 1 5 . 1 1 78 78 THR CB C 78 69.110 69.110 68.988 0.122 18441
1872 1 5 . 1 1 78 78 THR H H 78 7.130 7.130 7.449 -0.319 18441
1873 1 5 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.387 -0.141 18441
1874 1 5 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.882 -0.202 18441
1875 1 5 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.168 0.223 18441
1876 1 6 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.793 -0.263 18441
1877 1 6 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.505 1.085 18441
1878 1 6 . 1 1 2 2 ASP CB C 2 41.693 41.693 42.985 -1.292 18441
1879 1 6 . 1 1 3 3 ARG N N 3 121.498 121.498 121.687 -0.189 18441
1880 1 6 . 1 1 3 3 ARG HA H 3 4.241 4.241 3.901 0.340 18441
1881 1 6 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.301 -0.631 18441
1882 1 6 . 1 1 3 3 ARG CB C 3 30.510 30.510 29.236 1.274 18441
1883 1 6 . 1 1 3 3 ARG H H 3 8.382 8.382 8.730 -0.348 18441
1884 1 6 . 1 1 4 4 LYS N N 4 122.257 122.257 120.647 1.610 18441
1885 1 6 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.081 -0.023 18441
1886 1 6 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.473 0.237 18441
1887 1 6 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.574 0.702 18441
1888 1 6 . 1 1 4 4 LYS H H 4 8.226 8.226 8.029 0.197 18441
1889 1 6 . 1 1 5 5 VAL N N 5 120.494 120.494 118.047 2.447 18441
1890 1 6 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.743 -0.022 18441
1891 1 6 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.571 1.079 18441
1892 1 6 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.539 0.535 18441
1893 1 6 . 1 1 5 5 VAL H H 5 8.109 8.109 8.121 -0.012 18441
1894 1 6 . 1 1 6 6 ALA N N 6 123.149 123.149 123.123 0.026 18441
1895 1 6 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.313 -0.278 18441
1896 1 6 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.168 0.722 18441
1897 1 6 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.304 0.956 18441
1898 1 6 . 1 1 6 6 ALA H H 6 8.374 8.374 7.720 0.654 18441
1899 1 6 . 1 1 7 7 ARG N N 7 119.587 119.587 118.840 0.747 18441
1900 1 6 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.955 0.046 18441
1901 1 6 . 1 1 7 7 ARG CA C 7 59.770 59.770 58.509 1.261 18441
1902 1 6 . 1 1 7 7 ARG CB C 7 30.770 30.770 29.851 0.919 18441
1903 1 6 . 1 1 7 7 ARG H H 7 7.992 7.992 7.889 0.103 18441
1904 1 6 . 1 1 8 8 GLU N N 8 119.745 119.745 120.111 -0.366 18441
1905 1 6 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.111 -0.053 18441
1906 1 6 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.727 0.043 18441
1907 1 6 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.877 0.073 18441
1908 1 6 . 1 1 8 8 GLU H H 8 8.165 8.165 8.328 -0.163 18441
1909 1 6 . 1 1 9 9 PHE N N 9 121.436 121.436 119.812 1.624 18441
1910 1 6 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.314 -0.187 18441
1911 1 6 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.075 2.945 18441
1912 1 6 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.373 1.250 18441
1913 1 6 . 1 1 9 9 PHE H H 9 8.180 8.180 8.427 -0.247 18441
1914 1 6 . 1 1 10 10 ARG N N 10 119.028 119.028 119.561 -0.533 18441
1915 1 6 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.534 0.327 18441
1916 1 6 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.448 1.132 18441
1917 1 6 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.071 1.249 18441
1918 1 6 . 1 1 10 10 ARG H H 10 7.910 7.910 7.930 -0.020 18441
1919 1 6 . 1 1 11 11 HIS N N 11 116.563 116.563 118.427 -1.864 18441
1920 1 6 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.226 0.230 18441
1921 1 6 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.023 0.157 18441
1922 1 6 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.948 0.082 18441
1923 1 6 . 1 1 11 11 HIS H H 11 8.001 8.001 8.156 -0.155 18441
1924 1 6 . 1 1 12 12 LYS N N 12 120.773 120.773 119.257 1.516 18441
1925 1 6 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.054 -0.046 18441
1926 1 6 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.677 0.303 18441
1927 1 6 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.426 0.267 18441
1928 1 6 . 1 1 12 12 LYS H H 12 7.796 7.796 7.772 0.024 18441
1929 1 6 . 1 1 13 13 VAL N N 13 120.125 120.125 120.255 -0.130 18441
1930 1 6 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.677 -0.566 18441
1931 1 6 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.158 1.022 18441
1932 1 6 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.496 0.644 18441
1933 1 6 . 1 1 13 13 VAL H H 13 7.821 7.821 7.912 -0.091 18441
1934 1 6 . 1 1 14 14 ASP N N 14 117.462 117.462 119.421 -1.959 18441
1935 1 6 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.371 -0.109 18441
1936 1 6 . 1 1 14 14 ASP CA C 14 57.400 57.400 56.984 0.416 18441
1937 1 6 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.789 0.525 18441
1938 1 6 . 1 1 14 14 ASP H H 14 8.276 8.276 7.857 0.419 18441
1939 1 6 . 1 1 15 15 PHE N N 15 117.914 117.914 118.367 -0.453 18441
1940 1 6 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.331 0.031 18441
1941 1 6 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.372 -0.182 18441
1942 1 6 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.491 1.207 18441
1943 1 6 . 1 1 15 15 PHE H H 15 7.664 7.664 7.791 -0.127 18441
1944 1 6 . 1 1 16 16 LEU N N 16 116.737 116.737 116.666 0.071 18441
1945 1 6 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.128 0.106 18441
1946 1 6 . 1 1 16 16 LEU CA C 16 56.420 56.420 55.054 1.366 18441
1947 1 6 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.643 2.435 18441
1948 1 6 . 1 1 16 16 LEU H H 16 7.658 7.658 7.678 -0.020 18441
1949 1 6 . 1 1 17 17 ILE N N 17 120.533 120.533 116.574 3.959 18441
1950 1 6 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.270 -0.162 18441
1951 1 6 . 1 1 17 17 ILE CA C 17 60.540 60.540 60.412 0.128 18441
1952 1 6 . 1 1 17 17 ILE CB C 17 38.357 38.357 38.842 -0.485 18441
1953 1 6 . 1 1 17 17 ILE H H 17 8.336 8.336 7.399 0.937 18441
1954 1 6 . 1 1 18 18 GLU N N 18 124.531 124.531 121.869 2.662 18441
1955 1 6 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.218 -0.008 18441
1956 1 6 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.514 0.086 18441
1957 1 6 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.434 1.576 18441
1958 1 6 . 1 1 18 18 GLU H H 18 8.276 8.276 8.714 -0.438 18441
1959 1 6 . 1 1 19 19 ASN N N 19 117.630 117.630 116.424 1.206 18441
1960 1 6 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.596 0.209 18441
1961 1 6 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.872 -1.134 18441
1962 1 6 . 1 1 19 19 ASN CB C 19 41.178 41.178 38.470 2.708 18441
1963 1 6 . 1 1 19 19 ASN H H 19 7.700 7.700 7.965 -0.265 18441
1964 1 6 . 1 1 20 20 ASP N N 20 127.428 127.428 117.790 9.638 18441
1965 1 6 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.189 0.060 18441
1966 1 6 . 1 1 20 20 ASP CA C 20 58.850 58.850 57.172 1.678 18441
1967 1 6 . 1 1 20 20 ASP CB C 20 41.314 41.314 39.372 1.942 18441
1968 1 6 . 1 1 20 20 ASP H H 20 8.998 8.998 7.907 1.091 18441
1969 1 6 . 1 1 21 21 ALA N N 21 122.271 122.271 121.895 0.376 18441
1970 1 6 . 1 1 21 21 ALA HA H 21 4.260 4.260 3.956 0.304 18441
1971 1 6 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.369 0.631 18441
1972 1 6 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.440 0.210 18441
1973 1 6 . 1 1 21 21 ALA H H 21 8.346 8.346 7.975 0.371 18441
1974 1 6 . 1 1 22 22 GLU N N 22 118.716 118.716 117.609 1.107 18441
1975 1 6 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.991 0.123 18441
1976 1 6 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.796 0.564 18441
1977 1 6 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.078 2.694 18441
1978 1 6 . 1 1 22 22 GLU H H 22 7.724 7.724 8.868 -1.144 18441
1979 1 6 . 1 1 23 23 LYS N N 23 121.088 121.088 118.053 3.035 18441
1980 1 6 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.802 0.009 18441
1981 1 6 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.983 2.687 18441
1982 1 6 . 1 1 23 23 LYS CB C 23 33.070 33.070 32.033 1.037 18441
1983 1 6 . 1 1 23 23 LYS H H 23 7.618 7.618 7.433 0.185 18441
1984 1 6 . 1 1 24 24 ASP N N 24 119.010 119.010 120.554 -1.544 18441
1985 1 6 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.463 0.026 18441
1986 1 6 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.573 0.937 18441
1987 1 6 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.905 -0.068 18441
1988 1 6 . 1 1 24 24 ASP H H 24 8.424 8.424 7.930 0.494 18441
1989 1 6 . 1 1 25 25 TYR N N 25 120.417 120.417 121.413 -0.996 18441
1990 1 6 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.236 0.007 18441
1991 1 6 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.203 0.987 18441
1992 1 6 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.623 -0.124 18441
1993 1 6 . 1 1 25 25 TYR H H 25 7.676 7.676 8.093 -0.417 18441
1994 1 6 . 1 1 26 26 LEU N N 26 120.960 120.960 120.354 0.606 18441
1995 1 6 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.914 -0.313 18441
1996 1 6 . 1 1 26 26 LEU CA C 26 59.440 59.440 57.639 1.800 18441
1997 1 6 . 1 1 26 26 LEU CB C 26 42.151 42.151 40.930 1.221 18441
1998 1 6 . 1 1 26 26 LEU H H 26 7.965 7.965 7.820 0.145 18441
1999 1 6 . 1 1 27 27 TYR N N 27 116.521 116.521 118.453 -1.932 18441
2000 1 6 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.123 -0.347 18441
2001 1 6 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.944 4.466 18441
2002 1 6 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.148 1.255 18441
2003 1 6 . 1 1 27 27 TYR H H 27 8.097 8.097 7.976 0.121 18441
2004 1 6 . 1 1 28 28 ASP N N 28 123.384 123.384 119.884 3.500 18441
2005 1 6 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.398 0.078 18441
2006 1 6 . 1 1 28 28 ASP CA C 28 58.540 58.540 58.104 0.436 18441
2007 1 6 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.732 0.662 18441
2008 1 6 . 1 1 28 28 ASP H H 28 8.355 8.355 7.907 0.448 18441
2009 1 6 . 1 1 29 29 VAL N N 29 121.272 121.272 120.360 0.912 18441
2010 1 6 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.684 0.029 18441
2011 1 6 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.346 0.304 18441
2012 1 6 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.646 0.272 18441
2013 1 6 . 1 1 29 29 VAL H H 29 8.252 8.252 8.087 0.165 18441
2014 1 6 . 1 1 30 30 LEU N N 30 122.443 122.443 120.479 1.964 18441
2015 1 6 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.099 -0.056 18441
2016 1 6 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.399 0.481 18441
2017 1 6 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.609 0.672 18441
2018 1 6 . 1 1 30 30 LEU H H 30 7.987 7.987 8.195 -0.208 18441
2019 1 6 . 1 1 31 31 ARG N N 31 122.386 122.386 118.442 3.944 18441
2020 1 6 . 1 1 31 31 ARG HA H 31 4.016 4.016 3.978 0.038 18441
2021 1 6 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.862 0.518 18441
2022 1 6 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.292 0.108 18441
2023 1 6 . 1 1 31 31 ARG H H 31 8.637 8.637 8.286 0.351 18441
2024 1 6 . 1 1 32 32 MET N N 32 120.006 120.006 119.874 0.132 18441
2025 1 6 . 1 1 32 32 MET HA H 32 4.359 4.359 4.152 0.207 18441
2026 1 6 . 1 1 32 32 MET CA C 32 58.490 58.490 59.120 -0.630 18441
2027 1 6 . 1 1 32 32 MET CB C 32 31.677 31.677 32.383 -0.706 18441
2028 1 6 . 1 1 32 32 MET H H 32 8.327 8.327 7.972 0.355 18441
2029 1 6 . 1 1 33 33 TYR N N 33 123.220 123.220 120.659 2.561 18441
2030 1 6 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.273 0.451 18441
2031 1 6 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.017 0.983 18441
2032 1 6 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.737 1.950 18441
2033 1 6 . 1 1 33 33 TYR H H 33 8.054 8.054 8.133 -0.079 18441
2034 1 6 . 1 1 34 34 HIS N N 34 120.860 120.860 118.026 2.834 18441
2035 1 6 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.106 -0.330 18441
2036 1 6 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.244 1.466 18441
2037 1 6 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.193 1.199 18441
2038 1 6 . 1 1 34 34 HIS H H 34 8.548 8.548 7.915 0.633 18441
2039 1 6 . 1 1 35 35 GLN N N 35 113.582 113.582 118.895 -5.313 18441
2040 1 6 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.283 -0.283 18441
2041 1 6 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.342 0.338 18441
2042 1 6 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.601 0.949 18441
2043 1 6 . 1 1 35 35 GLN H H 35 7.542 7.542 8.318 -0.776 18441
2044 1 6 . 1 1 36 36 THR N N 36 111.117 111.117 108.640 2.477 18441
2045 1 6 . 1 1 36 36 THR HA H 36 4.214 4.214 4.247 -0.033 18441
2046 1 6 . 1 1 36 36 THR CA C 36 63.980 63.980 62.765 1.215 18441
2047 1 6 . 1 1 36 36 THR CB C 36 71.670 71.670 69.956 1.714 18441
2048 1 6 . 1 1 36 36 THR H H 36 8.569 8.569 8.432 0.137 18441
2049 1 6 . 1 1 37 37 MET N N 37 120.444 120.444 117.407 3.037 18441
2050 1 6 . 1 1 37 37 MET HA H 37 3.740 3.740 4.213 -0.473 18441
2051 1 6 . 1 1 37 37 MET CA C 37 56.430 56.430 56.132 0.298 18441
2052 1 6 . 1 1 37 37 MET CB C 37 31.399 31.399 30.216 1.183 18441
2053 1 6 . 1 1 37 37 MET H H 37 9.542 9.542 7.582 1.960 18441
2054 1 6 . 1 1 38 38 ASP N N 38 117.020 117.020 121.445 -4.425 18441
2055 1 6 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.819 0.125 18441
2056 1 6 . 1 1 38 38 ASP CA C 38 53.476 53.476 54.281 -0.805 18441
2057 1 6 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.146 -0.106 18441
2058 1 6 . 1 1 38 38 ASP H H 38 7.456 7.456 7.699 -0.243 18441
2059 1 6 . 1 1 39 39 VAL N N 39 128.507 128.507 124.294 4.213 18441
2060 1 6 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.603 0.228 18441
2061 1 6 . 1 1 39 39 VAL CA C 39 64.840 64.840 63.629 1.211 18441
2062 1 6 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.212 1.488 18441
2063 1 6 . 1 1 39 39 VAL H H 39 8.425 8.425 8.666 -0.241 18441
2064 1 6 . 1 1 40 40 ALA N N 40 125.621 125.621 122.730 2.891 18441
2065 1 6 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.057 -0.070 18441
2066 1 6 . 1 1 40 40 ALA CA C 40 55.860 55.860 54.893 0.967 18441
2067 1 6 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.290 0.180 18441
2068 1 6 . 1 1 40 40 ALA H H 40 7.998 7.998 8.306 -0.308 18441
2069 1 6 . 1 1 41 41 VAL N N 41 122.132 122.132 118.299 3.833 18441
2070 1 6 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.705 -0.135 18441
2071 1 6 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.975 0.705 18441
2072 1 6 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.829 0.873 18441
2073 1 6 . 1 1 41 41 VAL H H 41 7.663 7.663 7.622 0.041 18441
2074 1 6 . 1 1 42 42 LEU N N 42 120.190 120.190 119.077 1.113 18441
2075 1 6 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.228 0.032 18441
2076 1 6 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.153 0.838 18441
2077 1 6 . 1 1 42 42 LEU CB C 42 40.705 40.705 40.973 -0.268 18441
2078 1 6 . 1 1 42 42 LEU H H 42 7.361 7.361 7.258 0.103 18441
2079 1 6 . 1 1 43 43 VAL N N 43 116.802 116.802 120.199 -3.397 18441
2080 1 6 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.544 -0.127 18441
2081 1 6 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.652 2.128 18441
2082 1 6 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.661 1.319 18441
2083 1 6 . 1 1 43 43 VAL H H 43 8.062 8.062 7.764 0.298 18441
2084 1 6 . 1 1 44 44 GLY N N 44 106.242 106.242 107.494 -1.252 18441
2085 1 6 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.448 0.868 18441
2086 1 6 . 1 1 44 44 GLY H H 44 7.901 7.901 7.873 0.028 18441
2087 1 6 . 1 1 45 45 ASP N N 45 123.359 123.359 123.188 0.171 18441
2088 1 6 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.564 0.101 18441
2089 1 6 . 1 1 45 45 ASP CA C 45 57.760 57.760 56.991 0.769 18441
2090 1 6 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.358 0.510 18441
2091 1 6 . 1 1 45 45 ASP H H 45 8.680 8.680 7.877 0.803 18441
2092 1 6 . 1 1 46 46 LEU N N 46 123.201 123.201 121.041 2.160 18441
2093 1 6 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.947 0.119 18441
2094 1 6 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.187 -0.067 18441
2095 1 6 . 1 1 46 46 LEU CB C 46 42.999 42.999 42.039 0.960 18441
2096 1 6 . 1 1 46 46 LEU H H 46 9.018 9.018 8.434 0.584 18441
2097 1 6 . 1 1 47 47 LYS N N 47 119.196 119.196 118.624 0.572 18441
2098 1 6 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.044 -0.074 18441
2099 1 6 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.690 0.600 18441
2100 1 6 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.120 1.021 18441
2101 1 6 . 1 1 47 47 LYS H H 47 8.017 8.017 7.748 0.269 18441
2102 1 6 . 1 1 48 48 LEU N N 48 116.358 116.358 120.369 -4.011 18441
2103 1 6 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.019 0.142 18441
2104 1 6 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.897 -0.227 18441
2105 1 6 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.300 -0.140 18441
2106 1 6 . 1 1 48 48 LEU H H 48 7.143 7.143 7.578 -0.435 18441
2107 1 6 . 1 1 49 49 VAL N N 49 112.662 112.662 114.556 -1.894 18441
2108 1 6 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.067 0.406 18441
2109 1 6 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.416 -0.356 18441
2110 1 6 . 1 1 49 49 VAL CB C 49 35.166 35.166 31.748 3.418 18441
2111 1 6 . 1 1 49 49 VAL H H 49 7.266 7.266 7.575 -0.309 18441
2112 1 6 . 1 1 50 50 ILE N N 50 124.631 124.631 117.173 7.458 18441
2113 1 6 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.436 -0.591 18441
2114 1 6 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.749 0.841 18441
2115 1 6 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.955 -3.793 18441
2116 1 6 . 1 1 50 50 ILE H H 50 8.475 8.475 7.617 0.858 18441
2117 1 6 . 1 1 51 51 ASN N N 51 119.027 119.027 119.402 -0.375 18441
2118 1 6 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.543 0.164 18441
2119 1 6 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.612 -0.164 18441
2120 1 6 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.075 0.886 18441
2121 1 6 . 1 1 51 51 ASN H H 51 7.347 7.347 8.299 -0.952 18441
2122 1 6 . 1 1 52 52 GLU N N 52 115.889 115.889 116.846 -0.957 18441
2123 1 6 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.801 0.087 18441
2124 1 6 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.544 2.241 18441
2125 1 6 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.288 -0.268 18441
2126 1 6 . 1 1 52 52 GLU H H 52 7.438 7.438 7.463 -0.025 18441
2127 1 6 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.201 0.009 18441
2128 1 6 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.207 1.753 18441
2129 1 6 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.870 1.078 18441
2130 1 6 . 1 1 54 54 SER N N 54 113.711 113.711 112.387 1.324 18441
2131 1 6 . 1 1 54 54 SER HA H 54 4.173 4.173 4.328 -0.155 18441
2132 1 6 . 1 1 54 54 SER CA C 54 61.650 61.650 60.675 0.975 18441
2133 1 6 . 1 1 54 54 SER CB C 54 62.930 62.930 63.074 -0.144 18441
2134 1 6 . 1 1 54 54 SER H H 54 8.946 8.946 8.187 0.759 18441
2135 1 6 . 1 1 55 55 ARG N N 55 116.455 116.455 118.947 -2.492 18441
2136 1 6 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.404 0.000 18441
2137 1 6 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.419 0.891 18441
2138 1 6 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.416 3.196 18441
2139 1 6 . 1 1 55 55 ARG H H 55 7.759 7.759 7.513 0.246 18441
2140 1 6 . 1 1 56 56 LEU N N 56 121.468 121.468 123.422 -1.954 18441
2141 1 6 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.306 -0.171 18441
2142 1 6 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.850 0.050 18441
2143 1 6 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.578 1.419 18441
2144 1 6 . 1 1 56 56 LEU H H 56 7.472 7.472 8.000 -0.527 18441
2145 1 6 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.388 0.308 18441
2146 1 6 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.347 -0.167 18441
2147 1 6 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.247 1.143 18441
2148 1 6 . 1 1 58 58 LEU N N 58 119.923 119.923 117.528 2.395 18441
2149 1 6 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.156 -0.106 18441
2150 1 6 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.439 0.881 18441
2151 1 6 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.531 0.497 18441
2152 1 6 . 1 1 58 58 LEU H H 58 8.734 8.734 7.422 1.312 18441
2153 1 6 . 1 1 59 59 PHE N N 59 116.632 116.632 120.502 -3.870 18441
2154 1 6 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.245 0.234 18441
2155 1 6 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.636 1.444 18441
2156 1 6 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.178 -0.326 18441
2157 1 6 . 1 1 59 59 PHE H H 59 8.312 8.312 8.779 -0.467 18441
2158 1 6 . 1 1 60 60 ASP N N 60 120.603 120.603 117.958 2.645 18441
2159 1 6 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.332 0.339 18441
2160 1 6 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.282 1.588 18441
2161 1 6 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.277 1.264 18441
2162 1 6 . 1 1 60 60 ASP H H 60 7.462 7.462 8.005 -0.543 18441
2163 1 6 . 1 1 61 61 ALA N N 61 122.470 122.470 122.826 -0.356 18441
2164 1 6 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.868 0.393 18441
2165 1 6 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.454 0.092 18441
2166 1 6 . 1 1 61 61 ALA CB C 61 18.880 18.880 19.021 -0.141 18441
2167 1 6 . 1 1 61 61 ALA H H 61 7.664 7.664 7.523 0.141 18441
2168 1 6 . 1 1 62 62 ILE N N 62 115.525 115.525 118.054 -2.529 18441
2169 1 6 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.045 0.637 18441
2170 1 6 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.276 0.144 18441
2171 1 6 . 1 1 62 62 ILE CB C 62 40.155 40.155 38.008 2.147 18441
2172 1 6 . 1 1 62 62 ILE H H 62 7.653 7.653 7.694 -0.041 18441
2173 1 6 . 1 1 63 63 ARG N N 63 121.016 121.016 120.556 0.460 18441
2174 1 6 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.489 -0.015 18441
2175 1 6 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.274 1.096 18441
2176 1 6 . 1 1 63 63 ARG H H 63 6.917 6.917 7.254 -0.337 18441
2177 1 6 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.113 0.198 18441
2178 1 6 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.467 0.273 18441
2179 1 6 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.059 1.128 18441
2180 1 6 . 1 1 65 65 LEU N N 65 114.713 114.713 115.799 -1.086 18441
2181 1 6 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.069 -0.149 18441
2182 1 6 . 1 1 65 65 LEU CA C 65 55.660 55.660 55.967 -0.307 18441
2183 1 6 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.785 0.323 18441
2184 1 6 . 1 1 65 65 LEU H H 65 8.074 8.074 7.552 0.522 18441
2185 1 6 . 1 1 66 66 ILE N N 66 120.129 120.129 118.863 1.266 18441
2186 1 6 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.126 0.179 18441
2187 1 6 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.769 -5.008 18441
2188 1 6 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.575 -0.931 18441
2189 1 6 . 1 1 66 66 ILE H H 66 7.398 7.398 7.437 -0.039 18441
2190 1 6 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.345 -0.040 18441
2191 1 6 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.546 1.094 18441
2192 1 6 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.354 0.935 18441
2193 1 6 . 1 1 68 68 LEU N N 68 124.673 124.673 122.312 2.361 18441
2194 1 6 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.922 -0.072 18441
2195 1 6 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.666 -0.046 18441
2196 1 6 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.795 0.672 18441
2197 1 6 . 1 1 68 68 LEU H H 68 8.471 8.471 8.373 0.098 18441
2198 1 6 . 1 1 69 69 LYS N N 69 115.247 115.247 118.822 -3.575 18441
2199 1 6 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.065 0.104 18441
2200 1 6 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.044 -0.023 18441
2201 1 6 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.963 0.543 18441
2202 1 6 . 1 1 69 69 LYS H H 69 8.536 8.536 8.318 0.218 18441
2203 1 6 . 1 1 70 70 HIS N N 70 118.849 118.849 116.765 2.084 18441
2204 1 6 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.371 0.854 18441
2205 1 6 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.549 -3.660 18441
2206 1 6 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.728 5.310 18441
2207 1 6 . 1 1 70 70 HIS H H 70 8.060 8.060 8.302 -0.242 18441
2208 1 6 . 1 1 71 71 GLN N N 71 122.130 122.130 120.039 2.091 18441
2209 1 6 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.119 -0.420 18441
2210 1 6 . 1 1 71 71 GLN CA C 71 61.690 61.690 58.981 2.709 18441
2211 1 6 . 1 1 71 71 GLN CB C 71 29.250 29.250 27.831 1.419 18441
2212 1 6 . 1 1 71 71 GLN H H 71 7.732 7.732 8.614 -0.882 18441
2213 1 6 . 1 1 72 72 VAL N N 72 119.182 119.182 121.183 -2.001 18441
2214 1 6 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.737 0.071 18441
2215 1 6 . 1 1 72 72 VAL CA C 72 67.220 67.220 65.591 1.629 18441
2216 1 6 . 1 1 72 72 VAL CB C 72 31.814 31.814 30.850 0.964 18441
2217 1 6 . 1 1 72 72 VAL H H 72 8.203 8.203 7.626 0.577 18441
2218 1 6 . 1 1 73 73 GLU N N 73 121.878 121.878 120.379 1.499 18441
2219 1 6 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.047 -0.069 18441
2220 1 6 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.200 0.900 18441
2221 1 6 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.517 1.143 18441
2222 1 6 . 1 1 73 73 GLU H H 73 8.136 8.136 7.907 0.229 18441
2223 1 6 . 1 1 74 74 TYR N N 74 119.780 119.780 120.343 -0.563 18441
2224 1 6 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.072 -0.395 18441
2225 1 6 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.580 1.730 18441
2226 1 6 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.352 1.668 18441
2227 1 6 . 1 1 74 74 TYR H H 74 8.491 8.491 8.341 0.150 18441
2228 1 6 . 1 1 75 75 ASP N N 75 120.231 120.231 118.390 1.841 18441
2229 1 6 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.554 -0.411 18441
2230 1 6 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.239 0.321 18441
2231 1 6 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.705 -0.127 18441
2232 1 6 . 1 1 75 75 ASP H H 75 8.566 8.566 8.162 0.404 18441
2233 1 6 . 1 1 76 76 GLN N N 76 118.324 118.324 117.418 0.906 18441
2234 1 6 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.148 -0.092 18441
2235 1 6 . 1 1 76 76 GLN CA C 76 58.430 58.430 57.880 0.550 18441
2236 1 6 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.792 0.638 18441
2237 1 6 . 1 1 76 76 GLN H H 76 7.844 7.844 7.928 -0.085 18441
2238 1 6 . 1 1 77 77 LEU N N 77 117.932 117.932 119.031 -1.099 18441
2239 1 6 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.678 -0.481 18441
2240 1 6 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.153 -0.243 18441
2241 1 6 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.194 3.210 18441
2242 1 6 . 1 1 77 77 LEU H H 77 7.665 7.665 7.782 -0.117 18441
2243 1 6 . 1 1 78 78 THR N N 78 110.323 110.323 113.339 -3.016 18441
2244 1 6 . 1 1 78 78 THR HA H 78 3.709 3.709 4.177 -0.468 18441
2245 1 6 . 1 1 78 78 THR CA C 78 59.750 59.750 66.884 -7.134 18441
2246 1 6 . 1 1 78 78 THR CB C 78 69.110 69.110 67.774 1.336 18441
2247 1 6 . 1 1 78 78 THR H H 78 7.130 7.130 7.775 -0.645 18441
2248 1 6 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.394 -0.148 18441
2249 1 6 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.901 -0.221 18441
2250 1 6 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.853 0.538 18441
2251 1 7 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.935 -0.405 18441
2252 1 7 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.349 1.241 18441
2253 1 7 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.921 -0.228 18441
2254 1 7 . 1 1 3 3 ARG N N 3 121.498 121.498 119.661 1.837 18441
2255 1 7 . 1 1 3 3 ARG HA H 3 4.241 4.241 3.931 0.310 18441
2256 1 7 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.411 -0.741 18441
2257 1 7 . 1 1 3 3 ARG CB C 3 30.510 30.510 29.267 1.243 18441
2258 1 7 . 1 1 3 3 ARG H H 3 8.382 8.382 8.832 -0.450 18441
2259 1 7 . 1 1 4 4 LYS N N 4 122.257 122.257 119.992 2.265 18441
2260 1 7 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.077 -0.019 18441
2261 1 7 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.152 0.558 18441
2262 1 7 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.491 0.785 18441
2263 1 7 . 1 1 4 4 LYS H H 4 8.226 8.226 7.786 0.440 18441
2264 1 7 . 1 1 5 5 VAL N N 5 120.494 120.494 118.552 1.942 18441
2265 1 7 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.724 -0.003 18441
2266 1 7 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.879 0.771 18441
2267 1 7 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.492 0.582 18441
2268 1 7 . 1 1 5 5 VAL H H 5 8.109 8.109 8.176 -0.067 18441
2269 1 7 . 1 1 6 6 ALA N N 6 123.149 123.149 122.904 0.245 18441
2270 1 7 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.290 -0.255 18441
2271 1 7 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.179 0.711 18441
2272 1 7 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.315 0.945 18441
2273 1 7 . 1 1 6 6 ALA H H 6 8.374 8.374 7.706 0.668 18441
2274 1 7 . 1 1 7 7 ARG N N 7 119.587 119.587 118.597 0.990 18441
2275 1 7 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.908 0.093 18441
2276 1 7 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.103 0.667 18441
2277 1 7 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.099 0.670 18441
2278 1 7 . 1 1 7 7 ARG H H 7 7.992 7.992 7.779 0.213 18441
2279 1 7 . 1 1 8 8 GLU N N 8 119.745 119.745 120.405 -0.660 18441
2280 1 7 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.167 -0.109 18441
2281 1 7 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.645 0.126 18441
2282 1 7 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.437 0.513 18441
2283 1 7 . 1 1 8 8 GLU H H 8 8.165 8.165 8.327 -0.162 18441
2284 1 7 . 1 1 9 9 PHE N N 9 121.436 121.436 119.998 1.438 18441
2285 1 7 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.436 -0.309 18441
2286 1 7 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.995 3.025 18441
2287 1 7 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.767 0.855 18441
2288 1 7 . 1 1 9 9 PHE H H 9 8.180 8.180 8.155 0.025 18441
2289 1 7 . 1 1 10 10 ARG N N 10 119.028 119.028 120.019 -0.991 18441
2290 1 7 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.424 0.437 18441
2291 1 7 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.243 0.337 18441
2292 1 7 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.337 0.983 18441
2293 1 7 . 1 1 10 10 ARG H H 10 7.910 7.910 7.956 -0.046 18441
2294 1 7 . 1 1 11 11 HIS N N 11 116.563 116.563 118.504 -1.941 18441
2295 1 7 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.253 0.203 18441
2296 1 7 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.981 0.199 18441
2297 1 7 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.963 0.067 18441
2298 1 7 . 1 1 11 11 HIS H H 11 8.001 8.001 8.245 -0.244 18441
2299 1 7 . 1 1 12 12 LYS N N 12 120.773 120.773 119.128 1.645 18441
2300 1 7 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.932 0.076 18441
2301 1 7 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.572 0.408 18441
2302 1 7 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.351 0.342 18441
2303 1 7 . 1 1 12 12 LYS H H 12 7.796 7.796 7.745 0.051 18441
2304 1 7 . 1 1 13 13 VAL N N 13 120.125 120.125 120.276 -0.151 18441
2305 1 7 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.613 -0.502 18441
2306 1 7 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.122 1.058 18441
2307 1 7 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.407 0.733 18441
2308 1 7 . 1 1 13 13 VAL H H 13 7.821 7.821 7.924 -0.103 18441
2309 1 7 . 1 1 14 14 ASP N N 14 117.462 117.462 119.193 -1.731 18441
2310 1 7 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.362 -0.100 18441
2311 1 7 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.493 -0.093 18441
2312 1 7 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.916 0.398 18441
2313 1 7 . 1 1 14 14 ASP H H 14 8.276 8.276 7.819 0.457 18441
2314 1 7 . 1 1 15 15 PHE N N 15 117.914 117.914 119.235 -1.321 18441
2315 1 7 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.306 0.056 18441
2316 1 7 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.596 -0.406 18441
2317 1 7 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.511 1.187 18441
2318 1 7 . 1 1 15 15 PHE H H 15 7.664 7.664 7.723 -0.059 18441
2319 1 7 . 1 1 16 16 LEU N N 16 116.737 116.737 117.026 -0.289 18441
2320 1 7 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.397 -0.163 18441
2321 1 7 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.964 1.456 18441
2322 1 7 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.635 2.443 18441
2323 1 7 . 1 1 16 16 LEU H H 16 7.658 7.658 7.901 -0.243 18441
2324 1 7 . 1 1 17 17 ILE N N 17 120.533 120.533 117.224 3.309 18441
2325 1 7 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.327 -0.219 18441
2326 1 7 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.082 1.458 18441
2327 1 7 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.179 1.178 18441
2328 1 7 . 1 1 17 17 ILE H H 17 8.336 8.336 7.483 0.853 18441
2329 1 7 . 1 1 18 18 GLU N N 18 124.531 124.531 123.931 0.600 18441
2330 1 7 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.019 0.191 18441
2331 1 7 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.677 -0.077 18441
2332 1 7 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.525 1.485 18441
2333 1 7 . 1 1 18 18 GLU H H 18 8.276 8.276 8.633 -0.357 18441
2334 1 7 . 1 1 19 19 ASN N N 19 117.630 117.630 118.924 -1.294 18441
2335 1 7 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.516 0.289 18441
2336 1 7 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.767 -0.029 18441
2337 1 7 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.576 1.602 18441
2338 1 7 . 1 1 19 19 ASN H H 19 7.700 7.700 8.017 -0.317 18441
2339 1 7 . 1 1 20 20 ASP N N 20 127.428 127.428 118.805 8.623 18441
2340 1 7 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.579 -0.330 18441
2341 1 7 . 1 1 20 20 ASP CA C 20 58.850 58.850 55.912 2.938 18441
2342 1 7 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.093 0.221 18441
2343 1 7 . 1 1 20 20 ASP H H 20 8.998 8.998 8.434 0.564 18441
2344 1 7 . 1 1 21 21 ALA N N 21 122.271 122.271 123.324 -1.053 18441
2345 1 7 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.209 0.051 18441
2346 1 7 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.081 0.919 18441
2347 1 7 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.142 0.508 18441
2348 1 7 . 1 1 21 21 ALA H H 21 8.346 8.346 8.214 0.132 18441
2349 1 7 . 1 1 22 22 GLU N N 22 118.716 118.716 117.995 0.721 18441
2350 1 7 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.001 0.113 18441
2351 1 7 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.086 0.274 18441
2352 1 7 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.043 2.729 18441
2353 1 7 . 1 1 22 22 GLU H H 22 7.724 7.724 8.833 -1.109 18441
2354 1 7 . 1 1 23 23 LYS N N 23 121.088 121.088 117.624 3.464 18441
2355 1 7 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.745 0.066 18441
2356 1 7 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.227 2.443 18441
2357 1 7 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.815 1.255 18441
2358 1 7 . 1 1 23 23 LYS H H 23 7.618 7.618 8.047 -0.429 18441
2359 1 7 . 1 1 24 24 ASP N N 24 119.010 119.010 120.436 -1.426 18441
2360 1 7 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.502 -0.013 18441
2361 1 7 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.939 0.571 18441
2362 1 7 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.759 0.078 18441
2363 1 7 . 1 1 24 24 ASP H H 24 8.424 8.424 7.507 0.917 18441
2364 1 7 . 1 1 25 25 TYR N N 25 120.417 120.417 120.647 -0.230 18441
2365 1 7 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.190 0.053 18441
2366 1 7 . 1 1 25 25 TYR CA C 25 62.190 62.190 60.459 1.731 18441
2367 1 7 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.398 0.101 18441
2368 1 7 . 1 1 25 25 TYR H H 25 7.676 7.676 8.354 -0.678 18441
2369 1 7 . 1 1 26 26 LEU N N 26 120.960 120.960 121.046 -0.086 18441
2370 1 7 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.922 -0.321 18441
2371 1 7 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.036 1.403 18441
2372 1 7 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.471 0.680 18441
2373 1 7 . 1 1 26 26 LEU H H 26 7.965 7.965 7.878 0.087 18441
2374 1 7 . 1 1 27 27 TYR N N 27 116.521 116.521 117.896 -1.375 18441
2375 1 7 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.151 -0.375 18441
2376 1 7 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.815 4.595 18441
2377 1 7 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.045 1.358 18441
2378 1 7 . 1 1 27 27 TYR H H 27 8.097 8.097 7.991 0.106 18441
2379 1 7 . 1 1 28 28 ASP N N 28 123.384 123.384 119.824 3.560 18441
2380 1 7 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.454 0.022 18441
2381 1 7 . 1 1 28 28 ASP CA C 28 58.540 58.540 58.044 0.496 18441
2382 1 7 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.384 1.010 18441
2383 1 7 . 1 1 28 28 ASP H H 28 8.355 8.355 8.012 0.343 18441
2384 1 7 . 1 1 29 29 VAL N N 29 121.272 121.272 120.768 0.504 18441
2385 1 7 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.718 -0.005 18441
2386 1 7 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.130 -0.480 18441
2387 1 7 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.914 0.004 18441
2388 1 7 . 1 1 29 29 VAL H H 29 8.252 8.252 8.019 0.233 18441
2389 1 7 . 1 1 30 30 LEU N N 30 122.443 122.443 119.868 2.575 18441
2390 1 7 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.124 -0.081 18441
2391 1 7 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.350 0.530 18441
2392 1 7 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.745 0.536 18441
2393 1 7 . 1 1 30 30 LEU H H 30 7.987 7.987 8.067 -0.080 18441
2394 1 7 . 1 1 31 31 ARG N N 31 122.386 122.386 118.940 3.446 18441
2395 1 7 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.073 -0.057 18441
2396 1 7 . 1 1 31 31 ARG CA C 31 60.380 60.380 58.983 1.397 18441
2397 1 7 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.017 0.383 18441
2398 1 7 . 1 1 31 31 ARG H H 31 8.637 8.637 8.397 0.240 18441
2399 1 7 . 1 1 32 32 MET N N 32 120.006 120.006 119.401 0.605 18441
2400 1 7 . 1 1 32 32 MET HA H 32 4.359 4.359 4.394 -0.035 18441
2401 1 7 . 1 1 32 32 MET CA C 32 58.490 58.490 58.938 -0.448 18441
2402 1 7 . 1 1 32 32 MET CB C 32 31.677 31.677 32.319 -0.642 18441
2403 1 7 . 1 1 32 32 MET H H 32 8.327 8.327 8.449 -0.122 18441
2404 1 7 . 1 1 33 33 TYR N N 33 123.220 123.220 121.500 1.720 18441
2405 1 7 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.290 0.434 18441
2406 1 7 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.202 0.798 18441
2407 1 7 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.765 1.922 18441
2408 1 7 . 1 1 33 33 TYR H H 33 8.054 8.054 8.745 -0.691 18441
2409 1 7 . 1 1 34 34 HIS N N 34 120.860 120.860 118.332 2.528 18441
2410 1 7 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.140 -0.364 18441
2411 1 7 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.328 1.383 18441
2412 1 7 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.384 1.008 18441
2413 1 7 . 1 1 34 34 HIS H H 34 8.548 8.548 7.948 0.600 18441
2414 1 7 . 1 1 35 35 GLN N N 35 113.582 113.582 118.404 -4.822 18441
2415 1 7 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.281 -0.281 18441
2416 1 7 . 1 1 35 35 GLN CA C 35 58.680 58.680 57.956 0.723 18441
2417 1 7 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.259 1.291 18441
2418 1 7 . 1 1 35 35 GLN H H 35 7.542 7.542 8.256 -0.714 18441
2419 1 7 . 1 1 36 36 THR N N 36 111.117 111.117 111.098 0.019 18441
2420 1 7 . 1 1 36 36 THR HA H 36 4.214 4.214 4.242 -0.028 18441
2421 1 7 . 1 1 36 36 THR CA C 36 63.980 63.980 62.781 1.199 18441
2422 1 7 . 1 1 36 36 THR CB C 36 71.670 71.670 69.707 1.963 18441
2423 1 7 . 1 1 36 36 THR H H 36 8.569 8.569 8.351 0.218 18441
2424 1 7 . 1 1 37 37 MET N N 37 120.444 120.444 118.502 1.942 18441
2425 1 7 . 1 1 37 37 MET HA H 37 3.740 3.740 4.177 -0.437 18441
2426 1 7 . 1 1 37 37 MET CA C 37 56.430 56.430 56.328 0.102 18441
2427 1 7 . 1 1 37 37 MET CB C 37 31.399 31.399 30.414 0.985 18441
2428 1 7 . 1 1 37 37 MET H H 37 9.542 9.542 7.688 1.854 18441
2429 1 7 . 1 1 38 38 ASP N N 38 117.020 117.020 120.819 -3.799 18441
2430 1 7 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.899 0.045 18441
2431 1 7 . 1 1 38 38 ASP CA C 38 53.476 53.476 52.930 0.546 18441
2432 1 7 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.476 -0.436 18441
2433 1 7 . 1 1 38 38 ASP H H 38 7.456 7.456 7.875 -0.419 18441
2434 1 7 . 1 1 39 39 VAL N N 39 128.507 128.507 123.992 4.515 18441
2435 1 7 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.569 0.262 18441
2436 1 7 . 1 1 39 39 VAL CA C 39 64.840 64.840 65.012 -0.172 18441
2437 1 7 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.663 1.037 18441
2438 1 7 . 1 1 39 39 VAL H H 39 8.425 8.425 8.569 -0.144 18441
2439 1 7 . 1 1 40 40 ALA N N 40 125.621 125.621 121.459 4.162 18441
2440 1 7 . 1 1 40 40 ALA HA H 40 3.987 3.987 3.976 0.011 18441
2441 1 7 . 1 1 40 40 ALA CA C 40 55.860 55.860 54.870 0.990 18441
2442 1 7 . 1 1 40 40 ALA CB C 40 18.470 18.470 17.922 0.548 18441
2443 1 7 . 1 1 40 40 ALA H H 40 7.998 7.998 8.251 -0.253 18441
2444 1 7 . 1 1 41 41 VAL N N 41 122.132 122.132 118.096 4.036 18441
2445 1 7 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.790 -0.219 18441
2446 1 7 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.053 0.627 18441
2447 1 7 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.369 1.333 18441
2448 1 7 . 1 1 41 41 VAL H H 41 7.663 7.663 7.807 -0.144 18441
2449 1 7 . 1 1 42 42 LEU N N 42 120.190 120.190 118.945 1.245 18441
2450 1 7 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.169 0.091 18441
2451 1 7 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.374 0.616 18441
2452 1 7 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.037 -0.332 18441
2453 1 7 . 1 1 42 42 LEU H H 42 7.361 7.361 7.405 -0.044 18441
2454 1 7 . 1 1 43 43 VAL N N 43 116.802 116.802 119.331 -2.529 18441
2455 1 7 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.876 -0.459 18441
2456 1 7 . 1 1 43 43 VAL CA C 43 68.780 68.780 65.495 3.285 18441
2457 1 7 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.516 1.464 18441
2458 1 7 . 1 1 43 43 VAL H H 43 8.062 8.062 7.771 0.291 18441
2459 1 7 . 1 1 44 44 GLY N N 44 106.242 106.242 108.530 -2.288 18441
2460 1 7 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.377 0.939 18441
2461 1 7 . 1 1 44 44 GLY H H 44 7.901 7.901 8.044 -0.143 18441
2462 1 7 . 1 1 45 45 ASP N N 45 123.359 123.359 123.203 0.156 18441
2463 1 7 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.301 0.364 18441
2464 1 7 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.206 0.554 18441
2465 1 7 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.370 0.498 18441
2466 1 7 . 1 1 45 45 ASP H H 45 8.680 8.680 7.820 0.860 18441
2467 1 7 . 1 1 46 46 LEU N N 46 123.201 123.201 120.113 3.088 18441
2468 1 7 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.553 0.513 18441
2469 1 7 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.651 0.469 18441
2470 1 7 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.489 1.510 18441
2471 1 7 . 1 1 46 46 LEU H H 46 9.018 9.018 8.227 0.791 18441
2472 1 7 . 1 1 47 47 LYS N N 47 119.196 119.196 118.657 0.539 18441
2473 1 7 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.903 0.067 18441
2474 1 7 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.540 0.750 18441
2475 1 7 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.109 1.032 18441
2476 1 7 . 1 1 47 47 LYS H H 47 8.017 8.017 7.335 0.682 18441
2477 1 7 . 1 1 48 48 LEU N N 48 116.358 116.358 119.014 -2.656 18441
2478 1 7 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.004 0.157 18441
2479 1 7 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.380 0.290 18441
2480 1 7 . 1 1 48 48 LEU CB C 48 42.160 42.160 41.822 0.338 18441
2481 1 7 . 1 1 48 48 LEU H H 48 7.143 7.143 7.281 -0.138 18441
2482 1 7 . 1 1 49 49 VAL N N 49 112.662 112.662 114.421 -1.759 18441
2483 1 7 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.968 0.505 18441
2484 1 7 . 1 1 49 49 VAL CA C 49 62.060 62.060 61.891 0.169 18441
2485 1 7 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.334 2.833 18441
2486 1 7 . 1 1 49 49 VAL H H 49 7.266 7.266 7.168 0.098 18441
2487 1 7 . 1 1 50 50 ILE N N 50 124.631 124.631 117.759 6.872 18441
2488 1 7 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.245 -0.400 18441
2489 1 7 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.333 1.257 18441
2490 1 7 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.318 -3.157 18441
2491 1 7 . 1 1 50 50 ILE H H 50 8.475 8.475 7.476 0.999 18441
2492 1 7 . 1 1 51 51 ASN N N 51 119.027 119.027 118.869 0.158 18441
2493 1 7 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.686 0.021 18441
2494 1 7 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.381 0.067 18441
2495 1 7 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.279 0.681 18441
2496 1 7 . 1 1 51 51 ASN H H 51 7.347 7.347 8.063 -0.716 18441
2497 1 7 . 1 1 52 52 GLU N N 52 115.889 115.889 118.437 -2.548 18441
2498 1 7 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.765 0.123 18441
2499 1 7 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.079 1.706 18441
2500 1 7 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.835 0.185 18441
2501 1 7 . 1 1 52 52 GLU H H 52 7.438 7.438 7.529 -0.091 18441
2502 1 7 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.268 -0.058 18441
2503 1 7 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.614 1.346 18441
2504 1 7 . 1 1 53 53 PRO CB C 53 32.948 32.948 32.007 0.942 18441
2505 1 7 . 1 1 54 54 SER N N 54 113.711 113.711 110.201 3.510 18441
2506 1 7 . 1 1 54 54 SER HA H 54 4.173 4.173 4.385 -0.212 18441
2507 1 7 . 1 1 54 54 SER CA C 54 61.650 61.650 60.484 1.166 18441
2508 1 7 . 1 1 54 54 SER CB C 54 62.930 62.930 63.458 -0.528 18441
2509 1 7 . 1 1 54 54 SER H H 54 8.946 8.946 8.148 0.798 18441
2510 1 7 . 1 1 55 55 ARG N N 55 116.455 116.455 118.832 -2.377 18441
2511 1 7 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.331 0.073 18441
2512 1 7 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.093 0.218 18441
2513 1 7 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.350 3.262 18441
2514 1 7 . 1 1 55 55 ARG H H 55 7.759 7.759 7.812 -0.053 18441
2515 1 7 . 1 1 56 56 LEU N N 56 121.468 121.468 123.174 -1.706 18441
2516 1 7 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.308 -0.173 18441
2517 1 7 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.019 -0.119 18441
2518 1 7 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.503 1.494 18441
2519 1 7 . 1 1 56 56 LEU H H 56 7.472 7.472 8.487 -1.015 18441
2520 1 7 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.187 0.509 18441
2521 1 7 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.189 -0.009 18441
2522 1 7 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.125 1.264 18441
2523 1 7 . 1 1 58 58 LEU N N 58 119.923 119.923 117.426 2.497 18441
2524 1 7 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.141 -0.091 18441
2525 1 7 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.418 0.902 18441
2526 1 7 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.580 0.448 18441
2527 1 7 . 1 1 58 58 LEU H H 58 8.734 8.734 7.652 1.082 18441
2528 1 7 . 1 1 59 59 PHE N N 59 116.632 116.632 121.250 -4.618 18441
2529 1 7 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.359 0.120 18441
2530 1 7 . 1 1 59 59 PHE CA C 59 63.080 63.080 59.698 3.382 18441
2531 1 7 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.867 -0.014 18441
2532 1 7 . 1 1 59 59 PHE H H 59 8.312 8.312 8.693 -0.381 18441
2533 1 7 . 1 1 60 60 ASP N N 60 120.603 120.603 118.864 1.739 18441
2534 1 7 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.397 0.274 18441
2535 1 7 . 1 1 60 60 ASP CA C 60 57.870 57.870 57.448 0.422 18441
2536 1 7 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.833 0.708 18441
2537 1 7 . 1 1 60 60 ASP H H 60 7.462 7.462 7.820 -0.358 18441
2538 1 7 . 1 1 61 61 ALA N N 61 122.470 122.470 122.454 0.016 18441
2539 1 7 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.967 0.294 18441
2540 1 7 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.558 -0.012 18441
2541 1 7 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.740 0.140 18441
2542 1 7 . 1 1 61 61 ALA H H 61 7.664 7.664 7.720 -0.056 18441
2543 1 7 . 1 1 62 62 ILE N N 62 115.525 115.525 117.895 -2.370 18441
2544 1 7 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.128 0.554 18441
2545 1 7 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.140 0.280 18441
2546 1 7 . 1 1 62 62 ILE CB C 62 40.155 40.155 38.036 2.119 18441
2547 1 7 . 1 1 62 62 ILE H H 62 7.653 7.653 7.411 0.242 18441
2548 1 7 . 1 1 63 63 ARG N N 63 121.016 121.016 120.474 0.542 18441
2549 1 7 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.421 0.053 18441
2550 1 7 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.456 0.914 18441
2551 1 7 . 1 1 63 63 ARG H H 63 6.917 6.917 7.443 -0.526 18441
2552 1 7 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.156 0.155 18441
2553 1 7 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.113 0.627 18441
2554 1 7 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.071 1.116 18441
2555 1 7 . 1 1 65 65 LEU N N 65 114.713 114.713 117.120 -2.407 18441
2556 1 7 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.093 -0.173 18441
2557 1 7 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.089 -0.429 18441
2558 1 7 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.868 0.240 18441
2559 1 7 . 1 1 65 65 LEU H H 65 8.074 8.074 7.495 0.579 18441
2560 1 7 . 1 1 66 66 ILE N N 66 120.129 120.129 118.627 1.502 18441
2561 1 7 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.130 0.175 18441
2562 1 7 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.877 -5.117 18441
2563 1 7 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.395 -0.751 18441
2564 1 7 . 1 1 66 66 ILE H H 66 7.398 7.398 7.407 -0.009 18441
2565 1 7 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.363 -0.058 18441
2566 1 7 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.904 0.736 18441
2567 1 7 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.364 0.925 18441
2568 1 7 . 1 1 68 68 LEU N N 68 124.673 124.673 122.393 2.280 18441
2569 1 7 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.905 -0.055 18441
2570 1 7 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.521 0.099 18441
2571 1 7 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.490 0.977 18441
2572 1 7 . 1 1 68 68 LEU H H 68 8.471 8.471 8.356 0.115 18441
2573 1 7 . 1 1 69 69 LYS N N 69 115.247 115.247 118.938 -3.691 18441
2574 1 7 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.019 0.150 18441
2575 1 7 . 1 1 69 69 LYS CA C 69 59.020 59.020 58.987 0.033 18441
2576 1 7 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.767 0.739 18441
2577 1 7 . 1 1 69 69 LYS H H 69 8.536 8.536 8.334 0.202 18441
2578 1 7 . 1 1 70 70 HIS N N 70 118.849 118.849 118.606 0.243 18441
2579 1 7 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.372 0.853 18441
2580 1 7 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.333 -3.444 18441
2581 1 7 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.501 5.537 18441
2582 1 7 . 1 1 70 70 HIS H H 70 8.060 8.060 8.203 -0.143 18441
2583 1 7 . 1 1 71 71 GLN N N 71 122.130 122.130 119.433 2.697 18441
2584 1 7 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.010 -0.311 18441
2585 1 7 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.424 2.266 18441
2586 1 7 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.788 0.462 18441
2587 1 7 . 1 1 71 71 GLN H H 71 7.732 7.732 8.503 -0.771 18441
2588 1 7 . 1 1 72 72 VAL N N 72 119.182 119.182 119.476 -0.294 18441
2589 1 7 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.675 0.133 18441
2590 1 7 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.686 0.534 18441
2591 1 7 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.180 0.634 18441
2592 1 7 . 1 1 72 72 VAL H H 72 8.203 8.203 7.734 0.469 18441
2593 1 7 . 1 1 73 73 GLU N N 73 121.878 121.878 120.005 1.873 18441
2594 1 7 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.277 -0.299 18441
2595 1 7 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.045 1.055 18441
2596 1 7 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.528 1.132 18441
2597 1 7 . 1 1 73 73 GLU H H 73 8.136 8.136 7.873 0.263 18441
2598 1 7 . 1 1 74 74 TYR N N 74 119.780 119.780 121.002 -1.222 18441
2599 1 7 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.060 -0.383 18441
2600 1 7 . 1 1 74 74 TYR CA C 74 63.310 63.310 62.213 1.097 18441
2601 1 7 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.414 1.606 18441
2602 1 7 . 1 1 74 74 TYR H H 74 8.491 8.491 8.283 0.208 18441
2603 1 7 . 1 1 75 75 ASP N N 75 120.231 120.231 117.778 2.453 18441
2604 1 7 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.372 -0.229 18441
2605 1 7 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.837 0.723 18441
2606 1 7 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.616 -0.038 18441
2607 1 7 . 1 1 75 75 ASP H H 75 8.566 8.566 7.882 0.684 18441
2608 1 7 . 1 1 76 76 GLN N N 76 118.324 118.324 117.027 1.297 18441
2609 1 7 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.039 0.017 18441
2610 1 7 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.285 0.145 18441
2611 1 7 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.051 0.379 18441
2612 1 7 . 1 1 76 76 GLN H H 76 7.844 7.844 7.677 0.167 18441
2613 1 7 . 1 1 77 77 LEU N N 77 117.932 117.932 116.426 1.506 18441
2614 1 7 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.191 0.006 18441
2615 1 7 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.493 0.417 18441
2616 1 7 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.874 2.530 18441
2617 1 7 . 1 1 77 77 LEU H H 77 7.665 7.665 7.403 0.262 18441
2618 1 7 . 1 1 78 78 THR N N 78 110.323 110.323 112.016 -1.693 18441
2619 1 7 . 1 1 78 78 THR HA H 78 3.709 3.709 4.276 -0.567 18441
2620 1 7 . 1 1 78 78 THR CA C 78 59.750 59.750 59.247 0.503 18441
2621 1 7 . 1 1 78 78 THR CB C 78 69.110 69.110 69.394 -0.284 18441
2622 1 7 . 1 1 78 78 THR H H 78 7.130 7.130 7.624 -0.494 18441
2623 1 7 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.486 -0.240 18441
2624 1 7 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.114 0.566 18441
2625 1 7 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.361 0.030 18441
2626 1 8 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.727 -0.197 18441
2627 1 8 . 1 1 2 2 ASP CA C 2 55.590 55.590 55.905 -0.315 18441
2628 1 8 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.457 0.236 18441
2629 1 8 . 1 1 3 3 ARG N N 3 121.498 121.498 120.676 0.822 18441
2630 1 8 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.179 0.062 18441
2631 1 8 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.133 -0.464 18441
2632 1 8 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.037 0.473 18441
2633 1 8 . 1 1 3 3 ARG H H 3 8.382 8.382 8.289 0.093 18441
2634 1 8 . 1 1 4 4 LYS N N 4 122.257 122.257 119.698 2.559 18441
2635 1 8 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.082 -0.024 18441
