data_25464
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25464
_Entry.PDB_ID 2MYY
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 25464
_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 PRO HA H 2 4.460 4.460 4.713 -0.253 25464
2 1 1 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.701 0.699 25464
3 1 1 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.938 -0.838 25464
4 1 1 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.807 0.293 25464
5 1 1 . 1 1 10 10 ASP N N 10 121.500 121.500 122.056 -0.556 25464
6 1 1 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.517 0.083 25464
7 1 1 . 1 1 10 10 ASP C C 10 175.300 175.300 175.504 -0.204 25464
8 1 1 . 1 1 10 10 ASP CA C 10 54.500 54.500 53.669 0.831 25464
9 1 1 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.516 -0.616 25464
10 1 1 . 1 1 10 10 ASP H H 10 8.420 8.420 7.686 0.734 25464
11 1 1 . 1 1 11 11 ASN N N 11 118.400 118.400 119.601 -1.201 25464
12 1 1 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.907 0.043 25464
13 1 1 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.604 -0.804 25464
14 1 1 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.984 0.116 25464
15 1 1 . 1 1 11 11 ASN H H 11 8.270 8.270 8.535 -0.265 25464
16 1 1 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.696 -0.316 25464
17 1 1 . 1 1 12 12 PRO C C 12 177.100 177.100 176.260 0.840 25464
18 1 1 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.104 0.596 25464
19 1 1 . 1 1 12 12 PRO CB C 12 31.900 31.900 32.395 -0.495 25464
20 1 1 . 1 1 13 13 PHE N N 13 117.500 117.500 117.783 -0.283 25464
21 1 1 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.483 0.017 25464
22 1 1 . 1 1 13 13 PHE C C 13 175.700 175.700 174.775 0.925 25464
23 1 1 . 1 1 13 13 PHE CA C 13 58.300 58.300 57.954 0.346 25464
24 1 1 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.838 -0.138 25464
25 1 1 . 1 1 13 13 PHE H H 13 8.120 8.120 7.719 0.401 25464
26 1 1 . 1 1 14 14 ASP N N 14 120.000 120.000 116.425 3.575 25464
27 1 1 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.645 -0.025 25464
28 1 1 . 1 1 14 14 ASP C C 14 175.800 175.800 175.403 0.397 25464
29 1 1 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.220 1.180 25464
30 1 1 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.486 0.914 25464
31 1 1 . 1 1 14 14 ASP H H 14 8.010 8.010 8.010 0.000 25464
32 1 1 . 1 1 15 15 ASP N N 15 119.900 119.900 122.534 -2.634 25464
33 1 1 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.753 -0.143 25464
34 1 1 . 1 1 15 15 ASP C C 15 176.700 176.700 177.388 -0.688 25464
35 1 1 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.100 -0.600 25464
36 1 1 . 1 1 15 15 ASP CB C 15 41.200 41.200 41.307 -0.107 25464
37 1 1 . 1 1 15 15 ASP H H 15 7.900 7.900 7.887 0.013 25464
38 1 1 . 1 1 16 16 GLU N N 16 122.700 122.700 124.566 -1.866 25464
39 1 1 . 1 1 16 16 GLU HA H 16 4.230 4.230 3.927 0.303 25464
40 1 1 . 1 1 16 16 GLU C C 16 176.600 176.600 177.081 -0.481 25464
41 1 1 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.764 -1.364 25464
42 1 1 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.294 0.806 25464
43 1 1 . 1 1 16 16 GLU H H 16 8.610 8.610 8.898 -0.288 25464
44 1 1 . 1 1 17 17 ASP N N 17 119.500 119.500 119.036 0.464 25464
45 1 1 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.466 0.384 25464
46 1 1 . 1 1 17 17 ASP C C 17 176.300 176.300 176.847 -0.547 25464
47 1 1 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.152 -0.852 25464
48 1 1 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.440 1.160 25464
49 1 1 . 1 1 17 17 ASP H H 17 8.490 8.490 8.427 0.063 25464
50 1 1 . 1 1 18 18 GLY N N 18 107.700 107.700 106.647 1.053 25464
51 1 1 . 1 1 18 18 GLY C C 18 172.700 172.700 172.581 0.119 25464
52 1 1 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.031 0.869 25464
53 1 1 . 1 1 18 18 GLY H H 18 8.070 8.070 7.749 0.321 25464
54 1 1 . 1 1 19 19 MET N N 19 117.400 117.400 119.499 -2.099 25464
55 1 1 . 1 1 19 19 MET HA H 19 4.890 4.890 4.533 0.357 25464
56 1 1 . 1 1 19 19 MET C C 19 176.000 176.000 174.939 1.061 25464
57 1 1 . 1 1 19 19 MET CA C 19 53.700 53.700 55.325 -1.625 25464
58 1 1 . 1 1 19 19 MET CB C 19 35.100 35.100 33.725 1.375 25464
59 1 1 . 1 1 19 19 MET H H 19 7.820 7.820 8.287 -0.467 25464
60 1 1 . 1 1 20 20 PHE N N 20 120.100 120.100 119.717 0.383 25464
61 1 1 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.731 0.279 25464
62 1 1 . 1 1 20 20 PHE C C 20 174.200 174.200 174.830 -0.630 25464
63 1 1 . 1 1 20 20 PHE CA C 20 57.400 57.400 54.542 2.858 25464
64 1 1 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.867 3.933 25464
65 1 1 . 1 1 20 20 PHE H H 20 9.370 9.370 8.583 0.787 25464
66 1 1 . 1 1 21 21 PHE N N 21 115.200 115.200 115.561 -0.361 25464
67 1 1 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.304 0.326 25464
68 1 1 . 1 1 21 21 PHE C C 21 177.500 177.500 174.678 2.822 25464
69 1 1 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.505 -0.005 25464
70 1 1 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.639 3.461 25464
71 1 1 . 1 1 21 21 PHE H H 21 9.600 9.600 8.481 1.119 25464
72 1 1 . 1 1 22 22 VAL N N 22 116.600 116.600 121.031 -4.431 25464
73 1 1 . 1 1 22 22 VAL C C 22 175.000 175.000 175.464 -0.464 25464
74 1 1 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.982 0.718 25464
75 1 1 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.127 0.673 25464
76 1 1 . 1 1 22 22 VAL H H 22 8.750 8.750 8.628 0.122 25464
77 1 1 . 1 1 23 23 LEU N N 23 126.500 126.500 126.938 -0.438 25464
78 1 1 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.581 0.059 25464
79 1 1 . 1 1 23 23 LEU C C 23 176.200 176.200 176.085 0.115 25464
80 1 1 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.936 -1.136 25464
81 1 1 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.316 1.384 25464
82 1 1 . 1 1 23 23 LEU H H 23 9.530 9.530 8.911 0.619 25464
83 1 1 . 1 1 24 24 ILE N N 24 117.700 117.700 118.421 -0.721 25464
84 1 1 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.393 0.297 25464
85 1 1 . 1 1 24 24 ILE C C 24 174.300 174.300 173.413 0.887 25464
86 1 1 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.054 -0.154 25464
87 1 1 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.702 0.898 25464
88 1 1 . 1 1 24 24 ILE H H 24 9.300 9.300 8.843 0.457 25464
89 1 1 . 1 1 25 25 ASN N N 25 122.500 122.500 123.384 -0.884 25464
90 1 1 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.878 -0.178 25464
91 1 1 . 1 1 25 25 ASN C C 25 177.700 177.700 175.962 1.738 25464
92 1 1 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.845 -1.145 25464
93 1 1 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.352 -2.752 25464
94 1 1 . 1 1 25 25 ASN H H 25 7.300 7.300 8.455 -1.155 25464
95 1 1 . 1 1 26 26 ASP N N 26 118.100 118.100 122.791 -4.691 25464
96 1 1 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.266 0.094 25464
97 1 1 . 1 1 26 26 ASP C C 26 176.700 176.700 176.125 0.575 25464
98 1 1 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.593 -1.093 25464
99 1 1 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.795 -0.895 25464
100 1 1 . 1 1 26 26 ASP H H 26 8.340 8.340 8.756 -0.416 25464
101 1 1 . 1 1 27 27 GLU N N 27 117.600 117.600 117.749 -0.149 25464
102 1 1 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.214 0.326 25464
103 1 1 . 1 1 27 27 GLU C C 27 175.100 175.100 176.050 -0.950 25464
104 1 1 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.180 -0.480 25464
105 1 1 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.285 1.215 25464
106 1 1 . 1 1 27 27 GLU H H 27 7.190 7.190 7.838 -0.648 25464
107 1 1 . 1 1 28 28 GLU N N 28 112.800 112.800 113.817 -1.017 25464
108 1 1 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.951 -0.361 25464
109 1 1 . 1 1 28 28 GLU C C 28 175.200 175.200 175.384 -0.184 25464
110 1 1 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.693 0.107 25464
111 1 1 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.985 -0.485 25464
112 1 1 . 1 1 28 28 GLU H H 28 8.050 8.050 7.826 0.224 25464
113 1 1 . 1 1 29 29 GLN N N 29 117.200 117.200 117.699 -0.499 25464
114 1 1 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.216 0.064 25464
115 1 1 . 1 1 29 29 GLN C C 29 174.600 174.600 175.516 -0.916 25464
116 1 1 . 1 1 29 29 GLN CA C 29 54.900 54.900 54.607 0.293 25464
117 1 1 . 1 1 29 29 GLN CB C 29 29.300 29.300 28.467 0.833 25464
118 1 1 . 1 1 29 29 GLN H H 29 7.840 7.840 7.684 0.156 25464
119 1 1 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.802 0.258 25464
120 1 1 . 1 1 30 30 HIS C C 30 175.900 175.900 174.840 1.060 25464
121 1 1 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.611 1.089 25464
122 1 1 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.959 0.941 25464
123 1 1 . 1 1 31 31 SER N N 31 113.100 113.100 115.700 -2.600 25464
124 1 1 . 1 1 31 31 SER HA H 31 4.740 4.740 4.667 0.073 25464
125 1 1 . 1 1 31 31 SER C C 31 173.200 173.200 171.859 1.341 25464
126 1 1 . 1 1 31 31 SER CA C 31 57.400 57.400 57.880 -0.479 25464
127 1 1 . 1 1 31 31 SER CB C 31 66.600 66.600 64.315 2.285 25464
128 1 1 . 1 1 31 31 SER H H 31 8.850 8.850 8.646 0.204 25464
129 1 1 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.072 0.288 25464
130 1 1 . 1 1 32 32 LEU C C 32 178.200 178.200 174.871 3.329 25464
131 1 1 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.311 1.689 25464
132 1 1 . 1 1 32 32 LEU CB C 32 43.700 43.700 43.919 -0.219 25464
133 1 1 . 1 1 33 33 TRP N N 33 123.400 123.400 129.773 -6.373 25464
134 1 1 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.911 0.389 25464
135 1 1 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.175 -0.075 25464
136 1 1 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.899 1.601 25464
137 1 1 . 1 1 33 33 TRP H H 33 9.170 9.170 9.310 -0.140 25464
138 1 1 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.515 -0.705 25464
139 1 1 . 1 1 34 34 PRO C C 34 177.400 177.400 177.373 0.027 25464
140 1 1 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.039 -0.239 25464
141 1 1 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.580 -1.579 25464
142 1 1 . 1 1 35 35 THR N N 35 107.700 107.700 114.606 -6.906 25464
143 1 1 . 1 1 35 35 THR HA H 35 3.730 3.730 4.374 -0.644 25464
144 1 1 . 1 1 35 35 THR C C 35 176.100 176.100 174.925 1.175 25464
145 1 1 . 1 1 35 35 THR CA C 35 63.600 63.600 64.674 -1.074 25464
146 1 1 . 1 1 35 35 THR CB C 35 68.200 68.200 68.288 -0.088 25464
147 1 1 . 1 1 35 35 THR H H 35 7.260 7.260 8.039 -0.779 25464
148 1 1 . 1 1 36 36 PHE N N 36 114.500 114.500 119.277 -4.777 25464
149 1 1 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.640 -0.130 25464
150 1 1 . 1 1 36 36 PHE C C 36 174.500 174.500 175.025 -0.525 25464
151 1 1 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.421 -0.521 25464
152 1 1 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.516 -0.916 25464
153 1 1 . 1 1 36 36 PHE H H 36 6.770 6.770 7.455 -0.685 25464
154 1 1 . 1 1 37 37 ALA N N 37 125.300 125.300 121.911 3.389 25464
155 1 1 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.688 0.022 25464
156 1 1 . 1 1 37 37 ALA C C 37 177.300 177.300 174.997 2.303 25464
157 1 1 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.885 -0.685 25464
158 1 1 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.488 -1.087 25464
159 1 1 . 1 1 37 37 ALA H H 37 6.950 6.950 7.491 -0.541 25464
160 1 1 . 1 1 38 38 ASP N N 38 124.500 124.500 121.281 3.219 25464
161 1 1 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.865 -0.385 25464
162 1 1 . 1 1 38 38 ASP C C 38 176.700 176.700 176.046 0.654 25464
163 1 1 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.873 1.127 25464
164 1 1 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.607 -2.207 25464
165 1 1 . 1 1 38 38 ASP H H 38 8.870 8.870 8.577 0.293 25464
166 1 1 . 1 1 39 39 VAL N N 39 126.000 126.000 122.712 3.288 25464
167 1 1 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.759 -0.399 25464
168 1 1 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.250 0.850 25464
