data_19799
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19799
_Entry.PDB_ID 2MKX
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 19799
_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 THR N N 2 113.079 113.079 115.970 -2.891 19799
2 1 1 . 1 1 2 2 THR HA H 2 4.349 4.349 4.487 -0.138 19799
3 1 1 . 1 1 2 2 THR C C 2 174.385 174.385 172.449 1.936 19799
4 1 1 . 1 1 2 2 THR CA C 2 61.412 61.412 61.863 -0.451 19799
5 1 1 . 1 1 2 2 THR CB C 2 70.028 70.028 70.349 -0.321 19799
6 1 1 . 1 1 2 2 THR H H 2 8.033 8.033 8.025 0.008 19799
7 1 1 . 1 1 3 3 ASN N N 3 121.005 121.005 121.481 -0.476 19799
8 1 1 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.727 0.070 19799
9 1 1 . 1 1 3 3 ASN C C 3 174.634 174.634 174.197 0.437 19799
10 1 1 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.940 -0.436 19799
11 1 1 . 1 1 3 3 ASN CB C 3 39.620 39.620 41.188 -1.568 19799
12 1 1 . 1 1 3 3 ASN H H 3 8.403 8.403 8.436 -0.033 19799
13 1 1 . 1 1 4 4 THR N N 4 117.293 117.293 120.231 -2.938 19799
14 1 1 . 1 1 4 4 THR HA H 4 4.349 4.349 4.402 -0.053 19799
15 1 1 . 1 1 4 4 THR C C 4 172.910 172.910 173.290 -0.380 19799
16 1 1 . 1 1 4 4 THR CA C 4 62.524 62.524 61.391 1.133 19799
17 1 1 . 1 1 4 4 THR CB C 4 69.624 69.624 68.231 1.393 19799
18 1 1 . 1 1 4 4 THR H H 4 8.264 8.264 8.179 0.085 19799
19 1 1 . 1 1 5 5 TYR N N 5 125.362 125.362 125.222 0.140 19799
20 1 1 . 1 1 5 5 TYR HA H 5 5.537 5.537 4.771 0.766 19799
21 1 1 . 1 1 5 5 TYR C C 5 174.901 174.901 174.415 0.486 19799
22 1 1 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.432 1.409 19799
23 1 1 . 1 1 5 5 TYR CB C 5 41.944 41.944 38.255 3.689 19799
24 1 1 . 1 1 5 5 TYR H H 5 8.887 8.887 7.427 1.460 19799
25 1 1 . 1 1 6 6 TYR N N 6 123.590 123.590 125.884 -2.294 19799
26 1 1 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.931 -0.343 19799
27 1 1 . 1 1 6 6 TYR C C 6 173.568 173.568 174.172 -0.604 19799
28 1 1 . 1 1 6 6 TYR CA C 6 57.479 57.479 55.876 1.603 19799
29 1 1 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.157 2.006 19799
30 1 1 . 1 1 6 6 TYR H H 6 9.338 9.338 9.257 0.081 19799
31 1 1 . 1 1 7 7 THR N N 7 124.727 124.727 119.789 4.938 19799
32 1 1 . 1 1 7 7 THR HA H 7 4.701 4.701 4.610 0.091 19799
33 1 1 . 1 1 7 7 THR C C 7 172.279 172.279 174.308 -2.029 19799
34 1 1 . 1 1 7 7 THR CA C 7 61.635 61.635 60.598 1.037 19799
35 1 1 . 1 1 7 7 THR CB C 7 68.780 68.780 69.201 -0.422 19799
36 1 1 . 1 1 7 7 THR H H 7 7.482 7.482 8.155 -0.673 19799
37 1 1 . 1 1 8 8 VAL N N 8 126.420 126.420 127.126 -0.706 19799
38 1 1 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.634 0.106 19799
39 1 1 . 1 1 8 8 VAL C C 8 176.689 176.689 175.419 1.270 19799
40 1 1 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.170 0.520 19799
41 1 1 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.085 0.852 19799
42 1 1 . 1 1 8 8 VAL H H 8 8.660 8.660 8.619 0.041 19799
43 1 1 . 1 1 9 9 LYS N N 9 130.614 130.614 129.108 1.506 19799
44 1 1 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.629 0.041 19799
45 1 1 . 1 1 9 9 LYS C C 9 176.438 176.438 175.477 0.961 19799
46 1 1 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.373 0.042 19799
47 1 1 . 1 1 9 9 LYS CB C 9 35.596 35.596 35.143 0.453 19799
48 1 1 . 1 1 9 9 LYS H H 9 9.297 9.297 8.672 0.625 19799
49 1 1 . 1 1 10 10 SER N N 10 116.022 116.022 115.866 0.156 19799
50 1 1 . 1 1 10 10 SER HA H 10 4.050 4.050 4.285 -0.235 19799
51 1 1 . 1 1 10 10 SER C C 10 175.932 175.932 174.784 1.148 19799
52 1 1 . 1 1 10 10 SER CA C 10 60.451 60.451 60.608 -0.157 19799
53 1 1 . 1 1 10 10 SER CB C 10 62.680 62.680 63.317 -0.637 19799
54 1 1 . 1 1 10 10 SER H H 10 8.766 8.766 8.490 0.276 19799
55 1 1 . 1 1 11 11 GLY N N 11 116.079 116.079 114.166 1.913 19799
56 1 1 . 1 1 11 11 GLY C C 11 174.938 174.938 174.322 0.616 19799
57 1 1 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.867 0.223 19799
58 1 1 . 1 1 11 11 GLY H H 11 9.067 9.067 8.465 0.602 19799
59 1 1 . 1 1 12 12 ASP N N 12 120.579 120.579 118.736 1.843 19799
60 1 1 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.417 0.196 19799
61 1 1 . 1 1 12 12 ASP C C 12 176.265 176.265 175.799 0.466 19799
62 1 1 . 1 1 12 12 ASP CA C 12 56.030 56.030 55.066 0.964 19799
63 1 1 . 1 1 12 12 ASP CB C 12 41.845 41.845 39.980 1.865 19799
64 1 1 . 1 1 12 12 ASP H H 12 7.963 7.963 8.655 -0.692 19799
65 1 1 . 1 1 13 13 THR N N 13 106.911 106.911 113.831 -6.920 19799
66 1 1 . 1 1 13 13 THR HA H 13 4.657 4.657 4.630 0.027 19799
67 1 1 . 1 1 13 13 THR C C 13 174.774 174.774 174.539 0.235 19799
68 1 1 . 1 1 13 13 THR CA C 13 58.612 58.612 60.209 -1.597 19799
69 1 1 . 1 1 13 13 THR CB C 13 72.416 72.416 72.241 0.175 19799
70 1 1 . 1 1 13 13 THR H H 13 6.809 6.809 7.369 -0.560 19799
71 1 1 . 1 1 14 14 LEU N N 14 122.612 122.612 126.774 -4.162 19799
72 1 1 . 1 1 14 14 LEU HA H 14 3.900 3.900 4.059 -0.159 19799
73 1 1 . 1 1 14 14 LEU C C 14 178.071 178.071 177.406 0.665 19799
74 1 1 . 1 1 14 14 LEU CA C 14 58.460 58.460 58.585 -0.125 19799
75 1 1 . 1 1 14 14 LEU CB C 14 41.774 41.774 42.101 -0.327 19799
76 1 1 . 1 1 14 14 LEU H H 14 9.478 9.478 8.625 0.853 19799
77 1 1 . 1 1 15 15 ASN N N 15 114.945 114.945 115.851 -0.906 19799
78 1 1 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.378 -0.235 19799
79 1 1 . 1 1 15 15 ASN C C 15 177.943 177.943 177.444 0.499 19799
80 1 1 . 1 1 15 15 ASN CA C 15 56.545 56.545 55.673 0.872 19799
81 1 1 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.396 0.750 19799
82 1 1 . 1 1 15 15 ASN H H 15 8.471 8.471 8.282 0.189 19799
83 1 1 . 1 1 16 16 LYS N N 16 121.113 121.113 120.812 0.301 19799
84 1 1 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.070 -0.037 19799
85 1 1 . 1 1 16 16 LYS C C 16 179.167 179.167 178.978 0.189 19799
86 1 1 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.247 0.455 19799
87 1 1 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.639 0.853 19799
88 1 1 . 1 1 16 16 LYS H H 16 7.725 7.725 7.589 0.136 19799
89 1 1 . 1 1 17 17 ILE N N 17 121.712 121.712 116.348 5.364 19799
90 1 1 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.723 -0.213 19799
91 1 1 . 1 1 17 17 ILE C C 17 177.445 177.445 177.051 0.394 19799
92 1 1 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.136 1.046 19799
93 1 1 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.456 1.182 19799
94 1 1 . 1 1 17 17 ILE H H 17 7.933 7.933 8.024 -0.091 19799
95 1 1 . 1 1 18 18 ALA N N 18 121.562 121.562 123.027 -1.465 19799
96 1 1 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.580 0.262 19799
97 1 1 . 1 1 18 18 ALA C C 18 179.665 179.665 178.752 0.913 19799
98 1 1 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.058 0.422 19799
99 1 1 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.109 -0.076 19799
100 1 1 . 1 1 18 18 ALA H H 18 8.401 8.401 8.269 0.132 19799
101 1 1 . 1 1 19 19 ALA N N 19 117.623 117.623 118.729 -1.106 19799
102 1 1 . 1 1 19 19 ALA HA H 19 4.166 4.166 3.985 0.181 19799
103 1 1 . 1 1 19 19 ALA C C 19 180.714 180.714 179.117 1.597 19799
104 1 1 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.924 0.584 19799
105 1 1 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.317 -0.268 19799
106 1 1 . 1 1 19 19 ALA H H 19 7.500 7.500 7.521 -0.021 19799
107 1 1 . 1 1 20 20 GLN N N 20 118.679 118.679 118.472 0.207 19799
108 1 1 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.067 -0.211 19799
109 1 1 . 1 1 20 20 GLN C C 20 177.608 177.608 177.651 -0.043 19799
110 1 1 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.156 0.314 19799
111 1 1 . 1 1 20 20 GLN CB C 20 28.282 28.282 29.182 -0.900 19799
112 1 1 . 1 1 20 20 GLN H H 20 7.941 7.941 7.471 0.470 19799
113 1 1 . 1 1 21 21 TYR N N 21 113.907 113.907 112.631 1.276 19799
114 1 1 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.795 -0.429 19799
115 1 1 . 1 1 21 21 TYR C C 21 175.496 175.496 175.145 0.351 19799
116 1 1 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.596 4.440 19799
117 1 1 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.123 1.075 19799
118 1 1 . 1 1 21 21 TYR H H 21 7.669 7.669 7.224 0.445 19799
119 1 1 . 1 1 22 22 GLY N N 22 111.326 111.326 108.580 2.746 19799
120 1 1 . 1 1 22 22 GLY C C 22 174.783 174.783 173.648 1.135 19799
121 1 1 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.268 2.182 19799
122 1 1 . 1 1 22 22 GLY H H 22 7.949 7.949 7.502 0.447 19799
123 1 1 . 1 1 23 23 VAL N N 23 113.949 113.949 117.830 -3.881 19799
124 1 1 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.546 0.261 19799
125 1 1 . 1 1 23 23 VAL C C 23 173.768 173.768 173.857 -0.089 19799
126 1 1 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.410 -0.976 19799
127 1 1 . 1 1 23 23 VAL CB C 23 34.961 34.961 34.535 0.426 19799
128 1 1 . 1 1 23 23 VAL H H 23 8.040 8.040 8.126 -0.086 19799
129 1 1 . 1 1 24 24 SER N N 24 115.672 115.672 121.149 -5.477 19799
130 1 1 . 1 1 24 24 SER HA H 24 4.655 4.655 4.534 0.121 19799
131 1 1 . 1 1 24 24 SER C C 24 176.015 176.015 175.970 0.045 19799
132 1 1 . 1 1 24 24 SER CA C 24 56.111 56.111 57.320 -1.209 19799
133 1 1 . 1 1 24 24 SER CB C 24 65.385 65.385 64.326 1.059 19799
134 1 1 . 1 1 24 24 SER H H 24 8.269 8.269 8.210 0.059 19799
135 1 1 . 1 1 25 25 VAL N N 25 122.227 122.227 125.607 -3.380 19799
136 1 1 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.687 -0.310 19799
137 1 1 . 1 1 25 25 VAL C C 25 177.775 177.775 177.060 0.715 19799
138 1 1 . 1 1 25 25 VAL CA C 25 67.140 67.140 65.963 1.177 19799
139 1 1 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.583 -0.213 19799
140 1 1 . 1 1 25 25 VAL H H 25 8.866 8.866 8.770 0.096 19799
141 1 1 . 1 1 26 26 ALA N N 26 120.890 120.890 122.359 -1.469 19799
142 1 1 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.912 0.002 19799
143 1 1 . 1 1 26 26 ALA C C 26 180.692 180.692 178.637 2.055 19799
144 1 1 . 1 1 26 26 ALA CA C 26 55.312 55.312 56.116 -0.804 19799
145 1 1 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.180 -0.355 19799
146 1 1 . 1 1 26 26 ALA H H 26 8.218 8.218 7.770 0.448 19799
147 1 1 . 1 1 27 27 ASN N N 27 118.099 118.099 116.971 1.128 19799
148 1 1 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.152 -0.449 19799
149 1 1 . 1 1 27 27 ASN C C 27 175.308 175.308 176.850 -1.542 19799
150 1 1 . 1 1 27 27 ASN CA C 27 55.220 55.220 54.903 0.317 19799
151 1 1 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.103 -0.239 19799
152 1 1 . 1 1 27 27 ASN H H 27 7.846 7.846 8.276 -0.430 19799
153 1 1 . 1 1 28 28 LEU N N 28 116.512 116.512 119.625 -3.113 19799
154 1 1 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.731 0.012 19799
155 1 1 . 1 1 28 28 LEU C C 28 181.142 181.142 178.513 2.629 19799
156 1 1 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.606 0.651 19799
157 1 1 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.809 0.276 19799
158 1 1 . 1 1 28 28 LEU H H 28 7.475 7.475 7.517 -0.042 19799
159 1 1 . 1 1 29 29 ARG N N 29 117.344 117.344 118.761 -1.417 19799
160 1 1 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.828 0.124 19799
161 1 1 . 1 1 29 29 ARG C C 29 178.818 178.818 178.468 0.350 19799
162 1 1 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.741 1.042 19799
163 1 1 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.943 0.117 19799
164 1 1 . 1 1 29 29 ARG H H 29 8.571 8.571 7.763 0.808 19799
165 1 1 . 1 1 30 30 SER N N 30 114.887 114.887 115.273 -0.386 19799
166 1 1 . 1 1 30 30 SER HA H 30 4.255 4.255 4.141 0.114 19799
167 1 1 . 1 1 30 30 SER C C 30 178.552 178.552 175.714 2.838 19799
168 1 1 . 1 1 30 30 SER CA C 30 61.314 61.314 61.293 0.021 19799
169 1 1 . 1 1 30 30 SER CB C 30 62.982 62.982 62.754 0.228 19799
170 1 1 . 1 1 30 30 SER H H 30 7.995 7.995 7.411 0.584 19799
171 1 1 . 1 1 31 31 TRP N N 31 119.302 119.302 117.836 1.466 19799
172 1 1 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.825 -0.040 19799
173 1 1 . 1 1 31 31 TRP C C 31 177.570 177.570 176.336 1.234 19799
174 1 1 . 1 1 31 31 TRP CA C 31 57.005 57.005 56.361 0.644 19799
175 1 1 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.798 1.130 19799
176 1 1 . 1 1 31 31 TRP H H 31 9.055 9.055 7.026 2.029 19799
177 1 1 . 1 1 32 32 ASN N N 32 109.665 109.665 117.432 -7.767 19799
178 1 1 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.871 0.233 19799
179 1 1 . 1 1 32 32 ASN C C 32 174.034 174.034 176.243 -2.209 19799
180 1 1 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.422 -0.872 19799
181 1 1 . 1 1 32 32 ASN CB C 32 42.065 42.065 40.821 1.244 19799
182 1 1 . 1 1 32 32 ASN H H 32 7.232 7.232 7.325 -0.093 19799
183 1 1 . 1 1 33 33 GLY N N 33 111.582 111.582 109.803 1.779 19799
184 1 1 . 1 1 33 33 GLY C C 33 174.930 174.930 173.854 1.076 19799
185 1 1 . 1 1 33 33 GLY CA C 33 47.611 47.611 45.741 1.870 19799
186 1 1 . 1 1 33 33 GLY H H 33 7.864 7.864 8.365 -0.501 19799
187 1 1 . 1 1 34 34 ILE N N 34 118.759 118.759 121.105 -2.346 19799
188 1 1 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.269 -0.053 19799
189 1 1 . 1 1 34 34 ILE C C 34 175.882 175.882 174.979 0.903 19799
190 1 1 . 1 1 34 34 ILE CA C 34 60.719 60.719 60.822 -0.103 19799
191 1 1 . 1 1 34 34 ILE CB C 34 40.553 40.553 39.568 0.985 19799
192 1 1 . 1 1 34 34 ILE H H 34 7.918 7.918 7.466 0.452 19799
193 1 1 . 1 1 35 35 SER N N 35 122.217 122.217 123.578 -1.361 19799
194 1 1 . 1 1 35 35 SER HA H 35 4.583 4.583 4.797 -0.214 19799
195 1 1 . 1 1 35 35 SER C C 35 174.848 174.848 174.309 0.539 19799
196 1 1 . 1 1 35 35 SER CA C 35 57.461 57.461 57.167 0.294 19799
197 1 1 . 1 1 35 35 SER CB C 35 63.929 63.929 63.365 0.564 19799
198 1 1 . 1 1 35 35 SER H H 35 8.801 8.801 8.883 -0.082 19799
199 1 1 . 1 1 36 36 GLY N N 36 114.644 114.644 114.316 0.328 19799
200 1 1 . 1 1 36 36 GLY C C 36 173.365 173.365 172.925 0.440 19799
201 1 1 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.668 1.420 19799
202 1 1 . 1 1 36 36 GLY H H 36 8.614 8.614 8.339 0.275 19799
203 1 1 . 1 1 37 37 ASP N N 37 122.530 122.530 120.170 2.360 19799
204 1 1 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.896 0.014 19799
205 1 1 . 1 1 37 37 ASP C C 37 175.986 175.986 176.737 -0.751 19799
206 1 1 . 1 1 37 37 ASP CA C 37 53.560 53.560 53.874 -0.314 19799
207 1 1 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.875 1.083 19799
208 1 1 . 1 1 37 37 ASP H H 37 8.537 8.537 8.633 -0.096 19799
209 1 1 . 1 1 38 38 LEU N N 38 121.818 121.818 119.010 2.808 19799
210 1 1 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.619 -0.290 19799
211 1 1 . 1 1 38 38 LEU C C 38 175.373 175.373 175.716 -0.343 19799
212 1 1 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.930 1.361 19799
213 1 1 . 1 1 38 38 LEU CB C 38 41.868 41.868 40.164 1.704 19799
214 1 1 . 1 1 38 38 LEU H H 38 7.602 7.602 7.825 -0.223 19799
215 1 1 . 1 1 39 39 ILE N N 39 118.291 118.291 122.466 -4.175 19799
216 1 1 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.278 0.620 19799
217 1 1 . 1 1 39 39 ILE C C 39 174.861 174.861 174.531 0.330 19799
218 1 1 . 1 1 39 39 ILE CA C 39 59.354 59.354 60.617 -1.262 19799
219 1 1 . 1 1 39 39 ILE CB C 39 42.014 42.014 41.224 0.790 19799
220 1 1 . 1 1 39 39 ILE H H 39 7.708 7.708 8.171 -0.463 19799
221 1 1 . 1 1 40 40 PHE N N 40 118.274 118.274 120.463 -2.189 19799
222 1 1 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.836 0.215 19799
223 1 1 . 1 1 40 40 PHE C C 40 174.537 174.537 173.268 1.269 19799
224 1 1 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.574 -0.136 19799
225 1 1 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.371 1.609 19799
226 1 1 . 1 1 40 40 PHE H H 40 8.195 8.195 7.690 0.505 19799
227 1 1 . 1 1 41 41 VAL N N 41 121.812 121.812 122.262 -0.450 19799
228 1 1 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.040 -0.820 19799
229 1 1 . 1 1 41 41 VAL C C 41 177.510 177.510 177.497 0.013 19799
230 1 1 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.129 1.518 19799
231 1 1 . 1 1 41 41 VAL CB C 41 31.030 31.030 30.889 0.141 19799
232 1 1 . 1 1 41 41 VAL H H 41 8.680 8.680 8.614 0.066 19799
233 1 1 . 1 1 42 42 GLY N N 42 116.069 116.069 115.744 0.325 19799
234 1 1 . 1 1 42 42 GLY C C 42 173.772 173.772 173.689 0.083 19799
235 1 1 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.648 0.014 19799
236 1 1 . 1 1 42 42 GLY H H 42 8.815 8.815 8.586 0.229 19799
237 1 1 . 1 1 43 43 GLN N N 43 124.343 124.343 121.352 2.991 19799
238 1 1 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.978 -0.119 19799
239 1 1 . 1 1 43 43 GLN C C 43 174.324 174.324 174.860 -0.536 19799
240 1 1 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.962 0.893 19799
241 1 1 . 1 1 43 43 GLN CB C 43 29.033 29.033 29.174 -0.141 19799
242 1 1 . 1 1 43 43 GLN H H 43 8.038 8.038 7.545 0.493 19799
243 1 1 . 1 1 44 44 LYS N N 44 126.564 126.564 127.076 -0.512 19799
244 1 1 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.456 0.397 19799
245 1 1 . 1 1 44 44 LYS C C 44 176.019 176.019 175.900 0.119 19799
246 1 1 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.724 -0.183 19799
247 1 1 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.011 0.997 19799
248 1 1 . 1 1 44 44 LYS H H 44 8.633 8.633 8.360 0.273 19799
249 1 1 . 1 1 45 45 LEU N N 45 126.114 126.114 125.557 0.557 19799
250 1 1 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.170 -0.451 19799
251 1 1 . 1 1 45 45 LEU C C 45 176.670 176.670 175.791 0.879 19799
252 1 1 . 1 1 45 45 LEU CA C 45 53.094 53.094 53.111 -0.017 19799
253 1 1 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.760 0.342 19799
254 1 1 . 1 1 45 45 LEU H H 45 9.458 9.458 8.937 0.521 19799
255 1 1 . 1 1 46 46 ILE N N 46 123.782 123.782 123.709 0.073 19799
256 1 1 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.491 -0.633 19799
257 1 1 . 1 1 46 46 ILE C C 46 176.810 176.810 174.928 1.882 19799
258 1 1 . 1 1 46 46 ILE CA C 46 62.646 62.646 61.930 0.716 19799
259 1 1 . 1 1 46 46 ILE CB C 46 39.156 39.156 38.207 0.949 19799
260 1 1 . 1 1 46 46 ILE H H 46 10.038 10.038 9.120 0.918 19799
261 1 1 . 1 1 47 47 VAL N N 47 117.819 117.819 126.307 -8.488 19799
262 1 1 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.457 0.050 19799
263 1 1 . 1 1 47 47 VAL C C 47 173.753 173.753 173.072 0.681 19799
264 1 1 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.454 0.177 19799
265 1 1 . 1 1 47 47 VAL CB C 47 32.918 32.918 35.042 -2.124 19799
266 1 1 . 1 1 47 47 VAL H H 47 8.268 8.268 8.537 -0.269 19799
267 1 1 . 1 1 48 48 LYS N N 48 118.041 118.041 127.024 -8.983 19799
268 1 1 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.436 -0.408 19799
269 1 1 . 1 1 48 48 LYS C C 48 174.214 174.214 175.015 -0.801 19799
270 1 1 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.601 2.712 19799
271 1 1 . 1 1 48 48 LYS CB C 48 35.472 35.472 33.499 1.973 19799
272 1 1 . 1 1 48 48 LYS H H 48 6.778 6.778 7.368 -0.590 19799
273 1 1 . 1 1 49 49 LYS N N 49 124.877 124.877 124.700 0.177 19799
274 1 1 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.693 -0.510 19799
275 1 1 . 1 1 49 49 LYS C C 49 176.704 176.704 176.624 0.080 19799
276 1 1 . 1 1 49 49 LYS CA C 49 54.753 54.753 55.695 -0.942 19799
277 1 1 . 1 1 49 49 LYS CB C 49 33.181 33.181 33.116 0.065 19799
278 1 1 . 1 1 49 49 LYS H H 49 7.204 7.204 8.453 -1.249 19799
279 1 1 . 1 1 50 50 GLY N N 50 112.262 112.262 110.795 1.467 19799
280 1 1 . 1 1 50 50 GLY C C 50 173.665 173.665 173.895 -0.230 19799
281 1 1 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.135 0.003 19799
282 1 1 . 1 1 50 50 GLY H H 50 8.363 8.363 8.821 -0.458 19799
283 1 2 . 1 1 2 2 THR N N 2 113.079 113.079 117.892 -4.813 19799
284 1 2 . 1 1 2 2 THR HA H 2 4.349 4.349 4.433 -0.084 19799
285 1 2 . 1 1 2 2 THR C C 2 174.385 174.385 173.391 0.994 19799
286 1 2 . 1 1 2 2 THR CA C 2 61.412 61.412 61.764 -0.352 19799
287 1 2 . 1 1 2 2 THR CB C 2 70.028 70.028 69.839 0.189 19799
288 1 2 . 1 1 2 2 THR H H 2 8.033 8.033 8.342 -0.309 19799
289 1 2 . 1 1 3 3 ASN N N 3 121.005 121.005 119.423 1.582 19799
290 1 2 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.619 0.178 19799
291 1 2 . 1 1 3 3 ASN C C 3 174.634 174.634 173.194 1.440 19799
292 1 2 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.420 0.084 19799
293 1 2 . 1 1 3 3 ASN CB C 3 39.620 39.620 40.461 -0.841 19799
294 1 2 . 1 1 3 3 ASN H H 3 8.403 8.403 8.313 0.090 19799
295 1 2 . 1 1 4 4 THR N N 4 117.293 117.293 118.648 -1.355 19799
296 1 2 . 1 1 4 4 THR HA H 4 4.349 4.349 4.420 -0.071 19799
297 1 2 . 1 1 4 4 THR C C 4 172.910 172.910 172.782 0.128 19799
298 1 2 . 1 1 4 4 THR CA C 4 62.524 62.524 60.992 1.532 19799
299 1 2 . 1 1 4 4 THR CB C 4 69.624 69.624 71.496 -1.872 19799
300 1 2 . 1 1 4 4 THR H H 4 8.264 8.264 7.830 0.434 19799
301 1 2 . 1 1 5 5 TYR N N 5 125.362 125.362 119.987 5.375 19799
302 1 2 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.062 0.475 19799
303 1 2 . 1 1 5 5 TYR C C 5 174.901 174.901 173.649 1.252 19799
304 1 2 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.248 1.593 19799
305 1 2 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.002 0.942 19799
306 1 2 . 1 1 5 5 TYR H H 5 8.887 8.887 7.698 1.189 19799
307 1 2 . 1 1 6 6 TYR N N 6 123.590 123.590 123.164 0.426 19799
308 1 2 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.921 -0.333 19799
309 1 2 . 1 1 6 6 TYR C C 6 173.568 173.568 174.343 -0.775 19799
310 1 2 . 1 1 6 6 TYR CA C 6 57.479 57.479 55.890 1.589 19799
311 1 2 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.017 2.146 19799
312 1 2 . 1 1 6 6 TYR H H 6 9.338 9.338 9.263 0.075 19799
313 1 2 . 1 1 7 7 THR N N 7 124.727 124.727 120.246 4.481 19799
314 1 2 . 1 1 7 7 THR HA H 7 4.701 4.701 4.472 0.229 19799
315 1 2 . 1 1 7 7 THR C C 7 172.279 172.279 173.861 -1.582 19799
316 1 2 . 1 1 7 7 THR CA C 7 61.635 61.635 60.843 0.792 19799
317 1 2 . 1 1 7 7 THR CB C 7 68.780 68.780 68.899 -0.119 19799
318 1 2 . 1 1 7 7 THR H H 7 7.482 7.482 8.297 -0.815 19799
319 1 2 . 1 1 8 8 VAL N N 8 126.420 126.420 127.309 -0.889 19799
320 1 2 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.785 -0.045 19799
321 1 2 . 1 1 8 8 VAL C C 8 176.689 176.689 175.462 1.227 19799
322 1 2 . 1 1 8 8 VAL CA C 8 64.690 64.690 63.949 0.741 19799
323 1 2 . 1 1 8 8 VAL CB C 8 31.937 31.937 30.973 0.964 19799
324 1 2 . 1 1 8 8 VAL H H 8 8.660 8.660 8.584 0.076 19799
325 1 2 . 1 1 9 9 LYS N N 9 130.614 130.614 128.637 1.977 19799
326 1 2 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.496 0.174 19799
327 1 2 . 1 1 9 9 LYS C C 9 176.438 176.438 177.461 -1.023 19799
328 1 2 . 1 1 9 9 LYS CA C 9 54.415 54.415 53.943 0.472 19799
329 1 2 . 1 1 9 9 LYS CB C 9 35.596 35.596 33.466 2.130 19799
330 1 2 . 1 1 9 9 LYS H H 9 9.297 9.297 7.811 1.486 19799
331 1 2 . 1 1 10 10 SER N N 10 116.022 116.022 114.438 1.584 19799
332 1 2 . 1 1 10 10 SER HA H 10 4.050 4.050 4.182 -0.132 19799
333 1 2 . 1 1 10 10 SER C C 10 175.932 175.932 175.781 0.151 19799
334 1 2 . 1 1 10 10 SER CA C 10 60.451 60.451 61.009 -0.558 19799
335 1 2 . 1 1 10 10 SER CB C 10 62.680 62.680 62.969 -0.289 19799
336 1 2 . 1 1 10 10 SER H H 10 8.766 8.766 8.622 0.144 19799
337 1 2 . 1 1 11 11 GLY N N 11 116.079 116.079 107.970 8.109 19799
338 1 2 . 1 1 11 11 GLY C C 11 174.938 174.938 173.479 1.459 19799
339 1 2 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.495 0.595 19799
340 1 2 . 1 1 11 11 GLY H H 11 9.067 9.067 8.410 0.657 19799
341 1 2 . 1 1 12 12 ASP N N 12 120.579 120.579 117.163 3.416 19799
342 1 2 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.543 0.070 19799
343 1 2 . 1 1 12 12 ASP C C 12 176.265 176.265 175.698 0.567 19799
344 1 2 . 1 1 12 12 ASP CA C 12 56.030 56.030 54.763 1.267 19799
345 1 2 . 1 1 12 12 ASP CB C 12 41.845 41.845 41.128 0.717 19799
346 1 2 . 1 1 12 12 ASP H H 12 7.963 7.963 7.783 0.180 19799
347 1 2 . 1 1 13 13 THR N N 13 106.911 106.911 112.596 -5.685 19799
348 1 2 . 1 1 13 13 THR HA H 13 4.657 4.657 4.606 0.051 19799
349 1 2 . 1 1 13 13 THR C C 13 174.774 174.774 174.216 0.558 19799
350 1 2 . 1 1 13 13 THR CA C 13 58.612 58.612 60.484 -1.872 19799
351 1 2 . 1 1 13 13 THR CB C 13 72.416 72.416 71.904 0.512 19799
352 1 2 . 1 1 13 13 THR H H 13 6.809 6.809 7.107 -0.298 19799
353 1 2 . 1 1 14 14 LEU N N 14 122.612 122.612 126.742 -4.130 19799
354 1 2 . 1 1 14 14 LEU HA H 14 3.900 3.900 4.078 -0.178 19799
355 1 2 . 1 1 14 14 LEU C C 14 178.071 178.071 177.421 0.650 19799
356 1 2 . 1 1 14 14 LEU CA C 14 58.460 58.460 58.681 -0.221 19799
357 1 2 . 1 1 14 14 LEU CB C 14 41.774 41.774 42.147 -0.373 19799
358 1 2 . 1 1 14 14 LEU H H 14 9.478 9.478 8.911 0.567 19799
359 1 2 . 1 1 15 15 ASN N N 15 114.945 114.945 114.437 0.508 19799
360 1 2 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.334 -0.191 19799
361 1 2 . 1 1 15 15 ASN C C 15 177.943 177.943 177.169 0.774 19799
362 1 2 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.092 0.453 19799
363 1 2 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.634 0.512 19799
364 1 2 . 1 1 15 15 ASN H H 15 8.471 8.471 8.897 -0.426 19799
365 1 2 . 1 1 16 16 LYS N N 16 121.113 121.113 120.339 0.774 19799
366 1 2 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.032 0.001 19799
367 1 2 . 1 1 16 16 LYS C C 16 179.167 179.167 178.939 0.228 19799
368 1 2 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.102 0.600 19799
369 1 2 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.614 0.878 19799
370 1 2 . 1 1 16 16 LYS H H 16 7.725 7.725 7.589 0.136 19799
371 1 2 . 1 1 17 17 ILE N N 17 121.712 121.712 115.807 5.905 19799
372 1 2 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.620 -0.110 19799
373 1 2 . 1 1 17 17 ILE C C 17 177.445 177.445 177.094 0.351 19799
374 1 2 . 1 1 17 17 ILE CA C 17 65.182 65.182 63.953 1.229 19799
375 1 2 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.332 1.306 19799
376 1 2 . 1 1 17 17 ILE H H 17 7.933 7.933 7.803 0.130 19799
377 1 2 . 1 1 18 18 ALA N N 18 121.562 121.562 122.910 -1.348 19799
378 1 2 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.852 -0.010 19799
379 1 2 . 1 1 18 18 ALA C C 18 179.665 179.665 178.866 0.799 19799
380 1 2 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.140 0.340 19799
381 1 2 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.226 -0.192 19799
382 1 2 . 1 1 18 18 ALA H H 18 8.401 8.401 8.434 -0.033 19799
383 1 2 . 1 1 19 19 ALA N N 19 117.623 117.623 118.915 -1.292 19799
384 1 2 . 1 1 19 19 ALA HA H 19 4.166 4.166 3.997 0.169 19799
385 1 2 . 1 1 19 19 ALA C C 19 180.714 180.714 179.191 1.523 19799
386 1 2 . 1 1 19 19 ALA CA C 19 54.508 54.508 54.049 0.459 19799
387 1 2 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.171 -0.122 19799
388 1 2 . 1 1 19 19 ALA H H 19 7.500 7.500 7.490 0.010 19799
389 1 2 . 1 1 20 20 GLN N N 20 118.679 118.679 118.316 0.363 19799
390 1 2 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.018 -0.162 19799
391 1 2 . 1 1 20 20 GLN C C 20 177.608 177.608 177.419 0.189 19799
392 1 2 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.050 0.420 19799
393 1 2 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.971 -0.689 19799
394 1 2 . 1 1 20 20 GLN H H 20 7.941 7.941 7.503 0.438 19799
395 1 2 . 1 1 21 21 TYR N N 21 113.907 113.907 113.297 0.610 19799
396 1 2 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.830 -0.464 19799