2636 1 8 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.782 -0.072 18441
2637 1 8 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.870 1.406 18441
2638 1 8 . 1 1 4 4 LYS H H 4 8.226 8.226 8.321 -0.095 18441
2639 1 8 . 1 1 5 5 VAL N N 5 120.494 120.494 118.410 2.084 18441
2640 1 8 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.798 -0.077 18441
2641 1 8 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.468 1.182 18441
2642 1 8 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.137 0.937 18441
2643 1 8 . 1 1 5 5 VAL H H 5 8.109 8.109 7.560 0.549 18441
2644 1 8 . 1 1 6 6 ALA N N 6 123.149 123.149 123.311 -0.162 18441
2645 1 8 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.276 -0.241 18441
2646 1 8 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.377 0.513 18441
2647 1 8 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.370 0.890 18441
2648 1 8 . 1 1 6 6 ALA H H 6 8.374 8.374 7.402 0.972 18441
2649 1 8 . 1 1 7 7 ARG N N 7 119.587 119.587 118.484 1.103 18441
2650 1 8 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.944 0.057 18441
2651 1 8 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.467 0.303 18441
2652 1 8 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.242 0.528 18441
2653 1 8 . 1 1 7 7 ARG H H 7 7.992 7.992 7.954 0.038 18441
2654 1 8 . 1 1 8 8 GLU N N 8 119.745 119.745 120.058 -0.313 18441
2655 1 8 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.193 -0.135 18441
2656 1 8 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.597 0.173 18441
2657 1 8 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.775 0.175 18441
2658 1 8 . 1 1 8 8 GLU H H 8 8.165 8.165 8.329 -0.164 18441
2659 1 8 . 1 1 9 9 PHE N N 9 121.436 121.436 120.066 1.370 18441
2660 1 8 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.369 -0.242 18441
2661 1 8 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.136 2.884 18441
2662 1 8 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.507 1.116 18441
2663 1 8 . 1 1 9 9 PHE H H 9 8.180 8.180 8.289 -0.108 18441
2664 1 8 . 1 1 10 10 ARG N N 10 119.028 119.028 119.467 -0.439 18441
2665 1 8 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.602 0.259 18441
2666 1 8 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.466 1.114 18441
2667 1 8 . 1 1 10 10 ARG CB C 10 30.320 30.320 28.569 1.751 18441
2668 1 8 . 1 1 10 10 ARG H H 10 7.910 7.910 7.982 -0.072 18441
2669 1 8 . 1 1 11 11 HIS N N 11 116.563 116.563 119.543 -2.980 18441
2670 1 8 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.274 0.182 18441
2671 1 8 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.926 0.254 18441
2672 1 8 . 1 1 11 11 HIS CB C 11 30.030 30.030 30.031 -0.001 18441
2673 1 8 . 1 1 11 11 HIS H H 11 8.001 8.001 8.090 -0.089 18441
2674 1 8 . 1 1 12 12 LYS N N 12 120.773 120.773 119.160 1.613 18441
2675 1 8 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.937 0.071 18441
2676 1 8 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.578 0.402 18441
2677 1 8 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.372 0.321 18441
2678 1 8 . 1 1 12 12 LYS H H 12 7.796 7.796 7.754 0.042 18441
2679 1 8 . 1 1 13 13 VAL N N 13 120.125 120.125 120.173 -0.048 18441
2680 1 8 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.640 -0.529 18441
2681 1 8 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.118 1.062 18441
2682 1 8 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.289 0.851 18441
2683 1 8 . 1 1 13 13 VAL H H 13 7.821 7.821 7.801 0.020 18441
2684 1 8 . 1 1 14 14 ASP N N 14 117.462 117.462 119.470 -2.008 18441
2685 1 8 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.332 -0.070 18441
2686 1 8 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.441 -0.041 18441
2687 1 8 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.961 0.353 18441
2688 1 8 . 1 1 14 14 ASP H H 14 8.276 8.276 7.831 0.445 18441
2689 1 8 . 1 1 15 15 PHE N N 15 117.914 117.914 119.406 -1.492 18441
2690 1 8 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.301 0.061 18441
2691 1 8 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.586 -0.396 18441
2692 1 8 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.513 1.185 18441
2693 1 8 . 1 1 15 15 PHE H H 15 7.664 7.664 7.725 -0.061 18441
2694 1 8 . 1 1 16 16 LEU N N 16 116.737 116.737 116.328 0.409 18441
2695 1 8 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.128 0.106 18441
2696 1 8 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.711 1.709 18441
2697 1 8 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.148 2.930 18441
2698 1 8 . 1 1 16 16 LEU H H 16 7.658 7.658 7.942 -0.284 18441
2699 1 8 . 1 1 17 17 ILE N N 17 120.533 120.533 117.881 2.652 18441
2700 1 8 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.380 -0.272 18441
2701 1 8 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.840 1.700 18441
2702 1 8 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.142 1.215 18441
2703 1 8 . 1 1 17 17 ILE H H 17 8.336 8.336 7.152 1.184 18441
2704 1 8 . 1 1 18 18 GLU N N 18 124.531 124.531 123.394 1.137 18441
2705 1 8 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.062 0.148 18441
2706 1 8 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.628 -0.028 18441
2707 1 8 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.498 1.512 18441
2708 1 8 . 1 1 18 18 GLU H H 18 8.276 8.276 8.678 -0.402 18441
2709 1 8 . 1 1 19 19 ASN N N 19 117.630 117.630 120.603 -2.973 18441
2710 1 8 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.717 0.088 18441
2711 1 8 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.603 0.135 18441
2712 1 8 . 1 1 19 19 ASN CB C 19 41.178 41.178 38.657 2.521 18441
2713 1 8 . 1 1 19 19 ASN H H 19 7.700 7.700 7.934 -0.234 18441
2714 1 8 . 1 1 20 20 ASP N N 20 127.428 127.428 125.004 2.424 18441
2715 1 8 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.334 -0.085 18441
2716 1 8 . 1 1 20 20 ASP CA C 20 58.850 58.850 57.178 1.672 18441
2717 1 8 . 1 1 20 20 ASP CB C 20 41.314 41.314 40.582 0.732 18441
2718 1 8 . 1 1 20 20 ASP H H 20 8.998 8.998 8.867 0.131 18441
2719 1 8 . 1 1 21 21 ALA N N 21 122.271 122.271 122.287 -0.016 18441
2720 1 8 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.088 0.172 18441
2721 1 8 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.160 0.840 18441
2722 1 8 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.318 0.332 18441
2723 1 8 . 1 1 21 21 ALA H H 21 8.346 8.346 8.154 0.192 18441
2724 1 8 . 1 1 22 22 GLU N N 22 118.716 118.716 119.296 -0.580 18441
2725 1 8 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.986 0.128 18441
2726 1 8 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.419 0.941 18441
2727 1 8 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.099 2.672 18441
2728 1 8 . 1 1 22 22 GLU H H 22 7.724 7.724 8.616 -0.892 18441
2729 1 8 . 1 1 23 23 LYS N N 23 121.088 121.088 118.060 3.028 18441
2730 1 8 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.807 0.004 18441
2731 1 8 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.252 2.418 18441
2732 1 8 . 1 1 23 23 LYS CB C 23 33.070 33.070 32.053 1.017 18441
2733 1 8 . 1 1 23 23 LYS H H 23 7.618 7.618 7.430 0.188 18441
2734 1 8 . 1 1 24 24 ASP N N 24 119.010 119.010 120.953 -1.943 18441
2735 1 8 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.627 -0.138 18441
2736 1 8 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.637 0.873 18441
2737 1 8 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.852 -0.015 18441
2738 1 8 . 1 1 24 24 ASP H H 24 8.424 8.424 7.936 0.488 18441
2739 1 8 . 1 1 25 25 TYR N N 25 120.417 120.417 120.066 0.351 18441
2740 1 8 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.262 -0.019 18441
2741 1 8 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.467 0.723 18441
2742 1 8 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.562 -0.063 18441
2743 1 8 . 1 1 25 25 TYR H H 25 7.676 7.676 8.021 -0.345 18441
2744 1 8 . 1 1 26 26 LEU N N 26 120.960 120.960 120.015 0.945 18441
2745 1 8 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.834 -0.233 18441
2746 1 8 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.726 0.714 18441
2747 1 8 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.533 0.618 18441
2748 1 8 . 1 1 26 26 LEU H H 26 7.965 7.965 7.982 -0.017 18441
2749 1 8 . 1 1 27 27 TYR N N 27 116.521 116.521 118.179 -1.658 18441
2750 1 8 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.093 -0.317 18441
2751 1 8 . 1 1 27 27 TYR CA C 27 64.410 64.410 60.042 4.368 18441
2752 1 8 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.250 1.153 18441
2753 1 8 . 1 1 27 27 TYR H H 27 8.097 8.097 8.377 -0.280 18441
2754 1 8 . 1 1 28 28 ASP N N 28 123.384 123.384 119.310 4.074 18441
2755 1 8 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.483 -0.007 18441
2756 1 8 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.097 1.443 18441
2757 1 8 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.613 0.781 18441
2758 1 8 . 1 1 28 28 ASP H H 28 8.355 8.355 7.867 0.488 18441
2759 1 8 . 1 1 29 29 VAL N N 29 121.272 121.272 119.958 1.314 18441
2760 1 8 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.775 -0.062 18441
2761 1 8 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.665 -0.015 18441
2762 1 8 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.733 0.185 18441
2763 1 8 . 1 1 29 29 VAL H H 29 8.252 8.252 8.021 0.231 18441
2764 1 8 . 1 1 30 30 LEU N N 30 122.443 122.443 120.327 2.116 18441
2765 1 8 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.039 0.004 18441
2766 1 8 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.357 0.523 18441
2767 1 8 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.656 0.625 18441
2768 1 8 . 1 1 30 30 LEU H H 30 7.987 7.987 8.423 -0.436 18441
2769 1 8 . 1 1 31 31 ARG N N 31 122.386 122.386 117.989 4.397 18441
2770 1 8 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.008 0.008 18441
2771 1 8 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.754 0.626 18441
2772 1 8 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.176 0.224 18441
2773 1 8 . 1 1 31 31 ARG H H 31 8.637 8.637 8.225 0.412 18441
2774 1 8 . 1 1 32 32 MET N N 32 120.006 120.006 119.813 0.193 18441
2775 1 8 . 1 1 32 32 MET HA H 32 4.359 4.359 4.221 0.138 18441
2776 1 8 . 1 1 32 32 MET CA C 32 58.490 58.490 58.713 -0.223 18441
2777 1 8 . 1 1 32 32 MET CB C 32 31.677 31.677 32.241 -0.564 18441
2778 1 8 . 1 1 32 32 MET H H 32 8.327 8.327 7.932 0.395 18441
2779 1 8 . 1 1 33 33 TYR N N 33 123.220 123.220 120.093 3.127 18441
2780 1 8 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.119 0.605 18441
2781 1 8 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.958 0.042 18441
2782 1 8 . 1 1 33 33 TYR CB C 33 39.687 39.687 38.034 1.653 18441
2783 1 8 . 1 1 33 33 TYR H H 33 8.054 8.054 8.100 -0.046 18441
2784 1 8 . 1 1 34 34 HIS N N 34 120.860 120.860 118.507 2.353 18441
2785 1 8 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.238 -0.462 18441
2786 1 8 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.419 1.291 18441
2787 1 8 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.268 1.124 18441
2788 1 8 . 1 1 34 34 HIS H H 34 8.548 8.548 7.959 0.589 18441
2789 1 8 . 1 1 35 35 GLN N N 35 113.582 113.582 118.331 -4.749 18441
2790 1 8 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.214 -0.214 18441
2791 1 8 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.576 0.104 18441
2792 1 8 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.687 0.863 18441
2793 1 8 . 1 1 35 35 GLN H H 35 7.542 7.542 8.371 -0.829 18441
2794 1 8 . 1 1 36 36 THR N N 36 111.117 111.117 110.517 0.600 18441
2795 1 8 . 1 1 36 36 THR HA H 36 4.214 4.214 4.304 -0.090 18441
2796 1 8 . 1 1 36 36 THR CA C 36 63.980 63.980 63.285 0.695 18441
2797 1 8 . 1 1 36 36 THR CB C 36 71.670 71.670 70.033 1.637 18441
2798 1 8 . 1 1 36 36 THR H H 36 8.569 8.569 8.349 0.220 18441
2799 1 8 . 1 1 37 37 MET N N 37 120.444 120.444 119.073 1.371 18441
2800 1 8 . 1 1 37 37 MET HA H 37 3.740 3.740 4.077 -0.337 18441
2801 1 8 . 1 1 37 37 MET CA C 37 56.430 56.430 55.894 0.536 18441
2802 1 8 . 1 1 37 37 MET CB C 37 31.399 31.399 30.132 1.267 18441
2803 1 8 . 1 1 37 37 MET H H 37 9.542 9.542 7.550 1.992 18441
2804 1 8 . 1 1 38 38 ASP N N 38 117.020 117.020 120.826 -3.806 18441
2805 1 8 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.909 0.035 18441
2806 1 8 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.205 0.271 18441
2807 1 8 . 1 1 38 38 ASP CB C 38 42.040 42.040 43.375 -1.335 18441
2808 1 8 . 1 1 38 38 ASP H H 38 7.456 7.456 7.826 -0.370 18441
2809 1 8 . 1 1 39 39 VAL N N 39 128.507 128.507 124.773 3.734 18441
2810 1 8 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.840 -0.009 18441
2811 1 8 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.551 0.289 18441
2812 1 8 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.361 1.339 18441
2813 1 8 . 1 1 39 39 VAL H H 39 8.425 8.425 8.873 -0.448 18441
2814 1 8 . 1 1 40 40 ALA N N 40 125.621 125.621 123.270 2.351 18441
2815 1 8 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.158 -0.171 18441
2816 1 8 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.162 0.698 18441
2817 1 8 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.139 0.331 18441
2818 1 8 . 1 1 40 40 ALA H H 40 7.998 7.998 8.376 -0.378 18441
2819 1 8 . 1 1 41 41 VAL N N 41 122.132 122.132 119.490 2.642 18441
2820 1 8 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.728 -0.157 18441
2821 1 8 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.957 0.723 18441
2822 1 8 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.562 1.140 18441
2823 1 8 . 1 1 41 41 VAL H H 41 7.663 7.663 8.045 -0.382 18441
2824 1 8 . 1 1 42 42 LEU N N 42 120.190 120.190 120.666 -0.476 18441
2825 1 8 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.964 0.296 18441
2826 1 8 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.167 0.823 18441
2827 1 8 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.844 -1.139 18441
2828 1 8 . 1 1 42 42 LEU H H 42 7.361 7.361 7.458 -0.097 18441
2829 1 8 . 1 1 43 43 VAL N N 43 116.802 116.802 118.025 -1.223 18441
2830 1 8 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.625 -0.208 18441
2831 1 8 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.484 2.296 18441
2832 1 8 . 1 1 43 43 VAL CB C 43 31.980 31.980 31.338 0.642 18441
2833 1 8 . 1 1 43 43 VAL H H 43 8.062 8.062 7.781 0.281 18441
2834 1 8 . 1 1 44 44 GLY N N 44 106.242 106.242 107.873 -1.631 18441
2835 1 8 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.314 1.002 18441
2836 1 8 . 1 1 44 44 GLY H H 44 7.901 7.901 8.138 -0.237 18441
2837 1 8 . 1 1 45 45 ASP N N 45 123.359 123.359 123.346 0.013 18441
2838 1 8 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.516 0.149 18441
2839 1 8 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.063 0.697 18441
2840 1 8 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.853 0.015 18441
2841 1 8 . 1 1 45 45 ASP H H 45 8.680 8.680 7.855 0.825 18441
2842 1 8 . 1 1 46 46 LEU N N 46 123.201 123.201 120.773 2.428 18441
2843 1 8 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.834 0.232 18441
2844 1 8 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.288 -0.168 18441
2845 1 8 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.827 1.172 18441
2846 1 8 . 1 1 46 46 LEU H H 46 9.018 9.018 8.657 0.361 18441
2847 1 8 . 1 1 47 47 LYS N N 47 119.196 119.196 118.706 0.490 18441
2848 1 8 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.010 -0.040 18441
2849 1 8 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.573 0.717 18441
2850 1 8 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.266 0.875 18441
2851 1 8 . 1 1 47 47 LYS H H 47 8.017 8.017 7.723 0.294 18441
2852 1 8 . 1 1 48 48 LEU N N 48 116.358 116.358 118.406 -2.048 18441
2853 1 8 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.946 0.215 18441
2854 1 8 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.820 -0.150 18441
2855 1 8 . 1 1 48 48 LEU CB C 48 42.160 42.160 41.973 0.187 18441
2856 1 8 . 1 1 48 48 LEU H H 48 7.143 7.143 7.386 -0.243 18441
2857 1 8 . 1 1 49 49 VAL N N 49 112.662 112.662 116.017 -3.355 18441
2858 1 8 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.029 0.444 18441
2859 1 8 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.802 -0.742 18441
2860 1 8 . 1 1 49 49 VAL CB C 49 35.166 35.166 33.107 2.059 18441
2861 1 8 . 1 1 49 49 VAL H H 49 7.266 7.266 7.453 -0.187 18441
2862 1 8 . 1 1 50 50 ILE N N 50 124.631 124.631 118.857 5.774 18441
2863 1 8 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.258 -0.413 18441
2864 1 8 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.243 1.347 18441
2865 1 8 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.114 -2.954 18441
2866 1 8 . 1 1 50 50 ILE H H 50 8.475 8.475 7.648 0.827 18441
2867 1 8 . 1 1 51 51 ASN N N 51 119.027 119.027 119.063 -0.036 18441
2868 1 8 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.452 0.255 18441
2869 1 8 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.106 0.342 18441
2870 1 8 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.127 0.834 18441
2871 1 8 . 1 1 51 51 ASN H H 51 7.347 7.347 7.942 -0.595 18441
2872 1 8 . 1 1 52 52 GLU N N 52 115.889 115.889 117.793 -1.904 18441
2873 1 8 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.631 0.257 18441
2874 1 8 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.699 2.086 18441
2875 1 8 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.043 -0.023 18441
2876 1 8 . 1 1 52 52 GLU H H 52 7.438 7.438 7.569 -0.131 18441
2877 1 8 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.147 0.063 18441
2878 1 8 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.358 1.602 18441
2879 1 8 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.782 1.166 18441
2880 1 8 . 1 1 54 54 SER N N 54 113.711 113.711 110.729 2.982 18441
2881 1 8 . 1 1 54 54 SER HA H 54 4.173 4.173 4.282 -0.109 18441
2882 1 8 . 1 1 54 54 SER CA C 54 61.650 61.650 60.270 1.380 18441
2883 1 8 . 1 1 54 54 SER CB C 54 62.930 62.930 63.413 -0.483 18441
2884 1 8 . 1 1 54 54 SER H H 54 8.946 8.946 8.134 0.812 18441
2885 1 8 . 1 1 55 55 ARG N N 55 116.455 116.455 120.262 -3.807 18441
2886 1 8 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.406 -0.002 18441
2887 1 8 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.974 0.336 18441
2888 1 8 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.514 3.098 18441
2889 1 8 . 1 1 55 55 ARG H H 55 7.759 7.759 7.685 0.074 18441
2890 1 8 . 1 1 56 56 LEU N N 56 121.468 121.468 122.947 -1.479 18441
2891 1 8 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.076 0.059 18441
2892 1 8 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.136 -0.236 18441
2893 1 8 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.171 1.826 18441
2894 1 8 . 1 1 56 56 LEU H H 56 7.472 7.472 8.525 -1.053 18441
2895 1 8 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.186 0.510 18441
2896 1 8 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.071 0.109 18441
2897 1 8 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.090 1.300 18441
2898 1 8 . 1 1 58 58 LEU N N 58 119.923 119.923 118.169 1.754 18441
2899 1 8 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.090 -0.040 18441
2900 1 8 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.802 0.518 18441
2901 1 8 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.425 0.603 18441
2902 1 8 . 1 1 58 58 LEU H H 58 8.734 8.734 7.663 1.071 18441
2903 1 8 . 1 1 59 59 PHE N N 59 116.632 116.632 119.975 -3.343 18441
2904 1 8 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.281 0.198 18441
2905 1 8 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.279 1.800 18441
2906 1 8 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.673 0.179 18441
2907 1 8 . 1 1 59 59 PHE H H 59 8.312 8.312 9.013 -0.701 18441
2908 1 8 . 1 1 60 60 ASP N N 60 120.603 120.603 117.483 3.120 18441
2909 1 8 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.445 0.226 18441
2910 1 8 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.619 1.251 18441
2911 1 8 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.852 0.689 18441
2912 1 8 . 1 1 60 60 ASP H H 60 7.462 7.462 7.834 -0.372 18441
2913 1 8 . 1 1 61 61 ALA N N 61 122.470 122.470 122.193 0.277 18441
2914 1 8 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.857 0.404 18441
2915 1 8 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.552 -0.006 18441
2916 1 8 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.860 0.020 18441
2917 1 8 . 1 1 61 61 ALA H H 61 7.664 7.664 7.472 0.192 18441
2918 1 8 . 1 1 62 62 ILE N N 62 115.525 115.525 118.168 -2.643 18441
2919 1 8 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.151 0.531 18441
2920 1 8 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.222 0.198 18441
2921 1 8 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.919 2.236 18441
2922 1 8 . 1 1 62 62 ILE H H 62 7.653 7.653 7.818 -0.165 18441
2923 1 8 . 1 1 63 63 ARG N N 63 121.016 121.016 120.625 0.391 18441
2924 1 8 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.709 -0.235 18441
2925 1 8 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.490 0.880 18441
2926 1 8 . 1 1 63 63 ARG H H 63 6.917 6.917 7.607 -0.690 18441
2927 1 8 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.185 0.126 18441
2928 1 8 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.214 0.526 18441
2929 1 8 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.099 1.088 18441
2930 1 8 . 1 1 65 65 LEU N N 65 114.713 114.713 116.079 -1.366 18441
2931 1 8 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.098 -0.178 18441
2932 1 8 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.006 -0.346 18441
2933 1 8 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.777 0.331 18441
2934 1 8 . 1 1 65 65 LEU H H 65 8.074 8.074 7.462 0.612 18441
2935 1 8 . 1 1 66 66 ILE N N 66 120.129 120.129 119.053 1.076 18441
2936 1 8 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.113 0.192 18441
2937 1 8 . 1 1 66 66 ILE CA C 66 56.760 56.760 60.610 -3.850 18441
2938 1 8 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.507 -0.863 18441
2939 1 8 . 1 1 66 66 ILE H H 66 7.398 7.398 7.271 0.127 18441
2940 1 8 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.342 -0.037 18441
2941 1 8 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.823 0.817 18441
2942 1 8 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.354 0.935 18441
2943 1 8 . 1 1 68 68 LEU N N 68 124.673 124.673 122.403 2.270 18441
2944 1 8 . 1 1 68 68 LEU HA H 68 3.850 3.850 4.113 -0.263 18441
2945 1 8 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.089 0.531 18441
2946 1 8 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.897 0.570 18441
2947 1 8 . 1 1 68 68 LEU H H 68 8.471 8.471 8.380 0.091 18441
2948 1 8 . 1 1 69 69 LYS N N 69 115.247 115.247 118.390 -3.143 18441
2949 1 8 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.091 0.078 18441
2950 1 8 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.462 -0.442 18441
2951 1 8 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.541 0.965 18441
2952 1 8 . 1 1 69 69 LYS H H 69 8.536 8.536 8.654 -0.118 18441
2953 1 8 . 1 1 70 70 HIS N N 70 118.849 118.849 117.592 1.257 18441
2954 1 8 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.373 0.852 18441
2955 1 8 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.622 -3.733 18441
2956 1 8 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.578 5.460 18441
2957 1 8 . 1 1 70 70 HIS H H 70 8.060 8.060 8.563 -0.503 18441
2958 1 8 . 1 1 71 71 GLN N N 71 122.130 122.130 119.195 2.935 18441
2959 1 8 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.051 -0.352 18441
2960 1 8 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.458 2.232 18441
2961 1 8 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.735 0.515 18441
2962 1 8 . 1 1 71 71 GLN H H 71 7.732 7.732 8.480 -0.748 18441
2963 1 8 . 1 1 72 72 VAL N N 72 119.182 119.182 119.537 -0.355 18441
2964 1 8 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.722 0.086 18441
2965 1 8 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.190 1.030 18441
2966 1 8 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.024 0.790 18441
2967 1 8 . 1 1 72 72 VAL H H 72 8.203 8.203 7.733 0.470 18441
2968 1 8 . 1 1 73 73 GLU N N 73 121.878 121.878 119.454 2.424 18441
2969 1 8 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.079 -0.101 18441
2970 1 8 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.074 1.026 18441
2971 1 8 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.619 1.041 18441
2972 1 8 . 1 1 73 73 GLU H H 73 8.136 8.136 7.941 0.195 18441
2973 1 8 . 1 1 74 74 TYR N N 74 119.780 119.780 121.720 -1.940 18441
2974 1 8 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.222 -0.545 18441
2975 1 8 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.014 2.296 18441
2976 1 8 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.373 1.647 18441
2977 1 8 . 1 1 74 74 TYR H H 74 8.491 8.491 8.270 0.221 18441
2978 1 8 . 1 1 75 75 ASP N N 75 120.231 120.231 119.415 0.816 18441
2979 1 8 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.132 0.011 18441
2980 1 8 . 1 1 75 75 ASP CA C 75 57.560 57.560 58.031 -0.471 18441
2981 1 8 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.544 0.034 18441
2982 1 8 . 1 1 75 75 ASP H H 75 8.566 8.566 8.279 0.287 18441
2983 1 8 . 1 1 76 76 GLN N N 76 118.324 118.324 118.346 -0.022 18441
2984 1 8 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.027 0.029 18441
2985 1 8 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.595 -0.165 18441
2986 1 8 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.061 0.369 18441
2987 1 8 . 1 1 76 76 GLN H H 76 7.844 7.844 7.652 0.192 18441
2988 1 8 . 1 1 77 77 LEU N N 77 117.932 117.932 116.745 1.187 18441
2989 1 8 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.078 0.119 18441
2990 1 8 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.968 -0.058 18441
2991 1 8 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.534 2.870 18441
2992 1 8 . 1 1 77 77 LEU H H 77 7.665 7.665 7.646 0.019 18441
2993 1 8 . 1 1 78 78 THR N N 78 110.323 110.323 112.805 -2.482 18441
2994 1 8 . 1 1 78 78 THR HA H 78 3.709 3.709 4.230 -0.521 18441
2995 1 8 . 1 1 78 78 THR CA C 78 59.750 59.750 61.091 -1.341 18441
2996 1 8 . 1 1 78 78 THR CB C 78 69.110 69.110 68.863 0.247 18441
2997 1 8 . 1 1 78 78 THR H H 78 7.130 7.130 7.412 -0.282 18441
2998 1 8 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.486 -0.239 18441
2999 1 8 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.575 1.105 18441
3000 1 8 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.681 -0.290 18441
3001 1 9 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.722 -0.192 18441
3002 1 9 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.639 0.951 18441
3003 1 9 . 1 1 2 2 ASP CB C 2 41.693 41.693 40.878 0.815 18441
3004 1 9 . 1 1 3 3 ARG N N 3 121.498 121.498 120.977 0.521 18441
3005 1 9 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.306 -0.065 18441
3006 1 9 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.628 0.042 18441
3007 1 9 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.581 -0.071 18441
3008 1 9 . 1 1 3 3 ARG H H 3 8.382 8.382 8.191 0.191 18441
3009 1 9 . 1 1 4 4 LYS N N 4 122.257 122.257 121.003 1.254 18441
3010 1 9 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.066 -0.008 18441
3011 1 9 . 1 1 4 4 LYS CA C 4 59.710 59.710 58.976 0.734 18441
3012 1 9 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.765 1.512 18441
3013 1 9 . 1 1 4 4 LYS H H 4 8.226 8.226 8.307 -0.081 18441
3014 1 9 . 1 1 5 5 VAL N N 5 120.494 120.494 118.185 2.309 18441
3015 1 9 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.676 0.045 18441
3016 1 9 . 1 1 5 5 VAL CA C 5 66.650 66.650 66.013 0.637 18441
3017 1 9 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.443 0.631 18441
3018 1 9 . 1 1 5 5 VAL H H 5 8.109 8.109 8.115 -0.006 18441
3019 1 9 . 1 1 6 6 ALA N N 6 123.149 123.149 122.643 0.506 18441
3020 1 9 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.288 -0.253 18441
3021 1 9 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.261 0.629 18441
3022 1 9 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.253 1.007 18441
3023 1 9 . 1 1 6 6 ALA H H 6 8.374 8.374 7.463 0.911 18441
3024 1 9 . 1 1 7 7 ARG N N 7 119.587 119.587 118.134 1.453 18441
3025 1 9 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.831 0.170 18441
3026 1 9 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.229 0.541 18441
3027 1 9 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.008 0.762 18441
3028 1 9 . 1 1 7 7 ARG H H 7 7.992 7.992 7.789 0.203 18441
3029 1 9 . 1 1 8 8 GLU N N 8 119.745 119.745 120.109 -0.364 18441
3030 1 9 . 1 1 8 8 GLU HA H 8 4.058 4.058 3.930 0.128 18441
3031 1 9 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.927 -0.157 18441
3032 1 9 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.609 0.341 18441
3033 1 9 . 1 1 8 8 GLU H H 8 8.165 8.165 8.276 -0.111 18441
3034 1 9 . 1 1 9 9 PHE N N 9 121.436 121.436 119.628 1.808 18441
3035 1 9 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.421 -0.294 18441
3036 1 9 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.960 3.060 18441
3037 1 9 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.663 0.960 18441
3038 1 9 . 1 1 9 9 PHE H H 9 8.180 8.180 8.252 -0.072 18441
3039 1 9 . 1 1 10 10 ARG N N 10 119.028 119.028 119.655 -0.627 18441
3040 1 9 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.520 0.341 18441
3041 1 9 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.408 1.172 18441
3042 1 9 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.082 1.238 18441
3043 1 9 . 1 1 10 10 ARG H H 10 7.910 7.910 7.938 -0.028 18441
3044 1 9 . 1 1 11 11 HIS N N 11 116.563 116.563 117.766 -1.203 18441
3045 1 9 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.251 0.205 18441
3046 1 9 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.761 0.419 18441
3047 1 9 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.771 0.259 18441
3048 1 9 . 1 1 11 11 HIS H H 11 8.001 8.001 8.223 -0.222 18441
3049 1 9 . 1 1 12 12 LYS N N 12 120.773 120.773 119.810 0.963 18441
3050 1 9 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.090 -0.082 18441
3051 1 9 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.561 0.419 18441
3052 1 9 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.504 0.189 18441
3053 1 9 . 1 1 12 12 LYS H H 12 7.796 7.796 7.768 0.028 18441
3054 1 9 . 1 1 13 13 VAL N N 13 120.125 120.125 120.163 -0.038 18441
3055 1 9 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.565 -0.454 18441
3056 1 9 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.433 0.747 18441
3057 1 9 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.800 0.340 18441
3058 1 9 . 1 1 13 13 VAL H H 13 7.821 7.821 7.904 -0.083 18441
3059 1 9 . 1 1 14 14 ASP N N 14 117.462 117.462 119.415 -1.953 18441
3060 1 9 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.350 -0.088 18441
3061 1 9 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.114 0.286 18441
3062 1 9 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.828 0.486 18441
3063 1 9 . 1 1 14 14 ASP H H 14 8.276 8.276 7.846 0.430 18441
3064 1 9 . 1 1 15 15 PHE N N 15 117.914 117.914 120.525 -2.611 18441
3065 1 9 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.326 0.036 18441
3066 1 9 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.542 -0.352 18441
3067 1 9 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.590 1.108 18441
3068 1 9 . 1 1 15 15 PHE H H 15 7.664 7.664 7.797 -0.133 18441
3069 1 9 . 1 1 16 16 LEU N N 16 116.737 116.737 117.450 -0.713 18441
3070 1 9 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.337 -0.103 18441
3071 1 9 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.647 1.773 18441
3072 1 9 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.776 2.302 18441
3073 1 9 . 1 1 16 16 LEU H H 16 7.658 7.658 7.821 -0.163 18441
3074 1 9 . 1 1 17 17 ILE N N 17 120.533 120.533 117.863 2.670 18441
3075 1 9 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.361 -0.253 18441
3076 1 9 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.263 1.277 18441
3077 1 9 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.397 0.960 18441
3078 1 9 . 1 1 17 17 ILE H H 17 8.336 8.336 7.103 1.233 18441
3079 1 9 . 1 1 18 18 GLU N N 18 124.531 124.531 121.441 3.090 18441
3080 1 9 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.187 0.023 18441
3081 1 9 . 1 1 18 18 GLU CA C 18 58.600 58.600 57.720 0.880 18441
3082 1 9 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.503 1.507 18441
3083 1 9 . 1 1 18 18 GLU H H 18 8.276 8.276 8.609 -0.333 18441
3084 1 9 . 1 1 19 19 ASN N N 19 117.630 117.630 117.612 0.018 18441
3085 1 9 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.585 0.220 18441
3086 1 9 . 1 1 19 19 ASN CA C 19 53.738 53.738 55.253 -1.515 18441
3087 1 9 . 1 1 19 19 ASN CB C 19 41.178 41.178 38.624 2.554 18441
3088 1 9 . 1 1 19 19 ASN H H 19 7.700 7.700 8.167 -0.467 18441
3089 1 9 . 1 1 20 20 ASP N N 20 127.428 127.428 118.010 9.418 18441
3090 1 9 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.111 0.138 18441
3091 1 9 . 1 1 20 20 ASP CA C 20 58.850 58.850 57.837 1.013 18441
3092 1 9 . 1 1 20 20 ASP CB C 20 41.314 41.314 39.626 1.688 18441
3093 1 9 . 1 1 20 20 ASP H H 20 8.998 8.998 7.754 1.244 18441
3094 1 9 . 1 1 21 21 ALA N N 21 122.271 122.271 121.342 0.929 18441
3095 1 9 . 1 1 21 21 ALA HA H 21 4.260 4.260 3.971 0.289 18441
3096 1 9 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.356 0.644 18441
3097 1 9 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.525 0.125 18441
3098 1 9 . 1 1 21 21 ALA H H 21 8.346 8.346 8.121 0.225 18441
3099 1 9 . 1 1 22 22 GLU N N 22 118.716 118.716 117.649 1.067 18441
3100 1 9 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.957 0.157 18441
3101 1 9 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.854 0.506 18441
3102 1 9 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.072 2.700 18441
3103 1 9 . 1 1 22 22 GLU H H 22 7.724 7.724 8.899 -1.175 18441
3104 1 9 . 1 1 23 23 LYS N N 23 121.088 121.088 118.293 2.795 18441
3105 1 9 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.777 0.034 18441
3106 1 9 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.060 2.610 18441
3107 1 9 . 1 1 23 23 LYS CB C 23 33.070 33.070 32.206 0.864 18441
3108 1 9 . 1 1 23 23 LYS H H 23 7.618 7.618 7.713 -0.095 18441
3109 1 9 . 1 1 24 24 ASP N N 24 119.010 119.010 120.527 -1.517 18441
3110 1 9 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.552 -0.063 18441
3111 1 9 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.149 1.361 18441
3112 1 9 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.741 0.096 18441
3113 1 9 . 1 1 24 24 ASP H H 24 8.424 8.424 7.823 0.601 18441
3114 1 9 . 1 1 25 25 TYR N N 25 120.417 120.417 121.597 -1.180 18441
3115 1 9 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.140 0.103 18441
3116 1 9 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.883 0.307 18441
3117 1 9 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.525 -0.026 18441
3118 1 9 . 1 1 25 25 TYR H H 25 7.676 7.676 8.270 -0.594 18441
3119 1 9 . 1 1 26 26 LEU N N 26 120.960 120.960 119.631 1.329 18441
3120 1 9 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.854 -0.253 18441
3121 1 9 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.946 0.494 18441
3122 1 9 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.739 0.412 18441
3123 1 9 . 1 1 26 26 LEU H H 26 7.965 7.965 7.917 0.048 18441
3124 1 9 . 1 1 27 27 TYR N N 27 116.521 116.521 117.869 -1.348 18441
3125 1 9 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.088 -0.312 18441
3126 1 9 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.591 4.819 18441
3127 1 9 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.074 1.329 18441
3128 1 9 . 1 1 27 27 TYR H H 27 8.097 8.097 7.540 0.557 18441
3129 1 9 . 1 1 28 28 ASP N N 28 123.384 123.384 120.111 3.273 18441
3130 1 9 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.399 0.077 18441
3131 1 9 . 1 1 28 28 ASP CA C 28 58.540 58.540 58.133 0.407 18441
3132 1 9 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.609 0.785 18441
3133 1 9 . 1 1 28 28 ASP H H 28 8.355 8.355 7.832 0.523 18441
3134 1 9 . 1 1 29 29 VAL N N 29 121.272 121.272 120.281 0.991 18441
3135 1 9 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.668 0.045 18441
3136 1 9 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.708 -0.058 18441
3137 1 9 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.812 0.105 18441
3138 1 9 . 1 1 29 29 VAL H H 29 8.252 8.252 7.610 0.642 18441
3139 1 9 . 1 1 30 30 LEU N N 30 122.443 122.443 120.534 1.909 18441
3140 1 9 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.150 -0.107 18441
3141 1 9 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.453 0.427 18441
3142 1 9 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.721 0.560 18441
3143 1 9 . 1 1 30 30 LEU H H 30 7.987 7.987 7.956 0.031 18441
3144 1 9 . 1 1 31 31 ARG N N 31 122.386 122.386 118.875 3.511 18441
3145 1 9 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.032 -0.016 18441
3146 1 9 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.747 0.633 18441
3147 1 9 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.330 0.070 18441
3148 1 9 . 1 1 31 31 ARG H H 31 8.637 8.637 8.399 0.238 18441
3149 1 9 . 1 1 32 32 MET N N 32 120.006 120.006 119.703 0.303 18441
3150 1 9 . 1 1 32 32 MET HA H 32 4.359 4.359 4.233 0.126 18441
3151 1 9 . 1 1 32 32 MET CA C 32 58.490 58.490 57.814 0.676 18441
3152 1 9 . 1 1 32 32 MET CB C 32 31.677 31.677 32.145 -0.468 18441
3153 1 9 . 1 1 32 32 MET H H 32 8.327 8.327 8.157 0.170 18441
3154 1 9 . 1 1 33 33 TYR N N 33 123.220 123.220 120.803 2.417 18441
3155 1 9 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.239 0.485 18441
3156 1 9 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.038 0.962 18441
3157 1 9 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.871 1.816 18441
3158 1 9 . 1 1 33 33 TYR H H 33 8.054 8.054 8.370 -0.316 18441
3159 1 9 . 1 1 34 34 HIS N N 34 120.860 120.860 118.019 2.841 18441
3160 1 9 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.087 -0.311 18441
3161 1 9 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.541 1.169 18441
3162 1 9 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.180 1.212 18441
3163 1 9 . 1 1 34 34 HIS H H 34 8.548 8.548 8.060 0.488 18441
3164 1 9 . 1 1 35 35 GLN N N 35 113.582 113.582 118.541 -4.959 18441
3165 1 9 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.210 -0.210 18441
3166 1 9 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.334 0.346 18441
3167 1 9 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.474 1.076 18441
3168 1 9 . 1 1 35 35 GLN H H 35 7.542 7.542 8.294 -0.752 18441
3169 1 9 . 1 1 36 36 THR N N 36 111.117 111.117 111.229 -0.112 18441
3170 1 9 . 1 1 36 36 THR HA H 36 4.214 4.214 4.214 -0.000 18441
3171 1 9 . 1 1 36 36 THR CA C 36 63.980 63.980 63.386 0.594 18441
3172 1 9 . 1 1 36 36 THR CB C 36 71.670 71.670 69.670 2.000 18441
3173 1 9 . 1 1 36 36 THR H H 36 8.569 8.569 8.460 0.109 18441
3174 1 9 . 1 1 37 37 MET N N 37 120.444 120.444 118.502 1.942 18441
3175 1 9 . 1 1 37 37 MET HA H 37 3.740 3.740 4.249 -0.509 18441
3176 1 9 . 1 1 37 37 MET CA C 37 56.430 56.430 56.171 0.259 18441
3177 1 9 . 1 1 37 37 MET CB C 37 31.399 31.399 30.565 0.834 18441
3178 1 9 . 1 1 37 37 MET H H 37 9.542 9.542 7.630 1.912 18441
3179 1 9 . 1 1 38 38 ASP N N 38 117.020 117.020 120.796 -3.776 18441
3180 1 9 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.929 0.015 18441
3181 1 9 . 1 1 38 38 ASP CA C 38 53.476 53.476 54.005 -0.529 18441
3182 1 9 . 1 1 38 38 ASP CB C 38 42.040 42.040 41.584 0.456 18441
3183 1 9 . 1 1 38 38 ASP H H 38 7.456 7.456 7.944 -0.488 18441
3184 1 9 . 1 1 39 39 VAL N N 39 128.507 128.507 124.149 4.358 18441
3185 1 9 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.581 0.250 18441
3186 1 9 . 1 1 39 39 VAL CA C 39 64.840 64.840 65.189 -0.349 18441
3187 1 9 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.866 0.834 18441
3188 1 9 . 1 1 39 39 VAL H H 39 8.425 8.425 8.693 -0.268 18441
3189 1 9 . 1 1 40 40 ALA N N 40 125.621 125.621 122.149 3.472 18441
3190 1 9 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.059 -0.072 18441
3191 1 9 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.024 0.836 18441
3192 1 9 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.391 0.079 18441
3193 1 9 . 1 1 40 40 ALA H H 40 7.998 7.998 7.930 0.068 18441
3194 1 9 . 1 1 41 41 VAL N N 41 122.132 122.132 118.526 3.606 18441
3195 1 9 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.732 -0.161 18441
3196 1 9 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.755 0.925 18441
3197 1 9 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.852 0.851 18441
3198 1 9 . 1 1 41 41 VAL H H 41 7.663 7.663 7.651 0.012 18441
3199 1 9 . 1 1 42 42 LEU N N 42 120.190 120.190 119.151 1.039 18441
3200 1 9 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.257 0.003 18441
3201 1 9 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.324 0.666 18441
3202 1 9 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.219 -0.514 18441
3203 1 9 . 1 1 42 42 LEU H H 42 7.361 7.361 7.424 -0.063 18441
3204 1 9 . 1 1 43 43 VAL N N 43 116.802 116.802 119.387 -2.585 18441
3205 1 9 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.771 -0.354 18441
3206 1 9 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.888 1.892 18441
3207 1 9 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.866 1.114 18441
3208 1 9 . 1 1 43 43 VAL H H 43 8.062 8.062 7.827 0.235 18441
3209 1 9 . 1 1 44 44 GLY N N 44 106.242 106.242 108.303 -2.061 18441
3210 1 9 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.281 1.035 18441
3211 1 9 . 1 1 44 44 GLY H H 44 7.901 7.901 7.946 -0.045 18441
3212 1 9 . 1 1 45 45 ASP N N 45 123.359 123.359 123.715 -0.356 18441
3213 1 9 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.542 0.123 18441
3214 1 9 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.472 0.288 18441
3215 1 9 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.681 0.187 18441
3216 1 9 . 1 1 45 45 ASP H H 45 8.680 8.680 7.862 0.818 18441
3217 1 9 . 1 1 46 46 LEU N N 46 123.201 123.201 120.217 2.984 18441
3218 1 9 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.786 0.280 18441
3219 1 9 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.800 0.320 18441
3220 1 9 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.600 1.399 18441
3221 1 9 . 1 1 46 46 LEU H H 46 9.018 9.018 8.357 0.661 18441
3222 1 9 . 1 1 47 47 LYS N N 47 119.196 119.196 118.768 0.428 18441
3223 1 9 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.960 0.010 18441
3224 1 9 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.388 0.902 18441
3225 1 9 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.227 0.914 18441
3226 1 9 . 1 1 47 47 LYS H H 47 8.017 8.017 7.485 0.532 18441
3227 1 9 . 1 1 48 48 LEU N N 48 116.358 116.358 119.219 -2.861 18441
3228 1 9 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.992 0.169 18441
3229 1 9 . 1 1 48 48 LEU CA C 48 57.670 57.670 58.155 -0.485 18441
3230 1 9 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.204 -0.044 18441
3231 1 9 . 1 1 48 48 LEU H H 48 7.143 7.143 7.595 -0.452 18441
3232 1 9 . 1 1 49 49 VAL N N 49 112.662 112.662 114.505 -1.843 18441
3233 1 9 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.966 0.507 18441
3234 1 9 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.424 -0.364 18441
3235 1 9 . 1 1 49 49 VAL CB C 49 35.166 35.166 33.137 2.029 18441
3236 1 9 . 1 1 49 49 VAL H H 49 7.266 7.266 7.462 -0.196 18441
3237 1 9 . 1 1 50 50 ILE N N 50 124.631 124.631 118.422 6.209 18441
3238 1 9 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.160 -0.315 18441
3239 1 9 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.900 0.690 18441
3240 1 9 . 1 1 50 50 ILE CB C 50 35.161 35.161 37.718 -2.557 18441
3241 1 9 . 1 1 50 50 ILE H H 50 8.475 8.475 7.720 0.755 18441
3242 1 9 . 1 1 51 51 ASN N N 51 119.027 119.027 119.262 -0.235 18441
3243 1 9 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.678 0.029 18441
3244 1 9 . 1 1 51 51 ASN CA C 51 53.448 53.448 54.066 -0.618 18441
3245 1 9 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.574 0.387 18441
3246 1 9 . 1 1 51 51 ASN H H 51 7.347 7.347 8.021 -0.674 18441
3247 1 9 . 1 1 52 52 GLU N N 52 115.889 115.889 118.319 -2.430 18441
3248 1 9 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.828 0.060 18441
3249 1 9 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.123 1.663 18441
3250 1 9 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.703 0.317 18441
3251 1 9 . 1 1 52 52 GLU H H 52 7.438 7.438 7.625 -0.187 18441
3252 1 9 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.244 -0.034 18441
3253 1 9 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.171 1.789 18441
3254 1 9 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.878 1.070 18441
3255 1 9 . 1 1 54 54 SER N N 54 113.711 113.711 111.878 1.833 18441
3256 1 9 . 1 1 54 54 SER HA H 54 4.173 4.173 4.339 -0.166 18441
3257 1 9 . 1 1 54 54 SER CA C 54 61.650 61.650 60.183 1.467 18441
3258 1 9 . 1 1 54 54 SER CB C 54 62.930 62.930 63.211 -0.281 18441
3259 1 9 . 1 1 54 54 SER H H 54 8.946 8.946 8.151 0.795 18441
3260 1 9 . 1 1 55 55 ARG N N 55 116.455 116.455 120.032 -3.577 18441
3261 1 9 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.420 -0.016 18441
3262 1 9 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.646 0.664 18441
3263 1 9 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.545 3.067 18441
3264 1 9 . 1 1 55 55 ARG H H 55 7.759 7.759 7.627 0.132 18441
3265 1 9 . 1 1 56 56 LEU N N 56 121.468 121.468 123.133 -1.665 18441
3266 1 9 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.361 -0.226 18441
3267 1 9 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.953 -0.053 18441
3268 1 9 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.470 1.527 18441
3269 1 9 . 1 1 56 56 LEU H H 56 7.472 7.472 8.294 -0.822 18441
3270 1 9 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.220 0.476 18441
3271 1 9 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.488 -0.308 18441
3272 1 9 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.215 1.175 18441
3273 1 9 . 1 1 58 58 LEU N N 58 119.923 119.923 117.571 2.352 18441
3274 1 9 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.138 -0.088 18441
3275 1 9 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.596 0.724 18441
3276 1 9 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.604 0.424 18441
3277 1 9 . 1 1 58 58 LEU H H 58 8.734 8.734 7.617 1.117 18441
3278 1 9 . 1 1 59 59 PHE N N 59 116.632 116.632 120.320 -3.688 18441
3279 1 9 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.385 0.094 18441
3280 1 9 . 1 1 59 59 PHE CA C 59 63.080 63.080 59.738 3.342 18441
3281 1 9 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.907 -0.055 18441
3282 1 9 . 1 1 59 59 PHE H H 59 8.312 8.312 8.808 -0.496 18441
3283 1 9 . 1 1 60 60 ASP N N 60 120.603 120.603 118.709 1.894 18441
3284 1 9 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.517 0.154 18441
3285 1 9 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.751 1.119 18441
3286 1 9 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.099 0.443 18441
3287 1 9 . 1 1 60 60 ASP H H 60 7.462 7.462 7.838 -0.376 18441
3288 1 9 . 1 1 61 61 ALA N N 61 122.470 122.470 122.769 -0.299 18441
3289 1 9 . 1 1 61 61 ALA HA H 61 4.261 4.261 4.095 0.166 18441
3290 1 9 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.304 0.242 18441
3291 1 9 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.941 -0.061 18441
3292 1 9 . 1 1 61 61 ALA H H 61 7.664 7.664 7.743 -0.079 18441
3293 1 9 . 1 1 62 62 ILE N N 62 115.525 115.525 117.877 -2.352 18441
3294 1 9 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.149 0.533 18441
3295 1 9 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.342 0.078 18441
3296 1 9 . 1 1 62 62 ILE CB C 62 40.155 40.155 38.076 2.079 18441
3297 1 9 . 1 1 62 62 ILE H H 62 7.653 7.653 7.502 0.151 18441
3298 1 9 . 1 1 63 63 ARG N N 63 121.016 121.016 120.603 0.413 18441
3299 1 9 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.652 -0.178 18441
3300 1 9 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.169 1.201 18441
3301 1 9 . 1 1 63 63 ARG H H 63 6.917 6.917 7.523 -0.606 18441
3302 1 9 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.149 0.162 18441
3303 1 9 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.248 0.492 18441
3304 1 9 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.025 1.162 18441
3305 1 9 . 1 1 65 65 LEU N N 65 114.713 114.713 116.770 -2.057 18441
3306 1 9 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.072 -0.152 18441
3307 1 9 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.038 -0.378 18441
3308 1 9 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.839 0.269 18441
3309 1 9 . 1 1 65 65 LEU H H 65 8.074 8.074 7.329 0.745 18441
3310 1 9 . 1 1 66 66 ILE N N 66 120.129 120.129 118.930 1.199 18441
3311 1 9 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.093 0.212 18441
3312 1 9 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.710 -4.950 18441
3313 1 9 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.353 -0.709 18441
3314 1 9 . 1 1 66 66 ILE H H 66 7.398 7.398 7.403 -0.005 18441
3315 1 9 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.318 -0.013 18441
3316 1 9 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.791 0.849 18441
3317 1 9 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.284 1.005 18441
3318 1 9 . 1 1 68 68 LEU N N 68 124.673 124.673 122.647 2.026 18441
3319 1 9 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.887 -0.037 18441
3320 1 9 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.582 0.038 18441
3321 1 9 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.732 0.735 18441
3322 1 9 . 1 1 68 68 LEU H H 68 8.471 8.471 8.334 0.137 18441
3323 1 9 . 1 1 69 69 LYS N N 69 115.247 115.247 119.290 -4.043 18441
3324 1 9 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.004 0.165 18441
3325 1 9 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.215 -0.195 18441
3326 1 9 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.982 0.524 18441
3327 1 9 . 1 1 69 69 LYS H H 69 8.536 8.536 8.404 0.132 18441
3328 1 9 . 1 1 70 70 HIS N N 70 118.849 118.849 117.261 1.588 18441
3329 1 9 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.359 0.866 18441
3330 1 9 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.398 -3.509 18441
3331 1 9 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.567 5.471 18441
3332 1 9 . 1 1 70 70 HIS H H 70 8.060 8.060 8.420 -0.360 18441
3333 1 9 . 1 1 71 71 GLN N N 71 122.130 122.130 119.410 2.720 18441
3334 1 9 . 1 1 71 71 GLN HA H 71 3.699 3.699 3.966 -0.267 18441
3335 1 9 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.423 2.267 18441
3336 1 9 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.734 0.516 18441
3337 1 9 . 1 1 71 71 GLN H H 71 7.732 7.732 8.399 -0.667 18441
3338 1 9 . 1 1 72 72 VAL N N 72 119.182 119.182 119.717 -0.535 18441
3339 1 9 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.565 0.243 18441
3340 1 9 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.506 0.714 18441
3341 1 9 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.576 0.238 18441
3342 1 9 . 1 1 72 72 VAL H H 72 8.203 8.203 7.786 0.417 18441
3343 1 9 . 1 1 73 73 GLU N N 73 121.878 121.878 119.662 2.216 18441
3344 1 9 . 1 1 73 73 GLU HA H 73 3.978 3.978 3.989 -0.011 18441
3345 1 9 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.182 0.917 18441
3346 1 9 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.329 1.331 18441
3347 1 9 . 1 1 73 73 GLU H H 73 8.136 8.136 7.862 0.274 18441
3348 1 9 . 1 1 74 74 TYR N N 74 119.780 119.780 120.521 -0.741 18441
3349 1 9 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.063 -0.386 18441
3350 1 9 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.964 1.346 18441
3351 1 9 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.343 1.677 18441
3352 1 9 . 1 1 74 74 TYR H H 74 8.491 8.491 8.109 0.382 18441
3353 1 9 . 1 1 75 75 ASP N N 75 120.231 120.231 118.231 2.000 18441
3354 1 9 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.272 -0.129 18441
3355 1 9 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.300 0.261 18441
3356 1 9 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.692 -0.114 18441
3357 1 9 . 1 1 75 75 ASP H H 75 8.566 8.566 7.877 0.689 18441
3358 1 9 . 1 1 76 76 GLN N N 76 118.324 118.324 117.875 0.449 18441
3359 1 9 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.078 -0.022 18441
3360 1 9 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.134 0.296 18441
3361 1 9 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.887 0.543 18441
3362 1 9 . 1 1 76 76 GLN H H 76 7.844 7.844 7.812 0.032 18441
3363 1 9 . 1 1 77 77 LEU N N 77 117.932 117.932 117.572 0.360 18441
3364 1 9 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.231 -0.034 18441
3365 1 9 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.083 -0.173 18441
3366 1 9 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.097 3.307 18441
3367 1 9 . 1 1 77 77 LEU H H 77 7.665 7.665 7.692 -0.027 18441
3368 1 9 . 1 1 78 78 THR N N 78 110.323 110.323 112.464 -2.141 18441
3369 1 9 . 1 1 78 78 THR HA H 78 3.709 3.709 3.906 -0.197 18441
3370 1 9 . 1 1 78 78 THR CA C 78 59.750 59.750 66.986 -7.236 18441
3371 1 9 . 1 1 78 78 THR CB C 78 69.110 69.110 66.547 2.563 18441
3372 1 9 . 1 1 78 78 THR H H 78 7.130 7.130 7.734 -0.604 18441
3373 1 9 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.305 -0.059 18441
3374 1 9 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.727 -0.047 18441
3375 1 9 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.516 0.875 18441
3376 1 10 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.825 -0.295 18441
3377 1 10 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.688 1.902 18441
3378 1 10 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.000 0.693 18441
3379 1 10 . 1 1 3 3 ARG N N 3 121.498 121.498 120.172 1.326 18441
3380 1 10 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.266 -0.025 18441
3381 1 10 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.548 0.122 18441
3382 1 10 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.441 0.069 18441
3383 1 10 . 1 1 3 3 ARG H H 3 8.382 8.382 8.330 0.052 18441
3384 1 10 . 1 1 4 4 LYS N N 4 122.257 122.257 121.231 1.026 18441
3385 1 10 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.118 -0.060 18441
3386 1 10 . 1 1 4 4 LYS CA C 4 59.710 59.710 58.822 0.888 18441
3387 1 10 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.599 1.677 18441
3388 1 10 . 1 1 4 4 LYS H H 4 8.226 8.226 8.471 -0.245 18441
3389 1 10 . 1 1 5 5 VAL N N 5 120.494 120.494 119.084 1.410 18441
3390 1 10 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.734 -0.013 18441
3391 1 10 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.651 0.999 18441
3392 1 10 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.267 0.807 18441
3393 1 10 . 1 1 5 5 VAL H H 5 8.109 8.109 8.094 0.015 18441
3394 1 10 . 1 1 6 6 ALA N N 6 123.149 123.149 122.885 0.264 18441
3395 1 10 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.261 -0.226 18441
3396 1 10 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.214 0.676 18441
3397 1 10 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.295 0.965 18441