169 1 1 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.166 1.034 25464
170 1 1 . 1 1 39 39 VAL H H 39 8.650 8.650 8.429 0.221 25464
171 1 1 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.355 -0.105 25464
172 1 1 . 1 1 40 40 PRO C C 40 175.800 175.800 176.235 -0.435 25464
173 1 1 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.636 -0.437 25464
174 1 1 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.672 0.028 25464
175 1 1 . 1 1 41 41 ALA N N 41 122.700 122.700 125.969 -3.269 25464
176 1 1 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.052 0.128 25464
177 1 1 . 1 1 41 41 ALA C C 41 179.000 179.000 178.780 0.220 25464
178 1 1 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.476 -0.176 25464
179 1 1 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.055 -0.755 25464
180 1 1 . 1 1 41 41 ALA H H 41 8.280 8.280 8.430 -0.150 25464
181 1 1 . 1 1 42 42 GLY N N 42 109.800 109.800 111.557 -1.757 25464
182 1 1 . 1 1 42 42 GLY C C 42 173.800 173.800 173.506 0.294 25464
183 1 1 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.896 -0.196 25464
184 1 1 . 1 1 42 42 GLY H H 42 8.770 8.770 8.345 0.425 25464
185 1 1 . 1 1 43 43 TRP N N 43 120.300 120.300 121.597 -1.297 25464
186 1 1 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.358 -0.408 25464
187 1 1 . 1 1 43 43 TRP C C 43 174.900 174.900 175.992 -1.092 25464
188 1 1 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.049 -0.349 25464
189 1 1 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.762 1.238 25464
190 1 1 . 1 1 43 43 TRP H H 43 7.740 7.740 7.923 -0.183 25464
191 1 1 . 1 1 44 44 ARG N N 44 117.700 117.700 122.182 -4.482 25464
192 1 1 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.743 -0.023 25464
193 1 1 . 1 1 44 44 ARG C C 44 174.900 174.900 175.161 -0.261 25464
194 1 1 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.607 -0.707 25464
195 1 1 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.485 0.715 25464
196 1 1 . 1 1 44 44 ARG H H 44 8.990 8.990 9.060 -0.070 25464
197 1 1 . 1 1 45 45 VAL N N 45 122.800 122.800 124.834 -2.034 25464
198 1 1 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.146 -0.166 25464
199 1 1 . 1 1 45 45 VAL C C 45 177.600 177.600 176.763 0.837 25464
200 1 1 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.483 0.217 25464
201 1 1 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.442 0.658 25464
202 1 1 . 1 1 45 45 VAL H H 45 8.720 8.720 8.614 0.106 25464
203 1 1 . 1 1 46 46 VAL N N 46 120.400 120.400 125.351 -4.951 25464
204 1 1 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.114 0.566 25464
205 1 1 . 1 1 46 46 VAL C C 46 174.200 174.200 175.035 -0.835 25464
206 1 1 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.303 -2.803 25464
207 1 1 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.795 1.205 25464
208 1 1 . 1 1 46 46 VAL H H 46 9.060 9.060 8.716 0.344 25464
209 1 1 . 1 1 47 47 PHE N N 47 121.100 121.100 122.072 -0.972 25464
210 1 1 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.610 -0.160 25464
211 1 1 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.730 1.970 25464
212 1 1 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.660 0.040 25464
213 1 1 . 1 1 47 47 PHE H H 47 7.680 7.680 8.172 -0.492 25464
214 1 1 . 1 1 48 48 GLY N N 48 112.600 112.600 112.499 0.101 25464
215 1 1 . 1 1 48 48 GLY C C 48 174.700 174.700 173.839 0.861 25464
216 1 1 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.361 -2.361 25464
217 1 1 . 1 1 48 48 GLY H H 48 7.380 7.380 8.261 -0.881 25464
218 1 1 . 1 1 49 49 GLU N N 49 120.600 120.600 118.788 1.812 25464
219 1 1 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.289 -0.059 25464
220 1 1 . 1 1 49 49 GLU C C 49 174.900 174.900 175.816 -0.916 25464
221 1 1 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.411 -1.111 25464
222 1 1 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.915 2.285 25464
223 1 1 . 1 1 49 49 GLU H H 49 8.510 8.510 8.558 -0.048 25464
224 1 1 . 1 1 50 50 ALA N N 50 126.600 126.600 128.932 -2.332 25464
225 1 1 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.656 -0.016 25464
226 1 1 . 1 1 50 50 ALA C C 50 175.100 175.100 175.694 -0.594 25464
227 1 1 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.334 1.065 25464
228 1 1 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.798 0.402 25464
229 1 1 . 1 1 50 50 ALA H H 50 9.440 9.440 8.971 0.469 25464
230 1 1 . 1 1 51 51 SER N N 51 115.100 115.100 115.710 -0.610 25464
231 1 1 . 1 1 51 51 SER HA H 51 4.740 4.740 4.102 0.638 25464
232 1 1 . 1 1 51 51 SER C C 51 175.000 175.000 176.053 -1.053 25464
233 1 1 . 1 1 51 51 SER CA C 51 58.100 58.100 59.809 -1.709 25464
234 1 1 . 1 1 51 51 SER CB C 51 64.700 64.700 63.431 1.269 25464
235 1 1 . 1 1 51 51 SER H H 51 8.950 8.950 8.518 0.432 25464
236 1 1 . 1 1 52 52 ARG N N 52 123.500 123.500 126.968 -3.468 25464
237 1 1 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.845 -0.435 25464
238 1 1 . 1 1 52 52 ARG C C 52 178.200 178.200 177.643 0.557 25464
239 1 1 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.542 1.458 25464
240 1 1 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.976 -0.076 25464
241 1 1 . 1 1 52 52 ARG H H 52 9.540 9.540 8.427 1.113 25464
242 1 1 . 1 1 53 53 ALA N N 53 118.000 118.000 119.552 -1.552 25464
243 1 1 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.029 0.001 25464
244 1 1 . 1 1 53 53 ALA C C 53 181.000 181.000 179.309 1.691 25464
245 1 1 . 1 1 53 53 ALA CA C 53 55.300 55.300 54.855 0.445 25464
246 1 1 . 1 1 53 53 ALA CB C 53 18.100 18.100 18.262 -0.162 25464
247 1 1 . 1 1 53 53 ALA H H 53 8.770 8.770 8.588 0.182 25464
248 1 1 . 1 1 54 54 SER N N 54 115.300 115.300 115.111 0.189 25464
249 1 1 . 1 1 54 54 SER HA H 54 4.350 4.350 4.097 0.253 25464
250 1 1 . 1 1 54 54 SER C C 54 177.500 177.500 176.652 0.848 25464
251 1 1 . 1 1 54 54 SER CA C 54 61.900 61.900 61.108 0.792 25464
252 1 1 . 1 1 54 54 SER CB C 54 63.100 63.100 62.888 0.212 25464
253 1 1 . 1 1 54 54 SER H H 54 8.140 8.140 7.896 0.244 25464
254 1 1 . 1 1 55 55 CYS N N 55 121.900 121.900 121.468 0.432 25464
255 1 1 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.655 0.505 25464
256 1 1 . 1 1 55 55 CYS C C 55 176.300 176.300 176.855 -0.555 25464
257 1 1 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.045 0.255 25464
258 1 1 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.609 0.391 25464
259 1 1 . 1 1 55 55 CYS H H 55 8.430 8.430 7.595 0.835 25464
260 1 1 . 1 1 56 56 VAL N N 56 121.100 121.100 119.948 1.152 25464
261 1 1 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.623 -0.133 25464
262 1 1 . 1 1 56 56 VAL C C 56 177.800 177.800 178.270 -0.470 25464
263 1 1 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.779 0.221 25464
264 1 1 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.022 0.578 25464
265 1 1 . 1 1 56 56 VAL H H 56 8.750 8.750 8.368 0.382 25464
266 1 1 . 1 1 57 57 GLU N N 57 119.200 119.200 120.674 -1.474 25464
267 1 1 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.965 0.105 25464
268 1 1 . 1 1 57 57 GLU C C 57 177.900 177.900 178.913 -1.013 25464
269 1 1 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.760 -0.460 25464
270 1 1 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.607 -0.107 25464
271 1 1 . 1 1 57 57 GLU H H 57 7.780 7.780 8.277 -0.497 25464
272 1 1 . 1 1 58 58 TYR N N 58 119.400 119.400 120.244 -0.844 25464
273 1 1 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.200 -0.310 25464
274 1 1 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.696 0.504 25464
275 1 1 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.776 -1.576 25464
276 1 1 . 1 1 58 58 TYR H H 58 7.700 7.700 8.036 -0.336 25464
277 1 1 . 1 1 59 59 VAL N N 59 121.500 121.500 118.935 2.565 25464
278 1 1 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.388 -0.028 25464
279 1 1 . 1 1 59 59 VAL C C 59 176.300 176.300 177.644 -1.344 25464
280 1 1 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.636 0.764 25464
281 1 1 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.031 0.369 25464
282 1 1 . 1 1 59 59 VAL H H 59 8.380 8.380 8.268 0.112 25464
283 1 1 . 1 1 60 60 ASP N N 60 120.000 120.000 116.991 3.009 25464
284 1 1 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.766 -0.356 25464
285 1 1 . 1 1 60 60 ASP C C 60 178.300 178.300 177.931 0.369 25464
286 1 1 . 1 1 60 60 ASP CA C 60 57.100 57.100 56.866 0.234 25464
287 1 1 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.240 -0.640 25464
288 1 1 . 1 1 60 60 ASP H H 60 8.580 8.580 8.391 0.189 25464
289 1 1 . 1 1 61 61 GLN N N 61 114.500 114.500 116.012 -1.512 25464
290 1 1 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.431 -0.421 25464
291 1 1 . 1 1 61 61 GLN C C 61 176.700 176.700 177.140 -0.440 25464
292 1 1 . 1 1 61 61 GLN CA C 61 56.700 56.700 56.559 0.141 25464
293 1 1 . 1 1 61 61 GLN CB C 61 28.800 28.800 29.497 -0.697 25464
294 1 1 . 1 1 61 61 GLN H H 61 7.810 7.810 7.598 0.212 25464
295 1 1 . 1 1 62 62 HIS N N 62 115.100 115.100 119.757 -4.657 25464
296 1 1 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.434 -0.054 25464
297 1 1 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.201 1.099 25464
298 1 1 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.455 -0.455 25464
299 1 1 . 1 1 62 62 HIS H H 62 7.730 7.730 7.713 0.017 25464
300 1 1 . 1 1 63 63 TRP N N 63 121.500 121.500 117.789 3.711 25464
301 1 1 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.232 -0.432 25464
302 1 1 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.704 -0.004 25464
303 1 1 . 1 1 63 63 TRP H H 63 8.180 8.180 7.743 0.437 25464
304 1 1 . 1 1 64 64 THR N N 64 114.900 114.900 108.249 6.651 25464
305 1 1 . 1 1 64 64 THR HA H 64 4.180 4.180 3.941 0.239 25464
306 1 1 . 1 1 64 64 THR CA C 64 62.100 62.100 63.228 -1.128 25464
307 1 1 . 1 1 64 64 THR CB C 64 69.500 69.500 67.790 1.710 25464
308 1 1 . 1 1 64 64 THR H H 64 7.940 7.940 8.107 -0.167 25464
309 1 1 . 1 1 65 65 ASP N N 65 122.900 122.900 118.498 4.402 25464
310 1 1 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.593 -0.193 25464
311 1 1 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.457 -0.357 25464
312 1 1 . 1 1 65 65 ASP H H 65 8.340 8.340 8.103 0.237 25464
313 1 1 . 1 1 66 66 ILE N N 66 122.200 122.200 123.028 -0.828 25464
314 1 1 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.067 0.093 25464
315 1 1 . 1 1 66 66 ILE CA C 66 61.100 61.100 61.556 -0.456 25464
316 1 1 . 1 1 66 66 ILE CB C 66 38.500 38.500 38.529 -0.029 25464
317 1 1 . 1 1 66 66 ILE H H 66 8.250 8.250 8.335 -0.085 25464
318 1 1 . 1 1 67 67 ARG N N 67 124.000 124.000 125.252 -1.252 25464
319 1 1 . 1 1 67 67 ARG CA C 67 53.900 53.900 57.599 -3.699 25464
320 1 1 . 1 1 67 67 ARG CB C 67 30.000 30.000 29.017 0.983 25464
321 1 1 . 1 1 67 67 ARG H H 67 8.490 8.490 8.443 0.047 25464
322 1 1 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.443 -0.003 25464
323 1 1 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.901 0.199 25464
324 1 1 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.924 0.176 25464
325 1 1 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.422 -0.092 25464
326 1 1 . 1 1 69 69 LYS C C 69 175.900 175.900 176.402 -0.502 25464
327 1 1 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.286 0.014 25464
328 1 1 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.496 0.504 25464
329 1 1 . 1 1 69 69 LYS H H 69 8.270 8.270 8.450 -0.180 25464
330 1 1 . 1 1 70 70 SER N N 70 122.300 122.300 117.916 4.384 25464
331 1 1 . 1 1 70 70 SER HA H 70 4.580 4.580 4.698 -0.118 25464
332 1 1 . 1 1 70 70 SER CA C 70 59.900 59.900 57.518 2.382 25464
333 1 1 . 1 1 70 70 SER CB C 70 65.100 65.100 63.999 1.101 25464
334 1 1 . 1 1 70 70 SER H H 70 8.140 8.140 8.564 -0.424 25464
335 1 1 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.502 -0.182 25464
336 1 1 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.268 0.132 25464
337 1 1 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.661 -1.561 25464
338 1 1 . 1 1 76 76 ALA N N 76 124.000 124.000 125.958 -1.958 25464