397 1 2 . 1 1 21 21 TYR C C 21 175.496 175.496 175.584 -0.088 19799
398 1 2 . 1 1 21 21 TYR CA C 21 60.036 60.036 56.136 3.900 19799
399 1 2 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.374 0.824 19799
400 1 2 . 1 1 21 21 TYR H H 21 7.669 7.669 7.083 0.586 19799
401 1 2 . 1 1 22 22 GLY N N 22 111.326 111.326 109.894 1.432 19799
402 1 2 . 1 1 22 22 GLY C C 22 174.783 174.783 173.208 1.575 19799
403 1 2 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.380 2.070 19799
404 1 2 . 1 1 22 22 GLY H H 22 7.949 7.949 7.724 0.225 19799
405 1 2 . 1 1 23 23 VAL N N 23 113.949 113.949 118.614 -4.665 19799
406 1 2 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.520 0.287 19799
407 1 2 . 1 1 23 23 VAL C C 23 173.768 173.768 174.121 -0.353 19799
408 1 2 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.636 -1.202 19799
409 1 2 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.093 -0.132 19799
410 1 2 . 1 1 23 23 VAL H H 23 8.040 8.040 8.197 -0.157 19799
411 1 2 . 1 1 24 24 SER N N 24 115.672 115.672 121.077 -5.405 19799
412 1 2 . 1 1 24 24 SER HA H 24 4.655 4.655 4.524 0.131 19799
413 1 2 . 1 1 24 24 SER C C 24 176.015 176.015 176.091 -0.076 19799
414 1 2 . 1 1 24 24 SER CA C 24 56.111 56.111 57.691 -1.580 19799
415 1 2 . 1 1 24 24 SER CB C 24 65.385 65.385 64.343 1.042 19799
416 1 2 . 1 1 24 24 SER H H 24 8.269 8.269 8.198 0.071 19799
417 1 2 . 1 1 25 25 VAL N N 25 122.227 122.227 126.024 -3.797 19799
418 1 2 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.679 -0.302 19799
419 1 2 . 1 1 25 25 VAL C C 25 177.775 177.775 177.205 0.570 19799
420 1 2 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.425 0.715 19799
421 1 2 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.724 -0.354 19799
422 1 2 . 1 1 25 25 VAL H H 25 8.866 8.866 8.763 0.103 19799
423 1 2 . 1 1 26 26 ALA N N 26 120.890 120.890 121.863 -0.973 19799
424 1 2 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.893 0.021 19799
425 1 2 . 1 1 26 26 ALA C C 26 180.692 180.692 178.764 1.928 19799
426 1 2 . 1 1 26 26 ALA CA C 26 55.312 55.312 56.204 -0.892 19799
427 1 2 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.289 -0.464 19799
428 1 2 . 1 1 26 26 ALA H H 26 8.218 8.218 7.664 0.554 19799
429 1 2 . 1 1 27 27 ASN N N 27 118.099 118.099 116.415 1.684 19799
430 1 2 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.220 -0.517 19799
431 1 2 . 1 1 27 27 ASN C C 27 175.308 175.308 176.920 -1.612 19799
432 1 2 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.205 0.015 19799
433 1 2 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.152 -0.288 19799
434 1 2 . 1 1 27 27 ASN H H 27 7.846 7.846 7.851 -0.005 19799
435 1 2 . 1 1 28 28 LEU N N 28 116.512 116.512 119.594 -3.082 19799
436 1 2 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.970 -0.227 19799
437 1 2 . 1 1 28 28 LEU C C 28 181.142 181.142 178.196 2.946 19799
438 1 2 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.685 0.572 19799
439 1 2 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.972 0.113 19799
440 1 2 . 1 1 28 28 LEU H H 28 7.475 7.475 7.469 0.006 19799
441 1 2 . 1 1 29 29 ARG N N 29 117.344 117.344 117.082 0.262 19799
442 1 2 . 1 1 29 29 ARG HA H 29 3.952 3.952 4.088 -0.136 19799
443 1 2 . 1 1 29 29 ARG C C 29 178.818 178.818 178.270 0.548 19799
444 1 2 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.136 1.647 19799
445 1 2 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.912 0.148 19799
446 1 2 . 1 1 29 29 ARG H H 29 8.571 8.571 8.039 0.532 19799
447 1 2 . 1 1 30 30 SER N N 30 114.887 114.887 116.528 -1.641 19799
448 1 2 . 1 1 30 30 SER HA H 30 4.255 4.255 4.268 -0.013 19799
449 1 2 . 1 1 30 30 SER C C 30 178.552 178.552 176.055 2.497 19799
450 1 2 . 1 1 30 30 SER CA C 30 61.314 61.314 62.185 -0.871 19799
451 1 2 . 1 1 30 30 SER CB C 30 62.982 62.982 63.099 -0.117 19799
452 1 2 . 1 1 30 30 SER H H 30 7.995 7.995 7.565 0.430 19799
453 1 2 . 1 1 31 31 TRP N N 31 119.302 119.302 118.448 0.854 19799
454 1 2 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.703 0.082 19799
455 1 2 . 1 1 31 31 TRP C C 31 177.570 177.570 176.526 1.044 19799
456 1 2 . 1 1 31 31 TRP CA C 31 57.005 57.005 55.768 1.237 19799
457 1 2 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.384 1.544 19799
458 1 2 . 1 1 31 31 TRP H H 31 9.055 9.055 7.347 1.708 19799
459 1 2 . 1 1 32 32 ASN N N 32 109.665 109.665 117.202 -7.537 19799
460 1 2 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.854 0.250 19799
461 1 2 . 1 1 32 32 ASN C C 32 174.034 174.034 176.373 -2.339 19799
462 1 2 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.142 -0.592 19799
463 1 2 . 1 1 32 32 ASN CB C 32 42.065 42.065 39.860 2.205 19799
464 1 2 . 1 1 32 32 ASN H H 32 7.232 7.232 7.468 -0.236 19799
465 1 2 . 1 1 33 33 GLY N N 33 111.582 111.582 109.505 2.077 19799
466 1 2 . 1 1 33 33 GLY C C 33 174.930 174.930 173.961 0.969 19799
467 1 2 . 1 1 33 33 GLY CA C 33 47.611 47.611 45.782 1.829 19799
468 1 2 . 1 1 33 33 GLY H H 33 7.864 7.864 8.007 -0.142 19799
469 1 2 . 1 1 34 34 ILE N N 34 118.759 118.759 120.379 -1.620 19799
470 1 2 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.278 -0.062 19799
471 1 2 . 1 1 34 34 ILE C C 34 175.882 175.882 175.634 0.248 19799
472 1 2 . 1 1 34 34 ILE CA C 34 60.719 60.719 60.503 0.216 19799
473 1 2 . 1 1 34 34 ILE CB C 34 40.553 40.553 39.473 1.080 19799
474 1 2 . 1 1 34 34 ILE H H 34 7.918 7.918 7.656 0.262 19799
475 1 2 . 1 1 35 35 SER N N 35 122.217 122.217 124.072 -1.855 19799
476 1 2 . 1 1 35 35 SER HA H 35 4.583 4.583 4.610 -0.027 19799
477 1 2 . 1 1 35 35 SER C C 35 174.848 174.848 174.579 0.269 19799
478 1 2 . 1 1 35 35 SER CA C 35 57.461 57.461 58.421 -0.960 19799
479 1 2 . 1 1 35 35 SER CB C 35 63.929 63.929 63.400 0.529 19799
480 1 2 . 1 1 35 35 SER H H 35 8.801 8.801 8.812 -0.011 19799
481 1 2 . 1 1 36 36 GLY N N 36 114.644 114.644 114.289 0.355 19799
482 1 2 . 1 1 36 36 GLY C C 36 173.365 173.365 172.784 0.581 19799
483 1 2 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.522 1.566 19799
484 1 2 . 1 1 36 36 GLY H H 36 8.614 8.614 8.200 0.414 19799
485 1 2 . 1 1 37 37 ASP N N 37 122.530 122.530 119.195 3.335 19799
486 1 2 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.711 0.199 19799
487 1 2 . 1 1 37 37 ASP C C 37 175.986 175.986 175.597 0.389 19799
488 1 2 . 1 1 37 37 ASP CA C 37 53.560 53.560 53.354 0.206 19799
489 1 2 . 1 1 37 37 ASP CB C 37 41.958 41.958 39.514 2.444 19799
490 1 2 . 1 1 37 37 ASP H H 37 8.537 8.537 8.530 0.007 19799
491 1 2 . 1 1 38 38 LEU N N 38 121.818 121.818 118.651 3.167 19799
492 1 2 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.780 -0.451 19799
493 1 2 . 1 1 38 38 LEU C C 38 175.373 175.373 175.793 -0.420 19799
494 1 2 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.629 1.662 19799
495 1 2 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.871 -0.003 19799
496 1 2 . 1 1 38 38 LEU H H 38 7.602 7.602 7.631 -0.029 19799
497 1 2 . 1 1 39 39 ILE N N 39 118.291 118.291 124.017 -5.726 19799
498 1 2 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.503 0.395 19799
499 1 2 . 1 1 39 39 ILE C C 39 174.861 174.861 174.817 0.044 19799
500 1 2 . 1 1 39 39 ILE CA C 39 59.354 59.354 60.876 -1.522 19799
501 1 2 . 1 1 39 39 ILE CB C 39 42.014 42.014 41.422 0.592 19799
502 1 2 . 1 1 39 39 ILE H H 39 7.708 7.708 7.869 -0.161 19799
503 1 2 . 1 1 40 40 PHE N N 40 118.274 118.274 123.330 -5.056 19799
504 1 2 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.923 0.128 19799
505 1 2 . 1 1 40 40 PHE C C 40 174.537 174.537 173.578 0.959 19799
506 1 2 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.287 0.151 19799
507 1 2 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.425 1.555 19799
508 1 2 . 1 1 40 40 PHE H H 40 8.195 8.195 7.893 0.302 19799
509 1 2 . 1 1 41 41 VAL N N 41 121.812 121.812 121.873 -0.061 19799
510 1 2 . 1 1 41 41 VAL HA H 41 3.220 3.220 3.954 -0.734 19799
511 1 2 . 1 1 41 41 VAL C C 41 177.510 177.510 177.414 0.096 19799
512 1 2 . 1 1 41 41 VAL CA C 41 65.647 65.647 63.957 1.690 19799
513 1 2 . 1 1 41 41 VAL CB C 41 31.030 31.030 31.108 -0.078 19799
514 1 2 . 1 1 41 41 VAL H H 41 8.680 8.680 8.558 0.122 19799
515 1 2 . 1 1 42 42 GLY N N 42 116.069 116.069 115.408 0.661 19799
516 1 2 . 1 1 42 42 GLY C C 42 173.772 173.772 173.503 0.269 19799
517 1 2 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.660 0.002 19799
518 1 2 . 1 1 42 42 GLY H H 42 8.815 8.815 9.029 -0.214 19799
519 1 2 . 1 1 43 43 GLN N N 43 124.343 124.343 121.475 2.868 19799
520 1 2 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.846 0.013 19799
521 1 2 . 1 1 43 43 GLN C C 43 174.324 174.324 174.999 -0.675 19799
522 1 2 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.312 1.543 19799
523 1 2 . 1 1 43 43 GLN CB C 43 29.033 29.033 28.864 0.169 19799
524 1 2 . 1 1 43 43 GLN H H 43 8.038 8.038 7.347 0.691 19799
525 1 2 . 1 1 44 44 LYS N N 44 126.564 126.564 129.321 -2.757 19799
526 1 2 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.489 0.364 19799
527 1 2 . 1 1 44 44 LYS C C 44 176.019 176.019 175.515 0.504 19799
528 1 2 . 1 1 44 44 LYS CA C 44 55.541 55.541 56.188 -0.647 19799
529 1 2 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.386 0.622 19799
530 1 2 . 1 1 44 44 LYS H H 44 8.633 8.633 8.483 0.150 19799
531 1 2 . 1 1 45 45 LEU N N 45 126.114 126.114 125.891 0.223 19799
532 1 2 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.038 -0.319 19799
533 1 2 . 1 1 45 45 LEU C C 45 176.670 176.670 175.446 1.224 19799
534 1 2 . 1 1 45 45 LEU CA C 45 53.094 53.094 51.944 1.150 19799
535 1 2 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.336 0.766 19799
536 1 2 . 1 1 45 45 LEU H H 45 9.458 9.458 8.937 0.521 19799
537 1 2 . 1 1 46 46 ILE N N 46 123.782 123.782 123.513 0.269 19799
538 1 2 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.343 -0.485 19799
539 1 2 . 1 1 46 46 ILE C C 46 176.810 176.810 175.515 1.295 19799
540 1 2 . 1 1 46 46 ILE CA C 46 62.646 62.646 60.967 1.679 19799
541 1 2 . 1 1 46 46 ILE CB C 46 39.156 39.156 36.440 2.716 19799
542 1 2 . 1 1 46 46 ILE H H 46 10.038 10.038 9.409 0.629 19799
543 1 2 . 1 1 47 47 VAL N N 47 117.819 117.819 125.114 -7.295 19799
544 1 2 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.346 0.161 19799
545 1 2 . 1 1 47 47 VAL C C 47 173.753 173.753 173.060 0.693 19799
546 1 2 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.439 0.192 19799
547 1 2 . 1 1 47 47 VAL CB C 47 32.918 32.918 34.992 -2.074 19799
548 1 2 . 1 1 47 47 VAL H H 47 8.268 8.268 8.883 -0.615 19799
549 1 2 . 1 1 48 48 LYS N N 48 118.041 118.041 125.870 -7.829 19799
550 1 2 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.444 -0.416 19799
551 1 2 . 1 1 48 48 LYS C C 48 174.214 174.214 174.756 -0.542 19799
552 1 2 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.651 2.662 19799
553 1 2 . 1 1 48 48 LYS CB C 48 35.472 35.472 33.886 1.586 19799
554 1 2 . 1 1 48 48 LYS H H 48 6.778 6.778 7.920 -1.142 19799
555 1 2 . 1 1 49 49 LYS N N 49 124.877 124.877 127.378 -2.501 19799
556 1 2 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.543 -0.360 19799
557 1 2 . 1 1 49 49 LYS C C 49 176.704 176.704 176.811 -0.107 19799
558 1 2 . 1 1 49 49 LYS CA C 49 54.753 54.753 56.021 -1.268 19799
559 1 2 . 1 1 49 49 LYS CB C 49 33.181 33.181 31.833 1.348 19799
560 1 2 . 1 1 49 49 LYS H H 49 7.204 7.204 8.518 -1.314 19799
561 1 2 . 1 1 50 50 GLY N N 50 112.262 112.262 114.774 -2.512 19799
562 1 2 . 1 1 50 50 GLY C C 50 173.665 173.665 173.941 -0.276 19799
563 1 2 . 1 1 50 50 GLY CA C 50 45.138 45.138 44.672 0.466 19799
564 1 2 . 1 1 50 50 GLY H H 50 8.363 8.363 8.677 -0.314 19799
565 1 3 . 1 1 2 2 THR N N 2 113.079 113.079 115.678 -2.599 19799
566 1 3 . 1 1 2 2 THR HA H 2 4.349 4.349 4.518 -0.169 19799
567 1 3 . 1 1 2 2 THR C C 2 174.385 174.385 171.976 2.409 19799
568 1 3 . 1 1 2 2 THR CA C 2 61.412 61.412 62.011 -0.599 19799
569 1 3 . 1 1 2 2 THR CB C 2 70.028 70.028 70.168 -0.141 19799
570 1 3 . 1 1 2 2 THR H H 2 8.033 8.033 8.051 -0.018 19799
571 1 3 . 1 1 3 3 ASN N N 3 121.005 121.005 122.584 -1.579 19799
572 1 3 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.637 0.160 19799
573 1 3 . 1 1 3 3 ASN C C 3 174.634 174.634 173.450 1.184 19799
574 1 3 . 1 1 3 3 ASN CA C 3 52.504 52.504 53.037 -0.533 19799
575 1 3 . 1 1 3 3 ASN CB C 3 39.620 39.620 40.856 -1.236 19799
576 1 3 . 1 1 3 3 ASN H H 3 8.403 8.403 8.112 0.291 19799
577 1 3 . 1 1 4 4 THR N N 4 117.293 117.293 116.089 1.204 19799
578 1 3 . 1 1 4 4 THR HA H 4 4.349 4.349 4.398 -0.049 19799
579 1 3 . 1 1 4 4 THR C C 4 172.910 172.910 172.463 0.447 19799
580 1 3 . 1 1 4 4 THR CA C 4 62.524 62.524 60.508 2.015 19799
581 1 3 . 1 1 4 4 THR CB C 4 69.624 69.624 71.998 -2.374 19799
582 1 3 . 1 1 4 4 THR H H 4 8.264 8.264 7.823 0.441 19799
583 1 3 . 1 1 5 5 TYR N N 5 125.362 125.362 119.272 6.090 19799
584 1 3 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.313 0.224 19799
585 1 3 . 1 1 5 5 TYR C C 5 174.901 174.901 173.991 0.910 19799
586 1 3 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.520 1.321 19799
587 1 3 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.003 0.941 19799
588 1 3 . 1 1 5 5 TYR H H 5 8.887 8.887 7.705 1.182 19799
589 1 3 . 1 1 6 6 TYR N N 6 123.590 123.590 124.267 -0.677 19799
590 1 3 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.907 -0.319 19799
591 1 3 . 1 1 6 6 TYR C C 6 173.568 173.568 174.603 -1.035 19799
592 1 3 . 1 1 6 6 TYR CA C 6 57.479 57.479 55.979 1.500 19799
593 1 3 . 1 1 6 6 TYR CB C 6 44.163 44.163 41.650 2.513 19799
594 1 3 . 1 1 6 6 TYR H H 6 9.338 9.338 9.356 -0.018 19799
595 1 3 . 1 1 7 7 THR N N 7 124.727 124.727 120.859 3.868 19799
596 1 3 . 1 1 7 7 THR HA H 7 4.701 4.701 4.333 0.368 19799
597 1 3 . 1 1 7 7 THR C C 7 172.279 172.279 174.415 -2.136 19799
598 1 3 . 1 1 7 7 THR CA C 7 61.635 61.635 61.835 -0.200 19799
599 1 3 . 1 1 7 7 THR CB C 7 68.780 68.780 68.318 0.462 19799
600 1 3 . 1 1 7 7 THR H H 7 7.482 7.482 8.377 -0.895 19799
601 1 3 . 1 1 8 8 VAL N N 8 126.420 126.420 127.192 -0.772 19799
602 1 3 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.752 -0.012 19799
603 1 3 . 1 1 8 8 VAL C C 8 176.689 176.689 175.562 1.127 19799
604 1 3 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.141 0.549 19799
605 1 3 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.384 0.553 19799
606 1 3 . 1 1 8 8 VAL H H 8 8.660 8.660 8.721 -0.061 19799
607 1 3 . 1 1 9 9 LYS N N 9 130.614 130.614 128.190 2.424 19799
608 1 3 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.388 0.282 19799
609 1 3 . 1 1 9 9 LYS C C 9 176.438 176.438 177.355 -0.917 19799
610 1 3 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.532 -0.117 19799
611 1 3 . 1 1 9 9 LYS CB C 9 35.596 35.596 33.769 1.827 19799
612 1 3 . 1 1 9 9 LYS H H 9 9.297 9.297 8.107 1.190 19799
613 1 3 . 1 1 10 10 SER N N 10 116.022 116.022 114.950 1.072 19799
614 1 3 . 1 1 10 10 SER HA H 10 4.050 4.050 4.206 -0.156 19799
615 1 3 . 1 1 10 10 SER C C 10 175.932 175.932 176.184 -0.252 19799
616 1 3 . 1 1 10 10 SER CA C 10 60.451 60.451 60.558 -0.107 19799
617 1 3 . 1 1 10 10 SER CB C 10 62.680 62.680 63.067 -0.387 19799
618 1 3 . 1 1 10 10 SER H H 10 8.766 8.766 8.557 0.209 19799
619 1 3 . 1 1 11 11 GLY N N 11 116.079 116.079 108.572 7.507 19799
620 1 3 . 1 1 11 11 GLY C C 11 174.938 174.938 173.798 1.140 19799
621 1 3 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.432 0.658 19799
622 1 3 . 1 1 11 11 GLY H H 11 9.067 9.067 8.561 0.506 19799
623 1 3 . 1 1 12 12 ASP N N 12 120.579 120.579 118.806 1.773 19799
624 1 3 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.495 0.118 19799
625 1 3 . 1 1 12 12 ASP C C 12 176.265 176.265 175.707 0.558 19799
626 1 3 . 1 1 12 12 ASP CA C 12 56.030 56.030 55.092 0.938 19799
627 1 3 . 1 1 12 12 ASP CB C 12 41.845 41.845 41.055 0.790 19799
628 1 3 . 1 1 12 12 ASP H H 12 7.963 7.963 8.347 -0.384 19799
629 1 3 . 1 1 13 13 THR N N 13 106.911 106.911 113.105 -6.194 19799
630 1 3 . 1 1 13 13 THR HA H 13 4.657 4.657 4.555 0.102 19799
631 1 3 . 1 1 13 13 THR C C 13 174.774 174.774 175.174 -0.400 19799
632 1 3 . 1 1 13 13 THR CA C 13 58.612 58.612 59.969 -1.357 19799
633 1 3 . 1 1 13 13 THR CB C 13 72.416 72.416 72.377 0.039 19799
634 1 3 . 1 1 13 13 THR H H 13 6.809 6.809 7.307 -0.498 19799
635 1 3 . 1 1 14 14 LEU N N 14 122.612 122.612 125.387 -2.775 19799
636 1 3 . 1 1 14 14 LEU HA H 14 3.900 3.900 4.018 -0.118 19799
637 1 3 . 1 1 14 14 LEU C C 14 178.071 178.071 178.571 -0.500 19799
638 1 3 . 1 1 14 14 LEU CA C 14 58.460 58.460 58.696 -0.236 19799
639 1 3 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.024 0.750 19799
640 1 3 . 1 1 14 14 LEU H H 14 9.478 9.478 8.340 1.138 19799
641 1 3 . 1 1 15 15 ASN N N 15 114.945 114.945 115.284 -0.339 19799
642 1 3 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.425 -0.282 19799
643 1 3 . 1 1 15 15 ASN C C 15 177.943 177.943 177.361 0.582 19799
644 1 3 . 1 1 15 15 ASN CA C 15 56.545 56.545 55.538 1.007 19799
645 1 3 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.214 0.932 19799
646 1 3 . 1 1 15 15 ASN H H 15 8.471 8.471 8.850 -0.379 19799
647 1 3 . 1 1 16 16 LYS N N 16 121.113 121.113 120.712 0.401 19799
648 1 3 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.059 -0.026 19799
649 1 3 . 1 1 16 16 LYS C C 16 179.167 179.167 178.841 0.326 19799
650 1 3 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.171 0.531 19799
651 1 3 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.622 0.870 19799
652 1 3 . 1 1 16 16 LYS H H 16 7.725 7.725 7.455 0.270 19799
653 1 3 . 1 1 17 17 ILE N N 17 121.712 121.712 115.926 5.786 19799
654 1 3 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.784 -0.274 19799
655 1 3 . 1 1 17 17 ILE C C 17 177.445 177.445 177.299 0.146 19799
656 1 3 . 1 1 17 17 ILE CA C 17 65.182 65.182 63.781 1.401 19799
657 1 3 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.548 1.090 19799
658 1 3 . 1 1 17 17 ILE H H 17 7.933 7.933 7.644 0.289 19799
659 1 3 . 1 1 18 18 ALA N N 18 121.562 121.562 122.648 -1.086 19799
660 1 3 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.895 -0.053 19799
661 1 3 . 1 1 18 18 ALA C C 18 179.665 179.665 178.901 0.764 19799
662 1 3 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.065 0.415 19799
663 1 3 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.242 -0.209 19799
664 1 3 . 1 1 18 18 ALA H H 18 8.401 8.401 8.160 0.241 19799
665 1 3 . 1 1 19 19 ALA N N 19 117.623 117.623 119.498 -1.875 19799
666 1 3 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.006 0.160 19799
667 1 3 . 1 1 19 19 ALA C C 19 180.714 180.714 179.050 1.664 19799
668 1 3 . 1 1 19 19 ALA CA C 19 54.508 54.508 54.017 0.491 19799
669 1 3 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.332 -0.283 19799
670 1 3 . 1 1 19 19 ALA H H 19 7.500 7.500 7.557 -0.057 19799
671 1 3 . 1 1 20 20 GLN N N 20 118.679 118.679 118.739 -0.060 19799
672 1 3 . 1 1 20 20 GLN HA H 20 3.856 3.856 3.981 -0.125 19799
673 1 3 . 1 1 20 20 GLN C C 20 177.608 177.608 177.455 0.153 19799
674 1 3 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.163 0.307 19799
675 1 3 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.844 -0.562 19799
676 1 3 . 1 1 20 20 GLN H H 20 7.941 7.941 7.398 0.543 19799
677 1 3 . 1 1 21 21 TYR N N 21 113.907 113.907 113.143 0.764 19799
678 1 3 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.855 -0.489 19799
679 1 3 . 1 1 21 21 TYR C C 21 175.496 175.496 175.451 0.045 19799
680 1 3 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.755 4.281 19799
681 1 3 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.071 1.127 19799
682 1 3 . 1 1 21 21 TYR H H 21 7.669 7.669 6.948 0.721 19799
683 1 3 . 1 1 22 22 GLY N N 22 111.326 111.326 109.125 2.201 19799
684 1 3 . 1 1 22 22 GLY C C 22 174.783 174.783 173.486 1.297 19799
685 1 3 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.591 1.859 19799
686 1 3 . 1 1 22 22 GLY H H 22 7.949 7.949 7.732 0.217 19799
687 1 3 . 1 1 23 23 VAL N N 23 113.949 113.949 118.969 -5.020 19799
688 1 3 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.489 0.318 19799
689 1 3 . 1 1 23 23 VAL C C 23 173.768 173.768 174.186 -0.418 19799
690 1 3 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.530 -1.096 19799
691 1 3 . 1 1 23 23 VAL CB C 23 34.961 34.961 36.104 -1.143 19799
692 1 3 . 1 1 23 23 VAL H H 23 8.040 8.040 8.094 -0.054 19799
693 1 3 . 1 1 24 24 SER N N 24 115.672 115.672 116.503 -0.831 19799
694 1 3 . 1 1 24 24 SER HA H 24 4.655 4.655 4.702 -0.047 19799
695 1 3 . 1 1 24 24 SER C C 24 176.015 176.015 175.783 0.232 19799
696 1 3 . 1 1 24 24 SER CA C 24 56.111 56.111 56.351 -0.240 19799
697 1 3 . 1 1 24 24 SER CB C 24 65.385 65.385 64.249 1.136 19799
698 1 3 . 1 1 24 24 SER H H 24 8.269 8.269 8.523 -0.254 19799
699 1 3 . 1 1 25 25 VAL N N 25 122.227 122.227 127.652 -5.425 19799
700 1 3 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.693 -0.316 19799
701 1 3 . 1 1 25 25 VAL C C 25 177.775 177.775 177.215 0.560 19799
702 1 3 . 1 1 25 25 VAL CA C 25 67.140 67.140 65.988 1.152 19799
703 1 3 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.594 -0.224 19799
704 1 3 . 1 1 25 25 VAL H H 25 8.866 8.866 8.867 -0.001 19799
705 1 3 . 1 1 26 26 ALA N N 26 120.890 120.890 122.460 -1.570 19799
706 1 3 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.836 0.078 19799
707 1 3 . 1 1 26 26 ALA C C 26 180.692 180.692 178.757 1.935 19799
708 1 3 . 1 1 26 26 ALA CA C 26 55.312 55.312 56.013 -0.701 19799
709 1 3 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.371 -0.546 19799
710 1 3 . 1 1 26 26 ALA H H 26 8.218 8.218 7.746 0.472 19799
711 1 3 . 1 1 27 27 ASN N N 27 118.099 118.099 116.373 1.726 19799
712 1 3 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.049 -0.346 19799
713 1 3 . 1 1 27 27 ASN C C 27 175.308 175.308 176.844 -1.536 19799
714 1 3 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.326 -0.106 19799
715 1 3 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.466 -0.602 19799
716 1 3 . 1 1 27 27 ASN H H 27 7.846 7.846 7.596 0.250 19799
717 1 3 . 1 1 28 28 LEU N N 28 116.512 116.512 117.718 -1.206 19799
718 1 3 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.806 -0.063 19799
719 1 3 . 1 1 28 28 LEU C C 28 181.142 181.142 179.028 2.114 19799
720 1 3 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.087 1.170 19799
721 1 3 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.244 0.841 19799
722 1 3 . 1 1 28 28 LEU H H 28 7.475 7.475 7.423 0.052 19799
723 1 3 . 1 1 29 29 ARG N N 29 117.344 117.344 119.484 -2.140 19799
724 1 3 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.923 0.029 19799
725 1 3 . 1 1 29 29 ARG C C 29 178.818 178.818 178.599 0.219 19799
726 1 3 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.678 1.105 19799
727 1 3 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.733 0.327 19799
728 1 3 . 1 1 29 29 ARG H H 29 8.571 8.571 8.144 0.427 19799
729 1 3 . 1 1 30 30 SER N N 30 114.887 114.887 114.790 0.097 19799
730 1 3 . 1 1 30 30 SER HA H 30 4.255 4.255 4.308 -0.053 19799
731 1 3 . 1 1 30 30 SER C C 30 178.552 178.552 176.206 2.346 19799
732 1 3 . 1 1 30 30 SER CA C 30 61.314 61.314 61.586 -0.272 19799
733 1 3 . 1 1 30 30 SER CB C 30 62.982 62.982 63.276 -0.294 19799
734 1 3 . 1 1 30 30 SER H H 30 7.995 7.995 7.605 0.390 19799
735 1 3 . 1 1 31 31 TRP N N 31 119.302 119.302 119.395 -0.093 19799
736 1 3 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.749 0.036 19799
737 1 3 . 1 1 31 31 TRP C C 31 177.570 177.570 177.059 0.511 19799
738 1 3 . 1 1 31 31 TRP CA C 31 57.005 57.005 56.059 0.946 19799
739 1 3 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.622 1.306 19799
740 1 3 . 1 1 31 31 TRP H H 31 9.055 9.055 7.447 1.608 19799
741 1 3 . 1 1 32 32 ASN N N 32 109.665 109.665 117.872 -8.207 19799
742 1 3 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.906 0.198 19799
743 1 3 . 1 1 32 32 ASN C C 32 174.034 174.034 175.649 -1.615 19799
744 1 3 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.540 -0.990 19799
745 1 3 . 1 1 32 32 ASN CB C 32 42.065 42.065 40.324 1.741 19799
746 1 3 . 1 1 32 32 ASN H H 32 7.232 7.232 7.759 -0.527 19799
747 1 3 . 1 1 33 33 GLY N N 33 111.582 111.582 109.165 2.417 19799
748 1 3 . 1 1 33 33 GLY C C 33 174.930 174.930 174.225 0.705 19799
749 1 3 . 1 1 33 33 GLY CA C 33 47.611 47.611 45.853 1.758 19799
750 1 3 . 1 1 33 33 GLY H H 33 7.864 7.864 7.458 0.406 19799
751 1 3 . 1 1 34 34 ILE N N 34 118.759 118.759 120.277 -1.518 19799
752 1 3 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.181 0.035 19799
753 1 3 . 1 1 34 34 ILE C C 34 175.882 175.882 175.352 0.530 19799
754 1 3 . 1 1 34 34 ILE CA C 34 60.719 60.719 61.312 -0.593 19799
755 1 3 . 1 1 34 34 ILE CB C 34 40.553 40.553 38.419 2.134 19799
756 1 3 . 1 1 34 34 ILE H H 34 7.918 7.918 8.083 -0.165 19799
757 1 3 . 1 1 35 35 SER N N 35 122.217 122.217 123.113 -0.896 19799
758 1 3 . 1 1 35 35 SER HA H 35 4.583 4.583 4.625 -0.041 19799
759 1 3 . 1 1 35 35 SER C C 35 174.848 174.848 174.633 0.215 19799
760 1 3 . 1 1 35 35 SER CA C 35 57.461 57.461 57.661 -0.200 19799
761 1 3 . 1 1 35 35 SER CB C 35 63.929 63.929 63.217 0.712 19799
762 1 3 . 1 1 35 35 SER H H 35 8.801 8.801 8.699 0.102 19799
763 1 3 . 1 1 36 36 GLY N N 36 114.644 114.644 116.657 -2.013 19799
764 1 3 . 1 1 36 36 GLY C C 36 173.365 173.365 172.699 0.666 19799
765 1 3 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.777 1.311 19799
766 1 3 . 1 1 36 36 GLY H H 36 8.614 8.614 8.472 0.142 19799
767 1 3 . 1 1 37 37 ASP N N 37 122.530 122.530 120.258 2.272 19799
768 1 3 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.815 0.095 19799
769 1 3 . 1 1 37 37 ASP C C 37 175.986 175.986 175.804 0.182 19799
770 1 3 . 1 1 37 37 ASP CA C 37 53.560 53.560 53.079 0.481 19799
771 1 3 . 1 1 37 37 ASP CB C 37 41.958 41.958 41.028 0.930 19799
772 1 3 . 1 1 37 37 ASP H H 37 8.537 8.537 8.553 -0.016 19799
773 1 3 . 1 1 38 38 LEU N N 38 121.818 121.818 120.330 1.488 19799
774 1 3 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.464 -0.135 19799
775 1 3 . 1 1 38 38 LEU C C 38 175.373 175.373 175.812 -0.439 19799
776 1 3 . 1 1 38 38 LEU CA C 38 56.291 56.291 55.660 0.631 19799
777 1 3 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.271 0.597 19799
778 1 3 . 1 1 38 38 LEU H H 38 7.602 7.602 7.667 -0.065 19799
779 1 3 . 1 1 39 39 ILE N N 39 118.291 118.291 126.003 -7.712 19799
780 1 3 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.251 0.647 19799
781 1 3 . 1 1 39 39 ILE C C 39 174.861 174.861 174.445 0.416 19799
782 1 3 . 1 1 39 39 ILE CA C 39 59.354 59.354 60.910 -1.556 19799
783 1 3 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.775 1.239 19799
784 1 3 . 1 1 39 39 ILE H H 39 7.708 7.708 7.818 -0.110 19799
785 1 3 . 1 1 40 40 PHE N N 40 118.274 118.274 122.394 -4.120 19799
786 1 3 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.882 0.169 19799
787 1 3 . 1 1 40 40 PHE C C 40 174.537 174.537 174.291 0.246 19799
788 1 3 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.727 -0.289 19799
789 1 3 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.968 1.012 19799
790 1 3 . 1 1 40 40 PHE H H 40 8.195 8.195 7.685 0.510 19799
791 1 3 . 1 1 41 41 VAL N N 41 121.812 121.812 122.155 -0.343 19799