3398 1 10 . 1 1 6 6 ALA H H 6 8.374 8.374 7.635 0.739 18441
3399 1 10 . 1 1 7 7 ARG N N 7 119.587 119.587 118.563 1.024 18441
3400 1 10 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.920 0.081 18441
3401 1 10 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.373 0.397 18441
3402 1 10 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.174 0.596 18441
3403 1 10 . 1 1 7 7 ARG H H 7 7.992 7.992 7.717 0.275 18441
3404 1 10 . 1 1 8 8 GLU N N 8 119.745 119.745 120.327 -0.582 18441
3405 1 10 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.189 -0.131 18441
3406 1 10 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.496 0.274 18441
3407 1 10 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.696 0.254 18441
3408 1 10 . 1 1 8 8 GLU H H 8 8.165 8.165 8.351 -0.186 18441
3409 1 10 . 1 1 9 9 PHE N N 9 121.436 121.436 119.870 1.566 18441
3410 1 10 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.422 -0.295 18441
3411 1 10 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.031 2.989 18441
3412 1 10 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.603 1.020 18441
3413 1 10 . 1 1 9 9 PHE H H 9 8.180 8.180 8.358 -0.178 18441
3414 1 10 . 1 1 10 10 ARG N N 10 119.028 119.028 120.038 -1.010 18441
3415 1 10 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.486 0.374 18441
3416 1 10 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.180 0.400 18441
3417 1 10 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.318 1.002 18441
3418 1 10 . 1 1 10 10 ARG H H 10 7.910 7.910 7.953 -0.043 18441
3419 1 10 . 1 1 11 11 HIS N N 11 116.563 116.563 118.883 -2.320 18441
3420 1 10 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.250 0.206 18441
3421 1 10 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.021 0.159 18441
3422 1 10 . 1 1 11 11 HIS CB C 11 30.030 30.030 30.110 -0.080 18441
3423 1 10 . 1 1 11 11 HIS H H 11 8.001 8.001 8.160 -0.159 18441
3424 1 10 . 1 1 12 12 LYS N N 12 120.773 120.773 119.380 1.393 18441
3425 1 10 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.000 0.008 18441
3426 1 10 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.619 0.361 18441
3427 1 10 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.063 0.630 18441
3428 1 10 . 1 1 12 12 LYS H H 12 7.796 7.796 7.765 0.031 18441
3429 1 10 . 1 1 13 13 VAL N N 13 120.125 120.125 121.589 -1.464 18441
3430 1 10 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.702 -0.591 18441
3431 1 10 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.077 2.103 18441
3432 1 10 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.053 1.087 18441
3433 1 10 . 1 1 13 13 VAL H H 13 7.821 7.821 7.980 -0.159 18441
3434 1 10 . 1 1 14 14 ASP N N 14 117.462 117.462 119.062 -1.600 18441
3435 1 10 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.354 -0.092 18441
3436 1 10 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.267 0.133 18441
3437 1 10 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.931 0.383 18441
3438 1 10 . 1 1 14 14 ASP H H 14 8.276 8.276 7.807 0.469 18441
3439 1 10 . 1 1 15 15 PHE N N 15 117.914 117.914 119.658 -1.744 18441
3440 1 10 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.238 0.124 18441
3441 1 10 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.524 -0.334 18441
3442 1 10 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.339 1.359 18441
3443 1 10 . 1 1 15 15 PHE H H 15 7.664 7.664 7.703 -0.039 18441
3444 1 10 . 1 1 16 16 LEU N N 16 116.737 116.737 117.384 -0.647 18441
3445 1 10 . 1 1 16 16 LEU HA H 16 4.234 4.234 3.972 0.262 18441
3446 1 10 . 1 1 16 16 LEU CA C 16 56.420 56.420 55.669 0.751 18441
3447 1 10 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.441 2.637 18441
3448 1 10 . 1 1 16 16 LEU H H 16 7.658 7.658 8.063 -0.405 18441
3449 1 10 . 1 1 17 17 ILE N N 17 120.533 120.533 117.963 2.570 18441
3450 1 10 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.364 -0.256 18441
3451 1 10 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.765 1.775 18441
3452 1 10 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.155 1.202 18441
3453 1 10 . 1 1 17 17 ILE H H 17 8.336 8.336 7.532 0.804 18441
3454 1 10 . 1 1 18 18 GLU N N 18 124.531 124.531 122.301 2.230 18441
3455 1 10 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.025 0.185 18441
3456 1 10 . 1 1 18 18 GLU CA C 18 58.600 58.600 59.255 -0.655 18441
3457 1 10 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.696 1.314 18441
3458 1 10 . 1 1 18 18 GLU H H 18 8.276 8.276 8.613 -0.337 18441
3459 1 10 . 1 1 19 19 ASN N N 19 117.630 117.630 117.804 -0.174 18441
3460 1 10 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.637 0.168 18441
3461 1 10 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.083 -0.345 18441
3462 1 10 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.402 1.776 18441
3463 1 10 . 1 1 19 19 ASN H H 19 7.700 7.700 7.850 -0.150 18441
3464 1 10 . 1 1 20 20 ASP N N 20 127.428 127.428 119.451 7.977 18441
3465 1 10 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.620 -0.371 18441
3466 1 10 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.843 2.007 18441
3467 1 10 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.118 0.196 18441
3468 1 10 . 1 1 20 20 ASP H H 20 8.998 8.998 8.627 0.371 18441
3469 1 10 . 1 1 21 21 ALA N N 21 122.271 122.271 123.345 -1.074 18441
3470 1 10 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.122 0.138 18441
3471 1 10 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.157 0.843 18441
3472 1 10 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.312 0.338 18441
3473 1 10 . 1 1 21 21 ALA H H 21 8.346 8.346 8.150 0.196 18441
3474 1 10 . 1 1 22 22 GLU N N 22 118.716 118.716 117.970 0.746 18441
3475 1 10 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.954 0.160 18441
3476 1 10 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.056 0.304 18441
3477 1 10 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.072 2.700 18441
3478 1 10 . 1 1 22 22 GLU H H 22 7.724 7.724 8.844 -1.120 18441
3479 1 10 . 1 1 23 23 LYS N N 23 121.088 121.088 117.277 3.811 18441
3480 1 10 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.743 0.068 18441
3481 1 10 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.947 2.723 18441
3482 1 10 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.805 1.265 18441
3483 1 10 . 1 1 23 23 LYS H H 23 7.618 7.618 7.980 -0.362 18441
3484 1 10 . 1 1 24 24 ASP N N 24 119.010 119.010 120.573 -1.563 18441
3485 1 10 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.388 0.101 18441
3486 1 10 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.592 0.918 18441
3487 1 10 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.753 0.084 18441
3488 1 10 . 1 1 24 24 ASP H H 24 8.424 8.424 7.849 0.575 18441
3489 1 10 . 1 1 25 25 TYR N N 25 120.417 120.417 119.618 0.799 18441
3490 1 10 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.242 0.001 18441
3491 1 10 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.915 0.275 18441
3492 1 10 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.612 -0.113 18441
3493 1 10 . 1 1 25 25 TYR H H 25 7.676 7.676 8.036 -0.360 18441
3494 1 10 . 1 1 26 26 LEU N N 26 120.960 120.960 120.680 0.280 18441
3495 1 10 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.865 -0.264 18441
3496 1 10 . 1 1 26 26 LEU CA C 26 59.440 59.440 59.268 0.172 18441
3497 1 10 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.733 0.417 18441
3498 1 10 . 1 1 26 26 LEU H H 26 7.965 7.965 7.876 0.089 18441
3499 1 10 . 1 1 27 27 TYR N N 27 116.521 116.521 117.728 -1.207 18441
3500 1 10 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.093 -0.317 18441
3501 1 10 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.174 5.236 18441
3502 1 10 . 1 1 27 27 TYR CB C 27 38.403 38.403 36.931 1.472 18441
3503 1 10 . 1 1 27 27 TYR H H 27 8.097 8.097 8.284 -0.187 18441
3504 1 10 . 1 1 28 28 ASP N N 28 123.384 123.384 120.227 3.157 18441
3505 1 10 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.428 0.048 18441
3506 1 10 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.690 0.851 18441
3507 1 10 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.185 1.209 18441
3508 1 10 . 1 1 28 28 ASP H H 28 8.355 8.355 7.946 0.409 18441
3509 1 10 . 1 1 29 29 VAL N N 29 121.272 121.272 120.987 0.285 18441
3510 1 10 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.612 0.101 18441
3511 1 10 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.087 -0.437 18441
3512 1 10 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.912 0.006 18441
3513 1 10 . 1 1 29 29 VAL H H 29 8.252 8.252 7.837 0.415 18441
3514 1 10 . 1 1 30 30 LEU N N 30 122.443 122.443 119.663 2.780 18441
3515 1 10 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.038 0.005 18441
3516 1 10 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.309 0.571 18441
3517 1 10 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.437 0.844 18441
3518 1 10 . 1 1 30 30 LEU H H 30 7.987 7.987 8.103 -0.116 18441
3519 1 10 . 1 1 31 31 ARG N N 31 122.386 122.386 118.326 4.060 18441
3520 1 10 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.087 -0.071 18441
3521 1 10 . 1 1 31 31 ARG CA C 31 60.380 60.380 58.511 1.869 18441
3522 1 10 . 1 1 31 31 ARG CB C 31 30.400 30.400 29.739 0.661 18441
3523 1 10 . 1 1 31 31 ARG H H 31 8.637 8.637 8.192 0.445 18441
3524 1 10 . 1 1 32 32 MET N N 32 120.006 120.006 119.023 0.983 18441
3525 1 10 . 1 1 32 32 MET HA H 32 4.359 4.359 4.222 0.137 18441
3526 1 10 . 1 1 32 32 MET CA C 32 58.490 58.490 58.777 -0.287 18441
3527 1 10 . 1 1 32 32 MET CB C 32 31.677 31.677 32.042 -0.365 18441
3528 1 10 . 1 1 32 32 MET H H 32 8.327 8.327 8.223 0.104 18441
3529 1 10 . 1 1 33 33 TYR N N 33 123.220 123.220 120.813 2.407 18441
3530 1 10 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.363 0.361 18441
3531 1 10 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.497 0.503 18441
3532 1 10 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.785 1.902 18441
3533 1 10 . 1 1 33 33 TYR H H 33 8.054 8.054 8.491 -0.437 18441
3534 1 10 . 1 1 34 34 HIS N N 34 120.860 120.860 117.244 3.616 18441
3535 1 10 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.068 -0.292 18441
3536 1 10 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.093 1.617 18441
3537 1 10 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.373 1.019 18441
3538 1 10 . 1 1 34 34 HIS H H 34 8.548 8.548 7.956 0.592 18441
3539 1 10 . 1 1 35 35 GLN N N 35 113.582 113.582 118.674 -5.092 18441
3540 1 10 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.186 -0.186 18441
3541 1 10 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.514 0.167 18441
3542 1 10 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.349 1.201 18441
3543 1 10 . 1 1 35 35 GLN H H 35 7.542 7.542 8.411 -0.869 18441
3544 1 10 . 1 1 36 36 THR N N 36 111.117 111.117 111.563 -0.446 18441
3545 1 10 . 1 1 36 36 THR HA H 36 4.214 4.214 4.194 0.020 18441
3546 1 10 . 1 1 36 36 THR CA C 36 63.980 63.980 63.474 0.506 18441
3547 1 10 . 1 1 36 36 THR CB C 36 71.670 71.670 69.697 1.973 18441
3548 1 10 . 1 1 36 36 THR H H 36 8.569 8.569 8.405 0.164 18441
3549 1 10 . 1 1 37 37 MET N N 37 120.444 120.444 117.795 2.649 18441
3550 1 10 . 1 1 37 37 MET HA H 37 3.740 3.740 4.198 -0.458 18441
3551 1 10 . 1 1 37 37 MET CA C 37 56.430 56.430 56.703 -0.273 18441
3552 1 10 . 1 1 37 37 MET CB C 37 31.399 31.399 30.549 0.850 18441
3553 1 10 . 1 1 37 37 MET H H 37 9.542 9.542 7.384 2.158 18441
3554 1 10 . 1 1 38 38 ASP N N 38 117.020 117.020 120.642 -3.622 18441
3555 1 10 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.893 0.051 18441
3556 1 10 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.542 -0.066 18441
3557 1 10 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.803 -0.763 18441
3558 1 10 . 1 1 38 38 ASP H H 38 7.456 7.456 7.758 -0.302 18441
3559 1 10 . 1 1 39 39 VAL N N 39 128.507 128.507 125.999 2.508 18441
3560 1 10 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.716 0.115 18441
3561 1 10 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.423 0.417 18441
3562 1 10 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.774 0.926 18441
3563 1 10 . 1 1 39 39 VAL H H 39 8.425 8.425 8.790 -0.365 18441
3564 1 10 . 1 1 40 40 ALA N N 40 125.621 125.621 122.916 2.705 18441
3565 1 10 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.175 -0.188 18441
3566 1 10 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.435 0.425 18441
3567 1 10 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.308 0.162 18441
3568 1 10 . 1 1 40 40 ALA H H 40 7.998 7.998 8.090 -0.092 18441
3569 1 10 . 1 1 41 41 VAL N N 41 122.132 122.132 119.216 2.916 18441
3570 1 10 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.798 -0.227 18441
3571 1 10 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.226 1.454 18441
3572 1 10 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.456 1.246 18441
3573 1 10 . 1 1 41 41 VAL H H 41 7.663 7.663 7.710 -0.047 18441
3574 1 10 . 1 1 42 42 LEU N N 42 120.190 120.190 118.331 1.859 18441
3575 1 10 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.155 0.105 18441
3576 1 10 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.420 0.570 18441
3577 1 10 . 1 1 42 42 LEU CB C 42 40.705 40.705 40.833 -0.128 18441
3578 1 10 . 1 1 42 42 LEU H H 42 7.361 7.361 7.279 0.082 18441
3579 1 10 . 1 1 43 43 VAL N N 43 116.802 116.802 119.492 -2.690 18441
3580 1 10 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.538 -0.121 18441
3581 1 10 . 1 1 43 43 VAL CA C 43 68.780 68.780 67.001 1.780 18441
3582 1 10 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.872 1.109 18441
3583 1 10 . 1 1 43 43 VAL H H 43 8.062 8.062 7.787 0.275 18441
3584 1 10 . 1 1 44 44 GLY N N 44 106.242 106.242 108.297 -2.055 18441
3585 1 10 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.280 1.036 18441
3586 1 10 . 1 1 44 44 GLY H H 44 7.901 7.901 7.857 0.044 18441
3587 1 10 . 1 1 45 45 ASP N N 45 123.359 123.359 123.463 -0.104 18441
3588 1 10 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.568 0.097 18441
3589 1 10 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.323 0.437 18441
3590 1 10 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.435 0.433 18441
3591 1 10 . 1 1 45 45 ASP H H 45 8.680 8.680 7.821 0.859 18441
3592 1 10 . 1 1 46 46 LEU N N 46 123.201 123.201 120.267 2.934 18441
3593 1 10 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.940 0.126 18441
3594 1 10 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.067 0.053 18441
3595 1 10 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.836 1.163 18441
3596 1 10 . 1 1 46 46 LEU H H 46 9.018 9.018 8.617 0.401 18441
3597 1 10 . 1 1 47 47 LYS N N 47 119.196 119.196 119.212 -0.016 18441
3598 1 10 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.137 -0.167 18441
3599 1 10 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.251 1.039 18441
3600 1 10 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.029 1.111 18441
3601 1 10 . 1 1 47 47 LYS H H 47 8.017 8.017 7.833 0.184 18441
3602 1 10 . 1 1 48 48 LEU N N 48 116.358 116.358 119.842 -3.484 18441
3603 1 10 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.088 0.073 18441
3604 1 10 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.657 0.013 18441
3605 1 10 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.554 -0.394 18441
3606 1 10 . 1 1 48 48 LEU H H 48 7.143 7.143 7.663 -0.520 18441
3607 1 10 . 1 1 49 49 VAL N N 49 112.662 112.662 115.707 -3.045 18441
3608 1 10 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.147 0.326 18441
3609 1 10 . 1 1 49 49 VAL CA C 49 62.060 62.060 63.204 -1.144 18441
3610 1 10 . 1 1 49 49 VAL CB C 49 35.166 35.166 33.077 2.089 18441
3611 1 10 . 1 1 49 49 VAL H H 49 7.266 7.266 7.750 -0.484 18441
3612 1 10 . 1 1 50 50 ILE N N 50 124.631 124.631 119.377 5.254 18441
3613 1 10 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.337 -0.492 18441
3614 1 10 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.565 1.025 18441
3615 1 10 . 1 1 50 50 ILE CB C 50 35.161 35.161 39.187 -4.026 18441
3616 1 10 . 1 1 50 50 ILE H H 50 8.475 8.475 7.616 0.859 18441
3617 1 10 . 1 1 51 51 ASN N N 51 119.027 119.027 118.861 0.166 18441
3618 1 10 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.546 0.161 18441
3619 1 10 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.120 0.328 18441
3620 1 10 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.143 0.818 18441
3621 1 10 . 1 1 51 51 ASN H H 51 7.347 7.347 8.057 -0.710 18441
3622 1 10 . 1 1 52 52 GLU N N 52 115.889 115.889 118.951 -3.062 18441
3623 1 10 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.752 0.136 18441
3624 1 10 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.012 1.773 18441
3625 1 10 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.498 0.522 18441
3626 1 10 . 1 1 52 52 GLU H H 52 7.438 7.438 7.279 0.159 18441
3627 1 10 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.158 0.052 18441
3628 1 10 . 1 1 53 53 PRO CA C 53 66.960 66.960 66.145 0.815 18441
3629 1 10 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.794 1.153 18441
3630 1 10 . 1 1 54 54 SER N N 54 113.711 113.711 111.362 2.349 18441
3631 1 10 . 1 1 54 54 SER HA H 54 4.173 4.173 4.314 -0.141 18441
3632 1 10 . 1 1 54 54 SER CA C 54 61.650 61.650 60.341 1.309 18441
3633 1 10 . 1 1 54 54 SER CB C 54 62.930 62.930 63.380 -0.450 18441
3634 1 10 . 1 1 54 54 SER H H 54 8.946 8.946 8.285 0.661 18441
3635 1 10 . 1 1 55 55 ARG N N 55 116.455 116.455 120.617 -4.162 18441
3636 1 10 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.328 0.076 18441
3637 1 10 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.251 0.059 18441
3638 1 10 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.606 3.006 18441
3639 1 10 . 1 1 55 55 ARG H H 55 7.759 7.759 7.839 -0.080 18441
3640 1 10 . 1 1 56 56 LEU N N 56 121.468 121.468 123.008 -1.540 18441
3641 1 10 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.085 0.050 18441
3642 1 10 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.228 -0.328 18441
3643 1 10 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.160 1.837 18441
3644 1 10 . 1 1 56 56 LEU H H 56 7.472 7.472 8.609 -1.137 18441
3645 1 10 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.174 0.522 18441
3646 1 10 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.084 0.096 18441
3647 1 10 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.092 1.298 18441
3648 1 10 . 1 1 58 58 LEU N N 58 119.923 119.923 118.227 1.696 18441
3649 1 10 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.005 0.045 18441
3650 1 10 . 1 1 58 58 LEU CA C 58 58.320 58.320 58.098 0.222 18441
3651 1 10 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.899 0.129 18441
3652 1 10 . 1 1 58 58 LEU H H 58 8.734 8.734 7.834 0.900 18441
3653 1 10 . 1 1 59 59 PHE N N 59 116.632 116.632 119.378 -2.746 18441
3654 1 10 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.325 0.154 18441
3655 1 10 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.361 1.719 18441
3656 1 10 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.863 -0.011 18441
3657 1 10 . 1 1 59 59 PHE H H 59 8.312 8.312 9.051 -0.739 18441
3658 1 10 . 1 1 60 60 ASP N N 60 120.603 120.603 119.184 1.419 18441
3659 1 10 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.521 0.150 18441
3660 1 10 . 1 1 60 60 ASP CA C 60 57.870 57.870 57.518 0.352 18441
3661 1 10 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.678 0.863 18441
3662 1 10 . 1 1 60 60 ASP H H 60 7.462 7.462 7.764 -0.302 18441
3663 1 10 . 1 1 61 61 ALA N N 61 122.470 122.470 123.263 -0.793 18441
3664 1 10 . 1 1 61 61 ALA HA H 61 4.261 4.261 4.010 0.251 18441
3665 1 10 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.540 0.006 18441
3666 1 10 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.303 0.577 18441
3667 1 10 . 1 1 61 61 ALA H H 61 7.664 7.664 7.881 -0.217 18441
3668 1 10 . 1 1 62 62 ILE N N 62 115.525 115.525 118.313 -2.788 18441
3669 1 10 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.106 0.576 18441
3670 1 10 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.514 -0.094 18441
3671 1 10 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.857 2.298 18441
3672 1 10 . 1 1 62 62 ILE H H 62 7.653 7.653 7.356 0.297 18441
3673 1 10 . 1 1 63 63 ARG N N 63 121.016 121.016 120.495 0.521 18441
3674 1 10 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.469 0.005 18441
3675 1 10 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.277 1.093 18441
3676 1 10 . 1 1 63 63 ARG H H 63 6.917 6.917 7.334 -0.417 18441
3677 1 10 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.150 0.161 18441
3678 1 10 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.533 0.207 18441
3679 1 10 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.017 1.170 18441
3680 1 10 . 1 1 65 65 LEU N N 65 114.713 114.713 115.121 -0.408 18441
3681 1 10 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.030 -0.110 18441
3682 1 10 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.169 -0.508 18441
3683 1 10 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.800 0.308 18441
3684 1 10 . 1 1 65 65 LEU H H 65 8.074 8.074 7.344 0.730 18441
3685 1 10 . 1 1 66 66 ILE N N 66 120.129 120.129 119.040 1.089 18441
3686 1 10 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.024 0.281 18441
3687 1 10 . 1 1 66 66 ILE CA C 66 56.760 56.760 62.134 -5.374 18441
3688 1 10 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.436 -0.792 18441
3689 1 10 . 1 1 66 66 ILE H H 66 7.398 7.398 7.462 -0.064 18441
3690 1 10 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.337 -0.032 18441
3691 1 10 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.692 0.948 18441
3692 1 10 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.382 0.907 18441
3693 1 10 . 1 1 68 68 LEU N N 68 124.673 124.673 122.085 2.588 18441
3694 1 10 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.918 -0.068 18441
3695 1 10 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.277 0.343 18441
3696 1 10 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.723 0.744 18441
3697 1 10 . 1 1 68 68 LEU H H 68 8.471 8.471 8.364 0.107 18441
3698 1 10 . 1 1 69 69 LYS N N 69 115.247 115.247 118.394 -3.147 18441
3699 1 10 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.055 0.114 18441
3700 1 10 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.266 -0.246 18441
3701 1 10 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.875 0.631 18441
3702 1 10 . 1 1 69 69 LYS H H 69 8.536 8.536 8.443 0.093 18441
3703 1 10 . 1 1 70 70 HIS N N 70 118.849 118.849 117.776 1.073 18441
3704 1 10 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.395 0.830 18441
3705 1 10 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.129 -3.240 18441
3706 1 10 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.404 5.634 18441
3707 1 10 . 1 1 70 70 HIS H H 70 8.060 8.060 8.436 -0.376 18441
3708 1 10 . 1 1 71 71 GLN N N 71 122.130 122.130 119.982 2.148 18441
3709 1 10 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.103 -0.404 18441
3710 1 10 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.685 2.005 18441
3711 1 10 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.848 0.402 18441
3712 1 10 . 1 1 71 71 GLN H H 71 7.732 7.732 8.463 -0.731 18441
3713 1 10 . 1 1 72 72 VAL N N 72 119.182 119.182 120.004 -0.822 18441
3714 1 10 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.728 0.080 18441
3715 1 10 . 1 1 72 72 VAL CA C 72 67.220 67.220 65.882 1.338 18441
3716 1 10 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.794 0.019 18441
3717 1 10 . 1 1 72 72 VAL H H 72 8.203 8.203 7.914 0.289 18441
3718 1 10 . 1 1 73 73 GLU N N 73 121.878 121.878 120.199 1.679 18441
3719 1 10 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.232 -0.254 18441
3720 1 10 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.269 0.831 18441
3721 1 10 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.431 1.229 18441
3722 1 10 . 1 1 73 73 GLU H H 73 8.136 8.136 7.843 0.293 18441
3723 1 10 . 1 1 74 74 TYR N N 74 119.780 119.780 120.494 -0.714 18441
3724 1 10 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.071 -0.394 18441
3725 1 10 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.686 1.624 18441
3726 1 10 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.595 1.425 18441
3727 1 10 . 1 1 74 74 TYR H H 74 8.491 8.491 8.414 0.077 18441
3728 1 10 . 1 1 75 75 ASP N N 75 120.231 120.231 119.586 0.645 18441
3729 1 10 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.347 -0.204 18441
3730 1 10 . 1 1 75 75 ASP CA C 75 57.560 57.560 58.019 -0.459 18441
3731 1 10 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.781 -0.203 18441
3732 1 10 . 1 1 75 75 ASP H H 75 8.566 8.566 8.709 -0.143 18441
3733 1 10 . 1 1 76 76 GLN N N 76 118.324 118.324 119.438 -1.114 18441
3734 1 10 . 1 1 76 76 GLN HA H 76 4.056 4.056 3.998 0.058 18441
3735 1 10 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.762 -0.332 18441
3736 1 10 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.953 0.477 18441
3737 1 10 . 1 1 76 76 GLN H H 76 7.844 7.844 7.604 0.240 18441
3738 1 10 . 1 1 77 77 LEU N N 77 117.932 117.932 116.230 1.702 18441
3739 1 10 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.043 0.154 18441
3740 1 10 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.317 -0.407 18441
3741 1 10 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.206 3.198 18441
3742 1 10 . 1 1 77 77 LEU H H 77 7.665 7.665 7.536 0.129 18441
3743 1 10 . 1 1 78 78 THR N N 78 110.323 110.323 110.432 -0.109 18441
3744 1 10 . 1 1 78 78 THR HA H 78 3.709 3.709 4.472 -0.763 18441
3745 1 10 . 1 1 78 78 THR CA C 78 59.750 59.750 59.283 0.466 18441
3746 1 10 . 1 1 78 78 THR CB C 78 69.110 69.110 70.262 -1.152 18441
3747 1 10 . 1 1 78 78 THR H H 78 7.130 7.130 7.386 -0.256 18441
3748 1 10 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.290 -0.044 18441
3749 1 10 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.185 0.495 18441
3750 1 10 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.531 0.860 18441
3751 1 11 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.887 -0.357 18441
3752 1 11 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.478 2.112 18441
3753 1 11 . 1 1 2 2 ASP CB C 2 41.693 41.693 43.003 -1.310 18441
3754 1 11 . 1 1 3 3 ARG N N 3 121.498 121.498 120.774 0.724 18441
3755 1 11 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.166 0.075 18441
3756 1 11 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.690 -1.020 18441
3757 1 11 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.647 -0.137 18441
3758 1 11 . 1 1 3 3 ARG H H 3 8.382 8.382 8.496 -0.114 18441
3759 1 11 . 1 1 4 4 LYS N N 4 122.257 122.257 119.394 2.863 18441
3760 1 11 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.127 -0.069 18441
3761 1 11 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.247 0.463 18441
3762 1 11 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.976 1.300 18441
3763 1 11 . 1 1 4 4 LYS H H 4 8.226 8.226 8.367 -0.141 18441
3764 1 11 . 1 1 5 5 VAL N N 5 120.494 120.494 118.781 1.713 18441
3765 1 11 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.806 -0.085 18441
3766 1 11 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.999 0.651 18441
3767 1 11 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.207 0.867 18441
3768 1 11 . 1 1 5 5 VAL H H 5 8.109 8.109 7.945 0.164 18441
3769 1 11 . 1 1 6 6 ALA N N 6 123.149 123.149 122.855 0.294 18441
3770 1 11 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.294 -0.259 18441
3771 1 11 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.302 0.588 18441
3772 1 11 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.383 0.878 18441
3773 1 11 . 1 1 6 6 ALA H H 6 8.374 8.374 7.454 0.920 18441
3774 1 11 . 1 1 7 7 ARG N N 7 119.587 119.587 118.530 1.057 18441
3775 1 11 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.913 0.088 18441
3776 1 11 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.496 0.274 18441
3777 1 11 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.106 0.664 18441
3778 1 11 . 1 1 7 7 ARG H H 7 7.992 7.992 7.775 0.217 18441
3779 1 11 . 1 1 8 8 GLU N N 8 119.745 119.745 120.463 -0.718 18441
3780 1 11 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.161 -0.103 18441
3781 1 11 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.488 0.282 18441
3782 1 11 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.711 0.239 18441
3783 1 11 . 1 1 8 8 GLU H H 8 8.165 8.165 8.000 0.165 18441
3784 1 11 . 1 1 9 9 PHE N N 9 121.436 121.436 119.814 1.622 18441
3785 1 11 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.388 -0.261 18441
3786 1 11 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.046 2.974 18441
3787 1 11 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.577 1.046 18441
3788 1 11 . 1 1 9 9 PHE H H 9 8.180 8.180 8.130 0.050 18441
3789 1 11 . 1 1 10 10 ARG N N 10 119.028 119.028 119.876 -0.848 18441
3790 1 11 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.366 0.495 18441
3791 1 11 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.337 0.243 18441
3792 1 11 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.433 0.887 18441
3793 1 11 . 1 1 10 10 ARG H H 10 7.910 7.910 7.975 -0.065 18441
3794 1 11 . 1 1 11 11 HIS N N 11 116.563 116.563 118.579 -2.016 18441
3795 1 11 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.246 0.210 18441
3796 1 11 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.045 0.135 18441
3797 1 11 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.933 0.097 18441
3798 1 11 . 1 1 11 11 HIS H H 11 8.001 8.001 8.214 -0.213 18441
3799 1 11 . 1 1 12 12 LYS N N 12 120.773 120.773 118.750 2.023 18441
3800 1 11 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.051 -0.043 18441
3801 1 11 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.691 0.288 18441
3802 1 11 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.348 0.345 18441
3803 1 11 . 1 1 12 12 LYS H H 12 7.796 7.796 7.696 0.100 18441
3804 1 11 . 1 1 13 13 VAL N N 13 120.125 120.125 119.887 0.238 18441
3805 1 11 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.734 -0.623 18441
3806 1 11 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.264 1.916 18441
3807 1 11 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.414 0.726 18441
3808 1 11 . 1 1 13 13 VAL H H 13 7.821 7.821 7.838 -0.017 18441
3809 1 11 . 1 1 14 14 ASP N N 14 117.462 117.462 119.569 -2.107 18441
3810 1 11 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.350 -0.088 18441
3811 1 11 . 1 1 14 14 ASP CA C 14 57.400 57.400 56.965 0.435 18441
3812 1 11 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.806 0.508 18441
3813 1 11 . 1 1 14 14 ASP H H 14 8.276 8.276 7.822 0.454 18441
3814 1 11 . 1 1 15 15 PHE N N 15 117.914 117.914 118.501 -0.587 18441
3815 1 11 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.307 0.055 18441
3816 1 11 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.389 -0.199 18441
3817 1 11 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.555 1.143 18441
3818 1 11 . 1 1 15 15 PHE H H 15 7.664 7.664 7.858 -0.194 18441
3819 1 11 . 1 1 16 16 LEU N N 16 116.737 116.737 116.600 0.137 18441
3820 1 11 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.275 -0.041 18441
3821 1 11 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.278 2.142 18441
3822 1 11 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.365 2.713 18441
3823 1 11 . 1 1 16 16 LEU H H 16 7.658 7.658 7.686 -0.028 18441
3824 1 11 . 1 1 17 17 ILE N N 17 120.533 120.533 117.276 3.257 18441
3825 1 11 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.325 -0.217 18441
3826 1 11 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.096 1.444 18441
3827 1 11 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.348 1.009 18441
3828 1 11 . 1 1 17 17 ILE H H 17 8.336 8.336 7.160 1.176 18441
3829 1 11 . 1 1 18 18 GLU N N 18 124.531 124.531 122.381 2.150 18441
3830 1 11 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.083 0.127 18441
3831 1 11 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.571 0.029 18441
3832 1 11 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.715 1.296 18441
3833 1 11 . 1 1 18 18 GLU H H 18 8.276 8.276 8.532 -0.256 18441
3834 1 11 . 1 1 19 19 ASN N N 19 117.630 117.630 117.249 0.381 18441
3835 1 11 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.652 0.153 18441
3836 1 11 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.214 0.524 18441
3837 1 11 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.818 1.360 18441
3838 1 11 . 1 1 19 19 ASN H H 19 7.700 7.700 7.966 -0.266 18441
3839 1 11 . 1 1 20 20 ASP N N 20 127.428 127.428 122.305 5.123 18441
3840 1 11 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.505 -0.256 18441
3841 1 11 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.626 2.224 18441
3842 1 11 . 1 1 20 20 ASP CB C 20 41.314 41.314 40.687 0.627 18441
3843 1 11 . 1 1 20 20 ASP H H 20 8.998 8.998 8.656 0.342 18441
3844 1 11 . 1 1 21 21 ALA N N 21 122.271 122.271 122.689 -0.418 18441
3845 1 11 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.039 0.221 18441
3846 1 11 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.192 0.808 18441
3847 1 11 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.207 0.443 18441
3848 1 11 . 1 1 21 21 ALA H H 21 8.346 8.346 8.160 0.186 18441
3849 1 11 . 1 1 22 22 GLU N N 22 118.716 118.716 118.665 0.051 18441
3850 1 11 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.937 0.177 18441
3851 1 11 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.549 0.811 18441
3852 1 11 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.002 2.770 18441
3853 1 11 . 1 1 22 22 GLU H H 22 7.724 7.724 8.664 -0.940 18441
3854 1 11 . 1 1 23 23 LYS N N 23 121.088 121.088 117.464 3.624 18441
3855 1 11 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.820 -0.009 18441
3856 1 11 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.873 2.797 18441
3857 1 11 . 1 1 23 23 LYS CB C 23 33.070 33.070 32.010 1.060 18441
3858 1 11 . 1 1 23 23 LYS H H 23 7.618 7.618 7.731 -0.113 18441
3859 1 11 . 1 1 24 24 ASP N N 24 119.010 119.010 120.513 -1.503 18441
3860 1 11 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.308 0.181 18441
3861 1 11 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.424 1.086 18441
3862 1 11 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.834 0.003 18441
3863 1 11 . 1 1 24 24 ASP H H 24 8.424 8.424 7.604 0.820 18441
3864 1 11 . 1 1 25 25 TYR N N 25 120.417 120.417 119.880 0.537 18441
3865 1 11 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.132 0.111 18441
3866 1 11 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.193 0.997 18441
3867 1 11 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.455 0.044 18441
3868 1 11 . 1 1 25 25 TYR H H 25 7.676 7.676 8.352 -0.676 18441
3869 1 11 . 1 1 26 26 LEU N N 26 120.960 120.960 119.900 1.060 18441
3870 1 11 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.872 -0.271 18441
3871 1 11 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.728 0.712 18441
3872 1 11 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.466 0.685 18441
3873 1 11 . 1 1 26 26 LEU H H 26 7.965 7.965 7.855 0.110 18441
3874 1 11 . 1 1 27 27 TYR N N 27 116.521 116.521 117.813 -1.292 18441
3875 1 11 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.110 -0.334 18441
3876 1 11 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.066 5.344 18441
3877 1 11 . 1 1 27 27 TYR CB C 27 38.403 38.403 36.982 1.421 18441
3878 1 11 . 1 1 27 27 TYR H H 27 8.097 8.097 7.726 0.371 18441
3879 1 11 . 1 1 28 28 ASP N N 28 123.384 123.384 119.654 3.730 18441
3880 1 11 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.476 -0.000 18441
3881 1 11 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.166 1.374 18441
3882 1 11 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.673 0.721 18441
3883 1 11 . 1 1 28 28 ASP H H 28 8.355 8.355 7.781 0.574 18441
3884 1 11 . 1 1 29 29 VAL N N 29 121.272 121.272 120.524 0.748 18441
3885 1 11 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.483 0.230 18441
3886 1 11 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.291 -0.641 18441
3887 1 11 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.841 0.077 18441
3888 1 11 . 1 1 29 29 VAL H H 29 8.252 8.252 8.015 0.237 18441
3889 1 11 . 1 1 30 30 LEU N N 30 122.443 122.443 119.576 2.867 18441
3890 1 11 . 1 1 30 30 LEU HA H 30 4.043 4.043 3.995 0.048 18441
3891 1 11 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.236 0.644 18441
3892 1 11 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.581 0.700 18441
3893 1 11 . 1 1 30 30 LEU H H 30 7.987 7.987 8.428 -0.441 18441
3894 1 11 . 1 1 31 31 ARG N N 31 122.386 122.386 118.580 3.806 18441
3895 1 11 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.015 0.001 18441
3896 1 11 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.636 0.744 18441
3897 1 11 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.065 0.335 18441
3898 1 11 . 1 1 31 31 ARG H H 31 8.637 8.637 8.022 0.615 18441
3899 1 11 . 1 1 32 32 MET N N 32 120.006 120.006 119.135 0.871 18441
3900 1 11 . 1 1 32 32 MET HA H 32 4.359 4.359 4.175 0.184 18441
3901 1 11 . 1 1 32 32 MET CA C 32 58.490 58.490 58.067 0.423 18441
3902 1 11 . 1 1 32 32 MET CB C 32 31.677 31.677 31.630 0.047 18441
3903 1 11 . 1 1 32 32 MET H H 32 8.327 8.327 7.901 0.426 18441
3904 1 11 . 1 1 33 33 TYR N N 33 123.220 123.220 120.580 2.640 18441
3905 1 11 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.150 0.574 18441
3906 1 11 . 1 1 33 33 TYR CA C 33 61.000 61.000 61.000 0.000 18441
3907 1 11 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.893 1.794 18441
3908 1 11 . 1 1 33 33 TYR H H 33 8.054 8.054 8.118 -0.064 18441
3909 1 11 . 1 1 34 34 HIS N N 34 120.860 120.860 117.669 3.191 18441
3910 1 11 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.179 -0.403 18441
3911 1 11 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.146 1.564 18441
3912 1 11 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.225 1.167 18441
3913 1 11 . 1 1 34 34 HIS H H 34 8.548 8.548 8.000 0.548 18441
3914 1 11 . 1 1 35 35 GLN N N 35 113.582 113.582 118.468 -4.886 18441
3915 1 11 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.197 -0.197 18441
3916 1 11 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.603 0.077 18441
3917 1 11 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.570 0.980 18441
3918 1 11 . 1 1 35 35 GLN H H 35 7.542 7.542 8.383 -0.841 18441
3919 1 11 . 1 1 36 36 THR N N 36 111.117 111.117 110.180 0.937 18441
3920 1 11 . 1 1 36 36 THR HA H 36 4.214 4.214 4.271 -0.057 18441
3921 1 11 . 1 1 36 36 THR CA C 36 63.980 63.980 62.770 1.210 18441
3922 1 11 . 1 1 36 36 THR CB C 36 71.670 71.670 69.966 1.704 18441
3923 1 11 . 1 1 36 36 THR H H 36 8.569 8.569 8.422 0.147 18441
3924 1 11 . 1 1 37 37 MET N N 37 120.444 120.444 118.747 1.697 18441
3925 1 11 . 1 1 37 37 MET HA H 37 3.740 3.740 4.065 -0.325 18441
3926 1 11 . 1 1 37 37 MET CA C 37 56.430 56.430 56.056 0.374 18441
3927 1 11 . 1 1 37 37 MET CB C 37 31.399 31.399 30.526 0.873 18441
3928 1 11 . 1 1 37 37 MET H H 37 9.542 9.542 7.553 1.989 18441
3929 1 11 . 1 1 38 38 ASP N N 38 117.020 117.020 120.092 -3.072 18441
3930 1 11 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.871 0.073 18441
3931 1 11 . 1 1 38 38 ASP CA C 38 53.476 53.476 52.743 0.733 18441
3932 1 11 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.806 -0.766 18441
3933 1 11 . 1 1 38 38 ASP H H 38 7.456 7.456 7.851 -0.395 18441
3934 1 11 . 1 1 39 39 VAL N N 39 128.507 128.507 125.615 2.892 18441
3935 1 11 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.908 -0.077 18441
3936 1 11 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.559 0.281 18441
3937 1 11 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.547 1.153 18441
3938 1 11 . 1 1 39 39 VAL H H 39 8.425 8.425 8.688 -0.263 18441
3939 1 11 . 1 1 40 40 ALA N N 40 125.621 125.621 122.379 3.242 18441
3940 1 11 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.095 -0.108 18441
3941 1 11 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.384 0.476 18441
3942 1 11 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.407 0.063 18441
3943 1 11 . 1 1 40 40 ALA H H 40 7.998 7.998 8.282 -0.284 18441
3944 1 11 . 1 1 41 41 VAL N N 41 122.132 122.132 118.431 3.701 18441
3945 1 11 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.783 -0.212 18441
3946 1 11 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.497 1.183 18441
3947 1 11 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.091 1.611 18441
3948 1 11 . 1 1 41 41 VAL H H 41 7.663 7.663 7.511 0.152 18441
3949 1 11 . 1 1 42 42 LEU N N 42 120.190 120.190 120.389 -0.199 18441
3950 1 11 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.919 0.341 18441
3951 1 11 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.135 0.855 18441
3952 1 11 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.681 -0.976 18441
3953 1 11 . 1 1 42 42 LEU H H 42 7.361 7.361 7.362 -0.001 18441
3954 1 11 . 1 1 43 43 VAL N N 43 116.802 116.802 117.578 -0.776 18441
3955 1 11 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.591 -0.174 18441
3956 1 11 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.633 2.147 18441
3957 1 11 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.765 1.214 18441
3958 1 11 . 1 1 43 43 VAL H H 43 8.062 8.062 7.724 0.338 18441
3959 1 11 . 1 1 44 44 GLY N N 44 106.242 106.242 108.244 -2.002 18441
3960 1 11 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.333 0.983 18441
3961 1 11 . 1 1 44 44 GLY H H 44 7.901 7.901 7.964 -0.063 18441
3962 1 11 . 1 1 45 45 ASP N N 45 123.359 123.359 123.535 -0.176 18441
3963 1 11 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.547 0.118 18441
3964 1 11 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.688 0.072 18441
3965 1 11 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.373 0.494 18441
3966 1 11 . 1 1 45 45 ASP H H 45 8.680 8.680 7.800 0.880 18441
3967 1 11 . 1 1 46 46 LEU N N 46 123.201 123.201 120.526 2.675 18441
3968 1 11 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.875 0.191 18441
3969 1 11 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.992 0.127 18441
3970 1 11 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.900 1.099 18441
3971 1 11 . 1 1 46 46 LEU H H 46 9.018 9.018 8.599 0.419 18441
3972 1 11 . 1 1 47 47 LYS N N 47 119.196 119.196 118.992 0.204 18441
3973 1 11 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.117 -0.147 18441
3974 1 11 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.761 0.529 18441
3975 1 11 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.194 0.947 18441
3976 1 11 . 1 1 47 47 LYS H H 47 8.017 8.017 7.753 0.264 18441
3977 1 11 . 1 1 48 48 LEU N N 48 116.358 116.358 120.201 -3.843 18441
3978 1 11 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.096 0.065 18441
3979 1 11 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.960 -0.290 18441
3980 1 11 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.433 -0.273 18441
3981 1 11 . 1 1 48 48 LEU H H 48 7.143 7.143 7.606 -0.463 18441
3982 1 11 . 1 1 49 49 VAL N N 49 112.662 112.662 114.601 -1.939 18441
3983 1 11 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.149 0.324 18441
3984 1 11 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.410 -0.350 18441
3985 1 11 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.676 2.490 18441
3986 1 11 . 1 1 49 49 VAL H H 49 7.266 7.266 7.622 -0.356 18441
3987 1 11 . 1 1 50 50 ILE N N 50 124.631 124.631 117.925 6.706 18441
3988 1 11 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.465 -0.620 18441
3989 1 11 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.358 1.232 18441
3990 1 11 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.947 -3.786 18441
3991 1 11 . 1 1 50 50 ILE H H 50 8.475 8.475 7.653 0.822 18441
3992 1 11 . 1 1 51 51 ASN N N 51 119.027 119.027 118.858 0.169 18441
3993 1 11 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.614 0.093 18441
3994 1 11 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.241 0.207 18441
3995 1 11 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.192 0.769 18441
3996 1 11 . 1 1 51 51 ASN H H 51 7.347 7.347 8.164 -0.817 18441
3997 1 11 . 1 1 52 52 GLU N N 52 115.889 115.889 118.792 -2.903 18441
3998 1 11 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.751 0.137 18441
3999 1 11 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.084 1.702 18441
4000 1 11 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.418 -0.398 18441
4001 1 11 . 1 1 52 52 GLU H H 52 7.438 7.438 7.597 -0.159 18441
4002 1 11 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.245 -0.035 18441
4003 1 11 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.430 1.530 18441
4004 1 11 . 1 1 53 53 PRO CB C 53 32.948 32.948 32.043 0.905 18441
4005 1 11 . 1 1 54 54 SER N N 54 113.711 113.711 112.345 1.366 18441
4006 1 11 . 1 1 54 54 SER HA H 54 4.173 4.173 4.344 -0.171 18441
4007 1 11 . 1 1 54 54 SER CA C 54 61.650 61.650 60.281 1.369 18441
4008 1 11 . 1 1 54 54 SER CB C 54 62.930 62.930 63.261 -0.331 18441
4009 1 11 . 1 1 54 54 SER H H 54 8.946 8.946 8.067 0.879 18441
4010 1 11 . 1 1 55 55 ARG N N 55 116.455 116.455 119.388 -2.933 18441
4011 1 11 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.338 0.066 18441
4012 1 11 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.323 -0.013 18441
4013 1 11 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.291 3.321 18441
4014 1 11 . 1 1 55 55 ARG H H 55 7.759 7.759 7.363 0.396 18441
4015 1 11 . 1 1 56 56 LEU N N 56 121.468 121.468 123.232 -1.764 18441
4016 1 11 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.227 -0.092 18441
4017 1 11 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.040 -0.140 18441
4018 1 11 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.380 1.617 18441
4019 1 11 . 1 1 56 56 LEU H H 56 7.472 7.472 8.488 -1.016 18441
4020 1 11 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.212 0.484 18441
4021 1 11 . 1 1 57 57 PRO CA C 57 66.180 66.180 65.983 0.197 18441
4022 1 11 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.011 1.379 18441
4023 1 11 . 1 1 58 58 LEU N N 58 119.923 119.923 118.030 1.893 18441
4024 1 11 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.146 -0.096 18441
4025 1 11 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.709 0.611 18441
4026 1 11 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.475 0.553 18441
4027 1 11 . 1 1 58 58 LEU H H 58 8.734 8.734 7.599 1.135 18441
4028 1 11 . 1 1 59 59 PHE N N 59 116.632 116.632 121.046 -4.414 18441
4029 1 11 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.207 0.272 18441
4030 1 11 . 1 1 59 59 PHE CA C 59 63.080 63.080 62.318 0.762 18441
4031 1 11 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.127 -0.275 18441
4032 1 11 . 1 1 59 59 PHE H H 59 8.312 8.312 8.825 -0.513 18441
4033 1 11 . 1 1 60 60 ASP N N 60 120.603 120.603 118.383 2.220 18441
4034 1 11 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.374 0.297 18441
4035 1 11 . 1 1 60 60 ASP CA C 60 57.870 57.870 57.592 0.278 18441
4036 1 11 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.908 0.633 18441
4037 1 11 . 1 1 60 60 ASP H H 60 7.462 7.462 7.839 -0.377 18441
4038 1 11 . 1 1 61 61 ALA N N 61 122.470 122.470 123.094 -0.624 18441
4039 1 11 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.872 0.389 18441
4040 1 11 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.704 -0.158 18441
4041 1 11 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.727 0.153 18441
4042 1 11 . 1 1 61 61 ALA H H 61 7.664 7.664 7.481 0.183 18441
4043 1 11 . 1 1 62 62 ILE N N 62 115.525 115.525 117.996 -2.471 18441
4044 1 11 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.999 0.683 18441
4045 1 11 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.621 -0.201 18441
4046 1 11 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.868 2.287 18441
4047 1 11 . 1 1 62 62 ILE H H 62 7.653 7.653 7.685 -0.032 18441
4048 1 11 . 1 1 63 63 ARG N N 63 121.016 121.016 119.666 1.350 18441
4049 1 11 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.413 0.061 18441
4050 1 11 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.561 0.809 18441
4051 1 11 . 1 1 63 63 ARG H H 63 6.917 6.917 7.191 -0.274 18441
4052 1 11 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.129 0.182 18441
4053 1 11 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.653 0.087 18441
4054 1 11 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.009 1.179 18441
4055 1 11 . 1 1 65 65 LEU N N 65 114.713 114.713 115.542 -0.829 18441
4056 1 11 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.072 -0.152 18441
4057 1 11 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.069 -0.409 18441
4058 1 11 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.875 0.233 18441
4059 1 11 . 1 1 65 65 LEU H H 65 8.074 8.074 7.428 0.646 18441
4060 1 11 . 1 1 66 66 ILE N N 66 120.129 120.129 118.964 1.165 18441
4061 1 11 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.111 0.194 18441
4062 1 11 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.180 -4.420 18441
4063 1 11 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.435 -0.791 18441
4064 1 11 . 1 1 66 66 ILE H H 66 7.398 7.398 7.536 -0.138 18441
4065 1 11 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.320 -0.015 18441
4066 1 11 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.720 0.920 18441
4067 1 11 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.315 0.974 18441
4068 1 11 . 1 1 68 68 LEU N N 68 124.673 124.673 123.540 1.133 18441
4069 1 11 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.980 -0.130 18441
4070 1 11 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.482 0.138 18441
4071 1 11 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.977 0.490 18441
4072 1 11 . 1 1 68 68 LEU H H 68 8.471 8.471 8.346 0.125 18441
4073 1 11 . 1 1 69 69 LYS N N 69 115.247 115.247 118.795 -3.548 18441
4074 1 11 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.068 0.101 18441
4075 1 11 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.582 -0.562 18441
4076 1 11 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.910 0.596 18441
4077 1 11 . 1 1 69 69 LYS H H 69 8.536 8.536 8.483 0.053 18441
4078 1 11 . 1 1 70 70 HIS N N 70 118.849 118.849 117.201 1.648 18441
4079 1 11 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.345 0.880 18441
4080 1 11 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.675 -3.786 18441
4081 1 11 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.762 5.276 18441
4082 1 11 . 1 1 70 70 HIS H H 70 8.060 8.060 8.532 -0.472 18441
4083 1 11 . 1 1 71 71 GLN N N 71 122.130 122.130 119.334 2.796 18441
4084 1 11 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.018 -0.319 18441
4085 1 11 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.621 2.069 18441
4086 1 11 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.762 0.488 18441
4087 1 11 . 1 1 71 71 GLN H H 71 7.732 7.732 8.451 -0.719 18441
4088 1 11 . 1 1 72 72 VAL N N 72 119.182 119.182 119.944 -0.762 18441
4089 1 11 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.710 0.098 18441
4090 1 11 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.912 0.308 18441
4091 1 11 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.473 0.341 18441
4092 1 11 . 1 1 72 72 VAL H H 72 8.203 8.203 7.752 0.451 18441
4093 1 11 . 1 1 73 73 GLU N N 73 121.878 121.878 120.305 1.573 18441
4094 1 11 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.230 -0.252 18441
4095 1 11 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.178 0.922 18441
4096 1 11 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.829 0.831 18441
4097 1 11 . 1 1 73 73 GLU H H 73 8.136 8.136 7.833 0.303 18441
4098 1 11 . 1 1 74 74 TYR N N 74 119.780 119.780 120.782 -1.002 18441
4099 1 11 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.115 -0.438 18441
4100 1 11 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.476 1.834 18441
4101 1 11 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.330 1.690 18441
4102 1 11 . 1 1 74 74 TYR H H 74 8.491 8.491 8.497 -0.006 18441
4103 1 11 . 1 1 75 75 ASP N N 75 120.231 120.231 118.712 1.519 18441
4104 1 11 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.426 -0.283 18441
4105 1 11 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.692 -0.132 18441
4106 1 11 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.669 -0.091 18441
4107 1 11 . 1 1 75 75 ASP H H 75 8.566 8.566 8.058 0.508 18441
4108 1 11 . 1 1 76 76 GLN N N 76 118.324 118.324 118.377 -0.053 18441
4109 1 11 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.118 -0.062 18441
4110 1 11 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.121 0.309 18441
4111 1 11 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.745 0.685 18441
4112 1 11 . 1 1 76 76 GLN H H 76 7.844 7.844 7.875 -0.031 18441
4113 1 11 . 1 1 77 77 LEU N N 77 117.932 117.932 116.918 1.014 18441
4114 1 11 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.407 -0.210 18441
4115 1 11 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.696 0.214 18441
4116 1 11 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.482 2.922 18441
4117 1 11 . 1 1 77 77 LEU H H 77 7.665 7.665 7.580 0.085 18441
4118 1 11 . 1 1 78 78 THR N N 78 110.323 110.323 112.270 -1.947 18441
4119 1 11 . 1 1 78 78 THR HA H 78 3.709 3.709 4.120 -0.411 18441
4120 1 11 . 1 1 78 78 THR CA C 78 59.750 59.750 65.653 -5.903 18441
4121 1 11 . 1 1 78 78 THR CB C 78 69.110 69.110 67.646 1.464 18441
4122 1 11 . 1 1 78 78 THR H H 78 7.130 7.130 7.607 -0.477 18441
4123 1 11 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.243 0.003 18441
4124 1 11 . 1 1 79 79 PRO CA C 79 63.680 63.680 64.432 -0.752 18441
4125 1 11 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.749 0.642 18441
4126 1 12 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.932 -0.402 18441
4127 1 12 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.959 1.631 18441
4128 1 12 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.336 0.357 18441
4129 1 12 . 1 1 3 3 ARG N N 3 121.498 121.498 121.011 0.487 18441
4130 1 12 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.228 0.013 18441
4131 1 12 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.310 -0.640 18441
4132 1 12 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.658 -0.148 18441
4133 1 12 . 1 1 3 3 ARG H H 3 8.382 8.382 8.296 0.086 18441
4134 1 12 . 1 1 4 4 LYS N N 4 122.257 122.257 120.135 2.122 18441
4135 1 12 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.121 -0.063 18441
4136 1 12 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.368 0.342 18441
4137 1 12 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.887 1.389 18441
4138 1 12 . 1 1 4 4 LYS H H 4 8.226 8.226 8.486 -0.260 18441
4139 1 12 . 1 1 5 5 VAL N N 5 120.494 120.494 118.023 2.471 18441
4140 1 12 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.851 -0.130 18441
4141 1 12 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.964 0.686 18441
4142 1 12 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.131 0.943 18441
4143 1 12 . 1 1 5 5 VAL H H 5 8.109 8.109 8.069 0.040 18441
4144 1 12 . 1 1 6 6 ALA N N 6 123.149 123.149 123.001 0.148 18441
4145 1 12 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.208 -0.173 18441
4146 1 12 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.138 0.752 18441
4147 1 12 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.373 0.887 18441
4148 1 12 . 1 1 6 6 ALA H H 6 8.374 8.374 7.846 0.528 18441