339 1 1 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.435 -0.105 25464
340 1 1 . 1 1 76 76 ALA CA C 76 52.700 52.700 53.263 -0.563 25464
341 1 1 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.100 -0.100 25464
342 1 1 . 1 1 76 76 ALA H H 76 8.200 8.200 8.563 -0.363 25464
343 1 1 . 1 1 77 77 SER N N 77 114.100 114.100 111.653 2.447 25464
344 1 1 . 1 1 77 77 SER HA H 77 4.450 4.450 5.086 -0.636 25464
345 1 1 . 1 1 77 77 SER CA C 77 58.200 58.200 57.861 0.339 25464
346 1 1 . 1 1 77 77 SER CB C 77 63.900 63.900 65.677 -1.777 25464
347 1 1 . 1 1 77 77 SER H H 77 8.210 8.210 8.094 0.116 25464
348 1 1 . 1 1 78 78 GLY N N 78 110.500 110.500 108.245 2.255 25464
349 1 1 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.786 0.614 25464
350 1 1 . 1 1 78 78 GLY H H 78 8.390 8.390 8.500 -0.110 25464
351 1 1 . 1 1 79 79 GLN N N 79 119.600 119.600 119.876 -0.276 25464
352 1 1 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.008 0.592 25464
353 1 1 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.531 -0.931 25464
354 1 1 . 1 1 79 79 GLN H H 79 8.250 8.250 9.624 -1.374 25464
355 1 2 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.592 -0.132 25464
356 1 2 . 1 1 2 2 PRO CA C 2 63.400 63.400 63.041 0.359 25464
357 1 2 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.356 -0.256 25464
358 1 2 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.587 0.513 25464
359 1 2 . 1 1 10 10 ASP N N 10 121.500 121.500 121.879 -0.379 25464
360 1 2 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.716 -0.116 25464
361 1 2 . 1 1 10 10 ASP C C 10 175.300 175.300 174.747 0.553 25464
362 1 2 . 1 1 10 10 ASP CA C 10 54.500 54.500 53.597 0.902 25464
363 1 2 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.434 -0.534 25464
364 1 2 . 1 1 10 10 ASP H H 10 8.420 8.420 8.291 0.129 25464
365 1 2 . 1 1 11 11 ASN N N 11 118.400 118.400 118.682 -0.282 25464
366 1 2 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.744 0.206 25464
367 1 2 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.712 0.089 25464
368 1 2 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.379 0.721 25464
369 1 2 . 1 1 11 11 ASN H H 11 8.270 8.270 8.379 -0.109 25464
370 1 2 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.321 0.059 25464
371 1 2 . 1 1 12 12 PRO C C 12 177.100 177.100 176.341 0.759 25464
372 1 2 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.988 -0.288 25464
373 1 2 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.814 0.086 25464
374 1 2 . 1 1 13 13 PHE N N 13 117.500 117.500 114.072 3.428 25464
375 1 2 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.741 -0.241 25464
376 1 2 . 1 1 13 13 PHE C C 13 175.700 175.700 174.688 1.012 25464
377 1 2 . 1 1 13 13 PHE CA C 13 58.300 58.300 55.428 2.872 25464
378 1 2 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.682 0.018 25464
379 1 2 . 1 1 13 13 PHE H H 13 8.120 8.120 6.822 1.298 25464
380 1 2 . 1 1 14 14 ASP N N 14 120.000 120.000 121.461 -1.461 25464
381 1 2 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.618 0.002 25464
382 1 2 . 1 1 14 14 ASP C C 14 175.800 175.800 175.312 0.488 25464
383 1 2 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.359 1.041 25464
384 1 2 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.432 -0.032 25464
385 1 2 . 1 1 14 14 ASP H H 14 8.010 8.010 7.508 0.502 25464
386 1 2 . 1 1 15 15 ASP N N 15 119.900 119.900 119.221 0.679 25464
387 1 2 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.649 -0.039 25464
388 1 2 . 1 1 15 15 ASP C C 15 176.700 176.700 177.577 -0.877 25464
389 1 2 . 1 1 15 15 ASP CA C 15 54.500 54.500 53.849 0.651 25464
390 1 2 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.369 -1.169 25464
391 1 2 . 1 1 15 15 ASP H H 15 7.900 7.900 8.134 -0.234 25464
392 1 2 . 1 1 16 16 GLU N N 16 122.700 122.700 123.369 -0.669 25464
393 1 2 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.009 0.221 25464
394 1 2 . 1 1 16 16 GLU C C 16 176.600 176.600 177.710 -1.110 25464
395 1 2 . 1 1 16 16 GLU CA C 16 57.400 57.400 59.483 -2.083 25464
396 1 2 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.426 0.674 25464
397 1 2 . 1 1 16 16 GLU H H 16 8.610 8.610 8.834 -0.224 25464
398 1 2 . 1 1 17 17 ASP N N 17 119.500 119.500 119.100 0.400 25464
399 1 2 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.453 0.397 25464
400 1 2 . 1 1 17 17 ASP C C 17 176.300 176.300 176.443 -0.143 25464
401 1 2 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.042 -0.742 25464
402 1 2 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.295 0.305 25464
403 1 2 . 1 1 17 17 ASP H H 17 8.490 8.490 7.996 0.494 25464
404 1 2 . 1 1 18 18 GLY N N 18 107.700 107.700 107.647 0.053 25464
405 1 2 . 1 1 18 18 GLY C C 18 172.700 172.700 173.487 -0.787 25464
406 1 2 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.650 0.251 25464
407 1 2 . 1 1 18 18 GLY H H 18 8.070 8.070 7.601 0.469 25464
408 1 2 . 1 1 19 19 MET N N 19 117.400 117.400 123.713 -6.313 25464
409 1 2 . 1 1 19 19 MET HA H 19 4.890 4.890 4.153 0.737 25464
410 1 2 . 1 1 19 19 MET C C 19 176.000 176.000 175.225 0.775 25464
411 1 2 . 1 1 19 19 MET CA C 19 53.700 53.700 56.344 -2.644 25464
412 1 2 . 1 1 19 19 MET CB C 19 35.100 35.100 32.571 2.530 25464
413 1 2 . 1 1 19 19 MET H H 19 7.820 7.820 8.149 -0.329 25464
414 1 2 . 1 1 20 20 PHE N N 20 120.100 120.100 120.367 -0.267 25464
415 1 2 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.512 0.498 25464
416 1 2 . 1 1 20 20 PHE C C 20 174.200 174.200 174.648 -0.448 25464
417 1 2 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.111 2.289 25464
418 1 2 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.088 3.712 25464
419 1 2 . 1 1 20 20 PHE H H 20 9.370 9.370 8.631 0.739 25464
420 1 2 . 1 1 21 21 PHE N N 21 115.200 115.200 114.600 0.600 25464
421 1 2 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.350 0.280 25464
422 1 2 . 1 1 21 21 PHE C C 21 177.500 177.500 174.556 2.944 25464
423 1 2 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.563 -0.063 25464
424 1 2 . 1 1 21 21 PHE CB C 21 44.100 44.100 41.296 2.804 25464
425 1 2 . 1 1 21 21 PHE H H 21 9.600 9.600 8.555 1.045 25464
426 1 2 . 1 1 22 22 VAL N N 22 116.600 116.600 119.891 -3.291 25464
427 1 2 . 1 1 22 22 VAL C C 22 175.000 175.000 175.539 -0.539 25464
428 1 2 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.447 1.253 25464
429 1 2 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.452 0.348 25464
430 1 2 . 1 1 22 22 VAL H H 22 8.750 8.750 8.659 0.091 25464
431 1 2 . 1 1 23 23 LEU N N 23 126.500 126.500 127.326 -0.826 25464
432 1 2 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.628 0.012 25464
433 1 2 . 1 1 23 23 LEU C C 23 176.200 176.200 176.208 -0.008 25464
434 1 2 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.072 -1.272 25464
435 1 2 . 1 1 23 23 LEU CB C 23 46.700 46.700 44.995 1.705 25464
436 1 2 . 1 1 23 23 LEU H H 23 9.530 9.530 8.926 0.604 25464
437 1 2 . 1 1 24 24 ILE N N 24 117.700 117.700 117.836 -0.136 25464
438 1 2 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.212 0.478 25464
439 1 2 . 1 1 24 24 ILE C C 24 174.300 174.300 173.574 0.726 25464
440 1 2 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.054 -0.154 25464
441 1 2 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.433 1.167 25464
442 1 2 . 1 1 24 24 ILE H H 24 9.300 9.300 8.799 0.501 25464
443 1 2 . 1 1 25 25 ASN N N 25 122.500 122.500 122.681 -0.181 25464
444 1 2 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.874 -0.174 25464
445 1 2 . 1 1 25 25 ASN C C 25 177.700 177.700 175.462 2.238 25464
446 1 2 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.136 -1.437 25464
447 1 2 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.851 -3.251 25464
448 1 2 . 1 1 25 25 ASN H H 25 7.300 7.300 8.076 -0.776 25464
449 1 2 . 1 1 26 26 ASP N N 26 118.100 118.100 123.060 -4.960 25464
450 1 2 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.373 -0.013 25464
451 1 2 . 1 1 26 26 ASP C C 26 176.700 176.700 175.873 0.827 25464
452 1 2 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.872 -0.372 25464
453 1 2 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.676 -0.776 25464
454 1 2 . 1 1 26 26 ASP H H 26 8.340 8.340 8.891 -0.551 25464
455 1 2 . 1 1 27 27 GLU N N 27 117.600 117.600 116.139 1.461 25464
456 1 2 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.358 0.182 25464
457 1 2 . 1 1 27 27 GLU C C 27 175.100 175.100 175.717 -0.617 25464
458 1 2 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.842 -0.142 25464
459 1 2 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.206 1.294 25464
460 1 2 . 1 1 27 27 GLU H H 27 7.190 7.190 7.911 -0.721 25464
461 1 2 . 1 1 28 28 GLU N N 28 112.800 112.800 116.227 -3.427 25464
462 1 2 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.952 -0.362 25464
463 1 2 . 1 1 28 28 GLU C C 28 175.200 175.200 176.298 -1.098 25464
464 1 2 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.685 0.115 25464
465 1 2 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.608 -1.107 25464
466 1 2 . 1 1 28 28 GLU H H 28 8.050 8.050 8.451 -0.401 25464
467 1 2 . 1 1 29 29 GLN N N 29 117.200 117.200 117.060 0.140 25464
468 1 2 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.304 -0.024 25464
469 1 2 . 1 1 29 29 GLN C C 29 174.600 174.600 175.199 -0.599 25464
470 1 2 . 1 1 29 29 GLN CA C 29 54.900 54.900 56.456 -1.556 25464
471 1 2 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.904 -0.604 25464
472 1 2 . 1 1 29 29 GLN H H 29 7.840 7.840 7.534 0.306 25464
473 1 2 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.813 0.247 25464
474 1 2 . 1 1 30 30 HIS C C 30 175.900 175.900 174.483 1.417 25464
475 1 2 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.896 0.804 25464
476 1 2 . 1 1 30 30 HIS CB C 30 32.900 32.900 33.620 -0.720 25464
477 1 2 . 1 1 31 31 SER N N 31 113.100 113.100 114.475 -1.375 25464
478 1 2 . 1 1 31 31 SER HA H 31 4.740 4.740 4.679 0.061 25464
479 1 2 . 1 1 31 31 SER C C 31 173.200 173.200 172.048 1.152 25464
480 1 2 . 1 1 31 31 SER CA C 31 57.400 57.400 58.727 -1.327 25464
481 1 2 . 1 1 31 31 SER CB C 31 66.600 66.600 64.146 2.454 25464
482 1 2 . 1 1 31 31 SER H H 31 8.850 8.850 9.026 -0.176 25464
483 1 2 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.954 0.406 25464
484 1 2 . 1 1 32 32 LEU C C 32 178.200 178.200 175.545 2.655 25464
485 1 2 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.561 1.439 25464
486 1 2 . 1 1 32 32 LEU CB C 32 43.700 43.700 43.286 0.414 25464
487 1 2 . 1 1 33 33 TRP N N 33 123.400 123.400 129.364 -5.964 25464
488 1 2 . 1 1 33 33 TRP HA H 33 5.300 5.300 5.056 0.244 25464
489 1 2 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.334 -0.234 25464
490 1 2 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.789 1.711 25464
491 1 2 . 1 1 33 33 TRP H H 33 9.170 9.170 9.352 -0.182 25464
492 1 2 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.415 -0.605 25464
493 1 2 . 1 1 34 34 PRO C C 34 177.400 177.400 177.295 0.105 25464
494 1 2 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.058 -0.258 25464
495 1 2 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.474 -1.474 25464
496 1 2 . 1 1 35 35 THR N N 35 107.700 107.700 114.706 -7.006 25464
497 1 2 . 1 1 35 35 THR HA H 35 3.730 3.730 4.261 -0.531 25464
498 1 2 . 1 1 35 35 THR C C 35 176.100 176.100 174.911 1.189 25464
499 1 2 . 1 1 35 35 THR CA C 35 63.600 63.600 64.857 -1.257 25464
500 1 2 . 1 1 35 35 THR CB C 35 68.200 68.200 68.237 -0.037 25464
501 1 2 . 1 1 35 35 THR H H 35 7.260 7.260 7.952 -0.692 25464
502 1 2 . 1 1 36 36 PHE N N 36 114.500 114.500 117.949 -3.449 25464
503 1 2 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.556 -0.046 25464
504 1 2 . 1 1 36 36 PHE C C 36 174.500 174.500 174.646 -0.146 25464
505 1 2 . 1 1 36 36 PHE CA C 36 56.900 56.900 56.783 0.117 25464
506 1 2 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.189 -0.589 25464
507 1 2 . 1 1 36 36 PHE H H 36 6.770 6.770 7.296 -0.526 25464
508 1 2 . 1 1 37 37 ALA N N 37 125.300 125.300 121.558 3.742 25464