792 1 3 . 1 1 41 41 VAL HA H 41 3.220 3.220 3.897 -0.677 19799
793 1 3 . 1 1 41 41 VAL C C 41 177.510 177.510 177.817 -0.307 19799
794 1 3 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.228 1.419 19799
795 1 3 . 1 1 41 41 VAL CB C 41 31.030 31.030 31.133 -0.102 19799
796 1 3 . 1 1 41 41 VAL H H 41 8.680 8.680 8.551 0.129 19799
797 1 3 . 1 1 42 42 GLY N N 42 116.069 116.069 115.518 0.551 19799
798 1 3 . 1 1 42 42 GLY C C 42 173.772 173.772 173.633 0.139 19799
799 1 3 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.793 -0.131 19799
800 1 3 . 1 1 42 42 GLY H H 42 8.815 8.815 8.457 0.358 19799
801 1 3 . 1 1 43 43 GLN N N 43 124.343 124.343 122.748 1.595 19799
802 1 3 . 1 1 43 43 GLN HA H 43 3.859 3.859 4.139 -0.280 19799
803 1 3 . 1 1 43 43 GLN C C 43 174.324 174.324 175.218 -0.894 19799
804 1 3 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.497 1.358 19799
805 1 3 . 1 1 43 43 GLN CB C 43 29.033 29.033 28.971 0.062 19799
806 1 3 . 1 1 43 43 GLN H H 43 8.038 8.038 7.511 0.527 19799
807 1 3 . 1 1 44 44 LYS N N 44 126.564 126.564 127.938 -1.374 19799
808 1 3 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.488 0.365 19799
809 1 3 . 1 1 44 44 LYS C C 44 176.019 176.019 175.941 0.078 19799
810 1 3 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.960 -0.419 19799
811 1 3 . 1 1 44 44 LYS CB C 44 33.008 33.008 31.972 1.036 19799
812 1 3 . 1 1 44 44 LYS H H 44 8.633 8.633 8.539 0.094 19799
813 1 3 . 1 1 45 45 LEU N N 45 126.114 126.114 123.047 3.067 19799
814 1 3 . 1 1 45 45 LEU HA H 45 4.719 4.719 4.978 -0.259 19799
815 1 3 . 1 1 45 45 LEU C C 45 176.670 176.670 176.653 0.017 19799
816 1 3 . 1 1 45 45 LEU CA C 45 53.094 53.094 53.245 -0.151 19799
817 1 3 . 1 1 45 45 LEU CB C 45 45.102 45.102 43.703 1.399 19799
818 1 3 . 1 1 45 45 LEU H H 45 9.458 9.458 8.790 0.668 19799
819 1 3 . 1 1 46 46 ILE N N 46 123.782 123.782 122.526 1.256 19799
820 1 3 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.389 -0.531 19799
821 1 3 . 1 1 46 46 ILE C C 46 176.810 176.810 175.653 1.157 19799
822 1 3 . 1 1 46 46 ILE CA C 46 62.646 62.646 61.247 1.399 19799
823 1 3 . 1 1 46 46 ILE CB C 46 39.156 39.156 36.465 2.691 19799
824 1 3 . 1 1 46 46 ILE H H 46 10.038 10.038 9.308 0.730 19799
825 1 3 . 1 1 47 47 VAL N N 47 117.819 117.819 126.326 -8.507 19799
826 1 3 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.531 -0.024 19799
827 1 3 . 1 1 47 47 VAL C C 47 173.753 173.753 173.032 0.721 19799
828 1 3 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.372 0.259 19799
829 1 3 . 1 1 47 47 VAL CB C 47 32.918 32.918 35.068 -2.150 19799
830 1 3 . 1 1 47 47 VAL H H 47 8.268 8.268 9.041 -0.773 19799
831 1 3 . 1 1 48 48 LYS N N 48 118.041 118.041 126.035 -7.994 19799
832 1 3 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.423 -0.395 19799
833 1 3 . 1 1 48 48 LYS C C 48 174.214 174.214 174.666 -0.452 19799
834 1 3 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.998 2.315 19799
835 1 3 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.369 1.103 19799
836 1 3 . 1 1 48 48 LYS H H 48 6.778 6.778 7.886 -1.108 19799
837 1 3 . 1 1 49 49 LYS N N 49 124.877 124.877 125.103 -0.226 19799
838 1 3 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.658 -0.475 19799
839 1 3 . 1 1 49 49 LYS C C 49 176.704 176.704 176.117 0.587 19799
840 1 3 . 1 1 49 49 LYS CA C 49 54.753 54.753 55.783 -1.030 19799
841 1 3 . 1 1 49 49 LYS CB C 49 33.181 33.181 33.453 -0.272 19799
842 1 3 . 1 1 49 49 LYS H H 49 7.204 7.204 8.654 -1.450 19799
843 1 3 . 1 1 50 50 GLY N N 50 112.262 112.262 113.965 -1.703 19799
844 1 3 . 1 1 50 50 GLY C C 50 173.665 173.665 174.793 -1.128 19799
845 1 3 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.138 -0.000 19799
846 1 3 . 1 1 50 50 GLY H H 50 8.363 8.363 8.712 -0.349 19799
847 1 4 . 1 1 2 2 THR N N 2 113.079 113.079 117.512 -4.433 19799
848 1 4 . 1 1 2 2 THR HA H 2 4.349 4.349 4.243 0.106 19799
849 1 4 . 1 1 2 2 THR C C 2 174.385 174.385 172.962 1.423 19799
850 1 4 . 1 1 2 2 THR CA C 2 61.412 61.412 61.696 -0.284 19799
851 1 4 . 1 1 2 2 THR CB C 2 70.028 70.028 68.642 1.386 19799
852 1 4 . 1 1 2 2 THR H H 2 8.033 8.033 8.197 -0.164 19799
853 1 4 . 1 1 3 3 ASN N N 3 121.005 121.005 122.856 -1.851 19799
854 1 4 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.770 0.027 19799
855 1 4 . 1 1 3 3 ASN C C 3 174.634 174.634 173.812 0.822 19799
856 1 4 . 1 1 3 3 ASN CA C 3 52.504 52.504 53.359 -0.855 19799
857 1 4 . 1 1 3 3 ASN CB C 3 39.620 39.620 41.050 -1.430 19799
858 1 4 . 1 1 3 3 ASN H H 3 8.403 8.403 7.950 0.453 19799
859 1 4 . 1 1 4 4 THR N N 4 117.293 117.293 119.271 -1.978 19799
860 1 4 . 1 1 4 4 THR HA H 4 4.349 4.349 4.466 -0.117 19799
861 1 4 . 1 1 4 4 THR C C 4 172.910 172.910 173.002 -0.092 19799
862 1 4 . 1 1 4 4 THR CA C 4 62.524 62.524 60.802 1.722 19799
863 1 4 . 1 1 4 4 THR CB C 4 69.624 69.624 70.838 -1.214 19799
864 1 4 . 1 1 4 4 THR H H 4 8.264 8.264 7.903 0.361 19799
865 1 4 . 1 1 5 5 TYR N N 5 125.362 125.362 120.038 5.324 19799
866 1 4 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.202 0.335 19799
867 1 4 . 1 1 5 5 TYR C C 5 174.901 174.901 173.752 1.149 19799
868 1 4 . 1 1 5 5 TYR CA C 5 56.841 56.841 54.896 1.945 19799
869 1 4 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.017 0.926 19799
870 1 4 . 1 1 5 5 TYR H H 5 8.887 8.887 7.867 1.020 19799
871 1 4 . 1 1 6 6 TYR N N 6 123.590 123.590 124.971 -1.381 19799
872 1 4 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.859 -0.271 19799
873 1 4 . 1 1 6 6 TYR C C 6 173.568 173.568 174.666 -1.098 19799
874 1 4 . 1 1 6 6 TYR CA C 6 57.479 57.479 55.861 1.618 19799
875 1 4 . 1 1 6 6 TYR CB C 6 44.163 44.163 40.906 3.257 19799
876 1 4 . 1 1 6 6 TYR H H 6 9.338 9.338 9.364 -0.026 19799
877 1 4 . 1 1 7 7 THR N N 7 124.727 124.727 121.457 3.270 19799
878 1 4 . 1 1 7 7 THR HA H 7 4.701 4.701 4.290 0.411 19799
879 1 4 . 1 1 7 7 THR C C 7 172.279 172.279 174.438 -2.159 19799
880 1 4 . 1 1 7 7 THR CA C 7 61.635 61.635 62.141 -0.506 19799
881 1 4 . 1 1 7 7 THR CB C 7 68.780 68.780 68.235 0.545 19799
882 1 4 . 1 1 7 7 THR H H 7 7.482 7.482 8.454 -0.972 19799
883 1 4 . 1 1 8 8 VAL N N 8 126.420 126.420 127.705 -1.285 19799
884 1 4 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.732 0.008 19799
885 1 4 . 1 1 8 8 VAL C C 8 176.689 176.689 175.740 0.949 19799
886 1 4 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.237 0.453 19799
887 1 4 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.150 0.787 19799
888 1 4 . 1 1 8 8 VAL H H 8 8.660 8.660 8.669 -0.009 19799
889 1 4 . 1 1 9 9 LYS N N 9 130.614 130.614 128.871 1.743 19799
890 1 4 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.407 0.263 19799
891 1 4 . 1 1 9 9 LYS C C 9 176.438 176.438 177.141 -0.703 19799
892 1 4 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.294 0.121 19799
893 1 4 . 1 1 9 9 LYS CB C 9 35.596 35.596 33.442 2.154 19799
894 1 4 . 1 1 9 9 LYS H H 9 9.297 9.297 7.646 1.651 19799
895 1 4 . 1 1 10 10 SER N N 10 116.022 116.022 115.042 0.980 19799
896 1 4 . 1 1 10 10 SER HA H 10 4.050 4.050 4.240 -0.190 19799
897 1 4 . 1 1 10 10 SER C C 10 175.932 175.932 176.063 -0.131 19799
898 1 4 . 1 1 10 10 SER CA C 10 60.451 60.451 60.541 -0.090 19799
899 1 4 . 1 1 10 10 SER CB C 10 62.680 62.680 62.951 -0.271 19799
900 1 4 . 1 1 10 10 SER H H 10 8.766 8.766 8.564 0.202 19799
901 1 4 . 1 1 11 11 GLY N N 11 116.079 116.079 109.271 6.808 19799
902 1 4 . 1 1 11 11 GLY C C 11 174.938 174.938 173.659 1.279 19799
903 1 4 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.627 0.463 19799
904 1 4 . 1 1 11 11 GLY H H 11 9.067 9.067 8.552 0.515 19799
905 1 4 . 1 1 12 12 ASP N N 12 120.579 120.579 117.451 3.128 19799
906 1 4 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.493 0.120 19799
907 1 4 . 1 1 12 12 ASP C C 12 176.265 176.265 175.862 0.403 19799
908 1 4 . 1 1 12 12 ASP CA C 12 56.030 56.030 55.265 0.765 19799
909 1 4 . 1 1 12 12 ASP CB C 12 41.845 41.845 41.224 0.621 19799
910 1 4 . 1 1 12 12 ASP H H 12 7.963 7.963 7.935 0.028 19799
911 1 4 . 1 1 13 13 THR N N 13 106.911 106.911 112.661 -5.750 19799
912 1 4 . 1 1 13 13 THR HA H 13 4.657 4.657 4.601 0.056 19799
913 1 4 . 1 1 13 13 THR C C 13 174.774 174.774 174.368 0.406 19799
914 1 4 . 1 1 13 13 THR CA C 13 58.612 58.612 60.013 -1.401 19799
915 1 4 . 1 1 13 13 THR CB C 13 72.416 72.416 72.099 0.317 19799
916 1 4 . 1 1 13 13 THR H H 13 6.809 6.809 7.311 -0.502 19799
917 1 4 . 1 1 14 14 LEU N N 14 122.612 122.612 125.259 -2.647 19799
918 1 4 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.946 -0.046 19799
919 1 4 . 1 1 14 14 LEU C C 14 178.071 178.071 178.384 -0.313 19799
920 1 4 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.353 -0.893 19799
921 1 4 . 1 1 14 14 LEU CB C 14 41.774 41.774 40.822 0.952 19799
922 1 4 . 1 1 14 14 LEU H H 14 9.478 9.478 8.894 0.584 19799
923 1 4 . 1 1 15 15 ASN N N 15 114.945 114.945 115.121 -0.176 19799
924 1 4 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.414 -0.271 19799
925 1 4 . 1 1 15 15 ASN C C 15 177.943 177.943 177.473 0.470 19799
926 1 4 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.067 0.478 19799
927 1 4 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.130 1.016 19799
928 1 4 . 1 1 15 15 ASN H H 15 8.471 8.471 8.858 -0.387 19799
929 1 4 . 1 1 16 16 LYS N N 16 121.113 121.113 121.407 -0.294 19799
930 1 4 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.091 -0.058 19799
931 1 4 . 1 1 16 16 LYS C C 16 179.167 179.167 178.888 0.279 19799
932 1 4 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.014 0.688 19799
933 1 4 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.605 0.888 19799
934 1 4 . 1 1 16 16 LYS H H 16 7.725 7.725 7.317 0.408 19799
935 1 4 . 1 1 17 17 ILE N N 17 121.712 121.712 115.830 5.882 19799
936 1 4 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.769 -0.259 19799
937 1 4 . 1 1 17 17 ILE C C 17 177.445 177.445 177.180 0.265 19799
938 1 4 . 1 1 17 17 ILE CA C 17 65.182 65.182 63.805 1.377 19799
939 1 4 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.544 1.094 19799
940 1 4 . 1 1 17 17 ILE H H 17 7.933 7.933 7.853 0.080 19799
941 1 4 . 1 1 18 18 ALA N N 18 121.562 121.562 122.736 -1.174 19799
942 1 4 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.760 0.082 19799
943 1 4 . 1 1 18 18 ALA C C 18 179.665 179.665 178.850 0.815 19799
944 1 4 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.045 0.435 19799
945 1 4 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.177 -0.144 19799
946 1 4 . 1 1 18 18 ALA H H 18 8.401 8.401 8.116 0.285 19799
947 1 4 . 1 1 19 19 ALA N N 19 117.623 117.623 119.062 -1.439 19799
948 1 4 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.020 0.146 19799
949 1 4 . 1 1 19 19 ALA C C 19 180.714 180.714 178.900 1.814 19799
950 1 4 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.898 0.610 19799
951 1 4 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.368 -0.319 19799
952 1 4 . 1 1 19 19 ALA H H 19 7.500 7.500 7.586 -0.086 19799
953 1 4 . 1 1 20 20 GLN N N 20 118.679 118.679 118.758 -0.079 19799
954 1 4 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.011 -0.155 19799
955 1 4 . 1 1 20 20 GLN C C 20 177.608 177.608 177.478 0.130 19799
956 1 4 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.146 0.324 19799
957 1 4 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.954 -0.672 19799
958 1 4 . 1 1 20 20 GLN H H 20 7.941 7.941 7.421 0.520 19799
959 1 4 . 1 1 21 21 TYR N N 21 113.907 113.907 113.155 0.752 19799
960 1 4 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.817 -0.451 19799
961 1 4 . 1 1 21 21 TYR C C 21 175.496 175.496 175.730 -0.234 19799
962 1 4 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.578 4.458 19799
963 1 4 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.269 0.929 19799
964 1 4 . 1 1 21 21 TYR H H 21 7.669 7.669 6.997 0.672 19799
965 1 4 . 1 1 22 22 GLY N N 22 111.326 111.326 109.574 1.752 19799
966 1 4 . 1 1 22 22 GLY C C 22 174.783 174.783 173.609 1.174 19799
967 1 4 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.368 2.082 19799
968 1 4 . 1 1 22 22 GLY H H 22 7.949 7.949 7.703 0.246 19799
969 1 4 . 1 1 23 23 VAL N N 23 113.949 113.949 117.675 -3.726 19799
970 1 4 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.578 0.229 19799
971 1 4 . 1 1 23 23 VAL C C 23 173.768 173.768 173.650 0.118 19799
972 1 4 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.669 -1.236 19799
973 1 4 . 1 1 23 23 VAL CB C 23 34.961 34.961 34.983 -0.022 19799
974 1 4 . 1 1 23 23 VAL H H 23 8.040 8.040 8.075 -0.035 19799
975 1 4 . 1 1 24 24 SER N N 24 115.672 115.672 117.718 -2.046 19799
976 1 4 . 1 1 24 24 SER HA H 24 4.655 4.655 4.648 0.007 19799
977 1 4 . 1 1 24 24 SER C C 24 176.015 176.015 175.629 0.386 19799
978 1 4 . 1 1 24 24 SER CA C 24 56.111 56.111 57.959 -1.849 19799
979 1 4 . 1 1 24 24 SER CB C 24 65.385 65.385 64.519 0.866 19799
980 1 4 . 1 1 24 24 SER H H 24 8.269 8.269 8.473 -0.204 19799
981 1 4 . 1 1 25 25 VAL N N 25 122.227 122.227 124.763 -2.536 19799
982 1 4 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.627 -0.250 19799
983 1 4 . 1 1 25 25 VAL C C 25 177.775 177.775 177.538 0.237 19799
984 1 4 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.652 0.488 19799
985 1 4 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.404 -0.034 19799
986 1 4 . 1 1 25 25 VAL H H 25 8.866 8.866 8.790 0.076 19799
987 1 4 . 1 1 26 26 ALA N N 26 120.890 120.890 121.959 -1.069 19799
988 1 4 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.933 -0.019 19799
989 1 4 . 1 1 26 26 ALA C C 26 180.692 180.692 178.950 1.742 19799
990 1 4 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.620 -0.308 19799
991 1 4 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.170 -0.345 19799
992 1 4 . 1 1 26 26 ALA H H 26 8.218 8.218 8.414 -0.196 19799
993 1 4 . 1 1 27 27 ASN N N 27 118.099 118.099 116.247 1.852 19799
994 1 4 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.112 -0.409 19799
995 1 4 . 1 1 27 27 ASN C C 27 175.308 175.308 176.666 -1.358 19799
996 1 4 . 1 1 27 27 ASN CA C 27 55.220 55.220 54.906 0.314 19799
997 1 4 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.150 -0.286 19799
998 1 4 . 1 1 27 27 ASN H H 27 7.846 7.846 7.591 0.255 19799
999 1 4 . 1 1 28 28 LEU N N 28 116.512 116.512 118.494 -1.982 19799
1000 1 4 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.550 0.193 19799
1001 1 4 . 1 1 28 28 LEU C C 28 181.142 181.142 178.787 2.355 19799
1002 1 4 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.179 1.078 19799
1003 1 4 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.176 0.909 19799
1004 1 4 . 1 1 28 28 LEU H H 28 7.475 7.475 7.436 0.039 19799
1005 1 4 . 1 1 29 29 ARG N N 29 117.344 117.344 119.489 -2.145 19799
1006 1 4 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.820 0.132 19799
1007 1 4 . 1 1 29 29 ARG C C 29 178.818 178.818 178.678 0.140 19799
1008 1 4 . 1 1 29 29 ARG CA C 29 60.783 60.783 60.170 0.613 19799
1009 1 4 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.890 0.171 19799
1010 1 4 . 1 1 29 29 ARG H H 29 8.571 8.571 8.268 0.303 19799
1011 1 4 . 1 1 30 30 SER N N 30 114.887 114.887 114.734 0.153 19799
1012 1 4 . 1 1 30 30 SER HA H 30 4.255 4.255 4.294 -0.039 19799
1013 1 4 . 1 1 30 30 SER C C 30 178.552 178.552 176.122 2.430 19799
1014 1 4 . 1 1 30 30 SER CA C 30 61.314 61.314 61.075 0.239 19799
1015 1 4 . 1 1 30 30 SER CB C 30 62.982 62.982 63.025 -0.043 19799
1016 1 4 . 1 1 30 30 SER H H 30 7.995 7.995 7.438 0.557 19799
1017 1 4 . 1 1 31 31 TRP N N 31 119.302 119.302 119.047 0.255 19799
1018 1 4 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.729 0.056 19799
1019 1 4 . 1 1 31 31 TRP C C 31 177.570 177.570 176.549 1.021 19799
1020 1 4 . 1 1 31 31 TRP CA C 31 57.005 57.005 56.242 0.763 19799
1021 1 4 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.484 1.444 19799
1022 1 4 . 1 1 31 31 TRP H H 31 9.055 9.055 7.283 1.772 19799
1023 1 4 . 1 1 32 32 ASN N N 32 109.665 109.665 117.762 -8.097 19799
1024 1 4 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.897 0.207 19799
1025 1 4 . 1 1 32 32 ASN C C 32 174.034 174.034 175.697 -1.663 19799
1026 1 4 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.498 -0.948 19799
1027 1 4 . 1 1 32 32 ASN CB C 32 42.065 42.065 40.214 1.851 19799
1028 1 4 . 1 1 32 32 ASN H H 32 7.232 7.232 7.525 -0.293 19799
1029 1 4 . 1 1 33 33 GLY N N 33 111.582 111.582 109.070 2.512 19799
1030 1 4 . 1 1 33 33 GLY C C 33 174.930 174.930 174.433 0.497 19799
1031 1 4 . 1 1 33 33 GLY CA C 33 47.611 47.611 45.992 1.619 19799
1032 1 4 . 1 1 33 33 GLY H H 33 7.864 7.864 7.443 0.421 19799
1033 1 4 . 1 1 34 34 ILE N N 34 118.759 118.759 120.219 -1.460 19799
1034 1 4 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.013 0.203 19799
1035 1 4 . 1 1 34 34 ILE C C 34 175.882 175.882 175.659 0.223 19799
1036 1 4 . 1 1 34 34 ILE CA C 34 60.719 60.719 61.658 -0.939 19799
1037 1 4 . 1 1 34 34 ILE CB C 34 40.553 40.553 38.049 2.504 19799
1038 1 4 . 1 1 34 34 ILE H H 34 7.918 7.918 7.701 0.217 19799
1039 1 4 . 1 1 35 35 SER N N 35 122.217 122.217 122.808 -0.591 19799
1040 1 4 . 1 1 35 35 SER HA H 35 4.583 4.583 4.546 0.037 19799
1041 1 4 . 1 1 35 35 SER C C 35 174.848 174.848 174.090 0.758 19799
1042 1 4 . 1 1 35 35 SER CA C 35 57.461 57.461 57.753 -0.292 19799
1043 1 4 . 1 1 35 35 SER CB C 35 63.929 63.929 63.488 0.441 19799
1044 1 4 . 1 1 35 35 SER H H 35 8.801 8.801 8.675 0.126 19799
1045 1 4 . 1 1 36 36 GLY N N 36 114.644 114.644 115.136 -0.492 19799
1046 1 4 . 1 1 36 36 GLY C C 36 173.365 173.365 172.952 0.413 19799
1047 1 4 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.487 1.601 19799
1048 1 4 . 1 1 36 36 GLY H H 36 8.614 8.614 8.278 0.336 19799
1049 1 4 . 1 1 37 37 ASP N N 37 122.530 122.530 121.335 1.195 19799
1050 1 4 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.846 0.064 19799
1051 1 4 . 1 1 37 37 ASP C C 37 175.986 175.986 175.419 0.567 19799
1052 1 4 . 1 1 37 37 ASP CA C 37 53.560 53.560 53.881 -0.321 19799
1053 1 4 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.830 1.128 19799
1054 1 4 . 1 1 37 37 ASP H H 37 8.537 8.537 8.423 0.114 19799
1055 1 4 . 1 1 38 38 LEU N N 38 121.818 121.818 119.555 2.263 19799
1056 1 4 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.813 -0.484 19799
1057 1 4 . 1 1 38 38 LEU C C 38 175.373 175.373 176.028 -0.655 19799
1058 1 4 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.644 1.647 19799
1059 1 4 . 1 1 38 38 LEU CB C 38 41.868 41.868 42.563 -0.695 19799
1060 1 4 . 1 1 38 38 LEU H H 38 7.602 7.602 7.545 0.057 19799
1061 1 4 . 1 1 39 39 ILE N N 39 118.291 118.291 125.653 -7.362 19799
1062 1 4 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.203 0.695 19799
1063 1 4 . 1 1 39 39 ILE C C 39 174.861 174.861 174.536 0.325 19799
1064 1 4 . 1 1 39 39 ILE CA C 39 59.354 59.354 61.145 -1.791 19799
1065 1 4 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.581 1.433 19799
1066 1 4 . 1 1 39 39 ILE H H 39 7.708 7.708 8.034 -0.326 19799
1067 1 4 . 1 1 40 40 PHE N N 40 118.274 118.274 123.476 -5.202 19799
1068 1 4 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.991 0.060 19799
1069 1 4 . 1 1 40 40 PHE C C 40 174.537 174.537 173.594 0.943 19799
1070 1 4 . 1 1 40 40 PHE CA C 40 55.438 55.438 54.916 0.522 19799
1071 1 4 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.367 1.613 19799
1072 1 4 . 1 1 40 40 PHE H H 40 8.195 8.195 7.556 0.639 19799
1073 1 4 . 1 1 41 41 VAL N N 41 121.812 121.812 121.861 -0.049 19799
1074 1 4 . 1 1 41 41 VAL HA H 41 3.220 3.220 3.995 -0.775 19799
1075 1 4 . 1 1 41 41 VAL C C 41 177.510 177.510 177.303 0.207 19799
1076 1 4 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.162 1.485 19799
1077 1 4 . 1 1 41 41 VAL CB C 41 31.030 31.030 31.354 -0.324 19799
1078 1 4 . 1 1 41 41 VAL H H 41 8.680 8.680 8.606 0.074 19799
1079 1 4 . 1 1 42 42 GLY N N 42 116.069 116.069 115.144 0.925 19799
1080 1 4 . 1 1 42 42 GLY C C 42 173.772 173.772 173.593 0.179 19799
1081 1 4 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.617 0.045 19799
1082 1 4 . 1 1 42 42 GLY H H 42 8.815 8.815 8.723 0.092 19799
1083 1 4 . 1 1 43 43 GLN N N 43 124.343 124.343 122.712 1.631 19799
1084 1 4 . 1 1 43 43 GLN HA H 43 3.859 3.859 4.149 -0.290 19799
1085 1 4 . 1 1 43 43 GLN C C 43 174.324 174.324 175.340 -1.016 19799
1086 1 4 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.554 1.301 19799
1087 1 4 . 1 1 43 43 GLN CB C 43 29.033 29.033 28.979 0.054 19799
1088 1 4 . 1 1 43 43 GLN H H 43 8.038 8.038 7.613 0.425 19799
1089 1 4 . 1 1 44 44 LYS N N 44 126.564 126.564 127.616 -1.052 19799
1090 1 4 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.321 0.532 19799
1091 1 4 . 1 1 44 44 LYS C C 44 176.019 176.019 175.862 0.157 19799
1092 1 4 . 1 1 44 44 LYS CA C 44 55.541 55.541 56.170 -0.629 19799
1093 1 4 . 1 1 44 44 LYS CB C 44 33.008 33.008 31.981 1.027 19799
1094 1 4 . 1 1 44 44 LYS H H 44 8.633 8.633 8.568 0.065 19799
1095 1 4 . 1 1 45 45 LEU N N 45 126.114 126.114 123.844 2.270 19799
1096 1 4 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.074 -0.355 19799
1097 1 4 . 1 1 45 45 LEU C C 45 176.670 176.670 176.497 0.173 19799
1098 1 4 . 1 1 45 45 LEU CA C 45 53.094 53.094 53.333 -0.239 19799
1099 1 4 . 1 1 45 45 LEU CB C 45 45.102 45.102 43.736 1.367 19799
1100 1 4 . 1 1 45 45 LEU H H 45 9.458 9.458 8.643 0.815 19799
1101 1 4 . 1 1 46 46 ILE N N 46 123.782 123.782 124.217 -0.435 19799
1102 1 4 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.282 -0.424 19799
1103 1 4 . 1 1 46 46 ILE C C 46 176.810 176.810 175.642 1.168 19799
1104 1 4 . 1 1 46 46 ILE CA C 46 62.646 62.646 62.483 0.163 19799
1105 1 4 . 1 1 46 46 ILE CB C 46 39.156 39.156 37.635 1.521 19799
1106 1 4 . 1 1 46 46 ILE H H 46 10.038 10.038 9.164 0.874 19799
1107 1 4 . 1 1 47 47 VAL N N 47 117.819 117.819 126.129 -8.310 19799
1108 1 4 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.484 0.023 19799
1109 1 4 . 1 1 47 47 VAL C C 47 173.753 173.753 173.003 0.750 19799
1110 1 4 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.341 0.290 19799
1111 1 4 . 1 1 47 47 VAL CB C 47 32.918 32.918 34.099 -1.181 19799
1112 1 4 . 1 1 47 47 VAL H H 47 8.268 8.268 8.803 -0.535 19799
1113 1 4 . 1 1 48 48 LYS N N 48 118.041 118.041 125.907 -7.866 19799
1114 1 4 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.355 -0.327 19799
1115 1 4 . 1 1 48 48 LYS C C 48 174.214 174.214 174.648 -0.434 19799
1116 1 4 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.412 2.901 19799
1117 1 4 . 1 1 48 48 LYS CB C 48 35.472 35.472 33.686 1.786 19799
1118 1 4 . 1 1 48 48 LYS H H 48 6.778 6.778 7.639 -0.861 19799
1119 1 4 . 1 1 49 49 LYS N N 49 124.877 124.877 126.003 -1.126 19799
1120 1 4 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.337 -0.154 19799
1121 1 4 . 1 1 49 49 LYS C C 49 176.704 176.704 176.454 0.250 19799
1122 1 4 . 1 1 49 49 LYS CA C 49 54.753 54.753 56.976 -2.223 19799
1123 1 4 . 1 1 49 49 LYS CB C 49 33.181 33.181 31.859 1.322 19799
1124 1 4 . 1 1 49 49 LYS H H 49 7.204 7.204 8.557 -1.353 19799
1125 1 4 . 1 1 50 50 GLY N N 50 112.262 112.262 114.825 -2.563 19799
1126 1 4 . 1 1 50 50 GLY C C 50 173.665 173.665 172.921 0.744 19799
1127 1 4 . 1 1 50 50 GLY CA C 50 45.138 45.138 44.962 0.176 19799
1128 1 4 . 1 1 50 50 GLY H H 50 8.363 8.363 8.410 -0.047 19799
1129 1 5 . 1 1 2 2 THR N N 2 113.079 113.079 114.679 -1.600 19799
1130 1 5 . 1 1 2 2 THR HA H 2 4.349 4.349 4.094 0.255 19799
1131 1 5 . 1 1 2 2 THR C C 2 174.385 174.385 174.392 -0.007 19799
1132 1 5 . 1 1 2 2 THR CA C 2 61.412 61.412 63.446 -2.034 19799
1133 1 5 . 1 1 2 2 THR CB C 2 70.028 70.028 69.101 0.927 19799
1134 1 5 . 1 1 2 2 THR H H 2 8.033 8.033 8.087 -0.054 19799
1135 1 5 . 1 1 3 3 ASN N N 3 121.005 121.005 118.356 2.649 19799
1136 1 5 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.617 0.180 19799
1137 1 5 . 1 1 3 3 ASN C C 3 174.634 174.634 174.142 0.492 19799
1138 1 5 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.286 0.218 19799
1139 1 5 . 1 1 3 3 ASN CB C 3 39.620 39.620 39.137 0.483 19799
1140 1 5 . 1 1 3 3 ASN H H 3 8.403 8.403 7.814 0.589 19799
1141 1 5 . 1 1 4 4 THR N N 4 117.293 117.293 116.498 0.795 19799
1142 1 5 . 1 1 4 4 THR HA H 4 4.349 4.349 4.342 0.007 19799
1143 1 5 . 1 1 4 4 THR C C 4 172.910 172.910 172.957 -0.047 19799
1144 1 5 . 1 1 4 4 THR CA C 4 62.524 62.524 61.313 1.211 19799
1145 1 5 . 1 1 4 4 THR CB C 4 69.624 69.624 71.527 -1.903 19799
1146 1 5 . 1 1 4 4 THR H H 4 8.264 8.264 7.772 0.492 19799
1147 1 5 . 1 1 5 5 TYR N N 5 125.362 125.362 120.195 5.167 19799
1148 1 5 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.201 0.336 19799
1149 1 5 . 1 1 5 5 TYR C C 5 174.901 174.901 173.831 1.070 19799
1150 1 5 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.342 1.499 19799
1151 1 5 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.563 0.381 19799
1152 1 5 . 1 1 5 5 TYR H H 5 8.887 8.887 7.703 1.184 19799
1153 1 5 . 1 1 6 6 TYR N N 6 123.590 123.590 121.518 2.072 19799
1154 1 5 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.985 -0.397 19799
1155 1 5 . 1 1 6 6 TYR C C 6 173.568 173.568 173.776 -0.208 19799
1156 1 5 . 1 1 6 6 TYR CA C 6 57.479 57.479 57.046 0.433 19799
1157 1 5 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.639 1.524 19799
1158 1 5 . 1 1 6 6 TYR H H 6 9.338 9.338 8.891 0.447 19799
1159 1 5 . 1 1 7 7 THR N N 7 124.727 124.727 118.957 5.770 19799
1160 1 5 . 1 1 7 7 THR HA H 7 4.701 4.701 4.756 -0.055 19799
1161 1 5 . 1 1 7 7 THR C C 7 172.279 172.279 174.526 -2.247 19799
1162 1 5 . 1 1 7 7 THR CA C 7 61.635 61.635 60.182 1.453 19799
1163 1 5 . 1 1 7 7 THR CB C 7 68.780 68.780 69.200 -0.420 19799
1164 1 5 . 1 1 7 7 THR H H 7 7.482 7.482 8.165 -0.683 19799
1165 1 5 . 1 1 8 8 VAL N N 8 126.420 126.420 127.766 -1.346 19799
1166 1 5 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.591 0.149 19799
1167 1 5 . 1 1 8 8 VAL C C 8 176.689 176.689 175.223 1.466 19799
1168 1 5 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.460 0.230 19799
1169 1 5 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.358 0.579 19799
1170 1 5 . 1 1 8 8 VAL H H 8 8.660 8.660 8.758 -0.098 19799
1171 1 5 . 1 1 9 9 LYS N N 9 130.614 130.614 129.155 1.459 19799
1172 1 5 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.421 0.249 19799
1173 1 5 . 1 1 9 9 LYS C C 9 176.438 176.438 177.054 -0.616 19799
1174 1 5 . 1 1 9 9 LYS CA C 9 54.415 54.415 55.088 -0.673 19799
1175 1 5 . 1 1 9 9 LYS CB C 9 35.596 35.596 33.296 2.300 19799
1176 1 5 . 1 1 9 9 LYS H H 9 9.297 9.297 8.243 1.054 19799
1177 1 5 . 1 1 10 10 SER N N 10 116.022 116.022 113.979 2.043 19799
1178 1 5 . 1 1 10 10 SER HA H 10 4.050 4.050 4.205 -0.155 19799
1179 1 5 . 1 1 10 10 SER C C 10 175.932 175.932 176.140 -0.208 19799
1180 1 5 . 1 1 10 10 SER CA C 10 60.451 60.451 60.998 -0.547 19799
1181 1 5 . 1 1 10 10 SER CB C 10 62.680 62.680 63.081 -0.401 19799
1182 1 5 . 1 1 10 10 SER H H 10 8.766 8.766 8.597 0.169 19799
1183 1 5 . 1 1 11 11 GLY N N 11 116.079 116.079 108.047 8.032 19799
1184 1 5 . 1 1 11 11 GLY C C 11 174.938 174.938 173.583 1.355 19799
1185 1 5 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.321 0.769 19799
1186 1 5 . 1 1 11 11 GLY H H 11 9.067 9.067 8.553 0.514 19799
1187 1 5 . 1 1 12 12 ASP N N 12 120.579 120.579 117.884 2.695 19799