4149 1 12 . 1 1 7 7 ARG N N 7 119.587 119.587 118.538 1.049 18441
4150 1 12 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.892 0.109 18441
4151 1 12 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.455 0.315 18441
4152 1 12 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.237 0.533 18441
4153 1 12 . 1 1 7 7 ARG H H 7 7.992 7.992 7.978 0.014 18441
4154 1 12 . 1 1 8 8 GLU N N 8 119.745 119.745 119.935 -0.190 18441
4155 1 12 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.112 -0.054 18441
4156 1 12 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.759 0.011 18441
4157 1 12 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.850 0.100 18441
4158 1 12 . 1 1 8 8 GLU H H 8 8.165 8.165 8.280 -0.115 18441
4159 1 12 . 1 1 9 9 PHE N N 9 121.436 121.436 119.633 1.803 18441
4160 1 12 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.384 -0.257 18441
4161 1 12 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.919 3.101 18441
4162 1 12 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.675 0.948 18441
4163 1 12 . 1 1 9 9 PHE H H 9 8.180 8.180 8.459 -0.279 18441
4164 1 12 . 1 1 10 10 ARG N N 10 119.028 119.028 120.024 -0.996 18441
4165 1 12 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.550 0.311 18441
4166 1 12 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.257 0.323 18441
4167 1 12 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.409 0.911 18441
4168 1 12 . 1 1 10 10 ARG H H 10 7.910 7.910 7.954 -0.044 18441
4169 1 12 . 1 1 11 11 HIS N N 11 116.563 116.563 118.736 -2.173 18441
4170 1 12 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.260 0.196 18441
4171 1 12 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.976 0.204 18441
4172 1 12 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.926 0.104 18441
4173 1 12 . 1 1 11 11 HIS H H 11 8.001 8.001 8.177 -0.176 18441
4174 1 12 . 1 1 12 12 LYS N N 12 120.773 120.773 118.699 2.074 18441
4175 1 12 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.994 0.014 18441
4176 1 12 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.668 0.312 18441
4177 1 12 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.487 0.206 18441
4178 1 12 . 1 1 12 12 LYS H H 12 7.796 7.796 7.745 0.051 18441
4179 1 12 . 1 1 13 13 VAL N N 13 120.125 120.125 120.060 0.065 18441
4180 1 12 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.602 -0.491 18441
4181 1 12 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.613 0.567 18441
4182 1 12 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.797 0.343 18441
4183 1 12 . 1 1 13 13 VAL H H 13 7.821 7.821 7.861 -0.040 18441
4184 1 12 . 1 1 14 14 ASP N N 14 117.462 117.462 119.215 -1.753 18441
4185 1 12 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.354 -0.092 18441
4186 1 12 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.028 0.373 18441
4187 1 12 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.895 0.419 18441
4188 1 12 . 1 1 14 14 ASP H H 14 8.276 8.276 7.776 0.500 18441
4189 1 12 . 1 1 15 15 PHE N N 15 117.914 117.914 119.071 -1.157 18441
4190 1 12 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.353 0.009 18441
4191 1 12 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.215 -0.025 18441
4192 1 12 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.471 1.227 18441
4193 1 12 . 1 1 15 15 PHE H H 15 7.664 7.664 7.750 -0.086 18441
4194 1 12 . 1 1 16 16 LEU N N 16 116.737 116.737 117.181 -0.444 18441
4195 1 12 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.180 0.054 18441
4196 1 12 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.674 1.746 18441
4197 1 12 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.585 2.493 18441
4198 1 12 . 1 1 16 16 LEU H H 16 7.658 7.658 7.798 -0.140 18441
4199 1 12 . 1 1 17 17 ILE N N 17 120.533 120.533 117.402 3.131 18441
4200 1 12 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.404 -0.296 18441
4201 1 12 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.897 1.643 18441
4202 1 12 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.013 1.344 18441
4203 1 12 . 1 1 17 17 ILE H H 17 8.336 8.336 7.196 1.140 18441
4204 1 12 . 1 1 18 18 GLU N N 18 124.531 124.531 123.674 0.857 18441
4205 1 12 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.038 0.172 18441
4206 1 12 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.449 0.151 18441
4207 1 12 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.865 1.145 18441
4208 1 12 . 1 1 18 18 GLU H H 18 8.276 8.276 8.562 -0.286 18441
4209 1 12 . 1 1 19 19 ASN N N 19 117.630 117.630 117.624 0.006 18441
4210 1 12 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.628 0.177 18441
4211 1 12 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.153 -0.415 18441
4212 1 12 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.573 1.605 18441
4213 1 12 . 1 1 19 19 ASN H H 19 7.700 7.700 8.250 -0.550 18441
4214 1 12 . 1 1 20 20 ASP N N 20 127.428 127.428 120.254 7.174 18441
4215 1 12 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.545 -0.296 18441
4216 1 12 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.067 2.783 18441
4217 1 12 . 1 1 20 20 ASP CB C 20 41.314 41.314 40.535 0.778 18441
4218 1 12 . 1 1 20 20 ASP H H 20 8.998 8.998 8.482 0.516 18441
4219 1 12 . 1 1 21 21 ALA N N 21 122.271 122.271 122.840 -0.569 18441
4220 1 12 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.068 0.192 18441
4221 1 12 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.300 0.700 18441
4222 1 12 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.370 0.280 18441
4223 1 12 . 1 1 21 21 ALA H H 21 8.346 8.346 8.156 0.190 18441
4224 1 12 . 1 1 22 22 GLU N N 22 118.716 118.716 118.509 0.207 18441
4225 1 12 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.943 0.171 18441
4226 1 12 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.870 0.490 18441
4227 1 12 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.994 2.779 18441
4228 1 12 . 1 1 22 22 GLU H H 22 7.724 7.724 8.764 -1.040 18441
4229 1 12 . 1 1 23 23 LYS N N 23 121.088 121.088 117.156 3.932 18441
4230 1 12 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.721 0.090 18441
4231 1 12 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.082 2.588 18441
4232 1 12 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.706 1.364 18441
4233 1 12 . 1 1 23 23 LYS H H 23 7.618 7.618 7.942 -0.324 18441
4234 1 12 . 1 1 24 24 ASP N N 24 119.010 119.010 120.545 -1.535 18441
4235 1 12 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.515 -0.026 18441
4236 1 12 . 1 1 24 24 ASP CA C 24 58.510 58.510 56.862 1.648 18441
4237 1 12 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.603 0.234 18441
4238 1 12 . 1 1 24 24 ASP H H 24 8.424 8.424 7.534 0.890 18441
4239 1 12 . 1 1 25 25 TYR N N 25 120.417 120.417 120.691 -0.274 18441
4240 1 12 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.119 0.124 18441
4241 1 12 . 1 1 25 25 TYR CA C 25 62.190 62.190 62.135 0.055 18441
4242 1 12 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.657 -0.158 18441
4243 1 12 . 1 1 25 25 TYR H H 25 7.676 7.676 8.238 -0.562 18441
4244 1 12 . 1 1 26 26 LEU N N 26 120.960 120.960 119.535 1.425 18441
4245 1 12 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.904 -0.303 18441
4246 1 12 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.574 0.866 18441
4247 1 12 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.591 0.560 18441
4248 1 12 . 1 1 26 26 LEU H H 26 7.965 7.965 7.926 0.039 18441
4249 1 12 . 1 1 27 27 TYR N N 27 116.521 116.521 117.989 -1.468 18441
4250 1 12 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.108 -0.332 18441
4251 1 12 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.125 5.285 18441
4252 1 12 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.128 1.275 18441
4253 1 12 . 1 1 27 27 TYR H H 27 8.097 8.097 8.004 0.093 18441
4254 1 12 . 1 1 28 28 ASP N N 28 123.384 123.384 119.560 3.824 18441
4255 1 12 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.451 0.025 18441
4256 1 12 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.754 0.786 18441
4257 1 12 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.887 0.507 18441
4258 1 12 . 1 1 28 28 ASP H H 28 8.355 8.355 7.853 0.502 18441
4259 1 12 . 1 1 29 29 VAL N N 29 121.272 121.272 120.284 0.988 18441
4260 1 12 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.793 -0.080 18441
4261 1 12 . 1 1 29 29 VAL CA C 29 66.650 66.650 65.647 1.003 18441
4262 1 12 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.323 0.595 18441
4263 1 12 . 1 1 29 29 VAL H H 29 8.252 8.252 7.906 0.346 18441
4264 1 12 . 1 1 30 30 LEU N N 30 122.443 122.443 120.263 2.180 18441
4265 1 12 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.070 -0.027 18441
4266 1 12 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.631 0.249 18441
4267 1 12 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.352 0.929 18441
4268 1 12 . 1 1 30 30 LEU H H 30 7.987 7.987 8.316 -0.329 18441
4269 1 12 . 1 1 31 31 ARG N N 31 122.386 122.386 118.656 3.730 18441
4270 1 12 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.068 -0.052 18441
4271 1 12 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.184 1.196 18441
4272 1 12 . 1 1 31 31 ARG CB C 31 30.400 30.400 29.972 0.428 18441
4273 1 12 . 1 1 31 31 ARG H H 31 8.637 8.637 8.115 0.522 18441
4274 1 12 . 1 1 32 32 MET N N 32 120.006 120.006 119.362 0.644 18441
4275 1 12 . 1 1 32 32 MET HA H 32 4.359 4.359 4.171 0.188 18441
4276 1 12 . 1 1 32 32 MET CA C 32 58.490 58.490 59.096 -0.606 18441
4277 1 12 . 1 1 32 32 MET CB C 32 31.677 31.677 32.133 -0.456 18441
4278 1 12 . 1 1 32 32 MET H H 32 8.327 8.327 8.191 0.136 18441
4279 1 12 . 1 1 33 33 TYR N N 33 123.220 123.220 121.375 1.845 18441
4280 1 12 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.339 0.385 18441
4281 1 12 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.246 0.754 18441
4282 1 12 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.758 1.929 18441
4283 1 12 . 1 1 33 33 TYR H H 33 8.054 8.054 8.519 -0.465 18441
4284 1 12 . 1 1 34 34 HIS N N 34 120.860 120.860 117.202 3.658 18441
4285 1 12 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.106 -0.330 18441
4286 1 12 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.398 1.312 18441
4287 1 12 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.196 1.196 18441
4288 1 12 . 1 1 34 34 HIS H H 34 8.548 8.548 8.045 0.503 18441
4289 1 12 . 1 1 35 35 GLN N N 35 113.582 113.582 118.701 -5.119 18441
4290 1 12 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.228 -0.228 18441
4291 1 12 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.588 0.092 18441
4292 1 12 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.649 0.901 18441
4293 1 12 . 1 1 35 35 GLN H H 35 7.542 7.542 8.485 -0.943 18441
4294 1 12 . 1 1 36 36 THR N N 36 111.117 111.117 109.454 1.663 18441
4295 1 12 . 1 1 36 36 THR HA H 36 4.214 4.214 4.308 -0.094 18441
4296 1 12 . 1 1 36 36 THR CA C 36 63.980 63.980 62.711 1.269 18441
4297 1 12 . 1 1 36 36 THR CB C 36 71.670 71.670 70.072 1.598 18441
4298 1 12 . 1 1 36 36 THR H H 36 8.569 8.569 8.457 0.112 18441
4299 1 12 . 1 1 37 37 MET N N 37 120.444 120.444 117.437 3.007 18441
4300 1 12 . 1 1 37 37 MET HA H 37 3.740 3.740 4.179 -0.439 18441
4301 1 12 . 1 1 37 37 MET CA C 37 56.430 56.430 56.886 -0.456 18441
4302 1 12 . 1 1 37 37 MET CB C 37 31.399 31.399 30.404 0.995 18441
4303 1 12 . 1 1 37 37 MET H H 37 9.542 9.542 7.639 1.903 18441
4304 1 12 . 1 1 38 38 ASP N N 38 117.020 117.020 121.077 -4.057 18441
4305 1 12 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.868 0.076 18441
4306 1 12 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.507 -0.031 18441
4307 1 12 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.187 -0.147 18441
4308 1 12 . 1 1 38 38 ASP H H 38 7.456 7.456 7.750 -0.294 18441
4309 1 12 . 1 1 39 39 VAL N N 39 128.507 128.507 124.042 4.465 18441
4310 1 12 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.583 0.248 18441
4311 1 12 . 1 1 39 39 VAL CA C 39 64.840 64.840 65.027 -0.187 18441
4312 1 12 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.482 1.218 18441
4313 1 12 . 1 1 39 39 VAL H H 39 8.425 8.425 8.639 -0.214 18441
4314 1 12 . 1 1 40 40 ALA N N 40 125.621 125.621 123.181 2.440 18441
4315 1 12 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.095 -0.108 18441
4316 1 12 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.078 0.782 18441
4317 1 12 . 1 1 40 40 ALA CB C 40 18.470 18.470 17.928 0.542 18441
4318 1 12 . 1 1 40 40 ALA H H 40 7.998 7.998 8.279 -0.281 18441
4319 1 12 . 1 1 41 41 VAL N N 41 122.132 122.132 119.462 2.670 18441
4320 1 12 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.801 -0.230 18441
4321 1 12 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.013 1.667 18441
4322 1 12 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.318 1.384 18441
4323 1 12 . 1 1 41 41 VAL H H 41 7.663 7.663 8.031 -0.368 18441
4324 1 12 . 1 1 42 42 LEU N N 42 120.190 120.190 119.144 1.046 18441
4325 1 12 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.144 0.116 18441
4326 1 12 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.398 0.592 18441
4327 1 12 . 1 1 42 42 LEU CB C 42 40.705 40.705 40.823 -0.118 18441
4328 1 12 . 1 1 42 42 LEU H H 42 7.361 7.361 7.316 0.045 18441
4329 1 12 . 1 1 43 43 VAL N N 43 116.802 116.802 120.092 -3.290 18441
4330 1 12 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.424 -0.007 18441
4331 1 12 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.844 1.936 18441
4332 1 12 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.772 1.208 18441
4333 1 12 . 1 1 43 43 VAL H H 43 8.062 8.062 7.644 0.418 18441
4334 1 12 . 1 1 44 44 GLY N N 44 106.242 106.242 107.895 -1.653 18441
4335 1 12 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.420 0.896 18441
4336 1 12 . 1 1 44 44 GLY H H 44 7.901 7.901 7.905 -0.004 18441
4337 1 12 . 1 1 45 45 ASP N N 45 123.359 123.359 123.295 0.064 18441
4338 1 12 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.533 0.132 18441
4339 1 12 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.429 0.331 18441
4340 1 12 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.594 0.274 18441
4341 1 12 . 1 1 45 45 ASP H H 45 8.680 8.680 7.869 0.811 18441
4342 1 12 . 1 1 46 46 LEU N N 46 123.201 123.201 120.575 2.626 18441
4343 1 12 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.926 0.140 18441
4344 1 12 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.137 -0.017 18441
4345 1 12 . 1 1 46 46 LEU CB C 46 42.999 42.999 42.000 0.999 18441
4346 1 12 . 1 1 46 46 LEU H H 46 9.018 9.018 8.432 0.586 18441
4347 1 12 . 1 1 47 47 LYS N N 47 119.196 119.196 119.304 -0.108 18441
4348 1 12 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.002 -0.032 18441
4349 1 12 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.447 0.843 18441
4350 1 12 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.068 1.073 18441
4351 1 12 . 1 1 47 47 LYS H H 47 8.017 8.017 7.780 0.237 18441
4352 1 12 . 1 1 48 48 LEU N N 48 116.358 116.358 119.477 -3.119 18441
4353 1 12 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.195 -0.034 18441
4354 1 12 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.455 0.215 18441
4355 1 12 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.187 -0.027 18441
4356 1 12 . 1 1 48 48 LEU H H 48 7.143 7.143 7.476 -0.333 18441
4357 1 12 . 1 1 49 49 VAL N N 49 112.662 112.662 114.973 -2.311 18441
4358 1 12 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.053 0.420 18441
4359 1 12 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.859 -0.799 18441
4360 1 12 . 1 1 49 49 VAL CB C 49 35.166 35.166 33.065 2.102 18441
4361 1 12 . 1 1 49 49 VAL H H 49 7.266 7.266 7.570 -0.304 18441
4362 1 12 . 1 1 50 50 ILE N N 50 124.631 124.631 119.262 5.369 18441
4363 1 12 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.276 -0.431 18441
4364 1 12 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.666 0.924 18441
4365 1 12 . 1 1 50 50 ILE CB C 50 35.161 35.161 39.051 -3.890 18441
4366 1 12 . 1 1 50 50 ILE H H 50 8.475 8.475 7.533 0.942 18441
4367 1 12 . 1 1 51 51 ASN N N 51 119.027 119.027 119.237 -0.210 18441
4368 1 12 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.478 0.229 18441
4369 1 12 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.411 0.037 18441
4370 1 12 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.372 0.589 18441
4371 1 12 . 1 1 51 51 ASN H H 51 7.347 7.347 8.030 -0.683 18441
4372 1 12 . 1 1 52 52 GLU N N 52 115.889 115.889 118.711 -2.822 18441
4373 1 12 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.667 0.221 18441
4374 1 12 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.725 2.059 18441
4375 1 12 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.704 -0.684 18441
4376 1 12 . 1 1 52 52 GLU H H 52 7.438 7.438 7.494 -0.056 18441
4377 1 12 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.125 0.085 18441
4378 1 12 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.709 1.252 18441
4379 1 12 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.798 1.150 18441
4380 1 12 . 1 1 54 54 SER N N 54 113.711 113.711 111.929 1.782 18441
4381 1 12 . 1 1 54 54 SER HA H 54 4.173 4.173 4.272 -0.099 18441
4382 1 12 . 1 1 54 54 SER CA C 54 61.650 61.650 61.409 0.241 18441
4383 1 12 . 1 1 54 54 SER CB C 54 62.930 62.930 63.180 -0.250 18441
4384 1 12 . 1 1 54 54 SER H H 54 8.946 8.946 8.415 0.531 18441
4385 1 12 . 1 1 55 55 ARG N N 55 116.455 116.455 119.455 -3.000 18441
4386 1 12 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.345 0.059 18441
4387 1 12 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.794 0.516 18441
4388 1 12 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.301 3.311 18441
4389 1 12 . 1 1 55 55 ARG H H 55 7.759 7.759 7.701 0.058 18441
4390 1 12 . 1 1 56 56 LEU N N 56 121.468 121.468 123.160 -1.692 18441
4391 1 12 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.195 -0.060 18441
4392 1 12 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.933 -0.033 18441
4393 1 12 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.491 1.506 18441
4394 1 12 . 1 1 56 56 LEU H H 56 7.472 7.472 8.335 -0.863 18441
4395 1 12 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.202 0.494 18441
4396 1 12 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.403 -0.222 18441
4397 1 12 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.182 1.208 18441
4398 1 12 . 1 1 58 58 LEU N N 58 119.923 119.923 117.179 2.744 18441
4399 1 12 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.194 -0.144 18441
4400 1 12 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.233 1.087 18441
4401 1 12 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.488 0.540 18441
4402 1 12 . 1 1 58 58 LEU H H 58 8.734 8.734 7.600 1.134 18441
4403 1 12 . 1 1 59 59 PHE N N 59 116.632 116.632 121.424 -4.792 18441
4404 1 12 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.302 0.177 18441
4405 1 12 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.678 1.402 18441
4406 1 12 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.056 -0.204 18441
4407 1 12 . 1 1 59 59 PHE H H 59 8.312 8.312 8.803 -0.491 18441
4408 1 12 . 1 1 60 60 ASP N N 60 120.603 120.603 118.534 2.069 18441
4409 1 12 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.353 0.318 18441
4410 1 12 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.568 1.302 18441
4411 1 12 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.373 1.168 18441
4412 1 12 . 1 1 60 60 ASP H H 60 7.462 7.462 7.863 -0.401 18441
4413 1 12 . 1 1 61 61 ALA N N 61 122.470 122.470 121.858 0.612 18441
4414 1 12 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.974 0.287 18441
4415 1 12 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.304 0.242 18441
4416 1 12 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.713 0.167 18441
4417 1 12 . 1 1 61 61 ALA H H 61 7.664 7.664 7.537 0.127 18441
4418 1 12 . 1 1 62 62 ILE N N 62 115.525 115.525 117.965 -2.440 18441
4419 1 12 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.884 0.798 18441
4420 1 12 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.412 0.008 18441
4421 1 12 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.951 2.204 18441
4422 1 12 . 1 1 62 62 ILE H H 62 7.653 7.653 7.565 0.088 18441
4423 1 12 . 1 1 63 63 ARG N N 63 121.016 121.016 119.910 1.106 18441
4424 1 12 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.463 0.011 18441
4425 1 12 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.645 0.725 18441
4426 1 12 . 1 1 63 63 ARG H H 63 6.917 6.917 7.172 -0.255 18441
4427 1 12 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.079 0.232 18441
4428 1 12 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.618 0.122 18441
4429 1 12 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.145 1.042 18441
4430 1 12 . 1 1 65 65 LEU N N 65 114.713 114.713 115.903 -1.190 18441
4431 1 12 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.074 -0.154 18441
4432 1 12 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.099 -0.439 18441
4433 1 12 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.849 0.259 18441
4434 1 12 . 1 1 65 65 LEU H H 65 8.074 8.074 7.541 0.533 18441
4435 1 12 . 1 1 66 66 ILE N N 66 120.129 120.129 118.879 1.250 18441
4436 1 12 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.107 0.198 18441
4437 1 12 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.852 -5.092 18441
4438 1 12 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.476 -0.832 18441
4439 1 12 . 1 1 66 66 ILE H H 66 7.398 7.398 7.516 -0.118 18441
4440 1 12 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.329 -0.024 18441
4441 1 12 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.718 0.922 18441
4442 1 12 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.404 0.885 18441
4443 1 12 . 1 1 68 68 LEU N N 68 124.673 124.673 123.409 1.264 18441
4444 1 12 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.971 -0.121 18441
4445 1 12 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.393 0.227 18441
4446 1 12 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.936 0.531 18441
4447 1 12 . 1 1 68 68 LEU H H 68 8.471 8.471 8.336 0.135 18441
4448 1 12 . 1 1 69 69 LYS N N 69 115.247 115.247 118.800 -3.553 18441
4449 1 12 . 1 1 69 69 LYS HA H 69 4.169 4.169 3.972 0.197 18441
4450 1 12 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.322 -0.302 18441
4451 1 12 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.929 0.577 18441
4452 1 12 . 1 1 69 69 LYS H H 69 8.536 8.536 8.370 0.166 18441
4453 1 12 . 1 1 70 70 HIS N N 70 118.849 118.849 116.871 1.978 18441
4454 1 12 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.363 0.862 18441
4455 1 12 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.068 -3.179 18441
4456 1 12 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.500 5.537 18441
4457 1 12 . 1 1 70 70 HIS H H 70 8.060 8.060 8.287 -0.227 18441
4458 1 12 . 1 1 71 71 GLN N N 71 122.130 122.130 120.077 2.053 18441
4459 1 12 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.003 -0.304 18441
4460 1 12 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.373 2.317 18441
4461 1 12 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.836 0.414 18441
4462 1 12 . 1 1 71 71 GLN H H 71 7.732 7.732 8.253 -0.521 18441
4463 1 12 . 1 1 72 72 VAL N N 72 119.182 119.182 120.294 -1.112 18441
4464 1 12 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.703 0.105 18441
4465 1 12 . 1 1 72 72 VAL CA C 72 67.220 67.220 65.850 1.370 18441
4466 1 12 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.878 -0.064 18441
4467 1 12 . 1 1 72 72 VAL H H 72 8.203 8.203 7.855 0.348 18441
4468 1 12 . 1 1 73 73 GLU N N 73 121.878 121.878 120.183 1.695 18441
4469 1 12 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.031 -0.053 18441
4470 1 12 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.150 0.950 18441
4471 1 12 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.332 1.328 18441
4472 1 12 . 1 1 73 73 GLU H H 73 8.136 8.136 7.830 0.306 18441
4473 1 12 . 1 1 74 74 TYR N N 74 119.780 119.780 120.687 -0.907 18441
4474 1 12 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.107 -0.430 18441
4475 1 12 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.412 1.898 18441
4476 1 12 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.323 1.697 18441
4477 1 12 . 1 1 74 74 TYR H H 74 8.491 8.491 8.071 0.420 18441
4478 1 12 . 1 1 75 75 ASP N N 75 120.231 120.231 119.423 0.808 18441
4479 1 12 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.523 -0.380 18441
4480 1 12 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.662 -0.102 18441
4481 1 12 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.449 0.129 18441
4482 1 12 . 1 1 75 75 ASP H H 75 8.566 8.566 8.113 0.453 18441
4483 1 12 . 1 1 76 76 GLN N N 76 118.324 118.324 119.099 -0.775 18441
4484 1 12 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.144 -0.088 18441
4485 1 12 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.606 -0.176 18441
4486 1 12 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.817 0.613 18441
4487 1 12 . 1 1 76 76 GLN H H 76 7.844 7.844 7.875 -0.031 18441
4488 1 12 . 1 1 77 77 LEU N N 77 117.932 117.932 118.466 -0.534 18441
4489 1 12 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.222 -0.025 18441
4490 1 12 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.556 -0.646 18441
4491 1 12 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.038 3.366 18441
4492 1 12 . 1 1 77 77 LEU H H 77 7.665 7.665 7.666 -0.001 18441
4493 1 12 . 1 1 78 78 THR N N 78 110.323 110.323 111.080 -0.757 18441
4494 1 12 . 1 1 78 78 THR HA H 78 3.709 3.709 4.280 -0.571 18441
4495 1 12 . 1 1 78 78 THR CA C 78 59.750 59.750 65.683 -5.934 18441
4496 1 12 . 1 1 78 78 THR CB C 78 69.110 69.110 67.051 2.059 18441
4497 1 12 . 1 1 78 78 THR H H 78 7.130 7.130 7.904 -0.774 18441
4498 1 12 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.420 -0.174 18441
4499 1 12 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.331 0.349 18441
4500 1 12 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.086 0.305 18441
4501 1 13 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.628 -0.098 18441
4502 1 13 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.441 1.149 18441
4503 1 13 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.453 0.240 18441
4504 1 13 . 1 1 3 3 ARG N N 3 121.498 121.498 122.041 -0.543 18441
4505 1 13 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.244 -0.003 18441
4506 1 13 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.270 0.400 18441
4507 1 13 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.983 -0.473 18441
4508 1 13 . 1 1 3 3 ARG H H 3 8.382 8.382 8.028 0.354 18441
4509 1 13 . 1 1 4 4 LYS N N 4 122.257 122.257 121.018 1.239 18441
4510 1 13 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.117 -0.059 18441
4511 1 13 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.074 0.636 18441
4512 1 13 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.552 1.724 18441
4513 1 13 . 1 1 4 4 LYS H H 4 8.226 8.226 8.501 -0.275 18441
4514 1 13 . 1 1 5 5 VAL N N 5 120.494 120.494 117.714 2.780 18441
4515 1 13 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.869 -0.148 18441
4516 1 13 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.202 1.448 18441
4517 1 13 . 1 1 5 5 VAL CB C 5 32.074 32.074 30.995 1.079 18441
4518 1 13 . 1 1 5 5 VAL H H 5 8.109 8.109 8.054 0.055 18441
4519 1 13 . 1 1 6 6 ALA N N 6 123.149 123.149 123.194 -0.045 18441
4520 1 13 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.234 -0.199 18441
4521 1 13 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.238 0.652 18441
4522 1 13 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.377 0.883 18441
4523 1 13 . 1 1 6 6 ALA H H 6 8.374 8.374 7.641 0.733 18441
4524 1 13 . 1 1 7 7 ARG N N 7 119.587 119.587 118.713 0.874 18441
4525 1 13 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.900 0.101 18441
4526 1 13 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.390 0.380 18441
4527 1 13 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.171 0.600 18441
4528 1 13 . 1 1 7 7 ARG H H 7 7.992 7.992 7.807 0.185 18441
4529 1 13 . 1 1 8 8 GLU N N 8 119.745 119.745 120.339 -0.594 18441
4530 1 13 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.133 -0.075 18441
4531 1 13 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.602 0.168 18441
4532 1 13 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.907 0.043 18441
4533 1 13 . 1 1 8 8 GLU H H 8 8.165 8.165 8.308 -0.143 18441
4534 1 13 . 1 1 9 9 PHE N N 9 121.436 121.436 119.525 1.911 18441
4535 1 13 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.363 -0.236 18441
4536 1 13 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.995 3.025 18441
4537 1 13 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.547 1.076 18441
4538 1 13 . 1 1 9 9 PHE H H 9 8.180 8.180 8.316 -0.136 18441
4539 1 13 . 1 1 10 10 ARG N N 10 119.028 119.028 119.944 -0.916 18441
4540 1 13 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.481 0.380 18441
4541 1 13 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.195 0.385 18441
4542 1 13 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.410 0.910 18441
4543 1 13 . 1 1 10 10 ARG H H 10 7.910 7.910 7.946 -0.036 18441
4544 1 13 . 1 1 11 11 HIS N N 11 116.563 116.563 118.694 -2.131 18441
4545 1 13 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.261 0.195 18441
4546 1 13 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.979 0.201 18441
4547 1 13 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.925 0.105 18441
4548 1 13 . 1 1 11 11 HIS H H 11 8.001 8.001 8.137 -0.136 18441
4549 1 13 . 1 1 12 12 LYS N N 12 120.773 120.773 118.680 2.093 18441
4550 1 13 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.854 0.154 18441
4551 1 13 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.586 0.394 18441
4552 1 13 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.394 0.299 18441
4553 1 13 . 1 1 12 12 LYS H H 12 7.796 7.796 7.690 0.106 18441
4554 1 13 . 1 1 13 13 VAL N N 13 120.125 120.125 119.851 0.274 18441
4555 1 13 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.668 -0.557 18441
4556 1 13 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.221 0.959 18441
4557 1 13 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.733 0.407 18441
4558 1 13 . 1 1 13 13 VAL H H 13 7.821 7.821 7.817 0.004 18441
4559 1 13 . 1 1 14 14 ASP N N 14 117.462 117.462 119.147 -1.685 18441
4560 1 13 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.329 -0.067 18441
4561 1 13 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.226 0.174 18441
4562 1 13 . 1 1 14 14 ASP CB C 14 41.314 41.314 41.094 0.220 18441
4563 1 13 . 1 1 14 14 ASP H H 14 8.276 8.276 7.834 0.442 18441
4564 1 13 . 1 1 15 15 PHE N N 15 117.914 117.914 118.598 -0.684 18441
4565 1 13 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.332 0.030 18441
4566 1 13 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.667 -0.478 18441
4567 1 13 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.560 1.138 18441
4568 1 13 . 1 1 15 15 PHE H H 15 7.664 7.664 7.734 -0.070 18441
4569 1 13 . 1 1 16 16 LEU N N 16 116.737 116.737 117.540 -0.803 18441
4570 1 13 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.425 -0.191 18441
4571 1 13 . 1 1 16 16 LEU CA C 16 56.420 56.420 55.333 1.087 18441
4572 1 13 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.732 2.346 18441
4573 1 13 . 1 1 16 16 LEU H H 16 7.658 7.658 7.959 -0.301 18441
4574 1 13 . 1 1 17 17 ILE N N 17 120.533 120.533 116.999 3.534 18441
4575 1 13 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.345 -0.237 18441
4576 1 13 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.870 1.670 18441
4577 1 13 . 1 1 17 17 ILE CB C 17 38.357 38.357 36.760 1.597 18441
4578 1 13 . 1 1 17 17 ILE H H 17 8.336 8.336 7.532 0.804 18441
4579 1 13 . 1 1 18 18 GLU N N 18 124.531 124.531 123.465 1.066 18441
4580 1 13 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.017 0.193 18441
4581 1 13 . 1 1 18 18 GLU CA C 18 58.600 58.600 59.148 -0.548 18441
4582 1 13 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.770 1.240 18441
4583 1 13 . 1 1 18 18 GLU H H 18 8.276 8.276 8.626 -0.350 18441
4584 1 13 . 1 1 19 19 ASN N N 19 117.630 117.630 117.260 0.370 18441
4585 1 13 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.537 0.268 18441
4586 1 13 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.470 -0.732 18441
4587 1 13 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.433 1.745 18441
4588 1 13 . 1 1 19 19 ASN H H 19 7.700 7.700 8.077 -0.377 18441
4589 1 13 . 1 1 20 20 ASP N N 20 127.428 127.428 117.766 9.662 18441
4590 1 13 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.713 -0.464 18441
4591 1 13 . 1 1 20 20 ASP CA C 20 58.850 58.850 55.972 2.878 18441
4592 1 13 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.601 -0.287 18441
4593 1 13 . 1 1 20 20 ASP H H 20 8.998 8.998 8.617 0.381 18441
4594 1 13 . 1 1 21 21 ALA N N 21 122.271 122.271 123.612 -1.341 18441
4595 1 13 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.031 0.229 18441
4596 1 13 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.648 0.352 18441
4597 1 13 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.095 0.555 18441
4598 1 13 . 1 1 21 21 ALA H H 21 8.346 8.346 8.129 0.217 18441
4599 1 13 . 1 1 22 22 GLU N N 22 118.716 118.716 118.070 0.646 18441
4600 1 13 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.973 0.141 18441
4601 1 13 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.685 0.674 18441
4602 1 13 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.954 2.818 18441
4603 1 13 . 1 1 22 22 GLU H H 22 7.724 7.724 8.790 -1.066 18441
4604 1 13 . 1 1 23 23 LYS N N 23 121.088 121.088 118.154 2.934 18441
4605 1 13 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.764 0.047 18441
4606 1 13 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.974 2.696 18441
4607 1 13 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.804 1.266 18441
4608 1 13 . 1 1 23 23 LYS H H 23 7.618 7.618 8.152 -0.534 18441
4609 1 13 . 1 1 24 24 ASP N N 24 119.010 119.010 120.447 -1.437 18441
4610 1 13 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.483 0.006 18441
4611 1 13 . 1 1 24 24 ASP CA C 24 58.510 58.510 58.008 0.502 18441
4612 1 13 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.897 -0.060 18441
4613 1 13 . 1 1 24 24 ASP H H 24 8.424 8.424 7.488 0.936 18441
4614 1 13 . 1 1 25 25 TYR N N 25 120.417 120.417 120.444 -0.027 18441
4615 1 13 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.152 0.091 18441
4616 1 13 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.935 0.255 18441
4617 1 13 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.551 -0.052 18441
4618 1 13 . 1 1 25 25 TYR H H 25 7.676 7.676 8.374 -0.698 18441
4619 1 13 . 1 1 26 26 LEU N N 26 120.960 120.960 119.986 0.974 18441
4620 1 13 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.913 -0.312 18441
4621 1 13 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.146 1.294 18441
4622 1 13 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.734 0.417 18441
4623 1 13 . 1 1 26 26 LEU H H 26 7.965 7.965 7.749 0.216 18441
4624 1 13 . 1 1 27 27 TYR N N 27 116.521 116.521 117.669 -1.148 18441
4625 1 13 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.124 -0.348 18441
4626 1 13 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.345 5.065 18441
4627 1 13 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.003 1.400 18441
4628 1 13 . 1 1 27 27 TYR H H 27 8.097 8.097 7.951 0.146 18441
4629 1 13 . 1 1 28 28 ASP N N 28 123.384 123.384 119.251 4.133 18441
4630 1 13 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.397 0.079 18441
4631 1 13 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.249 1.291 18441
4632 1 13 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.454 0.940 18441
4633 1 13 . 1 1 28 28 ASP H H 28 8.355 8.355 7.843 0.512 18441
4634 1 13 . 1 1 29 29 VAL N N 29 121.272 121.272 119.845 1.427 18441
4635 1 13 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.592 0.121 18441
4636 1 13 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.257 -0.607 18441
4637 1 13 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.851 0.067 18441
4638 1 13 . 1 1 29 29 VAL H H 29 8.252 8.252 7.549 0.703 18441
4639 1 13 . 1 1 30 30 LEU N N 30 122.443 122.443 119.544 2.899 18441
4640 1 13 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.011 0.032 18441
4641 1 13 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.362 0.518 18441
4642 1 13 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.424 0.857 18441
4643 1 13 . 1 1 30 30 LEU H H 30 7.987 7.987 7.852 0.135 18441
4644 1 13 . 1 1 31 31 ARG N N 31 122.386 122.386 118.449 3.937 18441
4645 1 13 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.005 0.011 18441
4646 1 13 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.381 0.999 18441
4647 1 13 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.027 0.373 18441
4648 1 13 . 1 1 31 31 ARG H H 31 8.637 8.637 8.180 0.457 18441
4649 1 13 . 1 1 32 32 MET N N 32 120.006 120.006 119.705 0.301 18441
4650 1 13 . 1 1 32 32 MET HA H 32 4.359 4.359 4.220 0.139 18441
4651 1 13 . 1 1 32 32 MET CA C 32 58.490 58.490 58.467 0.023 18441
4652 1 13 . 1 1 32 32 MET CB C 32 31.677 31.677 31.984 -0.307 18441
4653 1 13 . 1 1 32 32 MET H H 32 8.327 8.327 7.871 0.456 18441
4654 1 13 . 1 1 33 33 TYR N N 33 123.220 123.220 119.470 3.750 18441
4655 1 13 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.187 0.537 18441
4656 1 13 . 1 1 33 33 TYR CA C 33 61.000 61.000 61.287 -0.287 18441
4657 1 13 . 1 1 33 33 TYR CB C 33 39.687 39.687 38.158 1.529 18441
4658 1 13 . 1 1 33 33 TYR H H 33 8.054 8.054 8.064 -0.010 18441
4659 1 13 . 1 1 34 34 HIS N N 34 120.860 120.860 118.546 2.314 18441
4660 1 13 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.416 -0.640 18441
4661 1 13 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.753 0.957 18441
4662 1 13 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.527 0.865 18441
4663 1 13 . 1 1 34 34 HIS H H 34 8.548 8.548 8.034 0.514 18441
4664 1 13 . 1 1 35 35 GLN N N 35 113.582 113.582 118.338 -4.756 18441
4665 1 13 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.281 -0.281 18441
4666 1 13 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.674 0.006 18441
4667 1 13 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.378 1.172 18441
4668 1 13 . 1 1 35 35 GLN H H 35 7.542 7.542 8.647 -1.105 18441
4669 1 13 . 1 1 36 36 THR N N 36 111.117 111.117 111.824 -0.707 18441
4670 1 13 . 1 1 36 36 THR HA H 36 4.214 4.214 4.292 -0.078 18441
4671 1 13 . 1 1 36 36 THR CA C 36 63.980 63.980 63.078 0.902 18441
4672 1 13 . 1 1 36 36 THR CB C 36 71.670 71.670 70.037 1.633 18441
4673 1 13 . 1 1 36 36 THR H H 36 8.569 8.569 8.323 0.246 18441
4674 1 13 . 1 1 37 37 MET N N 37 120.444 120.444 117.232 3.212 18441
4675 1 13 . 1 1 37 37 MET HA H 37 3.740 3.740 4.282 -0.542 18441
4676 1 13 . 1 1 37 37 MET CA C 37 56.430 56.430 56.489 -0.059 18441
4677 1 13 . 1 1 37 37 MET CB C 37 31.399 31.399 29.896 1.503 18441
4678 1 13 . 1 1 37 37 MET H H 37 9.542 9.542 8.130 1.412 18441
4679 1 13 . 1 1 38 38 ASP N N 38 117.020 117.020 120.656 -3.636 18441
4680 1 13 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.703 0.241 18441
4681 1 13 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.044 0.432 18441
4682 1 13 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.286 -0.246 18441
4683 1 13 . 1 1 38 38 ASP H H 38 7.456 7.456 7.612 -0.156 18441
4684 1 13 . 1 1 39 39 VAL N N 39 128.507 128.507 125.401 3.106 18441
4685 1 13 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.629 0.202 18441
4686 1 13 . 1 1 39 39 VAL CA C 39 64.840 64.840 63.644 1.196 18441
4687 1 13 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.231 1.469 18441
4688 1 13 . 1 1 39 39 VAL H H 39 8.425 8.425 8.728 -0.303 18441
4689 1 13 . 1 1 40 40 ALA N N 40 125.621 125.621 122.862 2.759 18441
4690 1 13 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.166 -0.179 18441
4691 1 13 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.228 0.632 18441
4692 1 13 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.336 0.134 18441
4693 1 13 . 1 1 40 40 ALA H H 40 7.998 7.998 7.674 0.324 18441
4694 1 13 . 1 1 41 41 VAL N N 41 122.132 122.132 118.936 3.196 18441
4695 1 13 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.729 -0.158 18441
4696 1 13 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.016 0.664 18441
4697 1 13 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.726 0.976 18441
4698 1 13 . 1 1 41 41 VAL H H 41 7.663 7.663 7.627 0.036 18441
4699 1 13 . 1 1 42 42 LEU N N 42 120.190 120.190 120.312 -0.122 18441
4700 1 13 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.926 0.334 18441
4701 1 13 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.857 0.133 18441
4702 1 13 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.734 -1.029 18441
4703 1 13 . 1 1 42 42 LEU H H 42 7.361 7.361 7.454 -0.093 18441
4704 1 13 . 1 1 43 43 VAL N N 43 116.802 116.802 118.399 -1.597 18441
4705 1 13 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.850 -0.433 18441
4706 1 13 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.385 2.395 18441
4707 1 13 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.631 1.349 18441
4708 1 13 . 1 1 43 43 VAL H H 43 8.062 8.062 7.827 0.235 18441
4709 1 13 . 1 1 44 44 GLY N N 44 106.242 106.242 108.051 -1.809 18441
4710 1 13 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.168 1.148 18441
4711 1 13 . 1 1 44 44 GLY H H 44 7.901 7.901 7.769 0.132 18441
4712 1 13 . 1 1 45 45 ASP N N 45 123.359 123.359 123.494 -0.135 18441
4713 1 13 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.551 0.114 18441
4714 1 13 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.910 -0.151 18441
4715 1 13 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.843 0.025 18441
4716 1 13 . 1 1 45 45 ASP H H 45 8.680 8.680 7.783 0.897 18441
4717 1 13 . 1 1 46 46 LEU N N 46 123.201 123.201 120.085 3.116 18441
4718 1 13 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.740 0.326 18441
4719 1 13 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.943 0.177 18441
4720 1 13 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.706 1.293 18441
4721 1 13 . 1 1 46 46 LEU H H 46 9.018 9.018 8.630 0.388 18441
4722 1 13 . 1 1 47 47 LYS N N 47 119.196 119.196 118.936 0.260 18441
4723 1 13 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.011 -0.041 18441
4724 1 13 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.601 0.689 18441
4725 1 13 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.296 0.845 18441
4726 1 13 . 1 1 47 47 LYS H H 47 8.017 8.017 7.669 0.348 18441
4727 1 13 . 1 1 48 48 LEU N N 48 116.358 116.358 120.419 -4.061 18441
4728 1 13 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.036 0.125 18441
4729 1 13 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.798 -0.128 18441
4730 1 13 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.318 -0.158 18441
4731 1 13 . 1 1 48 48 LEU H H 48 7.143 7.143 7.750 -0.607 18441
4732 1 13 . 1 1 49 49 VAL N N 49 112.662 112.662 114.970 -2.308 18441
4733 1 13 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.077 0.396 18441
4734 1 13 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.192 -0.132 18441
4735 1 13 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.678 2.488 18441
4736 1 13 . 1 1 49 49 VAL H H 49 7.266 7.266 7.604 -0.338 18441
4737 1 13 . 1 1 50 50 ILE N N 50 124.631 124.631 117.977 6.654 18441
4738 1 13 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.163 -0.318 18441
4739 1 13 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.430 1.160 18441
4740 1 13 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.336 -3.175 18441
4741 1 13 . 1 1 50 50 ILE H H 50 8.475 8.475 7.527 0.948 18441
4742 1 13 . 1 1 51 51 ASN N N 51 119.027 119.027 119.232 -0.205 18441
4743 1 13 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.692 0.015 18441
4744 1 13 . 1 1 51 51 ASN CA C 51 53.448 53.448 54.073 -0.625 18441
4745 1 13 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.588 0.373 18441
4746 1 13 . 1 1 51 51 ASN H H 51 7.347 7.347 8.007 -0.660 18441
4747 1 13 . 1 1 52 52 GLU N N 52 115.889 115.889 118.446 -2.557 18441
4748 1 13 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.816 0.072 18441
4749 1 13 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.248 1.537 18441
4750 1 13 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.600 0.420 18441
4751 1 13 . 1 1 52 52 GLU H H 52 7.438 7.438 7.550 -0.112 18441
4752 1 13 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.207 0.003 18441
4753 1 13 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.922 1.038 18441
4754 1 13 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.879 1.069 18441
4755 1 13 . 1 1 54 54 SER N N 54 113.711 113.711 112.483 1.228 18441
4756 1 13 . 1 1 54 54 SER HA H 54 4.173 4.173 4.312 -0.139 18441
4757 1 13 . 1 1 54 54 SER CA C 54 61.650 61.650 60.572 1.078 18441
4758 1 13 . 1 1 54 54 SER CB C 54 62.930 62.930 63.484 -0.554 18441
4759 1 13 . 1 1 54 54 SER H H 54 8.946 8.946 8.467 0.479 18441
4760 1 13 . 1 1 55 55 ARG N N 55 116.455 116.455 120.222 -3.767 18441
4761 1 13 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.376 0.028 18441
4762 1 13 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.036 0.274 18441
4763 1 13 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.288 3.324 18441
4764 1 13 . 1 1 55 55 ARG H H 55 7.759 7.759 7.649 0.110 18441
4765 1 13 . 1 1 56 56 LEU N N 56 121.468 121.468 123.230 -1.762 18441
4766 1 13 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.319 -0.184 18441
4767 1 13 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.197 -0.297 18441
4768 1 13 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.337 1.660 18441
4769 1 13 . 1 1 56 56 LEU H H 56 7.472 7.472 8.385 -0.913 18441
4770 1 13 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.195 0.501 18441
4771 1 13 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.165 0.015 18441
4772 1 13 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.047 1.343 18441
4773 1 13 . 1 1 58 58 LEU N N 58 119.923 119.923 118.200 1.723 18441
4774 1 13 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.020 0.030 18441
4775 1 13 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.770 0.549 18441
4776 1 13 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.310 0.718 18441
4777 1 13 . 1 1 58 58 LEU H H 58 8.734 8.734 7.497 1.237 18441
4778 1 13 . 1 1 59 59 PHE N N 59 116.632 116.632 119.373 -2.741 18441
4779 1 13 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.346 0.133 18441
4780 1 13 . 1 1 59 59 PHE CA C 59 63.080 63.080 60.365 2.715 18441
4781 1 13 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.566 0.285 18441
4782 1 13 . 1 1 59 59 PHE H H 59 8.312 8.312 8.839 -0.527 18441
4783 1 13 . 1 1 60 60 ASP N N 60 120.603 120.603 118.625 1.978 18441
4784 1 13 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.537 0.134 18441
4785 1 13 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.538 1.332 18441
4786 1 13 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.862 0.679 18441
4787 1 13 . 1 1 60 60 ASP H H 60 7.462 7.462 7.891 -0.429 18441
4788 1 13 . 1 1 61 61 ALA N N 61 122.470 122.470 122.993 -0.523 18441
4789 1 13 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.949 0.312 18441
4790 1 13 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.740 -0.194 18441
4791 1 13 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.888 -0.008 18441
4792 1 13 . 1 1 61 61 ALA H H 61 7.664 7.664 7.935 -0.271 18441
4793 1 13 . 1 1 62 62 ILE N N 62 115.525 115.525 118.152 -2.627 18441
4794 1 13 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.984 0.698 18441
4795 1 13 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.320 0.100 18441
4796 1 13 . 1 1 62 62 ILE CB C 62 40.155 40.155 38.063 2.092 18441
4797 1 13 . 1 1 62 62 ILE H H 62 7.653 7.653 7.729 -0.076 18441
4798 1 13 . 1 1 63 63 ARG N N 63 121.016 121.016 120.850 0.166 18441
4799 1 13 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.717 -0.243 18441
4800 1 13 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.514 0.856 18441
4801 1 13 . 1 1 63 63 ARG H H 63 6.917 6.917 7.590 -0.673 18441
4802 1 13 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.122 0.189 18441
4803 1 13 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.540 0.200 18441
4804 1 13 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.051 1.136 18441
4805 1 13 . 1 1 65 65 LEU N N 65 114.713 114.713 114.977 -0.264 18441
4806 1 13 . 1 1 65 65 LEU HA H 65 3.920 3.920 3.965 -0.045 18441
4807 1 13 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.043 -0.383 18441
4808 1 13 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.682 0.426 18441
4809 1 13 . 1 1 65 65 LEU H H 65 8.074 8.074 7.425 0.649 18441
4810 1 13 . 1 1 66 66 ILE N N 66 120.129 120.129 118.378 1.751 18441
4811 1 13 . 1 1 66 66 ILE HA H 66 4.305 4.305 3.665 0.640 18441
4812 1 13 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.053 -4.293 18441
4813 1 13 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.365 -0.721 18441
4814 1 13 . 1 1 66 66 ILE H H 66 7.398 7.398 7.427 -0.029 18441
4815 1 13 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.240 0.065 18441
4816 1 13 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.506 1.134 18441
4817 1 13 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.337 0.952 18441
4818 1 13 . 1 1 68 68 LEU N N 68 124.673 124.673 123.210 1.463 18441
4819 1 13 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.963 -0.113 18441
4820 1 13 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.212 0.408 18441
4821 1 13 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.538 0.929 18441
4822 1 13 . 1 1 68 68 LEU H H 68 8.471 8.471 8.390 0.081 18441
4823 1 13 . 1 1 69 69 LYS N N 69 115.247 115.247 117.180 -1.933 18441
4824 1 13 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.038 0.131 18441
4825 1 13 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.408 -0.388 18441
4826 1 13 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.228 1.278 18441
4827 1 13 . 1 1 69 69 LYS H H 69 8.536 8.536 8.572 -0.036 18441
4828 1 13 . 1 1 70 70 HIS N N 70 118.849 118.849 118.349 0.500 18441
4829 1 13 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.391 0.834 18441
4830 1 13 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.370 -3.481 18441
4831 1 13 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.709 5.329 18441
4832 1 13 . 1 1 70 70 HIS H H 70 8.060 8.060 8.367 -0.307 18441
4833 1 13 . 1 1 71 71 GLN N N 71 122.130 122.130 119.639 2.491 18441
4834 1 13 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.029 -0.330 18441
4835 1 13 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.621 2.069 18441
4836 1 13 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.748 0.502 18441
4837 1 13 . 1 1 71 71 GLN H H 71 7.732 7.732 8.463 -0.731 18441
4838 1 13 . 1 1 72 72 VAL N N 72 119.182 119.182 119.098 0.084 18441
4839 1 13 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.692 0.116 18441
4840 1 13 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.616 0.604 18441
4841 1 13 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.578 0.236 18441
4842 1 13 . 1 1 72 72 VAL H H 72 8.203 8.203 7.753 0.450 18441
4843 1 13 . 1 1 73 73 GLU N N 73 121.878 121.878 120.105 1.773 18441
4844 1 13 . 1 1 73 73 GLU HA H 73 3.978 3.978 3.997 -0.019 18441
4845 1 13 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.337 0.763 18441
4846 1 13 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.622 1.038 18441
4847 1 13 . 1 1 73 73 GLU H H 73 8.136 8.136 7.875 0.261 18441
4848 1 13 . 1 1 74 74 TYR N N 74 119.780 119.780 121.113 -1.333 18441
4849 1 13 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.162 -0.485 18441
4850 1 13 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.753 1.557 18441
4851 1 13 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.596 1.424 18441
4852 1 13 . 1 1 74 74 TYR H H 74 8.491 8.491 8.625 -0.134 18441
4853 1 13 . 1 1 75 75 ASP N N 75 120.231 120.231 118.145 2.086 18441
4854 1 13 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.353 -0.210 18441
4855 1 13 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.830 0.730 18441
4856 1 13 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.339 0.239 18441
4857 1 13 . 1 1 75 75 ASP H H 75 8.566 8.566 7.978 0.588 18441
4858 1 13 . 1 1 76 76 GLN N N 76 118.324 118.324 117.822 0.502 18441
4859 1 13 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.054 0.002 18441
4860 1 13 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.139 0.291 18441
4861 1 13 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.024 0.406 18441
4862 1 13 . 1 1 76 76 GLN H H 76 7.844 7.844 7.776 0.068 18441
4863 1 13 . 1 1 77 77 LEU N N 77 117.932 117.932 117.257 0.675 18441
4864 1 13 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.085 0.112 18441
4865 1 13 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.984 -0.074 18441
4866 1 13 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.356 3.048 18441
4867 1 13 . 1 1 77 77 LEU H H 77 7.665 7.665 7.534 0.131 18441
4868 1 13 . 1 1 78 78 THR N N 78 110.323 110.323 110.930 -0.607 18441
4869 1 13 . 1 1 78 78 THR HA H 78 3.709 3.709 3.991 -0.282 18441
4870 1 13 . 1 1 78 78 THR CA C 78 59.750 59.750 59.474 0.276 18441
4871 1 13 . 1 1 78 78 THR CB C 78 69.110 69.110 68.981 0.129 18441
4872 1 13 . 1 1 78 78 THR H H 78 7.130 7.130 7.539 -0.409 18441
4873 1 13 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.298 -0.052 18441
4874 1 13 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.078 0.602 18441
4875 1 13 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.308 1.083 18441
4876 1 14 . 1 1 2 2 ASP HA H 2 4.530 4.530 5.037 -0.507 18441
4877 1 14 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.777 1.813 18441
4878 1 14 . 1 1 2 2 ASP CB C 2 41.693 41.693 42.886 -1.193 18441
4879 1 14 . 1 1 3 3 ARG N N 3 121.498 121.498 120.037 1.461 18441
4880 1 14 . 1 1 3 3 ARG HA H 3 4.241 4.241 3.801 0.440 18441
4881 1 14 . 1 1 3 3 ARG CA C 3 57.670 57.670 58.680 -1.010 18441
4882 1 14 . 1 1 3 3 ARG CB C 3 30.510 30.510 29.043 1.467 18441
4883 1 14 . 1 1 3 3 ARG H H 3 8.382 8.382 8.728 -0.346 18441
4884 1 14 . 1 1 4 4 LYS N N 4 122.257 122.257 120.457 1.800 18441
4885 1 14 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.105 -0.047 18441
4886 1 14 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.331 0.379 18441
4887 1 14 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.107 1.169 18441
4888 1 14 . 1 1 4 4 LYS H H 4 8.226 8.226 8.250 -0.024 18441
4889 1 14 . 1 1 5 5 VAL N N 5 120.494 120.494 118.342 2.152 18441
4890 1 14 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.852 -0.131 18441
4891 1 14 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.245 1.405 18441
4892 1 14 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.028 1.046 18441
4893 1 14 . 1 1 5 5 VAL H H 5 8.109 8.109 8.035 0.074 18441
4894 1 14 . 1 1 6 6 ALA N N 6 123.149 123.149 123.409 -0.260 18441
4895 1 14 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.251 -0.216 18441
4896 1 14 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.272 0.618 18441
4897 1 14 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.317 0.943 18441
4898 1 14 . 1 1 6 6 ALA H H 6 8.374 8.374 7.387 0.987 18441
4899 1 14 . 1 1 7 7 ARG N N 7 119.587 119.587 118.848 0.739 18441