509 1 2 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.523 0.187 25464
510 1 2 . 1 1 37 37 ALA C C 37 177.300 177.300 175.121 2.179 25464
511 1 2 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.097 -0.897 25464
512 1 2 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.529 -1.129 25464
513 1 2 . 1 1 37 37 ALA H H 37 6.950 6.950 7.320 -0.370 25464
514 1 2 . 1 1 38 38 ASP N N 38 124.500 124.500 120.631 3.869 25464
515 1 2 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.865 -0.385 25464
516 1 2 . 1 1 38 38 ASP C C 38 176.700 176.700 176.057 0.643 25464
517 1 2 . 1 1 38 38 ASP CA C 38 55.000 55.000 54.026 0.973 25464
518 1 2 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.658 -2.258 25464
519 1 2 . 1 1 38 38 ASP H H 38 8.870 8.870 8.541 0.329 25464
520 1 2 . 1 1 39 39 VAL N N 39 126.000 126.000 123.068 2.932 25464
521 1 2 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.625 -0.265 25464
522 1 2 . 1 1 39 39 VAL CA C 39 61.100 61.100 59.926 1.174 25464
523 1 2 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.230 0.970 25464
524 1 2 . 1 1 39 39 VAL H H 39 8.650 8.650 8.397 0.253 25464
525 1 2 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.384 -0.134 25464
526 1 2 . 1 1 40 40 PRO C C 40 175.800 175.800 176.299 -0.499 25464
527 1 2 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.706 -0.506 25464
528 1 2 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.841 -0.141 25464
529 1 2 . 1 1 41 41 ALA N N 41 122.700 122.700 125.515 -2.815 25464
530 1 2 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.048 0.132 25464
531 1 2 . 1 1 41 41 ALA C C 41 179.000 179.000 178.792 0.208 25464
532 1 2 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.437 -0.137 25464
533 1 2 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.018 -0.718 25464
534 1 2 . 1 1 41 41 ALA H H 41 8.280 8.280 8.408 -0.128 25464
535 1 2 . 1 1 42 42 GLY N N 42 109.800 109.800 111.871 -2.071 25464
536 1 2 . 1 1 42 42 GLY C C 42 173.800 173.800 173.439 0.361 25464
537 1 2 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.883 -0.183 25464
538 1 2 . 1 1 42 42 GLY H H 42 8.770 8.770 8.366 0.404 25464
539 1 2 . 1 1 43 43 TRP N N 43 120.300 120.300 120.892 -0.592 25464
540 1 2 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.338 -0.388 25464
541 1 2 . 1 1 43 43 TRP C C 43 174.900 174.900 175.887 -0.987 25464
542 1 2 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.218 -0.518 25464
543 1 2 . 1 1 43 43 TRP CB C 43 32.000 32.000 31.370 0.630 25464
544 1 2 . 1 1 43 43 TRP H H 43 7.740 7.740 7.894 -0.154 25464
545 1 2 . 1 1 44 44 ARG N N 44 117.700 117.700 120.899 -3.199 25464
546 1 2 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.780 -0.060 25464
547 1 2 . 1 1 44 44 ARG C C 44 174.900 174.900 174.746 0.154 25464
548 1 2 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.519 -0.619 25464
549 1 2 . 1 1 44 44 ARG CB C 44 33.200 33.200 33.572 -0.372 25464
550 1 2 . 1 1 44 44 ARG H H 44 8.990 8.990 9.044 -0.055 25464
551 1 2 . 1 1 45 45 VAL N N 45 122.800 122.800 123.810 -1.010 25464
552 1 2 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.195 -0.215 25464
553 1 2 . 1 1 45 45 VAL C C 45 177.600 177.600 176.713 0.887 25464
554 1 2 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.595 0.105 25464
555 1 2 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.578 0.522 25464
556 1 2 . 1 1 45 45 VAL H H 45 8.720 8.720 8.554 0.166 25464
557 1 2 . 1 1 46 46 VAL N N 46 120.400 120.400 125.444 -5.044 25464
558 1 2 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.308 0.372 25464
559 1 2 . 1 1 46 46 VAL C C 46 174.200 174.200 175.218 -1.018 25464
560 1 2 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.687 -3.187 25464
561 1 2 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.001 0.999 25464
562 1 2 . 1 1 46 46 VAL H H 46 9.060 9.060 8.683 0.377 25464
563 1 2 . 1 1 47 47 PHE N N 47 121.100 121.100 122.351 -1.251 25464
564 1 2 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.624 -0.174 25464
565 1 2 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.486 2.215 25464
566 1 2 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.328 0.372 25464
567 1 2 . 1 1 47 47 PHE H H 47 7.680 7.680 8.177 -0.497 25464
568 1 2 . 1 1 48 48 GLY N N 48 112.600 112.600 113.358 -0.758 25464
569 1 2 . 1 1 48 48 GLY C C 48 174.700 174.700 173.942 0.758 25464
570 1 2 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.548 -2.548 25464
571 1 2 . 1 1 48 48 GLY H H 48 7.380 7.380 8.236 -0.856 25464
572 1 2 . 1 1 49 49 GLU N N 49 120.600 120.600 119.861 0.739 25464
573 1 2 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.461 -0.231 25464
574 1 2 . 1 1 49 49 GLU C C 49 174.900 174.900 176.290 -1.390 25464
575 1 2 . 1 1 49 49 GLU CA C 49 56.300 56.300 58.407 -2.107 25464
576 1 2 . 1 1 49 49 GLU CB C 49 31.200 31.200 29.096 2.104 25464
577 1 2 . 1 1 49 49 GLU H H 49 8.510 8.510 8.585 -0.075 25464
578 1 2 . 1 1 50 50 ALA N N 50 126.600 126.600 127.266 -0.666 25464
579 1 2 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.754 -0.114 25464
580 1 2 . 1 1 50 50 ALA C C 50 175.100 175.100 175.293 -0.193 25464
581 1 2 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.729 0.671 25464
582 1 2 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.991 0.209 25464
583 1 2 . 1 1 50 50 ALA H H 50 9.440 9.440 8.863 0.577 25464
584 1 2 . 1 1 51 51 SER N N 51 115.100 115.100 114.559 0.541 25464
585 1 2 . 1 1 51 51 SER HA H 51 4.740 4.740 4.167 0.573 25464
586 1 2 . 1 1 51 51 SER C C 51 175.000 175.000 175.961 -0.961 25464
587 1 2 . 1 1 51 51 SER CA C 51 58.100 58.100 58.009 0.091 25464
588 1 2 . 1 1 51 51 SER CB C 51 64.700 64.700 63.904 0.795 25464
589 1 2 . 1 1 51 51 SER H H 51 8.950 8.950 8.757 0.193 25464
590 1 2 . 1 1 52 52 ARG N N 52 123.500 123.500 126.556 -3.056 25464
591 1 2 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.964 -0.554 25464
592 1 2 . 1 1 52 52 ARG C C 52 178.200 178.200 177.616 0.584 25464
593 1 2 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.228 1.772 25464
594 1 2 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.877 0.023 25464
595 1 2 . 1 1 52 52 ARG H H 52 9.540 9.540 8.157 1.383 25464
596 1 2 . 1 1 53 53 ALA N N 53 118.000 118.000 119.890 -1.890 25464
597 1 2 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.000 0.030 25464
598 1 2 . 1 1 53 53 ALA C C 53 181.000 181.000 179.607 1.393 25464
599 1 2 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.189 0.111 25464
600 1 2 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.934 0.166 25464
601 1 2 . 1 1 53 53 ALA H H 53 8.770 8.770 8.270 0.500 25464
602 1 2 . 1 1 54 54 SER N N 54 115.300 115.300 115.201 0.099 25464
603 1 2 . 1 1 54 54 SER HA H 54 4.350 4.350 4.190 0.160 25464
604 1 2 . 1 1 54 54 SER C C 54 177.500 177.500 176.286 1.214 25464
605 1 2 . 1 1 54 54 SER CA C 54 61.900 61.900 61.972 -0.072 25464
606 1 2 . 1 1 54 54 SER CB C 54 63.100 63.100 62.775 0.325 25464
607 1 2 . 1 1 54 54 SER H H 54 8.140 8.140 7.568 0.572 25464
608 1 2 . 1 1 55 55 CYS N N 55 121.900 121.900 120.903 0.997 25464
609 1 2 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.582 0.578 25464
610 1 2 . 1 1 55 55 CYS C C 55 176.300 176.300 176.826 -0.526 25464
611 1 2 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.219 0.081 25464
612 1 2 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.920 0.080 25464
613 1 2 . 1 1 55 55 CYS H H 55 8.430 8.430 7.755 0.675 25464
614 1 2 . 1 1 56 56 VAL N N 56 121.100 121.100 119.957 1.143 25464
615 1 2 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.576 -0.086 25464
616 1 2 . 1 1 56 56 VAL C C 56 177.800 177.800 177.935 -0.135 25464
617 1 2 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.012 -0.012 25464
618 1 2 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.293 0.307 25464
619 1 2 . 1 1 56 56 VAL H H 56 8.750 8.750 8.707 0.043 25464
620 1 2 . 1 1 57 57 GLU N N 57 119.200 119.200 120.248 -1.048 25464
621 1 2 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.912 0.158 25464
622 1 2 . 1 1 57 57 GLU C C 57 177.900 177.900 178.436 -0.536 25464
623 1 2 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.656 -0.356 25464
624 1 2 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.653 -0.153 25464
625 1 2 . 1 1 57 57 GLU H H 57 7.780 7.780 7.900 -0.120 25464
626 1 2 . 1 1 58 58 TYR N N 58 119.400 119.400 120.543 -1.143 25464
627 1 2 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.213 -0.323 25464
628 1 2 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.843 0.357 25464
629 1 2 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.670 -1.470 25464
630 1 2 . 1 1 58 58 TYR H H 58 7.700 7.700 8.063 -0.363 25464
631 1 2 . 1 1 59 59 VAL N N 59 121.500 121.500 118.751 2.749 25464
632 1 2 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.676 -0.316 25464
633 1 2 . 1 1 59 59 VAL C C 59 176.300 176.300 177.240 -0.940 25464
634 1 2 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.761 0.639 25464
635 1 2 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.329 0.071 25464
636 1 2 . 1 1 59 59 VAL H H 59 8.380 8.380 8.218 0.162 25464
637 1 2 . 1 1 60 60 ASP N N 60 120.000 120.000 117.083 2.917 25464
638 1 2 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.426 -0.016 25464
639 1 2 . 1 1 60 60 ASP C C 60 178.300 178.300 179.558 -1.258 25464
640 1 2 . 1 1 60 60 ASP CA C 60 57.100 57.100 56.816 0.284 25464
641 1 2 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.251 -0.651 25464
642 1 2 . 1 1 60 60 ASP H H 60 8.580 8.580 7.852 0.728 25464
643 1 2 . 1 1 61 61 GLN N N 61 114.500 114.500 117.801 -3.301 25464
644 1 2 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.070 -0.060 25464
645 1 2 . 1 1 61 61 GLN C C 61 176.700 176.700 178.328 -1.628 25464
646 1 2 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.821 -1.121 25464
647 1 2 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.542 0.258 25464
648 1 2 . 1 1 61 61 GLN H H 61 7.810 7.810 7.972 -0.162 25464
649 1 2 . 1 1 62 62 HIS N N 62 115.100 115.100 118.919 -3.819 25464
650 1 2 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.479 -0.099 25464
651 1 2 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.159 2.141 25464
652 1 2 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.202 -0.202 25464
653 1 2 . 1 1 62 62 HIS H H 62 7.730 7.730 7.877 -0.147 25464
654 1 2 . 1 1 63 63 TRP N N 63 121.500 121.500 120.168 1.332 25464
655 1 2 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.484 -0.684 25464
656 1 2 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.320 0.380 25464
657 1 2 . 1 1 63 63 TRP H H 63 8.180 8.180 7.348 0.832 25464
658 1 2 . 1 1 64 64 THR N N 64 114.900 114.900 108.837 6.063 25464
659 1 2 . 1 1 64 64 THR HA H 64 4.180 4.180 4.084 0.096 25464
660 1 2 . 1 1 64 64 THR CA C 64 62.100 62.100 61.302 0.798 25464
661 1 2 . 1 1 64 64 THR CB C 64 69.500 69.500 68.753 0.747 25464
662 1 2 . 1 1 64 64 THR H H 64 7.940 7.940 7.366 0.574 25464
663 1 2 . 1 1 65 65 ASP N N 65 122.900 122.900 120.117 2.783 25464
664 1 2 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.336 1.064 25464
665 1 2 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.625 -0.525 25464
666 1 2 . 1 1 65 65 ASP H H 65 8.340 8.340 7.243 1.097 25464
667 1 2 . 1 1 66 66 ILE N N 66 122.200 122.200 122.153 0.047 25464
668 1 2 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.009 0.151 25464
669 1 2 . 1 1 66 66 ILE CA C 66 61.100 61.100 61.470 -0.370 25464
670 1 2 . 1 1 66 66 ILE CB C 66 38.500 38.500 39.158 -0.658 25464
671 1 2 . 1 1 66 66 ILE H H 66 8.250 8.250 8.643 -0.393 25464
672 1 2 . 1 1 67 67 ARG N N 67 124.000 124.000 117.822 6.178 25464
673 1 2 . 1 1 67 67 ARG CA C 67 53.900 53.900 55.812 -1.912 25464
674 1 2 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.439 1.561 25464
675 1 2 . 1 1 67 67 ARG H H 67 8.490 8.490 7.890 0.600 25464
676 1 2 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.345 0.095 25464
677 1 2 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.828 -0.728 25464