1188 1 5 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.398 0.215 19799
1189 1 5 . 1 1 12 12 ASP C C 12 176.265 176.265 176.139 0.126 19799
1190 1 5 . 1 1 12 12 ASP CA C 12 56.030 56.030 55.041 0.989 19799
1191 1 5 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.462 1.383 19799
1192 1 5 . 1 1 12 12 ASP H H 12 7.963 7.963 8.168 -0.205 19799
1193 1 5 . 1 1 13 13 THR N N 13 106.911 106.911 113.327 -6.416 19799
1194 1 5 . 1 1 13 13 THR HA H 13 4.657 4.657 4.612 0.045 19799
1195 1 5 . 1 1 13 13 THR C C 13 174.774 174.774 174.628 0.146 19799
1196 1 5 . 1 1 13 13 THR CA C 13 58.612 58.612 59.564 -0.952 19799
1197 1 5 . 1 1 13 13 THR CB C 13 72.416 72.416 72.858 -0.442 19799
1198 1 5 . 1 1 13 13 THR H H 13 6.809 6.809 7.070 -0.261 19799
1199 1 5 . 1 1 14 14 LEU N N 14 122.612 122.612 125.909 -3.297 19799
1200 1 5 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.997 -0.097 19799
1201 1 5 . 1 1 14 14 LEU C C 14 178.071 178.071 177.572 0.499 19799
1202 1 5 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.120 -0.659 19799
1203 1 5 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.371 0.403 19799
1204 1 5 . 1 1 14 14 LEU H H 14 9.478 9.478 8.744 0.734 19799
1205 1 5 . 1 1 15 15 ASN N N 15 114.945 114.945 114.354 0.591 19799
1206 1 5 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.443 -0.300 19799
1207 1 5 . 1 1 15 15 ASN C C 15 177.943 177.943 177.519 0.424 19799
1208 1 5 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.068 0.477 19799
1209 1 5 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.058 1.088 19799
1210 1 5 . 1 1 15 15 ASN H H 15 8.471 8.471 8.901 -0.430 19799
1211 1 5 . 1 1 16 16 LYS N N 16 121.113 121.113 120.732 0.381 19799
1212 1 5 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.065 -0.032 19799
1213 1 5 . 1 1 16 16 LYS C C 16 179.167 179.167 178.823 0.344 19799
1214 1 5 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.414 0.288 19799
1215 1 5 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.579 0.913 19799
1216 1 5 . 1 1 16 16 LYS H H 16 7.725 7.725 7.439 0.286 19799
1217 1 5 . 1 1 17 17 ILE N N 17 121.712 121.712 116.065 5.647 19799
1218 1 5 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.645 -0.135 19799
1219 1 5 . 1 1 17 17 ILE C C 17 177.445 177.445 177.066 0.379 19799
1220 1 5 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.149 1.033 19799
1221 1 5 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.420 1.218 19799
1222 1 5 . 1 1 17 17 ILE H H 17 7.933 7.933 7.978 -0.045 19799
1223 1 5 . 1 1 18 18 ALA N N 18 121.562 121.562 122.745 -1.183 19799
1224 1 5 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.917 -0.075 19799
1225 1 5 . 1 1 18 18 ALA C C 18 179.665 179.665 178.941 0.724 19799
1226 1 5 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.169 0.311 19799
1227 1 5 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.245 -0.212 19799
1228 1 5 . 1 1 18 18 ALA H H 18 8.401 8.401 8.288 0.113 19799
1229 1 5 . 1 1 19 19 ALA N N 19 117.623 117.623 118.675 -1.052 19799
1230 1 5 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.092 0.074 19799
1231 1 5 . 1 1 19 19 ALA C C 19 180.714 180.714 179.220 1.494 19799
1232 1 5 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.843 0.665 19799
1233 1 5 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.434 -0.385 19799
1234 1 5 . 1 1 19 19 ALA H H 19 7.500 7.500 7.608 -0.108 19799
1235 1 5 . 1 1 20 20 GLN N N 20 118.679 118.679 118.686 -0.007 19799
1236 1 5 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.055 -0.199 19799
1237 1 5 . 1 1 20 20 GLN C C 20 177.608 177.608 177.713 -0.105 19799
1238 1 5 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.034 0.436 19799
1239 1 5 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.864 -0.583 19799
1240 1 5 . 1 1 20 20 GLN H H 20 7.941 7.941 7.542 0.399 19799
1241 1 5 . 1 1 21 21 TYR N N 21 113.907 113.907 112.604 1.303 19799
1242 1 5 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.889 -0.523 19799
1243 1 5 . 1 1 21 21 TYR C C 21 175.496 175.496 175.558 -0.062 19799
1244 1 5 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.555 4.481 19799
1245 1 5 . 1 1 21 21 TYR CB C 21 39.198 39.198 37.986 1.212 19799
1246 1 5 . 1 1 21 21 TYR H H 21 7.669 7.669 7.215 0.454 19799
1247 1 5 . 1 1 22 22 GLY N N 22 111.326 111.326 108.767 2.559 19799
1248 1 5 . 1 1 22 22 GLY C C 22 174.783 174.783 173.709 1.074 19799
1249 1 5 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.390 2.060 19799
1250 1 5 . 1 1 22 22 GLY H H 22 7.949 7.949 7.807 0.142 19799
1251 1 5 . 1 1 23 23 VAL N N 23 113.949 113.949 118.998 -5.049 19799
1252 1 5 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.623 0.184 19799
1253 1 5 . 1 1 23 23 VAL C C 23 173.768 173.768 174.317 -0.549 19799
1254 1 5 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.249 -0.816 19799
1255 1 5 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.761 -0.800 19799
1256 1 5 . 1 1 23 23 VAL H H 23 8.040 8.040 8.236 -0.196 19799
1257 1 5 . 1 1 24 24 SER N N 24 115.672 115.672 118.558 -2.886 19799
1258 1 5 . 1 1 24 24 SER HA H 24 4.655 4.655 4.562 0.093 19799
1259 1 5 . 1 1 24 24 SER C C 24 176.015 176.015 175.980 0.035 19799
1260 1 5 . 1 1 24 24 SER CA C 24 56.111 56.111 57.379 -1.268 19799
1261 1 5 . 1 1 24 24 SER CB C 24 65.385 65.385 64.159 1.226 19799
1262 1 5 . 1 1 24 24 SER H H 24 8.269 8.269 8.221 0.048 19799
1263 1 5 . 1 1 25 25 VAL N N 25 122.227 122.227 126.326 -4.099 19799
1264 1 5 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.699 -0.322 19799
1265 1 5 . 1 1 25 25 VAL C C 25 177.775 177.775 177.108 0.667 19799
1266 1 5 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.262 0.878 19799
1267 1 5 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.706 -0.336 19799
1268 1 5 . 1 1 25 25 VAL H H 25 8.866 8.866 8.810 0.056 19799
1269 1 5 . 1 1 26 26 ALA N N 26 120.890 120.890 121.979 -1.089 19799
1270 1 5 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.884 0.030 19799
1271 1 5 . 1 1 26 26 ALA C C 26 180.692 180.692 178.875 1.817 19799
1272 1 5 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.365 -0.053 19799
1273 1 5 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.323 -0.498 19799
1274 1 5 . 1 1 26 26 ALA H H 26 8.218 8.218 7.841 0.377 19799
1275 1 5 . 1 1 27 27 ASN N N 27 118.099 118.099 116.044 2.055 19799
1276 1 5 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.014 -0.311 19799
1277 1 5 . 1 1 27 27 ASN C C 27 175.308 175.308 176.765 -1.457 19799
1278 1 5 . 1 1 27 27 ASN CA C 27 55.220 55.220 54.768 0.452 19799
1279 1 5 . 1 1 27 27 ASN CB C 27 36.864 36.864 36.996 -0.132 19799
1280 1 5 . 1 1 27 27 ASN H H 27 7.846 7.846 7.775 0.071 19799
1281 1 5 . 1 1 28 28 LEU N N 28 116.512 116.512 119.635 -3.123 19799
1282 1 5 . 1 1 28 28 LEU HA H 28 3.743 3.743 4.014 -0.271 19799
1283 1 5 . 1 1 28 28 LEU C C 28 181.142 181.142 178.541 2.601 19799
1284 1 5 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.650 0.607 19799
1285 1 5 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.774 0.311 19799
1286 1 5 . 1 1 28 28 LEU H H 28 7.475 7.475 7.516 -0.041 19799
1287 1 5 . 1 1 29 29 ARG N N 29 117.344 117.344 118.572 -1.228 19799
1288 1 5 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.934 0.018 19799
1289 1 5 . 1 1 29 29 ARG C C 29 178.818 178.818 178.581 0.237 19799
1290 1 5 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.367 1.416 19799
1291 1 5 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.754 0.306 19799
1292 1 5 . 1 1 29 29 ARG H H 29 8.571 8.571 7.688 0.883 19799
1293 1 5 . 1 1 30 30 SER N N 30 114.887 114.887 115.191 -0.304 19799
1294 1 5 . 1 1 30 30 SER HA H 30 4.255 4.255 4.157 0.098 19799
1295 1 5 . 1 1 30 30 SER C C 30 178.552 178.552 175.590 2.962 19799
1296 1 5 . 1 1 30 30 SER CA C 30 61.314 61.314 60.819 0.494 19799
1297 1 5 . 1 1 30 30 SER CB C 30 62.982 62.982 62.999 -0.018 19799
1298 1 5 . 1 1 30 30 SER H H 30 7.995 7.995 7.473 0.522 19799
1299 1 5 . 1 1 31 31 TRP N N 31 119.302 119.302 117.944 1.358 19799
1300 1 5 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.820 -0.035 19799
1301 1 5 . 1 1 31 31 TRP C C 31 177.570 177.570 176.647 0.923 19799
1302 1 5 . 1 1 31 31 TRP CA C 31 57.005 57.005 55.647 1.359 19799
1303 1 5 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.948 0.980 19799
1304 1 5 . 1 1 31 31 TRP H H 31 9.055 9.055 7.007 2.048 19799
1305 1 5 . 1 1 32 32 ASN N N 32 109.665 109.665 117.424 -7.759 19799
1306 1 5 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.879 0.225 19799
1307 1 5 . 1 1 32 32 ASN C C 32 174.034 174.034 176.552 -2.518 19799
1308 1 5 . 1 1 32 32 ASN CA C 32 53.550 53.550 53.997 -0.447 19799
1309 1 5 . 1 1 32 32 ASN CB C 32 42.065 42.065 40.118 1.947 19799
1310 1 5 . 1 1 32 32 ASN H H 32 7.232 7.232 7.370 -0.138 19799
1311 1 5 . 1 1 33 33 GLY N N 33 111.582 111.582 110.160 1.422 19799
1312 1 5 . 1 1 33 33 GLY C C 33 174.930 174.930 174.158 0.772 19799
1313 1 5 . 1 1 33 33 GLY CA C 33 47.611 47.611 46.000 1.611 19799
1314 1 5 . 1 1 33 33 GLY H H 33 7.864 7.864 8.345 -0.481 19799
1315 1 5 . 1 1 34 34 ILE N N 34 118.759 118.759 120.657 -1.898 19799
1316 1 5 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.275 -0.059 19799
1317 1 5 . 1 1 34 34 ILE C C 34 175.882 175.882 175.442 0.440 19799
1318 1 5 . 1 1 34 34 ILE CA C 34 60.719 60.719 58.949 1.770 19799
1319 1 5 . 1 1 34 34 ILE CB C 34 40.553 40.553 39.399 1.154 19799
1320 1 5 . 1 1 34 34 ILE H H 34 7.918 7.918 7.439 0.479 19799
1321 1 5 . 1 1 35 35 SER N N 35 122.217 122.217 122.024 0.193 19799
1322 1 5 . 1 1 35 35 SER HA H 35 4.583 4.583 4.523 0.060 19799
1323 1 5 . 1 1 35 35 SER C C 35 174.848 174.848 175.303 -0.455 19799
1324 1 5 . 1 1 35 35 SER CA C 35 57.461 57.461 58.051 -0.590 19799
1325 1 5 . 1 1 35 35 SER CB C 35 63.929 63.929 63.535 0.395 19799
1326 1 5 . 1 1 35 35 SER H H 35 8.801 8.801 8.860 -0.059 19799
1327 1 5 . 1 1 36 36 GLY N N 36 114.644 114.644 113.269 1.375 19799
1328 1 5 . 1 1 36 36 GLY C C 36 173.365 173.365 175.204 -1.839 19799
1329 1 5 . 1 1 36 36 GLY CA C 36 46.088 46.088 46.511 -0.423 19799
1330 1 5 . 1 1 36 36 GLY H H 36 8.614 8.614 9.106 -0.492 19799
1331 1 5 . 1 1 37 37 ASP N N 37 122.530 122.530 121.232 1.298 19799
1332 1 5 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.488 0.422 19799
1333 1 5 . 1 1 37 37 ASP C C 37 175.986 175.986 177.164 -1.178 19799
1334 1 5 . 1 1 37 37 ASP CA C 37 53.560 53.560 56.042 -2.482 19799
1335 1 5 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.791 1.167 19799
1336 1 5 . 1 1 37 37 ASP H H 37 8.537 8.537 8.496 0.041 19799
1337 1 5 . 1 1 38 38 LEU N N 38 121.818 121.818 115.787 6.031 19799
1338 1 5 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.702 -0.373 19799
1339 1 5 . 1 1 38 38 LEU C C 38 175.373 175.373 176.077 -0.704 19799
1340 1 5 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.600 1.691 19799
1341 1 5 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.486 0.383 19799
1342 1 5 . 1 1 38 38 LEU H H 38 7.602 7.602 7.567 0.035 19799
1343 1 5 . 1 1 39 39 ILE N N 39 118.291 118.291 122.204 -3.913 19799
1344 1 5 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.002 0.896 19799
1345 1 5 . 1 1 39 39 ILE C C 39 174.861 174.861 174.889 -0.028 19799
1346 1 5 . 1 1 39 39 ILE CA C 39 59.354 59.354 61.480 -2.126 19799
1347 1 5 . 1 1 39 39 ILE CB C 39 42.014 42.014 39.169 2.845 19799
1348 1 5 . 1 1 39 39 ILE H H 39 7.708 7.708 7.339 0.369 19799
1349 1 5 . 1 1 40 40 PHE N N 40 118.274 118.274 122.392 -4.118 19799
1350 1 5 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.898 0.153 19799
1351 1 5 . 1 1 40 40 PHE C C 40 174.537 174.537 173.422 1.115 19799
1352 1 5 . 1 1 40 40 PHE CA C 40 55.438 55.438 54.966 0.472 19799
1353 1 5 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.072 1.908 19799
1354 1 5 . 1 1 40 40 PHE H H 40 8.195 8.195 7.552 0.643 19799
1355 1 5 . 1 1 41 41 VAL N N 41 121.812 121.812 121.358 0.454 19799
1356 1 5 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.063 -0.843 19799
1357 1 5 . 1 1 41 41 VAL C C 41 177.510 177.510 177.371 0.139 19799
1358 1 5 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.204 1.443 19799
1359 1 5 . 1 1 41 41 VAL CB C 41 31.030 31.030 31.342 -0.312 19799
1360 1 5 . 1 1 41 41 VAL H H 41 8.680 8.680 8.568 0.112 19799
1361 1 5 . 1 1 42 42 GLY N N 42 116.069 116.069 115.781 0.288 19799
1362 1 5 . 1 1 42 42 GLY C C 42 173.772 173.772 174.000 -0.228 19799
1363 1 5 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.579 0.083 19799
1364 1 5 . 1 1 42 42 GLY H H 42 8.815 8.815 8.897 -0.082 19799
1365 1 5 . 1 1 43 43 GLN N N 43 124.343 124.343 121.070 3.273 19799
1366 1 5 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.822 0.037 19799
1367 1 5 . 1 1 43 43 GLN C C 43 174.324 174.324 174.925 -0.601 19799
1368 1 5 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.877 0.978 19799
1369 1 5 . 1 1 43 43 GLN CB C 43 29.033 29.033 29.026 0.008 19799
1370 1 5 . 1 1 43 43 GLN H H 43 8.038 8.038 7.411 0.627 19799
1371 1 5 . 1 1 44 44 LYS N N 44 126.564 126.564 128.554 -1.990 19799
1372 1 5 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.604 0.249 19799
1373 1 5 . 1 1 44 44 LYS C C 44 176.019 176.019 175.629 0.390 19799
1374 1 5 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.417 0.124 19799
1375 1 5 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.356 0.652 19799
1376 1 5 . 1 1 44 44 LYS H H 44 8.633 8.633 8.403 0.230 19799
1377 1 5 . 1 1 45 45 LEU N N 45 126.114 126.114 125.408 0.706 19799
1378 1 5 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.085 -0.366 19799
1379 1 5 . 1 1 45 45 LEU C C 45 176.670 176.670 175.258 1.412 19799
1380 1 5 . 1 1 45 45 LEU CA C 45 53.094 53.094 52.113 0.981 19799
1381 1 5 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.547 0.555 19799
1382 1 5 . 1 1 45 45 LEU H H 45 9.458 9.458 8.570 0.888 19799
1383 1 5 . 1 1 46 46 ILE N N 46 123.782 123.782 122.772 1.010 19799
1384 1 5 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.419 -0.561 19799
1385 1 5 . 1 1 46 46 ILE C C 46 176.810 176.810 175.500 1.310 19799
1386 1 5 . 1 1 46 46 ILE CA C 46 62.646 62.646 60.498 2.148 19799
1387 1 5 . 1 1 46 46 ILE CB C 46 39.156 39.156 36.416 2.740 19799
1388 1 5 . 1 1 46 46 ILE H H 46 10.038 10.038 9.495 0.543 19799
1389 1 5 . 1 1 47 47 VAL N N 47 117.819 117.819 127.928 -10.109 19799
1390 1 5 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.616 -0.109 19799
1391 1 5 . 1 1 47 47 VAL C C 47 173.753 173.753 173.296 0.457 19799
1392 1 5 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.369 0.262 19799
1393 1 5 . 1 1 47 47 VAL CB C 47 32.918 32.918 35.521 -2.603 19799
1394 1 5 . 1 1 47 47 VAL H H 47 8.268 8.268 8.993 -0.725 19799
1395 1 5 . 1 1 48 48 LYS N N 48 118.041 118.041 128.184 -10.143 19799
1396 1 5 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.380 -0.352 19799
1397 1 5 . 1 1 48 48 LYS C C 48 174.214 174.214 175.340 -1.126 19799
1398 1 5 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.963 2.350 19799
1399 1 5 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.412 1.060 19799
1400 1 5 . 1 1 48 48 LYS H H 48 6.778 6.778 8.387 -1.609 19799
1401 1 5 . 1 1 49 49 LYS N N 49 124.877 124.877 125.221 -0.344 19799
1402 1 5 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.325 -0.142 19799
1403 1 5 . 1 1 49 49 LYS C C 49 176.704 176.704 176.813 -0.109 19799
1404 1 5 . 1 1 49 49 LYS CA C 49 54.753 54.753 57.060 -2.307 19799
1405 1 5 . 1 1 49 49 LYS CB C 49 33.181 33.181 31.877 1.304 19799
1406 1 5 . 1 1 49 49 LYS H H 49 7.204 7.204 8.654 -1.450 19799
1407 1 5 . 1 1 50 50 GLY N N 50 112.262 112.262 113.000 -0.738 19799
1408 1 5 . 1 1 50 50 GLY C C 50 173.665 173.665 173.656 0.009 19799
1409 1 5 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.231 -0.093 19799
1410 1 5 . 1 1 50 50 GLY H H 50 8.363 8.363 8.681 -0.318 19799
1411 1 6 . 1 1 2 2 THR N N 2 113.079 113.079 119.393 -6.314 19799
1412 1 6 . 1 1 2 2 THR HA H 2 4.349 4.349 4.266 0.083 19799
1413 1 6 . 1 1 2 2 THR C C 2 174.385 174.385 173.216 1.169 19799
1414 1 6 . 1 1 2 2 THR CA C 2 61.412 61.412 62.268 -0.856 19799
1415 1 6 . 1 1 2 2 THR CB C 2 70.028 70.028 68.307 1.721 19799
1416 1 6 . 1 1 2 2 THR H H 2 8.033 8.033 8.365 -0.332 19799
1417 1 6 . 1 1 3 3 ASN N N 3 121.005 121.005 122.681 -1.676 19799
1418 1 6 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.697 0.100 19799
1419 1 6 . 1 1 3 3 ASN C C 3 174.634 174.634 174.052 0.582 19799
1420 1 6 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.735 -0.231 19799
1421 1 6 . 1 1 3 3 ASN CB C 3 39.620 39.620 39.722 -0.102 19799
1422 1 6 . 1 1 3 3 ASN H H 3 8.403 8.403 7.861 0.542 19799
1423 1 6 . 1 1 4 4 THR N N 4 117.293 117.293 120.699 -3.406 19799
1424 1 6 . 1 1 4 4 THR HA H 4 4.349 4.349 4.306 0.043 19799
1425 1 6 . 1 1 4 4 THR C C 4 172.910 172.910 173.341 -0.431 19799
1426 1 6 . 1 1 4 4 THR CA C 4 62.524 62.524 61.152 1.372 19799
1427 1 6 . 1 1 4 4 THR CB C 4 69.624 69.624 70.582 -0.958 19799
1428 1 6 . 1 1 4 4 THR H H 4 8.264 8.264 7.788 0.476 19799
1429 1 6 . 1 1 5 5 TYR N N 5 125.362 125.362 119.773 5.589 19799
1430 1 6 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.232 0.305 19799
1431 1 6 . 1 1 5 5 TYR C C 5 174.901 174.901 173.672 1.229 19799
1432 1 6 . 1 1 5 5 TYR CA C 5 56.841 56.841 54.646 2.195 19799
1433 1 6 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.102 0.842 19799
1434 1 6 . 1 1 5 5 TYR H H 5 8.887 8.887 7.727 1.160 19799
1435 1 6 . 1 1 6 6 TYR N N 6 123.590 123.590 123.329 0.261 19799
1436 1 6 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.957 -0.369 19799
1437 1 6 . 1 1 6 6 TYR C C 6 173.568 173.568 174.611 -1.043 19799
1438 1 6 . 1 1 6 6 TYR CA C 6 57.479 57.479 55.991 1.488 19799
1439 1 6 . 1 1 6 6 TYR CB C 6 44.163 44.163 41.351 2.812 19799
1440 1 6 . 1 1 6 6 TYR H H 6 9.338 9.338 9.349 -0.011 19799
1441 1 6 . 1 1 7 7 THR N N 7 124.727 124.727 121.380 3.347 19799
1442 1 6 . 1 1 7 7 THR HA H 7 4.701 4.701 4.338 0.363 19799
1443 1 6 . 1 1 7 7 THR C C 7 172.279 172.279 174.096 -1.817 19799
1444 1 6 . 1 1 7 7 THR CA C 7 61.635 61.635 61.489 0.146 19799
1445 1 6 . 1 1 7 7 THR CB C 7 68.780 68.780 68.679 0.101 19799
1446 1 6 . 1 1 7 7 THR H H 7 7.482 7.482 8.435 -0.953 19799
1447 1 6 . 1 1 8 8 VAL N N 8 126.420 126.420 126.978 -0.558 19799
1448 1 6 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.810 -0.070 19799
1449 1 6 . 1 1 8 8 VAL C C 8 176.689 176.689 175.021 1.668 19799
1450 1 6 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.189 0.501 19799
1451 1 6 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.142 0.795 19799
1452 1 6 . 1 1 8 8 VAL H H 8 8.660 8.660 8.735 -0.075 19799
1453 1 6 . 1 1 9 9 LYS N N 9 130.614 130.614 128.420 2.194 19799
1454 1 6 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.580 0.090 19799
1455 1 6 . 1 1 9 9 LYS C C 9 176.438 176.438 177.316 -0.878 19799
1456 1 6 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.103 0.312 19799
1457 1 6 . 1 1 9 9 LYS CB C 9 35.596 35.596 34.474 1.122 19799
1458 1 6 . 1 1 9 9 LYS H H 9 9.297 9.297 7.897 1.400 19799
1459 1 6 . 1 1 10 10 SER N N 10 116.022 116.022 114.293 1.729 19799
1460 1 6 . 1 1 10 10 SER HA H 10 4.050 4.050 4.183 -0.133 19799
1461 1 6 . 1 1 10 10 SER C C 10 175.932 175.932 176.266 -0.334 19799
1462 1 6 . 1 1 10 10 SER CA C 10 60.451 60.451 61.123 -0.672 19799
1463 1 6 . 1 1 10 10 SER CB C 10 62.680 62.680 63.093 -0.413 19799
1464 1 6 . 1 1 10 10 SER H H 10 8.766 8.766 8.563 0.203 19799
1465 1 6 . 1 1 11 11 GLY N N 11 116.079 116.079 108.945 7.134 19799
1466 1 6 . 1 1 11 11 GLY C C 11 174.938 174.938 173.306 1.632 19799
1467 1 6 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.367 0.723 19799
1468 1 6 . 1 1 11 11 GLY H H 11 9.067 9.067 8.576 0.491 19799
1469 1 6 . 1 1 12 12 ASP N N 12 120.579 120.579 118.434 2.145 19799
1470 1 6 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.454 0.159 19799
1471 1 6 . 1 1 12 12 ASP C C 12 176.265 176.265 176.001 0.264 19799
1472 1 6 . 1 1 12 12 ASP CA C 12 56.030 56.030 54.668 1.362 19799
1473 1 6 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.682 1.163 19799
1474 1 6 . 1 1 12 12 ASP H H 12 7.963 7.963 8.020 -0.057 19799
1475 1 6 . 1 1 13 13 THR N N 13 106.911 106.911 113.552 -6.641 19799
1476 1 6 . 1 1 13 13 THR HA H 13 4.657 4.657 4.514 0.143 19799
1477 1 6 . 1 1 13 13 THR C C 13 174.774 174.774 175.346 -0.572 19799
1478 1 6 . 1 1 13 13 THR CA C 13 58.612 58.612 60.729 -2.117 19799
1479 1 6 . 1 1 13 13 THR CB C 13 72.416 72.416 71.882 0.534 19799
1480 1 6 . 1 1 13 13 THR H H 13 6.809 6.809 7.124 -0.315 19799
1481 1 6 . 1 1 14 14 LEU N N 14 122.612 122.612 124.739 -2.127 19799
1482 1 6 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.946 -0.046 19799
1483 1 6 . 1 1 14 14 LEU C C 14 178.071 178.071 178.184 -0.113 19799
1484 1 6 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.377 -0.917 19799
1485 1 6 . 1 1 14 14 LEU CB C 14 41.774 41.774 40.957 0.817 19799
1486 1 6 . 1 1 14 14 LEU H H 14 9.478 9.478 8.848 0.630 19799
1487 1 6 . 1 1 15 15 ASN N N 15 114.945 114.945 115.426 -0.481 19799
1488 1 6 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.391 -0.248 19799
1489 1 6 . 1 1 15 15 ASN C C 15 177.943 177.943 177.478 0.465 19799
1490 1 6 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.084 0.461 19799
1491 1 6 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.053 1.093 19799
1492 1 6 . 1 1 15 15 ASN H H 15 8.471 8.471 8.830 -0.359 19799
1493 1 6 . 1 1 16 16 LYS N N 16 121.113 121.113 120.581 0.532 19799
1494 1 6 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.140 -0.107 19799
1495 1 6 . 1 1 16 16 LYS C C 16 179.167 179.167 178.959 0.208 19799
1496 1 6 . 1 1 16 16 LYS CA C 16 59.702 59.702 58.281 1.421 19799
1497 1 6 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.375 1.117 19799
1498 1 6 . 1 1 16 16 LYS H H 16 7.725 7.725 7.541 0.184 19799
1499 1 6 . 1 1 17 17 ILE N N 17 121.712 121.712 115.460 6.252 19799
1500 1 6 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.643 -0.133 19799
1501 1 6 . 1 1 17 17 ILE C C 17 177.445 177.445 177.116 0.329 19799
1502 1 6 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.234 0.948 19799
1503 1 6 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.212 1.426 19799
1504 1 6 . 1 1 17 17 ILE H H 17 7.933 7.933 7.816 0.117 19799
1505 1 6 . 1 1 18 18 ALA N N 18 121.562 121.562 122.515 -0.953 19799
1506 1 6 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.817 0.025 19799
1507 1 6 . 1 1 18 18 ALA C C 18 179.665 179.665 178.885 0.780 19799
1508 1 6 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.028 0.452 19799
1509 1 6 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.257 -0.224 19799
1510 1 6 . 1 1 18 18 ALA H H 18 8.401 8.401 8.134 0.267 19799
1511 1 6 . 1 1 19 19 ALA N N 19 117.623 117.623 119.634 -2.011 19799
1512 1 6 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.071 0.095 19799
1513 1 6 . 1 1 19 19 ALA C C 19 180.714 180.714 179.037 1.677 19799
1514 1 6 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.845 0.663 19799
1515 1 6 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.402 -0.353 19799
1516 1 6 . 1 1 19 19 ALA H H 19 7.500 7.500 7.597 -0.097 19799
1517 1 6 . 1 1 20 20 GLN N N 20 118.679 118.679 118.762 -0.083 19799
1518 1 6 . 1 1 20 20 GLN HA H 20 3.856 3.856 3.989 -0.133 19799
1519 1 6 . 1 1 20 20 GLN C C 20 177.608 177.608 177.429 0.179 19799
1520 1 6 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.195 0.275 19799
1521 1 6 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.861 -0.579 19799
1522 1 6 . 1 1 20 20 GLN H H 20 7.941 7.941 7.418 0.523 19799
1523 1 6 . 1 1 21 21 TYR N N 21 113.907 113.907 113.015 0.892 19799
1524 1 6 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.845 -0.479 19799
1525 1 6 . 1 1 21 21 TYR C C 21 175.496 175.496 175.072 0.424 19799
1526 1 6 . 1 1 21 21 TYR CA C 21 60.036 60.036 54.788 5.248 19799
1527 1 6 . 1 1 21 21 TYR CB C 21 39.198 39.198 37.608 1.590 19799
1528 1 6 . 1 1 21 21 TYR H H 21 7.669 7.669 6.998 0.671 19799
1529 1 6 . 1 1 22 22 GLY N N 22 111.326 111.326 108.506 2.820 19799
1530 1 6 . 1 1 22 22 GLY C C 22 174.783 174.783 173.448 1.335 19799
1531 1 6 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.687 1.764 19799
1532 1 6 . 1 1 22 22 GLY H H 22 7.949 7.949 7.414 0.535 19799
1533 1 6 . 1 1 23 23 VAL N N 23 113.949 113.949 118.297 -4.348 19799
1534 1 6 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.827 -0.020 19799
1535 1 6 . 1 1 23 23 VAL C C 23 173.768 173.768 174.200 -0.432 19799
1536 1 6 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.490 -1.056 19799
1537 1 6 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.724 -0.763 19799
1538 1 6 . 1 1 23 23 VAL H H 23 8.040 8.040 8.303 -0.263 19799
1539 1 6 . 1 1 24 24 SER N N 24 115.672 115.672 116.467 -0.795 19799
1540 1 6 . 1 1 24 24 SER HA H 24 4.655 4.655 4.849 -0.194 19799
1541 1 6 . 1 1 24 24 SER C C 24 176.015 176.015 175.564 0.451 19799
1542 1 6 . 1 1 24 24 SER CA C 24 56.111 56.111 56.624 -0.513 19799
1543 1 6 . 1 1 24 24 SER CB C 24 65.385 65.385 65.355 0.030 19799
1544 1 6 . 1 1 24 24 SER H H 24 8.269 8.269 8.712 -0.443 19799
1545 1 6 . 1 1 25 25 VAL N N 25 122.227 122.227 124.460 -2.233 19799
1546 1 6 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.632 -0.255 19799
1547 1 6 . 1 1 25 25 VAL C C 25 177.775 177.775 177.493 0.282 19799
1548 1 6 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.888 0.252 19799
1549 1 6 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.488 -0.118 19799
1550 1 6 . 1 1 25 25 VAL H H 25 8.866 8.866 8.818 0.048 19799
1551 1 6 . 1 1 26 26 ALA N N 26 120.890 120.890 121.296 -0.406 19799
1552 1 6 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.984 -0.070 19799
1553 1 6 . 1 1 26 26 ALA C C 26 180.692 180.692 179.070 1.622 19799
1554 1 6 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.385 -0.073 19799
1555 1 6 . 1 1 26 26 ALA CB C 26 17.825 17.825 17.814 0.011 19799
1556 1 6 . 1 1 26 26 ALA H H 26 8.218 8.218 8.370 -0.152 19799
1557 1 6 . 1 1 27 27 ASN N N 27 118.099 118.099 116.365 1.734 19799
1558 1 6 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.030 -0.327 19799
1559 1 6 . 1 1 27 27 ASN C C 27 175.308 175.308 176.749 -1.441 19799
1560 1 6 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.189 0.031 19799
1561 1 6 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.325 -0.461 19799
1562 1 6 . 1 1 27 27 ASN H H 27 7.846 7.846 7.524 0.322 19799
1563 1 6 . 1 1 28 28 LEU N N 28 116.512 116.512 118.345 -1.833 19799
1564 1 6 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.702 0.041 19799
1565 1 6 . 1 1 28 28 LEU C C 28 181.142 181.142 178.662 2.480 19799
1566 1 6 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.584 0.673 19799
1567 1 6 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.269 0.816 19799
1568 1 6 . 1 1 28 28 LEU H H 28 7.475 7.475 7.553 -0.078 19799
1569 1 6 . 1 1 29 29 ARG N N 29 117.344 117.344 118.816 -1.472 19799
1570 1 6 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.947 0.005 19799
1571 1 6 . 1 1 29 29 ARG C C 29 178.818 178.818 178.825 -0.007 19799
1572 1 6 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.470 1.313 19799
1573 1 6 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.692 0.367 19799