4900 1 14 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.889 0.112 18441
4901 1 14 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.148 0.623 18441
4902 1 14 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.023 0.747 18441
4903 1 14 . 1 1 7 7 ARG H H 7 7.992 7.992 8.233 -0.241 18441
4904 1 14 . 1 1 8 8 GLU N N 8 119.745 119.745 119.834 -0.089 18441
4905 1 14 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.105 -0.047 18441
4906 1 14 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.760 0.010 18441
4907 1 14 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.849 0.101 18441
4908 1 14 . 1 1 8 8 GLU H H 8 8.165 8.165 7.986 0.179 18441
4909 1 14 . 1 1 9 9 PHE N N 9 121.436 121.436 119.338 2.098 18441
4910 1 14 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.365 -0.238 18441
4911 1 14 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.823 3.197 18441
4912 1 14 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.536 1.087 18441
4913 1 14 . 1 1 9 9 PHE H H 9 8.180 8.180 8.104 0.076 18441
4914 1 14 . 1 1 10 10 ARG N N 10 119.028 119.028 120.082 -1.054 18441
4915 1 14 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.530 0.331 18441
4916 1 14 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.375 0.205 18441
4917 1 14 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.468 0.852 18441
4918 1 14 . 1 1 10 10 ARG H H 10 7.910 7.910 7.964 -0.054 18441
4919 1 14 . 1 1 11 11 HIS N N 11 116.563 116.563 118.580 -2.017 18441
4920 1 14 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.258 0.198 18441
4921 1 14 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.004 0.176 18441
4922 1 14 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.961 0.069 18441
4923 1 14 . 1 1 11 11 HIS H H 11 8.001 8.001 8.274 -0.273 18441
4924 1 14 . 1 1 12 12 LYS N N 12 120.773 120.773 119.047 1.726 18441
4925 1 14 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.917 0.091 18441
4926 1 14 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.560 0.420 18441
4927 1 14 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.337 0.355 18441
4928 1 14 . 1 1 12 12 LYS H H 12 7.796 7.796 7.752 0.044 18441
4929 1 14 . 1 1 13 13 VAL N N 13 120.125 120.125 120.252 -0.127 18441
4930 1 14 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.681 -0.570 18441
4931 1 14 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.080 1.100 18441
4932 1 14 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.488 0.652 18441
4933 1 14 . 1 1 13 13 VAL H H 13 7.821 7.821 7.922 -0.101 18441
4934 1 14 . 1 1 14 14 ASP N N 14 117.462 117.462 119.531 -2.069 18441
4935 1 14 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.377 -0.115 18441
4936 1 14 . 1 1 14 14 ASP CA C 14 57.400 57.400 56.987 0.413 18441
4937 1 14 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.728 0.586 18441
4938 1 14 . 1 1 14 14 ASP H H 14 8.276 8.276 7.780 0.496 18441
4939 1 14 . 1 1 15 15 PHE N N 15 117.914 117.914 119.065 -1.151 18441
4940 1 14 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.275 0.087 18441
4941 1 14 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.645 -0.455 18441
4942 1 14 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.514 1.184 18441
4943 1 14 . 1 1 15 15 PHE H H 15 7.664 7.664 7.716 -0.052 18441
4944 1 14 . 1 1 16 16 LEU N N 16 116.737 116.737 117.447 -0.710 18441
4945 1 14 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.445 -0.211 18441
4946 1 14 . 1 1 16 16 LEU CA C 16 56.420 56.420 55.248 1.173 18441
4947 1 14 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.628 2.450 18441
4948 1 14 . 1 1 16 16 LEU H H 16 7.658 7.658 7.982 -0.325 18441
4949 1 14 . 1 1 17 17 ILE N N 17 120.533 120.533 117.338 3.195 18441
4950 1 14 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.309 -0.201 18441
4951 1 14 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.295 1.245 18441
4952 1 14 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.496 0.861 18441
4953 1 14 . 1 1 17 17 ILE H H 17 8.336 8.336 7.528 0.808 18441
4954 1 14 . 1 1 18 18 GLU N N 18 124.531 124.531 123.110 1.421 18441
4955 1 14 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.069 0.141 18441
4956 1 14 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.963 -0.363 18441
4957 1 14 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.748 1.262 18441
4958 1 14 . 1 1 18 18 GLU H H 18 8.276 8.276 8.641 -0.365 18441
4959 1 14 . 1 1 19 19 ASN N N 19 117.630 117.630 118.261 -0.631 18441
4960 1 14 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.540 0.265 18441
4961 1 14 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.058 -0.320 18441
4962 1 14 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.035 2.143 18441
4963 1 14 . 1 1 19 19 ASN H H 19 7.700 7.700 7.948 -0.248 18441
4964 1 14 . 1 1 20 20 ASP N N 20 127.428 127.428 118.262 9.166 18441
4965 1 14 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.697 -0.448 18441
4966 1 14 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.571 2.279 18441
4967 1 14 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.451 -0.137 18441
4968 1 14 . 1 1 20 20 ASP H H 20 8.998 8.998 8.567 0.431 18441
4969 1 14 . 1 1 21 21 ALA N N 21 122.271 122.271 123.527 -1.256 18441
4970 1 14 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.172 0.088 18441
4971 1 14 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.275 0.725 18441
4972 1 14 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.349 0.301 18441
4973 1 14 . 1 1 21 21 ALA H H 21 8.346 8.346 8.133 0.213 18441
4974 1 14 . 1 1 22 22 GLU N N 22 118.716 118.716 118.235 0.481 18441
4975 1 14 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.029 0.085 18441
4976 1 14 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.866 0.494 18441
4977 1 14 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.953 2.819 18441
4978 1 14 . 1 1 22 22 GLU H H 22 7.724 7.724 8.865 -1.141 18441
4979 1 14 . 1 1 23 23 LYS N N 23 121.088 121.088 117.740 3.348 18441
4980 1 14 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.820 -0.009 18441
4981 1 14 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.039 2.631 18441
4982 1 14 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.855 1.215 18441
4983 1 14 . 1 1 23 23 LYS H H 23 7.618 7.618 8.145 -0.527 18441
4984 1 14 . 1 1 24 24 ASP N N 24 119.010 119.010 120.250 -1.240 18441
4985 1 14 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.380 0.109 18441
4986 1 14 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.413 1.097 18441
4987 1 14 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.416 0.421 18441
4988 1 14 . 1 1 24 24 ASP H H 24 8.424 8.424 7.586 0.838 18441
4989 1 14 . 1 1 25 25 TYR N N 25 120.417 120.417 120.374 0.043 18441
4990 1 14 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.114 0.129 18441
4991 1 14 . 1 1 25 25 TYR CA C 25 62.190 62.190 62.373 -0.183 18441
4992 1 14 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.681 -0.182 18441
4993 1 14 . 1 1 25 25 TYR H H 25 7.676 7.676 8.250 -0.574 18441
4994 1 14 . 1 1 26 26 LEU N N 26 120.960 120.960 119.841 1.119 18441
4995 1 14 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.932 -0.331 18441
4996 1 14 . 1 1 26 26 LEU CA C 26 59.440 59.440 59.170 0.270 18441
4997 1 14 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.655 0.496 18441
4998 1 14 . 1 1 26 26 LEU H H 26 7.965 7.965 7.964 0.001 18441
4999 1 14 . 1 1 27 27 TYR N N 27 116.521 116.521 118.027 -1.506 18441
5000 1 14 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.148 -0.372 18441
5001 1 14 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.093 5.317 18441
5002 1 14 . 1 1 27 27 TYR CB C 27 38.403 38.403 36.978 1.425 18441
5003 1 14 . 1 1 27 27 TYR H H 27 8.097 8.097 7.815 0.282 18441
5004 1 14 . 1 1 28 28 ASP N N 28 123.384 123.384 119.018 4.366 18441
5005 1 14 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.429 0.047 18441
5006 1 14 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.459 1.081 18441
5007 1 14 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.392 1.002 18441
5008 1 14 . 1 1 28 28 ASP H H 28 8.355 8.355 7.894 0.461 18441
5009 1 14 . 1 1 29 29 VAL N N 29 121.272 121.272 120.429 0.843 18441
5010 1 14 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.781 -0.068 18441
5011 1 14 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.076 0.574 18441
5012 1 14 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.383 0.535 18441
5013 1 14 . 1 1 29 29 VAL H H 29 8.252 8.252 8.357 -0.105 18441
5014 1 14 . 1 1 30 30 LEU N N 30 122.443 122.443 119.670 2.773 18441
5015 1 14 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.091 -0.048 18441
5016 1 14 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.480 0.400 18441
5017 1 14 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.538 0.743 18441
5018 1 14 . 1 1 30 30 LEU H H 30 7.987 7.987 8.155 -0.168 18441
5019 1 14 . 1 1 31 31 ARG N N 31 122.386 122.386 119.094 3.292 18441
5020 1 14 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.011 0.005 18441
5021 1 14 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.774 0.606 18441
5022 1 14 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.349 0.051 18441
5023 1 14 . 1 1 31 31 ARG H H 31 8.637 8.637 8.295 0.342 18441
5024 1 14 . 1 1 32 32 MET N N 32 120.006 120.006 119.564 0.442 18441
5025 1 14 . 1 1 32 32 MET HA H 32 4.359 4.359 4.203 0.156 18441
5026 1 14 . 1 1 32 32 MET CA C 32 58.490 58.490 58.072 0.418 18441
5027 1 14 . 1 1 32 32 MET CB C 32 31.677 31.677 32.012 -0.335 18441
5028 1 14 . 1 1 32 32 MET H H 32 8.327 8.327 8.381 -0.054 18441
5029 1 14 . 1 1 33 33 TYR N N 33 123.220 123.220 120.988 2.232 18441
5030 1 14 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.188 0.536 18441
5031 1 14 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.168 0.832 18441
5032 1 14 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.842 1.845 18441
5033 1 14 . 1 1 33 33 TYR H H 33 8.054 8.054 8.419 -0.365 18441
5034 1 14 . 1 1 34 34 HIS N N 34 120.860 120.860 117.152 3.708 18441
5035 1 14 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.067 -0.291 18441
5036 1 14 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.383 1.327 18441
5037 1 14 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.120 1.272 18441
5038 1 14 . 1 1 34 34 HIS H H 34 8.548 8.548 7.908 0.640 18441
5039 1 14 . 1 1 35 35 GLN N N 35 113.582 113.582 118.951 -5.369 18441
5040 1 14 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.249 -0.249 18441
5041 1 14 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.463 0.217 18441
5042 1 14 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.529 1.021 18441
5043 1 14 . 1 1 35 35 GLN H H 35 7.542 7.542 8.378 -0.836 18441
5044 1 14 . 1 1 36 36 THR N N 36 111.117 111.117 109.805 1.312 18441
5045 1 14 . 1 1 36 36 THR HA H 36 4.214 4.214 4.274 -0.060 18441
5046 1 14 . 1 1 36 36 THR CA C 36 63.980 63.980 62.730 1.250 18441
5047 1 14 . 1 1 36 36 THR CB C 36 71.670 71.670 69.631 2.039 18441
5048 1 14 . 1 1 36 36 THR H H 36 8.569 8.569 8.378 0.191 18441
5049 1 14 . 1 1 37 37 MET N N 37 120.444 120.444 119.068 1.376 18441
5050 1 14 . 1 1 37 37 MET HA H 37 3.740 3.740 4.229 -0.489 18441
5051 1 14 . 1 1 37 37 MET CA C 37 56.430 56.430 56.340 0.090 18441
5052 1 14 . 1 1 37 37 MET CB C 37 31.399 31.399 30.728 0.671 18441
5053 1 14 . 1 1 37 37 MET H H 37 9.542 9.542 7.658 1.884 18441
5054 1 14 . 1 1 38 38 ASP N N 38 117.020 117.020 120.362 -3.342 18441
5055 1 14 . 1 1 38 38 ASP HA H 38 4.944 4.944 5.018 -0.074 18441
5056 1 14 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.292 0.184 18441
5057 1 14 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.413 -0.373 18441
5058 1 14 . 1 1 38 38 ASP H H 38 7.456 7.456 7.777 -0.321 18441
5059 1 14 . 1 1 39 39 VAL N N 39 128.507 128.507 123.827 4.680 18441
5060 1 14 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.596 0.235 18441
5061 1 14 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.673 0.167 18441
5062 1 14 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.786 0.914 18441
5063 1 14 . 1 1 39 39 VAL H H 39 8.425 8.425 8.656 -0.231 18441
5064 1 14 . 1 1 40 40 ALA N N 40 125.621 125.621 122.172 3.449 18441
5065 1 14 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.090 -0.103 18441
5066 1 14 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.029 0.831 18441
5067 1 14 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.293 0.177 18441
5068 1 14 . 1 1 40 40 ALA H H 40 7.998 7.998 8.216 -0.218 18441
5069 1 14 . 1 1 41 41 VAL N N 41 122.132 122.132 119.095 3.037 18441
5070 1 14 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.734 -0.163 18441
5071 1 14 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.477 0.203 18441
5072 1 14 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.995 0.707 18441
5073 1 14 . 1 1 41 41 VAL H H 41 7.663 7.663 7.391 0.272 18441
5074 1 14 . 1 1 42 42 LEU N N 42 120.190 120.190 118.585 1.605 18441
5075 1 14 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.150 0.110 18441
5076 1 14 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.277 0.713 18441
5077 1 14 . 1 1 42 42 LEU CB C 42 40.705 40.705 40.765 -0.060 18441
5078 1 14 . 1 1 42 42 LEU H H 42 7.361 7.361 7.372 -0.011 18441
5079 1 14 . 1 1 43 43 VAL N N 43 116.802 116.802 119.947 -3.145 18441
5080 1 14 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.476 -0.059 18441
5081 1 14 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.307 2.473 18441
5082 1 14 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.515 1.465 18441
5083 1 14 . 1 1 43 43 VAL H H 43 8.062 8.062 7.726 0.336 18441
5084 1 14 . 1 1 44 44 GLY N N 44 106.242 106.242 108.023 -1.781 18441
5085 1 14 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.404 0.912 18441
5086 1 14 . 1 1 44 44 GLY H H 44 7.901 7.901 7.924 -0.023 18441
5087 1 14 . 1 1 45 45 ASP N N 45 123.359 123.359 123.275 0.084 18441
5088 1 14 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.521 0.144 18441
5089 1 14 . 1 1 45 45 ASP CA C 45 57.760 57.760 58.217 -0.457 18441
5090 1 14 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.763 0.105 18441
5091 1 14 . 1 1 45 45 ASP H H 45 8.680 8.680 7.841 0.839 18441
5092 1 14 . 1 1 46 46 LEU N N 46 123.201 123.201 120.515 2.686 18441
5093 1 14 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.925 0.141 18441
5094 1 14 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.216 -0.096 18441
5095 1 14 . 1 1 46 46 LEU CB C 46 42.999 42.999 42.025 0.974 18441
5096 1 14 . 1 1 46 46 LEU H H 46 9.018 9.018 8.561 0.457 18441
5097 1 14 . 1 1 47 47 LYS N N 47 119.196 119.196 119.178 0.018 18441
5098 1 14 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.053 -0.083 18441
5099 1 14 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.490 0.800 18441
5100 1 14 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.142 0.999 18441
5101 1 14 . 1 1 47 47 LYS H H 47 8.017 8.017 7.806 0.211 18441
5102 1 14 . 1 1 48 48 LEU N N 48 116.358 116.358 119.732 -3.374 18441
5103 1 14 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.899 0.262 18441
5104 1 14 . 1 1 48 48 LEU CA C 48 57.670 57.670 58.141 -0.471 18441
5105 1 14 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.221 -0.061 18441
5106 1 14 . 1 1 48 48 LEU H H 48 7.143 7.143 7.588 -0.445 18441
5107 1 14 . 1 1 49 49 VAL N N 49 112.662 112.662 114.754 -2.092 18441
5108 1 14 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.931 0.542 18441
5109 1 14 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.696 -0.636 18441
5110 1 14 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.016 3.151 18441
5111 1 14 . 1 1 49 49 VAL H H 49 7.266 7.266 7.498 -0.232 18441
5112 1 14 . 1 1 50 50 ILE N N 50 124.631 124.631 118.052 6.579 18441
5113 1 14 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.260 -0.415 18441
5114 1 14 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.510 1.081 18441
5115 1 14 . 1 1 50 50 ILE CB C 50 35.161 35.161 39.034 -3.873 18441
5116 1 14 . 1 1 50 50 ILE H H 50 8.475 8.475 7.704 0.772 18441
5117 1 14 . 1 1 51 51 ASN N N 51 119.027 119.027 119.177 -0.150 18441
5118 1 14 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.550 0.157 18441
5119 1 14 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.958 -0.510 18441
5120 1 14 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.511 0.450 18441
5121 1 14 . 1 1 51 51 ASN H H 51 7.347 7.347 8.001 -0.654 18441
5122 1 14 . 1 1 52 52 GLU N N 52 115.889 115.889 118.389 -2.500 18441
5123 1 14 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.786 0.102 18441
5124 1 14 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.118 1.667 18441
5125 1 14 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.698 0.322 18441
5126 1 14 . 1 1 52 52 GLU H H 52 7.438 7.438 7.599 -0.161 18441
5127 1 14 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.192 0.018 18441
5128 1 14 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.847 1.113 18441
5129 1 14 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.795 1.153 18441
5130 1 14 . 1 1 54 54 SER N N 54 113.711 113.711 112.908 0.803 18441
5131 1 14 . 1 1 54 54 SER HA H 54 4.173 4.173 4.289 -0.116 18441
5132 1 14 . 1 1 54 54 SER CA C 54 61.650 61.650 60.408 1.242 18441
5133 1 14 . 1 1 54 54 SER CB C 54 62.930 62.930 63.363 -0.433 18441
5134 1 14 . 1 1 54 54 SER H H 54 8.946 8.946 8.341 0.605 18441
5135 1 14 . 1 1 55 55 ARG N N 55 116.455 116.455 119.959 -3.504 18441
5136 1 14 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.422 -0.018 18441
5137 1 14 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.877 0.434 18441
5138 1 14 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.402 3.210 18441
5139 1 14 . 1 1 55 55 ARG H H 55 7.759 7.759 7.568 0.191 18441
5140 1 14 . 1 1 56 56 LEU N N 56 121.468 121.468 123.271 -1.803 18441
5141 1 14 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.231 -0.096 18441
5142 1 14 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.865 0.035 18441
5143 1 14 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.475 1.522 18441
5144 1 14 . 1 1 56 56 LEU H H 56 7.472 7.472 8.368 -0.896 18441
5145 1 14 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.203 0.493 18441
5146 1 14 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.161 0.019 18441
5147 1 14 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.114 1.276 18441
5148 1 14 . 1 1 58 58 LEU N N 58 119.923 119.923 117.791 2.132 18441
5149 1 14 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.146 -0.096 18441
5150 1 14 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.660 0.659 18441
5151 1 14 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.599 0.429 18441
5152 1 14 . 1 1 58 58 LEU H H 58 8.734 8.734 7.608 1.126 18441
5153 1 14 . 1 1 59 59 PHE N N 59 116.632 116.632 121.075 -4.443 18441
5154 1 14 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.288 0.191 18441
5155 1 14 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.821 1.259 18441
5156 1 14 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.047 -0.195 18441
5157 1 14 . 1 1 59 59 PHE H H 59 8.312 8.312 8.677 -0.365 18441
5158 1 14 . 1 1 60 60 ASP N N 60 120.603 120.603 117.728 2.875 18441
5159 1 14 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.451 0.220 18441
5160 1 14 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.401 1.469 18441
5161 1 14 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.610 0.931 18441
5162 1 14 . 1 1 60 60 ASP H H 60 7.462 7.462 7.796 -0.334 18441
5163 1 14 . 1 1 61 61 ALA N N 61 122.470 122.470 121.942 0.528 18441
5164 1 14 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.985 0.276 18441
5165 1 14 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.115 0.431 18441
5166 1 14 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.715 0.165 18441
5167 1 14 . 1 1 61 61 ALA H H 61 7.664 7.664 7.477 0.187 18441
5168 1 14 . 1 1 62 62 ILE N N 62 115.525 115.525 118.076 -2.551 18441
5169 1 14 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.979 0.703 18441
5170 1 14 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.623 -0.203 18441
5171 1 14 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.872 2.283 18441
5172 1 14 . 1 1 62 62 ILE H H 62 7.653 7.653 7.639 0.014 18441
5173 1 14 . 1 1 63 63 ARG N N 63 121.016 121.016 120.209 0.807 18441
5174 1 14 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.392 0.082 18441
5175 1 14 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.356 1.014 18441
5176 1 14 . 1 1 63 63 ARG H H 63 6.917 6.917 7.115 -0.198 18441
5177 1 14 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.110 0.201 18441
5178 1 14 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.581 0.159 18441
5179 1 14 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.010 1.177 18441
5180 1 14 . 1 1 65 65 LEU N N 65 114.713 114.713 115.809 -1.096 18441
5181 1 14 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.063 -0.143 18441
5182 1 14 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.110 -0.450 18441
5183 1 14 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.893 0.215 18441
5184 1 14 . 1 1 65 65 LEU H H 65 8.074 8.074 7.458 0.616 18441
5185 1 14 . 1 1 66 66 ILE N N 66 120.129 120.129 118.801 1.328 18441
5186 1 14 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.112 0.193 18441
5187 1 14 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.579 -4.819 18441
5188 1 14 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.541 -0.897 18441
5189 1 14 . 1 1 66 66 ILE H H 66 7.398 7.398 7.568 -0.170 18441
5190 1 14 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.318 -0.013 18441
5191 1 14 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.873 0.767 18441
5192 1 14 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.364 0.925 18441
5193 1 14 . 1 1 68 68 LEU N N 68 124.673 124.673 123.466 1.207 18441
5194 1 14 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.982 -0.132 18441
5195 1 14 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.390 0.230 18441
5196 1 14 . 1 1 68 68 LEU CB C 68 42.467 42.467 42.025 0.442 18441
5197 1 14 . 1 1 68 68 LEU H H 68 8.471 8.471 8.345 0.126 18441
5198 1 14 . 1 1 69 69 LYS N N 69 115.247 115.247 118.697 -3.450 18441
5199 1 14 . 1 1 69 69 LYS HA H 69 4.169 4.169 3.979 0.190 18441
5200 1 14 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.481 -0.461 18441
5201 1 14 . 1 1 69 69 LYS CB C 69 32.506 32.506 32.002 0.504 18441
5202 1 14 . 1 1 69 69 LYS H H 69 8.536 8.536 8.350 0.186 18441
5203 1 14 . 1 1 70 70 HIS N N 70 118.849 118.849 116.219 2.630 18441
5204 1 14 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.381 0.844 18441
5205 1 14 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.453 -3.564 18441
5206 1 14 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.524 5.514 18441
5207 1 14 . 1 1 70 70 HIS H H 70 8.060 8.060 8.438 -0.378 18441
5208 1 14 . 1 1 71 71 GLN N N 71 122.130 122.130 118.858 3.272 18441
5209 1 14 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.068 -0.369 18441
5210 1 14 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.023 2.667 18441
5211 1 14 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.372 0.878 18441
5212 1 14 . 1 1 71 71 GLN H H 71 7.732 7.732 8.379 -0.647 18441
5213 1 14 . 1 1 72 72 VAL N N 72 119.182 119.182 119.916 -0.734 18441
5214 1 14 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.677 0.131 18441
5215 1 14 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.939 0.281 18441
5216 1 14 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.070 0.744 18441
5217 1 14 . 1 1 72 72 VAL H H 72 8.203 8.203 7.967 0.236 18441
5218 1 14 . 1 1 73 73 GLU N N 73 121.878 121.878 120.683 1.195 18441
5219 1 14 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.024 -0.046 18441
5220 1 14 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.376 0.724 18441
5221 1 14 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.653 1.007 18441
5222 1 14 . 1 1 73 73 GLU H H 73 8.136 8.136 7.894 0.242 18441
5223 1 14 . 1 1 74 74 TYR N N 74 119.780 119.780 120.609 -0.829 18441
5224 1 14 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.095 -0.418 18441
5225 1 14 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.577 1.733 18441
5226 1 14 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.298 1.722 18441
5227 1 14 . 1 1 74 74 TYR H H 74 8.491 8.491 8.451 0.040 18441
5228 1 14 . 1 1 75 75 ASP N N 75 120.231 120.231 118.665 1.566 18441
5229 1 14 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.536 -0.393 18441
5230 1 14 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.489 0.071 18441
5231 1 14 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.808 -0.230 18441
5232 1 14 . 1 1 75 75 ASP H H 75 8.566 8.566 8.445 0.121 18441
5233 1 14 . 1 1 76 76 GLN N N 76 118.324 118.324 117.124 1.200 18441
5234 1 14 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.105 -0.049 18441
5235 1 14 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.242 0.188 18441
5236 1 14 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.210 0.220 18441
5237 1 14 . 1 1 76 76 GLN H H 76 7.844 7.844 7.995 -0.151 18441
5238 1 14 . 1 1 77 77 LEU N N 77 117.932 117.932 116.265 1.667 18441
5239 1 14 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.249 -0.052 18441
5240 1 14 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.183 -0.273 18441
5241 1 14 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.371 3.033 18441
5242 1 14 . 1 1 77 77 LEU H H 77 7.665 7.665 7.564 0.101 18441
5243 1 14 . 1 1 78 78 THR N N 78 110.323 110.323 111.715 -1.392 18441
5244 1 14 . 1 1 78 78 THR HA H 78 3.709 3.709 4.151 -0.442 18441
5245 1 14 . 1 1 78 78 THR CA C 78 59.750 59.750 65.575 -5.824 18441
5246 1 14 . 1 1 78 78 THR CB C 78 69.110 69.110 67.502 1.608 18441
5247 1 14 . 1 1 78 78 THR H H 78 7.130 7.130 7.867 -0.737 18441
5248 1 14 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.787 -0.541 18441
5249 1 14 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.379 1.301 18441
5250 1 14 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.661 -0.270 18441
5251 1 15 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.723 -0.193 18441
5252 1 15 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.391 1.199 18441
5253 1 15 . 1 1 2 2 ASP CB C 2 41.693 41.693 40.863 0.830 18441
5254 1 15 . 1 1 3 3 ARG N N 3 121.498 121.498 120.355 1.143 18441
5255 1 15 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.384 -0.143 18441
5256 1 15 . 1 1 3 3 ARG CA C 3 57.670 57.670 56.255 1.415 18441
5257 1 15 . 1 1 3 3 ARG CB C 3 30.510 30.510 31.349 -0.839 18441
5258 1 15 . 1 1 3 3 ARG H H 3 8.382 8.382 8.051 0.331 18441
5259 1 15 . 1 1 4 4 LYS N N 4 122.257 122.257 121.596 0.661 18441
5260 1 15 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.146 -0.088 18441
5261 1 15 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.093 0.618 18441
5262 1 15 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.350 0.926 18441
5263 1 15 . 1 1 4 4 LYS H H 4 8.226 8.226 8.260 -0.034 18441
5264 1 15 . 1 1 5 5 VAL N N 5 120.494 120.494 118.413 2.081 18441
5265 1 15 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.803 -0.082 18441
5266 1 15 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.392 1.258 18441
5267 1 15 . 1 1 5 5 VAL CB C 5 32.074 32.074 30.984 1.090 18441
5268 1 15 . 1 1 5 5 VAL H H 5 8.109 8.109 8.047 0.062 18441
5269 1 15 . 1 1 6 6 ALA N N 6 123.149 123.149 122.746 0.403 18441
5270 1 15 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.239 -0.204 18441
5271 1 15 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.284 0.606 18441
5272 1 15 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.323 0.937 18441
5273 1 15 . 1 1 6 6 ALA H H 6 8.374 8.374 7.593 0.781 18441
5274 1 15 . 1 1 7 7 ARG N N 7 119.587 119.587 118.471 1.116 18441
5275 1 15 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.891 0.110 18441
5276 1 15 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.308 0.462 18441
5277 1 15 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.201 0.569 18441
5278 1 15 . 1 1 7 7 ARG H H 7 7.992 7.992 7.966 0.026 18441
5279 1 15 . 1 1 8 8 GLU N N 8 119.745 119.745 120.448 -0.703 18441
5280 1 15 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.070 -0.012 18441
5281 1 15 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.968 -0.197 18441
5282 1 15 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.552 0.398 18441
5283 1 15 . 1 1 8 8 GLU H H 8 8.165 8.165 8.276 -0.111 18441
5284 1 15 . 1 1 9 9 PHE N N 9 121.436 121.436 119.750 1.686 18441
5285 1 15 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.484 -0.357 18441
5286 1 15 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.023 2.997 18441
5287 1 15 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.687 0.936 18441
5288 1 15 . 1 1 9 9 PHE H H 9 8.180 8.180 8.159 0.021 18441
5289 1 15 . 1 1 10 10 ARG N N 10 119.028 119.028 120.001 -0.973 18441
5290 1 15 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.549 0.312 18441
5291 1 15 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.738 0.842 18441
5292 1 15 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.136 1.184 18441
5293 1 15 . 1 1 10 10 ARG H H 10 7.910 7.910 7.989 -0.079 18441
5294 1 15 . 1 1 11 11 HIS N N 11 116.563 116.563 118.922 -2.359 18441
5295 1 15 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.239 0.217 18441
5296 1 15 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.824 -0.644 18441
5297 1 15 . 1 1 11 11 HIS CB C 11 30.030 30.030 30.030 -0.000 18441
5298 1 15 . 1 1 11 11 HIS H H 11 8.001 8.001 8.123 -0.122 18441
5299 1 15 . 1 1 12 12 LYS N N 12 120.773 120.773 119.475 1.298 18441
5300 1 15 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.250 -0.242 18441
5301 1 15 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.683 0.297 18441
5302 1 15 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.107 0.586 18441
5303 1 15 . 1 1 12 12 LYS H H 12 7.796 7.796 7.883 -0.087 18441
5304 1 15 . 1 1 13 13 VAL N N 13 120.125 120.125 120.688 -0.563 18441
5305 1 15 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.613 -0.502 18441
5306 1 15 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.296 0.884 18441
5307 1 15 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.862 0.278 18441
5308 1 15 . 1 1 13 13 VAL H H 13 7.821 7.821 7.873 -0.052 18441
5309 1 15 . 1 1 14 14 ASP N N 14 117.462 117.462 119.238 -1.776 18441
5310 1 15 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.290 -0.028 18441
5311 1 15 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.307 0.093 18441
5312 1 15 . 1 1 14 14 ASP CB C 14 41.314 41.314 41.030 0.284 18441
5313 1 15 . 1 1 14 14 ASP H H 14 8.276 8.276 7.796 0.480 18441
5314 1 15 . 1 1 15 15 PHE N N 15 117.914 117.914 119.273 -1.359 18441
5315 1 15 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.275 0.087 18441
5316 1 15 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.259 -0.069 18441
5317 1 15 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.469 1.229 18441
5318 1 15 . 1 1 15 15 PHE H H 15 7.664 7.664 7.743 -0.079 18441
5319 1 15 . 1 1 16 16 LEU N N 16 116.737 116.737 116.656 0.081 18441
5320 1 15 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.072 0.162 18441
5321 1 15 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.531 1.889 18441
5322 1 15 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.296 2.782 18441
5323 1 15 . 1 1 16 16 LEU H H 16 7.658 7.658 7.856 -0.198 18441
5324 1 15 . 1 1 17 17 ILE N N 17 120.533 120.533 117.298 3.235 18441
5325 1 15 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.288 -0.180 18441
5326 1 15 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.961 1.579 18441
5327 1 15 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.368 0.989 18441
5328 1 15 . 1 1 17 17 ILE H H 17 8.336 8.336 7.141 1.195 18441
5329 1 15 . 1 1 18 18 GLU N N 18 124.531 124.531 121.757 2.774 18441
5330 1 15 . 1 1 18 18 GLU HA H 18 4.210 4.210 3.985 0.225 18441
5331 1 15 . 1 1 18 18 GLU CA C 18 58.600 58.600 59.139 -0.539 18441
5332 1 15 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.599 1.411 18441
5333 1 15 . 1 1 18 18 GLU H H 18 8.276 8.276 8.599 -0.323 18441
5334 1 15 . 1 1 19 19 ASN N N 19 117.630 117.630 116.494 1.136 18441
5335 1 15 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.643 0.162 18441
5336 1 15 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.114 -0.376 18441
5337 1 15 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.431 1.747 18441
5338 1 15 . 1 1 19 19 ASN H H 19 7.700 7.700 7.895 -0.195 18441
5339 1 15 . 1 1 20 20 ASP N N 20 127.428 127.428 118.862 8.566 18441
5340 1 15 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.606 -0.357 18441
5341 1 15 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.567 2.283 18441
5342 1 15 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.532 -0.218 18441
5343 1 15 . 1 1 20 20 ASP H H 20 8.998 8.998 8.572 0.426 18441
5344 1 15 . 1 1 21 21 ALA N N 21 122.271 122.271 123.433 -1.162 18441
5345 1 15 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.113 0.147 18441
5346 1 15 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.113 0.887 18441
5347 1 15 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.219 0.431 18441
5348 1 15 . 1 1 21 21 ALA H H 21 8.346 8.346 8.120 0.226 18441
5349 1 15 . 1 1 22 22 GLU N N 22 118.716 118.716 118.616 0.100 18441
5350 1 15 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.974 0.140 18441
5351 1 15 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.212 0.148 18441
5352 1 15 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.989 2.783 18441
5353 1 15 . 1 1 22 22 GLU H H 22 7.724 7.724 8.858 -1.134 18441
5354 1 15 . 1 1 23 23 LYS N N 23 121.088 121.088 117.463 3.625 18441
5355 1 15 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.826 -0.015 18441
5356 1 15 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.974 2.696 18441
5357 1 15 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.723 1.347 18441
5358 1 15 . 1 1 23 23 LYS H H 23 7.618 7.618 8.022 -0.404 18441
5359 1 15 . 1 1 24 24 ASP N N 24 119.010 119.010 120.275 -1.265 18441
5360 1 15 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.154 0.335 18441
5361 1 15 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.197 1.313 18441
5362 1 15 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.535 0.302 18441
5363 1 15 . 1 1 24 24 ASP H H 24 8.424 8.424 7.631 0.793 18441
5364 1 15 . 1 1 25 25 TYR N N 25 120.417 120.417 120.205 0.212 18441
5365 1 15 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.117 0.126 18441
5366 1 15 . 1 1 25 25 TYR CA C 25 62.190 62.190 62.100 0.090 18441
5367 1 15 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.577 -0.078 18441
5368 1 15 . 1 1 25 25 TYR H H 25 7.676 7.676 8.162 -0.486 18441
5369 1 15 . 1 1 26 26 LEU N N 26 120.960 120.960 119.544 1.416 18441
5370 1 15 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.999 -0.398 18441
5371 1 15 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.886 0.553 18441
5372 1 15 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.709 0.442 18441
5373 1 15 . 1 1 26 26 LEU H H 26 7.965 7.965 7.858 0.107 18441
5374 1 15 . 1 1 27 27 TYR N N 27 116.521 116.521 118.093 -1.572 18441
5375 1 15 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.132 -0.356 18441
5376 1 15 . 1 1 27 27 TYR CA C 27 64.410 64.410 58.544 5.866 18441
5377 1 15 . 1 1 27 27 TYR CB C 27 38.403 38.403 36.935 1.468 18441
5378 1 15 . 1 1 27 27 TYR H H 27 8.097 8.097 7.858 0.239 18441
5379 1 15 . 1 1 28 28 ASP N N 28 123.384 123.384 119.486 3.898 18441
5380 1 15 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.372 0.104 18441
5381 1 15 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.818 0.722 18441
5382 1 15 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.795 0.599 18441
5383 1 15 . 1 1 28 28 ASP H H 28 8.355 8.355 7.852 0.503 18441
5384 1 15 . 1 1 29 29 VAL N N 29 121.272 121.272 120.253 1.019 18441
5385 1 15 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.630 0.083 18441
5386 1 15 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.901 -0.251 18441
5387 1 15 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.917 0.001 18441
5388 1 15 . 1 1 29 29 VAL H H 29 8.252 8.252 7.931 0.321 18441
5389 1 15 . 1 1 30 30 LEU N N 30 122.443 122.443 119.583 2.860 18441
5390 1 15 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.085 -0.042 18441
5391 1 15 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.250 0.630 18441
5392 1 15 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.504 0.777 18441
5393 1 15 . 1 1 30 30 LEU H H 30 7.987 7.987 7.864 0.123 18441
5394 1 15 . 1 1 31 31 ARG N N 31 122.386 122.386 118.302 4.084 18441
5395 1 15 . 1 1 31 31 ARG HA H 31 4.016 4.016 3.988 0.028 18441
5396 1 15 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.767 0.613 18441
5397 1 15 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.073 0.327 18441
5398 1 15 . 1 1 31 31 ARG H H 31 8.637 8.637 8.353 0.284 18441
5399 1 15 . 1 1 32 32 MET N N 32 120.006 120.006 118.729 1.277 18441
5400 1 15 . 1 1 32 32 MET HA H 32 4.359 4.359 4.204 0.155 18441
5401 1 15 . 1 1 32 32 MET CA C 32 58.490 58.490 59.063 -0.573 18441
5402 1 15 . 1 1 32 32 MET CB C 32 31.677 31.677 32.227 -0.551 18441
5403 1 15 . 1 1 32 32 MET H H 32 8.327 8.327 8.010 0.317 18441
5404 1 15 . 1 1 33 33 TYR N N 33 123.220 123.220 119.860 3.360 18441
5405 1 15 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.169 0.555 18441
5406 1 15 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.946 0.054 18441
5407 1 15 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.889 1.798 18441
5408 1 15 . 1 1 33 33 TYR H H 33 8.054 8.054 8.051 0.003 18441
5409 1 15 . 1 1 34 34 HIS N N 34 120.860 120.860 118.001 2.859 18441
5410 1 15 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.413 -0.637 18441
5411 1 15 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.657 1.053 18441
5412 1 15 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.632 0.760 18441
5413 1 15 . 1 1 34 34 HIS H H 34 8.548 8.548 7.942 0.606 18441
5414 1 15 . 1 1 35 35 GLN N N 35 113.582 113.582 118.458 -4.876 18441
5415 1 15 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.305 -0.305 18441
5416 1 15 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.262 0.418 18441
5417 1 15 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.444 1.107 18441
5418 1 15 . 1 1 35 35 GLN H H 35 7.542 7.542 8.588 -1.046 18441
5419 1 15 . 1 1 36 36 THR N N 36 111.117 111.117 110.926 0.191 18441
5420 1 15 . 1 1 36 36 THR HA H 36 4.214 4.214 4.328 -0.114 18441
5421 1 15 . 1 1 36 36 THR CA C 36 63.980 63.980 62.241 1.739 18441
5422 1 15 . 1 1 36 36 THR CB C 36 71.670 71.670 69.887 1.783 18441
5423 1 15 . 1 1 36 36 THR H H 36 8.569 8.569 8.283 0.286 18441
5424 1 15 . 1 1 37 37 MET N N 37 120.444 120.444 118.439 2.005 18441
5425 1 15 . 1 1 37 37 MET HA H 37 3.740 3.740 4.468 -0.728 18441
5426 1 15 . 1 1 37 37 MET CA C 37 56.430 56.430 56.477 -0.047 18441
5427 1 15 . 1 1 37 37 MET CB C 37 31.399 31.399 30.439 0.960 18441
5428 1 15 . 1 1 37 37 MET H H 37 9.542 9.542 7.926 1.616 18441
5429 1 15 . 1 1 38 38 ASP N N 38 117.020 117.020 120.261 -3.241 18441
5430 1 15 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.754 0.190 18441
5431 1 15 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.227 0.249 18441
5432 1 15 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.594 -0.554 18441
5433 1 15 . 1 1 38 38 ASP H H 38 7.456 7.456 7.734 -0.278 18441
5434 1 15 . 1 1 39 39 VAL N N 39 128.507 128.507 126.252 2.255 18441
5435 1 15 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.521 0.310 18441
5436 1 15 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.331 0.509 18441
5437 1 15 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.556 1.144 18441
5438 1 15 . 1 1 39 39 VAL H H 39 8.425 8.425 8.535 -0.110 18441
5439 1 15 . 1 1 40 40 ALA N N 40 125.621 125.621 122.281 3.340 18441
5440 1 15 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.056 -0.069 18441
5441 1 15 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.006 0.854 18441
5442 1 15 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.337 0.133 18441
5443 1 15 . 1 1 40 40 ALA H H 40 7.998 7.998 7.644 0.354 18441
5444 1 15 . 1 1 41 41 VAL N N 41 122.132 122.132 118.894 3.238 18441
5445 1 15 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.785 -0.214 18441
5446 1 15 . 1 1 41 41 VAL CA C 41 66.680 66.680 64.837 1.843 18441
5447 1 15 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.033 1.669 18441
5448 1 15 . 1 1 41 41 VAL H H 41 7.663 7.663 7.566 0.097 18441
5449 1 15 . 1 1 42 42 LEU N N 42 120.190 120.190 120.538 -0.348 18441
5450 1 15 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.891 0.369 18441
5451 1 15 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.959 0.031 18441
5452 1 15 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.644 -0.939 18441
5453 1 15 . 1 1 42 42 LEU H H 42 7.361 7.361 7.333 0.028 18441
5454 1 15 . 1 1 43 43 VAL N N 43 116.802 116.802 118.359 -1.557 18441
5455 1 15 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.465 -0.048 18441
5456 1 15 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.833 1.947 18441
5457 1 15 . 1 1 43 43 VAL CB C 43 31.980 31.980 31.140 0.840 18441
5458 1 15 . 1 1 43 43 VAL H H 43 8.062 8.062 7.711 0.351 18441
5459 1 15 . 1 1 44 44 GLY N N 44 106.242 106.242 107.383 -1.141 18441
5460 1 15 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.196 1.121 18441
5461 1 15 . 1 1 44 44 GLY H H 44 7.901 7.901 7.679 0.222 18441
5462 1 15 . 1 1 45 45 ASP N N 45 123.359 123.359 123.920 -0.561 18441
5463 1 15 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.500 0.165 18441
5464 1 15 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.946 -0.186 18441
5465 1 15 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.656 0.212 18441
5466 1 15 . 1 1 45 45 ASP H H 45 8.680 8.680 7.863 0.817 18441
5467 1 15 . 1 1 46 46 LEU N N 46 123.201 123.201 120.381 2.820 18441
5468 1 15 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.884 0.182 18441
5469 1 15 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.705 -0.585 18441
5470 1 15 . 1 1 46 46 LEU CB C 46 42.999 42.999 42.071 0.928 18441
5471 1 15 . 1 1 46 46 LEU H H 46 9.018 9.018 8.630 0.388 18441
5472 1 15 . 1 1 47 47 LYS N N 47 119.196 119.196 119.330 -0.134 18441
5473 1 15 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.955 0.015 18441
5474 1 15 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.782 0.508 18441
5475 1 15 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.202 0.939 18441
5476 1 15 . 1 1 47 47 LYS H H 47 8.017 8.017 7.777 0.240 18441
5477 1 15 . 1 1 48 48 LEU N N 48 116.358 116.358 119.167 -2.809 18441
5478 1 15 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.932 0.229 18441
5479 1 15 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.657 0.013 18441
5480 1 15 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.013 0.147 18441
5481 1 15 . 1 1 48 48 LEU H H 48 7.143 7.143 7.734 -0.591 18441
5482 1 15 . 1 1 49 49 VAL N N 49 112.662 112.662 115.794 -3.132 18441
5483 1 15 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.062 0.411 18441
5484 1 15 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.431 -0.371 18441
5485 1 15 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.712 2.454 18441
5486 1 15 . 1 1 49 49 VAL H H 49 7.266 7.266 7.560 -0.294 18441
5487 1 15 . 1 1 50 50 ILE N N 50 124.631 124.631 118.972 5.659 18441
5488 1 15 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.315 -0.470 18441
5489 1 15 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.677 0.913 18441
5490 1 15 . 1 1 50 50 ILE CB C 50 35.161 35.161 39.005 -3.844 18441
5491 1 15 . 1 1 50 50 ILE H H 50 8.475 8.475 7.528 0.947 18441
5492 1 15 . 1 1 51 51 ASN N N 51 119.027 119.027 119.731 -0.704 18441
5493 1 15 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.459 0.248 18441
5494 1 15 . 1 1 51 51 ASN CA C 51 53.448 53.448 52.810 0.638 18441
5495 1 15 . 1 1 51 51 ASN CB C 51 38.961 38.961 37.953 1.008 18441
5496 1 15 . 1 1 51 51 ASN H H 51 7.347 7.347 7.965 -0.618 18441
5497 1 15 . 1 1 52 52 GLU N N 52 115.889 115.889 118.219 -2.330 18441
5498 1 15 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.675 0.213 18441
5499 1 15 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.853 1.932 18441
5500 1 15 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.192 -0.172 18441
5501 1 15 . 1 1 52 52 GLU H H 52 7.438 7.438 7.611 -0.173 18441
5502 1 15 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.172 0.038 18441
5503 1 15 . 1 1 53 53 PRO CA C 53 66.960 66.960 66.153 0.807 18441
5504 1 15 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.782 1.166 18441
5505 1 15 . 1 1 54 54 SER N N 54 113.711 113.711 111.370 2.341 18441
5506 1 15 . 1 1 54 54 SER HA H 54 4.173 4.173 4.294 -0.121 18441
5507 1 15 . 1 1 54 54 SER CA C 54 61.650 61.650 60.328 1.322 18441
5508 1 15 . 1 1 54 54 SER CB C 54 62.930 62.930 63.327 -0.397 18441
5509 1 15 . 1 1 54 54 SER H H 54 8.946 8.946 8.384 0.562 18441
5510 1 15 . 1 1 55 55 ARG N N 55 116.455 116.455 118.823 -2.368 18441
5511 1 15 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.359 0.045 18441
5512 1 15 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.966 0.344 18441
5513 1 15 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.363 3.249 18441
5514 1 15 . 1 1 55 55 ARG H H 55 7.759 7.759 7.777 -0.018 18441
5515 1 15 . 1 1 56 56 LEU N N 56 121.468 121.468 123.340 -1.872 18441
5516 1 15 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.222 -0.087 18441
5517 1 15 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.944 -0.044 18441
5518 1 15 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.588 1.409 18441
5519 1 15 . 1 1 56 56 LEU H H 56 7.472 7.472 8.451 -0.979 18441
5520 1 15 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.223 0.473 18441
5521 1 15 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.146 0.034 18441
5522 1 15 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.160 1.230 18441
5523 1 15 . 1 1 58 58 LEU N N 58 119.923 119.923 117.619 2.304 18441
5524 1 15 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.192 -0.142 18441
5525 1 15 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.673 0.647 18441
5526 1 15 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.596 0.432 18441
5527 1 15 . 1 1 58 58 LEU H H 58 8.734 8.734 7.634 1.100 18441
5528 1 15 . 1 1 59 59 PHE N N 59 116.632 116.632 121.006 -4.374 18441
5529 1 15 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.236 0.243 18441
5530 1 15 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.988 1.092 18441
5531 1 15 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.103 -0.251 18441
5532 1 15 . 1 1 59 59 PHE H H 59 8.312 8.312 8.633 -0.321 18441
5533 1 15 . 1 1 60 60 ASP N N 60 120.603 120.603 118.760 1.843 18441
5534 1 15 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.484 0.187 18441
5535 1 15 . 1 1 60 60 ASP CA C 60 57.870 57.870 55.989 1.881 18441
5536 1 15 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.984 0.557 18441
5537 1 15 . 1 1 60 60 ASP H H 60 7.462 7.462 7.918 -0.456 18441
5538 1 15 . 1 1 61 61 ALA N N 61 122.470 122.470 122.038 0.432 18441
5539 1 15 . 1 1 61 61 ALA HA H 61 4.261 4.261 4.025 0.236 18441
5540 1 15 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.284 0.262 18441
5541 1 15 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.641 0.239 18441
5542 1 15 . 1 1 61 61 ALA H H 61 7.664 7.664 7.606 0.058 18441
5543 1 15 . 1 1 62 62 ILE N N 62 115.525 115.525 117.861 -2.336 18441
5544 1 15 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.833 0.849 18441
5545 1 15 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.197 0.223 18441
5546 1 15 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.947 2.208 18441
5547 1 15 . 1 1 62 62 ILE H H 62 7.653 7.653 7.544 0.109 18441
5548 1 15 . 1 1 63 63 ARG N N 63 121.016 121.016 120.131 0.885 18441
5549 1 15 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.533 -0.059 18441
5550 1 15 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.698 0.672 18441
5551 1 15 . 1 1 63 63 ARG H H 63 6.917 6.917 7.247 -0.330 18441
5552 1 15 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.099 0.212 18441
5553 1 15 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.578 0.162 18441
5554 1 15 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.039 1.148 18441
5555 1 15 . 1 1 65 65 LEU N N 65 114.713 114.713 115.289 -0.576 18441
5556 1 15 . 1 1 65 65 LEU HA H 65 3.920 3.920 3.978 -0.058 18441
5557 1 15 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.195 -0.535 18441
5558 1 15 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.737 0.371 18441
5559 1 15 . 1 1 65 65 LEU H H 65 8.074 8.074 7.565 0.509 18441
5560 1 15 . 1 1 66 66 ILE N N 66 120.129 120.129 118.466 1.663 18441
5561 1 15 . 1 1 66 66 ILE HA H 66 4.305 4.305 3.799 0.506 18441
5562 1 15 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.347 -4.587 18441
5563 1 15 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.540 -0.896 18441
5564 1 15 . 1 1 66 66 ILE H H 66 7.398 7.398 7.456 -0.058 18441
5565 1 15 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.401 -0.096 18441
5566 1 15 . 1 1 67 67 PRO CA C 67 63.640 63.640 61.955 1.685 18441
5567 1 15 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.534 0.755 18441
5568 1 15 . 1 1 68 68 LEU N N 68 124.673 124.673 122.985 1.688 18441
5569 1 15 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.984 -0.134 18441
5570 1 15 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.117 0.503 18441
5571 1 15 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.332 1.135 18441
5572 1 15 . 1 1 68 68 LEU H H 68 8.471 8.471 8.439 0.032 18441
5573 1 15 . 1 1 69 69 LYS N N 69 115.247 115.247 117.437 -2.190 18441
5574 1 15 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.052 0.117 18441
5575 1 15 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.465 -0.445 18441
5576 1 15 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.063 1.443 18441
5577 1 15 . 1 1 69 69 LYS H H 69 8.536 8.536 8.633 -0.097 18441
5578 1 15 . 1 1 70 70 HIS N N 70 118.849 118.849 118.707 0.142 18441
5579 1 15 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.380 0.845 18441
5580 1 15 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.394 -3.505 18441
5581 1 15 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.673 5.365 18441
5582 1 15 . 1 1 70 70 HIS H H 70 8.060 8.060 8.362 -0.302 18441
5583 1 15 . 1 1 71 71 GLN N N 71 122.130 122.130 119.671 2.459 18441
5584 1 15 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.066 -0.367 18441
5585 1 15 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.481 2.209 18441
5586 1 15 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.795 0.455 18441
5587 1 15 . 1 1 71 71 GLN H H 71 7.732 7.732 8.535 -0.803 18441
5588 1 15 . 1 1 72 72 VAL N N 72 119.182 119.182 119.914 -0.732 18441
5589 1 15 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.663 0.145 18441
5590 1 15 . 1 1 72 72 VAL CA C 72 67.220 67.220 67.122 0.098 18441
5591 1 15 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.773 0.041 18441
5592 1 15 . 1 1 72 72 VAL H H 72 8.203 8.203 7.878 0.325 18441
5593 1 15 . 1 1 73 73 GLU N N 73 121.878 121.878 120.016 1.862 18441
5594 1 15 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.049 -0.071 18441
5595 1 15 . 1 1 73 73 GLU CA C 73 60.100 60.100 58.958 1.142 18441
5596 1 15 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.440 1.220 18441
5597 1 15 . 1 1 73 73 GLU H H 73 8.136 8.136 7.884 0.252 18441
5598 1 15 . 1 1 74 74 TYR N N 74 119.780 119.780 120.628 -0.848 18441
5599 1 15 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.153 -0.476 18441
5600 1 15 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.483 1.827 18441
5601 1 15 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.639 1.381 18441
5602 1 15 . 1 1 74 74 TYR H H 74 8.491 8.491 8.594 -0.103 18441
5603 1 15 . 1 1 75 75 ASP N N 75 120.231 120.231 119.309 0.922 18441
5604 1 15 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.406 -0.263 18441
5605 1 15 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.426 0.134 18441
5606 1 15 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.779 -0.201 18441
5607 1 15 . 1 1 75 75 ASP H H 75 8.566 8.566 7.946 0.620 18441
5608 1 15 . 1 1 76 76 GLN N N 76 118.324 118.324 119.006 -0.682 18441
5609 1 15 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.137 -0.081 18441
5610 1 15 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.514 -0.084 18441
5611 1 15 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.918 0.512 18441
5612 1 15 . 1 1 76 76 GLN H H 76 7.844 7.844 7.881 -0.037 18441
5613 1 15 . 1 1 77 77 LEU N N 77 117.932 117.932 117.321 0.611 18441
5614 1 15 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.257 -0.060 18441
5615 1 15 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.364 -0.454 18441
5616 1 15 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.212 3.192 18441
5617 1 15 . 1 1 77 77 LEU H H 77 7.665 7.665 7.559 0.106 18441
5618 1 15 . 1 1 78 78 THR N N 78 110.323 110.323 110.822 -0.499 18441
5619 1 15 . 1 1 78 78 THR HA H 78 3.709 3.709 4.178 -0.469 18441
5620 1 15 . 1 1 78 78 THR CA C 78 59.750 59.750 64.318 -4.568 18441
5621 1 15 . 1 1 78 78 THR CB C 78 69.110 69.110 66.873 2.237 18441
5622 1 15 . 1 1 78 78 THR H H 78 7.130 7.130 7.615 -0.485 18441
5623 1 15 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.358 -0.112 18441
5624 1 15 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.260 0.420 18441
5625 1 15 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.095 0.296 18441
5626 1 16 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.929 -0.399 18441
5627 1 16 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.002 1.588 18441
5628 1 16 . 1 1 2 2 ASP CB C 2 41.693 41.693 42.194 -0.501 18441
5629 1 16 . 1 1 3 3 ARG N N 3 121.498 121.498 123.429 -1.931 18441
5630 1 16 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.454 -0.213 18441
5631 1 16 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.535 0.135 18441
5632 1 16 . 1 1 3 3 ARG CB C 3 30.510 30.510 31.324 -0.814 18441
5633 1 16 . 1 1 3 3 ARG H H 3 8.382 8.382 8.740 -0.358 18441
5634 1 16 . 1 1 4 4 LYS N N 4 122.257 122.257 121.544 0.713 18441
5635 1 16 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.155 -0.097 18441
5636 1 16 . 1 1 4 4 LYS CA C 4 59.710 59.710 58.994 0.716 18441
5637 1 16 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.546 1.730 18441
5638 1 16 . 1 1 4 4 LYS H H 4 8.226 8.226 8.468 -0.242 18441
5639 1 16 . 1 1 5 5 VAL N N 5 120.494 120.494 118.447 2.047 18441
5640 1 16 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.812 -0.091 18441
5641 1 16 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.431 1.218 18441
5642 1 16 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.363 0.711 18441
5643 1 16 . 1 1 5 5 VAL H H 5 8.109 8.109 8.076 0.033 18441
5644 1 16 . 1 1 6 6 ALA N N 6 123.149 123.149 122.874 0.275 18441
5645 1 16 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.243 -0.208 18441
5646 1 16 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.073 0.817 18441
5647 1 16 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.290 0.971 18441
5648 1 16 . 1 1 6 6 ALA H H 6 8.374 8.374 8.063 0.311 18441
5649 1 16 . 1 1 7 7 ARG N N 7 119.587 119.587 118.687 0.900 18441
5650 1 16 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.903 0.098 18441
5651 1 16 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.410 0.360 18441
5652 1 16 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.143 0.627 18441