678 1 2 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.824 0.276 25464
679 1 2 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.483 -0.153 25464
680 1 2 . 1 1 69 69 LYS C C 69 175.900 175.900 174.341 1.559 25464
681 1 2 . 1 1 69 69 LYS CA C 69 56.300 56.300 55.906 0.394 25464
682 1 2 . 1 1 69 69 LYS CB C 69 33.000 33.000 35.186 -2.186 25464
683 1 2 . 1 1 69 69 LYS H H 69 8.270 8.270 7.641 0.629 25464
684 1 2 . 1 1 70 70 SER N N 70 122.300 122.300 118.223 4.077 25464
685 1 2 . 1 1 70 70 SER HA H 70 4.580 4.580 4.813 -0.233 25464
686 1 2 . 1 1 70 70 SER CA C 70 59.900 59.900 57.253 2.647 25464
687 1 2 . 1 1 70 70 SER CB C 70 65.100 65.100 65.496 -0.396 25464
688 1 2 . 1 1 70 70 SER H H 70 8.140 8.140 8.376 -0.236 25464
689 1 2 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.822 -0.502 25464
690 1 2 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.847 0.553 25464
691 1 2 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.866 -1.766 25464
692 1 2 . 1 1 76 76 ALA N N 76 124.000 124.000 126.816 -2.816 25464
693 1 2 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.810 -0.480 25464
694 1 2 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.546 1.154 25464
695 1 2 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.608 -0.608 25464
696 1 2 . 1 1 76 76 ALA H H 76 8.200 8.200 8.545 -0.345 25464
697 1 2 . 1 1 77 77 SER N N 77 114.100 114.100 119.362 -5.262 25464
698 1 2 . 1 1 77 77 SER HA H 77 4.450 4.450 4.610 -0.160 25464
699 1 2 . 1 1 77 77 SER CA C 77 58.200 58.200 57.860 0.340 25464
700 1 2 . 1 1 77 77 SER CB C 77 63.900 63.900 62.464 1.437 25464
701 1 2 . 1 1 77 77 SER H H 77 8.210 8.210 8.894 -0.684 25464
702 1 2 . 1 1 78 78 GLY N N 78 110.500 110.500 111.836 -1.336 25464
703 1 2 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.179 0.221 25464
704 1 2 . 1 1 78 78 GLY H H 78 8.390 8.390 7.706 0.684 25464
705 1 2 . 1 1 79 79 GLN N N 79 119.600 119.600 121.457 -1.857 25464
706 1 2 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.631 -0.031 25464
707 1 2 . 1 1 79 79 GLN CB C 79 29.600 29.600 27.667 1.933 25464
708 1 2 . 1 1 79 79 GLN H H 79 8.250 8.250 8.511 -0.261 25464
709 1 3 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.652 -0.192 25464
710 1 3 . 1 1 2 2 PRO CA C 2 63.400 63.400 61.882 1.518 25464
711 1 3 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.246 0.854 25464
712 1 3 . 1 1 3 3 GLY CA C 3 45.100 45.100 46.243 -1.143 25464
713 1 3 . 1 1 10 10 ASP N N 10 121.500 121.500 120.947 0.553 25464
714 1 3 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.485 0.115 25464
715 1 3 . 1 1 10 10 ASP C C 10 175.300 175.300 174.630 0.670 25464
716 1 3 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.304 0.196 25464
717 1 3 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.475 -0.575 25464
718 1 3 . 1 1 10 10 ASP H H 10 8.420 8.420 8.379 0.041 25464
719 1 3 . 1 1 11 11 ASN N N 11 118.400 118.400 116.412 1.988 25464
720 1 3 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.663 0.287 25464
721 1 3 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.677 0.123 25464
722 1 3 . 1 1 11 11 ASN CB C 11 39.100 39.100 39.498 -0.398 25464
723 1 3 . 1 1 11 11 ASN H H 11 8.270 8.270 8.073 0.197 25464
724 1 3 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.678 -0.298 25464
725 1 3 . 1 1 12 12 PRO C C 12 177.100 177.100 175.417 1.683 25464
726 1 3 . 1 1 12 12 PRO CA C 12 63.700 63.700 62.827 0.873 25464
727 1 3 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.312 0.588 25464
728 1 3 . 1 1 13 13 PHE N N 13 117.500 117.500 112.396 5.104 25464
729 1 3 . 1 1 13 13 PHE HA H 13 4.500 4.500 3.931 0.569 25464
730 1 3 . 1 1 13 13 PHE C C 13 175.700 175.700 174.622 1.078 25464
731 1 3 . 1 1 13 13 PHE CA C 13 58.300 58.300 55.562 2.738 25464
732 1 3 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.361 0.339 25464
733 1 3 . 1 1 13 13 PHE H H 13 8.120 8.120 6.900 1.220 25464
734 1 3 . 1 1 14 14 ASP N N 14 120.000 120.000 121.333 -1.333 25464
735 1 3 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.555 0.065 25464
736 1 3 . 1 1 14 14 ASP C C 14 175.800 175.800 176.329 -0.529 25464
737 1 3 . 1 1 14 14 ASP CA C 14 54.400 54.400 55.902 -1.502 25464
738 1 3 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.602 -0.202 25464
739 1 3 . 1 1 14 14 ASP H H 14 8.010 8.010 7.327 0.683 25464
740 1 3 . 1 1 15 15 ASP N N 15 119.900 119.900 119.600 0.300 25464
741 1 3 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.525 0.085 25464
742 1 3 . 1 1 15 15 ASP C C 15 176.700 176.700 176.958 -0.258 25464
743 1 3 . 1 1 15 15 ASP CA C 15 54.500 54.500 56.187 -1.687 25464
744 1 3 . 1 1 15 15 ASP CB C 15 41.200 41.200 41.373 -0.173 25464
745 1 3 . 1 1 15 15 ASP H H 15 7.900 7.900 8.437 -0.537 25464
746 1 3 . 1 1 16 16 GLU N N 16 122.700 122.700 122.661 0.039 25464
747 1 3 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.058 0.172 25464
748 1 3 . 1 1 16 16 GLU C C 16 176.600 176.600 176.700 -0.100 25464
749 1 3 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.261 -0.861 25464
750 1 3 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.972 0.128 25464
751 1 3 . 1 1 16 16 GLU H H 16 8.610 8.610 8.674 -0.064 25464
752 1 3 . 1 1 17 17 ASP N N 17 119.500 119.500 117.576 1.924 25464
753 1 3 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.549 0.301 25464
754 1 3 . 1 1 17 17 ASP C C 17 176.300 176.300 176.969 -0.669 25464
755 1 3 . 1 1 17 17 ASP CA C 17 54.300 54.300 53.819 0.481 25464
756 1 3 . 1 1 17 17 ASP CB C 17 41.600 41.600 39.987 1.613 25464
757 1 3 . 1 1 17 17 ASP H H 17 8.490 8.490 8.327 0.163 25464
758 1 3 . 1 1 18 18 GLY N N 18 107.700 107.700 107.708 -0.008 25464
759 1 3 . 1 1 18 18 GLY C C 18 172.700 172.700 173.209 -0.509 25464
760 1 3 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.557 0.343 25464
761 1 3 . 1 1 18 18 GLY H H 18 8.070 8.070 7.689 0.381 25464
762 1 3 . 1 1 19 19 MET N N 19 117.400 117.400 122.017 -4.617 25464
763 1 3 . 1 1 19 19 MET HA H 19 4.890 4.890 4.534 0.356 25464
764 1 3 . 1 1 19 19 MET C C 19 176.000 176.000 175.004 0.996 25464
765 1 3 . 1 1 19 19 MET CA C 19 53.700 53.700 55.520 -1.820 25464
766 1 3 . 1 1 19 19 MET CB C 19 35.100 35.100 33.286 1.814 25464
767 1 3 . 1 1 19 19 MET H H 19 7.820 7.820 8.170 -0.350 25464
768 1 3 . 1 1 20 20 PHE N N 20 120.100 120.100 119.479 0.621 25464
769 1 3 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.689 0.321 25464
770 1 3 . 1 1 20 20 PHE C C 20 174.200 174.200 174.676 -0.476 25464
771 1 3 . 1 1 20 20 PHE CA C 20 57.400 57.400 54.609 2.791 25464
772 1 3 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.115 3.685 25464
773 1 3 . 1 1 20 20 PHE H H 20 9.370 9.370 8.564 0.806 25464
774 1 3 . 1 1 21 21 PHE N N 21 115.200 115.200 116.041 -0.841 25464
775 1 3 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.365 0.265 25464
776 1 3 . 1 1 21 21 PHE C C 21 177.500 177.500 174.951 2.549 25464
777 1 3 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.390 0.110 25464
778 1 3 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.521 3.579 25464
779 1 3 . 1 1 21 21 PHE H H 21 9.600 9.600 8.407 1.193 25464
780 1 3 . 1 1 22 22 VAL N N 22 116.600 116.600 121.261 -4.661 25464
781 1 3 . 1 1 22 22 VAL C C 22 175.000 175.000 175.617 -0.617 25464
782 1 3 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.907 0.793 25464
783 1 3 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.544 0.256 25464
784 1 3 . 1 1 22 22 VAL H H 22 8.750 8.750 8.610 0.140 25464
785 1 3 . 1 1 23 23 LEU N N 23 126.500 126.500 127.425 -0.925 25464
786 1 3 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.750 -0.110 25464
787 1 3 . 1 1 23 23 LEU C C 23 176.200 176.200 175.991 0.209 25464
788 1 3 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.868 -1.068 25464
789 1 3 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.796 0.904 25464
790 1 3 . 1 1 23 23 LEU H H 23 9.530 9.530 8.777 0.753 25464
791 1 3 . 1 1 24 24 ILE N N 24 117.700 117.700 118.430 -0.730 25464
792 1 3 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.577 0.113 25464
793 1 3 . 1 1 24 24 ILE C C 24 174.300 174.300 173.415 0.885 25464
794 1 3 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.050 -0.150 25464
795 1 3 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.871 0.729 25464
796 1 3 . 1 1 24 24 ILE H H 24 9.300 9.300 8.944 0.356 25464
797 1 3 . 1 1 25 25 ASN N N 25 122.500 122.500 123.771 -1.271 25464
798 1 3 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.852 -0.152 25464
799 1 3 . 1 1 25 25 ASN C C 25 177.700 177.700 175.270 2.430 25464
800 1 3 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.809 -1.109 25464
801 1 3 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.472 -2.872 25464
802 1 3 . 1 1 25 25 ASN H H 25 7.300 7.300 8.161 -0.861 25464
803 1 3 . 1 1 26 26 ASP N N 26 118.100 118.100 121.994 -3.894 25464
804 1 3 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.223 0.137 25464
805 1 3 . 1 1 26 26 ASP C C 26 176.700 176.700 177.429 -0.729 25464
806 1 3 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.205 -0.705 25464
807 1 3 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.843 -0.943 25464
808 1 3 . 1 1 26 26 ASP H H 26 8.340 8.340 8.826 -0.486 25464
809 1 3 . 1 1 27 27 GLU N N 27 117.600 117.600 118.344 -0.744 25464
810 1 3 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.119 0.421 25464
811 1 3 . 1 1 27 27 GLU C C 27 175.100 175.100 175.265 -0.165 25464
812 1 3 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.214 -0.514 25464
813 1 3 . 1 1 27 27 GLU CB C 27 29.500 29.500 27.870 1.630 25464
814 1 3 . 1 1 27 27 GLU H H 27 7.190 7.190 8.275 -1.085 25464
815 1 3 . 1 1 28 28 GLU N N 28 112.800 112.800 113.727 -0.927 25464
816 1 3 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.695 -0.105 25464
817 1 3 . 1 1 28 28 GLU C C 28 175.200 175.200 174.945 0.255 25464
818 1 3 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.505 0.295 25464
819 1 3 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.637 -0.137 25464
820 1 3 . 1 1 28 28 GLU H H 28 8.050 8.050 8.041 0.009 25464
821 1 3 . 1 1 29 29 GLN N N 29 117.200 117.200 117.713 -0.513 25464
822 1 3 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.005 0.275 25464
823 1 3 . 1 1 29 29 GLN C C 29 174.600 174.600 175.286 -0.686 25464
824 1 3 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.905 -1.005 25464
825 1 3 . 1 1 29 29 GLN CB C 29 29.300 29.300 28.890 0.410 25464
826 1 3 . 1 1 29 29 GLN H H 29 7.840 7.840 7.546 0.294 25464
827 1 3 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.620 0.440 25464
828 1 3 . 1 1 30 30 HIS C C 30 175.900 175.900 174.726 1.174 25464
829 1 3 . 1 1 30 30 HIS CA C 30 54.700 54.700 55.136 -0.436 25464
830 1 3 . 1 1 30 30 HIS CB C 30 32.900 32.900 32.130 0.770 25464
831 1 3 . 1 1 31 31 SER N N 31 113.100 113.100 116.182 -3.082 25464
832 1 3 . 1 1 31 31 SER HA H 31 4.740 4.740 4.883 -0.143 25464
833 1 3 . 1 1 31 31 SER C C 31 173.200 173.200 172.302 0.898 25464
834 1 3 . 1 1 31 31 SER CA C 31 57.400 57.400 57.102 0.298 25464
835 1 3 . 1 1 31 31 SER CB C 31 66.600 66.600 65.150 1.450 25464
836 1 3 . 1 1 31 31 SER H H 31 8.850 8.850 8.674 0.176 25464
837 1 3 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.132 0.228 25464
838 1 3 . 1 1 32 32 LEU C C 32 178.200 178.200 174.544 3.656 25464
839 1 3 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.452 1.548 25464
840 1 3 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.329 -1.629 25464
841 1 3 . 1 1 33 33 TRP N N 33 123.400 123.400 127.912 -4.512 25464
842 1 3 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.867 0.433 25464
843 1 3 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.251 -0.151 25464
844 1 3 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.100 1.400 25464
845 1 3 . 1 1 33 33 TRP H H 33 9.170 9.170 9.282 -0.112 25464
846 1 3 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.376 -0.566 25464
847 1 3 . 1 1 34 34 PRO C C 34 177.400 177.400 177.224 0.176 25464
848 1 3 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.351 -0.551 25464
849 1 3 . 1 1 34 34 PRO CB C 34 32.000 32.000 32.944 -0.944 25464