1574 1 6 . 1 1 29 29 ARG H H 29 8.571 8.571 8.090 0.481 19799
1575 1 6 . 1 1 30 30 SER N N 30 114.887 114.887 115.436 -0.549 19799
1576 1 6 . 1 1 30 30 SER HA H 30 4.255 4.255 4.203 0.052 19799
1577 1 6 . 1 1 30 30 SER C C 30 178.552 178.552 176.100 2.452 19799
1578 1 6 . 1 1 30 30 SER CA C 30 61.314 61.314 60.807 0.507 19799
1579 1 6 . 1 1 30 30 SER CB C 30 62.982 62.982 62.886 0.096 19799
1580 1 6 . 1 1 30 30 SER H H 30 7.995 7.995 7.438 0.557 19799
1581 1 6 . 1 1 31 31 TRP N N 31 119.302 119.302 118.919 0.383 19799
1582 1 6 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.862 -0.077 19799
1583 1 6 . 1 1 31 31 TRP C C 31 177.570 177.570 177.265 0.305 19799
1584 1 6 . 1 1 31 31 TRP CA C 31 57.005 57.005 55.804 1.201 19799
1585 1 6 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.686 1.242 19799
1586 1 6 . 1 1 31 31 TRP H H 31 9.055 9.055 7.213 1.842 19799
1587 1 6 . 1 1 32 32 ASN N N 32 109.665 109.665 118.788 -9.123 19799
1588 1 6 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.881 0.223 19799
1589 1 6 . 1 1 32 32 ASN C C 32 174.034 174.034 176.779 -2.745 19799
1590 1 6 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.713 -1.163 19799
1591 1 6 . 1 1 32 32 ASN CB C 32 42.065 42.065 39.658 2.407 19799
1592 1 6 . 1 1 32 32 ASN H H 32 7.232 7.232 7.544 -0.312 19799
1593 1 6 . 1 1 33 33 GLY N N 33 111.582 111.582 109.030 2.552 19799
1594 1 6 . 1 1 33 33 GLY C C 33 174.930 174.930 174.030 0.900 19799
1595 1 6 . 1 1 33 33 GLY CA C 33 47.611 47.611 46.019 1.592 19799
1596 1 6 . 1 1 33 33 GLY H H 33 7.864 7.864 8.162 -0.298 19799
1597 1 6 . 1 1 34 34 ILE N N 34 118.759 118.759 115.375 3.384 19799
1598 1 6 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.478 -0.262 19799
1599 1 6 . 1 1 34 34 ILE C C 34 175.882 175.882 174.925 0.957 19799
1600 1 6 . 1 1 34 34 ILE CA C 34 60.719 60.719 59.096 1.623 19799
1601 1 6 . 1 1 34 34 ILE CB C 34 40.553 40.553 40.205 0.348 19799
1602 1 6 . 1 1 34 34 ILE H H 34 7.918 7.918 7.304 0.614 19799
1603 1 6 . 1 1 35 35 SER N N 35 122.217 122.217 116.625 5.592 19799
1604 1 6 . 1 1 35 35 SER HA H 35 4.583 4.583 4.468 0.115 19799
1605 1 6 . 1 1 35 35 SER C C 35 174.848 174.848 175.793 -0.945 19799
1606 1 6 . 1 1 35 35 SER CA C 35 57.461 57.461 58.336 -0.875 19799
1607 1 6 . 1 1 35 35 SER CB C 35 63.929 63.929 64.453 -0.524 19799
1608 1 6 . 1 1 35 35 SER H H 35 8.801 8.801 8.623 0.178 19799
1609 1 6 . 1 1 36 36 GLY N N 36 114.644 114.644 114.404 0.240 19799
1610 1 6 . 1 1 36 36 GLY C C 36 173.365 173.365 174.182 -0.817 19799
1611 1 6 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.907 1.181 19799
1612 1 6 . 1 1 36 36 GLY H H 36 8.614 8.614 8.933 -0.319 19799
1613 1 6 . 1 1 37 37 ASP N N 37 122.530 122.530 120.348 2.182 19799
1614 1 6 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.779 0.131 19799
1615 1 6 . 1 1 37 37 ASP C C 37 175.986 175.986 177.074 -1.088 19799
1616 1 6 . 1 1 37 37 ASP CA C 37 53.560 53.560 55.800 -2.240 19799
1617 1 6 . 1 1 37 37 ASP CB C 37 41.958 41.958 42.458 -0.500 19799
1618 1 6 . 1 1 37 37 ASP H H 37 8.537 8.537 8.259 0.278 19799
1619 1 6 . 1 1 38 38 LEU N N 38 121.818 121.818 119.237 2.581 19799
1620 1 6 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.843 -0.514 19799
1621 1 6 . 1 1 38 38 LEU C C 38 175.373 175.373 175.650 -0.277 19799
1622 1 6 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.764 1.527 19799
1623 1 6 . 1 1 38 38 LEU CB C 38 41.868 41.868 42.024 -0.156 19799
1624 1 6 . 1 1 38 38 LEU H H 38 7.602 7.602 7.453 0.149 19799
1625 1 6 . 1 1 39 39 ILE N N 39 118.291 118.291 124.255 -5.964 19799
1626 1 6 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.664 0.234 19799
1627 1 6 . 1 1 39 39 ILE C C 39 174.861 174.861 174.599 0.262 19799
1628 1 6 . 1 1 39 39 ILE CA C 39 59.354 59.354 60.863 -1.509 19799
1629 1 6 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.283 1.731 19799
1630 1 6 . 1 1 39 39 ILE H H 39 7.708 7.708 7.914 -0.206 19799
1631 1 6 . 1 1 40 40 PHE N N 40 118.274 118.274 123.160 -4.886 19799
1632 1 6 . 1 1 40 40 PHE HA H 40 5.051 5.051 5.013 0.038 19799
1633 1 6 . 1 1 40 40 PHE C C 40 174.537 174.537 173.203 1.334 19799
1634 1 6 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.335 0.103 19799
1635 1 6 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.561 1.419 19799
1636 1 6 . 1 1 40 40 PHE H H 40 8.195 8.195 7.949 0.246 19799
1637 1 6 . 1 1 41 41 VAL N N 41 121.812 121.812 121.645 0.167 19799
1638 1 6 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.235 -1.015 19799
1639 1 6 . 1 1 41 41 VAL C C 41 177.510 177.510 177.662 -0.152 19799
1640 1 6 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.559 1.088 19799
1641 1 6 . 1 1 41 41 VAL CB C 41 31.030 31.030 30.464 0.566 19799
1642 1 6 . 1 1 41 41 VAL H H 41 8.680 8.680 8.599 0.081 19799
1643 1 6 . 1 1 42 42 GLY N N 42 116.069 116.069 116.392 -0.323 19799
1644 1 6 . 1 1 42 42 GLY C C 42 173.772 173.772 173.502 0.270 19799
1645 1 6 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.700 -0.039 19799
1646 1 6 . 1 1 42 42 GLY H H 42 8.815 8.815 8.873 -0.058 19799
1647 1 6 . 1 1 43 43 GLN N N 43 124.343 124.343 121.843 2.500 19799
1648 1 6 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.986 -0.127 19799
1649 1 6 . 1 1 43 43 GLN C C 43 174.324 174.324 175.087 -0.763 19799
1650 1 6 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.409 1.446 19799
1651 1 6 . 1 1 43 43 GLN CB C 43 29.033 29.033 29.071 -0.038 19799
1652 1 6 . 1 1 43 43 GLN H H 43 8.038 8.038 7.541 0.497 19799
1653 1 6 . 1 1 44 44 LYS N N 44 126.564 126.564 127.483 -0.919 19799
1654 1 6 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.461 0.392 19799
1655 1 6 . 1 1 44 44 LYS C C 44 176.019 176.019 175.795 0.224 19799
1656 1 6 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.694 -0.153 19799
1657 1 6 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.066 0.942 19799
1658 1 6 . 1 1 44 44 LYS H H 44 8.633 8.633 8.433 0.200 19799
1659 1 6 . 1 1 45 45 LEU N N 45 126.114 126.114 123.669 2.445 19799
1660 1 6 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.030 -0.311 19799
1661 1 6 . 1 1 45 45 LEU C C 45 176.670 176.670 176.270 0.400 19799
1662 1 6 . 1 1 45 45 LEU CA C 45 53.094 53.094 53.274 -0.180 19799
1663 1 6 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.229 0.873 19799
1664 1 6 . 1 1 45 45 LEU H H 45 9.458 9.458 8.531 0.927 19799
1665 1 6 . 1 1 46 46 ILE N N 46 123.782 123.782 123.691 0.091 19799
1666 1 6 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.393 -0.535 19799
1667 1 6 . 1 1 46 46 ILE C C 46 176.810 176.810 175.831 0.979 19799
1668 1 6 . 1 1 46 46 ILE CA C 46 62.646 62.646 62.319 0.327 19799
1669 1 6 . 1 1 46 46 ILE CB C 46 39.156 39.156 37.811 1.345 19799
1670 1 6 . 1 1 46 46 ILE H H 46 10.038 10.038 9.002 1.036 19799
1671 1 6 . 1 1 47 47 VAL N N 47 117.819 117.819 125.604 -7.785 19799
1672 1 6 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.482 0.025 19799
1673 1 6 . 1 1 47 47 VAL C C 47 173.753 173.753 173.034 0.719 19799
1674 1 6 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.630 0.001 19799
1675 1 6 . 1 1 47 47 VAL CB C 47 32.918 32.918 34.510 -1.592 19799
1676 1 6 . 1 1 47 47 VAL H H 47 8.268 8.268 8.966 -0.698 19799
1677 1 6 . 1 1 48 48 LYS N N 48 118.041 118.041 124.420 -6.379 19799
1678 1 6 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.342 -0.314 19799
1679 1 6 . 1 1 48 48 LYS C C 48 174.214 174.214 174.655 -0.441 19799
1680 1 6 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.445 2.868 19799
1681 1 6 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.690 0.783 19799
1682 1 6 . 1 1 48 48 LYS H H 48 6.778 6.778 7.483 -0.705 19799
1683 1 6 . 1 1 49 49 LYS N N 49 124.877 124.877 122.271 2.606 19799
1684 1 6 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.631 -0.448 19799
1685 1 6 . 1 1 49 49 LYS C C 49 176.704 176.704 176.778 -0.074 19799
1686 1 6 . 1 1 49 49 LYS CA C 49 54.753 54.753 55.709 -0.956 19799
1687 1 6 . 1 1 49 49 LYS CB C 49 33.181 33.181 32.891 0.290 19799
1688 1 6 . 1 1 49 49 LYS H H 49 7.204 7.204 8.508 -1.304 19799
1689 1 6 . 1 1 50 50 GLY N N 50 112.262 112.262 112.685 -0.423 19799
1690 1 6 . 1 1 50 50 GLY C C 50 173.665 173.665 173.980 -0.315 19799
1691 1 6 . 1 1 50 50 GLY CA C 50 45.138 45.138 44.841 0.297 19799
1692 1 6 . 1 1 50 50 GLY H H 50 8.363 8.363 8.503 -0.140 19799
1693 1 7 . 1 1 2 2 THR N N 2 113.079 113.079 115.999 -2.920 19799
1694 1 7 . 1 1 2 2 THR HA H 2 4.349 4.349 4.444 -0.095 19799
1695 1 7 . 1 1 2 2 THR C C 2 174.385 174.385 173.475 0.910 19799
1696 1 7 . 1 1 2 2 THR CA C 2 61.412 61.412 61.936 -0.524 19799
1697 1 7 . 1 1 2 2 THR CB C 2 70.028 70.028 70.424 -0.396 19799
1698 1 7 . 1 1 2 2 THR H H 2 8.033 8.033 8.099 -0.066 19799
1699 1 7 . 1 1 3 3 ASN N N 3 121.005 121.005 123.412 -2.407 19799
1700 1 7 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.627 0.170 19799
1701 1 7 . 1 1 3 3 ASN C C 3 174.634 174.634 174.650 -0.016 19799
1702 1 7 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.930 -0.426 19799
1703 1 7 . 1 1 3 3 ASN CB C 3 39.620 39.620 39.145 0.475 19799
1704 1 7 . 1 1 3 3 ASN H H 3 8.403 8.403 8.508 -0.105 19799
1705 1 7 . 1 1 4 4 THR N N 4 117.293 117.293 116.412 0.881 19799
1706 1 7 . 1 1 4 4 THR HA H 4 4.349 4.349 4.249 0.100 19799
1707 1 7 . 1 1 4 4 THR C C 4 172.910 172.910 172.919 -0.009 19799
1708 1 7 . 1 1 4 4 THR CA C 4 62.524 62.524 61.058 1.466 19799
1709 1 7 . 1 1 4 4 THR CB C 4 69.624 69.624 71.016 -1.393 19799
1710 1 7 . 1 1 4 4 THR H H 4 8.264 8.264 7.908 0.356 19799
1711 1 7 . 1 1 5 5 TYR N N 5 125.362 125.362 119.806 5.556 19799
1712 1 7 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.117 0.420 19799
1713 1 7 . 1 1 5 5 TYR C C 5 174.901 174.901 173.782 1.119 19799
1714 1 7 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.402 1.439 19799
1715 1 7 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.037 0.907 19799
1716 1 7 . 1 1 5 5 TYR H H 5 8.887 8.887 7.709 1.178 19799
1717 1 7 . 1 1 6 6 TYR N N 6 123.590 123.590 124.460 -0.870 19799
1718 1 7 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.918 -0.330 19799
1719 1 7 . 1 1 6 6 TYR C C 6 173.568 173.568 174.155 -0.587 19799
1720 1 7 . 1 1 6 6 TYR CA C 6 57.479 57.479 56.014 1.465 19799
1721 1 7 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.417 1.746 19799
1722 1 7 . 1 1 6 6 TYR H H 6 9.338 9.338 9.255 0.083 19799
1723 1 7 . 1 1 7 7 THR N N 7 124.727 124.727 118.912 5.815 19799
1724 1 7 . 1 1 7 7 THR HA H 7 4.701 4.701 4.442 0.259 19799
1725 1 7 . 1 1 7 7 THR C C 7 172.279 172.279 174.155 -1.876 19799
1726 1 7 . 1 1 7 7 THR CA C 7 61.635 61.635 60.458 1.177 19799
1727 1 7 . 1 1 7 7 THR CB C 7 68.780 68.780 68.645 0.135 19799
1728 1 7 . 1 1 7 7 THR H H 7 7.482 7.482 8.127 -0.645 19799
1729 1 7 . 1 1 8 8 VAL N N 8 126.420 126.420 127.201 -0.781 19799
1730 1 7 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.738 0.002 19799
1731 1 7 . 1 1 8 8 VAL C C 8 176.689 176.689 174.822 1.867 19799
1732 1 7 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.477 0.213 19799
1733 1 7 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.319 0.618 19799
1734 1 7 . 1 1 8 8 VAL H H 8 8.660 8.660 8.783 -0.123 19799
1735 1 7 . 1 1 9 9 LYS N N 9 130.614 130.614 127.516 3.098 19799
1736 1 7 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.562 0.108 19799
1737 1 7 . 1 1 9 9 LYS C C 9 176.438 176.438 175.397 1.041 19799
1738 1 7 . 1 1 9 9 LYS CA C 9 54.415 54.415 53.248 1.167 19799
1739 1 7 . 1 1 9 9 LYS CB C 9 35.596 35.596 35.023 0.573 19799
1740 1 7 . 1 1 9 9 LYS H H 9 9.297 9.297 7.938 1.359 19799
1741 1 7 . 1 1 10 10 SER N N 10 116.022 116.022 115.585 0.437 19799
1742 1 7 . 1 1 10 10 SER HA H 10 4.050 4.050 4.241 -0.191 19799
1743 1 7 . 1 1 10 10 SER C C 10 175.932 175.932 175.678 0.254 19799
1744 1 7 . 1 1 10 10 SER CA C 10 60.451 60.451 60.202 0.249 19799
1745 1 7 . 1 1 10 10 SER CB C 10 62.680 62.680 63.080 -0.400 19799
1746 1 7 . 1 1 10 10 SER H H 10 8.766 8.766 8.469 0.297 19799
1747 1 7 . 1 1 11 11 GLY N N 11 116.079 116.079 111.628 4.451 19799
1748 1 7 . 1 1 11 11 GLY C C 11 174.938 174.938 173.947 0.991 19799
1749 1 7 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.834 0.256 19799
1750 1 7 . 1 1 11 11 GLY H H 11 9.067 9.067 8.354 0.713 19799
1751 1 7 . 1 1 12 12 ASP N N 12 120.579 120.579 116.154 4.425 19799
1752 1 7 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.542 0.071 19799
1753 1 7 . 1 1 12 12 ASP C C 12 176.265 176.265 176.089 0.176 19799
1754 1 7 . 1 1 12 12 ASP CA C 12 56.030 56.030 54.651 1.379 19799
1755 1 7 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.714 1.131 19799
1756 1 7 . 1 1 12 12 ASP H H 12 7.963 7.963 8.564 -0.601 19799
1757 1 7 . 1 1 13 13 THR N N 13 106.911 106.911 113.651 -6.740 19799
1758 1 7 . 1 1 13 13 THR HA H 13 4.657 4.657 4.546 0.111 19799
1759 1 7 . 1 1 13 13 THR C C 13 174.774 174.774 175.117 -0.343 19799
1760 1 7 . 1 1 13 13 THR CA C 13 58.612 58.612 60.000 -1.388 19799
1761 1 7 . 1 1 13 13 THR CB C 13 72.416 72.416 71.828 0.588 19799
1762 1 7 . 1 1 13 13 THR H H 13 6.809 6.809 7.093 -0.284 19799
1763 1 7 . 1 1 14 14 LEU N N 14 122.612 122.612 125.146 -2.534 19799
1764 1 7 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.935 -0.035 19799
1765 1 7 . 1 1 14 14 LEU C C 14 178.071 178.071 178.445 -0.374 19799
1766 1 7 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.608 -1.148 19799
1767 1 7 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.230 0.544 19799
1768 1 7 . 1 1 14 14 LEU H H 14 9.478 9.478 8.879 0.599 19799
1769 1 7 . 1 1 15 15 ASN N N 15 114.945 114.945 115.256 -0.311 19799
1770 1 7 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.358 -0.215 19799
1771 1 7 . 1 1 15 15 ASN C C 15 177.943 177.943 177.378 0.565 19799
1772 1 7 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.226 0.319 19799
1773 1 7 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.200 0.946 19799
1774 1 7 . 1 1 15 15 ASN H H 15 8.471 8.471 8.933 -0.462 19799
1775 1 7 . 1 1 16 16 LYS N N 16 121.113 121.113 120.623 0.490 19799
1776 1 7 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.092 -0.059 19799
1777 1 7 . 1 1 16 16 LYS C C 16 179.167 179.167 179.013 0.154 19799
1778 1 7 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.020 0.682 19799
1779 1 7 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.694 0.798 19799
1780 1 7 . 1 1 16 16 LYS H H 16 7.725 7.725 7.639 0.086 19799
1781 1 7 . 1 1 17 17 ILE N N 17 121.712 121.712 116.342 5.370 19799
1782 1 7 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.598 -0.088 19799
1783 1 7 . 1 1 17 17 ILE C C 17 177.445 177.445 177.066 0.379 19799
1784 1 7 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.143 1.039 19799
1785 1 7 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.360 1.278 19799
1786 1 7 . 1 1 17 17 ILE H H 17 7.933 7.933 7.921 0.012 19799
1787 1 7 . 1 1 18 18 ALA N N 18 121.562 121.562 122.583 -1.021 19799
1788 1 7 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.948 -0.106 19799
1789 1 7 . 1 1 18 18 ALA C C 18 179.665 179.665 178.843 0.822 19799
1790 1 7 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.144 0.336 19799
1791 1 7 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.270 -0.237 19799
1792 1 7 . 1 1 18 18 ALA H H 18 8.401 8.401 8.376 0.025 19799
1793 1 7 . 1 1 19 19 ALA N N 19 117.623 117.623 119.192 -1.569 19799
1794 1 7 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.048 0.118 19799
1795 1 7 . 1 1 19 19 ALA C C 19 180.714 180.714 179.181 1.533 19799
1796 1 7 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.899 0.609 19799
1797 1 7 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.387 -0.338 19799
1798 1 7 . 1 1 19 19 ALA H H 19 7.500 7.500 7.576 -0.076 19799
1799 1 7 . 1 1 20 20 GLN N N 20 118.679 118.679 118.810 -0.131 19799
1800 1 7 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.002 -0.146 19799
1801 1 7 . 1 1 20 20 GLN C C 20 177.608 177.608 177.651 -0.043 19799
1802 1 7 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.215 0.255 19799
1803 1 7 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.884 -0.602 19799
1804 1 7 . 1 1 20 20 GLN H H 20 7.941 7.941 7.438 0.503 19799
1805 1 7 . 1 1 21 21 TYR N N 21 113.907 113.907 113.879 0.028 19799
1806 1 7 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.667 -0.301 19799
1807 1 7 . 1 1 21 21 TYR C C 21 175.496 175.496 176.044 -0.548 19799
1808 1 7 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.669 4.367 19799
1809 1 7 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.381 0.817 19799
1810 1 7 . 1 1 21 21 TYR H H 21 7.669 7.669 6.969 0.700 19799
1811 1 7 . 1 1 22 22 GLY N N 22 111.326 111.326 109.610 1.716 19799
1812 1 7 . 1 1 22 22 GLY C C 22 174.783 174.783 173.548 1.235 19799
1813 1 7 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.327 2.123 19799
1814 1 7 . 1 1 22 22 GLY H H 22 7.949 7.949 7.662 0.287 19799
1815 1 7 . 1 1 23 23 VAL N N 23 113.949 113.949 118.064 -4.115 19799
1816 1 7 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.612 0.195 19799
1817 1 7 . 1 1 23 23 VAL C C 23 173.768 173.768 174.404 -0.636 19799
1818 1 7 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.197 -0.763 19799
1819 1 7 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.934 -0.973 19799
1820 1 7 . 1 1 23 23 VAL H H 23 8.040 8.040 8.256 -0.216 19799
1821 1 7 . 1 1 24 24 SER N N 24 115.672 115.672 118.486 -2.814 19799
1822 1 7 . 1 1 24 24 SER HA H 24 4.655 4.655 4.749 -0.094 19799
1823 1 7 . 1 1 24 24 SER C C 24 176.015 176.015 175.876 0.139 19799
1824 1 7 . 1 1 24 24 SER CA C 24 56.111 56.111 56.826 -0.715 19799
1825 1 7 . 1 1 24 24 SER CB C 24 65.385 65.385 64.153 1.232 19799
1826 1 7 . 1 1 24 24 SER H H 24 8.269 8.269 8.255 0.014 19799
1827 1 7 . 1 1 25 25 VAL N N 25 122.227 122.227 124.754 -2.527 19799
1828 1 7 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.647 -0.270 19799
1829 1 7 . 1 1 25 25 VAL C C 25 177.775 177.775 177.797 -0.022 19799
1830 1 7 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.400 0.740 19799
1831 1 7 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.189 0.181 19799
1832 1 7 . 1 1 25 25 VAL H H 25 8.866 8.866 8.879 -0.013 19799
1833 1 7 . 1 1 26 26 ALA N N 26 120.890 120.890 122.054 -1.164 19799
1834 1 7 . 1 1 26 26 ALA HA H 26 3.914 3.914 4.002 -0.088 19799
1835 1 7 . 1 1 26 26 ALA C C 26 180.692 180.692 178.927 1.765 19799
1836 1 7 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.562 -0.250 19799
1837 1 7 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.392 -0.567 19799
1838 1 7 . 1 1 26 26 ALA H H 26 8.218 8.218 8.517 -0.299 19799
1839 1 7 . 1 1 27 27 ASN N N 27 118.099 118.099 117.230 0.869 19799
1840 1 7 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.051 -0.348 19799
1841 1 7 . 1 1 27 27 ASN C C 27 175.308 175.308 176.733 -1.425 19799
1842 1 7 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.426 -0.206 19799
1843 1 7 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.459 -0.595 19799
1844 1 7 . 1 1 27 27 ASN H H 27 7.846 7.846 7.508 0.338 19799
1845 1 7 . 1 1 28 28 LEU N N 28 116.512 116.512 118.910 -2.398 19799
1846 1 7 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.948 -0.205 19799
1847 1 7 . 1 1 28 28 LEU C C 28 181.142 181.142 178.557 2.585 19799
1848 1 7 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.918 0.339 19799
1849 1 7 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.939 0.146 19799
1850 1 7 . 1 1 28 28 LEU H H 28 7.475 7.475 7.547 -0.072 19799
1851 1 7 . 1 1 29 29 ARG N N 29 117.344 117.344 119.307 -1.963 19799
1852 1 7 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.995 -0.043 19799
1853 1 7 . 1 1 29 29 ARG C C 29 178.818 178.818 178.596 0.222 19799
1854 1 7 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.600 1.183 19799
1855 1 7 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.887 0.173 19799
1856 1 7 . 1 1 29 29 ARG H H 29 8.571 8.571 7.806 0.765 19799
1857 1 7 . 1 1 30 30 SER N N 30 114.887 114.887 114.387 0.500 19799
1858 1 7 . 1 1 30 30 SER HA H 30 4.255 4.255 4.216 0.039 19799
1859 1 7 . 1 1 30 30 SER C C 30 178.552 178.552 175.771 2.781 19799
1860 1 7 . 1 1 30 30 SER CA C 30 61.314 61.314 61.926 -0.612 19799
1861 1 7 . 1 1 30 30 SER CB C 30 62.982 62.982 62.775 0.207 19799
1862 1 7 . 1 1 30 30 SER H H 30 7.995 7.995 7.204 0.791 19799
1863 1 7 . 1 1 31 31 TRP N N 31 119.302 119.302 118.705 0.597 19799
1864 1 7 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.729 0.056 19799
1865 1 7 . 1 1 31 31 TRP C C 31 177.570 177.570 176.695 0.875 19799
1866 1 7 . 1 1 31 31 TRP CA C 31 57.005 57.005 56.169 0.836 19799
1867 1 7 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.490 1.438 19799
1868 1 7 . 1 1 31 31 TRP H H 31 9.055 9.055 7.233 1.822 19799
1869 1 7 . 1 1 32 32 ASN N N 32 109.665 109.665 117.637 -7.972 19799
1870 1 7 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.840 0.264 19799
1871 1 7 . 1 1 32 32 ASN C C 32 174.034 174.034 176.407 -2.373 19799
1872 1 7 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.463 -0.913 19799
1873 1 7 . 1 1 32 32 ASN CB C 32 42.065 42.065 39.445 2.620 19799
1874 1 7 . 1 1 32 32 ASN H H 32 7.232 7.232 7.462 -0.230 19799
1875 1 7 . 1 1 33 33 GLY N N 33 111.582 111.582 109.723 1.859 19799
1876 1 7 . 1 1 33 33 GLY C C 33 174.930 174.930 174.314 0.616 19799
1877 1 7 . 1 1 33 33 GLY CA C 33 47.611 47.611 46.133 1.478 19799
1878 1 7 . 1 1 33 33 GLY H H 33 7.864 7.864 7.870 -0.006 19799
1879 1 7 . 1 1 34 34 ILE N N 34 118.759 118.759 118.212 0.547 19799
1880 1 7 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.416 -0.200 19799
1881 1 7 . 1 1 34 34 ILE C C 34 175.882 175.882 175.891 -0.009 19799
1882 1 7 . 1 1 34 34 ILE CA C 34 60.719 60.719 59.865 0.854 19799
1883 1 7 . 1 1 34 34 ILE CB C 34 40.553 40.553 38.724 1.829 19799
1884 1 7 . 1 1 34 34 ILE H H 34 7.918 7.918 7.473 0.445 19799
1885 1 7 . 1 1 35 35 SER N N 35 122.217 122.217 121.817 0.400 19799
1886 1 7 . 1 1 35 35 SER HA H 35 4.583 4.583 4.750 -0.167 19799
1887 1 7 . 1 1 35 35 SER C C 35 174.848 174.848 174.867 -0.019 19799
1888 1 7 . 1 1 35 35 SER CA C 35 57.461 57.461 57.685 -0.224 19799
1889 1 7 . 1 1 35 35 SER CB C 35 63.929 63.929 63.457 0.472 19799
1890 1 7 . 1 1 35 35 SER H H 35 8.801 8.801 8.677 0.124 19799
1891 1 7 . 1 1 36 36 GLY N N 36 114.644 114.644 113.568 1.076 19799
1892 1 7 . 1 1 36 36 GLY C C 36 173.365 173.365 172.345 1.020 19799
1893 1 7 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.545 1.542 19799
1894 1 7 . 1 1 36 36 GLY H H 36 8.614 8.614 8.271 0.343 19799
1895 1 7 . 1 1 37 37 ASP N N 37 122.530 122.530 118.551 3.979 19799
1896 1 7 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.782 0.128 19799
1897 1 7 . 1 1 37 37 ASP C C 37 175.986 175.986 176.338 -0.352 19799
1898 1 7 . 1 1 37 37 ASP CA C 37 53.560 53.560 53.538 0.022 19799
1899 1 7 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.629 1.329 19799
1900 1 7 . 1 1 37 37 ASP H H 37 8.537 8.537 8.425 0.112 19799
1901 1 7 . 1 1 38 38 LEU N N 38 121.818 121.818 119.289 2.529 19799
1902 1 7 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.647 -0.318 19799
1903 1 7 . 1 1 38 38 LEU C C 38 175.373 175.373 175.776 -0.403 19799
1904 1 7 . 1 1 38 38 LEU CA C 38 56.291 56.291 55.073 1.218 19799
1905 1 7 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.728 0.140 19799
1906 1 7 . 1 1 38 38 LEU H H 38 7.602 7.602 7.545 0.057 19799
1907 1 7 . 1 1 39 39 ILE N N 39 118.291 118.291 125.599 -7.308 19799
1908 1 7 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.356 0.542 19799
1909 1 7 . 1 1 39 39 ILE C C 39 174.861 174.861 174.333 0.528 19799
1910 1 7 . 1 1 39 39 ILE CA C 39 59.354 59.354 61.056 -1.702 19799
1911 1 7 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.859 1.155 19799
1912 1 7 . 1 1 39 39 ILE H H 39 7.708 7.708 7.834 -0.126 19799
1913 1 7 . 1 1 40 40 PHE N N 40 118.274 118.274 122.951 -4.677 19799
1914 1 7 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.906 0.145 19799
1915 1 7 . 1 1 40 40 PHE C C 40 174.537 174.537 173.528 1.009 19799
1916 1 7 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.218 0.220 19799
1917 1 7 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.590 1.390 19799
1918 1 7 . 1 1 40 40 PHE H H 40 8.195 8.195 7.790 0.405 19799
1919 1 7 . 1 1 41 41 VAL N N 41 121.812 121.812 121.977 -0.165 19799
1920 1 7 . 1 1 41 41 VAL HA H 41 3.220 3.220 3.959 -0.739 19799
1921 1 7 . 1 1 41 41 VAL C C 41 177.510 177.510 177.520 -0.010 19799
1922 1 7 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.488 1.159 19799
1923 1 7 . 1 1 41 41 VAL CB C 41 31.030 31.030 30.441 0.589 19799
1924 1 7 . 1 1 41 41 VAL H H 41 8.680 8.680 8.605 0.075 19799
1925 1 7 . 1 1 42 42 GLY N N 42 116.069 116.069 116.519 -0.450 19799
1926 1 7 . 1 1 42 42 GLY C C 42 173.772 173.772 173.547 0.225 19799
1927 1 7 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.707 -0.045 19799
1928 1 7 . 1 1 42 42 GLY H H 42 8.815 8.815 8.906 -0.091 19799
1929 1 7 . 1 1 43 43 GLN N N 43 124.343 124.343 121.883 2.460 19799
1930 1 7 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.971 -0.112 19799
1931 1 7 . 1 1 43 43 GLN C C 43 174.324 174.324 174.789 -0.465 19799
1932 1 7 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.566 1.289 19799
1933 1 7 . 1 1 43 43 GLN CB C 43 29.033 29.033 28.993 0.040 19799
1934 1 7 . 1 1 43 43 GLN H H 43 8.038 8.038 7.455 0.583 19799
1935 1 7 . 1 1 44 44 LYS N N 44 126.564 126.564 128.982 -2.418 19799
1936 1 7 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.742 0.111 19799
1937 1 7 . 1 1 44 44 LYS C C 44 176.019 176.019 175.587 0.432 19799
1938 1 7 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.587 -0.047 19799
1939 1 7 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.797 0.211 19799
1940 1 7 . 1 1 44 44 LYS H H 44 8.633 8.633 8.467 0.166 19799
1941 1 7 . 1 1 45 45 LEU N N 45 126.114 126.114 125.550 0.564 19799
1942 1 7 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.076 -0.357 19799
1943 1 7 . 1 1 45 45 LEU C C 45 176.670 176.670 175.576 1.094 19799
1944 1 7 . 1 1 45 45 LEU CA C 45 53.094 53.094 51.848 1.246 19799
1945 1 7 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.111 0.991 19799
1946 1 7 . 1 1 45 45 LEU H H 45 9.458 9.458 9.092 0.366 19799
1947 1 7 . 1 1 46 46 ILE N N 46 123.782 123.782 122.763 1.019 19799
1948 1 7 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.347 -0.489 19799
1949 1 7 . 1 1 46 46 ILE C C 46 176.810 176.810 175.587 1.223 19799
1950 1 7 . 1 1 46 46 ILE CA C 46 62.646 62.646 60.904 1.742 19799
1951 1 7 . 1 1 46 46 ILE CB C 46 39.156 39.156 36.329 2.827 19799
1952 1 7 . 1 1 46 46 ILE H H 46 10.038 10.038 9.409 0.629 19799
1953 1 7 . 1 1 47 47 VAL N N 47 117.819 117.819 127.421 -9.602 19799
1954 1 7 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.519 -0.012 19799
1955 1 7 . 1 1 47 47 VAL C C 47 173.753 173.753 173.089 0.664 19799
1956 1 7 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.618 0.013 19799
1957 1 7 . 1 1 47 47 VAL CB C 47 32.918 32.918 35.897 -2.979 19799
1958 1 7 . 1 1 47 47 VAL H H 47 8.268 8.268 8.960 -0.692 19799
1959 1 7 . 1 1 48 48 LYS N N 48 118.041 118.041 127.424 -9.383 19799
1960 1 7 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.349 -0.321 19799