5653 1 16 . 1 1 7 7 ARG H H 7 7.992 7.992 7.935 0.057 18441
5654 1 16 . 1 1 8 8 GLU N N 8 119.745 119.745 119.808 -0.063 18441
5655 1 16 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.005 0.053 18441
5656 1 16 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.732 0.038 18441
5657 1 16 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.804 0.146 18441
5658 1 16 . 1 1 8 8 GLU H H 8 8.165 8.165 7.952 0.213 18441
5659 1 16 . 1 1 9 9 PHE N N 9 121.436 121.436 119.870 1.566 18441
5660 1 16 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.389 -0.262 18441
5661 1 16 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.868 3.152 18441
5662 1 16 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.486 1.137 18441
5663 1 16 . 1 1 9 9 PHE H H 9 8.180 8.180 8.117 0.063 18441
5664 1 16 . 1 1 10 10 ARG N N 10 119.028 119.028 119.492 -0.464 18441
5665 1 16 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.595 0.266 18441
5666 1 16 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.427 1.153 18441
5667 1 16 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.183 1.137 18441
5668 1 16 . 1 1 10 10 ARG H H 10 7.910 7.910 7.959 -0.049 18441
5669 1 16 . 1 1 11 11 HIS N N 11 116.563 116.563 118.620 -2.057 18441
5670 1 16 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.264 0.192 18441
5671 1 16 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.937 -0.757 18441
5672 1 16 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.815 0.215 18441
5673 1 16 . 1 1 11 11 HIS H H 11 8.001 8.001 8.149 -0.148 18441
5674 1 16 . 1 1 12 12 LYS N N 12 120.773 120.773 119.327 1.446 18441
5675 1 16 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.088 -0.080 18441
5676 1 16 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.726 0.254 18441
5677 1 16 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.391 0.302 18441
5678 1 16 . 1 1 12 12 LYS H H 12 7.796 7.796 7.803 -0.007 18441
5679 1 16 . 1 1 13 13 VAL N N 13 120.125 120.125 120.089 0.036 18441
5680 1 16 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.660 -0.549 18441
5681 1 16 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.968 1.212 18441
5682 1 16 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.309 0.831 18441
5683 1 16 . 1 1 13 13 VAL H H 13 7.821 7.821 7.870 -0.049 18441
5684 1 16 . 1 1 14 14 ASP N N 14 117.462 117.462 119.146 -1.684 18441
5685 1 16 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.273 -0.011 18441
5686 1 16 . 1 1 14 14 ASP CA C 14 57.400 57.400 56.956 0.444 18441
5687 1 16 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.639 0.675 18441
5688 1 16 . 1 1 14 14 ASP H H 14 8.276 8.276 7.713 0.563 18441
5689 1 16 . 1 1 15 15 PHE N N 15 117.914 117.914 118.442 -0.528 18441
5690 1 16 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.265 0.097 18441
5691 1 16 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.544 -0.354 18441
5692 1 16 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.608 1.089 18441
5693 1 16 . 1 1 15 15 PHE H H 15 7.664 7.664 7.603 0.061 18441
5694 1 16 . 1 1 16 16 LEU N N 16 116.737 116.737 116.102 0.635 18441
5695 1 16 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.345 -0.111 18441
5696 1 16 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.479 1.941 18441
5697 1 16 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.240 2.838 18441
5698 1 16 . 1 1 16 16 LEU H H 16 7.658 7.658 7.858 -0.200 18441
5699 1 16 . 1 1 17 17 ILE N N 17 120.533 120.533 117.934 2.599 18441
5700 1 16 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.393 -0.285 18441
5701 1 16 . 1 1 17 17 ILE CA C 17 60.540 60.540 58.985 1.555 18441
5702 1 16 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.309 1.048 18441
5703 1 16 . 1 1 17 17 ILE H H 17 8.336 8.336 7.160 1.176 18441
5704 1 16 . 1 1 18 18 GLU N N 18 124.531 124.531 123.382 1.149 18441
5705 1 16 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.005 0.205 18441
5706 1 16 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.570 0.030 18441
5707 1 16 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.543 1.467 18441
5708 1 16 . 1 1 18 18 GLU H H 18 8.276 8.276 8.536 -0.260 18441
5709 1 16 . 1 1 19 19 ASN N N 19 117.630 117.630 119.858 -2.228 18441
5710 1 16 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.638 0.167 18441
5711 1 16 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.089 -0.351 18441
5712 1 16 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.110 2.068 18441
5713 1 16 . 1 1 19 19 ASN H H 19 7.700 7.700 7.673 0.027 18441
5714 1 16 . 1 1 20 20 ASP N N 20 127.428 127.428 123.236 4.192 18441
5715 1 16 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.411 -0.162 18441
5716 1 16 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.905 1.945 18441
5717 1 16 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.037 0.277 18441
5718 1 16 . 1 1 20 20 ASP H H 20 8.998 8.998 8.763 0.235 18441
5719 1 16 . 1 1 21 21 ALA N N 21 122.271 122.271 122.820 -0.549 18441
5720 1 16 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.114 0.146 18441
5721 1 16 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.033 0.967 18441
5722 1 16 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.175 0.475 18441
5723 1 16 . 1 1 21 21 ALA H H 21 8.346 8.346 8.125 0.221 18441
5724 1 16 . 1 1 22 22 GLU N N 22 118.716 118.716 118.173 0.543 18441
5725 1 16 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.933 0.181 18441
5726 1 16 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.978 0.382 18441
5727 1 16 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.140 2.632 18441
5728 1 16 . 1 1 22 22 GLU H H 22 7.724 7.724 8.820 -1.096 18441
5729 1 16 . 1 1 23 23 LYS N N 23 121.088 121.088 117.573 3.515 18441
5730 1 16 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.745 0.066 18441
5731 1 16 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.949 2.721 18441
5732 1 16 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.912 1.158 18441
5733 1 16 . 1 1 23 23 LYS H H 23 7.618 7.618 7.409 0.209 18441
5734 1 16 . 1 1 24 24 ASP N N 24 119.010 119.010 120.720 -1.710 18441
5735 1 16 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.614 -0.125 18441
5736 1 16 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.171 1.339 18441
5737 1 16 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.769 0.069 18441
5738 1 16 . 1 1 24 24 ASP H H 24 8.424 8.424 7.803 0.621 18441
5739 1 16 . 1 1 25 25 TYR N N 25 120.417 120.417 120.610 -0.193 18441
5740 1 16 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.237 0.006 18441
5741 1 16 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.528 0.662 18441
5742 1 16 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.512 -0.013 18441
5743 1 16 . 1 1 25 25 TYR H H 25 7.676 7.676 8.113 -0.437 18441
5744 1 16 . 1 1 26 26 LEU N N 26 120.960 120.960 119.876 1.084 18441
5745 1 16 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.807 -0.206 18441
5746 1 16 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.370 1.070 18441
5747 1 16 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.644 0.507 18441
5748 1 16 . 1 1 26 26 LEU H H 26 7.965 7.965 7.750 0.215 18441
5749 1 16 . 1 1 27 27 TYR N N 27 116.521 116.521 118.373 -1.852 18441
5750 1 16 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.069 -0.293 18441
5751 1 16 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.833 4.577 18441
5752 1 16 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.197 1.206 18441
5753 1 16 . 1 1 27 27 TYR H H 27 8.097 8.097 8.326 -0.229 18441
5754 1 16 . 1 1 28 28 ASP N N 28 123.384 123.384 119.782 3.602 18441
5755 1 16 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.406 0.070 18441
5756 1 16 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.942 0.598 18441
5757 1 16 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.715 0.679 18441
5758 1 16 . 1 1 28 28 ASP H H 28 8.355 8.355 7.865 0.489 18441
5759 1 16 . 1 1 29 29 VAL N N 29 121.272 121.272 119.874 1.398 18441
5760 1 16 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.651 0.062 18441
5761 1 16 . 1 1 29 29 VAL CA C 29 66.650 66.650 65.450 1.200 18441
5762 1 16 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.037 0.881 18441
5763 1 16 . 1 1 29 29 VAL H H 29 8.252 8.252 8.032 0.220 18441
5764 1 16 . 1 1 30 30 LEU N N 30 122.443 122.443 120.011 2.432 18441
5765 1 16 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.028 0.015 18441
5766 1 16 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.553 0.327 18441
5767 1 16 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.418 0.863 18441
5768 1 16 . 1 1 30 30 LEU H H 30 7.987 7.987 8.281 -0.294 18441
5769 1 16 . 1 1 31 31 ARG N N 31 122.386 122.386 118.145 4.241 18441
5770 1 16 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.001 0.015 18441
5771 1 16 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.727 0.653 18441
5772 1 16 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.138 0.262 18441
5773 1 16 . 1 1 31 31 ARG H H 31 8.637 8.637 8.066 0.571 18441
5774 1 16 . 1 1 32 32 MET N N 32 120.006 120.006 119.139 0.867 18441
5775 1 16 . 1 1 32 32 MET HA H 32 4.359 4.359 4.167 0.192 18441
5776 1 16 . 1 1 32 32 MET CA C 32 58.490 58.490 59.763 -1.273 18441
5777 1 16 . 1 1 32 32 MET CB C 32 31.677 31.677 32.565 -0.888 18441
5778 1 16 . 1 1 32 32 MET H H 32 8.327 8.327 7.888 0.439 18441
5779 1 16 . 1 1 33 33 TYR N N 33 123.220 123.220 120.235 2.985 18441
5780 1 16 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.192 0.532 18441
5781 1 16 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.964 0.036 18441
5782 1 16 . 1 1 33 33 TYR CB C 33 39.687 39.687 38.063 1.624 18441
5783 1 16 . 1 1 33 33 TYR H H 33 8.054 8.054 8.074 -0.020 18441
5784 1 16 . 1 1 34 34 HIS N N 34 120.860 120.860 117.370 3.490 18441
5785 1 16 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.376 -0.600 18441
5786 1 16 . 1 1 34 34 HIS CA C 34 60.710 60.710 58.957 1.753 18441
5787 1 16 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.594 0.798 18441
5788 1 16 . 1 1 34 34 HIS H H 34 8.548 8.548 8.005 0.543 18441
5789 1 16 . 1 1 35 35 GLN N N 35 113.582 113.582 118.649 -5.067 18441
5790 1 16 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.277 -0.277 18441
5791 1 16 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.354 0.326 18441
5792 1 16 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.203 1.347 18441
5793 1 16 . 1 1 35 35 GLN H H 35 7.542 7.542 8.604 -1.062 18441
5794 1 16 . 1 1 36 36 THR N N 36 111.117 111.117 112.413 -1.296 18441
5795 1 16 . 1 1 36 36 THR HA H 36 4.214 4.214 4.331 -0.117 18441
5796 1 16 . 1 1 36 36 THR CA C 36 63.980 63.980 62.292 1.688 18441
5797 1 16 . 1 1 36 36 THR CB C 36 71.670 71.670 69.829 1.841 18441
5798 1 16 . 1 1 36 36 THR H H 36 8.569 8.569 8.343 0.226 18441
5799 1 16 . 1 1 37 37 MET N N 37 120.444 120.444 119.572 0.872 18441
5800 1 16 . 1 1 37 37 MET HA H 37 3.740 3.740 4.427 -0.687 18441
5801 1 16 . 1 1 37 37 MET CA C 37 56.430 56.430 56.649 -0.219 18441
5802 1 16 . 1 1 37 37 MET CB C 37 31.399 31.399 31.844 -0.445 18441
5803 1 16 . 1 1 37 37 MET H H 37 9.542 9.542 8.088 1.454 18441
5804 1 16 . 1 1 38 38 ASP N N 38 117.020 117.020 117.535 -0.515 18441
5805 1 16 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.755 0.189 18441
5806 1 16 . 1 1 38 38 ASP CA C 38 53.476 53.476 52.303 1.173 18441
5807 1 16 . 1 1 38 38 ASP CB C 38 42.040 42.040 41.231 0.809 18441
5808 1 16 . 1 1 38 38 ASP H H 38 7.456 7.456 7.743 -0.287 18441
5809 1 16 . 1 1 39 39 VAL N N 39 128.507 128.507 122.154 6.353 18441
5810 1 16 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.600 0.231 18441
5811 1 16 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.057 0.783 18441
5812 1 16 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.260 1.440 18441
5813 1 16 . 1 1 39 39 VAL H H 39 8.425 8.425 8.543 -0.118 18441
5814 1 16 . 1 1 40 40 ALA N N 40 125.621 125.621 123.120 2.501 18441
5815 1 16 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.237 -0.250 18441
5816 1 16 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.142 0.719 18441
5817 1 16 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.089 0.381 18441
5818 1 16 . 1 1 40 40 ALA H H 40 7.998 7.998 8.148 -0.150 18441
5819 1 16 . 1 1 41 41 VAL N N 41 122.132 122.132 118.685 3.447 18441
5820 1 16 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.750 -0.179 18441
5821 1 16 . 1 1 41 41 VAL CA C 41 66.680 66.680 64.997 1.683 18441
5822 1 16 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.329 1.373 18441
5823 1 16 . 1 1 41 41 VAL H H 41 7.663 7.663 8.006 -0.343 18441
5824 1 16 . 1 1 42 42 LEU N N 42 120.190 120.190 120.338 -0.148 18441
5825 1 16 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.862 0.398 18441
5826 1 16 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.797 0.193 18441
5827 1 16 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.783 -1.079 18441
5828 1 16 . 1 1 42 42 LEU H H 42 7.361 7.361 7.443 -0.082 18441
5829 1 16 . 1 1 43 43 VAL N N 43 116.802 116.802 118.757 -1.955 18441
5830 1 16 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.636 -0.219 18441
5831 1 16 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.771 2.009 18441
5832 1 16 . 1 1 43 43 VAL CB C 43 31.980 31.980 31.296 0.684 18441
5833 1 16 . 1 1 43 43 VAL H H 43 8.062 8.062 7.755 0.307 18441
5834 1 16 . 1 1 44 44 GLY N N 44 106.242 106.242 107.731 -1.489 18441
5835 1 16 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.216 1.100 18441
5836 1 16 . 1 1 44 44 GLY H H 44 7.901 7.901 7.705 0.196 18441
5837 1 16 . 1 1 45 45 ASP N N 45 123.359 123.359 123.594 -0.235 18441
5838 1 16 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.541 0.124 18441
5839 1 16 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.370 0.390 18441
5840 1 16 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.377 0.491 18441
5841 1 16 . 1 1 45 45 ASP H H 45 8.680 8.680 7.782 0.898 18441
5842 1 16 . 1 1 46 46 LEU N N 46 123.201 123.201 120.009 3.192 18441
5843 1 16 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.663 0.403 18441
5844 1 16 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.936 0.184 18441
5845 1 16 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.462 1.538 18441
5846 1 16 . 1 1 46 46 LEU H H 46 9.018 9.018 8.519 0.499 18441
5847 1 16 . 1 1 47 47 LYS N N 47 119.196 119.196 118.385 0.811 18441
5848 1 16 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.916 0.054 18441
5849 1 16 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.566 0.724 18441
5850 1 16 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.300 0.841 18441
5851 1 16 . 1 1 47 47 LYS H H 47 8.017 8.017 7.512 0.505 18441
5852 1 16 . 1 1 48 48 LEU N N 48 116.358 116.358 118.491 -2.133 18441
5853 1 16 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.969 0.192 18441
5854 1 16 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.740 -0.070 18441
5855 1 16 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.513 -0.353 18441
5856 1 16 . 1 1 48 48 LEU H H 48 7.143 7.143 7.516 -0.373 18441
5857 1 16 . 1 1 49 49 VAL N N 49 112.662 112.662 114.018 -1.356 18441
5858 1 16 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.973 0.500 18441
5859 1 16 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.068 -0.007 18441
5860 1 16 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.679 2.487 18441
5861 1 16 . 1 1 49 49 VAL H H 49 7.266 7.266 7.467 -0.201 18441
5862 1 16 . 1 1 50 50 ILE N N 50 124.631 124.631 118.718 5.913 18441
5863 1 16 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.309 -0.464 18441
5864 1 16 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.588 1.002 18441
5865 1 16 . 1 1 50 50 ILE CB C 50 35.161 35.161 37.942 -2.781 18441
5866 1 16 . 1 1 50 50 ILE H H 50 8.475 8.475 7.582 0.893 18441
5867 1 16 . 1 1 51 51 ASN N N 51 119.027 119.027 118.828 0.199 18441
5868 1 16 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.713 -0.006 18441
5869 1 16 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.149 0.299 18441
5870 1 16 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.283 0.678 18441
5871 1 16 . 1 1 51 51 ASN H H 51 7.347 7.347 8.090 -0.743 18441
5872 1 16 . 1 1 52 52 GLU N N 52 115.889 115.889 118.798 -2.909 18441
5873 1 16 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.802 0.086 18441
5874 1 16 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.066 1.719 18441
5875 1 16 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.631 0.389 18441
5876 1 16 . 1 1 52 52 GLU H H 52 7.438 7.438 7.331 0.107 18441
5877 1 16 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.284 -0.074 18441
5878 1 16 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.491 1.469 18441
5879 1 16 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.953 0.995 18441
5880 1 16 . 1 1 54 54 SER N N 54 113.711 113.711 110.094 3.617 18441
5881 1 16 . 1 1 54 54 SER HA H 54 4.173 4.173 4.408 -0.235 18441
5882 1 16 . 1 1 54 54 SER CA C 54 61.650 61.650 60.423 1.226 18441
5883 1 16 . 1 1 54 54 SER CB C 54 62.930 62.930 63.412 -0.482 18441
5884 1 16 . 1 1 54 54 SER H H 54 8.946 8.946 8.223 0.723 18441
5885 1 16 . 1 1 55 55 ARG N N 55 116.455 116.455 119.168 -2.713 18441
5886 1 16 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.341 0.063 18441
5887 1 16 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.044 0.266 18441
5888 1 16 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.364 3.248 18441
5889 1 16 . 1 1 55 55 ARG H H 55 7.759 7.759 7.814 -0.055 18441
5890 1 16 . 1 1 56 56 LEU N N 56 121.468 121.468 123.221 -1.753 18441
5891 1 16 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.336 -0.201 18441
5892 1 16 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.936 -0.036 18441
5893 1 16 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.524 1.473 18441
5894 1 16 . 1 1 56 56 LEU H H 56 7.472 7.472 8.491 -1.019 18441
5895 1 16 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.220 0.476 18441
5896 1 16 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.194 -0.014 18441
5897 1 16 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.164 1.226 18441
5898 1 16 . 1 1 58 58 LEU N N 58 119.923 119.923 117.404 2.519 18441
5899 1 16 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.182 -0.132 18441
5900 1 16 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.506 0.814 18441
5901 1 16 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.549 0.479 18441
5902 1 16 . 1 1 58 58 LEU H H 58 8.734 8.734 7.653 1.081 18441
5903 1 16 . 1 1 59 59 PHE N N 59 116.632 116.632 121.252 -4.620 18441
5904 1 16 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.392 0.087 18441
5905 1 16 . 1 1 59 59 PHE CA C 59 63.080 63.080 59.715 3.365 18441
5906 1 16 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.830 0.022 18441
5907 1 16 . 1 1 59 59 PHE H H 59 8.312 8.312 8.619 -0.307 18441
5908 1 16 . 1 1 60 60 ASP N N 60 120.603 120.603 118.805 1.798 18441
5909 1 16 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.502 0.169 18441
5910 1 16 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.652 1.218 18441
5911 1 16 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.179 0.362 18441
5912 1 16 . 1 1 60 60 ASP H H 60 7.462 7.462 7.863 -0.401 18441
5913 1 16 . 1 1 61 61 ALA N N 61 122.470 122.470 121.419 1.051 18441
5914 1 16 . 1 1 61 61 ALA HA H 61 4.261 4.261 4.014 0.247 18441
5915 1 16 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.421 0.125 18441
5916 1 16 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.547 0.333 18441
5917 1 16 . 1 1 61 61 ALA H H 61 7.664 7.664 7.573 0.091 18441
5918 1 16 . 1 1 62 62 ILE N N 62 115.525 115.525 118.169 -2.644 18441
5919 1 16 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.063 0.619 18441
5920 1 16 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.164 0.256 18441
5921 1 16 . 1 1 62 62 ILE CB C 62 40.155 40.155 38.007 2.148 18441
5922 1 16 . 1 1 62 62 ILE H H 62 7.653 7.653 7.462 0.191 18441
5923 1 16 . 1 1 63 63 ARG N N 63 121.016 121.016 121.346 -0.330 18441
5924 1 16 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.522 -0.048 18441
5925 1 16 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.235 1.135 18441
5926 1 16 . 1 1 63 63 ARG H H 63 6.917 6.917 7.475 -0.558 18441
5927 1 16 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.163 0.148 18441
5928 1 16 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.174 0.566 18441
5929 1 16 . 1 1 64 64 PRO CB C 64 32.187 32.187 30.988 1.199 18441
5930 1 16 . 1 1 65 65 LEU N N 65 114.713 114.713 116.749 -2.036 18441
5931 1 16 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.012 -0.092 18441
5932 1 16 . 1 1 65 65 LEU CA C 65 55.660 55.660 55.917 -0.257 18441
5933 1 16 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.771 0.337 18441
5934 1 16 . 1 1 65 65 LEU H H 65 8.074 8.074 7.442 0.632 18441
5935 1 16 . 1 1 66 66 ILE N N 66 120.129 120.129 118.169 1.960 18441
5936 1 16 . 1 1 66 66 ILE HA H 66 4.305 4.305 3.726 0.579 18441
5937 1 16 . 1 1 66 66 ILE CA C 66 56.760 56.760 60.913 -4.153 18441
5938 1 16 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.375 -0.731 18441
5939 1 16 . 1 1 66 66 ILE H H 66 7.398 7.398 7.301 0.097 18441
5940 1 16 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.393 -0.088 18441
5941 1 16 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.346 1.294 18441
5942 1 16 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.498 0.791 18441
5943 1 16 . 1 1 68 68 LEU N N 68 124.673 124.673 122.339 2.334 18441
5944 1 16 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.905 -0.055 18441
5945 1 16 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.417 0.203 18441
5946 1 16 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.737 0.730 18441
5947 1 16 . 1 1 68 68 LEU H H 68 8.471 8.471 8.441 0.030 18441
5948 1 16 . 1 1 69 69 LYS N N 69 115.247 115.247 119.513 -4.266 18441
5949 1 16 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.090 0.079 18441
5950 1 16 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.412 -0.392 18441
5951 1 16 . 1 1 69 69 LYS CB C 69 32.506 32.506 32.033 0.473 18441
5952 1 16 . 1 1 69 69 LYS H H 69 8.536 8.536 8.523 0.013 18441
5953 1 16 . 1 1 70 70 HIS N N 70 118.849 118.849 117.225 1.624 18441
5954 1 16 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.374 0.851 18441
5955 1 16 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.641 -3.752 18441
5956 1 16 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.828 5.210 18441
5957 1 16 . 1 1 70 70 HIS H H 70 8.060 8.060 8.556 -0.496 18441
5958 1 16 . 1 1 71 71 GLN N N 71 122.130 122.130 119.309 2.821 18441
5959 1 16 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.105 -0.406 18441
5960 1 16 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.132 2.558 18441
5961 1 16 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.377 0.873 18441
5962 1 16 . 1 1 71 71 GLN H H 71 7.732 7.732 8.583 -0.851 18441
5963 1 16 . 1 1 72 72 VAL N N 72 119.182 119.182 119.598 -0.416 18441
5964 1 16 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.631 0.177 18441
5965 1 16 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.823 0.397 18441
5966 1 16 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.473 0.341 18441
5967 1 16 . 1 1 72 72 VAL H H 72 8.203 8.203 8.097 0.106 18441
5968 1 16 . 1 1 73 73 GLU N N 73 121.878 121.878 120.017 1.861 18441
5969 1 16 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.005 -0.027 18441
5970 1 16 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.367 0.733 18441
5971 1 16 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.512 1.148 18441
5972 1 16 . 1 1 73 73 GLU H H 73 8.136 8.136 7.863 0.273 18441
5973 1 16 . 1 1 74 74 TYR N N 74 119.780 119.780 120.733 -0.953 18441
5974 1 16 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.154 -0.477 18441
5975 1 16 . 1 1 74 74 TYR CA C 74 63.310 63.310 62.191 1.119 18441
5976 1 16 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.519 1.501 18441
5977 1 16 . 1 1 74 74 TYR H H 74 8.491 8.491 8.598 -0.107 18441
5978 1 16 . 1 1 75 75 ASP N N 75 120.231 120.231 118.203 2.028 18441
5979 1 16 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.372 -0.229 18441
5980 1 16 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.826 0.734 18441
5981 1 16 . 1 1 75 75 ASP CB C 75 40.578 40.578 41.124 -0.546 18441
5982 1 16 . 1 1 75 75 ASP H H 75 8.566 8.566 7.936 0.630 18441
5983 1 16 . 1 1 76 76 GLN N N 76 118.324 118.324 116.610 1.714 18441
5984 1 16 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.044 0.012 18441
5985 1 16 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.200 0.230 18441
5986 1 16 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.212 0.218 18441
5987 1 16 . 1 1 76 76 GLN H H 76 7.844 7.844 7.721 0.123 18441
5988 1 16 . 1 1 77 77 LEU N N 77 117.932 117.932 117.230 0.702 18441
5989 1 16 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.245 -0.048 18441
5990 1 16 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.665 0.245 18441
5991 1 16 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.948 2.456 18441
5992 1 16 . 1 1 77 77 LEU H H 77 7.665 7.665 7.449 0.216 18441
5993 1 16 . 1 1 78 78 THR N N 78 110.323 110.323 112.028 -1.705 18441
5994 1 16 . 1 1 78 78 THR HA H 78 3.709 3.709 4.315 -0.606 18441
5995 1 16 . 1 1 78 78 THR CA C 78 59.750 59.750 58.880 0.870 18441
5996 1 16 . 1 1 78 78 THR CB C 78 69.110 69.110 68.823 0.287 18441
5997 1 16 . 1 1 78 78 THR H H 78 7.130 7.130 7.603 -0.473 18441
5998 1 16 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.314 -0.068 18441
5999 1 16 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.525 0.155 18441
6000 1 16 . 1 1 79 79 PRO CB C 79 32.391 32.391 31.919 0.472 18441
6001 1 17 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.923 -0.393 18441
6002 1 17 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.002 1.588 18441
6003 1 17 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.360 0.333 18441
6004 1 17 . 1 1 3 3 ARG N N 3 121.498 121.498 119.841 1.657 18441
6005 1 17 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.230 0.011 18441
6006 1 17 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.838 -0.168 18441
6007 1 17 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.515 -0.005 18441
6008 1 17 . 1 1 3 3 ARG H H 3 8.382 8.382 8.159 0.223 18441
6009 1 17 . 1 1 4 4 LYS N N 4 122.257 122.257 120.973 1.284 18441
6010 1 17 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.089 -0.031 18441
6011 1 17 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.524 0.186 18441
6012 1 17 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.912 1.364 18441
6013 1 17 . 1 1 4 4 LYS H H 4 8.226 8.226 8.313 -0.087 18441
6014 1 17 . 1 1 5 5 VAL N N 5 120.494 120.494 117.301 3.193 18441
6015 1 17 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.850 -0.129 18441
6016 1 17 . 1 1 5 5 VAL CA C 5 66.650 66.650 66.221 0.429 18441
6017 1 17 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.579 0.495 18441
6018 1 17 . 1 1 5 5 VAL H H 5 8.109 8.109 8.138 -0.029 18441
6019 1 17 . 1 1 6 6 ALA N N 6 123.149 123.149 123.241 -0.092 18441
6020 1 17 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.276 -0.241 18441
6021 1 17 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.245 0.645 18441
6022 1 17 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.401 0.859 18441
6023 1 17 . 1 1 6 6 ALA H H 6 8.374 8.374 7.593 0.781 18441
6024 1 17 . 1 1 7 7 ARG N N 7 119.587 119.587 118.664 0.923 18441
6025 1 17 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.933 0.068 18441
6026 1 17 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.170 0.600 18441
6027 1 17 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.108 0.662 18441
6028 1 17 . 1 1 7 7 ARG H H 7 7.992 7.992 7.933 0.059 18441
6029 1 17 . 1 1 8 8 GLU N N 8 119.745 119.745 120.094 -0.349 18441
6030 1 17 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.132 -0.074 18441
6031 1 17 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.725 0.045 18441
6032 1 17 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.922 0.028 18441
6033 1 17 . 1 1 8 8 GLU H H 8 8.165 8.165 8.210 -0.045 18441
6034 1 17 . 1 1 9 9 PHE N N 9 121.436 121.436 119.761 1.675 18441
6035 1 17 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.369 -0.242 18441
6036 1 17 . 1 1 9 9 PHE CA C 9 63.020 63.020 60.048 2.972 18441
6037 1 17 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.663 0.960 18441
6038 1 17 . 1 1 9 9 PHE H H 9 8.180 8.180 8.503 -0.323 18441
6039 1 17 . 1 1 10 10 ARG N N 10 119.028 119.028 119.963 -0.935 18441
6040 1 17 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.504 0.357 18441
6041 1 17 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.938 0.642 18441
6042 1 17 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.236 1.084 18441
6043 1 17 . 1 1 10 10 ARG H H 10 7.910 7.910 7.938 -0.028 18441
6044 1 17 . 1 1 11 11 HIS N N 11 116.563 116.563 118.647 -2.084 18441
6045 1 17 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.262 0.194 18441
6046 1 17 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.256 -0.076 18441
6047 1 17 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.968 0.062 18441
6048 1 17 . 1 1 11 11 HIS H H 11 8.001 8.001 8.111 -0.110 18441
6049 1 17 . 1 1 12 12 LYS N N 12 120.773 120.773 118.788 1.985 18441
6050 1 17 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.899 0.109 18441
6051 1 17 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.529 0.451 18441
6052 1 17 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.370 0.323 18441
6053 1 17 . 1 1 12 12 LYS H H 12 7.796 7.796 7.702 0.094 18441
6054 1 17 . 1 1 13 13 VAL N N 13 120.125 120.125 120.150 -0.025 18441
6055 1 17 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.639 -0.528 18441
6056 1 17 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.561 1.619 18441
6057 1 17 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.371 0.769 18441
6058 1 17 . 1 1 13 13 VAL H H 13 7.821 7.821 7.796 0.025 18441
6059 1 17 . 1 1 14 14 ASP N N 14 117.462 117.462 119.132 -1.670 18441
6060 1 17 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.326 -0.064 18441
6061 1 17 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.091 0.309 18441
6062 1 17 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.832 0.482 18441
6063 1 17 . 1 1 14 14 ASP H H 14 8.276 8.276 7.777 0.499 18441
6064 1 17 . 1 1 15 15 PHE N N 15 117.914 117.914 118.897 -0.983 18441
6065 1 17 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.234 0.128 18441
6066 1 17 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.327 -0.137 18441
6067 1 17 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.378 1.320 18441
6068 1 17 . 1 1 15 15 PHE H H 15 7.664 7.664 7.648 0.016 18441
6069 1 17 . 1 1 16 16 LEU N N 16 116.737 116.737 116.997 -0.260 18441
6070 1 17 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.195 0.039 18441
6071 1 17 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.568 1.852 18441
6072 1 17 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.445 2.633 18441
6073 1 17 . 1 1 16 16 LEU H H 16 7.658 7.658 7.799 -0.141 18441
6074 1 17 . 1 1 17 17 ILE N N 17 120.533 120.533 117.306 3.227 18441
6075 1 17 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.294 -0.186 18441
6076 1 17 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.076 1.464 18441
6077 1 17 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.614 0.743 18441
6078 1 17 . 1 1 17 17 ILE H H 17 8.336 8.336 7.136 1.200 18441
6079 1 17 . 1 1 18 18 GLU N N 18 124.531 124.531 122.428 2.103 18441
6080 1 17 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.010 0.200 18441
6081 1 17 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.795 -0.195 18441
6082 1 17 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.696 1.314 18441
6083 1 17 . 1 1 18 18 GLU H H 18 8.276 8.276 8.525 -0.249 18441
6084 1 17 . 1 1 19 19 ASN N N 19 117.630 117.630 117.290 0.340 18441
6085 1 17 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.661 0.144 18441
6086 1 17 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.390 0.348 18441
6087 1 17 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.867 1.311 18441
6088 1 17 . 1 1 19 19 ASN H H 19 7.700 7.700 7.857 -0.157 18441
6089 1 17 . 1 1 20 20 ASP N N 20 127.428 127.428 120.904 6.524 18441
6090 1 17 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.610 -0.361 18441
6091 1 17 . 1 1 20 20 ASP CA C 20 58.850 58.850 57.108 1.742 18441
6092 1 17 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.468 -0.154 18441
6093 1 17 . 1 1 20 20 ASP H H 20 8.998 8.998 8.758 0.240 18441
6094 1 17 . 1 1 21 21 ALA N N 21 122.271 122.271 123.637 -1.366 18441
6095 1 17 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.107 0.153 18441
6096 1 17 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.529 0.471 18441
6097 1 17 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.184 0.466 18441
6098 1 17 . 1 1 21 21 ALA H H 21 8.346 8.346 7.789 0.557 18441
6099 1 17 . 1 1 22 22 GLU N N 22 118.716 118.716 117.971 0.745 18441
6100 1 17 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.946 0.168 18441
6101 1 17 . 1 1 22 22 GLU CA C 22 60.360 60.360 60.147 0.213 18441
6102 1 17 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.057 2.715 18441
6103 1 17 . 1 1 22 22 GLU H H 22 7.724 7.724 8.868 -1.144 18441
6104 1 17 . 1 1 23 23 LYS N N 23 121.088 121.088 117.499 3.589 18441
6105 1 17 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.767 0.044 18441
6106 1 17 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.096 2.574 18441
6107 1 17 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.815 1.255 18441
6108 1 17 . 1 1 23 23 LYS H H 23 7.618 7.618 7.982 -0.364 18441
6109 1 17 . 1 1 24 24 ASP N N 24 119.010 119.010 121.109 -2.099 18441
6110 1 17 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.621 -0.132 18441
6111 1 17 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.252 1.258 18441
6112 1 17 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.467 0.370 18441
6113 1 17 . 1 1 24 24 ASP H H 24 8.424 8.424 7.642 0.782 18441
6114 1 17 . 1 1 25 25 TYR N N 25 120.417 120.417 120.783 -0.366 18441
6115 1 17 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.240 0.003 18441
6116 1 17 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.690 0.500 18441
6117 1 17 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.583 -0.084 18441
6118 1 17 . 1 1 25 25 TYR H H 25 7.676 7.676 8.395 -0.719 18441
6119 1 17 . 1 1 26 26 LEU N N 26 120.960 120.960 120.025 0.935 18441
6120 1 17 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.825 -0.224 18441
6121 1 17 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.308 1.132 18441
6122 1 17 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.835 0.316 18441
6123 1 17 . 1 1 26 26 LEU H H 26 7.965 7.965 7.760 0.205 18441
6124 1 17 . 1 1 27 27 TYR N N 27 116.521 116.521 118.134 -1.613 18441
6125 1 17 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.073 -0.297 18441
6126 1 17 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.761 4.649 18441
6127 1 17 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.232 1.171 18441
6128 1 17 . 1 1 27 27 TYR H H 27 8.097 8.097 8.064 0.033 18441
6129 1 17 . 1 1 28 28 ASP N N 28 123.384 123.384 119.753 3.631 18441
6130 1 17 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.433 0.043 18441
6131 1 17 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.469 1.071 18441
6132 1 17 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.681 0.713 18441
6133 1 17 . 1 1 28 28 ASP H H 28 8.355 8.355 7.886 0.469 18441
6134 1 17 . 1 1 29 29 VAL N N 29 121.272 121.272 119.852 1.420 18441
6135 1 17 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.646 0.067 18441
6136 1 17 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.516 0.134 18441
6137 1 17 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.665 0.253 18441
6138 1 17 . 1 1 29 29 VAL H H 29 8.252 8.252 7.720 0.532 18441
6139 1 17 . 1 1 30 30 LEU N N 30 122.443 122.443 120.084 2.359 18441
6140 1 17 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.101 -0.058 18441
6141 1 17 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.376 0.504 18441
6142 1 17 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.670 0.611 18441
6143 1 17 . 1 1 30 30 LEU H H 30 7.987 7.987 8.320 -0.333 18441
6144 1 17 . 1 1 31 31 ARG N N 31 122.386 122.386 118.744 3.642 18441
6145 1 17 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.008 0.008 18441
6146 1 17 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.582 0.798 18441
6147 1 17 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.303 0.097 18441
6148 1 17 . 1 1 31 31 ARG H H 31 8.637 8.637 8.280 0.357 18441
6149 1 17 . 1 1 32 32 MET N N 32 120.006 120.006 118.815 1.191 18441
6150 1 17 . 1 1 32 32 MET HA H 32 4.359 4.359 4.212 0.147 18441
6151 1 17 . 1 1 32 32 MET CA C 32 58.490 58.490 59.194 -0.704 18441
6152 1 17 . 1 1 32 32 MET CB C 32 31.677 31.677 32.281 -0.604 18441
6153 1 17 . 1 1 32 32 MET H H 32 8.327 8.327 7.953 0.374 18441
6154 1 17 . 1 1 33 33 TYR N N 33 123.220 123.220 120.492 2.728 18441
6155 1 17 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.207 0.517 18441
6156 1 17 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.599 0.401 18441
6157 1 17 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.949 1.738 18441
6158 1 17 . 1 1 33 33 TYR H H 33 8.054 8.054 8.298 -0.244 18441
6159 1 17 . 1 1 34 34 HIS N N 34 120.860 120.860 118.176 2.684 18441
6160 1 17 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.193 -0.417 18441
6161 1 17 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.672 1.038 18441
6162 1 17 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.210 1.182 18441
6163 1 17 . 1 1 34 34 HIS H H 34 8.548 8.548 8.016 0.532 18441
6164 1 17 . 1 1 35 35 GLN N N 35 113.582 113.582 118.525 -4.943 18441
6165 1 17 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.245 -0.245 18441
6166 1 17 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.517 0.163 18441
6167 1 17 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.577 0.973 18441
6168 1 17 . 1 1 35 35 GLN H H 35 7.542 7.542 8.179 -0.637 18441
6169 1 17 . 1 1 36 36 THR N N 36 111.117 111.117 111.202 -0.085 18441
6170 1 17 . 1 1 36 36 THR HA H 36 4.214 4.214 4.245 -0.031 18441
6171 1 17 . 1 1 36 36 THR CA C 36 63.980 63.980 63.294 0.686 18441
6172 1 17 . 1 1 36 36 THR CB C 36 71.670 71.670 69.819 1.851 18441
6173 1 17 . 1 1 36 36 THR H H 36 8.569 8.569 8.523 0.046 18441
6174 1 17 . 1 1 37 37 MET N N 37 120.444 120.444 119.449 0.995 18441
6175 1 17 . 1 1 37 37 MET HA H 37 3.740 3.740 4.161 -0.421 18441
6176 1 17 . 1 1 37 37 MET CA C 37 56.430 56.430 55.542 0.888 18441
6177 1 17 . 1 1 37 37 MET CB C 37 31.399 31.399 30.541 0.858 18441
6178 1 17 . 1 1 37 37 MET H H 37 9.542 9.542 7.452 2.090 18441
6179 1 17 . 1 1 38 38 ASP N N 38 117.020 117.020 120.397 -3.377 18441
6180 1 17 . 1 1 38 38 ASP HA H 38 4.944 4.944 5.018 -0.074 18441
6181 1 17 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.355 0.122 18441
6182 1 17 . 1 1 38 38 ASP CB C 38 42.040 42.040 43.410 -1.370 18441
6183 1 17 . 1 1 38 38 ASP H H 38 7.456 7.456 7.849 -0.393 18441
6184 1 17 . 1 1 39 39 VAL N N 39 128.507 128.507 125.190 3.317 18441
6185 1 17 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.804 0.027 18441
6186 1 17 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.338 0.502 18441
6187 1 17 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.675 1.025 18441
6188 1 17 . 1 1 39 39 VAL H H 39 8.425 8.425 8.851 -0.426 18441
6189 1 17 . 1 1 40 40 ALA N N 40 125.621 125.621 123.183 2.438 18441
6190 1 17 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.142 -0.155 18441
6191 1 17 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.382 0.478 18441
6192 1 17 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.329 0.141 18441
6193 1 17 . 1 1 40 40 ALA H H 40 7.998 7.998 7.774 0.224 18441
6194 1 17 . 1 1 41 41 VAL N N 41 122.132 122.132 118.826 3.306 18441
6195 1 17 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.649 -0.078 18441
6196 1 17 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.698 0.982 18441
6197 1 17 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.738 0.964 18441
6198 1 17 . 1 1 41 41 VAL H H 41 7.663 7.663 7.499 0.164 18441
6199 1 17 . 1 1 42 42 LEU N N 42 120.190 120.190 120.545 -0.355 18441
6200 1 17 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.956 0.304 18441
6201 1 17 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.149 0.841 18441
6202 1 17 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.945 -1.240 18441
6203 1 17 . 1 1 42 42 LEU H H 42 7.361 7.361 7.385 -0.024 18441
6204 1 17 . 1 1 43 43 VAL N N 43 116.802 116.802 118.255 -1.453 18441
6205 1 17 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.640 -0.223 18441
6206 1 17 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.581 2.199 18441
6207 1 17 . 1 1 43 43 VAL CB C 43 31.980 31.980 31.250 0.730 18441
6208 1 17 . 1 1 43 43 VAL H H 43 8.062 8.062 7.726 0.336 18441
6209 1 17 . 1 1 44 44 GLY N N 44 106.242 106.242 107.493 -1.251 18441
6210 1 17 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.245 1.071 18441
6211 1 17 . 1 1 44 44 GLY H H 44 7.901 7.901 7.943 -0.042 18441
6212 1 17 . 1 1 45 45 ASP N N 45 123.359 123.359 123.237 0.122 18441
6213 1 17 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.493 0.172 18441
6214 1 17 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.170 0.590 18441
6215 1 17 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.465 0.404 18441
6216 1 17 . 1 1 45 45 ASP H H 45 8.680 8.680 7.775 0.905 18441
6217 1 17 . 1 1 46 46 LEU N N 46 123.201 123.201 120.744 2.457 18441
6218 1 17 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.679 0.387 18441
6219 1 17 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.596 0.524 18441
6220 1 17 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.542 1.457 18441
6221 1 17 . 1 1 46 46 LEU H H 46 9.018 9.018 8.450 0.568 18441
6222 1 17 . 1 1 47 47 LYS N N 47 119.196 119.196 118.532 0.664 18441
6223 1 17 . 1 1 47 47 LYS HA H 47 3.970 3.970 3.938 0.032 18441
6224 1 17 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.679 0.611 18441
6225 1 17 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.230 0.911 18441
6226 1 17 . 1 1 47 47 LYS H H 47 8.017 8.017 7.518 0.499 18441
6227 1 17 . 1 1 48 48 LEU N N 48 116.358 116.358 119.807 -3.449 18441
6228 1 17 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.065 0.096 18441
6229 1 17 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.693 -0.023 18441
6230 1 17 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.257 -0.097 18441
6231 1 17 . 1 1 48 48 LEU H H 48 7.143 7.143 7.496 -0.353 18441
6232 1 17 . 1 1 49 49 VAL N N 49 112.662 112.662 114.336 -1.674 18441
6233 1 17 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.058 0.415 18441
6234 1 17 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.283 -0.223 18441
6235 1 17 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.656 2.510 18441
6236 1 17 . 1 1 49 49 VAL H H 49 7.266 7.266 7.533 -0.267 18441
6237 1 17 . 1 1 50 50 ILE N N 50 124.631 124.631 116.785 7.846 18441
6238 1 17 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.336 -0.491 18441
6239 1 17 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.355 1.236 18441
6240 1 17 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.500 -3.339 18441
6241 1 17 . 1 1 50 50 ILE H H 50 8.475 8.475 7.527 0.948 18441
6242 1 17 . 1 1 51 51 ASN N N 51 119.027 119.027 118.845 0.182 18441
6243 1 17 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.716 -0.009 18441
6244 1 17 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.319 0.130 18441
6245 1 17 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.312 0.649 18441
6246 1 17 . 1 1 51 51 ASN H H 51 7.347 7.347 8.190 -0.843 18441
6247 1 17 . 1 1 52 52 GLU N N 52 115.889 115.889 118.368 -2.479 18441
6248 1 17 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.768 0.120 18441
6249 1 17 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.837 1.948 18441
6250 1 17 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.584 -0.564 18441
6251 1 17 . 1 1 52 52 GLU H H 52 7.438 7.438 7.588 -0.150 18441
6252 1 17 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.231 -0.021 18441
6253 1 17 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.248 1.712 18441
6254 1 17 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.900 1.048 18441
6255 1 17 . 1 1 54 54 SER N N 54 113.711 113.711 112.139 1.572 18441
6256 1 17 . 1 1 54 54 SER HA H 54 4.173 4.173 4.305 -0.132 18441
6257 1 17 . 1 1 54 54 SER CA C 54 61.650 61.650 60.069 1.581 18441
6258 1 17 . 1 1 54 54 SER CB C 54 62.930 62.930 63.208 -0.278 18441
6259 1 17 . 1 1 54 54 SER H H 54 8.946 8.946 8.067 0.879 18441
6260 1 17 . 1 1 55 55 ARG N N 55 116.455 116.455 120.059 -3.604 18441
6261 1 17 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.366 0.038 18441
6262 1 17 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.688 0.622 18441
6263 1 17 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.363 3.249 18441
6264 1 17 . 1 1 55 55 ARG H H 55 7.759 7.759 7.294 0.465 18441
6265 1 17 . 1 1 56 56 LEU N N 56 121.468 121.468 123.404 -1.936 18441
6266 1 17 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.321 -0.186 18441
6267 1 17 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.057 -0.157 18441
6268 1 17 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.516 1.481 18441
6269 1 17 . 1 1 56 56 LEU H H 56 7.472 7.472 8.478 -1.006 18441
6270 1 17 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.205 0.491 18441
6271 1 17 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.138 0.042 18441
6272 1 17 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.143 1.246 18441
6273 1 17 . 1 1 58 58 LEU N N 58 119.923 119.923 118.251 1.672 18441
6274 1 17 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.058 -0.008 18441
6275 1 17 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.823 0.497 18441
6276 1 17 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.633 0.395 18441
6277 1 17 . 1 1 58 58 LEU H H 58 8.734 8.734 7.722 1.012 18441
6278 1 17 . 1 1 59 59 PHE N N 59 116.632 116.632 119.958 -3.326 18441
6279 1 17 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.263 0.216 18441
6280 1 17 . 1 1 59 59 PHE CA C 59 63.080 63.080 60.331 2.749 18441
6281 1 17 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.654 0.198 18441
6282 1 17 . 1 1 59 59 PHE H H 59 8.312 8.312 8.460 -0.148 18441
6283 1 17 . 1 1 60 60 ASP N N 60 120.603 120.603 119.139 1.464 18441
6284 1 17 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.431 0.240 18441
6285 1 17 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.240 1.630 18441
6286 1 17 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.954 0.587 18441
6287 1 17 . 1 1 60 60 ASP H H 60 7.462 7.462 7.875 -0.413 18441
6288 1 17 . 1 1 61 61 ALA N N 61 122.470 122.470 122.601 -0.131 18441
6289 1 17 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.969 0.292 18441
6290 1 17 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.585 -0.039 18441
6291 1 17 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.894 -0.014 18441
6292 1 17 . 1 1 61 61 ALA H H 61 7.664 7.664 7.673 -0.009 18441
6293 1 17 . 1 1 62 62 ILE N N 62 115.525 115.525 117.820 -2.295 18441
6294 1 17 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.963 0.719 18441
6295 1 17 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.226 0.194 18441
6296 1 17 . 1 1 62 62 ILE CB C 62 40.155 40.155 38.108 2.047 18441
6297 1 17 . 1 1 62 62 ILE H H 62 7.653 7.653 7.642 0.011 18441
6298 1 17 . 1 1 63 63 ARG N N 63 121.016 121.016 120.663 0.353 18441
6299 1 17 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.433 0.041 18441
6300 1 17 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.279 1.091 18441
6301 1 17 . 1 1 63 63 ARG H H 63 6.917 6.917 7.424 -0.507 18441
6302 1 17 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.132 0.179 18441
6303 1 17 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.446 0.294 18441
6304 1 17 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.113 1.074 18441
6305 1 17 . 1 1 65 65 LEU N N 65 114.713 114.713 115.074 -0.361 18441
6306 1 17 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.072 -0.152 18441
6307 1 17 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.110 -0.450 18441
6308 1 17 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.825 0.283 18441
6309 1 17 . 1 1 65 65 LEU H H 65 8.074 8.074 7.627 0.447 18441
6310 1 17 . 1 1 66 66 ILE N N 66 120.129 120.129 118.813 1.316 18441
6311 1 17 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.057 0.248 18441
6312 1 17 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.722 -4.962 18441
6313 1 17 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.411 -0.767 18441
6314 1 17 . 1 1 66 66 ILE H H 66 7.398 7.398 7.360 0.038 18441
6315 1 17 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.353 -0.048 18441
6316 1 17 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.614 1.026 18441
6317 1 17 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.403 0.887 18441
6318 1 17 . 1 1 68 68 LEU N N 68 124.673 124.673 123.278 1.395 18441
6319 1 17 . 1 1 68 68 LEU HA H 68 3.850 3.850 4.001 -0.151 18441
6320 1 17 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.265 0.355 18441
6321 1 17 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.920 0.547 18441
6322 1 17 . 1 1 68 68 LEU H H 68 8.471 8.471 8.378 0.093 18441
6323 1 17 . 1 1 69 69 LYS N N 69 115.247 115.247 118.752 -3.505 18441
6324 1 17 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.020 0.149 18441
6325 1 17 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.057 -0.037 18441
6326 1 17 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.534 0.972 18441
6327 1 17 . 1 1 69 69 LYS H H 69 8.536 8.536 8.491 0.045 18441
6328 1 17 . 1 1 70 70 HIS N N 70 118.849 118.849 116.954 1.895 18441
6329 1 17 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.460 0.765 18441
6330 1 17 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.544 -3.655 18441
6331 1 17 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.547 5.491 18441
6332 1 17 . 1 1 70 70 HIS H H 70 8.060 8.060 8.448 -0.388 18441
6333 1 17 . 1 1 71 71 GLN N N 71 122.130 122.130 119.437 2.693 18441
6334 1 17 . 1 1 71 71 GLN HA H 71 3.699 3.699 3.988 -0.289 18441
6335 1 17 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.645 2.045 18441
6336 1 17 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.806 0.444 18441
6337 1 17 . 1 1 71 71 GLN H H 71 7.732 7.732 8.489 -0.757 18441
6338 1 17 . 1 1 72 72 VAL N N 72 119.182 119.182 119.766 -0.584 18441
6339 1 17 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.662 0.146 18441
6340 1 17 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.616 0.604 18441
6341 1 17 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.654 0.160 18441
6342 1 17 . 1 1 72 72 VAL H H 72 8.203 8.203 7.837 0.366 18441
6343 1 17 . 1 1 73 73 GLU N N 73 121.878 121.878 119.609 2.269 18441
6344 1 17 . 1 1 73 73 GLU HA H 73 3.978 3.978 3.981 -0.003 18441
6345 1 17 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.263 0.837 18441
6346 1 17 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.707 0.953 18441
6347 1 17 . 1 1 73 73 GLU H H 73 8.136 8.136 7.808 0.328 18441
6348 1 17 . 1 1 74 74 TYR N N 74 119.780 119.780 121.324 -1.544 18441
6349 1 17 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.061 -0.384 18441
6350 1 17 . 1 1 74 74 TYR CA C 74 63.310 63.310 62.196 1.114 18441
6351 1 17 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.419 1.601 18441
6352 1 17 . 1 1 74 74 TYR H H 74 8.491 8.491 8.489 0.002 18441
6353 1 17 . 1 1 75 75 ASP N N 75 120.231 120.231 118.734 1.497 18441
6354 1 17 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.470 -0.327 18441
6355 1 17 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.161 0.399 18441
6356 1 17 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.282 0.296 18441
6357 1 17 . 1 1 75 75 ASP H H 75 8.566 8.566 8.013 0.553 18441
6358 1 17 . 1 1 76 76 GLN N N 76 118.324 118.324 118.165 0.159 18441
6359 1 17 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.022 0.034 18441
6360 1 17 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.083 0.347 18441
6361 1 17 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.754 0.676 18441
6362 1 17 . 1 1 76 76 GLN H H 76 7.844 7.844 7.667 0.177 18441
6363 1 17 . 1 1 77 77 LEU N N 77 117.932 117.932 117.010 0.922 18441
6364 1 17 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.258 -0.061 18441
6365 1 17 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.798 0.112 18441
6366 1 17 . 1 1 77 77 LEU CB C 77 45.404 45.404 43.302 2.102 18441
6367 1 17 . 1 1 77 77 LEU H H 77 7.665 7.665 7.410 0.255 18441
6368 1 17 . 1 1 78 78 THR N N 78 110.323 110.323 113.139 -2.816 18441
6369 1 17 . 1 1 78 78 THR HA H 78 3.709 3.709 4.458 -0.749 18441
6370 1 17 . 1 1 78 78 THR CA C 78 59.750 59.750 58.632 1.118 18441
6371 1 17 . 1 1 78 78 THR CB C 78 69.110 69.110 70.320 -1.210 18441
6372 1 17 . 1 1 78 78 THR H H 78 7.130 7.130 7.876 -0.746 18441
6373 1 17 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.513 -0.267 18441
6374 1 17 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.580 1.100 18441
6375 1 17 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.600 -0.209 18441
6376 1 18 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.849 -0.319 18441
6377 1 18 . 1 1 2 2 ASP CA C 2 55.590 55.590 53.660 1.930 18441
6378 1 18 . 1 1 2 2 ASP CB C 2 41.693 41.693 42.888 -1.195 18441
6379 1 18 . 1 1 3 3 ARG N N 3 121.498 121.498 119.460 2.038 18441
6380 1 18 . 1 1 3 3 ARG HA H 3 4.241 4.241 3.909 0.332 18441
6381 1 18 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.998 -0.328 18441
6382 1 18 . 1 1 3 3 ARG CB C 3 30.510 30.510 29.412 1.099 18441
6383 1 18 . 1 1 3 3 ARG H H 3 8.382 8.382 8.679 -0.297 18441
6384 1 18 . 1 1 4 4 LYS N N 4 122.257 122.257 120.656 1.601 18441
6385 1 18 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.100 -0.042 18441
6386 1 18 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.194 0.516 18441
6387 1 18 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.317 0.959 18441
6388 1 18 . 1 1 4 4 LYS H H 4 8.226 8.226 7.817 0.409 18441
6389 1 18 . 1 1 5 5 VAL N N 5 120.494 120.494 119.189 1.305 18441
6390 1 18 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.881 -0.160 18441
6391 1 18 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.668 0.982 18441
6392 1 18 . 1 1 5 5 VAL CB C 5 32.074 32.074 30.854 1.220 18441
6393 1 18 . 1 1 5 5 VAL H H 5 8.109 8.109 8.082 0.027 18441
6394 1 18 . 1 1 6 6 ALA N N 6 123.149 123.149 123.075 0.074 18441
6395 1 18 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.345 -0.310 18441
6396 1 18 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.361 0.529 18441
6397 1 18 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.369 0.891 18441
6398 1 18 . 1 1 6 6 ALA H H 6 8.374 8.374 8.302 0.072 18441
6399 1 18 . 1 1 7 7 ARG N N 7 119.587 119.587 119.055 0.532 18441
6400 1 18 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.943 0.058 18441
6401 1 18 . 1 1 7 7 ARG CA C 7 59.770 59.770 58.754 1.016 18441
6402 1 18 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.055 0.715 18441
6403 1 18 . 1 1 7 7 ARG H H 7 7.992 7.992 8.628 -0.636 18441
6404 1 18 . 1 1 8 8 GLU N N 8 119.745 119.745 120.349 -0.604 18441
6405 1 18 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.143 -0.085 18441