850 1 3 . 1 1 35 35 THR N N 35 107.700 107.700 114.049 -6.349 25464
851 1 3 . 1 1 35 35 THR HA H 35 3.730 3.730 4.439 -0.709 25464
852 1 3 . 1 1 35 35 THR C C 35 176.100 176.100 175.498 0.602 25464
853 1 3 . 1 1 35 35 THR CA C 35 63.600 63.600 64.967 -1.367 25464
854 1 3 . 1 1 35 35 THR CB C 35 68.200 68.200 68.375 -0.175 25464
855 1 3 . 1 1 35 35 THR H H 35 7.260 7.260 8.230 -0.970 25464
856 1 3 . 1 1 36 36 PHE N N 36 114.500 114.500 119.031 -4.531 25464
857 1 3 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.622 -0.112 25464
858 1 3 . 1 1 36 36 PHE C C 36 174.500 174.500 175.850 -1.350 25464
859 1 3 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.999 -1.099 25464
860 1 3 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.657 -1.058 25464
861 1 3 . 1 1 36 36 PHE H H 36 6.770 6.770 7.655 -0.885 25464
862 1 3 . 1 1 37 37 ALA N N 37 125.300 125.300 121.578 3.722 25464
863 1 3 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.661 0.049 25464
864 1 3 . 1 1 37 37 ALA C C 37 177.300 177.300 175.262 2.038 25464
865 1 3 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.404 -1.204 25464
866 1 3 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.098 -0.698 25464
867 1 3 . 1 1 37 37 ALA H H 37 6.950 6.950 7.444 -0.494 25464
868 1 3 . 1 1 38 38 ASP N N 38 124.500 124.500 118.099 6.401 25464
869 1 3 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.957 -0.477 25464
870 1 3 . 1 1 38 38 ASP C C 38 176.700 176.700 175.797 0.903 25464
871 1 3 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.263 1.737 25464
872 1 3 . 1 1 38 38 ASP CB C 38 40.400 40.400 43.306 -2.905 25464
873 1 3 . 1 1 38 38 ASP H H 38 8.870 8.870 8.593 0.277 25464
874 1 3 . 1 1 39 39 VAL N N 39 126.000 126.000 123.717 2.283 25464
875 1 3 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.594 -0.234 25464
876 1 3 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.686 0.414 25464
877 1 3 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.748 0.452 25464
878 1 3 . 1 1 39 39 VAL H H 39 8.650 8.650 8.395 0.255 25464
879 1 3 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.294 -0.044 25464
880 1 3 . 1 1 40 40 PRO C C 40 175.800 175.800 176.617 -0.817 25464
881 1 3 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.333 -0.133 25464
882 1 3 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.885 -0.185 25464
883 1 3 . 1 1 41 41 ALA N N 41 122.700 122.700 125.692 -2.992 25464
884 1 3 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.056 0.124 25464
885 1 3 . 1 1 41 41 ALA C C 41 179.000 179.000 178.765 0.235 25464
886 1 3 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.592 -0.292 25464
887 1 3 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.002 -0.702 25464
888 1 3 . 1 1 41 41 ALA H H 41 8.280 8.280 8.451 -0.171 25464
889 1 3 . 1 1 42 42 GLY N N 42 109.800 109.800 111.659 -1.859 25464
890 1 3 . 1 1 42 42 GLY C C 42 173.800 173.800 174.044 -0.244 25464
891 1 3 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.873 -0.173 25464
892 1 3 . 1 1 42 42 GLY H H 42 8.770 8.770 8.325 0.445 25464
893 1 3 . 1 1 43 43 TRP N N 43 120.300 120.300 122.402 -2.102 25464
894 1 3 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.181 -0.231 25464
895 1 3 . 1 1 43 43 TRP C C 43 174.900 174.900 176.391 -1.491 25464
896 1 3 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.878 -1.178 25464
897 1 3 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.181 1.819 25464
898 1 3 . 1 1 43 43 TRP H H 43 7.740 7.740 7.975 -0.235 25464
899 1 3 . 1 1 44 44 ARG N N 44 117.700 117.700 122.086 -4.386 25464
900 1 3 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.785 -0.065 25464
901 1 3 . 1 1 44 44 ARG C C 44 174.900 174.900 175.106 -0.206 25464
902 1 3 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.572 -0.672 25464
903 1 3 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.968 0.232 25464
904 1 3 . 1 1 44 44 ARG H H 44 8.990 8.990 8.963 0.027 25464
905 1 3 . 1 1 45 45 VAL N N 45 122.800 122.800 124.384 -1.584 25464
906 1 3 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.276 -0.295 25464
907 1 3 . 1 1 45 45 VAL C C 45 177.600 177.600 176.729 0.871 25464
908 1 3 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.105 0.595 25464
909 1 3 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.782 1.318 25464
910 1 3 . 1 1 45 45 VAL H H 45 8.720 8.720 8.595 0.125 25464
911 1 3 . 1 1 46 46 VAL N N 46 120.400 120.400 125.792 -5.392 25464
912 1 3 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.312 0.368 25464
913 1 3 . 1 1 46 46 VAL C C 46 174.200 174.200 175.214 -1.014 25464
914 1 3 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.586 -3.086 25464
915 1 3 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.063 0.937 25464
916 1 3 . 1 1 46 46 VAL H H 46 9.060 9.060 8.695 0.365 25464
917 1 3 . 1 1 47 47 PHE N N 47 121.100 121.100 121.604 -0.504 25464
918 1 3 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.671 -0.221 25464
919 1 3 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.529 2.171 25464
920 1 3 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.951 -0.251 25464
921 1 3 . 1 1 47 47 PHE H H 47 7.680 7.680 8.198 -0.518 25464
922 1 3 . 1 1 48 48 GLY N N 48 112.600 112.600 112.119 0.481 25464
923 1 3 . 1 1 48 48 GLY C C 48 174.700 174.700 173.911 0.789 25464
924 1 3 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.389 -2.389 25464
925 1 3 . 1 1 48 48 GLY H H 48 7.380 7.380 8.402 -1.022 25464
926 1 3 . 1 1 49 49 GLU N N 49 120.600 120.600 118.763 1.837 25464
927 1 3 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.378 -0.148 25464
928 1 3 . 1 1 49 49 GLU C C 49 174.900 174.900 175.366 -0.466 25464
929 1 3 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.491 -1.191 25464
930 1 3 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.562 2.638 25464
931 1 3 . 1 1 49 49 GLU H H 49 8.510 8.510 8.649 -0.139 25464
932 1 3 . 1 1 50 50 ALA N N 50 126.600 126.600 129.284 -2.684 25464
933 1 3 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.657 -0.017 25464
934 1 3 . 1 1 50 50 ALA C C 50 175.100 175.100 175.888 -0.788 25464
935 1 3 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.028 1.372 25464
936 1 3 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.550 0.650 25464
937 1 3 . 1 1 50 50 ALA H H 50 9.440 9.440 8.906 0.534 25464
938 1 3 . 1 1 51 51 SER N N 51 115.100 115.100 116.164 -1.064 25464
939 1 3 . 1 1 51 51 SER HA H 51 4.740 4.740 4.069 0.671 25464
940 1 3 . 1 1 51 51 SER C C 51 175.000 175.000 175.808 -0.808 25464
941 1 3 . 1 1 51 51 SER CA C 51 58.100 58.100 59.510 -1.410 25464
942 1 3 . 1 1 51 51 SER CB C 51 64.700 64.700 63.311 1.389 25464
943 1 3 . 1 1 51 51 SER H H 51 8.950 8.950 8.541 0.409 25464
944 1 3 . 1 1 52 52 ARG N N 52 123.500 123.500 127.585 -4.085 25464
945 1 3 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.820 -0.410 25464
946 1 3 . 1 1 52 52 ARG C C 52 178.200 178.200 177.570 0.630 25464
947 1 3 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.314 1.686 25464
948 1 3 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.738 0.162 25464
949 1 3 . 1 1 52 52 ARG H H 52 9.540 9.540 8.358 1.182 25464
950 1 3 . 1 1 53 53 ALA N N 53 118.000 118.000 120.755 -2.755 25464
951 1 3 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.069 -0.039 25464
952 1 3 . 1 1 53 53 ALA C C 53 181.000 181.000 179.848 1.152 25464
953 1 3 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.134 0.166 25464
954 1 3 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.553 0.547 25464
955 1 3 . 1 1 53 53 ALA H H 53 8.770 8.770 8.432 0.338 25464
956 1 3 . 1 1 54 54 SER N N 54 115.300 115.300 115.034 0.266 25464
957 1 3 . 1 1 54 54 SER HA H 54 4.350 4.350 4.195 0.155 25464
958 1 3 . 1 1 54 54 SER C C 54 177.500 177.500 176.753 0.747 25464
959 1 3 . 1 1 54 54 SER CA C 54 61.900 61.900 61.080 0.820 25464
960 1 3 . 1 1 54 54 SER CB C 54 63.100 63.100 62.262 0.838 25464
961 1 3 . 1 1 54 54 SER H H 54 8.140 8.140 7.712 0.428 25464
962 1 3 . 1 1 55 55 CYS N N 55 121.900 121.900 120.206 1.694 25464
963 1 3 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.812 0.348 25464
964 1 3 . 1 1 55 55 CYS C C 55 176.300 176.300 176.833 -0.533 25464
965 1 3 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.487 -0.187 25464
966 1 3 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.272 -0.272 25464
967 1 3 . 1 1 55 55 CYS H H 55 8.430 8.430 7.849 0.581 25464
968 1 3 . 1 1 56 56 VAL N N 56 121.100 121.100 120.585 0.515 25464
969 1 3 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.545 -0.055 25464
970 1 3 . 1 1 56 56 VAL C C 56 177.800 177.800 178.179 -0.379 25464
971 1 3 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.117 -0.117 25464
972 1 3 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.623 -0.023 25464
973 1 3 . 1 1 56 56 VAL H H 56 8.750 8.750 8.385 0.365 25464
974 1 3 . 1 1 57 57 GLU N N 57 119.200 119.200 120.376 -1.176 25464
975 1 3 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.002 0.068 25464
976 1 3 . 1 1 57 57 GLU C C 57 177.900 177.900 178.639 -0.739 25464
977 1 3 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.664 -0.364 25464
978 1 3 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.126 0.374 25464
979 1 3 . 1 1 57 57 GLU H H 57 7.780 7.780 8.370 -0.590 25464
980 1 3 . 1 1 58 58 TYR N N 58 119.400 119.400 121.149 -1.749 25464
981 1 3 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.221 -0.331 25464
982 1 3 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.715 0.485 25464
983 1 3 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.651 -1.451 25464
984 1 3 . 1 1 58 58 TYR H H 58 7.700 7.700 8.080 -0.380 25464
985 1 3 . 1 1 59 59 VAL N N 59 121.500 121.500 119.094 2.406 25464
986 1 3 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.489 -0.129 25464
987 1 3 . 1 1 59 59 VAL C C 59 176.300 176.300 177.913 -1.613 25464
988 1 3 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.931 0.469 25464
989 1 3 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.733 -0.334 25464
990 1 3 . 1 1 59 59 VAL H H 59 8.380 8.380 8.201 0.179 25464
991 1 3 . 1 1 60 60 ASP N N 60 120.000 120.000 118.281 1.719 25464
992 1 3 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.243 0.167 25464
993 1 3 . 1 1 60 60 ASP C C 60 178.300 178.300 178.787 -0.487 25464
994 1 3 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.458 -0.358 25464
995 1 3 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.908 -0.309 25464
996 1 3 . 1 1 60 60 ASP H H 60 8.580 8.580 8.272 0.308 25464
997 1 3 . 1 1 61 61 GLN N N 61 114.500 114.500 117.247 -2.747 25464
998 1 3 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.084 -0.074 25464
999 1 3 . 1 1 61 61 GLN C C 61 176.700 176.700 178.493 -1.793 25464
1000 1 3 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.639 -1.939 25464
1001 1 3 . 1 1 61 61 GLN CB C 61 28.800 28.800 29.147 -0.347 25464
1002 1 3 . 1 1 61 61 GLN H H 61 7.810 7.810 7.624 0.186 25464
1003 1 3 . 1 1 62 62 HIS N N 62 115.100 115.100 118.395 -3.295 25464
1004 1 3 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.520 -0.140 25464
1005 1 3 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.121 1.179 25464
1006 1 3 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.549 -0.548 25464
1007 1 3 . 1 1 62 62 HIS H H 62 7.730 7.730 7.646 0.084 25464
1008 1 3 . 1 1 63 63 TRP N N 63 121.500 121.500 121.764 -0.264 25464
1009 1 3 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.936 -1.136 25464
1010 1 3 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.697 0.003 25464
1011 1 3 . 1 1 63 63 TRP H H 63 8.180 8.180 7.934 0.246 25464
1012 1 3 . 1 1 64 64 THR N N 64 114.900 114.900 114.118 0.782 25464
1013 1 3 . 1 1 64 64 THR HA H 64 4.180 4.180 3.993 0.187 25464
1014 1 3 . 1 1 64 64 THR CA C 64 62.100 62.100 65.557 -3.457 25464
1015 1 3 . 1 1 64 64 THR CB C 64 69.500 69.500 68.637 0.863 25464
1016 1 3 . 1 1 64 64 THR H H 64 7.940 7.940 7.745 0.195 25464
1017 1 3 . 1 1 65 65 ASP N N 65 122.900 122.900 122.574 0.326 25464