1961 1 7 . 1 1 48 48 LYS C C 48 174.214 174.214 175.319 -1.105 19799
1962 1 7 . 1 1 48 48 LYS CA C 48 57.313 57.313 55.035 2.278 19799
1963 1 7 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.018 1.454 19799
1964 1 7 . 1 1 48 48 LYS H H 48 6.778 6.778 8.089 -1.311 19799
1965 1 7 . 1 1 49 49 LYS N N 49 124.877 124.877 126.482 -1.605 19799
1966 1 7 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.296 -0.113 19799
1967 1 7 . 1 1 49 49 LYS C C 49 176.704 176.704 176.746 -0.042 19799
1968 1 7 . 1 1 49 49 LYS CA C 49 54.753 54.753 57.143 -2.390 19799
1969 1 7 . 1 1 49 49 LYS CB C 49 33.181 33.181 31.658 1.523 19799
1970 1 7 . 1 1 49 49 LYS H H 49 7.204 7.204 8.659 -1.455 19799
1971 1 7 . 1 1 50 50 GLY N N 50 112.262 112.262 114.341 -2.079 19799
1972 1 7 . 1 1 50 50 GLY C C 50 173.665 173.665 173.840 -0.175 19799
1973 1 7 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.126 0.013 19799
1974 1 7 . 1 1 50 50 GLY H H 50 8.363 8.363 8.723 -0.360 19799
1975 1 8 . 1 1 2 2 THR N N 2 113.079 113.079 115.784 -2.705 19799
1976 1 8 . 1 1 2 2 THR HA H 2 4.349 4.349 4.227 0.122 19799
1977 1 8 . 1 1 2 2 THR C C 2 174.385 174.385 174.650 -0.265 19799
1978 1 8 . 1 1 2 2 THR CA C 2 61.412 61.412 62.691 -1.279 19799
1979 1 8 . 1 1 2 2 THR CB C 2 70.028 70.028 69.318 0.710 19799
1980 1 8 . 1 1 2 2 THR H H 2 8.033 8.033 8.067 -0.034 19799
1981 1 8 . 1 1 3 3 ASN N N 3 121.005 121.005 119.499 1.506 19799
1982 1 8 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.586 0.211 19799
1983 1 8 . 1 1 3 3 ASN C C 3 174.634 174.634 173.921 0.713 19799
1984 1 8 . 1 1 3 3 ASN CA C 3 52.504 52.504 53.163 -0.658 19799
1985 1 8 . 1 1 3 3 ASN CB C 3 39.620 39.620 39.363 0.257 19799
1986 1 8 . 1 1 3 3 ASN H H 3 8.403 8.403 7.813 0.590 19799
1987 1 8 . 1 1 4 4 THR N N 4 117.293 117.293 114.794 2.499 19799
1988 1 8 . 1 1 4 4 THR HA H 4 4.349 4.349 4.390 -0.041 19799
1989 1 8 . 1 1 4 4 THR C C 4 172.910 172.910 173.047 -0.137 19799
1990 1 8 . 1 1 4 4 THR CA C 4 62.524 62.524 61.071 1.453 19799
1991 1 8 . 1 1 4 4 THR CB C 4 69.624 69.624 70.983 -1.359 19799
1992 1 8 . 1 1 4 4 THR H H 4 8.264 8.264 7.797 0.467 19799
1993 1 8 . 1 1 5 5 TYR N N 5 125.362 125.362 119.724 5.638 19799
1994 1 8 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.082 0.455 19799
1995 1 8 . 1 1 5 5 TYR C C 5 174.901 174.901 173.589 1.312 19799
1996 1 8 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.219 1.622 19799
1997 1 8 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.329 0.615 19799
1998 1 8 . 1 1 5 5 TYR H H 5 8.887 8.887 7.797 1.090 19799
1999 1 8 . 1 1 6 6 TYR N N 6 123.590 123.590 123.097 0.493 19799
2000 1 8 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.951 -0.363 19799
2001 1 8 . 1 1 6 6 TYR C C 6 173.568 173.568 173.845 -0.277 19799
2002 1 8 . 1 1 6 6 TYR CA C 6 57.479 57.479 56.652 0.827 19799
2003 1 8 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.812 1.351 19799
2004 1 8 . 1 1 6 6 TYR H H 6 9.338 9.338 9.196 0.142 19799
2005 1 8 . 1 1 7 7 THR N N 7 124.727 124.727 118.366 6.361 19799
2006 1 8 . 1 1 7 7 THR HA H 7 4.701 4.701 4.524 0.177 19799
2007 1 8 . 1 1 7 7 THR C C 7 172.279 172.279 174.226 -1.947 19799
2008 1 8 . 1 1 7 7 THR CA C 7 61.635 61.635 60.745 0.890 19799
2009 1 8 . 1 1 7 7 THR CB C 7 68.780 68.780 68.690 0.090 19799
2010 1 8 . 1 1 7 7 THR H H 7 7.482 7.482 8.121 -0.639 19799
2011 1 8 . 1 1 8 8 VAL N N 8 126.420 126.420 126.921 -0.501 19799
2012 1 8 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.584 0.156 19799
2013 1 8 . 1 1 8 8 VAL C C 8 176.689 176.689 175.262 1.427 19799
2014 1 8 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.103 0.587 19799
2015 1 8 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.368 0.569 19799
2016 1 8 . 1 1 8 8 VAL H H 8 8.660 8.660 8.597 0.063 19799
2017 1 8 . 1 1 9 9 LYS N N 9 130.614 130.614 128.933 1.681 19799
2018 1 8 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.479 0.191 19799
2019 1 8 . 1 1 9 9 LYS C C 9 176.438 176.438 175.193 1.245 19799
2020 1 8 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.103 0.312 19799
2021 1 8 . 1 1 9 9 LYS CB C 9 35.596 35.596 34.395 1.202 19799
2022 1 8 . 1 1 9 9 LYS H H 9 9.297 9.297 8.450 0.847 19799
2023 1 8 . 1 1 10 10 SER N N 10 116.022 116.022 114.752 1.270 19799
2024 1 8 . 1 1 10 10 SER HA H 10 4.050 4.050 4.322 -0.272 19799
2025 1 8 . 1 1 10 10 SER C C 10 175.932 175.932 174.931 1.001 19799
2026 1 8 . 1 1 10 10 SER CA C 10 60.451 60.451 59.828 0.624 19799
2027 1 8 . 1 1 10 10 SER CB C 10 62.680 62.680 62.681 -0.001 19799
2028 1 8 . 1 1 10 10 SER H H 10 8.766 8.766 8.490 0.276 19799
2029 1 8 . 1 1 11 11 GLY N N 11 116.079 116.079 112.121 3.958 19799
2030 1 8 . 1 1 11 11 GLY C C 11 174.938 174.938 174.955 -0.017 19799
2031 1 8 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.790 0.300 19799
2032 1 8 . 1 1 11 11 GLY H H 11 9.067 9.067 8.117 0.950 19799
2033 1 8 . 1 1 12 12 ASP N N 12 120.579 120.579 118.177 2.402 19799
2034 1 8 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.466 0.147 19799
2035 1 8 . 1 1 12 12 ASP C C 12 176.265 176.265 175.814 0.451 19799
2036 1 8 . 1 1 12 12 ASP CA C 12 56.030 56.030 55.186 0.844 19799
2037 1 8 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.253 1.592 19799
2038 1 8 . 1 1 12 12 ASP H H 12 7.963 7.963 8.799 -0.836 19799
2039 1 8 . 1 1 13 13 THR N N 13 106.911 106.911 113.247 -6.336 19799
2040 1 8 . 1 1 13 13 THR HA H 13 4.657 4.657 4.653 0.004 19799
2041 1 8 . 1 1 13 13 THR C C 13 174.774 174.774 175.181 -0.407 19799
2042 1 8 . 1 1 13 13 THR CA C 13 58.612 58.612 60.859 -2.247 19799
2043 1 8 . 1 1 13 13 THR CB C 13 72.416 72.416 72.241 0.175 19799
2044 1 8 . 1 1 13 13 THR H H 13 6.809 6.809 7.446 -0.637 19799
2045 1 8 . 1 1 14 14 LEU N N 14 122.612 122.612 123.563 -0.951 19799
2046 1 8 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.894 0.006 19799
2047 1 8 . 1 1 14 14 LEU C C 14 178.071 178.071 178.375 -0.304 19799
2048 1 8 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.690 -1.230 19799
2049 1 8 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.504 0.270 19799
2050 1 8 . 1 1 14 14 LEU H H 14 9.478 9.478 9.061 0.417 19799
2051 1 8 . 1 1 15 15 ASN N N 15 114.945 114.945 115.348 -0.403 19799
2052 1 8 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.404 -0.261 19799
2053 1 8 . 1 1 15 15 ASN C C 15 177.943 177.943 177.363 0.580 19799
2054 1 8 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.140 0.405 19799
2055 1 8 . 1 1 15 15 ASN CB C 15 38.146 38.146 36.990 1.156 19799
2056 1 8 . 1 1 15 15 ASN H H 15 8.471 8.471 8.905 -0.434 19799
2057 1 8 . 1 1 16 16 LYS N N 16 121.113 121.113 120.617 0.496 19799
2058 1 8 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.103 -0.070 19799
2059 1 8 . 1 1 16 16 LYS C C 16 179.167 179.167 179.012 0.155 19799
2060 1 8 . 1 1 16 16 LYS CA C 16 59.702 59.702 59.028 0.674 19799
2061 1 8 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.730 0.762 19799
2062 1 8 . 1 1 16 16 LYS H H 16 7.725 7.725 7.543 0.182 19799
2063 1 8 . 1 1 17 17 ILE N N 17 121.712 121.712 116.159 5.553 19799
2064 1 8 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.678 -0.168 19799
2065 1 8 . 1 1 17 17 ILE C C 17 177.445 177.445 177.195 0.250 19799
2066 1 8 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.301 0.881 19799
2067 1 8 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.597 1.041 19799
2068 1 8 . 1 1 17 17 ILE H H 17 7.933 7.933 8.029 -0.096 19799
2069 1 8 . 1 1 18 18 ALA N N 18 121.562 121.562 122.363 -0.801 19799
2070 1 8 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.973 -0.131 19799
2071 1 8 . 1 1 18 18 ALA C C 18 179.665 179.665 179.006 0.659 19799
2072 1 8 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.081 0.398 19799
2073 1 8 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.301 -0.268 19799
2074 1 8 . 1 1 18 18 ALA H H 18 8.401 8.401 8.149 0.252 19799
2075 1 8 . 1 1 19 19 ALA N N 19 117.623 117.623 118.853 -1.230 19799
2076 1 8 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.029 0.137 19799
2077 1 8 . 1 1 19 19 ALA C C 19 180.714 180.714 179.463 1.251 19799
2078 1 8 . 1 1 19 19 ALA CA C 19 54.508 54.508 54.011 0.497 19799
2079 1 8 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.220 -0.171 19799
2080 1 8 . 1 1 19 19 ALA H H 19 7.500 7.500 7.508 -0.008 19799
2081 1 8 . 1 1 20 20 GLN N N 20 118.679 118.679 117.761 0.918 19799
2082 1 8 . 1 1 20 20 GLN HA H 20 3.856 3.856 3.991 -0.135 19799
2083 1 8 . 1 1 20 20 GLN C C 20 177.608 177.608 177.633 -0.025 19799
2084 1 8 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.037 0.433 19799
2085 1 8 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.904 -0.622 19799
2086 1 8 . 1 1 20 20 GLN H H 20 7.941 7.941 7.465 0.476 19799
2087 1 8 . 1 1 21 21 TYR N N 21 113.907 113.907 113.100 0.807 19799
2088 1 8 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.827 -0.461 19799
2089 1 8 . 1 1 21 21 TYR C C 21 175.496 175.496 175.787 -0.291 19799
2090 1 8 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.910 4.126 19799
2091 1 8 . 1 1 21 21 TYR CB C 21 39.198 39.198 37.980 1.218 19799
2092 1 8 . 1 1 21 21 TYR H H 21 7.669 7.669 6.986 0.683 19799
2093 1 8 . 1 1 22 22 GLY N N 22 111.326 111.326 108.669 2.657 19799
2094 1 8 . 1 1 22 22 GLY C C 22 174.783 174.783 173.565 1.218 19799
2095 1 8 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.417 2.033 19799
2096 1 8 . 1 1 22 22 GLY H H 22 7.949 7.949 7.796 0.153 19799
2097 1 8 . 1 1 23 23 VAL N N 23 113.949 113.949 117.891 -3.942 19799
2098 1 8 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.549 0.258 19799
2099 1 8 . 1 1 23 23 VAL C C 23 173.768 173.768 173.939 -0.171 19799
2100 1 8 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.735 -1.301 19799
2101 1 8 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.371 -0.410 19799
2102 1 8 . 1 1 23 23 VAL H H 23 8.040 8.040 8.313 -0.273 19799
2103 1 8 . 1 1 24 24 SER N N 24 115.672 115.672 118.720 -3.048 19799
2104 1 8 . 1 1 24 24 SER HA H 24 4.655 4.655 4.713 -0.058 19799
2105 1 8 . 1 1 24 24 SER C C 24 176.015 176.015 175.678 0.337 19799
2106 1 8 . 1 1 24 24 SER CA C 24 56.111 56.111 56.846 -0.735 19799
2107 1 8 . 1 1 24 24 SER CB C 24 65.385 65.385 64.359 1.026 19799
2108 1 8 . 1 1 24 24 SER H H 24 8.269 8.269 8.014 0.255 19799
2109 1 8 . 1 1 25 25 VAL N N 25 122.227 122.227 124.385 -2.158 19799
2110 1 8 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.671 -0.294 19799
2111 1 8 . 1 1 25 25 VAL C C 25 177.775 177.775 177.707 0.068 19799
2112 1 8 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.518 0.622 19799
2113 1 8 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.314 0.056 19799
2114 1 8 . 1 1 25 25 VAL H H 25 8.866 8.866 8.829 0.037 19799
2115 1 8 . 1 1 26 26 ALA N N 26 120.890 120.890 121.986 -1.096 19799
2116 1 8 . 1 1 26 26 ALA HA H 26 3.914 3.914 4.063 -0.149 19799
2117 1 8 . 1 1 26 26 ALA C C 26 180.692 180.692 179.156 1.536 19799
2118 1 8 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.578 -0.265 19799
2119 1 8 . 1 1 26 26 ALA CB C 26 17.825 17.825 17.932 -0.107 19799
2120 1 8 . 1 1 26 26 ALA H H 26 8.218 8.218 8.437 -0.219 19799
2121 1 8 . 1 1 27 27 ASN N N 27 118.099 118.099 116.339 1.760 19799
2122 1 8 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.159 -0.456 19799
2123 1 8 . 1 1 27 27 ASN C C 27 175.308 175.308 176.855 -1.547 19799
2124 1 8 . 1 1 27 27 ASN CA C 27 55.220 55.220 54.870 0.350 19799
2125 1 8 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.185 -0.321 19799
2126 1 8 . 1 1 27 27 ASN H H 27 7.846 7.846 7.815 0.031 19799
2127 1 8 . 1 1 28 28 LEU N N 28 116.512 116.512 118.734 -2.222 19799
2128 1 8 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.933 -0.190 19799
2129 1 8 . 1 1 28 28 LEU C C 28 181.142 181.142 178.823 2.319 19799
2130 1 8 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.492 0.765 19799
2131 1 8 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.297 0.788 19799
2132 1 8 . 1 1 28 28 LEU H H 28 7.475 7.475 7.518 -0.043 19799
2133 1 8 . 1 1 29 29 ARG N N 29 117.344 117.344 119.484 -2.140 19799
2134 1 8 . 1 1 29 29 ARG HA H 29 3.952 3.952 4.043 -0.091 19799
2135 1 8 . 1 1 29 29 ARG C C 29 178.818 178.818 178.922 -0.104 19799
2136 1 8 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.541 1.242 19799
2137 1 8 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.890 0.170 19799
2138 1 8 . 1 1 29 29 ARG H H 29 8.571 8.571 8.222 0.349 19799
2139 1 8 . 1 1 30 30 SER N N 30 114.887 114.887 115.775 -0.888 19799
2140 1 8 . 1 1 30 30 SER HA H 30 4.255 4.255 4.252 0.003 19799
2141 1 8 . 1 1 30 30 SER C C 30 178.552 178.552 176.367 2.185 19799
2142 1 8 . 1 1 30 30 SER CA C 30 61.314 61.314 61.465 -0.152 19799
2143 1 8 . 1 1 30 30 SER CB C 30 62.982 62.982 62.903 0.079 19799
2144 1 8 . 1 1 30 30 SER H H 30 7.995 7.995 7.545 0.450 19799
2145 1 8 . 1 1 31 31 TRP N N 31 119.302 119.302 120.108 -0.806 19799
2146 1 8 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.719 0.066 19799
2147 1 8 . 1 1 31 31 TRP C C 31 177.570 177.570 176.286 1.284 19799
2148 1 8 . 1 1 31 31 TRP CA C 31 57.005 57.005 57.771 -0.766 19799
2149 1 8 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.253 1.675 19799
2150 1 8 . 1 1 31 31 TRP H H 31 9.055 9.055 7.485 1.570 19799
2151 1 8 . 1 1 32 32 ASN N N 32 109.665 109.665 117.494 -7.829 19799
2152 1 8 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.857 0.247 19799
2153 1 8 . 1 1 32 32 ASN C C 32 174.034 174.034 176.526 -2.492 19799
2154 1 8 . 1 1 32 32 ASN CA C 32 53.550 53.550 53.633 -0.083 19799
2155 1 8 . 1 1 32 32 ASN CB C 32 42.065 42.065 38.894 3.171 19799
2156 1 8 . 1 1 32 32 ASN H H 32 7.232 7.232 7.725 -0.493 19799
2157 1 8 . 1 1 33 33 GLY N N 33 111.582 111.582 109.596 1.986 19799
2158 1 8 . 1 1 33 33 GLY C C 33 174.930 174.930 174.197 0.733 19799
2159 1 8 . 1 1 33 33 GLY CA C 33 47.611 47.611 45.921 1.690 19799
2160 1 8 . 1 1 33 33 GLY H H 33 7.864 7.864 7.939 -0.075 19799
2161 1 8 . 1 1 34 34 ILE N N 34 118.759 118.759 120.774 -2.015 19799
2162 1 8 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.328 -0.112 19799
2163 1 8 . 1 1 34 34 ILE C C 34 175.882 175.882 175.512 0.370 19799
2164 1 8 . 1 1 34 34 ILE CA C 34 60.719 60.719 58.656 2.063 19799
2165 1 8 . 1 1 34 34 ILE CB C 34 40.553 40.553 39.471 1.082 19799
2166 1 8 . 1 1 34 34 ILE H H 34 7.918 7.918 7.640 0.278 19799
2167 1 8 . 1 1 35 35 SER N N 35 122.217 122.217 122.827 -0.610 19799
2168 1 8 . 1 1 35 35 SER HA H 35 4.583 4.583 4.489 0.094 19799
2169 1 8 . 1 1 35 35 SER C C 35 174.848 174.848 175.579 -0.731 19799
2170 1 8 . 1 1 35 35 SER CA C 35 57.461 57.461 58.876 -1.415 19799
2171 1 8 . 1 1 35 35 SER CB C 35 63.929 63.929 63.674 0.255 19799
2172 1 8 . 1 1 35 35 SER H H 35 8.801 8.801 8.998 -0.197 19799
2173 1 8 . 1 1 36 36 GLY N N 36 114.644 114.644 113.587 1.057 19799
2174 1 8 . 1 1 36 36 GLY C C 36 173.365 173.365 175.104 -1.739 19799
2175 1 8 . 1 1 36 36 GLY CA C 36 46.088 46.088 46.005 0.083 19799
2176 1 8 . 1 1 36 36 GLY H H 36 8.614 8.614 9.119 -0.505 19799
2177 1 8 . 1 1 37 37 ASP N N 37 122.530 122.530 121.202 1.328 19799
2178 1 8 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.476 0.434 19799
2179 1 8 . 1 1 37 37 ASP C C 37 175.986 175.986 177.064 -1.078 19799
2180 1 8 . 1 1 37 37 ASP CA C 37 53.560 53.560 56.076 -2.516 19799
2181 1 8 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.782 1.176 19799
2182 1 8 . 1 1 37 37 ASP H H 37 8.537 8.537 8.440 0.097 19799
2183 1 8 . 1 1 38 38 LEU N N 38 121.818 121.818 116.162 5.656 19799
2184 1 8 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.692 -0.363 19799
2185 1 8 . 1 1 38 38 LEU C C 38 175.373 175.373 176.183 -0.810 19799
2186 1 8 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.725 1.566 19799
2187 1 8 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.252 0.616 19799
2188 1 8 . 1 1 38 38 LEU H H 38 7.602 7.602 7.541 0.061 19799
2189 1 8 . 1 1 39 39 ILE N N 39 118.291 118.291 121.838 -3.547 19799
2190 1 8 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.532 0.366 19799
2191 1 8 . 1 1 39 39 ILE C C 39 174.861 174.861 175.492 -0.631 19799
2192 1 8 . 1 1 39 39 ILE CA C 39 59.354 59.354 61.438 -2.084 19799
2193 1 8 . 1 1 39 39 ILE CB C 39 42.014 42.014 38.816 3.199 19799
2194 1 8 . 1 1 39 39 ILE H H 39 7.708 7.708 7.403 0.305 19799
2195 1 8 . 1 1 40 40 PHE N N 40 118.274 118.274 123.678 -5.404 19799
2196 1 8 . 1 1 40 40 PHE HA H 40 5.051 5.051 5.021 0.030 19799
2197 1 8 . 1 1 40 40 PHE C C 40 174.537 174.537 173.220 1.317 19799
2198 1 8 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.183 0.255 19799
2199 1 8 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.574 1.406 19799
2200 1 8 . 1 1 40 40 PHE H H 40 8.195 8.195 8.355 -0.160 19799
2201 1 8 . 1 1 41 41 VAL N N 41 121.812 121.812 121.916 -0.104 19799
2202 1 8 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.043 -0.823 19799
2203 1 8 . 1 1 41 41 VAL C C 41 177.510 177.510 177.189 0.321 19799
2204 1 8 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.199 1.448 19799
2205 1 8 . 1 1 41 41 VAL CB C 41 31.030 31.030 31.367 -0.337 19799
2206 1 8 . 1 1 41 41 VAL H H 41 8.680 8.680 8.585 0.095 19799
2207 1 8 . 1 1 42 42 GLY N N 42 116.069 116.069 115.259 0.810 19799
2208 1 8 . 1 1 42 42 GLY C C 42 173.772 173.772 173.504 0.268 19799
2209 1 8 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.469 0.192 19799
2210 1 8 . 1 1 42 42 GLY H H 42 8.815 8.815 8.512 0.303 19799
2211 1 8 . 1 1 43 43 GLN N N 43 124.343 124.343 121.582 2.761 19799
2212 1 8 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.922 -0.063 19799
2213 1 8 . 1 1 43 43 GLN C C 43 174.324 174.324 174.688 -0.364 19799
2214 1 8 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.783 1.071 19799
2215 1 8 . 1 1 43 43 GLN CB C 43 29.033 29.033 29.167 -0.134 19799
2216 1 8 . 1 1 43 43 GLN H H 43 8.038 8.038 7.218 0.820 19799
2217 1 8 . 1 1 44 44 LYS N N 44 126.564 126.564 128.923 -2.359 19799
2218 1 8 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.656 0.197 19799
2219 1 8 . 1 1 44 44 LYS C C 44 176.019 176.019 175.513 0.506 19799
2220 1 8 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.505 0.036 19799
2221 1 8 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.669 0.339 19799
2222 1 8 . 1 1 44 44 LYS H H 44 8.633 8.633 8.414 0.219 19799
2223 1 8 . 1 1 45 45 LEU N N 45 126.114 126.114 125.285 0.829 19799
2224 1 8 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.044 -0.325 19799
2225 1 8 . 1 1 45 45 LEU C C 45 176.670 176.670 175.530 1.140 19799
2226 1 8 . 1 1 45 45 LEU CA C 45 53.094 53.094 51.719 1.375 19799
2227 1 8 . 1 1 45 45 LEU CB C 45 45.102 45.102 43.871 1.231 19799
2228 1 8 . 1 1 45 45 LEU H H 45 9.458 9.458 8.932 0.526 19799
2229 1 8 . 1 1 46 46 ILE N N 46 123.782 123.782 123.487 0.295 19799
2230 1 8 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.261 -0.403 19799
2231 1 8 . 1 1 46 46 ILE C C 46 176.810 176.810 175.460 1.350 19799
2232 1 8 . 1 1 46 46 ILE CA C 46 62.646 62.646 62.453 0.193 19799
2233 1 8 . 1 1 46 46 ILE CB C 46 39.156 39.156 37.582 1.574 19799
2234 1 8 . 1 1 46 46 ILE H H 46 10.038 10.038 9.221 0.817 19799
2235 1 8 . 1 1 47 47 VAL N N 47 117.819 117.819 125.848 -8.029 19799
2236 1 8 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.507 0.000 19799
2237 1 8 . 1 1 47 47 VAL C C 47 173.753 173.753 173.015 0.738 19799
2238 1 8 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.759 -0.128 19799
2239 1 8 . 1 1 47 47 VAL CB C 47 32.918 32.918 34.806 -1.888 19799
2240 1 8 . 1 1 47 47 VAL H H 47 8.268 8.268 8.943 -0.675 19799
2241 1 8 . 1 1 48 48 LYS N N 48 118.041 118.041 127.289 -9.248 19799
2242 1 8 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.363 -0.335 19799
2243 1 8 . 1 1 48 48 LYS C C 48 174.214 174.214 174.745 -0.531 19799
2244 1 8 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.778 2.535 19799
2245 1 8 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.573 0.899 19799
2246 1 8 . 1 1 48 48 LYS H H 48 6.778 6.778 8.065 -1.287 19799
2247 1 8 . 1 1 49 49 LYS N N 49 124.877 124.877 126.808 -1.931 19799
2248 1 8 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.355 -0.172 19799
2249 1 8 . 1 1 49 49 LYS C C 49 176.704 176.704 176.848 -0.144 19799
2250 1 8 . 1 1 49 49 LYS CA C 49 54.753 54.753 56.359 -1.606 19799
2251 1 8 . 1 1 49 49 LYS CB C 49 33.181 33.181 31.203 1.978 19799
2252 1 8 . 1 1 49 49 LYS H H 49 7.204 7.204 8.568 -1.364 19799
2253 1 8 . 1 1 50 50 GLY N N 50 112.262 112.262 114.807 -2.545 19799
2254 1 8 . 1 1 50 50 GLY C C 50 173.665 173.665 173.363 0.302 19799
2255 1 8 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.150 -0.012 19799
2256 1 8 . 1 1 50 50 GLY H H 50 8.363 8.363 8.589 -0.226 19799
2257 1 9 . 1 1 2 2 THR N N 2 113.079 113.079 115.967 -2.888 19799
2258 1 9 . 1 1 2 2 THR HA H 2 4.349 4.349 4.253 0.096 19799
2259 1 9 . 1 1 2 2 THR C C 2 174.385 174.385 174.377 0.008 19799
2260 1 9 . 1 1 2 2 THR CA C 2 61.412 61.412 61.632 -0.220 19799
2261 1 9 . 1 1 2 2 THR CB C 2 70.028 70.028 67.982 2.046 19799
2262 1 9 . 1 1 2 2 THR H H 2 8.033 8.033 8.138 -0.105 19799
2263 1 9 . 1 1 3 3 ASN N N 3 121.005 121.005 123.641 -2.636 19799
2264 1 9 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.660 0.137 19799
2265 1 9 . 1 1 3 3 ASN C C 3 174.634 174.634 175.164 -0.530 19799
2266 1 9 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.980 -0.476 19799
2267 1 9 . 1 1 3 3 ASN CB C 3 39.620 39.620 39.155 0.465 19799
2268 1 9 . 1 1 3 3 ASN H H 3 8.403 8.403 7.927 0.476 19799
2269 1 9 . 1 1 4 4 THR N N 4 117.293 117.293 115.944 1.349 19799
2270 1 9 . 1 1 4 4 THR HA H 4 4.349 4.349 4.270 0.079 19799
2271 1 9 . 1 1 4 4 THR C C 4 172.910 172.910 173.109 -0.199 19799
2272 1 9 . 1 1 4 4 THR CA C 4 62.524 62.524 61.384 1.140 19799
2273 1 9 . 1 1 4 4 THR CB C 4 69.624 69.624 70.300 -0.676 19799
2274 1 9 . 1 1 4 4 THR H H 4 8.264 8.264 7.981 0.283 19799
2275 1 9 . 1 1 5 5 TYR N N 5 125.362 125.362 119.572 5.790 19799
2276 1 9 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.158 0.379 19799
2277 1 9 . 1 1 5 5 TYR C C 5 174.901 174.901 173.850 1.051 19799
2278 1 9 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.359 1.482 19799
2279 1 9 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.137 0.807 19799
2280 1 9 . 1 1 5 5 TYR H H 5 8.887 8.887 7.628 1.259 19799
2281 1 9 . 1 1 6 6 TYR N N 6 123.590 123.590 123.543 0.047 19799
2282 1 9 . 1 1 6 6 TYR HA H 6 4.588 4.588 5.015 -0.427 19799
2283 1 9 . 1 1 6 6 TYR C C 6 173.568 173.568 174.111 -0.543 19799
2284 1 9 . 1 1 6 6 TYR CA C 6 57.479 57.479 56.072 1.407 19799
2285 1 9 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.490 1.673 19799
2286 1 9 . 1 1 6 6 TYR H H 6 9.338 9.338 9.253 0.085 19799
2287 1 9 . 1 1 7 7 THR N N 7 124.727 124.727 119.813 4.914 19799
2288 1 9 . 1 1 7 7 THR HA H 7 4.701 4.701 4.397 0.304 19799
2289 1 9 . 1 1 7 7 THR C C 7 172.279 172.279 173.705 -1.426 19799
2290 1 9 . 1 1 7 7 THR CA C 7 61.635 61.635 60.747 0.888 19799
2291 1 9 . 1 1 7 7 THR CB C 7 68.780 68.780 68.998 -0.218 19799
2292 1 9 . 1 1 7 7 THR H H 7 7.482 7.482 8.193 -0.711 19799
2293 1 9 . 1 1 8 8 VAL N N 8 126.420 126.420 127.600 -1.180 19799
2294 1 9 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.543 0.197 19799
2295 1 9 . 1 1 8 8 VAL C C 8 176.689 176.689 175.618 1.071 19799
2296 1 9 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.394 0.297 19799
2297 1 9 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.066 0.871 19799
2298 1 9 . 1 1 8 8 VAL H H 8 8.660 8.660 8.727 -0.067 19799
2299 1 9 . 1 1 9 9 LYS N N 9 130.614 130.614 128.785 1.829 19799
2300 1 9 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.646 0.024 19799
2301 1 9 . 1 1 9 9 LYS C C 9 176.438 176.438 175.809 0.629 19799
2302 1 9 . 1 1 9 9 LYS CA C 9 54.415 54.415 53.115 1.300 19799
2303 1 9 . 1 1 9 9 LYS CB C 9 35.596 35.596 34.670 0.926 19799
2304 1 9 . 1 1 9 9 LYS H H 9 9.297 9.297 8.240 1.057 19799
2305 1 9 . 1 1 10 10 SER N N 10 116.022 116.022 116.283 -0.261 19799
2306 1 9 . 1 1 10 10 SER HA H 10 4.050 4.050 4.216 -0.166 19799
2307 1 9 . 1 1 10 10 SER C C 10 175.932 175.932 175.021 0.911 19799
2308 1 9 . 1 1 10 10 SER CA C 10 60.451 60.451 60.133 0.318 19799
2309 1 9 . 1 1 10 10 SER CB C 10 62.680 62.680 63.026 -0.346 19799
2310 1 9 . 1 1 10 10 SER H H 10 8.766 8.766 8.477 0.289 19799
2311 1 9 . 1 1 11 11 GLY N N 11 116.079 116.079 112.217 3.862 19799
2312 1 9 . 1 1 11 11 GLY C C 11 174.938 174.938 174.660 0.278 19799
2313 1 9 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.602 0.488 19799
2314 1 9 . 1 1 11 11 GLY H H 11 9.067 9.067 8.333 0.734 19799
2315 1 9 . 1 1 12 12 ASP N N 12 120.579 120.579 117.747 2.832 19799
2316 1 9 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.424 0.189 19799
2317 1 9 . 1 1 12 12 ASP C C 12 176.265 176.265 175.893 0.372 19799
2318 1 9 . 1 1 12 12 ASP CA C 12 56.030 56.030 54.710 1.320 19799
2319 1 9 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.493 1.352 19799
2320 1 9 . 1 1 12 12 ASP H H 12 7.963 7.963 8.713 -0.750 19799
2321 1 9 . 1 1 13 13 THR N N 13 106.911 106.911 113.008 -6.097 19799
2322 1 9 . 1 1 13 13 THR HA H 13 4.657 4.657 4.582 0.075 19799
2323 1 9 . 1 1 13 13 THR C C 13 174.774 174.774 175.358 -0.584 19799
2324 1 9 . 1 1 13 13 THR CA C 13 58.612 58.612 60.833 -2.221 19799
2325 1 9 . 1 1 13 13 THR CB C 13 72.416 72.416 72.006 0.410 19799
2326 1 9 . 1 1 13 13 THR H H 13 6.809 6.809 7.443 -0.634 19799
2327 1 9 . 1 1 14 14 LEU N N 14 122.612 122.612 123.998 -1.386 19799
2328 1 9 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.882 0.018 19799
2329 1 9 . 1 1 14 14 LEU C C 14 178.071 178.071 178.251 -0.180 19799
2330 1 9 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.495 -1.035 19799
2331 1 9 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.638 0.136 19799
2332 1 9 . 1 1 14 14 LEU H H 14 9.478 9.478 8.837 0.641 19799
2333 1 9 . 1 1 15 15 ASN N N 15 114.945 114.945 115.108 -0.163 19799
2334 1 9 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.400 -0.257 19799
2335 1 9 . 1 1 15 15 ASN C C 15 177.943 177.943 177.404 0.539 19799
2336 1 9 . 1 1 15 15 ASN CA C 15 56.545 56.545 56.092 0.453 19799
2337 1 9 . 1 1 15 15 ASN CB C 15 38.146 38.146 36.945 1.201 19799
2338 1 9 . 1 1 15 15 ASN H H 15 8.471 8.471 8.790 -0.319 19799
2339 1 9 . 1 1 16 16 LYS N N 16 121.113 121.113 120.598 0.515 19799
2340 1 9 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.143 -0.110 19799
2341 1 9 . 1 1 16 16 LYS C C 16 179.167 179.167 178.927 0.240 19799
2342 1 9 . 1 1 16 16 LYS CA C 16 59.702 59.702 58.358 1.345 19799
2343 1 9 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.458 1.034 19799
2344 1 9 . 1 1 16 16 LYS H H 16 7.725 7.725 7.596 0.129 19799
2345 1 9 . 1 1 17 17 ILE N N 17 121.712 121.712 115.711 6.001 19799
2346 1 9 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.880 -0.370 19799
2347 1 9 . 1 1 17 17 ILE C C 17 177.445 177.445 177.479 -0.034 19799
2348 1 9 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.195 0.987 19799
2349 1 9 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.546 1.092 19799
2350 1 9 . 1 1 17 17 ILE H H 17 7.933 7.933 7.952 -0.019 19799
2351 1 9 . 1 1 18 18 ALA N N 18 121.562 121.562 122.378 -0.816 19799