6406 1 18 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.471 0.299 18441
6407 1 18 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.796 0.154 18441
6408 1 18 . 1 1 8 8 GLU H H 8 8.165 8.165 8.401 -0.236 18441
6409 1 18 . 1 1 9 9 PHE N N 9 121.436 121.436 119.585 1.851 18441
6410 1 18 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.373 -0.246 18441
6411 1 18 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.958 3.062 18441
6412 1 18 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.528 1.095 18441
6413 1 18 . 1 1 9 9 PHE H H 9 8.180 8.180 8.246 -0.066 18441
6414 1 18 . 1 1 10 10 ARG N N 10 119.028 119.028 119.819 -0.791 18441
6415 1 18 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.524 0.337 18441
6416 1 18 . 1 1 10 10 ARG CA C 10 59.580 59.580 59.224 0.356 18441
6417 1 18 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.438 0.882 18441
6418 1 18 . 1 1 10 10 ARG H H 10 7.910 7.910 7.949 -0.039 18441
6419 1 18 . 1 1 11 11 HIS N N 11 116.563 116.563 118.644 -2.081 18441
6420 1 18 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.251 0.205 18441
6421 1 18 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.116 0.064 18441
6422 1 18 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.924 0.106 18441
6423 1 18 . 1 1 11 11 HIS H H 11 8.001 8.001 8.116 -0.115 18441
6424 1 18 . 1 1 12 12 LYS N N 12 120.773 120.773 119.044 1.729 18441
6425 1 18 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.954 0.054 18441
6426 1 18 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.551 0.429 18441
6427 1 18 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.382 0.311 18441
6428 1 18 . 1 1 12 12 LYS H H 12 7.796 7.796 7.715 0.081 18441
6429 1 18 . 1 1 13 13 VAL N N 13 120.125 120.125 120.623 -0.498 18441
6430 1 18 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.576 -0.465 18441
6431 1 18 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.927 1.253 18441
6432 1 18 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.610 0.530 18441
6433 1 18 . 1 1 13 13 VAL H H 13 7.821 7.821 7.823 -0.002 18441
6434 1 18 . 1 1 14 14 ASP N N 14 117.462 117.462 118.965 -1.503 18441
6435 1 18 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.371 -0.109 18441
6436 1 18 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.052 0.348 18441
6437 1 18 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.815 0.499 18441
6438 1 18 . 1 1 14 14 ASP H H 14 8.276 8.276 7.820 0.456 18441
6439 1 18 . 1 1 15 15 PHE N N 15 117.914 117.914 119.480 -1.566 18441
6440 1 18 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.327 0.035 18441
6441 1 18 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.438 -0.248 18441
6442 1 18 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.478 1.220 18441
6443 1 18 . 1 1 15 15 PHE H H 15 7.664 7.664 7.712 -0.048 18441
6444 1 18 . 1 1 16 16 LEU N N 16 116.737 116.737 116.766 -0.029 18441
6445 1 18 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.110 0.124 18441
6446 1 18 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.914 1.506 18441
6447 1 18 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.204 2.874 18441
6448 1 18 . 1 1 16 16 LEU H H 16 7.658 7.658 7.920 -0.262 18441
6449 1 18 . 1 1 17 17 ILE N N 17 120.533 120.533 116.477 4.056 18441
6450 1 18 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.298 -0.190 18441
6451 1 18 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.149 1.391 18441
6452 1 18 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.369 0.988 18441
6453 1 18 . 1 1 17 17 ILE H H 17 8.336 8.336 7.418 0.918 18441
6454 1 18 . 1 1 18 18 GLU N N 18 124.531 124.531 122.688 1.843 18441
6455 1 18 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.069 0.141 18441
6456 1 18 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.451 0.149 18441
6457 1 18 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.562 1.448 18441
6458 1 18 . 1 1 18 18 GLU H H 18 8.276 8.276 8.755 -0.479 18441
6459 1 18 . 1 1 19 19 ASN N N 19 117.630 117.630 118.979 -1.349 18441
6460 1 18 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.621 0.184 18441
6461 1 18 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.654 0.084 18441
6462 1 18 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.065 2.114 18441
6463 1 18 . 1 1 19 19 ASN H H 19 7.700 7.700 8.184 -0.484 18441
6464 1 18 . 1 1 20 20 ASP N N 20 127.428 127.428 118.704 8.724 18441
6465 1 18 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.681 -0.432 18441
6466 1 18 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.597 2.253 18441
6467 1 18 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.350 -0.036 18441
6468 1 18 . 1 1 20 20 ASP H H 20 8.998 8.998 8.656 0.342 18441
6469 1 18 . 1 1 21 21 ALA N N 21 122.271 122.271 123.529 -1.258 18441
6470 1 18 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.140 0.120 18441
6471 1 18 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.258 0.742 18441
6472 1 18 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.236 0.414 18441
6473 1 18 . 1 1 21 21 ALA H H 21 8.346 8.346 8.156 0.190 18441
6474 1 18 . 1 1 22 22 GLU N N 22 118.716 118.716 118.118 0.598 18441
6475 1 18 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.002 0.112 18441
6476 1 18 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.709 0.651 18441
6477 1 18 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.938 2.834 18441
6478 1 18 . 1 1 22 22 GLU H H 22 7.724 7.724 8.872 -1.148 18441
6479 1 18 . 1 1 23 23 LYS N N 23 121.088 121.088 117.617 3.471 18441
6480 1 18 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.745 0.066 18441
6481 1 18 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.841 2.829 18441
6482 1 18 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.777 1.293 18441
6483 1 18 . 1 1 23 23 LYS H H 23 7.618 7.618 8.182 -0.564 18441
6484 1 18 . 1 1 24 24 ASP N N 24 119.010 119.010 120.688 -1.678 18441
6485 1 18 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.528 -0.039 18441
6486 1 18 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.207 1.303 18441
6487 1 18 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.815 0.022 18441
6488 1 18 . 1 1 24 24 ASP H H 24 8.424 8.424 7.904 0.520 18441
6489 1 18 . 1 1 25 25 TYR N N 25 120.417 120.417 120.547 -0.130 18441
6490 1 18 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.146 0.097 18441
6491 1 18 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.288 0.902 18441
6492 1 18 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.472 0.027 18441
6493 1 18 . 1 1 25 25 TYR H H 25 7.676 7.676 8.156 -0.480 18441
6494 1 18 . 1 1 26 26 LEU N N 26 120.960 120.960 119.629 1.331 18441
6495 1 18 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.784 -0.183 18441
6496 1 18 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.441 0.999 18441
6497 1 18 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.664 0.487 18441
6498 1 18 . 1 1 26 26 LEU H H 26 7.965 7.965 7.692 0.273 18441
6499 1 18 . 1 1 27 27 TYR N N 27 116.521 116.521 117.785 -1.264 18441
6500 1 18 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.085 -0.309 18441
6501 1 18 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.468 4.942 18441
6502 1 18 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.034 1.369 18441
6503 1 18 . 1 1 27 27 TYR H H 27 8.097 8.097 7.901 0.196 18441
6504 1 18 . 1 1 28 28 ASP N N 28 123.384 123.384 120.031 3.353 18441
6505 1 18 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.404 0.072 18441
6506 1 18 . 1 1 28 28 ASP CA C 28 58.540 58.540 58.138 0.402 18441
6507 1 18 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.415 0.979 18441
6508 1 18 . 1 1 28 28 ASP H H 28 8.355 8.355 7.910 0.445 18441
6509 1 18 . 1 1 29 29 VAL N N 29 121.272 121.272 120.504 0.768 18441
6510 1 18 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.544 0.169 18441
6511 1 18 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.167 -0.517 18441
6512 1 18 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.810 0.108 18441
6513 1 18 . 1 1 29 29 VAL H H 29 8.252 8.252 7.532 0.720 18441
6514 1 18 . 1 1 30 30 LEU N N 30 122.443 122.443 119.308 3.135 18441
6515 1 18 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.037 0.006 18441
6516 1 18 . 1 1 30 30 LEU CA C 30 58.880 58.880 57.973 0.907 18441
6517 1 18 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.564 0.717 18441
6518 1 18 . 1 1 30 30 LEU H H 30 7.987 7.987 7.796 0.191 18441
6519 1 18 . 1 1 31 31 ARG N N 31 122.386 122.386 119.259 3.127 18441
6520 1 18 . 1 1 31 31 ARG HA H 31 4.016 4.016 3.972 0.044 18441
6521 1 18 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.676 0.704 18441
6522 1 18 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.196 0.204 18441
6523 1 18 . 1 1 31 31 ARG H H 31 8.637 8.637 8.217 0.420 18441
6524 1 18 . 1 1 32 32 MET N N 32 120.006 120.006 118.447 1.559 18441
6525 1 18 . 1 1 32 32 MET HA H 32 4.359 4.359 4.236 0.123 18441
6526 1 18 . 1 1 32 32 MET CA C 32 58.490 58.490 57.911 0.579 18441
6527 1 18 . 1 1 32 32 MET CB C 32 31.677 31.677 31.681 -0.004 18441
6528 1 18 . 1 1 32 32 MET H H 32 8.327 8.327 7.802 0.525 18441
6529 1 18 . 1 1 33 33 TYR N N 33 123.220 123.220 121.149 2.071 18441
6530 1 18 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.197 0.527 18441
6531 1 18 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.968 0.032 18441
6532 1 18 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.790 1.897 18441
6533 1 18 . 1 1 33 33 TYR H H 33 8.054 8.054 8.189 -0.135 18441
6534 1 18 . 1 1 34 34 HIS N N 34 120.860 120.860 118.167 2.693 18441
6535 1 18 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.162 -0.386 18441
6536 1 18 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.719 0.991 18441
6537 1 18 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.227 1.165 18441
6538 1 18 . 1 1 34 34 HIS H H 34 8.548 8.548 7.893 0.655 18441
6539 1 18 . 1 1 35 35 GLN N N 35 113.582 113.582 118.198 -4.616 18441
6540 1 18 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.196 -0.196 18441
6541 1 18 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.324 0.356 18441
6542 1 18 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.353 1.197 18441
6543 1 18 . 1 1 35 35 GLN H H 35 7.542 7.542 8.180 -0.638 18441
6544 1 18 . 1 1 36 36 THR N N 36 111.117 111.117 113.031 -1.914 18441
6545 1 18 . 1 1 36 36 THR HA H 36 4.214 4.214 4.123 0.091 18441
6546 1 18 . 1 1 36 36 THR CA C 36 63.980 63.980 64.057 -0.077 18441
6547 1 18 . 1 1 36 36 THR CB C 36 71.670 71.670 69.547 2.123 18441
6548 1 18 . 1 1 36 36 THR H H 36 8.569 8.569 8.305 0.264 18441
6549 1 18 . 1 1 37 37 MET N N 37 120.444 120.444 117.144 3.300 18441
6550 1 18 . 1 1 37 37 MET HA H 37 3.740 3.740 4.080 -0.340 18441
6551 1 18 . 1 1 37 37 MET CA C 37 56.430 56.430 56.029 0.401 18441
6552 1 18 . 1 1 37 37 MET CB C 37 31.399 31.399 30.515 0.884 18441
6553 1 18 . 1 1 37 37 MET H H 37 9.542 9.542 7.509 2.033 18441
6554 1 18 . 1 1 38 38 ASP N N 38 117.020 117.020 120.271 -3.251 18441
6555 1 18 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.959 -0.015 18441
6556 1 18 . 1 1 38 38 ASP CA C 38 53.476 53.476 52.691 0.784 18441
6557 1 18 . 1 1 38 38 ASP CB C 38 42.040 42.040 43.930 -1.890 18441
6558 1 18 . 1 1 38 38 ASP H H 38 7.456 7.456 7.898 -0.442 18441
6559 1 18 . 1 1 39 39 VAL N N 39 128.507 128.507 125.095 3.412 18441
6560 1 18 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.778 0.053 18441
6561 1 18 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.317 0.523 18441
6562 1 18 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.694 1.006 18441
6563 1 18 . 1 1 39 39 VAL H H 39 8.425 8.425 8.851 -0.426 18441
6564 1 18 . 1 1 40 40 ALA N N 40 125.621 125.621 122.816 2.805 18441
6565 1 18 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.035 -0.048 18441
6566 1 18 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.143 0.717 18441
6567 1 18 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.469 0.001 18441
6568 1 18 . 1 1 40 40 ALA H H 40 7.998 7.998 7.837 0.161 18441
6569 1 18 . 1 1 41 41 VAL N N 41 122.132 122.132 118.727 3.405 18441
6570 1 18 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.725 -0.154 18441
6571 1 18 . 1 1 41 41 VAL CA C 41 66.680 66.680 66.220 0.460 18441
6572 1 18 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.479 1.223 18441
6573 1 18 . 1 1 41 41 VAL H H 41 7.663 7.663 7.435 0.228 18441
6574 1 18 . 1 1 42 42 LEU N N 42 120.190 120.190 120.586 -0.396 18441
6575 1 18 . 1 1 42 42 LEU HA H 42 4.260 4.260 3.902 0.358 18441
6576 1 18 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.032 0.958 18441
6577 1 18 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.759 -1.054 18441
6578 1 18 . 1 1 42 42 LEU H H 42 7.361 7.361 7.330 0.031 18441
6579 1 18 . 1 1 43 43 VAL N N 43 116.802 116.802 118.026 -1.224 18441
6580 1 18 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.600 -0.183 18441
6581 1 18 . 1 1 43 43 VAL CA C 43 68.780 68.780 65.739 3.041 18441
6582 1 18 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.383 1.597 18441
6583 1 18 . 1 1 43 43 VAL H H 43 8.062 8.062 7.641 0.421 18441
6584 1 18 . 1 1 44 44 GLY N N 44 106.242 106.242 107.682 -1.440 18441
6585 1 18 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.238 1.078 18441
6586 1 18 . 1 1 44 44 GLY H H 44 7.901 7.901 7.854 0.047 18441
6587 1 18 . 1 1 45 45 ASP N N 45 123.359 123.359 123.343 0.016 18441
6588 1 18 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.445 0.220 18441
6589 1 18 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.781 -0.021 18441
6590 1 18 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.741 0.127 18441
6591 1 18 . 1 1 45 45 ASP H H 45 8.680 8.680 7.746 0.934 18441
6592 1 18 . 1 1 46 46 LEU N N 46 123.201 123.201 120.925 2.276 18441
6593 1 18 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.819 0.247 18441
6594 1 18 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.823 0.297 18441
6595 1 18 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.701 1.298 18441
6596 1 18 . 1 1 46 46 LEU H H 46 9.018 9.018 8.492 0.526 18441
6597 1 18 . 1 1 47 47 LYS N N 47 119.196 119.196 118.831 0.365 18441
6598 1 18 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.139 -0.169 18441
6599 1 18 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.792 0.498 18441
6600 1 18 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.278 0.863 18441
6601 1 18 . 1 1 47 47 LYS H H 47 8.017 8.017 7.811 0.206 18441
6602 1 18 . 1 1 48 48 LEU N N 48 116.358 116.358 120.419 -4.061 18441
6603 1 18 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.076 0.085 18441
6604 1 18 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.870 -0.200 18441
6605 1 18 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.519 -0.359 18441
6606 1 18 . 1 1 48 48 LEU H H 48 7.143 7.143 7.694 -0.551 18441
6607 1 18 . 1 1 49 49 VAL N N 49 112.662 112.662 115.363 -2.701 18441
6608 1 18 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.076 0.397 18441
6609 1 18 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.985 -0.925 18441
6610 1 18 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.579 2.587 18441
6611 1 18 . 1 1 49 49 VAL H H 49 7.266 7.266 7.672 -0.406 18441
6612 1 18 . 1 1 50 50 ILE N N 50 124.631 124.631 119.243 5.388 18441
6613 1 18 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.395 -0.550 18441
6614 1 18 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.949 0.641 18441
6615 1 18 . 1 1 50 50 ILE CB C 50 35.161 35.161 39.088 -3.927 18441
6616 1 18 . 1 1 50 50 ILE H H 50 8.475 8.475 7.708 0.767 18441
6617 1 18 . 1 1 51 51 ASN N N 51 119.027 119.027 119.318 -0.291 18441
6618 1 18 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.648 0.059 18441
6619 1 18 . 1 1 51 51 ASN CA C 51 53.448 53.448 54.024 -0.576 18441
6620 1 18 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.603 0.357 18441
6621 1 18 . 1 1 51 51 ASN H H 51 7.347 7.347 8.066 -0.719 18441
6622 1 18 . 1 1 52 52 GLU N N 52 115.889 115.889 118.381 -2.492 18441
6623 1 18 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.804 0.084 18441
6624 1 18 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.179 1.606 18441
6625 1 18 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.407 0.613 18441
6626 1 18 . 1 1 52 52 GLU H H 52 7.438 7.438 7.574 -0.136 18441
6627 1 18 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.176 0.034 18441
6628 1 18 . 1 1 53 53 PRO CA C 53 66.960 66.960 66.107 0.853 18441
6629 1 18 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.828 1.120 18441
6630 1 18 . 1 1 54 54 SER N N 54 113.711 113.711 111.328 2.383 18441
6631 1 18 . 1 1 54 54 SER HA H 54 4.173 4.173 4.298 -0.125 18441
6632 1 18 . 1 1 54 54 SER CA C 54 61.650 61.650 60.557 1.093 18441
6633 1 18 . 1 1 54 54 SER CB C 54 62.930 62.930 63.393 -0.463 18441
6634 1 18 . 1 1 54 54 SER H H 54 8.946 8.946 8.434 0.512 18441
6635 1 18 . 1 1 55 55 ARG N N 55 116.455 116.455 119.384 -2.929 18441
6636 1 18 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.358 0.046 18441
6637 1 18 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.199 0.111 18441
6638 1 18 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.501 3.111 18441
6639 1 18 . 1 1 55 55 ARG H H 55 7.759 7.759 7.823 -0.064 18441
6640 1 18 . 1 1 56 56 LEU N N 56 121.468 121.468 123.133 -1.665 18441
6641 1 18 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.270 -0.135 18441
6642 1 18 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.898 0.002 18441
6643 1 18 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.492 1.505 18441
6644 1 18 . 1 1 56 56 LEU H H 56 7.472 7.472 8.425 -0.953 18441
6645 1 18 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.189 0.507 18441
6646 1 18 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.188 -0.007 18441
6647 1 18 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.128 1.262 18441
6648 1 18 . 1 1 58 58 LEU N N 58 119.923 119.923 117.602 2.321 18441
6649 1 18 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.073 -0.023 18441
6650 1 18 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.666 0.654 18441
6651 1 18 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.383 0.645 18441
6652 1 18 . 1 1 58 58 LEU H H 58 8.734 8.734 7.688 1.046 18441
6653 1 18 . 1 1 59 59 PHE N N 59 116.632 116.632 120.624 -3.992 18441
6654 1 18 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.160 0.319 18441
6655 1 18 . 1 1 59 59 PHE CA C 59 63.080 63.080 62.169 0.911 18441
6656 1 18 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.116 -0.264 18441
6657 1 18 . 1 1 59 59 PHE H H 59 8.312 8.312 8.426 -0.114 18441
6658 1 18 . 1 1 60 60 ASP N N 60 120.603 120.603 118.157 2.446 18441
6659 1 18 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.418 0.253 18441
6660 1 18 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.733 1.137 18441
6661 1 18 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.500 1.041 18441
6662 1 18 . 1 1 60 60 ASP H H 60 7.462 7.462 7.811 -0.349 18441
6663 1 18 . 1 1 61 61 ALA N N 61 122.470 122.470 121.849 0.621 18441
6664 1 18 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.975 0.286 18441
6665 1 18 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.324 0.222 18441
6666 1 18 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.703 0.177 18441
6667 1 18 . 1 1 61 61 ALA H H 61 7.664 7.664 7.721 -0.057 18441
6668 1 18 . 1 1 62 62 ILE N N 62 115.525 115.525 117.930 -2.405 18441
6669 1 18 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.966 0.716 18441
6670 1 18 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.498 -0.078 18441
6671 1 18 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.898 2.257 18441
6672 1 18 . 1 1 62 62 ILE H H 62 7.653 7.653 7.821 -0.168 18441
6673 1 18 . 1 1 63 63 ARG N N 63 121.016 121.016 119.903 1.113 18441
6674 1 18 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.405 0.069 18441
6675 1 18 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.674 0.696 18441
6676 1 18 . 1 1 63 63 ARG H H 63 6.917 6.917 7.220 -0.303 18441
6677 1 18 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.107 0.204 18441
6678 1 18 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.563 0.177 18441
6679 1 18 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.037 1.150 18441
6680 1 18 . 1 1 65 65 LEU N N 65 114.713 114.713 115.769 -1.056 18441
6681 1 18 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.064 -0.144 18441
6682 1 18 . 1 1 65 65 LEU CA C 65 55.660 55.660 55.998 -0.338 18441
6683 1 18 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.848 0.260 18441
6684 1 18 . 1 1 65 65 LEU H H 65 8.074 8.074 7.538 0.536 18441
6685 1 18 . 1 1 66 66 ILE N N 66 120.129 120.129 118.867 1.262 18441
6686 1 18 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.090 0.215 18441
6687 1 18 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.666 -4.906 18441
6688 1 18 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.458 -0.814 18441
6689 1 18 . 1 1 66 66 ILE H H 66 7.398 7.398 7.491 -0.093 18441
6690 1 18 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.345 -0.040 18441
6691 1 18 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.953 0.687 18441
6692 1 18 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.315 0.974 18441
6693 1 18 . 1 1 68 68 LEU N N 68 124.673 124.673 122.067 2.606 18441
6694 1 18 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.910 -0.060 18441
6695 1 18 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.425 0.195 18441
6696 1 18 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.319 1.148 18441
6697 1 18 . 1 1 68 68 LEU H H 68 8.471 8.471 8.341 0.130 18441
6698 1 18 . 1 1 69 69 LYS N N 69 115.247 115.247 117.452 -2.205 18441
6699 1 18 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.080 0.089 18441
6700 1 18 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.226 -0.206 18441
6701 1 18 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.392 1.114 18441
6702 1 18 . 1 1 69 69 LYS H H 69 8.536 8.536 8.673 -0.137 18441
6703 1 18 . 1 1 70 70 HIS N N 70 118.849 118.849 118.715 0.134 18441
6704 1 18 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.404 0.821 18441
6705 1 18 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.279 -3.390 18441
6706 1 18 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.712 5.326 18441
6707 1 18 . 1 1 70 70 HIS H H 70 8.060 8.060 8.349 -0.289 18441
6708 1 18 . 1 1 71 71 GLN N N 71 122.130 122.130 120.074 2.056 18441
6709 1 18 . 1 1 71 71 GLN HA H 71 3.699 3.699 3.994 -0.295 18441
6710 1 18 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.504 2.186 18441
6711 1 18 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.789 0.461 18441
6712 1 18 . 1 1 71 71 GLN H H 71 7.732 7.732 8.450 -0.718 18441
6713 1 18 . 1 1 72 72 VAL N N 72 119.182 119.182 120.072 -0.890 18441
6714 1 18 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.769 0.039 18441
6715 1 18 . 1 1 72 72 VAL CA C 72 67.220 67.220 65.641 1.579 18441
6716 1 18 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.834 -0.020 18441
6717 1 18 . 1 1 72 72 VAL H H 72 8.203 8.203 7.636 0.567 18441
6718 1 18 . 1 1 73 73 GLU N N 73 121.878 121.878 119.739 2.139 18441
6719 1 18 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.044 -0.066 18441
6720 1 18 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.380 0.720 18441
6721 1 18 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.765 0.895 18441
6722 1 18 . 1 1 73 73 GLU H H 73 8.136 8.136 7.796 0.340 18441
6723 1 18 . 1 1 74 74 TYR N N 74 119.780 119.780 121.620 -1.840 18441
6724 1 18 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.159 -0.482 18441
6725 1 18 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.637 1.673 18441
6726 1 18 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.292 1.728 18441
6727 1 18 . 1 1 74 74 TYR H H 74 8.491 8.491 8.542 -0.051 18441
6728 1 18 . 1 1 75 75 ASP N N 75 120.231 120.231 118.309 1.922 18441
6729 1 18 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.503 -0.360 18441
6730 1 18 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.190 0.370 18441
6731 1 18 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.466 0.112 18441
6732 1 18 . 1 1 75 75 ASP H H 75 8.566 8.566 7.985 0.581 18441
6733 1 18 . 1 1 76 76 GLN N N 76 118.324 118.324 117.583 0.741 18441
6734 1 18 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.079 -0.023 18441
6735 1 18 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.107 0.323 18441
6736 1 18 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.877 0.553 18441
6737 1 18 . 1 1 76 76 GLN H H 76 7.844 7.844 7.673 0.171 18441
6738 1 18 . 1 1 77 77 LEU N N 77 117.932 117.932 117.448 0.484 18441
6739 1 18 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.187 0.010 18441
6740 1 18 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.270 -0.360 18441
6741 1 18 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.921 2.483 18441
6742 1 18 . 1 1 77 77 LEU H H 77 7.665 7.665 7.457 0.208 18441
6743 1 18 . 1 1 78 78 THR N N 78 110.323 110.323 113.659 -3.336 18441
6744 1 18 . 1 1 78 78 THR HA H 78 3.709 3.709 4.587 -0.878 18441
6745 1 18 . 1 1 78 78 THR CA C 78 59.750 59.750 58.603 1.147 18441
6746 1 18 . 1 1 78 78 THR CB C 78 69.110 69.110 70.117 -1.007 18441
6747 1 18 . 1 1 78 78 THR H H 78 7.130 7.130 7.426 -0.296 18441
6748 1 18 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.610 -0.364 18441
6749 1 18 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.497 1.183 18441
6750 1 18 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.548 -0.157 18441
6751 1 19 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.797 -0.267 18441
6752 1 19 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.243 1.347 18441
6753 1 19 . 1 1 2 2 ASP CB C 2 41.693 41.693 40.023 1.670 18441
6754 1 19 . 1 1 3 3 ARG N N 3 121.498 121.498 119.099 2.399 18441
6755 1 19 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.334 -0.093 18441
6756 1 19 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.263 0.407 18441
6757 1 19 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.559 -0.049 18441
6758 1 19 . 1 1 3 3 ARG H H 3 8.382 8.382 8.111 0.271 18441
6759 1 19 . 1 1 4 4 LYS N N 4 122.257 122.257 122.358 -0.101 18441
6760 1 19 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.101 -0.043 18441
6761 1 19 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.731 -0.021 18441
6762 1 19 . 1 1 4 4 LYS CB C 4 33.276 33.276 32.498 0.778 18441
6763 1 19 . 1 1 4 4 LYS H H 4 8.226 8.226 7.909 0.317 18441
6764 1 19 . 1 1 5 5 VAL N N 5 120.494 120.494 119.091 1.403 18441
6765 1 19 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.707 0.014 18441
6766 1 19 . 1 1 5 5 VAL CA C 5 66.650 66.650 66.352 0.298 18441
6767 1 19 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.440 0.634 18441
6768 1 19 . 1 1 5 5 VAL H H 5 8.109 8.109 7.859 0.250 18441
6769 1 19 . 1 1 6 6 ALA N N 6 123.149 123.149 122.421 0.728 18441
6770 1 19 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.236 -0.201 18441
6771 1 19 . 1 1 6 6 ALA CA C 6 55.890 55.890 54.963 0.927 18441
6772 1 19 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.285 0.975 18441
6773 1 19 . 1 1 6 6 ALA H H 6 8.374 8.374 8.046 0.328 18441
6774 1 19 . 1 1 7 7 ARG N N 7 119.587 119.587 118.705 0.882 18441
6775 1 19 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.927 0.074 18441
6776 1 19 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.368 0.402 18441
6777 1 19 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.168 0.602 18441
6778 1 19 . 1 1 7 7 ARG H H 7 7.992 7.992 8.078 -0.086 18441
6779 1 19 . 1 1 8 8 GLU N N 8 119.745 119.745 120.069 -0.324 18441
6780 1 19 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.176 -0.118 18441
6781 1 19 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.783 -0.014 18441
6782 1 19 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.793 0.157 18441
6783 1 19 . 1 1 8 8 GLU H H 8 8.165 8.165 8.290 -0.125 18441
6784 1 19 . 1 1 9 9 PHE N N 9 121.436 121.436 120.246 1.190 18441
6785 1 19 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.403 -0.276 18441
6786 1 19 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.898 3.122 18441
6787 1 19 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.370 1.253 18441
6788 1 19 . 1 1 9 9 PHE H H 9 8.180 8.180 8.243 -0.063 18441
6789 1 19 . 1 1 10 10 ARG N N 10 119.028 119.028 119.586 -0.558 18441
6790 1 19 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.656 0.205 18441
6791 1 19 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.351 1.229 18441
6792 1 19 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.023 1.297 18441
6793 1 19 . 1 1 10 10 ARG H H 10 7.910 7.910 7.926 -0.016 18441
6794 1 19 . 1 1 11 11 HIS N N 11 116.563 116.563 118.374 -1.811 18441
6795 1 19 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.269 0.187 18441
6796 1 19 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.984 0.196 18441
6797 1 19 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.991 0.039 18441
6798 1 19 . 1 1 11 11 HIS H H 11 8.001 8.001 8.224 -0.223 18441
6799 1 19 . 1 1 12 12 LYS N N 12 120.773 120.773 119.002 1.771 18441
6800 1 19 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.915 0.093 18441
6801 1 19 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.534 0.446 18441
6802 1 19 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.425 0.268 18441
6803 1 19 . 1 1 12 12 LYS H H 12 7.796 7.796 7.747 0.049 18441
6804 1 19 . 1 1 13 13 VAL N N 13 120.125 120.125 120.659 -0.534 18441
6805 1 19 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.581 -0.470 18441
6806 1 19 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.737 0.443 18441
6807 1 19 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.831 0.309 18441
6808 1 19 . 1 1 13 13 VAL H H 13 7.821 7.821 8.020 -0.199 18441
6809 1 19 . 1 1 14 14 ASP N N 14 117.462 117.462 118.767 -1.305 18441
6810 1 19 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.352 -0.090 18441
6811 1 19 . 1 1 14 14 ASP CA C 14 57.400 57.400 56.925 0.475 18441
6812 1 19 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.857 0.457 18441
6813 1 19 . 1 1 14 14 ASP H H 14 8.276 8.276 7.822 0.454 18441
6814 1 19 . 1 1 15 15 PHE N N 15 117.914 117.914 119.290 -1.376 18441
6815 1 19 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.294 0.068 18441
6816 1 19 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.703 -0.513 18441
6817 1 19 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.571 1.127 18441
6818 1 19 . 1 1 15 15 PHE H H 15 7.664 7.664 7.675 -0.011 18441
6819 1 19 . 1 1 16 16 LEU N N 16 116.737 116.737 116.212 0.525 18441
6820 1 19 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.237 -0.003 18441
6821 1 19 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.851 1.569 18441
6822 1 19 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.255 2.823 18441
6823 1 19 . 1 1 16 16 LEU H H 16 7.658 7.658 8.007 -0.349 18441
6824 1 19 . 1 1 17 17 ILE N N 17 120.533 120.533 117.654 2.879 18441
6825 1 19 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.373 -0.265 18441
6826 1 19 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.068 1.472 18441
6827 1 19 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.078 1.279 18441
6828 1 19 . 1 1 17 17 ILE H H 17 8.336 8.336 7.445 0.891 18441
6829 1 19 . 1 1 18 18 GLU N N 18 124.531 124.531 123.928 0.603 18441
6830 1 19 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.040 0.170 18441
6831 1 19 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.494 0.106 18441
6832 1 19 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.591 1.419 18441
6833 1 19 . 1 1 18 18 GLU H H 18 8.276 8.276 8.519 -0.243 18441
6834 1 19 . 1 1 19 19 ASN N N 19 117.630 117.630 119.017 -1.387 18441
6835 1 19 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.593 0.212 18441
6836 1 19 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.153 0.585 18441
6837 1 19 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.510 1.668 18441
6838 1 19 . 1 1 19 19 ASN H H 19 7.700 7.700 8.023 -0.323 18441
6839 1 19 . 1 1 20 20 ASP N N 20 127.428 127.428 124.733 2.695 18441
6840 1 19 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.486 -0.237 18441
6841 1 19 . 1 1 20 20 ASP CA C 20 58.850 58.850 57.610 1.240 18441
6842 1 19 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.062 0.252 18441
6843 1 19 . 1 1 20 20 ASP H H 20 8.998 8.998 8.923 0.075 18441
6844 1 19 . 1 1 21 21 ALA N N 21 122.271 122.271 122.519 -0.248 18441
6845 1 19 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.049 0.211 18441
6846 1 19 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.611 0.389 18441
6847 1 19 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.219 0.431 18441
6848 1 19 . 1 1 21 21 ALA H H 21 8.346 8.346 7.768 0.578 18441
6849 1 19 . 1 1 22 22 GLU N N 22 118.716 118.716 117.956 0.760 18441
6850 1 19 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.975 0.139 18441
6851 1 19 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.885 0.475 18441
6852 1 19 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.085 2.687 18441
6853 1 19 . 1 1 22 22 GLU H H 22 7.724 7.724 8.889 -1.165 18441
6854 1 19 . 1 1 23 23 LYS N N 23 121.088 121.088 118.730 2.358 18441
6855 1 19 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.724 0.087 18441
6856 1 19 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.980 2.690 18441
6857 1 19 . 1 1 23 23 LYS CB C 23 33.070 33.070 32.027 1.043 18441
6858 1 19 . 1 1 23 23 LYS H H 23 7.618 7.618 7.329 0.289 18441
6859 1 19 . 1 1 24 24 ASP N N 24 119.010 119.010 120.838 -1.828 18441
6860 1 19 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.587 -0.098 18441
6861 1 19 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.537 0.973 18441
6862 1 19 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.473 0.364 18441
6863 1 19 . 1 1 24 24 ASP H H 24 8.424 8.424 8.107 0.317 18441
6864 1 19 . 1 1 25 25 TYR N N 25 120.417 120.417 120.605 -0.188 18441
6865 1 19 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.236 0.007 18441
6866 1 19 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.384 0.806 18441
6867 1 19 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.528 -0.029 18441
6868 1 19 . 1 1 25 25 TYR H H 25 7.676 7.676 8.233 -0.557 18441
6869 1 19 . 1 1 26 26 LEU N N 26 120.960 120.960 120.097 0.863 18441
6870 1 19 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.806 -0.205 18441
6871 1 19 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.725 0.715 18441
6872 1 19 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.578 0.573 18441
6873 1 19 . 1 1 26 26 LEU H H 26 7.965 7.965 7.873 0.092 18441
6874 1 19 . 1 1 27 27 TYR N N 27 116.521 116.521 117.788 -1.267 18441
6875 1 19 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.146 -0.370 18441
6876 1 19 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.616 4.794 18441
6877 1 19 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.011 1.392 18441
6878 1 19 . 1 1 27 27 TYR H H 27 8.097 8.097 8.293 -0.196 18441
6879 1 19 . 1 1 28 28 ASP N N 28 123.384 123.384 120.267 3.117 18441
6880 1 19 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.537 -0.061 18441
6881 1 19 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.752 0.788 18441
6882 1 19 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.367 1.027 18441
6883 1 19 . 1 1 28 28 ASP H H 28 8.355 8.355 7.959 0.396 18441
6884 1 19 . 1 1 29 29 VAL N N 29 121.272 121.272 120.711 0.561 18441
6885 1 19 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.781 -0.068 18441
6886 1 19 . 1 1 29 29 VAL CA C 29 66.650 66.650 67.056 -0.406 18441
6887 1 19 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.930 -0.012 18441
6888 1 19 . 1 1 29 29 VAL H H 29 8.252 8.252 7.728 0.524 18441
6889 1 19 . 1 1 30 30 LEU N N 30 122.443 122.443 120.671 1.772 18441
6890 1 19 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.195 -0.152 18441
6891 1 19 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.272 0.608 18441
6892 1 19 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.749 0.532 18441
6893 1 19 . 1 1 30 30 LEU H H 30 7.987 7.987 8.315 -0.328 18441
6894 1 19 . 1 1 31 31 ARG N N 31 122.386 122.386 118.545 3.841 18441
6895 1 19 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.121 -0.105 18441
6896 1 19 . 1 1 31 31 ARG CA C 31 60.380 60.380 58.767 1.613 18441
6897 1 19 . 1 1 31 31 ARG CB C 31 30.400 30.400 29.843 0.557 18441
6898 1 19 . 1 1 31 31 ARG H H 31 8.637 8.637 8.345 0.292 18441
6899 1 19 . 1 1 32 32 MET N N 32 120.006 120.006 119.477 0.529 18441
6900 1 19 . 1 1 32 32 MET HA H 32 4.359 4.359 4.301 0.058 18441
6901 1 19 . 1 1 32 32 MET CA C 32 58.490 58.490 58.136 0.354 18441
6902 1 19 . 1 1 32 32 MET CB C 32 31.677 31.677 32.163 -0.486 18441
6903 1 19 . 1 1 32 32 MET H H 32 8.327 8.327 8.196 0.131 18441
6904 1 19 . 1 1 33 33 TYR N N 33 123.220 123.220 120.924 2.296 18441
6905 1 19 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.248 0.476 18441
6906 1 19 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.379 0.621 18441
6907 1 19 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.796 1.891 18441
6908 1 19 . 1 1 33 33 TYR H H 33 8.054 8.054 8.531 -0.477 18441
6909 1 19 . 1 1 34 34 HIS N N 34 120.860 120.860 118.233 2.627 18441
6910 1 19 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.088 -0.312 18441
6911 1 19 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.546 1.164 18441
6912 1 19 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.226 1.166 18441
6913 1 19 . 1 1 34 34 HIS H H 34 8.548 8.548 8.004 0.544 18441
6914 1 19 . 1 1 35 35 GLN N N 35 113.582 113.582 119.028 -5.446 18441
6915 1 19 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.293 -0.293 18441
6916 1 19 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.062 0.618 18441
6917 1 19 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.310 1.240 18441
6918 1 19 . 1 1 35 35 GLN H H 35 7.542 7.542 8.296 -0.754 18441
6919 1 19 . 1 1 36 36 THR N N 36 111.117 111.117 109.677 1.440 18441
6920 1 19 . 1 1 36 36 THR HA H 36 4.214 4.214 4.196 0.018 18441
6921 1 19 . 1 1 36 36 THR CA C 36 63.980 63.980 63.021 0.959 18441
6922 1 19 . 1 1 36 36 THR CB C 36 71.670 71.670 69.566 2.104 18441
6923 1 19 . 1 1 36 36 THR H H 36 8.569 8.569 8.360 0.209 18441
6924 1 19 . 1 1 37 37 MET N N 37 120.444 120.444 116.816 3.628 18441
6925 1 19 . 1 1 37 37 MET HA H 37 3.740 3.740 4.274 -0.534 18441
6926 1 19 . 1 1 37 37 MET CA C 37 56.430 56.430 56.366 0.064 18441
6927 1 19 . 1 1 37 37 MET CB C 37 31.399 31.399 30.433 0.966 18441
6928 1 19 . 1 1 37 37 MET H H 37 9.542 9.542 7.462 2.080 18441
6929 1 19 . 1 1 38 38 ASP N N 38 117.020 117.020 121.131 -4.111 18441
6930 1 19 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.797 0.147 18441
6931 1 19 . 1 1 38 38 ASP CA C 38 53.476 53.476 54.033 -0.557 18441
6932 1 19 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.042 -0.002 18441
6933 1 19 . 1 1 38 38 ASP H H 38 7.456 7.456 7.851 -0.395 18441
6934 1 19 . 1 1 39 39 VAL N N 39 128.507 128.507 124.445 4.062 18441
6935 1 19 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.564 0.267 18441
6936 1 19 . 1 1 39 39 VAL CA C 39 64.840 64.840 63.896 0.944 18441
6937 1 19 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.389 1.311 18441
6938 1 19 . 1 1 39 39 VAL H H 39 8.425 8.425 8.569 -0.144 18441
6939 1 19 . 1 1 40 40 ALA N N 40 125.621 125.621 122.253 3.368 18441
6940 1 19 . 1 1 40 40 ALA HA H 40 3.987 3.987 3.991 -0.004 18441
6941 1 19 . 1 1 40 40 ALA CA C 40 55.860 55.860 54.732 1.128 18441
6942 1 19 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.261 0.209 18441
6943 1 19 . 1 1 40 40 ALA H H 40 7.998 7.998 8.258 -0.260 18441
6944 1 19 . 1 1 41 41 VAL N N 41 122.132 122.132 118.633 3.499 18441
6945 1 19 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.765 -0.194 18441
6946 1 19 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.942 0.738 18441
6947 1 19 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.775 0.927 18441
6948 1 19 . 1 1 41 41 VAL H H 41 7.663 7.663 7.664 -0.001 18441
6949 1 19 . 1 1 42 42 LEU N N 42 120.190 120.190 119.174 1.016 18441
6950 1 19 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.251 0.009 18441
6951 1 19 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.398 0.592 18441
6952 1 19 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.271 -0.566 18441
6953 1 19 . 1 1 42 42 LEU H H 42 7.361 7.361 7.385 -0.024 18441
6954 1 19 . 1 1 43 43 VAL N N 43 116.802 116.802 119.692 -2.890 18441
6955 1 19 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.817 -0.400 18441
6956 1 19 . 1 1 43 43 VAL CA C 43 68.780 68.780 67.078 1.702 18441
6957 1 19 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.959 1.021 18441
6958 1 19 . 1 1 43 43 VAL H H 43 8.062 8.062 7.741 0.321 18441
6959 1 19 . 1 1 44 44 GLY N N 44 106.242 106.242 107.877 -1.635 18441
6960 1 19 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.330 0.986 18441
6961 1 19 . 1 1 44 44 GLY H H 44 7.901 7.901 8.010 -0.109 18441
6962 1 19 . 1 1 45 45 ASP N N 45 123.359 123.359 123.332 0.027 18441
6963 1 19 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.322 0.343 18441
6964 1 19 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.495 0.265 18441
6965 1 19 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.774 0.094 18441
6966 1 19 . 1 1 45 45 ASP H H 45 8.680 8.680 7.814 0.866 18441
6967 1 19 . 1 1 46 46 LEU N N 46 123.201 123.201 120.318 2.883 18441
6968 1 19 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.469 0.597 18441
6969 1 19 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.434 0.686 18441
6970 1 19 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.194 1.805 18441
6971 1 19 . 1 1 46 46 LEU H H 46 9.018 9.018 8.182 0.836 18441
6972 1 19 . 1 1 47 47 LYS N N 47 119.196 119.196 117.802 1.394 18441
6973 1 19 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.026 -0.056 18441
6974 1 19 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.088 1.202 18441
6975 1 19 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.084 1.056 18441
6976 1 19 . 1 1 47 47 LYS H H 47 8.017 8.017 7.578 0.439 18441
6977 1 19 . 1 1 48 48 LEU N N 48 116.358 116.358 120.209 -3.851 18441
6978 1 19 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.940 0.221 18441
6979 1 19 . 1 1 48 48 LEU CA C 48 57.670 57.670 58.044 -0.374 18441
6980 1 19 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.120 0.041 18441
6981 1 19 . 1 1 48 48 LEU H H 48 7.143 7.143 7.530 -0.387 18441
6982 1 19 . 1 1 49 49 VAL N N 49 112.662 112.662 114.135 -1.473 18441
6983 1 19 . 1 1 49 49 VAL HA H 49 4.473 4.473 3.783 0.690 18441
6984 1 19 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.193 -0.133 18441
6985 1 19 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.099 3.067 18441
6986 1 19 . 1 1 49 49 VAL H H 49 7.266 7.266 7.139 0.127 18441
6987 1 19 . 1 1 50 50 ILE N N 50 124.631 124.631 118.093 6.538 18441
6988 1 19 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.156 -0.311 18441
6989 1 19 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.836 0.754 18441
6990 1 19 . 1 1 50 50 ILE CB C 50 35.161 35.161 37.951 -2.790 18441
6991 1 19 . 1 1 50 50 ILE H H 50 8.475 8.475 7.690 0.785 18441
6992 1 19 . 1 1 51 51 ASN N N 51 119.027 119.027 119.595 -0.568 18441
6993 1 19 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.650 0.057 18441
6994 1 19 . 1 1 51 51 ASN CA C 51 53.448 53.448 54.124 -0.676 18441
6995 1 19 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.616 0.345 18441
6996 1 19 . 1 1 51 51 ASN H H 51 7.347 7.347 8.148 -0.801 18441
6997 1 19 . 1 1 52 52 GLU N N 52 115.889 115.889 116.504 -0.615 18441
6998 1 19 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.875 0.013 18441
6999 1 19 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.918 1.867 18441
7000 1 19 . 1 1 52 52 GLU CB C 52 31.020 31.020 31.110 -0.090 18441
7001 1 19 . 1 1 52 52 GLU H H 52 7.438 7.438 7.480 -0.042 18441
7002 1 19 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.243 -0.033 18441
7003 1 19 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.695 1.265 18441
7004 1 19 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.949 0.999 18441
7005 1 19 . 1 1 54 54 SER N N 54 113.711 113.711 112.313 1.398 18441
7006 1 19 . 1 1 54 54 SER HA H 54 4.173 4.173 4.315 -0.142 18441
7007 1 19 . 1 1 54 54 SER CA C 54 61.650 61.650 60.981 0.669 18441
7008 1 19 . 1 1 54 54 SER CB C 54 62.930 62.930 63.431 -0.501 18441
7009 1 19 . 1 1 54 54 SER H H 54 8.946 8.946 8.213 0.733 18441
7010 1 19 . 1 1 55 55 ARG N N 55 116.455 116.455 118.659 -2.204 18441
7011 1 19 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.333 0.071 18441
7012 1 19 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.827 0.483 18441
7013 1 19 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.508 3.104 18441
7014 1 19 . 1 1 55 55 ARG H H 55 7.759 7.759 7.666 0.093 18441
7015 1 19 . 1 1 56 56 LEU N N 56 121.468 121.468 123.453 -1.985 18441
7016 1 19 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.293 -0.158 18441
7017 1 19 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.261 -0.361 18441
7018 1 19 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.346 1.651 18441
7019 1 19 . 1 1 56 56 LEU H H 56 7.472 7.472 8.459 -0.987 18441
7020 1 19 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.202 0.494 18441
7021 1 19 . 1 1 57 57 PRO CA C 57 66.180 66.180 65.941 0.239 18441
7022 1 19 . 1 1 57 57 PRO CB C 57 32.390 32.390 30.940 1.450 18441
7023 1 19 . 1 1 58 58 LEU N N 58 119.923 119.923 117.596 2.327 18441
7024 1 19 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.168 -0.118 18441
7025 1 19 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.323 0.997 18441
7026 1 19 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.415 0.613 18441
7027 1 19 . 1 1 58 58 LEU H H 58 8.734 8.734 7.460 1.274 18441
7028 1 19 . 1 1 59 59 PHE N N 59 116.632 116.632 120.560 -3.928 18441
7029 1 19 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.335 0.144 18441
7030 1 19 . 1 1 59 59 PHE CA C 59 63.080 63.080 59.678 3.402 18441
7031 1 19 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.083 -0.231 18441
7032 1 19 . 1 1 59 59 PHE H H 59 8.312 8.312 8.829 -0.517 18441
7033 1 19 . 1 1 60 60 ASP N N 60 120.603 120.603 118.606 1.997 18441
7034 1 19 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.451 0.220 18441
7035 1 19 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.977 0.893 18441
7036 1 19 . 1 1 60 60 ASP CB C 60 41.541 41.541 41.116 0.425 18441
7037 1 19 . 1 1 60 60 ASP H H 60 7.462 7.462 7.813 -0.351 18441
7038 1 19 . 1 1 61 61 ALA N N 61 122.470 122.470 121.948 0.522 18441
7039 1 19 . 1 1 61 61 ALA HA H 61 4.261 4.261 4.105 0.156 18441
7040 1 19 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.195 0.351 18441
7041 1 19 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.888 -0.008 18441
7042 1 19 . 1 1 61 61 ALA H H 61 7.664 7.664 7.670 -0.006 18441
7043 1 19 . 1 1 62 62 ILE N N 62 115.525 115.525 118.307 -2.782 18441
7044 1 19 . 1 1 62 62 ILE HA H 62 3.682 3.682 2.889 0.793 18441
7045 1 19 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.351 0.069 18441
7046 1 19 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.981 2.174 18441
7047 1 19 . 1 1 62 62 ILE H H 62 7.653 7.653 7.380 0.273 18441
7048 1 19 . 1 1 63 63 ARG N N 63 121.016 121.016 120.654 0.362 18441
7049 1 19 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.425 0.049 18441
7050 1 19 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.294 1.076 18441
7051 1 19 . 1 1 63 63 ARG H H 63 6.917 6.917 7.443 -0.526 18441
7052 1 19 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.115 0.196 18441
7053 1 19 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.509 0.231 18441
7054 1 19 . 1 1 64 64 PRO CB C 64 32.187 32.187 30.948 1.239 18441
7055 1 19 . 1 1 65 65 LEU N N 65 114.713 114.713 115.749 -1.036 18441
7056 1 19 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.081 -0.161 18441
7057 1 19 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.047 -0.387 18441
7058 1 19 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.938 0.171 18441
7059 1 19 . 1 1 65 65 LEU H H 65 8.074 8.074 7.397 0.677 18441
7060 1 19 . 1 1 66 66 ILE N N 66 120.129 120.129 119.000 1.129 18441
7061 1 19 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.153 0.152 18441
7062 1 19 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.812 -5.053 18441
7063 1 19 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.200 -0.556 18441
7064 1 19 . 1 1 66 66 ILE H H 66 7.398 7.398 7.607 -0.209 18441
7065 1 19 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.386 -0.082 18441
7066 1 19 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.679 0.961 18441
7067 1 19 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.435 0.854 18441
7068 1 19 . 1 1 68 68 LEU N N 68 124.673 124.673 122.294 2.379 18441
7069 1 19 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.922 -0.072 18441
7070 1 19 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.732 -0.112 18441
7071 1 19 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.443 1.024 18441
7072 1 19 . 1 1 68 68 LEU H H 68 8.471 8.471 8.322 0.149 18441
7073 1 19 . 1 1 69 69 LYS N N 69 115.247 115.247 119.127 -3.880 18441
7074 1 19 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.010 0.159 18441
7075 1 19 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.208 -0.188 18441
7076 1 19 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.932 0.574 18441
7077 1 19 . 1 1 69 69 LYS H H 69 8.536 8.536 8.323 0.213 18441
7078 1 19 . 1 1 70 70 HIS N N 70 118.849 118.849 116.663 2.186 18441
7079 1 19 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.381 0.844 18441
7080 1 19 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.278 -3.389 18441
7081 1 19 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.585 5.453 18441
7082 1 19 . 1 1 70 70 HIS H H 70 8.060 8.060 8.350 -0.290 18441
7083 1 19 . 1 1 71 71 GLN N N 71 122.130 122.130 119.316 2.814 18441
7084 1 19 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.039 -0.340 18441
7085 1 19 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.675 2.015 18441
7086 1 19 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.816 0.434 18441
7087 1 19 . 1 1 71 71 GLN H H 71 7.732 7.732 8.506 -0.774 18441
7088 1 19 . 1 1 72 72 VAL N N 72 119.182 119.182 119.510 -0.328 18441
7089 1 19 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.680 0.128 18441
7090 1 19 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.804 0.416 18441
7091 1 19 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.313 0.501 18441
7092 1 19 . 1 1 72 72 VAL H H 72 8.203 8.203 8.033 0.170 18441
7093 1 19 . 1 1 73 73 GLU N N 73 121.878 121.878 120.009 1.869 18441
7094 1 19 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.329 -0.351 18441
7095 1 19 . 1 1 73 73 GLU CA C 73 60.100 60.100 58.961 1.139 18441
7096 1 19 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.480 1.180 18441
7097 1 19 . 1 1 73 73 GLU H H 73 8.136 8.136 7.947 0.189 18441
7098 1 19 . 1 1 74 74 TYR N N 74 119.780 119.780 120.652 -0.872 18441
7099 1 19 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.065 -0.388 18441
7100 1 19 . 1 1 74 74 TYR CA C 74 63.310 63.310 62.124 1.185 18441
7101 1 19 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.447 1.573 18441
7102 1 19 . 1 1 74 74 TYR H H 74 8.491 8.491 8.311 0.180 18441
7103 1 19 . 1 1 75 75 ASP N N 75 120.231 120.231 118.593 1.638 18441
7104 1 19 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.645 -0.502 18441
7105 1 19 . 1 1 75 75 ASP CA C 75 57.560 57.560 56.453 1.107 18441
7106 1 19 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.846 -0.268 18441
7107 1 19 . 1 1 75 75 ASP H H 75 8.566 8.566 7.905 0.661 18441
7108 1 19 . 1 1 76 76 GLN N N 76 118.324 118.324 118.357 -0.033 18441
7109 1 19 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.025 0.031 18441
7110 1 19 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.370 0.060 18441
7111 1 19 . 1 1 76 76 GLN CB C 76 29.430 29.430 28.857 0.573 18441
7112 1 19 . 1 1 76 76 GLN H H 76 7.844 7.844 7.577 0.267 18441
7113 1 19 . 1 1 77 77 LEU N N 77 117.932 117.932 116.038 1.894 18441
7114 1 19 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.246 -0.049 18441
7115 1 19 . 1 1 77 77 LEU CA C 77 55.910 55.910 55.926 -0.016 18441
7116 1 19 . 1 1 77 77 LEU CB C 77 45.404 45.404 43.188 2.216 18441
7117 1 19 . 1 1 77 77 LEU H H 77 7.665 7.665 7.419 0.246 18441
7118 1 19 . 1 1 78 78 THR N N 78 110.323 110.323 113.053 -2.730 18441
7119 1 19 . 1 1 78 78 THR HA H 78 3.709 3.709 4.562 -0.853 18441
7120 1 19 . 1 1 78 78 THR CA C 78 59.750 59.750 58.959 0.791 18441
7121 1 19 . 1 1 78 78 THR CB C 78 69.110 69.110 70.872 -1.762 18441
7122 1 19 . 1 1 78 78 THR H H 78 7.130 7.130 7.584 -0.454 18441
7123 1 19 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.529 -0.283 18441
7124 1 19 . 1 1 79 79 PRO CA C 79 63.680 63.680 62.618 1.062 18441
7125 1 19 . 1 1 79 79 PRO CB C 79 32.391 32.391 33.013 -0.622 18441
7126 1 20 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.771 -0.241 18441
7127 1 20 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.473 1.117 18441
7128 1 20 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.337 0.356 18441
7129 1 20 . 1 1 3 3 ARG N N 3 121.498 121.498 120.120 1.378 18441
7130 1 20 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.426 -0.185 18441
7131 1 20 . 1 1 3 3 ARG CA C 3 57.670 57.670 56.447 1.223 18441
7132 1 20 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.848 -0.338 18441
7133 1 20 . 1 1 3 3 ARG H H 3 8.382 8.382 8.109 0.273 18441
7134 1 20 . 1 1 4 4 LYS N N 4 122.257 122.257 121.078 1.179 18441
7135 1 20 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.138 -0.080 18441
7136 1 20 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.066 0.644 18441
7137 1 20 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.526 1.750 18441
7138 1 20 . 1 1 4 4 LYS H H 4 8.226 8.226 8.290 -0.064 18441
7139 1 20 . 1 1 5 5 VAL N N 5 120.494 120.494 117.792 2.702 18441
7140 1 20 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.801 -0.080 18441
7141 1 20 . 1 1 5 5 VAL CA C 5 66.650 66.650 66.346 0.304 18441
7142 1 20 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.301 0.773 18441
7143 1 20 . 1 1 5 5 VAL H H 5 8.109 8.109 8.222 -0.113 18441
7144 1 20 . 1 1 6 6 ALA N N 6 123.149 123.149 123.060 0.089 18441
7145 1 20 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.253 -0.218 18441
7146 1 20 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.330 0.561 18441
7147 1 20 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.330 0.930 18441
7148 1 20 . 1 1 6 6 ALA H H 6 8.374 8.374 7.479 0.895 18441
7149 1 20 . 1 1 7 7 ARG N N 7 119.587 119.587 118.903 0.684 18441
7150 1 20 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.894 0.107 18441
7151 1 20 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.244 0.526 18441
7152 1 20 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.183 0.587 18441
7153 1 20 . 1 1 7 7 ARG H H 7 7.992 7.992 7.911 0.081 18441
7154 1 20 . 1 1 8 8 GLU N N 8 119.745 119.745 120.181 -0.436 18441
7155 1 20 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.126 -0.068 18441
7156 1 20 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.459 0.311 18441
7157 1 20 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.855 0.096 18441
7158 1 20 . 1 1 8 8 GLU H H 8 8.165 8.165 8.284 -0.119 18441
7159 1 20 . 1 1 9 9 PHE N N 9 121.436 121.436 119.739 1.697 18441