1018 1 3 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.746 -0.346 25464
1019 1 3 . 1 1 65 65 ASP CB C 65 41.100 41.100 39.942 1.158 25464
1020 1 3 . 1 1 65 65 ASP H H 65 8.340 8.340 7.526 0.814 25464
1021 1 3 . 1 1 66 66 ILE N N 66 122.200 122.200 121.829 0.371 25464
1022 1 3 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.243 -0.083 25464
1023 1 3 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.445 0.655 25464
1024 1 3 . 1 1 66 66 ILE CB C 66 38.500 38.500 40.849 -2.349 25464
1025 1 3 . 1 1 66 66 ILE H H 66 8.250 8.250 7.655 0.595 25464
1026 1 3 . 1 1 67 67 ARG N N 67 124.000 124.000 125.745 -1.745 25464
1027 1 3 . 1 1 67 67 ARG CA C 67 53.900 53.900 55.640 -1.740 25464
1028 1 3 . 1 1 67 67 ARG CB C 67 30.000 30.000 31.916 -1.916 25464
1029 1 3 . 1 1 67 67 ARG H H 67 8.490 8.490 8.551 -0.061 25464
1030 1 3 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.640 -0.200 25464
1031 1 3 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.902 0.198 25464
1032 1 3 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.563 0.537 25464
1033 1 3 . 1 1 69 69 LYS HA H 69 4.330 4.330 3.839 0.491 25464
1034 1 3 . 1 1 69 69 LYS C C 69 175.900 175.900 176.242 -0.342 25464
1035 1 3 . 1 1 69 69 LYS CA C 69 56.300 56.300 58.276 -1.976 25464
1036 1 3 . 1 1 69 69 LYS CB C 69 33.000 33.000 30.390 2.610 25464
1037 1 3 . 1 1 69 69 LYS H H 69 8.270 8.270 8.516 -0.246 25464
1038 1 3 . 1 1 70 70 SER N N 70 122.300 122.300 115.144 7.156 25464
1039 1 3 . 1 1 70 70 SER HA H 70 4.580 4.580 4.426 0.154 25464
1040 1 3 . 1 1 70 70 SER CA C 70 59.900 59.900 56.982 2.918 25464
1041 1 3 . 1 1 70 70 SER CB C 70 65.100 65.100 63.959 1.141 25464
1042 1 3 . 1 1 70 70 SER H H 70 8.140 8.140 8.022 0.118 25464
1043 1 3 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.256 0.064 25464
1044 1 3 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.782 -0.382 25464
1045 1 3 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.194 -0.094 25464
1046 1 3 . 1 1 76 76 ALA N N 76 124.000 124.000 127.877 -3.877 25464
1047 1 3 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.683 -0.353 25464
1048 1 3 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.722 0.978 25464
1049 1 3 . 1 1 76 76 ALA CB C 76 19.000 19.000 20.211 -1.211 25464
1050 1 3 . 1 1 76 76 ALA H H 76 8.200 8.200 8.352 -0.152 25464
1051 1 3 . 1 1 77 77 SER N N 77 114.100 114.100 118.312 -4.212 25464
1052 1 3 . 1 1 77 77 SER HA H 77 4.450 4.450 4.298 0.152 25464
1053 1 3 . 1 1 77 77 SER CA C 77 58.200 58.200 58.816 -0.616 25464
1054 1 3 . 1 1 77 77 SER CB C 77 63.900 63.900 63.510 0.390 25464
1055 1 3 . 1 1 77 77 SER H H 77 8.210 8.210 8.813 -0.603 25464
1056 1 3 . 1 1 78 78 GLY N N 78 110.500 110.500 108.465 2.035 25464
1057 1 3 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.433 0.967 25464
1058 1 3 . 1 1 78 78 GLY H H 78 8.390 8.390 7.681 0.709 25464
1059 1 3 . 1 1 79 79 GLN N N 79 119.600 119.600 119.048 0.552 25464
1060 1 3 . 1 1 79 79 GLN CA C 79 55.600 55.600 56.008 -0.408 25464
1061 1 3 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.452 0.148 25464
1062 1 3 . 1 1 79 79 GLN H H 79 8.250 8.250 8.339 -0.089 25464
1063 1 4 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.542 -0.082 25464
1064 1 4 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.562 0.839 25464
1065 1 4 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.878 0.222 25464
1066 1 4 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.224 -0.124 25464
1067 1 4 . 1 1 10 10 ASP N N 10 121.500 121.500 124.142 -2.642 25464
1068 1 4 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.553 0.047 25464
1069 1 4 . 1 1 10 10 ASP C C 10 175.300 175.300 175.166 0.134 25464
1070 1 4 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.854 -0.354 25464
1071 1 4 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.382 -0.481 25464
1072 1 4 . 1 1 10 10 ASP H H 10 8.420 8.420 8.374 0.046 25464
1073 1 4 . 1 1 11 11 ASN N N 11 118.400 118.400 120.687 -2.287 25464
1074 1 4 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.572 0.378 25464
1075 1 4 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.003 -0.203 25464
1076 1 4 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.717 0.383 25464
1077 1 4 . 1 1 11 11 ASN H H 11 8.270 8.270 8.324 -0.054 25464
1078 1 4 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.170 0.210 25464
1079 1 4 . 1 1 12 12 PRO C C 12 177.100 177.100 176.409 0.691 25464
1080 1 4 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.999 -0.299 25464
1081 1 4 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.867 0.033 25464
1082 1 4 . 1 1 13 13 PHE N N 13 117.500 117.500 113.971 3.529 25464
1083 1 4 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.519 -0.019 25464
1084 1 4 . 1 1 13 13 PHE C C 13 175.700 175.700 174.863 0.837 25464
1085 1 4 . 1 1 13 13 PHE CA C 13 58.300 58.300 54.624 3.676 25464
1086 1 4 . 1 1 13 13 PHE CB C 13 38.700 38.700 37.369 1.331 25464
1087 1 4 . 1 1 13 13 PHE H H 13 8.120 8.120 6.874 1.246 25464
1088 1 4 . 1 1 14 14 ASP N N 14 120.000 120.000 119.876 0.124 25464
1089 1 4 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.306 0.314 25464
1090 1 4 . 1 1 14 14 ASP C C 14 175.800 175.800 176.347 -0.547 25464
1091 1 4 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.725 -0.325 25464
1092 1 4 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.274 1.126 25464
1093 1 4 . 1 1 14 14 ASP H H 14 8.010 8.010 7.770 0.240 25464
1094 1 4 . 1 1 15 15 ASP N N 15 119.900 119.900 119.131 0.769 25464
1095 1 4 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.689 -0.079 25464
1096 1 4 . 1 1 15 15 ASP C C 15 176.700 176.700 175.748 0.952 25464
1097 1 4 . 1 1 15 15 ASP CA C 15 54.500 54.500 53.550 0.950 25464
1098 1 4 . 1 1 15 15 ASP CB C 15 41.200 41.200 43.389 -2.189 25464
1099 1 4 . 1 1 15 15 ASP H H 15 7.900 7.900 7.627 0.273 25464
1100 1 4 . 1 1 16 16 GLU N N 16 122.700 122.700 115.745 6.955 25464
1101 1 4 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.555 -0.325 25464
1102 1 4 . 1 1 16 16 GLU C C 16 176.600 176.600 176.235 0.365 25464
1103 1 4 . 1 1 16 16 GLU CA C 16 57.400 57.400 56.505 0.895 25464
1104 1 4 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.988 -0.888 25464
1105 1 4 . 1 1 16 16 GLU H H 16 8.610 8.610 8.524 0.086 25464
1106 1 4 . 1 1 17 17 ASP N N 17 119.500 119.500 121.903 -2.403 25464
1107 1 4 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.508 0.342 25464
1108 1 4 . 1 1 17 17 ASP C C 17 176.300 176.300 176.300 0.000 25464
1109 1 4 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.829 -1.529 25464
1110 1 4 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.474 0.126 25464
1111 1 4 . 1 1 17 17 ASP H H 17 8.490 8.490 8.629 -0.139 25464
1112 1 4 . 1 1 18 18 GLY N N 18 107.700 107.700 105.051 2.649 25464
1113 1 4 . 1 1 18 18 GLY C C 18 172.700 172.700 172.223 0.477 25464
1114 1 4 . 1 1 18 18 GLY CA C 18 44.900 44.900 43.533 1.367 25464
1115 1 4 . 1 1 18 18 GLY H H 18 8.070 8.070 7.519 0.551 25464
1116 1 4 . 1 1 19 19 MET N N 19 117.400 117.400 118.416 -1.016 25464
1117 1 4 . 1 1 19 19 MET HA H 19 4.890 4.890 4.122 0.768 25464
1118 1 4 . 1 1 19 19 MET C C 19 176.000 176.000 174.742 1.258 25464
1119 1 4 . 1 1 19 19 MET CA C 19 53.700 53.700 55.715 -2.015 25464
1120 1 4 . 1 1 19 19 MET CB C 19 35.100 35.100 33.825 1.275 25464
1121 1 4 . 1 1 19 19 MET H H 19 7.820 7.820 8.193 -0.373 25464
1122 1 4 . 1 1 20 20 PHE N N 20 120.100 120.100 117.948 2.152 25464
1123 1 4 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.773 0.237 25464
1124 1 4 . 1 1 20 20 PHE C C 20 174.200 174.200 174.999 -0.799 25464
1125 1 4 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.106 2.294 25464
1126 1 4 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.821 3.979 25464
1127 1 4 . 1 1 20 20 PHE H H 20 9.370 9.370 8.435 0.935 25464
1128 1 4 . 1 1 21 21 PHE N N 21 115.200 115.200 116.685 -1.485 25464
1129 1 4 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.244 0.386 25464
1130 1 4 . 1 1 21 21 PHE C C 21 177.500 177.500 174.885 2.615 25464
1131 1 4 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.339 0.161 25464
1132 1 4 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.500 3.600 25464
1133 1 4 . 1 1 21 21 PHE H H 21 9.600 9.600 8.362 1.238 25464
1134 1 4 . 1 1 22 22 VAL N N 22 116.600 116.600 121.401 -4.801 25464
1135 1 4 . 1 1 22 22 VAL C C 22 175.000 175.000 175.443 -0.443 25464
1136 1 4 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.773 0.927 25464
1137 1 4 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.328 0.472 25464
1138 1 4 . 1 1 22 22 VAL H H 22 8.750 8.750 8.664 0.086 25464
1139 1 4 . 1 1 23 23 LEU N N 23 126.500 126.500 127.900 -1.400 25464
1140 1 4 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.459 0.181 25464
1141 1 4 . 1 1 23 23 LEU C C 23 176.200 176.200 175.492 0.708 25464
1142 1 4 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.043 -1.243 25464
1143 1 4 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.484 1.216 25464
1144 1 4 . 1 1 23 23 LEU H H 23 9.530 9.530 8.695 0.835 25464
1145 1 4 . 1 1 24 24 ILE N N 24 117.700 117.700 119.411 -1.711 25464
1146 1 4 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.321 0.369 25464
1147 1 4 . 1 1 24 24 ILE C C 24 174.300 174.300 174.013 0.287 25464
1148 1 4 . 1 1 24 24 ILE CA C 24 58.900 58.900 58.838 0.062 25464
1149 1 4 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.305 1.295 25464
1150 1 4 . 1 1 24 24 ILE H H 24 9.300 9.300 9.120 0.180 25464
1151 1 4 . 1 1 25 25 ASN N N 25 122.500 122.500 127.378 -4.878 25464
1152 1 4 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.513 0.187 25464
1153 1 4 . 1 1 25 25 ASN C C 25 177.700 177.700 176.354 1.346 25464
1154 1 4 . 1 1 25 25 ASN CA C 25 49.700 49.700 52.487 -2.787 25464
1155 1 4 . 1 1 25 25 ASN CB C 25 37.600 37.600 38.712 -1.112 25464
1156 1 4 . 1 1 25 25 ASN H H 25 7.300 7.300 8.764 -1.464 25464
1157 1 4 . 1 1 26 26 ASP N N 26 118.100 118.100 123.757 -5.657 25464
1158 1 4 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.285 0.075 25464
1159 1 4 . 1 1 26 26 ASP C C 26 176.700 176.700 176.271 0.429 25464
1160 1 4 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.959 -0.459 25464
1161 1 4 . 1 1 26 26 ASP CB C 26 39.900 39.900 41.041 -1.141 25464
1162 1 4 . 1 1 26 26 ASP H H 26 8.340 8.340 8.123 0.217 25464
1163 1 4 . 1 1 27 27 GLU N N 27 117.600 117.600 117.985 -0.385 25464
1164 1 4 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.142 0.398 25464
1165 1 4 . 1 1 27 27 GLU C C 27 175.100 175.100 175.854 -0.754 25464
1166 1 4 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.837 -0.137 25464
1167 1 4 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.541 0.959 25464
1168 1 4 . 1 1 27 27 GLU H H 27 7.190 7.190 7.737 -0.547 25464
1169 1 4 . 1 1 28 28 GLU N N 28 112.800 112.800 113.333 -0.533 25464
1170 1 4 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.918 -0.328 25464
1171 1 4 . 1 1 28 28 GLU C C 28 175.200 175.200 175.499 -0.299 25464
1172 1 4 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.561 0.239 25464
1173 1 4 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.180 -0.680 25464
1174 1 4 . 1 1 28 28 GLU H H 28 8.050 8.050 8.109 -0.059 25464
1175 1 4 . 1 1 29 29 GLN N N 29 117.200 117.200 117.600 -0.400 25464
1176 1 4 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.353 -0.073 25464
1177 1 4 . 1 1 29 29 GLN C C 29 174.600 174.600 175.583 -0.983 25464
1178 1 4 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.043 -0.143 25464
1179 1 4 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.981 -0.681 25464
1180 1 4 . 1 1 29 29 GLN H H 29 7.840 7.840 7.428 0.412 25464
1181 1 4 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.366 0.694 25464
1182 1 4 . 1 1 30 30 HIS C C 30 175.900 175.900 174.736 1.164 25464
1183 1 4 . 1 1 30 30 HIS CA C 30 54.700 54.700 54.766 -0.066 25464
1184 1 4 . 1 1 30 30 HIS CB C 30 32.900 32.900 30.987 1.913 25464
1185 1 4 . 1 1 31 31 SER N N 31 113.100 113.100 116.571 -3.471 25464
1186 1 4 . 1 1 31 31 SER HA H 31 4.740 4.740 4.745 -0.005 25464