2352 1 9 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.947 -0.105 19799
2353 1 9 . 1 1 18 18 ALA C C 18 179.665 179.665 178.964 0.701 19799
2354 1 9 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.089 0.391 19799
2355 1 9 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.265 -0.232 19799
2356 1 9 . 1 1 18 18 ALA H H 18 8.401 8.401 8.071 0.330 19799
2357 1 9 . 1 1 19 19 ALA N N 19 117.623 117.623 119.523 -1.900 19799
2358 1 9 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.045 0.121 19799
2359 1 9 . 1 1 19 19 ALA C C 19 180.714 180.714 179.232 1.482 19799
2360 1 9 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.964 0.544 19799
2361 1 9 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.360 -0.311 19799
2362 1 9 . 1 1 19 19 ALA H H 19 7.500 7.500 7.625 -0.125 19799
2363 1 9 . 1 1 20 20 GLN N N 20 118.679 118.679 119.040 -0.361 19799
2364 1 9 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.004 -0.148 19799
2365 1 9 . 1 1 20 20 GLN C C 20 177.608 177.608 177.524 0.084 19799
2366 1 9 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.231 0.239 19799
2367 1 9 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.855 -0.573 19799
2368 1 9 . 1 1 20 20 GLN H H 20 7.941 7.941 7.462 0.479 19799
2369 1 9 . 1 1 21 21 TYR N N 21 113.907 113.907 113.156 0.751 19799
2370 1 9 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.823 -0.457 19799
2371 1 9 . 1 1 21 21 TYR C C 21 175.496 175.496 175.569 -0.073 19799
2372 1 9 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.907 4.129 19799
2373 1 9 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.128 1.070 19799
2374 1 9 . 1 1 21 21 TYR H H 21 7.669 7.669 6.989 0.680 19799
2375 1 9 . 1 1 22 22 GLY N N 22 111.326 111.326 108.835 2.491 19799
2376 1 9 . 1 1 22 22 GLY C C 22 174.783 174.783 173.475 1.308 19799
2377 1 9 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.376 2.074 19799
2378 1 9 . 1 1 22 22 GLY H H 22 7.949 7.949 7.809 0.140 19799
2379 1 9 . 1 1 23 23 VAL N N 23 113.949 113.949 118.476 -4.527 19799
2380 1 9 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.485 0.322 19799
2381 1 9 . 1 1 23 23 VAL C C 23 173.768 173.768 173.756 0.012 19799
2382 1 9 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.652 -1.218 19799
2383 1 9 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.777 -0.816 19799
2384 1 9 . 1 1 23 23 VAL H H 23 8.040 8.040 8.305 -0.265 19799
2385 1 9 . 1 1 24 24 SER N N 24 115.672 115.672 116.635 -0.963 19799
2386 1 9 . 1 1 24 24 SER HA H 24 4.655 4.655 4.768 -0.113 19799
2387 1 9 . 1 1 24 24 SER C C 24 176.015 176.015 175.824 0.191 19799
2388 1 9 . 1 1 24 24 SER CA C 24 56.111 56.111 55.993 0.118 19799
2389 1 9 . 1 1 24 24 SER CB C 24 65.385 65.385 64.432 0.953 19799
2390 1 9 . 1 1 24 24 SER H H 24 8.269 8.269 8.519 -0.250 19799
2391 1 9 . 1 1 25 25 VAL N N 25 122.227 122.227 126.396 -4.169 19799
2392 1 9 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.747 -0.370 19799
2393 1 9 . 1 1 25 25 VAL C C 25 177.775 177.775 177.265 0.510 19799
2394 1 9 . 1 1 25 25 VAL CA C 25 67.140 67.140 65.311 1.829 19799
2395 1 9 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.162 0.208 19799
2396 1 9 . 1 1 25 25 VAL H H 25 8.866 8.866 8.900 -0.034 19799
2397 1 9 . 1 1 26 26 ALA N N 26 120.890 120.890 122.008 -1.118 19799
2398 1 9 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.917 -0.003 19799
2399 1 9 . 1 1 26 26 ALA C C 26 180.692 180.692 178.619 2.073 19799
2400 1 9 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.779 -0.467 19799
2401 1 9 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.246 -0.421 19799
2402 1 9 . 1 1 26 26 ALA H H 26 8.218 8.218 7.787 0.431 19799
2403 1 9 . 1 1 27 27 ASN N N 27 118.099 118.099 116.415 1.684 19799
2404 1 9 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.027 -0.324 19799
2405 1 9 . 1 1 27 27 ASN C C 27 175.308 175.308 176.809 -1.501 19799
2406 1 9 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.247 -0.027 19799
2407 1 9 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.580 -0.716 19799
2408 1 9 . 1 1 27 27 ASN H H 27 7.846 7.846 7.590 0.256 19799
2409 1 9 . 1 1 28 28 LEU N N 28 116.512 116.512 117.898 -1.386 19799
2410 1 9 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.583 0.160 19799
2411 1 9 . 1 1 28 28 LEU C C 28 181.142 181.142 178.812 2.330 19799
2412 1 9 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.182 1.075 19799
2413 1 9 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.184 0.901 19799
2414 1 9 . 1 1 28 28 LEU H H 28 7.475 7.475 7.474 0.001 19799
2415 1 9 . 1 1 29 29 ARG N N 29 117.344 117.344 118.565 -1.221 19799
2416 1 9 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.928 0.024 19799
2417 1 9 . 1 1 29 29 ARG C C 29 178.818 178.818 178.850 -0.032 19799
2418 1 9 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.446 1.337 19799
2419 1 9 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.862 0.198 19799
2420 1 9 . 1 1 29 29 ARG H H 29 8.571 8.571 8.009 0.562 19799
2421 1 9 . 1 1 30 30 SER N N 30 114.887 114.887 114.598 0.289 19799
2422 1 9 . 1 1 30 30 SER HA H 30 4.255 4.255 4.218 0.037 19799
2423 1 9 . 1 1 30 30 SER C C 30 178.552 178.552 175.801 2.751 19799
2424 1 9 . 1 1 30 30 SER CA C 30 61.314 61.314 60.953 0.361 19799
2425 1 9 . 1 1 30 30 SER CB C 30 62.982 62.982 62.962 0.020 19799
2426 1 9 . 1 1 30 30 SER H H 30 7.995 7.995 7.150 0.845 19799
2427 1 9 . 1 1 31 31 TRP N N 31 119.302 119.302 118.655 0.647 19799
2428 1 9 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.818 -0.033 19799
2429 1 9 . 1 1 31 31 TRP C C 31 177.570 177.570 177.126 0.444 19799
2430 1 9 . 1 1 31 31 TRP CA C 31 57.005 57.005 56.091 0.914 19799
2431 1 9 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.920 1.008 19799
2432 1 9 . 1 1 31 31 TRP H H 31 9.055 9.055 7.149 1.906 19799
2433 1 9 . 1 1 32 32 ASN N N 32 109.665 109.665 118.773 -9.108 19799
2434 1 9 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.870 0.234 19799
2435 1 9 . 1 1 32 32 ASN C C 32 174.034 174.034 176.718 -2.684 19799
2436 1 9 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.594 -1.044 19799
2437 1 9 . 1 1 32 32 ASN CB C 32 42.065 42.065 39.433 2.632 19799
2438 1 9 . 1 1 32 32 ASN H H 32 7.232 7.232 7.604 -0.372 19799
2439 1 9 . 1 1 33 33 GLY N N 33 111.582 111.582 109.074 2.508 19799
2440 1 9 . 1 1 33 33 GLY C C 33 174.930 174.930 173.930 1.000 19799
2441 1 9 . 1 1 33 33 GLY CA C 33 47.611 47.611 46.057 1.554 19799
2442 1 9 . 1 1 33 33 GLY H H 33 7.864 7.864 7.953 -0.089 19799
2443 1 9 . 1 1 34 34 ILE N N 34 118.759 118.759 119.275 -0.516 19799
2444 1 9 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.315 -0.099 19799
2445 1 9 . 1 1 34 34 ILE C C 34 175.882 175.882 175.312 0.570 19799
2446 1 9 . 1 1 34 34 ILE CA C 34 60.719 60.719 59.447 1.272 19799
2447 1 9 . 1 1 34 34 ILE CB C 34 40.553 40.553 40.875 -0.322 19799
2448 1 9 . 1 1 34 34 ILE H H 34 7.918 7.918 7.390 0.528 19799
2449 1 9 . 1 1 35 35 SER N N 35 122.217 122.217 120.383 1.834 19799
2450 1 9 . 1 1 35 35 SER HA H 35 4.583 4.583 4.427 0.156 19799
2451 1 9 . 1 1 35 35 SER C C 35 174.848 174.848 175.613 -0.765 19799
2452 1 9 . 1 1 35 35 SER CA C 35 57.461 57.461 58.773 -1.312 19799
2453 1 9 . 1 1 35 35 SER CB C 35 63.929 63.929 63.091 0.838 19799
2454 1 9 . 1 1 35 35 SER H H 35 8.801 8.801 8.762 0.039 19799
2455 1 9 . 1 1 36 36 GLY N N 36 114.644 114.644 112.675 1.969 19799
2456 1 9 . 1 1 36 36 GLY C C 36 173.365 173.365 173.860 -0.495 19799
2457 1 9 . 1 1 36 36 GLY CA C 36 46.088 46.088 45.590 0.498 19799
2458 1 9 . 1 1 36 36 GLY H H 36 8.614 8.614 8.716 -0.102 19799
2459 1 9 . 1 1 37 37 ASP N N 37 122.530 122.530 119.135 3.395 19799
2460 1 9 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.473 0.437 19799
2461 1 9 . 1 1 37 37 ASP C C 37 175.986 175.986 176.543 -0.557 19799
2462 1 9 . 1 1 37 37 ASP CA C 37 53.560 53.560 56.083 -2.523 19799
2463 1 9 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.860 1.098 19799
2464 1 9 . 1 1 37 37 ASP H H 37 8.537 8.537 8.057 0.480 19799
2465 1 9 . 1 1 38 38 LEU N N 38 121.818 121.818 117.372 4.446 19799
2466 1 9 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.712 -0.383 19799
2467 1 9 . 1 1 38 38 LEU C C 38 175.373 175.373 175.715 -0.342 19799
2468 1 9 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.434 1.857 19799
2469 1 9 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.407 0.461 19799
2470 1 9 . 1 1 38 38 LEU H H 38 7.602 7.602 7.342 0.260 19799
2471 1 9 . 1 1 39 39 ILE N N 39 118.291 118.291 124.532 -6.241 19799
2472 1 9 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.345 0.553 19799
2473 1 9 . 1 1 39 39 ILE C C 39 174.861 174.861 174.746 0.115 19799
2474 1 9 . 1 1 39 39 ILE CA C 39 59.354 59.354 60.802 -1.448 19799
2475 1 9 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.750 1.264 19799
2476 1 9 . 1 1 39 39 ILE H H 39 7.708 7.708 7.741 -0.033 19799
2477 1 9 . 1 1 40 40 PHE N N 40 118.274 118.274 122.465 -4.191 19799
2478 1 9 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.881 0.170 19799
2479 1 9 . 1 1 40 40 PHE C C 40 174.537 174.537 173.526 1.011 19799
2480 1 9 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.205 0.233 19799
2481 1 9 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.457 1.523 19799
2482 1 9 . 1 1 40 40 PHE H H 40 8.195 8.195 7.854 0.341 19799
2483 1 9 . 1 1 41 41 VAL N N 41 121.812 121.812 122.017 -0.205 19799
2484 1 9 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.070 -0.850 19799
2485 1 9 . 1 1 41 41 VAL C C 41 177.510 177.510 177.463 0.047 19799
2486 1 9 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.416 1.231 19799
2487 1 9 . 1 1 41 41 VAL CB C 41 31.030 31.030 30.536 0.494 19799
2488 1 9 . 1 1 41 41 VAL H H 41 8.680 8.680 8.586 0.094 19799
2489 1 9 . 1 1 42 42 GLY N N 42 116.069 116.069 116.482 -0.413 19799
2490 1 9 . 1 1 42 42 GLY C C 42 173.772 173.772 173.420 0.352 19799
2491 1 9 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.690 -0.028 19799
2492 1 9 . 1 1 42 42 GLY H H 42 8.815 8.815 8.864 -0.049 19799
2493 1 9 . 1 1 43 43 GLN N N 43 124.343 124.343 121.749 2.594 19799
2494 1 9 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.977 -0.118 19799
2495 1 9 . 1 1 43 43 GLN C C 43 174.324 174.324 174.776 -0.452 19799
2496 1 9 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.183 1.672 19799
2497 1 9 . 1 1 43 43 GLN CB C 43 29.033 29.033 28.977 0.056 19799
2498 1 9 . 1 1 43 43 GLN H H 43 8.038 8.038 7.320 0.718 19799
2499 1 9 . 1 1 44 44 LYS N N 44 126.564 126.564 129.272 -2.708 19799
2500 1 9 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.603 0.250 19799
2501 1 9 . 1 1 44 44 LYS C C 44 176.019 176.019 175.550 0.469 19799
2502 1 9 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.796 -0.255 19799
2503 1 9 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.642 0.366 19799
2504 1 9 . 1 1 44 44 LYS H H 44 8.633 8.633 8.523 0.110 19799
2505 1 9 . 1 1 45 45 LEU N N 45 126.114 126.114 125.878 0.236 19799
2506 1 9 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.087 -0.368 19799
2507 1 9 . 1 1 45 45 LEU C C 45 176.670 176.670 175.641 1.029 19799
2508 1 9 . 1 1 45 45 LEU CA C 45 53.094 53.094 51.827 1.268 19799
2509 1 9 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.182 0.920 19799
2510 1 9 . 1 1 45 45 LEU H H 45 9.458 9.458 9.098 0.360 19799
2511 1 9 . 1 1 46 46 ILE N N 46 123.782 123.782 123.089 0.693 19799
2512 1 9 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.466 -0.608 19799
2513 1 9 . 1 1 46 46 ILE C C 46 176.810 176.810 175.876 0.934 19799
2514 1 9 . 1 1 46 46 ILE CA C 46 62.646 62.646 60.803 1.843 19799
2515 1 9 . 1 1 46 46 ILE CB C 46 39.156 39.156 36.700 2.455 19799
2516 1 9 . 1 1 46 46 ILE H H 46 10.038 10.038 9.446 0.592 19799
2517 1 9 . 1 1 47 47 VAL N N 47 117.819 117.819 127.025 -9.206 19799
2518 1 9 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.543 -0.036 19799
2519 1 9 . 1 1 47 47 VAL C C 47 173.753 173.753 173.197 0.556 19799
2520 1 9 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.727 -0.096 19799
2521 1 9 . 1 1 47 47 VAL CB C 47 32.918 32.918 34.006 -1.088 19799
2522 1 9 . 1 1 47 47 VAL H H 47 8.268 8.268 9.058 -0.790 19799
2523 1 9 . 1 1 48 48 LYS N N 48 118.041 118.041 126.961 -8.920 19799
2524 1 9 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.235 -0.207 19799
2525 1 9 . 1 1 48 48 LYS C C 48 174.214 174.214 173.654 0.560 19799
2526 1 9 . 1 1 48 48 LYS CA C 48 57.313 57.313 55.976 1.337 19799
2527 1 9 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.749 0.723 19799
2528 1 9 . 1 1 48 48 LYS H H 48 6.778 6.778 7.570 -0.792 19799
2529 1 9 . 1 1 49 49 LYS N N 49 124.877 124.877 125.621 -0.744 19799
2530 1 9 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.545 -0.362 19799
2531 1 9 . 1 1 49 49 LYS C C 49 176.704 176.704 176.440 0.264 19799
2532 1 9 . 1 1 49 49 LYS CA C 49 54.753 54.753 56.112 -1.359 19799
2533 1 9 . 1 1 49 49 LYS CB C 49 33.181 33.181 31.863 1.319 19799
2534 1 9 . 1 1 49 49 LYS H H 49 7.204 7.204 8.565 -1.361 19799
2535 1 9 . 1 1 50 50 GLY N N 50 112.262 112.262 114.827 -2.565 19799
2536 1 9 . 1 1 50 50 GLY C C 50 173.665 173.665 173.513 0.152 19799
2537 1 9 . 1 1 50 50 GLY CA C 50 45.138 45.138 44.478 0.660 19799
2538 1 9 . 1 1 50 50 GLY H H 50 8.363 8.363 8.318 0.045 19799
2539 1 10 . 1 1 2 2 THR N N 2 113.079 113.079 117.348 -4.269 19799
2540 1 10 . 1 1 2 2 THR HA H 2 4.349 4.349 4.331 0.018 19799
2541 1 10 . 1 1 2 2 THR C C 2 174.385 174.385 174.218 0.167 19799
2542 1 10 . 1 1 2 2 THR CA C 2 61.412 61.412 61.723 -0.311 19799
2543 1 10 . 1 1 2 2 THR CB C 2 70.028 70.028 69.071 0.957 19799
2544 1 10 . 1 1 2 2 THR H H 2 8.033 8.033 8.152 -0.119 19799
2545 1 10 . 1 1 3 3 ASN N N 3 121.005 121.005 125.737 -4.732 19799
2546 1 10 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.253 0.544 19799
2547 1 10 . 1 1 3 3 ASN C C 3 174.634 174.634 174.387 0.247 19799
2548 1 10 . 1 1 3 3 ASN CA C 3 52.504 52.504 53.479 -0.975 19799
2549 1 10 . 1 1 3 3 ASN CB C 3 39.620 39.620 38.661 0.959 19799
2550 1 10 . 1 1 3 3 ASN H H 3 8.403 8.403 8.594 -0.191 19799
2551 1 10 . 1 1 4 4 THR N N 4 117.293 117.293 118.692 -1.399 19799
2552 1 10 . 1 1 4 4 THR HA H 4 4.349 4.349 4.302 0.047 19799
2553 1 10 . 1 1 4 4 THR C C 4 172.910 172.910 172.780 0.130 19799
2554 1 10 . 1 1 4 4 THR CA C 4 62.524 62.524 61.212 1.312 19799
2555 1 10 . 1 1 4 4 THR CB C 4 69.624 69.624 71.537 -1.913 19799
2556 1 10 . 1 1 4 4 THR H H 4 8.264 8.264 7.729 0.535 19799
2557 1 10 . 1 1 5 5 TYR N N 5 125.362 125.362 119.055 6.307 19799
2558 1 10 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.179 0.358 19799
2559 1 10 . 1 1 5 5 TYR C C 5 174.901 174.901 173.647 1.254 19799
2560 1 10 . 1 1 5 5 TYR CA C 5 56.841 56.841 54.823 2.018 19799
2561 1 10 . 1 1 5 5 TYR CB C 5 41.944 41.944 41.219 0.725 19799
2562 1 10 . 1 1 5 5 TYR H H 5 8.887 8.887 7.691 1.196 19799
2563 1 10 . 1 1 6 6 TYR N N 6 123.590 123.590 122.965 0.625 19799
2564 1 10 . 1 1 6 6 TYR HA H 6 4.588 4.588 5.011 -0.423 19799
2565 1 10 . 1 1 6 6 TYR C C 6 173.568 173.568 173.969 -0.401 19799
2566 1 10 . 1 1 6 6 TYR CA C 6 57.479 57.479 56.368 1.111 19799
2567 1 10 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.876 1.287 19799
2568 1 10 . 1 1 6 6 TYR H H 6 9.338 9.338 9.214 0.124 19799
2569 1 10 . 1 1 7 7 THR N N 7 124.727 124.727 120.079 4.648 19799
2570 1 10 . 1 1 7 7 THR HA H 7 4.701 4.701 4.572 0.129 19799
2571 1 10 . 1 1 7 7 THR C C 7 172.279 172.279 174.399 -2.120 19799
2572 1 10 . 1 1 7 7 THR CA C 7 61.635 61.635 60.534 1.101 19799
2573 1 10 . 1 1 7 7 THR CB C 7 68.780 68.780 68.796 -0.017 19799
2574 1 10 . 1 1 7 7 THR H H 7 7.482 7.482 8.312 -0.830 19799
2575 1 10 . 1 1 8 8 VAL N N 8 126.420 126.420 127.120 -0.700 19799
2576 1 10 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.663 0.077 19799
2577 1 10 . 1 1 8 8 VAL C C 8 176.689 176.689 175.779 0.910 19799
2578 1 10 . 1 1 8 8 VAL CA C 8 64.690 64.690 63.861 0.829 19799
2579 1 10 . 1 1 8 8 VAL CB C 8 31.937 31.937 30.900 1.037 19799
2580 1 10 . 1 1 8 8 VAL H H 8 8.660 8.660 8.762 -0.102 19799
2581 1 10 . 1 1 9 9 LYS N N 9 130.614 130.614 129.900 0.714 19799
2582 1 10 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.482 0.188 19799
2583 1 10 . 1 1 9 9 LYS C C 9 176.438 176.438 177.101 -0.663 19799
2584 1 10 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.484 -0.069 19799
2585 1 10 . 1 1 9 9 LYS CB C 9 35.596 35.596 34.021 1.575 19799
2586 1 10 . 1 1 9 9 LYS H H 9 9.297 9.297 8.366 0.931 19799
2587 1 10 . 1 1 10 10 SER N N 10 116.022 116.022 116.253 -0.231 19799
2588 1 10 . 1 1 10 10 SER HA H 10 4.050 4.050 4.259 -0.209 19799
2589 1 10 . 1 1 10 10 SER C C 10 175.932 175.932 174.119 1.813 19799
2590 1 10 . 1 1 10 10 SER CA C 10 60.451 60.451 59.638 0.813 19799
2591 1 10 . 1 1 10 10 SER CB C 10 62.680 62.680 61.908 0.772 19799
2592 1 10 . 1 1 10 10 SER H H 10 8.766 8.766 8.630 0.136 19799
2593 1 10 . 1 1 11 11 GLY N N 11 116.079 116.079 109.156 6.923 19799
2594 1 10 . 1 1 11 11 GLY C C 11 174.938 174.938 174.489 0.449 19799
2595 1 10 . 1 1 11 11 GLY CA C 11 45.090 45.090 45.476 -0.386 19799
2596 1 10 . 1 1 11 11 GLY H H 11 9.067 9.067 8.425 0.642 19799
2597 1 10 . 1 1 12 12 ASP N N 12 120.579 120.579 118.656 1.923 19799
2598 1 10 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.427 0.186 19799
2599 1 10 . 1 1 12 12 ASP C C 12 176.265 176.265 175.706 0.559 19799
2600 1 10 . 1 1 12 12 ASP CA C 12 56.030 56.030 55.071 0.959 19799
2601 1 10 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.064 1.781 19799
2602 1 10 . 1 1 12 12 ASP H H 12 7.963 7.963 8.731 -0.768 19799
2603 1 10 . 1 1 13 13 THR N N 13 106.911 106.911 114.273 -7.362 19799
2604 1 10 . 1 1 13 13 THR HA H 13 4.657 4.657 4.601 0.056 19799
2605 1 10 . 1 1 13 13 THR C C 13 174.774 174.774 175.110 -0.336 19799
2606 1 10 . 1 1 13 13 THR CA C 13 58.612 58.612 60.330 -1.718 19799
2607 1 10 . 1 1 13 13 THR CB C 13 72.416 72.416 72.397 0.019 19799
2608 1 10 . 1 1 13 13 THR H H 13 6.809 6.809 7.458 -0.649 19799
2609 1 10 . 1 1 14 14 LEU N N 14 122.612 122.612 124.947 -2.335 19799
2610 1 10 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.863 0.037 19799
2611 1 10 . 1 1 14 14 LEU C C 14 178.071 178.071 178.439 -0.368 19799
2612 1 10 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.588 -1.128 19799
2613 1 10 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.436 0.338 19799
2614 1 10 . 1 1 14 14 LEU H H 14 9.478 9.478 9.067 0.411 19799
2615 1 10 . 1 1 15 15 ASN N N 15 114.945 114.945 114.737 0.208 19799
2616 1 10 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.444 -0.301 19799
2617 1 10 . 1 1 15 15 ASN C C 15 177.943 177.943 177.404 0.539 19799
2618 1 10 . 1 1 15 15 ASN CA C 15 56.545 56.545 55.557 0.987 19799
2619 1 10 . 1 1 15 15 ASN CB C 15 38.146 38.146 36.950 1.196 19799
2620 1 10 . 1 1 15 15 ASN H H 15 8.471 8.471 8.753 -0.282 19799
2621 1 10 . 1 1 16 16 LYS N N 16 121.113 121.113 121.347 -0.234 19799
2622 1 10 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.142 -0.109 19799
2623 1 10 . 1 1 16 16 LYS C C 16 179.167 179.167 178.682 0.485 19799
2624 1 10 . 1 1 16 16 LYS CA C 16 59.702 59.702 58.248 1.454 19799
2625 1 10 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.370 1.122 19799
2626 1 10 . 1 1 16 16 LYS H H 16 7.725 7.725 7.639 0.086 19799
2627 1 10 . 1 1 17 17 ILE N N 17 121.712 121.712 115.917 5.795 19799
2628 1 10 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.944 -0.434 19799
2629 1 10 . 1 1 17 17 ILE C C 17 177.445 177.445 177.436 0.009 19799
2630 1 10 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.027 1.155 19799
2631 1 10 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.665 0.973 19799
2632 1 10 . 1 1 17 17 ILE H H 17 7.933 7.933 7.724 0.209 19799
2633 1 10 . 1 1 18 18 ALA N N 18 121.562 121.562 122.436 -0.874 19799
2634 1 10 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.883 -0.041 19799
2635 1 10 . 1 1 18 18 ALA C C 18 179.665 179.665 178.952 0.713 19799
2636 1 10 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.030 0.450 19799
2637 1 10 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.269 -0.236 19799
2638 1 10 . 1 1 18 18 ALA H H 18 8.401 8.401 8.141 0.260 19799
2639 1 10 . 1 1 19 19 ALA N N 19 117.623 117.623 119.593 -1.970 19799
2640 1 10 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.027 0.139 19799
2641 1 10 . 1 1 19 19 ALA C C 19 180.714 180.714 179.054 1.660 19799
2642 1 10 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.943 0.565 19799
2643 1 10 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.362 -0.313 19799
2644 1 10 . 1 1 19 19 ALA H H 19 7.500 7.500 7.577 -0.077 19799
2645 1 10 . 1 1 20 20 GLN N N 20 118.679 118.679 118.690 -0.011 19799
2646 1 10 . 1 1 20 20 GLN HA H 20 3.856 3.856 3.986 -0.130 19799
2647 1 10 . 1 1 20 20 GLN C C 20 177.608 177.608 177.324 0.284 19799
2648 1 10 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.170 0.300 19799
2649 1 10 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.828 -0.546 19799
2650 1 10 . 1 1 20 20 GLN H H 20 7.941 7.941 7.430 0.511 19799
2651 1 10 . 1 1 21 21 TYR N N 21 113.907 113.907 113.606 0.301 19799
2652 1 10 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.716 -0.350 19799
2653 1 10 . 1 1 21 21 TYR C C 21 175.496 175.496 175.636 -0.140 19799
2654 1 10 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.153 4.883 19799
2655 1 10 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.186 1.012 19799
2656 1 10 . 1 1 21 21 TYR H H 21 7.669 7.669 6.816 0.853 19799
2657 1 10 . 1 1 22 22 GLY N N 22 111.326 111.326 109.028 2.298 19799
2658 1 10 . 1 1 22 22 GLY C C 22 174.783 174.783 173.856 0.927 19799
2659 1 10 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.328 2.122 19799
2660 1 10 . 1 1 22 22 GLY H H 22 7.949 7.949 7.540 0.409 19799
2661 1 10 . 1 1 23 23 VAL N N 23 113.949 113.949 118.423 -4.474 19799
2662 1 10 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.511 0.296 19799
2663 1 10 . 1 1 23 23 VAL C C 23 173.768 173.768 173.579 0.189 19799
2664 1 10 . 1 1 23 23 VAL CA C 23 58.434 58.434 60.155 -1.721 19799
2665 1 10 . 1 1 23 23 VAL CB C 23 34.961 34.961 36.163 -1.202 19799
2666 1 10 . 1 1 23 23 VAL H H 23 8.040 8.040 8.199 -0.159 19799
2667 1 10 . 1 1 24 24 SER N N 24 115.672 115.672 115.799 -0.127 19799
2668 1 10 . 1 1 24 24 SER HA H 24 4.655 4.655 4.811 -0.156 19799
2669 1 10 . 1 1 24 24 SER C C 24 176.015 176.015 175.719 0.296 19799
2670 1 10 . 1 1 24 24 SER CA C 24 56.111 56.111 55.937 0.174 19799
2671 1 10 . 1 1 24 24 SER CB C 24 65.385 65.385 64.357 1.028 19799
2672 1 10 . 1 1 24 24 SER H H 24 8.269 8.269 8.710 -0.441 19799
2673 1 10 . 1 1 25 25 VAL N N 25 122.227 122.227 126.761 -4.534 19799
2674 1 10 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.711 -0.334 19799
2675 1 10 . 1 1 25 25 VAL C C 25 177.775 177.775 177.147 0.628 19799
2676 1 10 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.350 0.790 19799
2677 1 10 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.676 -0.306 19799
2678 1 10 . 1 1 25 25 VAL H H 25 8.866 8.866 8.910 -0.044 19799
2679 1 10 . 1 1 26 26 ALA N N 26 120.890 120.890 121.763 -0.873 19799
2680 1 10 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.892 0.022 19799
2681 1 10 . 1 1 26 26 ALA C C 26 180.692 180.692 178.567 2.125 19799
2682 1 10 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.799 -0.487 19799
2683 1 10 . 1 1 26 26 ALA CB C 26 17.825 17.825 17.944 -0.119 19799
2684 1 10 . 1 1 26 26 ALA H H 26 8.218 8.218 7.723 0.495 19799
2685 1 10 . 1 1 27 27 ASN N N 27 118.099 118.099 116.424 1.675 19799
2686 1 10 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.029 -0.326 19799
2687 1 10 . 1 1 27 27 ASN C C 27 175.308 175.308 176.795 -1.487 19799
2688 1 10 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.196 0.025 19799
2689 1 10 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.545 -0.682 19799
2690 1 10 . 1 1 27 27 ASN H H 27 7.846 7.846 7.681 0.165 19799
2691 1 10 . 1 1 28 28 LEU N N 28 116.512 116.512 117.546 -1.034 19799
2692 1 10 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.603 0.140 19799
2693 1 10 . 1 1 28 28 LEU C C 28 181.142 181.142 178.924 2.218 19799
2694 1 10 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.104 1.153 19799
2695 1 10 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.282 0.803 19799
2696 1 10 . 1 1 28 28 LEU H H 28 7.475 7.475 7.418 0.057 19799
2697 1 10 . 1 1 29 29 ARG N N 29 117.344 117.344 118.568 -1.224 19799
2698 1 10 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.938 0.014 19799
2699 1 10 . 1 1 29 29 ARG C C 29 178.818 178.818 178.564 0.254 19799
2700 1 10 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.019 1.764 19799
2701 1 10 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.628 0.432 19799
2702 1 10 . 1 1 29 29 ARG H H 29 8.571 8.571 8.293 0.278 19799
2703 1 10 . 1 1 30 30 SER N N 30 114.887 114.887 114.439 0.448 19799
2704 1 10 . 1 1 30 30 SER HA H 30 4.255 4.255 4.243 0.012 19799
2705 1 10 . 1 1 30 30 SER C C 30 178.552 178.552 175.621 2.931 19799
2706 1 10 . 1 1 30 30 SER CA C 30 61.314 61.314 60.987 0.327 19799
2707 1 10 . 1 1 30 30 SER CB C 30 62.982 62.982 63.094 -0.112 19799
2708 1 10 . 1 1 30 30 SER H H 30 7.995 7.995 7.247 0.748 19799
2709 1 10 . 1 1 31 31 TRP N N 31 119.302 119.302 118.575 0.727 19799
2710 1 10 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.841 -0.056 19799
2711 1 10 . 1 1 31 31 TRP C C 31 177.570 177.570 176.864 0.706 19799
2712 1 10 . 1 1 31 31 TRP CA C 31 57.005 57.005 55.733 1.272 19799
2713 1 10 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.804 1.124 19799
2714 1 10 . 1 1 31 31 TRP H H 31 9.055 9.055 7.173 1.882 19799
2715 1 10 . 1 1 32 32 ASN N N 32 109.665 109.665 119.025 -9.360 19799
2716 1 10 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.879 0.225 19799
2717 1 10 . 1 1 32 32 ASN C C 32 174.034 174.034 176.757 -2.723 19799
2718 1 10 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.682 -1.132 19799
2719 1 10 . 1 1 32 32 ASN CB C 32 42.065 42.065 39.439 2.626 19799
2720 1 10 . 1 1 32 32 ASN H H 32 7.232 7.232 7.652 -0.420 19799
2721 1 10 . 1 1 33 33 GLY N N 33 111.582 111.582 109.193 2.389 19799
2722 1 10 . 1 1 33 33 GLY C C 33 174.930 174.930 173.987 0.943 19799
2723 1 10 . 1 1 33 33 GLY CA C 33 47.611 47.611 46.093 1.518 19799
2724 1 10 . 1 1 33 33 GLY H H 33 7.864 7.864 8.174 -0.310 19799
2725 1 10 . 1 1 34 34 ILE N N 34 118.759 118.759 115.067 3.692 19799
2726 1 10 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.532 -0.316 19799
2727 1 10 . 1 1 34 34 ILE C C 34 175.882 175.882 175.991 -0.109 19799
2728 1 10 . 1 1 34 34 ILE CA C 34 60.719 60.719 58.815 1.904 19799
2729 1 10 . 1 1 34 34 ILE CB C 34 40.553 40.553 40.031 0.522 19799
2730 1 10 . 1 1 34 34 ILE H H 34 7.918 7.918 7.570 0.348 19799
2731 1 10 . 1 1 35 35 SER N N 35 122.217 122.217 117.688 4.529 19799
2732 1 10 . 1 1 35 35 SER HA H 35 4.583 4.583 4.442 0.141 19799
2733 1 10 . 1 1 35 35 SER C C 35 174.848 174.848 175.485 -0.637 19799
2734 1 10 . 1 1 35 35 SER CA C 35 57.461 57.461 58.616 -1.155 19799
2735 1 10 . 1 1 35 35 SER CB C 35 63.929 63.929 63.852 0.077 19799
2736 1 10 . 1 1 35 35 SER H H 35 8.801 8.801 8.708 0.093 19799
2737 1 10 . 1 1 36 36 GLY N N 36 114.644 114.644 107.341 7.303 19799