7160 1 20 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.370 -0.243 18441
7161 1 20 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.997 3.023 18441
7162 1 20 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.460 1.163 18441
7163 1 20 . 1 1 9 9 PHE H H 9 8.180 8.180 8.426 -0.246 18441
7164 1 20 . 1 1 10 10 ARG N N 10 119.028 119.028 119.436 -0.408 18441
7165 1 20 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.636 0.225 18441
7166 1 20 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.142 1.438 18441
7167 1 20 . 1 1 10 10 ARG CB C 10 30.320 30.320 28.942 1.378 18441
7168 1 20 . 1 1 10 10 ARG H H 10 7.910 7.910 7.936 -0.026 18441
7169 1 20 . 1 1 11 11 HIS N N 11 116.563 116.563 118.696 -2.133 18441
7170 1 20 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.218 0.238 18441
7171 1 20 . 1 1 11 11 HIS CA C 11 59.180 59.180 58.984 0.196 18441
7172 1 20 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.954 0.076 18441
7173 1 20 . 1 1 11 11 HIS H H 11 8.001 8.001 8.160 -0.159 18441
7174 1 20 . 1 1 12 12 LYS N N 12 120.773 120.773 119.032 1.741 18441
7175 1 20 . 1 1 12 12 LYS HA H 12 4.008 4.008 3.954 0.054 18441
7176 1 20 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.591 0.389 18441
7177 1 20 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.389 0.304 18441
7178 1 20 . 1 1 12 12 LYS H H 12 7.796 7.796 7.728 0.068 18441
7179 1 20 . 1 1 13 13 VAL N N 13 120.125 120.125 120.183 -0.058 18441
7180 1 20 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.661 -0.550 18441
7181 1 20 . 1 1 13 13 VAL CA C 13 68.180 68.180 67.055 1.125 18441
7182 1 20 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.305 0.835 18441
7183 1 20 . 1 1 13 13 VAL H H 13 7.821 7.821 7.818 0.003 18441
7184 1 20 . 1 1 14 14 ASP N N 14 117.462 117.462 119.116 -1.654 18441
7185 1 20 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.353 -0.091 18441
7186 1 20 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.077 0.324 18441
7187 1 20 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.866 0.448 18441
7188 1 20 . 1 1 14 14 ASP H H 14 8.276 8.276 7.825 0.451 18441
7189 1 20 . 1 1 15 15 PHE N N 15 117.914 117.914 118.839 -0.925 18441
7190 1 20 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.330 0.032 18441
7191 1 20 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.678 -0.489 18441
7192 1 20 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.604 1.094 18441
7193 1 20 . 1 1 15 15 PHE H H 15 7.664 7.664 7.717 -0.053 18441
7194 1 20 . 1 1 16 16 LEU N N 16 116.737 116.737 116.825 -0.088 18441
7195 1 20 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.260 -0.026 18441
7196 1 20 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.807 1.613 18441
7197 1 20 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.388 2.690 18441
7198 1 20 . 1 1 16 16 LEU H H 16 7.658 7.658 8.017 -0.359 18441
7199 1 20 . 1 1 17 17 ILE N N 17 120.533 120.533 116.915 3.618 18441
7200 1 20 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.346 -0.238 18441
7201 1 20 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.201 1.339 18441
7202 1 20 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.332 1.025 18441
7203 1 20 . 1 1 17 17 ILE H H 17 8.336 8.336 7.487 0.849 18441
7204 1 20 . 1 1 18 18 GLU N N 18 124.531 124.531 123.555 0.976 18441
7205 1 20 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.043 0.167 18441
7206 1 20 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.383 0.216 18441
7207 1 20 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.625 1.385 18441
7208 1 20 . 1 1 18 18 GLU H H 18 8.276 8.276 8.610 -0.334 18441
7209 1 20 . 1 1 19 19 ASN N N 19 117.630 117.630 117.156 0.474 18441
7210 1 20 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.591 0.214 18441
7211 1 20 . 1 1 19 19 ASN CA C 19 53.738 53.738 53.782 -0.044 18441
7212 1 20 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.664 1.514 18441
7213 1 20 . 1 1 19 19 ASN H H 19 7.700 7.700 7.940 -0.240 18441
7214 1 20 . 1 1 20 20 ASP N N 20 127.428 127.428 118.494 8.934 18441
7215 1 20 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.676 -0.427 18441
7216 1 20 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.238 2.612 18441
7217 1 20 . 1 1 20 20 ASP CB C 20 41.314 41.314 41.059 0.255 18441
7218 1 20 . 1 1 20 20 ASP H H 20 8.998 8.998 8.640 0.358 18441
7219 1 20 . 1 1 21 21 ALA N N 21 122.271 122.271 123.517 -1.246 18441
7220 1 20 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.072 0.188 18441
7221 1 20 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.194 0.806 18441
7222 1 20 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.266 0.384 18441
7223 1 20 . 1 1 21 21 ALA H H 21 8.346 8.346 8.225 0.121 18441
7224 1 20 . 1 1 22 22 GLU N N 22 118.716 118.716 118.181 0.535 18441
7225 1 20 . 1 1 22 22 GLU HA H 22 4.114 4.114 4.072 0.042 18441
7226 1 20 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.938 0.423 18441
7227 1 20 . 1 1 22 22 GLU CB C 22 31.772 31.772 28.956 2.816 18441
7228 1 20 . 1 1 22 22 GLU H H 22 7.724 7.724 8.859 -1.135 18441
7229 1 20 . 1 1 23 23 LYS N N 23 121.088 121.088 117.763 3.325 18441
7230 1 20 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.762 0.049 18441
7231 1 20 . 1 1 23 23 LYS CA C 23 61.670 61.670 58.920 2.750 18441
7232 1 20 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.776 1.294 18441
7233 1 20 . 1 1 23 23 LYS H H 23 7.618 7.618 8.148 -0.530 18441
7234 1 20 . 1 1 24 24 ASP N N 24 119.010 119.010 120.598 -1.588 18441
7235 1 20 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.530 -0.041 18441
7236 1 20 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.044 1.466 18441
7237 1 20 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.600 0.237 18441
7238 1 20 . 1 1 24 24 ASP H H 24 8.424 8.424 7.548 0.876 18441
7239 1 20 . 1 1 25 25 TYR N N 25 120.417 120.417 120.361 0.056 18441
7240 1 20 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.254 -0.011 18441
7241 1 20 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.178 1.012 18441
7242 1 20 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.479 0.020 18441
7243 1 20 . 1 1 25 25 TYR H H 25 7.676 7.676 8.110 -0.434 18441
7244 1 20 . 1 1 26 26 LEU N N 26 120.960 120.960 119.880 1.080 18441
7245 1 20 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.814 -0.213 18441
7246 1 20 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.645 0.795 18441
7247 1 20 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.568 0.583 18441
7248 1 20 . 1 1 26 26 LEU H H 26 7.965 7.965 7.812 0.153 18441
7249 1 20 . 1 1 27 27 TYR N N 27 116.521 116.521 118.095 -1.574 18441
7250 1 20 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.109 -0.333 18441
7251 1 20 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.307 5.103 18441
7252 1 20 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.147 1.256 18441
7253 1 20 . 1 1 27 27 TYR H H 27 8.097 8.097 7.911 0.186 18441
7254 1 20 . 1 1 28 28 ASP N N 28 123.384 123.384 120.204 3.180 18441
7255 1 20 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.426 0.050 18441
7256 1 20 . 1 1 28 28 ASP CA C 28 58.540 58.540 58.431 0.109 18441
7257 1 20 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.938 0.456 18441
7258 1 20 . 1 1 28 28 ASP H H 28 8.355 8.355 7.935 0.420 18441
7259 1 20 . 1 1 29 29 VAL N N 29 121.272 121.272 119.924 1.348 18441
7260 1 20 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.772 -0.059 18441
7261 1 20 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.847 -0.197 18441
7262 1 20 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.727 0.191 18441
7263 1 20 . 1 1 29 29 VAL H H 29 8.252 8.252 8.022 0.230 18441
7264 1 20 . 1 1 30 30 LEU N N 30 122.443 122.443 119.807 2.636 18441
7265 1 20 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.038 0.005 18441
7266 1 20 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.227 0.653 18441
7267 1 20 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.526 0.755 18441
7268 1 20 . 1 1 30 30 LEU H H 30 7.987 7.987 8.064 -0.077 18441
7269 1 20 . 1 1 31 31 ARG N N 31 122.386 122.386 119.183 3.203 18441
7270 1 20 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.064 -0.048 18441
7271 1 20 . 1 1 31 31 ARG CA C 31 60.380 60.380 60.031 0.349 18441
7272 1 20 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.340 0.060 18441
7273 1 20 . 1 1 31 31 ARG H H 31 8.637 8.637 8.370 0.267 18441
7274 1 20 . 1 1 32 32 MET N N 32 120.006 120.006 119.510 0.496 18441
7275 1 20 . 1 1 32 32 MET HA H 32 4.359 4.359 4.250 0.109 18441
7276 1 20 . 1 1 32 32 MET CA C 32 58.490 58.490 59.349 -0.859 18441
7277 1 20 . 1 1 32 32 MET CB C 32 31.677 31.677 32.449 -0.772 18441
7278 1 20 . 1 1 32 32 MET H H 32 8.327 8.327 8.194 0.133 18441
7279 1 20 . 1 1 33 33 TYR N N 33 123.220 123.220 119.985 3.235 18441
7280 1 20 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.156 0.568 18441
7281 1 20 . 1 1 33 33 TYR CA C 33 61.000 61.000 61.656 -0.656 18441
7282 1 20 . 1 1 33 33 TYR CB C 33 39.687 39.687 38.038 1.649 18441
7283 1 20 . 1 1 33 33 TYR H H 33 8.054 8.054 8.286 -0.232 18441
7284 1 20 . 1 1 34 34 HIS N N 34 120.860 120.860 117.751 3.109 18441
7285 1 20 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.303 -0.527 18441
7286 1 20 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.002 1.708 18441
7287 1 20 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.573 0.819 18441
7288 1 20 . 1 1 34 34 HIS H H 34 8.548 8.548 7.892 0.656 18441
7289 1 20 . 1 1 35 35 GLN N N 35 113.582 113.582 118.257 -4.675 18441
7290 1 20 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.199 -0.199 18441
7291 1 20 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.582 0.098 18441
7292 1 20 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.789 0.761 18441
7293 1 20 . 1 1 35 35 GLN H H 35 7.542 7.542 8.465 -0.923 18441
7294 1 20 . 1 1 36 36 THR N N 36 111.117 111.117 109.506 1.611 18441
7295 1 20 . 1 1 36 36 THR HA H 36 4.214 4.214 4.325 -0.111 18441
7296 1 20 . 1 1 36 36 THR CA C 36 63.980 63.980 62.175 1.805 18441
7297 1 20 . 1 1 36 36 THR CB C 36 71.670 71.670 70.004 1.666 18441
7298 1 20 . 1 1 36 36 THR H H 36 8.569 8.569 8.182 0.387 18441
7299 1 20 . 1 1 37 37 MET N N 37 120.444 120.444 118.977 1.467 18441
7300 1 20 . 1 1 37 37 MET HA H 37 3.740 3.740 3.952 -0.212 18441
7301 1 20 . 1 1 37 37 MET CA C 37 56.430 56.430 56.297 0.133 18441
7302 1 20 . 1 1 37 37 MET CB C 37 31.399 31.399 31.427 -0.028 18441
7303 1 20 . 1 1 37 37 MET H H 37 9.542 9.542 8.270 1.272 18441
7304 1 20 . 1 1 38 38 ASP N N 38 117.020 117.020 120.852 -3.832 18441
7305 1 20 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.754 0.190 18441
7306 1 20 . 1 1 38 38 ASP CA C 38 53.476 53.476 54.322 -0.846 18441
7307 1 20 . 1 1 38 38 ASP CB C 38 42.040 42.040 41.703 0.337 18441
7308 1 20 . 1 1 38 38 ASP H H 38 7.456 7.456 8.012 -0.556 18441
7309 1 20 . 1 1 39 39 VAL N N 39 128.507 128.507 125.628 2.879 18441
7310 1 20 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.868 -0.037 18441
7311 1 20 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.467 0.373 18441
7312 1 20 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.585 1.115 18441
7313 1 20 . 1 1 39 39 VAL H H 39 8.425 8.425 8.678 -0.253 18441
7314 1 20 . 1 1 40 40 ALA N N 40 125.621 125.621 122.146 3.475 18441
7315 1 20 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.201 -0.214 18441
7316 1 20 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.314 0.546 18441
7317 1 20 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.236 0.234 18441
7318 1 20 . 1 1 40 40 ALA H H 40 7.998 7.998 8.424 -0.426 18441
7319 1 20 . 1 1 41 41 VAL N N 41 122.132 122.132 119.296 2.836 18441
7320 1 20 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.819 -0.248 18441
7321 1 20 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.727 0.953 18441
7322 1 20 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.549 1.153 18441
7323 1 20 . 1 1 41 41 VAL H H 41 7.663 7.663 8.118 -0.455 18441
7324 1 20 . 1 1 42 42 LEU N N 42 120.190 120.190 120.622 -0.432 18441
7325 1 20 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.291 -0.031 18441
7326 1 20 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.160 0.830 18441
7327 1 20 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.312 -0.607 18441
7328 1 20 . 1 1 42 42 LEU H H 42 7.361 7.361 7.741 -0.380 18441
7329 1 20 . 1 1 43 43 VAL N N 43 116.802 116.802 120.078 -3.276 18441
7330 1 20 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.728 -0.311 18441
7331 1 20 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.765 2.015 18441
7332 1 20 . 1 1 43 43 VAL CB C 43 31.980 31.980 31.293 0.687 18441
7333 1 20 . 1 1 43 43 VAL H H 43 8.062 8.062 7.725 0.337 18441
7334 1 20 . 1 1 44 44 GLY N N 44 106.242 106.242 107.605 -1.363 18441
7335 1 20 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.455 0.862 18441
7336 1 20 . 1 1 44 44 GLY H H 44 7.901 7.901 8.191 -0.290 18441
7337 1 20 . 1 1 45 45 ASP N N 45 123.359 123.359 123.309 0.050 18441
7338 1 20 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.328 0.337 18441
7339 1 20 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.165 0.595 18441
7340 1 20 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.555 0.313 18441
7341 1 20 . 1 1 45 45 ASP H H 45 8.680 8.680 7.782 0.898 18441
7342 1 20 . 1 1 46 46 LEU N N 46 123.201 123.201 120.309 2.892 18441
7343 1 20 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.707 0.359 18441
7344 1 20 . 1 1 46 46 LEU CA C 46 58.120 58.120 57.850 0.270 18441
7345 1 20 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.578 1.421 18441
7346 1 20 . 1 1 46 46 LEU H H 46 9.018 9.018 8.042 0.976 18441
7347 1 20 . 1 1 47 47 LYS N N 47 119.196 119.196 118.947 0.249 18441
7348 1 20 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.155 -0.185 18441
7349 1 20 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.812 0.478 18441
7350 1 20 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.291 0.850 18441
7351 1 20 . 1 1 47 47 LYS H H 47 8.017 8.017 7.660 0.357 18441
7352 1 20 . 1 1 48 48 LEU N N 48 116.358 116.358 119.599 -3.241 18441
7353 1 20 . 1 1 48 48 LEU HA H 48 4.161 4.161 3.985 0.176 18441
7354 1 20 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.600 0.070 18441
7355 1 20 . 1 1 48 48 LEU CB C 48 42.160 42.160 41.768 0.392 18441
7356 1 20 . 1 1 48 48 LEU H H 48 7.143 7.143 7.595 -0.452 18441
7357 1 20 . 1 1 49 49 VAL N N 49 112.662 112.662 115.807 -3.145 18441
7358 1 20 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.066 0.407 18441
7359 1 20 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.280 -0.220 18441
7360 1 20 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.470 2.696 18441
7361 1 20 . 1 1 49 49 VAL H H 49 7.266 7.266 7.484 -0.218 18441
7362 1 20 . 1 1 50 50 ILE N N 50 124.631 124.631 118.912 5.719 18441
7363 1 20 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.337 -0.492 18441
7364 1 20 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.757 0.833 18441
7365 1 20 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.863 -3.702 18441
7366 1 20 . 1 1 50 50 ILE H H 50 8.475 8.475 7.655 0.820 18441
7367 1 20 . 1 1 51 51 ASN N N 51 119.027 119.027 119.037 -0.010 18441
7368 1 20 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.607 0.100 18441
7369 1 20 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.337 0.111 18441
7370 1 20 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.084 0.877 18441
7371 1 20 . 1 1 51 51 ASN H H 51 7.347 7.347 8.083 -0.736 18441
7372 1 20 . 1 1 52 52 GLU N N 52 115.889 115.889 118.675 -2.786 18441
7373 1 20 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.765 0.123 18441
7374 1 20 . 1 1 52 52 GLU CA C 52 54.785 54.785 53.076 1.709 18441
7375 1 20 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.759 0.261 18441
7376 1 20 . 1 1 52 52 GLU H H 52 7.438 7.438 7.527 -0.089 18441
7377 1 20 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.234 -0.024 18441
7378 1 20 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.649 1.311 18441
7379 1 20 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.931 1.017 18441
7380 1 20 . 1 1 54 54 SER N N 54 113.711 113.711 110.981 2.730 18441
7381 1 20 . 1 1 54 54 SER HA H 54 4.173 4.173 4.349 -0.176 18441
7382 1 20 . 1 1 54 54 SER CA C 54 61.650 61.650 60.442 1.208 18441
7383 1 20 . 1 1 54 54 SER CB C 54 62.930 62.930 63.482 -0.552 18441
7384 1 20 . 1 1 54 54 SER H H 54 8.946 8.946 8.120 0.826 18441
7385 1 20 . 1 1 55 55 ARG N N 55 116.455 116.455 119.247 -2.792 18441
7386 1 20 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.376 0.028 18441
7387 1 20 . 1 1 55 55 ARG CA C 55 57.310 57.310 57.180 0.130 18441
7388 1 20 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.420 3.192 18441
7389 1 20 . 1 1 55 55 ARG H H 55 7.759 7.759 7.786 -0.027 18441
7390 1 20 . 1 1 56 56 LEU N N 56 121.468 121.468 123.173 -1.705 18441
7391 1 20 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.220 -0.085 18441
7392 1 20 . 1 1 56 56 LEU CA C 56 59.900 59.900 60.203 -0.303 18441
7393 1 20 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.337 1.660 18441
7394 1 20 . 1 1 56 56 LEU H H 56 7.472 7.472 8.547 -1.075 18441
7395 1 20 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.176 0.520 18441
7396 1 20 . 1 1 57 57 PRO CA C 57 66.180 66.180 65.985 0.195 18441
7397 1 20 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.017 1.373 18441
7398 1 20 . 1 1 58 58 LEU N N 58 119.923 119.923 118.469 1.454 18441
7399 1 20 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.030 0.020 18441
7400 1 20 . 1 1 58 58 LEU CA C 58 58.320 58.320 58.129 0.191 18441
7401 1 20 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.517 0.511 18441
7402 1 20 . 1 1 58 58 LEU H H 58 8.734 8.734 7.719 1.015 18441
7403 1 20 . 1 1 59 59 PHE N N 59 116.632 116.632 120.069 -3.437 18441
7404 1 20 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.235 0.244 18441
7405 1 20 . 1 1 59 59 PHE CA C 59 63.080 63.080 62.002 1.078 18441
7406 1 20 . 1 1 59 59 PHE CB C 59 38.852 38.852 39.097 -0.245 18441
7407 1 20 . 1 1 59 59 PHE H H 59 8.312 8.312 8.738 -0.426 18441
7408 1 20 . 1 1 60 60 ASP N N 60 120.603 120.603 118.101 2.502 18441
7409 1 20 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.486 0.185 18441
7410 1 20 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.672 1.198 18441
7411 1 20 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.660 0.881 18441
7412 1 20 . 1 1 60 60 ASP H H 60 7.462 7.462 7.844 -0.382 18441
7413 1 20 . 1 1 61 61 ALA N N 61 122.470 122.470 121.375 1.095 18441
7414 1 20 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.884 0.377 18441
7415 1 20 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.555 -0.009 18441
7416 1 20 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.973 -0.093 18441
7417 1 20 . 1 1 61 61 ALA H H 61 7.664 7.664 7.667 -0.003 18441
7418 1 20 . 1 1 62 62 ILE N N 62 115.525 115.525 117.933 -2.408 18441
7419 1 20 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.052 0.630 18441
7420 1 20 . 1 1 62 62 ILE CA C 62 63.420 63.420 62.949 0.471 18441
7421 1 20 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.872 2.283 18441
7422 1 20 . 1 1 62 62 ILE H H 62 7.653 7.653 7.692 -0.039 18441
7423 1 20 . 1 1 63 63 ARG N N 63 121.016 121.016 120.818 0.198 18441
7424 1 20 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.655 -0.181 18441
7425 1 20 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.368 1.002 18441
7426 1 20 . 1 1 63 63 ARG H H 63 6.917 6.917 7.518 -0.601 18441
7427 1 20 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.189 0.122 18441
7428 1 20 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.186 0.554 18441
7429 1 20 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.079 1.108 18441
7430 1 20 . 1 1 65 65 LEU N N 65 114.713 114.713 116.235 -1.522 18441
7431 1 20 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.074 -0.154 18441
7432 1 20 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.002 -0.342 18441
7433 1 20 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.702 0.406 18441
7434 1 20 . 1 1 65 65 LEU H H 65 8.074 8.074 7.402 0.672 18441
7435 1 20 . 1 1 66 66 ILE N N 66 120.129 120.129 118.552 1.577 18441
7436 1 20 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.102 0.203 18441
7437 1 20 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.311 -4.551 18441
7438 1 20 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.427 -0.783 18441
7439 1 20 . 1 1 66 66 ILE H H 66 7.398 7.398 7.336 0.062 18441
7440 1 20 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.318 -0.013 18441
7441 1 20 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.688 0.952 18441
7442 1 20 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.309 0.980 18441
7443 1 20 . 1 1 68 68 LEU N N 68 124.673 124.673 123.789 0.884 18441
7444 1 20 . 1 1 68 68 LEU HA H 68 3.850 3.850 4.013 -0.163 18441
7445 1 20 . 1 1 68 68 LEU CA C 68 59.620 59.620 58.919 0.701 18441
7446 1 20 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.642 0.826 18441
7447 1 20 . 1 1 68 68 LEU H H 68 8.471 8.471 8.358 0.113 18441
7448 1 20 . 1 1 69 69 LYS N N 69 115.247 115.247 116.792 -1.545 18441
7449 1 20 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.044 0.125 18441
7450 1 20 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.442 -0.422 18441
7451 1 20 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.062 1.444 18441
7452 1 20 . 1 1 69 69 LYS H H 69 8.536 8.536 8.584 -0.048 18441
7453 1 20 . 1 1 70 70 HIS N N 70 118.849 118.849 118.582 0.267 18441
7454 1 20 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.380 0.845 18441
7455 1 20 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.422 -3.533 18441
7456 1 20 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.655 5.383 18441
7457 1 20 . 1 1 70 70 HIS H H 70 8.060 8.060 8.316 -0.256 18441
7458 1 20 . 1 1 71 71 GLN N N 71 122.130 122.130 119.184 2.946 18441
7459 1 20 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.097 -0.398 18441
7460 1 20 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.524 2.166 18441
7461 1 20 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.841 0.409 18441
7462 1 20 . 1 1 71 71 GLN H H 71 7.732 7.732 8.461 -0.729 18441
7463 1 20 . 1 1 72 72 VAL N N 72 119.182 119.182 119.937 -0.755 18441
7464 1 20 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.718 0.090 18441
7465 1 20 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.705 0.515 18441
7466 1 20 . 1 1 72 72 VAL CB C 72 31.814 31.814 30.995 0.819 18441
7467 1 20 . 1 1 72 72 VAL H H 72 8.203 8.203 7.856 0.347 18441
7468 1 20 . 1 1 73 73 GLU N N 73 121.878 121.878 120.009 1.869 18441
7469 1 20 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.075 -0.097 18441
7470 1 20 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.409 0.691 18441
7471 1 20 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.841 0.819 18441
7472 1 20 . 1 1 73 73 GLU H H 73 8.136 8.136 7.915 0.221 18441
7473 1 20 . 1 1 74 74 TYR N N 74 119.780 119.780 121.168 -1.388 18441
7474 1 20 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.244 -0.567 18441
7475 1 20 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.858 1.452 18441
7476 1 20 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.563 1.457 18441
7477 1 20 . 1 1 74 74 TYR H H 74 8.491 8.491 8.475 0.016 18441
7478 1 20 . 1 1 75 75 ASP N N 75 120.231 120.231 119.289 0.942 18441
7479 1 20 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.472 -0.329 18441
7480 1 20 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.009 0.551 18441
7481 1 20 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.679 -0.101 18441
7482 1 20 . 1 1 75 75 ASP H H 75 8.566 8.566 8.582 -0.016 18441
7483 1 20 . 1 1 76 76 GLN N N 76 118.324 118.324 117.467 0.857 18441
7484 1 20 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.069 -0.013 18441
7485 1 20 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.651 -0.221 18441
7486 1 20 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.324 0.106 18441
7487 1 20 . 1 1 76 76 GLN H H 76 7.844 7.844 7.798 0.046 18441
7488 1 20 . 1 1 77 77 LEU N N 77 117.932 117.932 117.274 0.658 18441
7489 1 20 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.156 0.041 18441
7490 1 20 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.380 -0.470 18441
7491 1 20 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.560 2.844 18441
7492 1 20 . 1 1 77 77 LEU H H 77 7.665 7.665 7.526 0.139 18441
7493 1 20 . 1 1 78 78 THR N N 78 110.323 110.323 114.201 -3.878 18441
7494 1 20 . 1 1 78 78 THR HA H 78 3.709 3.709 4.228 -0.519 18441
7495 1 20 . 1 1 78 78 THR CA C 78 59.750 59.750 59.309 0.441 18441
7496 1 20 . 1 1 78 78 THR CB C 78 69.110 69.110 69.740 -0.630 18441
7497 1 20 . 1 1 78 78 THR H H 78 7.130 7.130 7.244 -0.114 18441
7498 1 20 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.265 -0.019 18441
7499 1 20 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.107 0.573 18441
7500 1 20 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.223 0.168 18441
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 72 2.465 -0.505 2.430 18441
2 1 1 "Average Difference" HA 79 0.297 0.010 0.299 18441
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18441
4 1 1 "Average Difference" CA 78 1.439 -0.648 1.293 18441
5 1 1 "Average Difference" CB 76 1.378 -0.825 1.110 18441
6 1 1 "Average Difference" HN 72 0.487 -0.054 0.487 18441
7 1 2 "Average Difference" N 72 2.506 -0.570 2.457 18441
8 1 2 "Average Difference" HA 79 0.280 -0.011 0.281 18441
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18441
10 1 2 "Average Difference" CA 78 1.427 -0.598 1.304 18441
11 1 2 "Average Difference" CB 76 1.370 -0.793 1.124 18441
12 1 2 "Average Difference" HN 72 0.500 -0.060 0.500 18441
13 1 3 "Average Difference" N 72 2.581 -0.599 2.529 18441
14 1 3 "Average Difference" HA 79 0.265 -0.018 0.267 18441
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18441
16 1 3 "Average Difference" CA 78 1.536 -0.476 1.470 18441
17 1 3 "Average Difference" CB 76 1.432 -0.862 1.150 18441
18 1 3 "Average Difference" HN 72 0.540 -0.087 0.537 18441
19 1 4 "Average Difference" N 72 2.507 -0.624 2.445 18441
20 1 4 "Average Difference" HA 79 0.277 -0.006 0.278 18441
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18441
22 1 4 "Average Difference" CA 78 1.430 -0.628 1.294 18441
23 1 4 "Average Difference" CB 76 1.365 -0.794 1.118 18441
24 1 4 "Average Difference" HN 72 0.518 -0.064 0.518 18441
25 1 5 "Average Difference" N 72 2.472 -0.446 2.449 18441
26 1 5 "Average Difference" HA 79 0.261 -0.002 0.263 18441
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18441
28 1 5 "Average Difference" CA 78 1.328 -0.629 1.178 18441
29 1 5 "Average Difference" CB 76 1.369 -0.782 1.131 18441
30 1 5 "Average Difference" HN 72 0.531 -0.077 0.529 18441
31 1 6 "Average Difference" N 72 2.638 -0.544 2.600 18441
32 1 6 "Average Difference" HA 79 0.263 -0.001 0.264 18441
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18441
34 1 6 "Average Difference" CA 78 1.577 -0.513 1.501 18441
35 1 6 "Average Difference" CB 76 1.458 -0.865 1.181 18441
36 1 6 "Average Difference" HN 72 0.518 -0.076 0.516 18441
37 1 7 "Average Difference" N 72 2.544 -0.522 2.508 18441
38 1 7 "Average Difference" HA 79 0.273 -0.001 0.275 18441
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18441
40 1 7 "Average Difference" CA 78 1.398 -0.662 1.240 18441
41 1 7 "Average Difference" CB 76 1.355 -0.839 1.071 18441
42 1 7 "Average Difference" HN 72 0.524 -0.070 0.522 18441
43 1 8 "Average Difference" N 72 2.243 -0.327 2.234 18441
44 1 8 "Average Difference" HA 79 0.256 -0.007 0.257 18441
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18441
46 1 8 "Average Difference" CA 78 1.280 -0.576 1.151 18441
47 1 8 "Average Difference" CB 76 1.369 -0.817 1.105 18441
48 1 8 "Average Difference" HN 72 0.514 -0.050 0.515 18441
49 1 9 "Average Difference" N 72 2.509 -0.480 2.480 18441
50 1 9 "Average Difference" HA 79 0.237 -0.014 0.238 18441
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18441
52 1 9 "Average Difference" CA 78 1.567 -0.469 1.504 18441
53 1 9 "Average Difference" CB 76 1.367 -0.873 1.059 18441
54 1 9 "Average Difference" HN 72 0.543 -0.095 0.539 18441
55 1 10 "Average Difference" N 72 2.370 -0.365 2.358 18441
56 1 10 "Average Difference" HA 79 0.255 -0.001 0.257 18441
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18441
58 1 10 "Average Difference" CA 78 1.361 -0.542 1.256 18441
59 1 10 "Average Difference" CB 76 1.413 -0.827 1.153 18441
60 1 10 "Average Difference" HN 72 0.509 -0.031 0.512 18441
61 1 11 "Average Difference" N 72 2.316 -0.486 2.280 18441
62 1 11 "Average Difference" HA 79 0.269 -0.005 0.271 18441
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18441
64 1 11 "Average Difference" CA 78 1.512 -0.508 1.433 18441
65 1 11 "Average Difference" CB 76 1.375 -0.788 1.135 18441
66 1 11 "Average Difference" HN 72 0.529 -0.084 0.527 18441
67 1 12 "Average Difference" N 72 2.405 -0.424 2.384 18441
68 1 12 "Average Difference" HA 79 0.262 -0.007 0.264 18441
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18441
70 1 12 "Average Difference" CA 78 1.527 -0.502 1.451 18441
71 1 12 "Average Difference" CB 76 1.397 -0.838 1.126 18441
72 1 12 "Average Difference" HN 72 0.509 -0.050 0.510 18441
73 1 13 "Average Difference" N 72 2.477 -0.514 2.439 18441
74 1 13 "Average Difference" HA 79 0.278 -0.014 0.280 18441
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18441
76 1 13 "Average Difference" CA 78 1.324 -0.577 1.200 18441
77 1 13 "Average Difference" CB 76 1.360 -0.825 1.089 18441
78 1 13 "Average Difference" HN 72 0.507 -0.060 0.507 18441
79 1 14 "Average Difference" N 72 2.575 -0.539 2.536 18441
80 1 14 "Average Difference" HA 79 0.278 -0.001 0.280 18441
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18441
82 1 14 "Average Difference" CA 78 1.506 -0.476 1.438 18441
83 1 14 "Average Difference" CB 76 1.421 -0.827 1.163 18441
84 1 14 "Average Difference" HN 72 0.497 -0.037 0.499 18441
85 1 15 "Average Difference" N 72 2.372 -0.507 2.334 18441
86 1 15 "Average Difference" HA 79 0.293 -0.016 0.295 18441
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18441
88 1 15 "Average Difference" CA 78 1.478 -0.528 1.390 18441
89 1 15 "Average Difference" CB 76 1.407 -0.811 1.158 18441
90 1 15 "Average Difference" HN 72 0.496 -0.076 0.493 18441
91 1 16 "Average Difference" N 72 2.378 -0.489 2.344 18441
92 1 16 "Average Difference" HA 79 0.285 0.002 0.287 18441
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18441
94 1 16 "Average Difference" CA 78 1.384 -0.695 1.205 18441
95 1 16 "Average Difference" CB 76 1.332 -0.795 1.076 18441
96 1 16 "Average Difference" HN 72 0.492 -0.063 0.491 18441
97 1 17 "Average Difference" N 72 2.375 -0.463 2.346 18441
98 1 17 "Average Difference" HA 79 0.267 -0.002 0.269 18441
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18441
100 1 17 "Average Difference" CA 78 1.349 -0.657 1.186 18441
101 1 17 "Average Difference" CB 76 1.320 -0.709 1.120 18441
102 1 17 "Average Difference" HN 72 0.539 -0.088 0.536 18441
103 1 18 "Average Difference" N 72 2.441 -0.439 2.419 18441
104 1 18 "Average Difference" HA 79 0.276 -0.007 0.278 18441
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18441
106 1 18 "Average Difference" CA 78 1.339 -0.606 1.202 18441
107 1 18 "Average Difference" CB 76 1.421 -0.771 1.202 18441
108 1 18 "Average Difference" HN 72 0.511 -0.059 0.511 18441
109 1 19 "Average Difference" N 72 2.279 -0.429 2.254 18441
110 1 19 "Average Difference" HA 79 0.290 0.005 0.292 18441
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18441
112 1 19 "Average Difference" CA 78 1.342 -0.628 1.194 18441
113 1 19 "Average Difference" CB 76 1.370 -0.804 1.117 18441
114 1 19 "Average Difference" HN 72 0.521 -0.072 0.519 18441
115 1 20 "Average Difference" N 72 2.430 -0.452 2.404 18441
116 1 20 "Average Difference" HA 79 0.268 0.010 0.270 18441
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18441
118 1 20 "Average Difference" CA 78 1.327 -0.590 1.196 18441
119 1 20 "Average Difference" CB 76 1.361 -0.786 1.118 18441
120 1 20 "Average Difference" HN 72 0.496 -0.027 0.498 18441
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 18441
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ASP HA H 2 4.530 4.530 4.813 -0.283 18441
2 1 . 1 1 2 2 ASP CA C 2 55.590 55.590 54.177 1.413 18441
3 1 . 1 1 2 2 ASP CB C 2 41.693 41.693 41.712 -0.019 18441
4 1 . 1 1 3 3 ARG N N 3 121.498 121.498 120.517 0.981 18441
5 1 . 1 1 3 3 ARG HA H 3 4.241 4.241 4.196 0.045 18441
6 1 . 1 1 3 3 ARG CA C 3 57.670 57.670 57.773 -0.103 18441
7 1 . 1 1 3 3 ARG CB C 3 30.510 30.510 30.388 0.122 18441
8 1 . 1 1 3 3 ARG H H 3 8.382 8.382 8.377 0.005 18441
9 1 . 1 1 4 4 LYS N N 4 122.257 122.257 120.635 1.622 18441
10 1 . 1 1 4 4 LYS HA H 4 4.058 4.058 4.098 -0.040 18441
11 1 . 1 1 4 4 LYS CA C 4 59.710 59.710 59.211 0.499 18441
12 1 . 1 1 4 4 LYS CB C 4 33.276 33.276 31.951 1.325 18441
13 1 . 1 1 4 4 LYS H H 4 8.226 8.226 8.262 -0.036 18441
14 1 . 1 1 5 5 VAL N N 5 120.494 120.494 118.294 2.200 18441
15 1 . 1 1 5 5 VAL HA H 5 3.721 3.721 3.790 -0.069 18441
16 1 . 1 1 5 5 VAL CA C 5 66.650 66.650 65.741 0.909 18441
17 1 . 1 1 5 5 VAL CB C 5 32.074 32.074 31.275 0.799 18441
18 1 . 1 1 5 5 VAL H H 5 8.109 8.109 8.045 0.064 18441
19 1 . 1 1 6 6 ALA N N 6 123.149 123.149 122.985 0.164 18441
20 1 . 1 1 6 6 ALA HA H 6 4.035 4.035 4.262 -0.227 18441
21 1 . 1 1 6 6 ALA CA C 6 55.890 55.890 55.222 0.668 18441
22 1 . 1 1 6 6 ALA CB C 6 19.260 19.260 18.328 0.932 18441
23 1 . 1 1 6 6 ALA H H 6 8.374 8.374 7.648 0.726 18441
24 1 . 1 1 7 7 ARG N N 7 119.587 119.587 118.613 0.974 18441
25 1 . 1 1 7 7 ARG HA H 7 4.001 4.001 3.897 0.104 18441
26 1 . 1 1 7 7 ARG CA C 7 59.770 59.770 59.236 0.534 18441
27 1 . 1 1 7 7 ARG CB C 7 30.770 30.770 30.086 0.684 18441
28 1 . 1 1 7 7 ARG H H 7 7.992 7.992 7.920 0.072 18441
29 1 . 1 1 8 8 GLU N N 8 119.745 119.745 120.135 -0.390 18441
30 1 . 1 1 8 8 GLU HA H 8 4.058 4.058 4.083 -0.025 18441
31 1 . 1 1 8 8 GLU CA C 8 59.770 59.770 59.595 0.175 18441
32 1 . 1 1 8 8 GLU CB C 8 29.950 29.950 29.729 0.221 18441
33 1 . 1 1 8 8 GLU H H 8 8.165 8.165 8.199 -0.034 18441
34 1 . 1 1 9 9 PHE N N 9 121.436 121.436 119.742 1.694 18441
35 1 . 1 1 9 9 PHE HA H 9 4.127 4.127 4.392 -0.265 18441
36 1 . 1 1 9 9 PHE CA C 9 63.020 63.020 59.967 3.053 18441
37 1 . 1 1 9 9 PHE CB C 9 39.623 39.623 38.549 1.074 18441
38 1 . 1 1 9 9 PHE H H 9 8.180 8.180 8.260 -0.080 18441
39 1 . 1 1 10 10 ARG N N 10 119.028 119.028 119.831 -0.803 18441
40 1 . 1 1 10 10 ARG HA H 10 3.861 3.861 3.534 0.326 18441
41 1 . 1 1 10 10 ARG CA C 10 59.580 59.580 58.977 0.603 18441
42 1 . 1 1 10 10 ARG CB C 10 30.320 30.320 29.264 1.056 18441
43 1 . 1 1 10 10 ARG H H 10 7.910 7.910 7.943 -0.033 18441
44 1 . 1 1 11 11 HIS N N 11 116.563 116.563 118.437 -1.874 18441
45 1 . 1 1 11 11 HIS HA H 11 4.456 4.456 4.256 0.200 18441
46 1 . 1 1 11 11 HIS CA C 11 59.180 59.180 59.068 0.112 18441
47 1 . 1 1 11 11 HIS CB C 11 30.030 30.030 29.925 0.105 18441
48 1 . 1 1 11 11 HIS H H 11 8.001 8.001 8.176 -0.175 18441
49 1 . 1 1 12 12 LYS N N 12 120.773 120.773 119.235 1.538 18441
50 1 . 1 1 12 12 LYS HA H 12 4.008 4.008 4.023 -0.015 18441
51 1 . 1 1 12 12 LYS CA C 12 59.980 59.980 59.625 0.355 18441
52 1 . 1 1 12 12 LYS CB C 12 32.693 32.693 32.377 0.316 18441
53 1 . 1 1 12 12 LYS H H 12 7.796 7.796 7.762 0.034 18441
54 1 . 1 1 13 13 VAL N N 13 120.125 120.125 120.259 -0.134 18441
55 1 . 1 1 13 13 VAL HA H 13 3.111 3.111 3.644 -0.533 18441
56 1 . 1 1 13 13 VAL CA C 13 68.180 68.180 66.953 1.227 18441
57 1 . 1 1 13 13 VAL CB C 13 32.140 32.140 31.480 0.660 18441
58 1 . 1 1 13 13 VAL H H 13 7.821 7.821 7.888 -0.067 18441
59 1 . 1 1 14 14 ASP N N 14 117.462 117.462 119.231 -1.769 18441
60 1 . 1 1 14 14 ASP HA H 14 4.262 4.262 4.340 -0.078 18441
61 1 . 1 1 14 14 ASP CA C 14 57.400 57.400 57.118 0.282 18441
62 1 . 1 1 14 14 ASP CB C 14 41.314 41.314 40.845 0.469 18441
63 1 . 1 1 14 14 ASP H H 14 8.276 8.276 7.808 0.468 18441
64 1 . 1 1 15 15 PHE N N 15 117.914 117.914 119.184 -1.271 18441
65 1 . 1 1 15 15 PHE HA H 15 4.362 4.362 4.294 0.068 18441
66 1 . 1 1 15 15 PHE CA C 15 60.190 60.190 60.477 -0.287 18441
67 1 . 1 1 15 15 PHE CB C 15 40.698 40.698 39.516 1.182 18441
68 1 . 1 1 15 15 PHE H H 15 7.664 7.664 7.724 -0.060 18441
69 1 . 1 1 16 16 LEU N N 16 116.737 116.737 116.833 -0.096 18441
70 1 . 1 1 16 16 LEU HA H 16 4.234 4.234 4.234 -0.000 18441
71 1 . 1 1 16 16 LEU CA C 16 56.420 56.420 54.777 1.643 18441
72 1 . 1 1 16 16 LEU CB C 16 45.078 45.078 42.441 2.637 18441
73 1 . 1 1 16 16 LEU H H 16 7.658 7.658 7.878 -0.220 18441
74 1 . 1 1 17 17 ILE N N 17 120.533 120.533 117.363 3.170 18441
75 1 . 1 1 17 17 ILE HA H 17 4.108 4.108 4.351 -0.243 18441
76 1 . 1 1 17 17 ILE CA C 17 60.540 60.540 59.150 1.390 18441
77 1 . 1 1 17 17 ILE CB C 17 38.357 38.357 37.363 0.994 18441
78 1 . 1 1 17 17 ILE H H 17 8.336 8.336 7.303 1.033 18441
79 1 . 1 1 18 18 GLU N N 18 124.531 124.531 123.053 1.478 18441
80 1 . 1 1 18 18 GLU HA H 18 4.210 4.210 4.056 0.154 18441
81 1 . 1 1 18 18 GLU CA C 18 58.600 58.600 58.576 0.024 18441
82 1 . 1 1 18 18 GLU CB C 18 31.010 31.010 29.623 1.387 18441
83 1 . 1 1 18 18 GLU H H 18 8.276 8.276 8.607 -0.331 18441
84 1 . 1 1 19 19 ASN N N 19 117.630 117.630 117.813 -0.183 18441
85 1 . 1 1 19 19 ASN HA H 19 4.805 4.805 4.609 0.196 18441
86 1 . 1 1 19 19 ASN CA C 19 53.738 53.738 54.049 -0.311 18441
87 1 . 1 1 19 19 ASN CB C 19 41.178 41.178 39.257 1.921 18441
88 1 . 1 1 19 19 ASN H H 19 7.700 7.700 8.034 -0.334 18441
89 1 . 1 1 20 20 ASP N N 20 127.428 127.428 119.772 7.656 18441
90 1 . 1 1 20 20 ASP HA H 20 4.249 4.249 4.531 -0.282 18441
91 1 . 1 1 20 20 ASP CA C 20 58.850 58.850 56.656 2.194 18441
92 1 . 1 1 20 20 ASP CB C 20 41.314 41.314 40.903 0.411 18441
93 1 . 1 1 20 20 ASP H H 20 8.998 8.998 8.535 0.463 18441
94 1 . 1 1 21 21 ALA N N 21 122.271 122.271 122.958 -0.687 18441
95 1 . 1 1 21 21 ALA HA H 21 4.260 4.260 4.081 0.179 18441
96 1 . 1 1 21 21 ALA CA C 21 56.000 56.000 55.316 0.684 18441
97 1 . 1 1 21 21 ALA CB C 21 18.650 18.650 18.274 0.376 18441
98 1 . 1 1 21 21 ALA H H 21 8.346 8.346 8.051 0.295 18441
99 1 . 1 1 22 22 GLU N N 22 118.716 118.716 118.151 0.565 18441
100 1 . 1 1 22 22 GLU HA H 22 4.114 4.114 3.985 0.129 18441
101 1 . 1 1 22 22 GLU CA C 22 60.360 60.360 59.932 0.428 18441
102 1 . 1 1 22 22 GLU CB C 22 31.772 31.772 29.033 2.739 18441
103 1 . 1 1 22 22 GLU H H 22 7.724 7.724 8.836 -1.112 18441
104 1 . 1 1 23 23 LYS N N 23 121.088 121.088 117.742 3.346 18441
105 1 . 1 1 23 23 LYS HA H 23 3.811 3.811 3.782 0.029 18441
106 1 . 1 1 23 23 LYS CA C 23 61.670 61.670 59.036 2.634 18441
107 1 . 1 1 23 23 LYS CB C 23 33.070 33.070 31.891 1.179 18441
108 1 . 1 1 23 23 LYS H H 23 7.618 7.618 7.854 -0.236 18441
109 1 . 1 1 24 24 ASP N N 24 119.010 119.010 120.658 -1.648 18441
110 1 . 1 1 24 24 ASP HA H 24 4.489 4.489 4.496 -0.007 18441
111 1 . 1 1 24 24 ASP CA C 24 58.510 58.510 57.388 1.122 18441
112 1 . 1 1 24 24 ASP CB C 24 40.837 40.837 40.687 0.150 18441
113 1 . 1 1 24 24 ASP H H 24 8.424 8.424 7.741 0.683 18441
114 1 . 1 1 25 25 TYR N N 25 120.417 120.417 120.596 -0.179 18441
115 1 . 1 1 25 25 TYR HA H 25 4.243 4.243 4.188 0.055 18441
116 1 . 1 1 25 25 TYR CA C 25 62.190 62.190 61.492 0.698 18441
117 1 . 1 1 25 25 TYR CB C 25 38.499 38.499 38.538 -0.039 18441
118 1 . 1 1 25 25 TYR H H 25 7.676 7.676 8.233 -0.557 18441
119 1 . 1 1 26 26 LEU N N 26 120.960 120.960 120.030 0.930 18441
120 1 . 1 1 26 26 LEU HA H 26 3.601 3.601 3.867 -0.266 18441
121 1 . 1 1 26 26 LEU CA C 26 59.440 59.440 58.595 0.845 18441
122 1 . 1 1 26 26 LEU CB C 26 42.151 42.151 41.621 0.530 18441
123 1 . 1 1 26 26 LEU H H 26 7.965 7.965 7.853 0.112 18441
124 1 . 1 1 27 27 TYR N N 27 116.521 116.521 118.000 -1.479 18441
125 1 . 1 1 27 27 TYR HA H 27 3.776 3.776 4.103 -0.327 18441
126 1 . 1 1 27 27 TYR CA C 27 64.410 64.410 59.532 4.878 18441
127 1 . 1 1 27 27 TYR CB C 27 38.403 38.403 37.103 1.300 18441
128 1 . 1 1 27 27 TYR H H 27 8.097 8.097 8.009 0.088 18441
129 1 . 1 1 28 28 ASP N N 28 123.384 123.384 119.722 3.662 18441
130 1 . 1 1 28 28 ASP HA H 28 4.476 4.476 4.433 0.043 18441
131 1 . 1 1 28 28 ASP CA C 28 58.540 58.540 57.728 0.812 18441
132 1 . 1 1 28 28 ASP CB C 28 41.394 41.394 40.626 0.768 18441
133 1 . 1 1 28 28 ASP H H 28 8.355 8.355 7.888 0.467 18441
134 1 . 1 1 29 29 VAL N N 29 121.272 121.272 120.277 0.995 18441
135 1 . 1 1 29 29 VAL HA H 29 3.713 3.713 3.654 0.059 18441
136 1 . 1 1 29 29 VAL CA C 29 66.650 66.650 66.716 -0.066 18441
137 1 . 1 1 29 29 VAL CB C 29 31.918 31.918 31.698 0.220 18441
138 1 . 1 1 29 29 VAL H H 29 8.252 8.252 7.894 0.358 18441
139 1 . 1 1 30 30 LEU N N 30 122.443 122.443 119.939 2.505 18441
140 1 . 1 1 30 30 LEU HA H 30 4.043 4.043 4.070 -0.027 18441
141 1 . 1 1 30 30 LEU CA C 30 58.880 58.880 58.355 0.525 18441
142 1 . 1 1 30 30 LEU CB C 30 42.281 42.281 41.565 0.716 18441
143 1 . 1 1 30 30 LEU H H 30 7.987 7.987 8.177 -0.190 18441
144 1 . 1 1 31 31 ARG N N 31 122.386 122.386 118.681 3.705 18441
145 1 . 1 1 31 31 ARG HA H 31 4.016 4.016 4.028 -0.012 18441
146 1 . 1 1 31 31 ARG CA C 31 60.380 60.380 59.549 0.831 18441
147 1 . 1 1 31 31 ARG CB C 31 30.400 30.400 30.150 0.250 18441
148 1 . 1 1 31 31 ARG H H 31 8.637 8.637 8.238 0.399 18441
149 1 . 1 1 32 32 MET N N 32 120.006 120.006 119.329 0.677 18441
150 1 . 1 1 32 32 MET HA H 32 4.359 4.359 4.226 0.133 18441
151 1 . 1 1 32 32 MET CA C 32 58.490 58.490 58.717 -0.227 18441
152 1 . 1 1 32 32 MET CB C 32 31.677 31.677 32.159 -0.482 18441
153 1 . 1 1 32 32 MET H H 32 8.327 8.327 8.095 0.232 18441
154 1 . 1 1 33 33 TYR N N 33 123.220 123.220 120.663 2.557 18441
155 1 . 1 1 33 33 TYR HA H 33 4.724 4.724 4.213 0.511 18441
156 1 . 1 1 33 33 TYR CA C 33 61.000 61.000 60.671 0.329 18441
157 1 . 1 1 33 33 TYR CB C 33 39.687 39.687 37.883 1.804 18441
158 1 . 1 1 33 33 TYR H H 33 8.054 8.054 8.313 -0.259 18441
159 1 . 1 1 34 34 HIS N N 34 120.860 120.860 117.815 3.045 18441
160 1 . 1 1 34 34 HIS HA H 34 3.776 3.776 4.195 -0.419 18441
161 1 . 1 1 34 34 HIS CA C 34 60.710 60.710 59.396 1.314 18441
162 1 . 1 1 34 34 HIS CB C 34 31.392 31.392 30.339 1.053 18441
163 1 . 1 1 34 34 HIS H H 34 8.548 8.548 7.976 0.572 18441
164 1 . 1 1 35 35 GLN N N 35 113.582 113.582 118.569 -4.987 18441
165 1 . 1 1 35 35 GLN HA H 35 4.000 4.000 4.237 -0.237 18441
166 1 . 1 1 35 35 GLN CA C 35 58.680 58.680 58.400 0.280 18441
167 1 . 1 1 35 35 GLN CB C 35 30.550 30.550 29.499 1.051 18441
168 1 . 1 1 35 35 GLN H H 35 7.542 7.542 8.391 -0.850 18441
169 1 . 1 1 36 36 THR N N 36 111.117 111.117 110.574 0.543 18441
170 1 . 1 1 36 36 THR HA H 36 4.214 4.214 4.260 -0.046 18441
171 1 . 1 1 36 36 THR CA C 36 63.980 63.980 62.916 1.064 18441
172 1 . 1 1 36 36 THR CB C 36 71.670 71.670 69.814 1.856 18441
173 1 . 1 1 36 36 THR H H 36 8.569 8.569 8.358 0.210 18441
174 1 . 1 1 37 37 MET N N 37 120.444 120.444 117.933 2.511 18441
175 1 . 1 1 37 37 MET HA H 37 3.740 3.740 4.200 -0.460 18441
176 1 . 1 1 37 37 MET CA C 37 56.430 56.430 56.316 0.114 18441
177 1 . 1 1 37 37 MET CB C 37 31.399 31.399 30.574 0.825 18441
178 1 . 1 1 37 37 MET H H 37 9.542 9.542 7.717 1.825 18441
179 1 . 1 1 38 38 ASP N N 38 117.020 117.020 120.511 -3.490 18441
180 1 . 1 1 38 38 ASP HA H 38 4.944 4.944 4.853 0.091 18441
181 1 . 1 1 38 38 ASP CA C 38 53.476 53.476 53.331 0.145 18441
182 1 . 1 1 38 38 ASP CB C 38 42.040 42.040 42.479 -0.439 18441
183 1 . 1 1 38 38 ASP H H 38 7.456 7.456 7.809 -0.353 18441
184 1 . 1 1 39 39 VAL N N 39 128.507 128.507 124.778 3.729 18441
185 1 . 1 1 39 39 VAL HA H 39 3.831 3.831 3.661 0.170 18441
186 1 . 1 1 39 39 VAL CA C 39 64.840 64.840 64.311 0.529 18441
187 1 . 1 1 39 39 VAL CB C 39 32.700 32.700 31.507 1.193 18441
188 1 . 1 1 39 39 VAL H H 39 8.425 8.425 8.687 -0.262 18441
189 1 . 1 1 40 40 ALA N N 40 125.621 125.621 122.554 3.067 18441
190 1 . 1 1 40 40 ALA HA H 40 3.987 3.987 4.104 -0.117 18441
191 1 . 1 1 40 40 ALA CA C 40 55.860 55.860 55.127 0.733 18441
192 1 . 1 1 40 40 ALA CB C 40 18.470 18.470 18.297 0.173 18441
193 1 . 1 1 40 40 ALA H H 40 7.998 7.998 8.051 -0.053 18441
194 1 . 1 1 41 41 VAL N N 41 122.132 122.132 118.777 3.355 18441
195 1 . 1 1 41 41 VAL HA H 41 3.571 3.571 3.754 -0.183 18441
196 1 . 1 1 41 41 VAL CA C 41 66.680 66.680 65.763 0.917 18441
197 1 . 1 1 41 41 VAL CB C 41 32.702 32.702 31.543 1.159 18441
198 1 . 1 1 41 41 VAL H H 41 7.663 7.663 7.671 -0.008 18441
199 1 . 1 1 42 42 LEU N N 42 120.190 120.190 119.768 0.422 18441
200 1 . 1 1 42 42 LEU HA H 42 4.260 4.260 4.057 0.203 18441
201 1 . 1 1 42 42 LEU CA C 42 58.990 58.990 58.347 0.643 18441
202 1 . 1 1 42 42 LEU CB C 42 40.705 40.705 41.316 -0.611 18441
203 1 . 1 1 42 42 LEU H H 42 7.361 7.361 7.372 -0.011 18441
204 1 . 1 1 43 43 VAL N N 43 116.802 116.802 119.010 -2.208 18441
205 1 . 1 1 43 43 VAL HA H 43 3.417 3.417 3.649 -0.232 18441
206 1 . 1 1 43 43 VAL CA C 43 68.780 68.780 66.341 2.439 18441
207 1 . 1 1 43 43 VAL CB C 43 31.980 31.980 30.784 1.196 18441
208 1 . 1 1 43 43 VAL H H 43 8.062 8.062 7.747 0.315 18441
209 1 . 1 1 44 44 GLY N N 44 106.242 106.242 107.930 -1.688 18441
210 1 . 1 1 44 44 GLY CA C 44 48.316 48.316 47.324 0.993 18441
211 1 . 1 1 44 44 GLY H H 44 7.901 7.901 7.907 -0.006 18441
212 1 . 1 1 45 45 ASP N N 45 123.359 123.359 123.446 -0.087 18441
213 1 . 1 1 45 45 ASP HA H 45 4.665 4.665 4.497 0.168 18441
214 1 . 1 1 45 45 ASP CA C 45 57.760 57.760 57.511 0.249 18441
215 1 . 1 1 45 45 ASP CB C 45 40.868 40.868 40.570 0.298 18441
216 1 . 1 1 45 45 ASP H H 45 8.680 8.680 7.820 0.860 18441
217 1 . 1 1 46 46 LEU N N 46 123.201 123.201 120.447 2.754 18441
218 1 . 1 1 46 46 LEU HA H 46 4.066 4.066 3.795 0.271 18441
219 1 . 1 1 46 46 LEU CA C 46 58.120 58.120 58.040 0.080 18441
220 1 . 1 1 46 46 LEU CB C 46 42.999 42.999 41.772 1.227 18441
221 1 . 1 1 46 46 LEU H H 46 9.018 9.018 8.474 0.544 18441
222 1 . 1 1 47 47 LYS N N 47 119.196 119.196 118.860 0.336 18441
223 1 . 1 1 47 47 LYS HA H 47 3.970 3.970 4.016 -0.046 18441
224 1 . 1 1 47 47 LYS CA C 47 60.290 60.290 59.613 0.677 18441
225 1 . 1 1 47 47 LYS CB C 47 33.141 33.141 32.177 0.964 18441
226 1 . 1 1 47 47 LYS H H 47 8.017 8.017 7.682 0.335 18441
227 1 . 1 1 48 48 LEU N N 48 116.358 116.358 119.652 -3.294 18441
228 1 . 1 1 48 48 LEU HA H 48 4.161 4.161 4.014 0.147 18441
229 1 . 1 1 48 48 LEU CA C 48 57.670 57.670 57.781 -0.111 18441
230 1 . 1 1 48 48 LEU CB C 48 42.160 42.160 42.260 -0.100 18441
231 1 . 1 1 48 48 LEU H H 48 7.143 7.143 7.574 -0.431 18441
232 1 . 1 1 49 49 VAL N N 49 112.662 112.662 114.876 -2.214 18441
233 1 . 1 1 49 49 VAL HA H 49 4.473 4.473 4.035 0.438 18441
234 1 . 1 1 49 49 VAL CA C 49 62.060 62.060 62.503 -0.443 18441
235 1 . 1 1 49 49 VAL CB C 49 35.166 35.166 32.635 2.531 18441
236 1 . 1 1 49 49 VAL H H 49 7.266 7.266 7.508 -0.242 18441
237 1 . 1 1 50 50 ILE N N 50 124.631 124.631 118.358 6.273 18441
238 1 . 1 1 50 50 ILE HA H 50 3.845 3.845 4.308 -0.463 18441
239 1 . 1 1 50 50 ILE CA C 50 61.590 61.590 60.583 1.007 18441
240 1 . 1 1 50 50 ILE CB C 50 35.161 35.161 38.621 -3.460 18441
241 1 . 1 1 50 50 ILE H H 50 8.475 8.475 7.614 0.861 18441
242 1 . 1 1 51 51 ASN N N 51 119.027 119.027 119.125 -0.098 18441
243 1 . 1 1 51 51 ASN HA H 51 4.707 4.707 4.588 0.119 18441
244 1 . 1 1 51 51 ASN CA C 51 53.448 53.448 53.491 -0.043 18441
245 1 . 1 1 51 51 ASN CB C 51 38.961 38.961 38.309 0.652 18441
246 1 . 1 1 51 51 ASN H H 51 7.347 7.347 8.075 -0.728 18441
247 1 . 1 1 52 52 GLU N N 52 115.889 115.889 118.209 -2.320 18441
248 1 . 1 1 52 52 GLU HA H 52 4.888 4.888 4.759 0.129 18441
249 1 . 1 1 52 52 GLU CA C 52 54.785 54.785 52.947 1.838 18441
250 1 . 1 1 52 52 GLU CB C 52 31.020 31.020 30.994 0.026 18441
251 1 . 1 1 52 52 GLU H H 52 7.438 7.438 7.522 -0.084 18441
252 1 . 1 1 53 53 PRO HA H 53 4.210 4.210 4.210 0.000 18441
253 1 . 1 1 53 53 PRO CA C 53 66.960 66.960 65.565 1.395 18441
254 1 . 1 1 53 53 PRO CB C 53 32.948 32.948 31.888 1.060 18441
255 1 . 1 1 54 54 SER N N 54 113.711 113.711 111.591 2.120 18441
256 1 . 1 1 54 54 SER HA H 54 4.173 4.173 4.329 -0.156 18441
257 1 . 1 1 54 54 SER CA C 54 61.650 61.650 60.450 1.200 18441
258 1 . 1 1 54 54 SER CB C 54 62.930 62.930 63.315 -0.385 18441
259 1 . 1 1 54 54 SER H H 54 8.946 8.946 8.222 0.724 18441
260 1 . 1 1 55 55 ARG N N 55 116.455 116.455 119.439 -2.984 18441
261 1 . 1 1 55 55 ARG HA H 55 4.404 4.404 4.371 0.033 18441
262 1 . 1 1 55 55 ARG CA C 55 57.310 57.310 56.910 0.400 18441
263 1 . 1 1 55 55 ARG CB C 55 33.612 33.612 30.422 3.190 18441
264 1 . 1 1 55 55 ARG H H 55 7.759 7.759 7.668 0.091 18441
265 1 . 1 1 56 56 LEU N N 56 121.468 121.468 123.230 -1.762 18441
266 1 . 1 1 56 56 LEU HA H 56 4.135 4.135 4.250 -0.115 18441
267 1 . 1 1 56 56 LEU CA C 56 59.900 59.900 59.995 -0.095 18441
268 1 . 1 1 56 56 LEU CB C 56 40.997 40.997 39.456 1.541 18441
269 1 . 1 1 56 56 LEU H H 56 7.472 7.472 8.405 -0.933 18441
270 1 . 1 1 57 57 PRO HA H 57 4.696 4.696 4.211 0.485 18441
271 1 . 1 1 57 57 PRO CA C 57 66.180 66.180 66.165 0.015 18441
272 1 . 1 1 57 57 PRO CB C 57 32.390 32.390 31.119 1.270 18441
273 1 . 1 1 58 58 LEU N N 58 119.923 119.923 117.725 2.198 18441
274 1 . 1 1 58 58 LEU HA H 58 4.050 4.050 4.126 -0.076 18441
275 1 . 1 1 58 58 LEU CA C 58 58.320 58.320 57.620 0.700 18441
276 1 . 1 1 58 58 LEU CB C 58 42.028 42.028 41.541 0.487 18441
277 1 . 1 1 58 58 LEU H H 58 8.734 8.734 7.624 1.110 18441
278 1 . 1 1 59 59 PHE N N 59 116.632 116.632 120.655 -4.023 18441
279 1 . 1 1 59 59 PHE HA H 59 4.479 4.479 4.279 0.200 18441
280 1 . 1 1 59 59 PHE CA C 59 63.080 63.080 61.172 1.908 18441
281 1 . 1 1 59 59 PHE CB C 59 38.852 38.852 38.975 -0.123 18441
282 1 . 1 1 59 59 PHE H H 59 8.312 8.312 8.710 -0.398 18441
283 1 . 1 1 60 60 ASP N N 60 120.603 120.603 118.516 2.087 18441
284 1 . 1 1 60 60 ASP HA H 60 4.671 4.671 4.450 0.221 18441
285 1 . 1 1 60 60 ASP CA C 60 57.870 57.870 56.680 1.190 18441
286 1 . 1 1 60 60 ASP CB C 60 41.541 41.541 40.844 0.697 18441
287 1 . 1 1 60 60 ASP H H 60 7.462 7.462 7.845 -0.383 18441
288 1 . 1 1 61 61 ALA N N 61 122.470 122.470 122.493 -0.023 18441
289 1 . 1 1 61 61 ALA HA H 61 4.261 4.261 3.971 0.290 18441
290 1 . 1 1 61 61 ALA CA C 61 54.546 54.546 54.457 0.089 18441
291 1 . 1 1 61 61 ALA CB C 61 18.880 18.880 18.697 0.183 18441
292 1 . 1 1 61 61 ALA H H 61 7.664 7.664 7.622 0.041 18441
293 1 . 1 1 62 62 ILE N N 62 115.525 115.525 118.010 -2.485 18441
294 1 . 1 1 62 62 ILE HA H 62 3.682 3.682 3.003 0.679 18441
295 1 . 1 1 62 62 ILE CA C 62 63.420 63.420 63.346 0.074 18441
296 1 . 1 1 62 62 ILE CB C 62 40.155 40.155 37.951 2.204 18441
297 1 . 1 1 62 62 ILE H H 62 7.653 7.653 7.586 0.067 18441
298 1 . 1 1 63 63 ARG N N 63 121.016 121.016 120.386 0.630 18441
299 1 . 1 1 63 63 ARG HA H 63 3.474 3.474 3.537 -0.063 18441
300 1 . 1 1 63 63 ARG CA C 63 62.370 62.370 61.466 0.904 18441
301 1 . 1 1 63 63 ARG H H 63 6.917 6.917 7.351 -0.434 18441
302 1 . 1 1 64 64 PRO HA H 64 4.311 4.311 4.133 0.178 18441
303 1 . 1 1 64 64 PRO CA C 64 65.740 65.740 65.465 0.275 18441
304 1 . 1 1 64 64 PRO CB C 64 32.187 32.187 31.042 1.145 18441
305 1 . 1 1 65 65 LEU N N 65 114.713 114.713 115.750 -1.037 18441
306 1 . 1 1 65 65 LEU HA H 65 3.920 3.920 4.052 -0.132 18441
307 1 . 1 1 65 65 LEU CA C 65 55.660 55.660 56.067 -0.407 18441
308 1 . 1 1 65 65 LEU CB C 65 42.108 42.108 41.818 0.290 18441
309 1 . 1 1 65 65 LEU H H 65 8.074 8.074 7.469 0.605 18441
310 1 . 1 1 66 66 ILE N N 66 120.129 120.129 118.768 1.361 18441
311 1 . 1 1 66 66 ILE HA H 66 4.305 4.305 4.032 0.273 18441
312 1 . 1 1 66 66 ILE CA C 66 56.760 56.760 61.535 -4.775 18441
313 1 . 1 1 66 66 ILE CB C 66 36.644 36.644 37.429 -0.785 18441
314 1 . 1 1 66 66 ILE H H 66 7.398 7.398 7.454 -0.056 18441
315 1 . 1 1 67 67 PRO HA H 67 4.305 4.305 4.336 -0.031 18441
316 1 . 1 1 67 67 PRO CA C 67 63.640 63.640 62.634 1.006 18441
317 1 . 1 1 67 67 PRO CB C 67 33.289 33.289 32.376 0.913 18441
318 1 . 1 1 68 68 LEU N N 68 124.673 124.673 122.867 1.806 18441
319 1 . 1 1 68 68 LEU HA H 68 3.850 3.850 3.960 -0.110 18441
320 1 . 1 1 68 68 LEU CA C 68 59.620 59.620 59.339 0.281 18441
321 1 . 1 1 68 68 LEU CB C 68 42.467 42.467 41.725 0.742 18441
322 1 . 1 1 68 68 LEU H H 68 8.471 8.471 8.370 0.101 18441
323 1 . 1 1 69 69 LYS N N 69 115.247 115.247 118.357 -3.110 18441
324 1 . 1 1 69 69 LYS HA H 69 4.169 4.169 4.040 0.129 18441
325 1 . 1 1 69 69 LYS CA C 69 59.020 59.020 59.311 -0.291 18441
326 1 . 1 1 69 69 LYS CB C 69 32.506 32.506 31.633 0.873 18441
327 1 . 1 1 69 69 LYS H H 69 8.536 8.536 8.484 0.052 18441
328 1 . 1 1 70 70 HIS N N 70 118.849 118.849 117.683 1.166 18441
329 1 . 1 1 70 70 HIS HA H 70 5.225 5.225 4.385 0.840 18441
330 1 . 1 1 70 70 HIS CA C 70 54.889 54.889 58.407 -3.518 18441
331 1 . 1 1 70 70 HIS CB C 70 35.038 35.038 29.613 5.425 18441
332 1 . 1 1 70 70 HIS H H 70 8.060 8.060 8.388 -0.328 18441
333 1 . 1 1 71 71 GLN N N 71 122.130 122.130 119.584 2.546 18441
334 1 . 1 1 71 71 GLN HA H 71 3.699 3.699 4.050 -0.351 18441
335 1 . 1 1 71 71 GLN CA C 71 61.690 61.690 59.432 2.258 18441
336 1 . 1 1 71 71 GLN CB C 71 29.250 29.250 28.676 0.574 18441
337 1 . 1 1 71 71 GLN H H 71 7.732 7.732 8.461 -0.729 18441
338 1 . 1 1 72 72 VAL N N 72 119.182 119.182 119.897 -0.715 18441
339 1 . 1 1 72 72 VAL HA H 72 3.808 3.808 3.679 0.129 18441
340 1 . 1 1 72 72 VAL CA C 72 67.220 67.220 66.519 0.701 18441
341 1 . 1 1 72 72 VAL CB C 72 31.814 31.814 31.452 0.362 18441
342 1 . 1 1 72 72 VAL H H 72 8.203 8.203 7.822 0.381 18441
343 1 . 1 1 73 73 GLU N N 73 121.878 121.878 120.027 1.851 18441
344 1 . 1 1 73 73 GLU HA H 73 3.978 3.978 4.075 -0.097 18441
345 1 . 1 1 73 73 GLU CA C 73 60.100 60.100 59.273 0.827 18441
346 1 . 1 1 73 73 GLU CB C 73 30.660 30.660 29.609 1.051 18441
347 1 . 1 1 73 73 GLU H H 73 8.136 8.136 7.867 0.269 18441
348 1 . 1 1 74 74 TYR N N 74 119.780 119.780 120.919 -1.139 18441
349 1 . 1 1 74 74 TYR HA H 74 3.677 3.677 4.125 -0.448 18441
350 1 . 1 1 74 74 TYR CA C 74 63.310 63.310 61.618 1.692 18441
351 1 . 1 1 74 74 TYR CB C 74 40.020 40.020 38.426 1.594 18441
352 1 . 1 1 74 74 TYR H H 74 8.491 8.491 8.447 0.044 18441
353 1 . 1 1 75 75 ASP N N 75 120.231 120.231 118.720 1.511 18441
354 1 . 1 1 75 75 ASP HA H 75 4.143 4.143 4.422 -0.279 18441
355 1 . 1 1 75 75 ASP CA C 75 57.560 57.560 57.231 0.329 18441
356 1 . 1 1 75 75 ASP CB C 75 40.578 40.578 40.696 -0.118 18441
357 1 . 1 1 75 75 ASP H H 75 8.566 8.566 8.164 0.402 18441
358 1 . 1 1 76 76 GLN N N 76 118.324 118.324 117.939 0.385 18441
359 1 . 1 1 76 76 GLN HA H 76 4.056 4.056 4.074 -0.018 18441
360 1 . 1 1 76 76 GLN CA C 76 58.430 58.430 58.340 0.090 18441
361 1 . 1 1 76 76 GLN CB C 76 29.430 29.430 29.008 0.422 18441
362 1 . 1 1 76 76 GLN H H 76 7.844 7.844 7.767 0.077 18441
363 1 . 1 1 77 77 LEU N N 77 117.932 117.932 117.083 0.849 18441
364 1 . 1 1 77 77 LEU HA H 77 4.197 4.197 4.232 -0.035 18441
365 1 . 1 1 77 77 LEU CA C 77 55.910 55.910 56.046 -0.136 18441
366 1 . 1 1 77 77 LEU CB C 77 45.404 45.404 42.521 2.883 18441
367 1 . 1 1 77 77 LEU H H 77 7.665 7.665 7.558 0.107 18441
368 1 . 1 1 78 78 THR N N 78 110.323 110.323 112.098 -1.775 18441
369 1 . 1 1 78 78 THR HA H 78 3.709 3.709 4.272 -0.563 18441
370 1 . 1 1 78 78 THR CA C 78 59.750 59.750 61.841 -2.091 18441
371 1 . 1 1 78 78 THR CB C 78 69.110 69.110 68.683 0.427 18441
372 1 . 1 1 78 78 THR H H 78 7.130 7.130 7.609 -0.479 18441
373 1 . 1 1 79 79 PRO HA H 79 4.246 4.246 4.419 -0.173 18441
374 1 . 1 1 79 79 PRO CA C 79 63.680 63.680 63.125 0.555 18441
375 1 . 1 1 79 79 PRO CB C 79 32.391 32.391 32.011 0.380 18441
stop_
save_