2738 1 10 . 1 1 36 36 GLY C C 36 173.365 173.365 174.462 -1.097 19799
2739 1 10 . 1 1 36 36 GLY CA C 36 46.088 46.088 44.979 1.109 19799
2740 1 10 . 1 1 36 36 GLY H H 36 8.614 8.614 8.589 0.025 19799
2741 1 10 . 1 1 37 37 ASP N N 37 122.530 122.530 119.082 3.448 19799
2742 1 10 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.543 0.367 19799
2743 1 10 . 1 1 37 37 ASP C C 37 175.986 175.986 176.779 -0.793 19799
2744 1 10 . 1 1 37 37 ASP CA C 37 53.560 53.560 55.165 -1.605 19799
2745 1 10 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.594 1.364 19799
2746 1 10 . 1 1 37 37 ASP H H 37 8.537 8.537 8.231 0.306 19799
2747 1 10 . 1 1 38 38 LEU N N 38 121.818 121.818 117.911 3.907 19799
2748 1 10 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.865 -0.536 19799
2749 1 10 . 1 1 38 38 LEU C C 38 175.373 175.373 175.410 -0.037 19799
2750 1 10 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.239 2.052 19799
2751 1 10 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.195 0.673 19799
2752 1 10 . 1 1 38 38 LEU H H 38 7.602 7.602 7.430 0.172 19799
2753 1 10 . 1 1 39 39 ILE N N 39 118.291 118.291 123.886 -5.595 19799
2754 1 10 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.249 0.649 19799
2755 1 10 . 1 1 39 39 ILE C C 39 174.861 174.861 174.393 0.468 19799
2756 1 10 . 1 1 39 39 ILE CA C 39 59.354 59.354 61.058 -1.704 19799
2757 1 10 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.492 1.522 19799
2758 1 10 . 1 1 39 39 ILE H H 39 7.708 7.708 7.646 0.062 19799
2759 1 10 . 1 1 40 40 PHE N N 40 118.274 118.274 122.897 -4.623 19799
2760 1 10 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.930 0.121 19799
2761 1 10 . 1 1 40 40 PHE C C 40 174.537 174.537 173.276 1.261 19799
2762 1 10 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.121 0.317 19799
2763 1 10 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.377 1.603 19799
2764 1 10 . 1 1 40 40 PHE H H 40 8.195 8.195 7.628 0.567 19799
2765 1 10 . 1 1 41 41 VAL N N 41 121.812 121.812 121.870 -0.058 19799
2766 1 10 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.066 -0.846 19799
2767 1 10 . 1 1 41 41 VAL C C 41 177.510 177.510 177.597 -0.087 19799
2768 1 10 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.154 1.493 19799
2769 1 10 . 1 1 41 41 VAL CB C 41 31.030 31.030 30.928 0.102 19799
2770 1 10 . 1 1 41 41 VAL H H 41 8.680 8.680 8.592 0.088 19799
2771 1 10 . 1 1 42 42 GLY N N 42 116.069 116.069 114.797 1.272 19799
2772 1 10 . 1 1 42 42 GLY C C 42 173.772 173.772 173.421 0.351 19799
2773 1 10 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.794 -0.132 19799
2774 1 10 . 1 1 42 42 GLY H H 42 8.815 8.815 8.934 -0.119 19799
2775 1 10 . 1 1 43 43 GLN N N 43 124.343 124.343 121.254 3.089 19799
2776 1 10 . 1 1 43 43 GLN HA H 43 3.859 3.859 4.094 -0.235 19799
2777 1 10 . 1 1 43 43 GLN C C 43 174.324 174.324 174.581 -0.257 19799
2778 1 10 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.142 1.713 19799
2779 1 10 . 1 1 43 43 GLN CB C 43 29.033 29.033 29.721 -0.688 19799
2780 1 10 . 1 1 43 43 GLN H H 43 8.038 8.038 7.467 0.571 19799
2781 1 10 . 1 1 44 44 LYS N N 44 126.564 126.564 127.584 -1.020 19799
2782 1 10 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.643 0.210 19799
2783 1 10 . 1 1 44 44 LYS C C 44 176.019 176.019 175.829 0.190 19799
2784 1 10 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.528 0.013 19799
2785 1 10 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.250 0.758 19799
2786 1 10 . 1 1 44 44 LYS H H 44 8.633 8.633 8.379 0.254 19799
2787 1 10 . 1 1 45 45 LEU N N 45 126.114 126.114 125.382 0.732 19799
2788 1 10 . 1 1 45 45 LEU HA H 45 4.719 4.719 4.985 -0.266 19799
2789 1 10 . 1 1 45 45 LEU C C 45 176.670 176.670 175.479 1.191 19799
2790 1 10 . 1 1 45 45 LEU CA C 45 53.094 53.094 51.799 1.295 19799
2791 1 10 . 1 1 45 45 LEU CB C 45 45.102 45.102 43.888 1.214 19799
2792 1 10 . 1 1 45 45 LEU H H 45 9.458 9.458 8.877 0.581 19799
2793 1 10 . 1 1 46 46 ILE N N 46 123.782 123.782 122.552 1.230 19799
2794 1 10 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.329 -0.471 19799
2795 1 10 . 1 1 46 46 ILE C C 46 176.810 176.810 175.572 1.238 19799
2796 1 10 . 1 1 46 46 ILE CA C 46 62.646 62.646 62.447 0.199 19799
2797 1 10 . 1 1 46 46 ILE CB C 46 39.156 39.156 37.710 1.446 19799
2798 1 10 . 1 1 46 46 ILE H H 46 10.038 10.038 9.213 0.825 19799
2799 1 10 . 1 1 47 47 VAL N N 47 117.819 117.819 126.103 -8.284 19799
2800 1 10 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.407 0.100 19799
2801 1 10 . 1 1 47 47 VAL C C 47 173.753 173.753 173.082 0.671 19799
2802 1 10 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.983 -0.352 19799
2803 1 10 . 1 1 47 47 VAL CB C 47 32.918 32.918 35.427 -2.509 19799
2804 1 10 . 1 1 47 47 VAL H H 47 8.268 8.268 8.906 -0.638 19799
2805 1 10 . 1 1 48 48 LYS N N 48 118.041 118.041 125.843 -7.802 19799
2806 1 10 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.457 -0.429 19799
2807 1 10 . 1 1 48 48 LYS C C 48 174.214 174.214 175.487 -1.273 19799
2808 1 10 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.161 3.152 19799
2809 1 10 . 1 1 48 48 LYS CB C 48 35.472 35.472 33.619 1.853 19799
2810 1 10 . 1 1 48 48 LYS H H 48 6.778 6.778 7.590 -0.812 19799
2811 1 10 . 1 1 49 49 LYS N N 49 124.877 124.877 123.850 1.027 19799
2812 1 10 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.397 -0.214 19799
2813 1 10 . 1 1 49 49 LYS C C 49 176.704 176.704 177.725 -1.021 19799
2814 1 10 . 1 1 49 49 LYS CA C 49 54.753 54.753 56.448 -1.695 19799
2815 1 10 . 1 1 49 49 LYS CB C 49 33.181 33.181 32.400 0.781 19799
2816 1 10 . 1 1 49 49 LYS H H 49 7.204 7.204 8.343 -1.139 19799
2817 1 10 . 1 1 50 50 GLY N N 50 112.262 112.262 110.531 1.731 19799
2818 1 10 . 1 1 50 50 GLY C C 50 173.665 173.665 174.437 -0.772 19799
2819 1 10 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.545 -0.407 19799
2820 1 10 . 1 1 50 50 GLY H H 50 8.363 8.363 8.953 -0.590 19799
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 49 3.225 0.886 3.133 19799
2 1 1 "Average Difference" HA 55 0.329 -0.001 0.332 19799
3 1 1 "Average Difference" C 49 1.090 -0.447 1.005 19799
4 1 1 "Average Difference" CA 49 1.166 -0.459 1.083 19799
5 1 1 "Average Difference" CB 43 1.136 -0.521 1.022 19799
6 1 1 "Average Difference" HN 49 0.570 -0.142 0.558 19799
7 1 2 "Average Difference" N 49 3.571 0.643 3.549 19799
8 1 2 "Average Difference" HA 55 0.298 0.003 0.301 19799
9 1 2 "Average Difference" C 49 1.067 -0.430 0.987 19799
10 1 2 "Average Difference" CA 49 1.265 -0.506 1.171 19799
11 1 2 "Average Difference" CB 43 1.143 -0.502 1.039 19799
12 1 2 "Average Difference" HN 49 0.557 -0.137 0.545 19799
13 1 3 "Average Difference" N 49 3.518 0.639 3.495 19799
14 1 3 "Average Difference" HA 55 0.308 0.008 0.311 19799
15 1 3 "Average Difference" C 49 1.005 -0.292 0.971 19799
16 1 3 "Average Difference" CA 49 1.163 -0.442 1.087 19799
17 1 3 "Average Difference" CB 43 1.162 -0.457 1.081 19799
18 1 3 "Average Difference" HN 49 0.582 -0.141 0.571 19799
19 1 4 "Average Difference" N 49 3.382 0.773 3.326 19799
20 1 4 "Average Difference" HA 55 0.306 -0.019 0.308 19799
21 1 4 "Average Difference" C 49 0.971 -0.353 0.914 19799
22 1 4 "Average Difference" CA 49 1.281 -0.367 1.240 19799
23 1 4 "Average Difference" CB 43 1.184 -0.636 1.011 19799
24 1 4 "Average Difference" HN 49 0.577 -0.169 0.558 19799
25 1 5 "Average Difference" N 49 3.723 0.267 3.752 19799
26 1 5 "Average Difference" HA 55 0.326 -0.004 0.329 19799
27 1 5 "Average Difference" C 49 1.086 -0.216 1.075 19799
28 1 5 "Average Difference" CA 49 1.339 -0.412 1.287 19799
29 1 5 "Average Difference" CB 43 1.191 -0.519 1.085 19799
30 1 5 "Average Difference" HN 49 0.622 -0.144 0.612 19799
31 1 6 "Average Difference" N 49 3.560 0.252 3.587 19799
32 1 6 "Average Difference" HA 55 0.311 0.028 0.313 19799
33 1 6 "Average Difference" C 49 1.053 -0.222 1.040 19799
34 1 6 "Average Difference" CA 49 1.348 -0.445 1.286 19799
35 1 6 "Average Difference" CB 43 1.035 -0.503 0.915 19799
36 1 6 "Average Difference" HN 49 0.590 -0.153 0.576 19799
37 1 7 "Average Difference" N 49 3.580 0.638 3.560 19799
38 1 7 "Average Difference" HA 55 0.289 0.015 0.291 19799
39 1 7 "Average Difference" C 49 1.025 -0.314 0.986 19799
40 1 7 "Average Difference" CA 49 1.230 -0.477 1.145 19799
41 1 7 "Average Difference" CB 43 1.150 -0.512 1.042 19799
42 1 7 "Average Difference" HN 49 0.589 -0.122 0.582 19799
43 1 8 "Average Difference" N 49 3.391 0.411 3.401 19799
44 1 8 "Average Difference" HA 55 0.299 -0.006 0.302 19799
45 1 8 "Average Difference" C 49 1.020 -0.225 1.005 19799
46 1 8 "Average Difference" CA 49 1.291 -0.325 1.263 19799
47 1 8 "Average Difference" CB 43 1.147 -0.607 0.985 19799
48 1 8 "Average Difference" HN 49 0.566 -0.094 0.564 19799
49 1 9 "Average Difference" N 49 3.519 0.515 3.517 19799
50 1 9 "Average Difference" HA 55 0.316 -0.016 0.319 19799
51 1 9 "Average Difference" C 49 0.964 -0.279 0.932 19799
52 1 9 "Average Difference" CA 49 1.299 -0.492 1.215 19799
53 1 9 "Average Difference" CB 43 1.027 -0.577 0.860 19799
54 1 9 "Average Difference" HN 49 0.581 -0.149 0.567 19799
55 1 10 "Average Difference" N 49 3.823 0.126 3.861 19799
56 1 10 "Average Difference" HA 55 0.322 0.003 0.325 19799
57 1 10 "Average Difference" C 49 1.078 -0.234 1.063 19799
58 1 10 "Average Difference" CA 49 1.421 -0.517 1.337 19799
59 1 10 "Average Difference" CB 43 1.128 -0.536 1.005 19799
60 1 10 "Average Difference" HN 49 0.571 -0.125 0.563 19799
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 19799
_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 THR N N 2 113.079 113.079 116.622 -3.543 19799
2 1 . 1 1 2 2 THR HA H 2 4.349 4.349 4.330 0.019 19799
3 1 . 1 1 2 2 THR C C 2 174.385 174.385 173.511 0.874 19799
4 1 . 1 1 2 2 THR CA C 2 61.412 61.412 62.103 -0.691 19799
5 1 . 1 1 2 2 THR CB C 2 70.028 70.028 69.320 0.708 19799
6 1 . 1 1 2 2 THR H H 2 8.033 8.033 8.152 -0.119 19799
7 1 . 1 1 3 3 ASN N N 3 121.005 121.005 121.967 -0.962 19799
8 1 . 1 1 3 3 ASN HA H 3 4.797 4.797 4.619 0.178 19799
9 1 . 1 1 3 3 ASN C C 3 174.634 174.634 174.097 0.537 19799
10 1 . 1 1 3 3 ASN CA C 3 52.504 52.504 52.933 -0.429 19799
11 1 . 1 1 3 3 ASN CB C 3 39.620 39.620 39.874 -0.254 19799
12 1 . 1 1 3 3 ASN H H 3 8.403 8.403 8.133 0.270 19799
13 1 . 1 1 4 4 THR N N 4 117.293 117.293 117.728 -0.435 19799
14 1 . 1 1 4 4 THR HA H 4 4.349 4.349 4.354 -0.005 19799
15 1 . 1 1 4 4 THR C C 4 172.910 172.910 172.969 -0.059 19799
16 1 . 1 1 4 4 THR CA C 4 62.524 62.524 61.088 1.436 19799
17 1 . 1 1 4 4 THR CB C 4 69.624 69.624 70.851 -1.227 19799
18 1 . 1 1 4 4 THR H H 4 8.264 8.264 7.871 0.393 19799
19 1 . 1 1 5 5 TYR N N 5 125.362 125.362 120.264 5.098 19799
20 1 . 1 1 5 5 TYR HA H 5 5.537 5.537 5.132 0.405 19799
21 1 . 1 1 5 5 TYR C C 5 174.901 174.901 173.818 1.083 19799
22 1 . 1 1 5 5 TYR CA C 5 56.841 56.841 55.189 1.652 19799
23 1 . 1 1 5 5 TYR CB C 5 41.944 41.944 40.866 1.078 19799
24 1 . 1 1 5 5 TYR H H 5 8.887 8.887 7.695 1.192 19799
25 1 . 1 1 6 6 TYR N N 6 123.590 123.590 123.720 -0.130 19799
26 1 . 1 1 6 6 TYR HA H 6 4.588 4.588 4.946 -0.358 19799
27 1 . 1 1 6 6 TYR C C 6 173.568 173.568 174.225 -0.657 19799
28 1 . 1 1 6 6 TYR CA C 6 57.479 57.479 56.175 1.304 19799
29 1 . 1 1 6 6 TYR CB C 6 44.163 44.163 42.132 2.031 19799
30 1 . 1 1 6 6 TYR H H 6 9.338 9.338 9.240 0.098 19799
31 1 . 1 1 7 7 THR N N 7 124.727 124.727 119.986 4.741 19799
32 1 . 1 1 7 7 THR HA H 7 4.701 4.701 4.473 0.228 19799
33 1 . 1 1 7 7 THR C C 7 172.279 172.279 174.213 -1.934 19799
34 1 . 1 1 7 7 THR CA C 7 61.635 61.635 60.957 0.678 19799
35 1 . 1 1 7 7 THR CB C 7 68.780 68.780 68.766 0.014 19799
36 1 . 1 1 7 7 THR H H 7 7.482 7.482 8.264 -0.782 19799
37 1 . 1 1 8 8 VAL N N 8 126.420 126.420 127.292 -0.872 19799
38 1 . 1 1 8 8 VAL HA H 8 3.740 3.740 3.683 0.057 19799
39 1 . 1 1 8 8 VAL C C 8 176.689 176.689 175.391 1.298 19799
40 1 . 1 1 8 8 VAL CA C 8 64.690 64.690 64.198 0.492 19799
41 1 . 1 1 8 8 VAL CB C 8 31.937 31.937 31.174 0.762 19799
42 1 . 1 1 8 8 VAL H H 8 8.660 8.660 8.695 -0.035 19799
43 1 . 1 1 9 9 LYS N N 9 130.614 130.614 128.752 1.863 19799
44 1 . 1 1 9 9 LYS HA H 9 4.670 4.670 4.509 0.161 19799
45 1 . 1 1 9 9 LYS C C 9 176.438 176.438 176.530 -0.092 19799
46 1 . 1 1 9 9 LYS CA C 9 54.415 54.415 54.128 0.287 19799
47 1 . 1 1 9 9 LYS CB C 9 35.596 35.596 34.170 1.426 19799
48 1 . 1 1 9 9 LYS H H 9 9.297 9.297 8.137 1.160 19799
49 1 . 1 1 10 10 SER N N 10 116.022 116.022 115.144 0.878 19799
50 1 . 1 1 10 10 SER HA H 10 4.050 4.050 4.234 -0.184 19799
51 1 . 1 1 10 10 SER C C 10 175.932 175.932 175.497 0.435 19799
52 1 . 1 1 10 10 SER CA C 10 60.451 60.451 60.464 -0.013 19799
53 1 . 1 1 10 10 SER CB C 10 62.680 62.680 62.917 -0.237 19799
54 1 . 1 1 10 10 SER H H 10 8.766 8.766 8.546 0.220 19799
55 1 . 1 1 11 11 GLY N N 11 116.079 116.079 110.209 5.870 19799
56 1 . 1 1 11 11 GLY C C 11 174.938 174.938 174.020 0.918 19799
57 1 . 1 1 11 11 GLY CA C 11 45.090 45.090 44.681 0.409 19799
58 1 . 1 1 11 11 GLY H H 11 9.067 9.067 8.435 0.632 19799
59 1 . 1 1 12 12 ASP N N 12 120.579 120.579 117.921 2.658 19799
60 1 . 1 1 12 12 ASP HA H 12 4.613 4.613 4.466 0.147 19799
61 1 . 1 1 12 12 ASP C C 12 176.265 176.265 175.871 0.394 19799
62 1 . 1 1 12 12 ASP CA C 12 56.030 56.030 54.951 1.079 19799
63 1 . 1 1 12 12 ASP CB C 12 41.845 41.845 40.605 1.240 19799
64 1 . 1 1 12 12 ASP H H 12 7.963 7.963 8.371 -0.408 19799
65 1 . 1 1 13 13 THR N N 13 106.911 106.911 113.325 -6.414 19799
66 1 . 1 1 13 13 THR HA H 13 4.657 4.657 4.590 0.067 19799
67 1 . 1 1 13 13 THR C C 13 174.774 174.774 174.904 -0.130 19799
68 1 . 1 1 13 13 THR CA C 13 58.612 58.612 60.299 -1.687 19799
69 1 . 1 1 13 13 THR CB C 13 72.416 72.416 72.183 0.233 19799
70 1 . 1 1 13 13 THR H H 13 6.809 6.809 7.273 -0.464 19799
71 1 . 1 1 14 14 LEU N N 14 122.612 122.612 125.246 -2.634 19799
72 1 . 1 1 14 14 LEU HA H 14 3.900 3.900 3.962 -0.062 19799
73 1 . 1 1 14 14 LEU C C 14 178.071 178.071 178.105 -0.034 19799
74 1 . 1 1 14 14 LEU CA C 14 58.460 58.460 59.219 -0.759 19799
75 1 . 1 1 14 14 LEU CB C 14 41.774 41.774 41.423 0.351 19799
76 1 . 1 1 14 14 LEU H H 14 9.478 9.478 8.821 0.657 19799
77 1 . 1 1 15 15 ASN N N 15 114.945 114.945 115.092 -0.147 19799
78 1 . 1 1 15 15 ASN HA H 15 4.143 4.143 4.399 -0.256 19799
79 1 . 1 1 15 15 ASN C C 15 177.943 177.943 177.399 0.544 19799
80 1 . 1 1 15 15 ASN CA C 15 56.545 56.545 55.954 0.591 19799
81 1 . 1 1 15 15 ASN CB C 15 38.146 38.146 37.157 0.989 19799
82 1 . 1 1 15 15 ASN H H 15 8.471 8.471 8.800 -0.329 19799
83 1 . 1 1 16 16 LYS N N 16 121.113 121.113 120.777 0.336 19799
84 1 . 1 1 16 16 LYS HA H 16 4.033 4.033 4.094 -0.061 19799
85 1 . 1 1 16 16 LYS C C 16 179.167 179.167 178.906 0.261 19799
86 1 . 1 1 16 16 LYS CA C 16 59.702 59.702 58.888 0.814 19799
87 1 . 1 1 16 16 LYS CB C 16 33.492 33.492 32.569 0.924 19799
88 1 . 1 1 16 16 LYS H H 16 7.725 7.725 7.535 0.190 19799
89 1 . 1 1 17 17 ILE N N 17 121.712 121.712 115.956 5.755 19799
90 1 . 1 1 17 17 ILE HA H 17 3.510 3.510 3.728 -0.218 19799
91 1 . 1 1 17 17 ILE C C 17 177.445 177.445 177.198 0.247 19799
92 1 . 1 1 17 17 ILE CA C 17 65.182 65.182 64.072 1.110 19799
93 1 . 1 1 17 17 ILE CB C 17 38.638 38.638 37.468 1.170 19799
94 1 . 1 1 17 17 ILE H H 17 7.933 7.933 7.874 0.059 19799
95 1 . 1 1 18 18 ALA N N 18 121.562 121.562 122.634 -1.072 19799
96 1 . 1 1 18 18 ALA HA H 18 3.842 3.842 3.857 -0.015 19799
97 1 . 1 1 18 18 ALA C C 18 179.665 179.665 178.896 0.769 19799
98 1 . 1 1 18 18 ALA CA C 18 55.480 55.480 55.085 0.395 19799
99 1 . 1 1 18 18 ALA CB C 18 18.033 18.033 18.236 -0.203 19799
100 1 . 1 1 18 18 ALA H H 18 8.401 8.401 8.214 0.187 19799
101 1 . 1 1 19 19 ALA N N 19 117.623 117.623 119.167 -1.544 19799
102 1 . 1 1 19 19 ALA HA H 19 4.166 4.166 4.032 0.134 19799
103 1 . 1 1 19 19 ALA C C 19 180.714 180.714 179.144 1.569 19799
104 1 . 1 1 19 19 ALA CA C 19 54.508 54.508 53.939 0.569 19799
105 1 . 1 1 19 19 ALA CB C 19 18.049 18.049 18.335 -0.286 19799
106 1 . 1 1 19 19 ALA H H 19 7.500 7.500 7.564 -0.065 19799
107 1 . 1 1 20 20 GLN N N 20 118.679 118.679 118.603 0.076 19799
108 1 . 1 1 20 20 GLN HA H 20 3.856 3.856 4.010 -0.154 19799
109 1 . 1 1 20 20 GLN C C 20 177.608 177.608 177.528 0.080 19799
110 1 . 1 1 20 20 GLN CA C 20 58.470 58.470 58.140 0.330 19799
111 1 . 1 1 20 20 GLN CB C 20 28.282 28.282 28.915 -0.633 19799
112 1 . 1 1 20 20 GLN H H 20 7.941 7.941 7.455 0.486 19799
113 1 . 1 1 21 21 TYR N N 21 113.907 113.907 113.159 0.748 19799
114 1 . 1 1 21 21 TYR HA H 21 4.366 4.366 4.806 -0.440 19799
115 1 . 1 1 21 21 TYR C C 21 175.496 175.496 175.558 -0.062 19799
116 1 . 1 1 21 21 TYR CA C 21 60.036 60.036 55.605 4.431 19799
117 1 . 1 1 21 21 TYR CB C 21 39.198 39.198 38.111 1.087 19799
118 1 . 1 1 21 21 TYR H H 21 7.669 7.669 7.022 0.646 19799
119 1 . 1 1 22 22 GLY N N 22 111.326 111.326 109.059 2.267 19799
120 1 . 1 1 22 22 GLY C C 22 174.783 174.783 173.555 1.228 19799
121 1 . 1 1 22 22 GLY CA C 22 47.450 47.450 45.413 2.037 19799
122 1 . 1 1 22 22 GLY H H 22 7.949 7.949 7.669 0.280 19799
123 1 . 1 1 23 23 VAL N N 23 113.949 113.949 118.324 -4.375 19799
124 1 . 1 1 23 23 VAL HA H 23 4.807 4.807 4.574 0.233 19799
125 1 . 1 1 23 23 VAL C C 23 173.768 173.768 174.001 -0.233 19799
126 1 . 1 1 23 23 VAL CA C 23 58.434 58.434 59.572 -1.139 19799
127 1 . 1 1 23 23 VAL CB C 23 34.961 34.961 35.544 -0.584 19799
128 1 . 1 1 23 23 VAL H H 23 8.040 8.040 8.210 -0.170 19799
129 1 . 1 1 24 24 SER N N 24 115.672 115.672 118.111 -2.439 19799
130 1 . 1 1 24 24 SER HA H 24 4.655 4.655 4.686 -0.031 19799
131 1 . 1 1 24 24 SER C C 24 176.015 176.015 175.811 0.204 19799
132 1 . 1 1 24 24 SER CA C 24 56.111 56.111 56.893 -0.782 19799
133 1 . 1 1 24 24 SER CB C 24 65.385 65.385 64.425 0.960 19799
134 1 . 1 1 24 24 SER H H 24 8.269 8.269 8.384 -0.115 19799
135 1 . 1 1 25 25 VAL N N 25 122.227 122.227 125.713 -3.486 19799
136 1 . 1 1 25 25 VAL HA H 25 3.377 3.377 3.679 -0.302 19799
137 1 . 1 1 25 25 VAL C C 25 177.775 177.775 177.353 0.421 19799
138 1 . 1 1 25 25 VAL CA C 25 67.140 67.140 66.276 0.864 19799
139 1 . 1 1 25 25 VAL CB C 25 31.370 31.370 31.484 -0.114 19799
140 1 . 1 1 25 25 VAL H H 25 8.866 8.866 8.834 0.032 19799
141 1 . 1 1 26 26 ALA N N 26 120.890 120.890 121.973 -1.083 19799
142 1 . 1 1 26 26 ALA HA H 26 3.914 3.914 3.932 -0.018 19799
143 1 . 1 1 26 26 ALA C C 26 180.692 180.692 178.832 1.860 19799
144 1 . 1 1 26 26 ALA CA C 26 55.312 55.312 55.742 -0.430 19799
145 1 . 1 1 26 26 ALA CB C 26 17.825 17.825 18.166 -0.341 19799
146 1 . 1 1 26 26 ALA H H 26 8.218 8.218 8.027 0.191 19799
147 1 . 1 1 27 27 ASN N N 27 118.099 118.099 116.482 1.617 19799
148 1 . 1 1 27 27 ASN HA H 27 3.703 3.703 4.084 -0.381 19799
149 1 . 1 1 27 27 ASN C C 27 175.308 175.308 176.799 -1.491 19799
150 1 . 1 1 27 27 ASN CA C 27 55.220 55.220 55.104 0.116 19799
151 1 . 1 1 27 27 ASN CB C 27 36.864 36.864 37.296 -0.432 19799
152 1 . 1 1 27 27 ASN H H 27 7.846 7.846 7.721 0.125 19799
153 1 . 1 1 28 28 LEU N N 28 116.512 116.512 118.650 -2.138 19799
154 1 . 1 1 28 28 LEU HA H 28 3.743 3.743 3.784 -0.041 19799
155 1 . 1 1 28 28 LEU C C 28 181.142 181.142 178.684 2.458 19799
156 1 . 1 1 28 28 LEU CA C 28 58.257 58.257 57.449 0.808 19799
157 1 . 1 1 28 28 LEU CB C 28 42.085 42.085 41.495 0.590 19799
158 1 . 1 1 28 28 LEU H H 28 7.475 7.475 7.487 -0.012 19799
159 1 . 1 1 29 29 ARG N N 29 117.344 117.344 118.813 -1.469 19799
160 1 . 1 1 29 29 ARG HA H 29 3.952 3.952 3.944 0.008 19799
161 1 . 1 1 29 29 ARG C C 29 178.818 178.818 178.635 0.183 19799
162 1 . 1 1 29 29 ARG CA C 29 60.783 60.783 59.517 1.266 19799
163 1 . 1 1 29 29 ARG CB C 29 30.060 30.060 29.819 0.241 19799
164 1 . 1 1 29 29 ARG H H 29 8.571 8.571 8.032 0.539 19799
165 1 . 1 1 30 30 SER N N 30 114.887 114.887 115.115 -0.228 19799
166 1 . 1 1 30 30 SER HA H 30 4.255 4.255 4.230 0.025 19799
167 1 . 1 1 30 30 SER C C 30 178.552 178.552 175.935 2.617 19799
168 1 . 1 1 30 30 SER CA C 30 61.314 61.314 61.310 0.004 19799
169 1 . 1 1 30 30 SER CB C 30 62.982 62.982 62.977 0.005 19799
170 1 . 1 1 30 30 SER H H 30 7.995 7.995 7.408 0.587 19799
171 1 . 1 1 31 31 TRP N N 31 119.302 119.302 118.763 0.539 19799
172 1 . 1 1 31 31 TRP HA H 31 4.785 4.785 4.780 0.006 19799
173 1 . 1 1 31 31 TRP C C 31 177.570 177.570 176.735 0.835 19799
174 1 . 1 1 31 31 TRP CA C 31 57.005 57.005 56.164 0.841 19799
175 1 . 1 1 31 31 TRP CB C 31 29.928 29.928 28.639 1.289 19799
176 1 . 1 1 31 31 TRP H H 31 9.055 9.055 7.236 1.819 19799
177 1 . 1 1 32 32 ASN N N 32 109.665 109.665 117.941 -8.276 19799
178 1 . 1 1 32 32 ASN HA H 32 5.104 5.104 4.873 0.231 19799
179 1 . 1 1 32 32 ASN C C 32 174.034 174.034 176.370 -2.336 19799
180 1 . 1 1 32 32 ASN CA C 32 53.550 53.550 54.368 -0.818 19799
181 1 . 1 1 32 32 ASN CB C 32 42.065 42.065 39.821 2.244 19799
182 1 . 1 1 32 32 ASN H H 32 7.232 7.232 7.543 -0.311 19799
183 1 . 1 1 33 33 GLY N N 33 111.582 111.582 109.432 2.150 19799
184 1 . 1 1 33 33 GLY C C 33 174.930 174.930 174.109 0.821 19799
185 1 . 1 1 33 33 GLY CA C 33 47.611 47.611 45.959 1.652 19799
186 1 . 1 1 33 33 GLY H H 33 7.864 7.864 7.972 -0.107 19799
187 1 . 1 1 34 34 ILE N N 34 118.759 118.759 119.134 -0.375 19799
188 1 . 1 1 34 34 ILE HA H 34 4.216 4.216 4.308 -0.092 19799
189 1 . 1 1 34 34 ILE C C 34 175.882 175.882 175.470 0.412 19799
190 1 . 1 1 34 34 ILE CA C 34 60.719 60.719 59.912 0.807 19799
191 1 . 1 1 34 34 ILE CB C 34 40.553 40.553 39.421 1.132 19799
192 1 . 1 1 34 34 ILE H H 34 7.918 7.918 7.572 0.346 19799
193 1 . 1 1 35 35 SER N N 35 122.217 122.217 121.494 0.723 19799
194 1 . 1 1 35 35 SER HA H 35 4.583 4.583 4.568 0.015 19799
195 1 . 1 1 35 35 SER C C 35 174.848 174.848 175.025 -0.177 19799
196 1 . 1 1 35 35 SER CA C 35 57.461 57.461 58.134 -0.673 19799
197 1 . 1 1 35 35 SER CB C 35 63.929 63.929 63.553 0.376 19799
198 1 . 1 1 35 35 SER H H 35 8.801 8.801 8.770 0.031 19799
199 1 . 1 1 36 36 GLY N N 36 114.644 114.644 113.524 1.120 19799
200 1 . 1 1 36 36 GLY C C 36 173.365 173.365 173.652 -0.287 19799
201 1 . 1 1 36 36 GLY CA C 36 46.088 46.088 45.099 0.989 19799
202 1 . 1 1 36 36 GLY H H 36 8.614 8.614 8.602 0.012 19799
203 1 . 1 1 37 37 ASP N N 37 122.530 122.530 120.051 2.479 19799
204 1 . 1 1 37 37 ASP HA H 37 4.910 4.910 4.681 0.229 19799
205 1 . 1 1 37 37 ASP C C 37 175.986 175.986 176.452 -0.466 19799
206 1 . 1 1 37 37 ASP CA C 37 53.560 53.560 54.689 -1.129 19799
207 1 . 1 1 37 37 ASP CB C 37 41.958 41.958 40.836 1.122 19799
208 1 . 1 1 37 37 ASP H H 37 8.537 8.537 8.405 0.132 19799
209 1 . 1 1 38 38 LEU N N 38 121.818 121.818 118.330 3.488 19799
210 1 . 1 1 38 38 LEU HA H 38 4.329 4.329 4.714 -0.385 19799
211 1 . 1 1 38 38 LEU C C 38 175.373 175.373 175.816 -0.443 19799
212 1 . 1 1 38 38 LEU CA C 38 56.291 56.291 54.770 1.521 19799
213 1 . 1 1 38 38 LEU CB C 38 41.868 41.868 41.496 0.372 19799
214 1 . 1 1 38 38 LEU H H 38 7.602 7.602 7.555 0.047 19799
215 1 . 1 1 39 39 ILE N N 39 118.291 118.291 124.045 -5.754 19799
216 1 . 1 1 39 39 ILE HA H 39 4.898 4.898 4.338 0.560 19799
217 1 . 1 1 39 39 ILE C C 39 174.861 174.861 174.678 0.183 19799
218 1 . 1 1 39 39 ILE CA C 39 59.354 59.354 61.025 -1.670 19799
219 1 . 1 1 39 39 ILE CB C 39 42.014 42.014 40.437 1.577 19799
220 1 . 1 1 39 39 ILE H H 39 7.708 7.708 7.777 -0.069 19799
221 1 . 1 1 40 40 PHE N N 40 118.274 118.274 122.721 -4.447 19799
222 1 . 1 1 40 40 PHE HA H 40 5.051 5.051 4.928 0.123 19799
223 1 . 1 1 40 40 PHE C C 40 174.537 174.537 173.491 1.046 19799
224 1 . 1 1 40 40 PHE CA C 40 55.438 55.438 55.253 0.185 19799
225 1 . 1 1 40 40 PHE CB C 40 41.980 41.980 40.476 1.504 19799
226 1 . 1 1 40 40 PHE H H 40 8.195 8.195 7.795 0.400 19799
227 1 . 1 1 41 41 VAL N N 41 121.812 121.812 121.893 -0.081 19799
228 1 . 1 1 41 41 VAL HA H 41 3.220 3.220 4.032 -0.812 19799
229 1 . 1 1 41 41 VAL C C 41 177.510 177.510 177.483 0.027 19799
230 1 . 1 1 41 41 VAL CA C 41 65.647 65.647 64.250 1.397 19799
231 1 . 1 1 41 41 VAL CB C 41 31.030 31.030 30.956 0.074 19799
232 1 . 1 1 41 41 VAL H H 41 8.680 8.680 8.586 0.094 19799
233 1 . 1 1 42 42 GLY N N 42 116.069 116.069 115.704 0.365 19799
234 1 . 1 1 42 42 GLY C C 42 173.772 173.772 173.581 0.191 19799
235 1 . 1 1 42 42 GLY CA C 42 44.662 44.662 44.666 -0.004 19799
236 1 . 1 1 42 42 GLY H H 42 8.815 8.815 8.778 0.037 19799
237 1 . 1 1 43 43 GLN N N 43 124.343 124.343 121.767 2.576 19799
238 1 . 1 1 43 43 GLN HA H 43 3.859 3.859 3.988 -0.129 19799
239 1 . 1 1 43 43 GLN C C 43 174.324 174.324 174.926 -0.602 19799
240 1 . 1 1 43 43 GLN CA C 43 56.855 56.855 55.529 1.326 19799
241 1 . 1 1 43 43 GLN CB C 43 29.033 29.033 29.094 -0.061 19799
242 1 . 1 1 43 43 GLN H H 43 8.038 8.038 7.443 0.595 19799
243 1 . 1 1 44 44 LYS N N 44 126.564 126.564 128.275 -1.711 19799
244 1 . 1 1 44 44 LYS HA H 44 4.853 4.853 4.546 0.307 19799
245 1 . 1 1 44 44 LYS C C 44 176.019 176.019 175.712 0.307 19799
246 1 . 1 1 44 44 LYS CA C 44 55.541 55.541 55.757 -0.216 19799
247 1 . 1 1 44 44 LYS CB C 44 33.008 33.008 32.313 0.695 19799
248 1 . 1 1 44 44 LYS H H 44 8.633 8.633 8.457 0.176 19799
249 1 . 1 1 45 45 LEU N N 45 126.114 126.114 124.951 1.163 19799
250 1 . 1 1 45 45 LEU HA H 45 4.719 4.719 5.057 -0.338 19799
251 1 . 1 1 45 45 LEU C C 45 176.670 176.670 175.814 0.856 19799
252 1 . 1 1 45 45 LEU CA C 45 53.094 53.094 52.421 0.673 19799
253 1 . 1 1 45 45 LEU CB C 45 45.102 45.102 44.136 0.966 19799
254 1 . 1 1 45 45 LEU H H 45 9.458 9.458 8.841 0.617 19799
255 1 . 1 1 46 46 ILE N N 46 123.782 123.782 123.232 0.550 19799
256 1 . 1 1 46 46 ILE HA H 46 3.858 3.858 4.372 -0.514 19799
257 1 . 1 1 46 46 ILE C C 46 176.810 176.810 175.556 1.254 19799
258 1 . 1 1 46 46 ILE CA C 46 62.646 62.646 61.605 1.041 19799
259 1 . 1 1 46 46 ILE CB C 46 39.156 39.156 37.129 2.026 19799
260 1 . 1 1 46 46 ILE H H 46 10.038 10.038 9.279 0.759 19799
261 1 . 1 1 47 47 VAL N N 47 117.819 117.819 126.381 -8.562 19799
262 1 . 1 1 47 47 VAL HA H 47 4.507 4.507 4.489 0.018 19799
263 1 . 1 1 47 47 VAL C C 47 173.753 173.753 173.088 0.665 19799
264 1 . 1 1 47 47 VAL CA C 47 60.631 60.631 60.569 0.062 19799
265 1 . 1 1 47 47 VAL CB C 47 32.918 32.918 34.937 -2.019 19799
266 1 . 1 1 47 47 VAL H H 47 8.268 8.268 8.909 -0.641 19799
267 1 . 1 1 48 48 LYS N N 48 118.041 118.041 126.496 -8.455 19799
268 1 . 1 1 48 48 LYS HA H 48 4.028 4.028 4.378 -0.350 19799
269 1 . 1 1 48 48 LYS C C 48 174.214 174.214 174.828 -0.614 19799
270 1 . 1 1 48 48 LYS CA C 48 57.313 57.313 54.802 2.511 19799
271 1 . 1 1 48 48 LYS CB C 48 35.472 35.472 34.150 1.322 19799
272 1 . 1 1 48 48 LYS H H 48 6.778 6.778 7.800 -1.022 19799
273 1 . 1 1 49 49 LYS N N 49 124.877 124.877 125.344 -0.467 19799
274 1 . 1 1 49 49 LYS HA H 49 4.183 4.183 4.478 -0.295 19799
275 1 . 1 1 49 49 LYS C C 49 176.704 176.704 176.736 -0.032 19799
276 1 . 1 1 49 49 LYS CA C 49 54.753 54.753 56.331 -1.578 19799
277 1 . 1 1 49 49 LYS CB C 49 33.181 33.181 32.215 0.966 19799
278 1 . 1 1 49 49 LYS H H 49 7.204 7.204 8.548 -1.344 19799
279 1 . 1 1 50 50 GLY N N 50 112.262 112.262 113.455 -1.193 19799
280 1 . 1 1 50 50 GLY C C 50 173.665 173.665 173.834 -0.169 19799
281 1 . 1 1 50 50 GLY CA C 50 45.138 45.138 45.028 0.110 19799
282 1 . 1 1 50 50 GLY H H 50 8.363 8.363 8.639 -0.276 19799
stop_
save_