1187 1 4 . 1 1 31 31 SER C C 31 173.200 173.200 172.389 0.811 25464
1188 1 4 . 1 1 31 31 SER CA C 31 57.400 57.400 56.831 0.569 25464
1189 1 4 . 1 1 31 31 SER CB C 31 66.600 66.600 66.227 0.373 25464
1190 1 4 . 1 1 31 31 SER H H 31 8.850 8.850 8.851 -0.001 25464
1191 1 4 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.869 0.491 25464
1192 1 4 . 1 1 32 32 LEU C C 32 178.200 178.200 174.071 4.129 25464
1193 1 4 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.517 1.482 25464
1194 1 4 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.373 -1.673 25464
1195 1 4 . 1 1 33 33 TRP N N 33 123.400 123.400 128.148 -4.748 25464
1196 1 4 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.610 0.690 25464
1197 1 4 . 1 1 33 33 TRP CA C 33 54.100 54.100 53.585 0.515 25464
1198 1 4 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.333 2.167 25464
1199 1 4 . 1 1 33 33 TRP H H 33 9.170 9.170 8.873 0.297 25464
1200 1 4 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.754 -0.944 25464
1201 1 4 . 1 1 34 34 PRO C C 34 177.400 177.400 177.422 -0.022 25464
1202 1 4 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.406 -0.606 25464
1203 1 4 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.119 -1.119 25464
1204 1 4 . 1 1 35 35 THR N N 35 107.700 107.700 116.068 -8.368 25464
1205 1 4 . 1 1 35 35 THR HA H 35 3.730 3.730 4.215 -0.485 25464
1206 1 4 . 1 1 35 35 THR C C 35 176.100 176.100 175.688 0.412 25464
1207 1 4 . 1 1 35 35 THR CA C 35 63.600 63.600 64.961 -1.361 25464
1208 1 4 . 1 1 35 35 THR CB C 35 68.200 68.200 68.395 -0.196 25464
1209 1 4 . 1 1 35 35 THR H H 35 7.260 7.260 7.893 -0.633 25464
1210 1 4 . 1 1 36 36 PHE N N 36 114.500 114.500 118.775 -4.275 25464
1211 1 4 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.433 0.077 25464
1212 1 4 . 1 1 36 36 PHE C C 36 174.500 174.500 175.674 -1.174 25464
1213 1 4 . 1 1 36 36 PHE CA C 36 56.900 56.900 58.826 -1.926 25464
1214 1 4 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.496 -0.896 25464
1215 1 4 . 1 1 36 36 PHE H H 36 6.770 6.770 7.516 -0.746 25464
1216 1 4 . 1 1 37 37 ALA N N 37 125.300 125.300 121.939 3.361 25464
1217 1 4 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.498 0.212 25464
1218 1 4 . 1 1 37 37 ALA C C 37 177.300 177.300 176.321 0.979 25464
1219 1 4 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.179 -0.979 25464
1220 1 4 . 1 1 37 37 ALA CB C 37 20.400 20.400 20.337 0.062 25464
1221 1 4 . 1 1 37 37 ALA H H 37 6.950 6.950 7.371 -0.421 25464
1222 1 4 . 1 1 38 38 ASP N N 38 124.500 124.500 121.428 3.072 25464
1223 1 4 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.869 -0.389 25464
1224 1 4 . 1 1 38 38 ASP C C 38 176.700 176.700 176.211 0.489 25464
1225 1 4 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.832 1.168 25464
1226 1 4 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.507 -2.107 25464
1227 1 4 . 1 1 38 38 ASP H H 38 8.870 8.870 8.647 0.223 25464
1228 1 4 . 1 1 39 39 VAL N N 39 126.000 126.000 123.046 2.954 25464
1229 1 4 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.882 -0.522 25464
1230 1 4 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.682 0.417 25464
1231 1 4 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.459 0.741 25464
1232 1 4 . 1 1 39 39 VAL H H 39 8.650 8.650 8.456 0.194 25464
1233 1 4 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.491 -0.241 25464
1234 1 4 . 1 1 40 40 PRO C C 40 175.800 175.800 176.137 -0.337 25464
1235 1 4 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.580 -0.380 25464
1236 1 4 . 1 1 40 40 PRO CB C 40 31.700 31.700 32.008 -0.307 25464
1237 1 4 . 1 1 41 41 ALA N N 41 122.700 122.700 125.997 -3.297 25464
1238 1 4 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.063 0.117 25464
1239 1 4 . 1 1 41 41 ALA C C 41 179.000 179.000 178.701 0.299 25464
1240 1 4 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.564 -0.264 25464
1241 1 4 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.004 -0.704 25464
1242 1 4 . 1 1 41 41 ALA H H 41 8.280 8.280 8.506 -0.226 25464
1243 1 4 . 1 1 42 42 GLY N N 42 109.800 109.800 111.575 -1.775 25464
1244 1 4 . 1 1 42 42 GLY C C 42 173.800 173.800 173.531 0.269 25464
1245 1 4 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.871 -0.171 25464
1246 1 4 . 1 1 42 42 GLY H H 42 8.770 8.770 8.305 0.465 25464
1247 1 4 . 1 1 43 43 TRP N N 43 120.300 120.300 122.129 -1.829 25464
1248 1 4 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.031 -0.081 25464
1249 1 4 . 1 1 43 43 TRP C C 43 174.900 174.900 175.909 -1.009 25464
1250 1 4 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.388 -0.688 25464
1251 1 4 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.985 2.015 25464
1252 1 4 . 1 1 43 43 TRP H H 43 7.740 7.740 7.923 -0.183 25464
1253 1 4 . 1 1 44 44 ARG N N 44 117.700 117.700 123.155 -5.455 25464
1254 1 4 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.725 -0.005 25464
1255 1 4 . 1 1 44 44 ARG C C 44 174.900 174.900 175.192 -0.292 25464
1256 1 4 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.870 -0.970 25464
1257 1 4 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.207 0.993 25464
1258 1 4 . 1 1 44 44 ARG H H 44 8.990 8.990 8.919 0.071 25464
1259 1 4 . 1 1 45 45 VAL N N 45 122.800 122.800 125.159 -2.359 25464
1260 1 4 . 1 1 45 45 VAL HA H 45 3.980 3.980 3.993 -0.013 25464
1261 1 4 . 1 1 45 45 VAL C C 45 177.600 177.600 176.616 0.984 25464
1262 1 4 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.760 -0.060 25464
1263 1 4 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.775 0.325 25464
1264 1 4 . 1 1 45 45 VAL H H 45 8.720 8.720 8.616 0.104 25464
1265 1 4 . 1 1 46 46 VAL N N 46 120.400 120.400 124.984 -4.584 25464
1266 1 4 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.234 0.446 25464
1267 1 4 . 1 1 46 46 VAL C C 46 174.200 174.200 174.994 -0.794 25464
1268 1 4 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.872 -2.372 25464
1269 1 4 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.363 0.637 25464
1270 1 4 . 1 1 46 46 VAL H H 46 9.060 9.060 8.828 0.232 25464
1271 1 4 . 1 1 47 47 PHE N N 47 121.100 121.100 122.480 -1.380 25464
1272 1 4 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.699 -0.249 25464
1273 1 4 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.112 2.588 25464
1274 1 4 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.442 0.258 25464
1275 1 4 . 1 1 47 47 PHE H H 47 7.680 7.680 8.273 -0.593 25464
1276 1 4 . 1 1 48 48 GLY N N 48 112.600 112.600 112.588 0.012 25464
1277 1 4 . 1 1 48 48 GLY C C 48 174.700 174.700 173.742 0.958 25464
1278 1 4 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.372 -2.372 25464
1279 1 4 . 1 1 48 48 GLY H H 48 7.380 7.380 8.588 -1.208 25464
1280 1 4 . 1 1 49 49 GLU N N 49 120.600 120.600 118.539 2.061 25464
1281 1 4 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.175 0.055 25464
1282 1 4 . 1 1 49 49 GLU C C 49 174.900 174.900 175.247 -0.347 25464
1283 1 4 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.514 -1.214 25464
1284 1 4 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.543 2.657 25464
1285 1 4 . 1 1 49 49 GLU H H 49 8.510 8.510 8.602 -0.092 25464
1286 1 4 . 1 1 50 50 ALA N N 50 126.600 126.600 127.708 -1.108 25464
1287 1 4 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.622 0.018 25464
1288 1 4 . 1 1 50 50 ALA C C 50 175.100 175.100 175.532 -0.432 25464
1289 1 4 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.131 1.269 25464
1290 1 4 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.587 0.613 25464
1291 1 4 . 1 1 50 50 ALA H H 50 9.440 9.440 8.671 0.769 25464
1292 1 4 . 1 1 51 51 SER N N 51 115.100 115.100 114.342 0.758 25464
1293 1 4 . 1 1 51 51 SER HA H 51 4.740 4.740 4.185 0.555 25464
1294 1 4 . 1 1 51 51 SER C C 51 175.000 175.000 176.097 -1.097 25464
1295 1 4 . 1 1 51 51 SER CA C 51 58.100 58.100 57.780 0.320 25464
1296 1 4 . 1 1 51 51 SER CB C 51 64.700 64.700 64.252 0.448 25464
1297 1 4 . 1 1 51 51 SER H H 51 8.950 8.950 8.568 0.382 25464
1298 1 4 . 1 1 52 52 ARG N N 52 123.500 123.500 127.293 -3.793 25464
1299 1 4 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.018 -0.608 25464
1300 1 4 . 1 1 52 52 ARG C C 52 178.200 178.200 177.644 0.556 25464
1301 1 4 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.913 1.087 25464
1302 1 4 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.909 -0.009 25464
1303 1 4 . 1 1 52 52 ARG H H 52 9.540 9.540 8.955 0.585 25464
1304 1 4 . 1 1 53 53 ALA N N 53 118.000 118.000 120.737 -2.737 25464
1305 1 4 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.172 -0.142 25464
1306 1 4 . 1 1 53 53 ALA C C 53 181.000 181.000 179.669 1.331 25464
1307 1 4 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.490 -0.190 25464
1308 1 4 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.638 0.462 25464
1309 1 4 . 1 1 53 53 ALA H H 53 8.770 8.770 8.311 0.459 25464
1310 1 4 . 1 1 54 54 SER N N 54 115.300 115.300 115.480 -0.180 25464
1311 1 4 . 1 1 54 54 SER HA H 54 4.350 4.350 4.212 0.138 25464
1312 1 4 . 1 1 54 54 SER C C 54 177.500 177.500 176.985 0.515 25464
1313 1 4 . 1 1 54 54 SER CA C 54 61.900 61.900 62.162 -0.262 25464
1314 1 4 . 1 1 54 54 SER CB C 54 63.100 63.100 62.612 0.488 25464
1315 1 4 . 1 1 54 54 SER H H 54 8.140 8.140 8.266 -0.126 25464
1316 1 4 . 1 1 55 55 CYS N N 55 121.900 121.900 120.323 1.577 25464
1317 1 4 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.933 0.227 25464
1318 1 4 . 1 1 55 55 CYS C C 55 176.300 176.300 176.816 -0.516 25464
1319 1 4 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.254 0.046 25464
1320 1 4 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.142 -0.142 25464
1321 1 4 . 1 1 55 55 CYS H H 55 8.430 8.430 7.901 0.529 25464
1322 1 4 . 1 1 56 56 VAL N N 56 121.100 121.100 120.282 0.818 25464
1323 1 4 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.682 -0.192 25464
1324 1 4 . 1 1 56 56 VAL C C 56 177.800 177.800 178.327 -0.527 25464
1325 1 4 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.013 -0.013 25464
1326 1 4 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.033 0.567 25464
1327 1 4 . 1 1 56 56 VAL H H 56 8.750 8.750 8.810 -0.060 25464
1328 1 4 . 1 1 57 57 GLU N N 57 119.200 119.200 120.766 -1.566 25464
1329 1 4 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.007 0.063 25464
1330 1 4 . 1 1 57 57 GLU C C 57 177.900 177.900 178.820 -0.920 25464
1331 1 4 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.950 -0.650 25464
1332 1 4 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.671 -0.171 25464
1333 1 4 . 1 1 57 57 GLU H H 57 7.780 7.780 8.408 -0.628 25464
1334 1 4 . 1 1 58 58 TYR N N 58 119.400 119.400 120.576 -1.176 25464
1335 1 4 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.272 -0.382 25464
1336 1 4 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.056 0.144 25464
1337 1 4 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.917 -1.717 25464
1338 1 4 . 1 1 58 58 TYR H H 58 7.700 7.700 8.287 -0.587 25464
1339 1 4 . 1 1 59 59 VAL N N 59 121.500 121.500 118.497 3.003 25464
1340 1 4 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.751 -0.391 25464
1341 1 4 . 1 1 59 59 VAL C C 59 176.300 176.300 178.257 -1.957 25464
1342 1 4 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.601 0.799 25464
1343 1 4 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.085 0.315 25464
1344 1 4 . 1 1 59 59 VAL H H 59 8.380 8.380 8.487 -0.107 25464
1345 1 4 . 1 1 60 60 ASP N N 60 120.000 120.000 119.147 0.853 25464
1346 1 4 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.564 -0.154 25464
1347 1 4 . 1 1 60 60 ASP C C 60 178.300 178.300 179.233 -0.933 25464
1348 1 4 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.088 0.012 25464
1349 1 4 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.097 -0.497 25464
1350 1 4 . 1 1 60 60 ASP H H 60 8.580 8.580 8.380 0.200 25464
1351 1 4 . 1 1 61 61 GLN N N 61 114.500 114.500 118.031 -3.531 25464
1352 1 4 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.063 -0.053 25464
1353 1 4 . 1 1 61 61 GLN C C 61 176.700 176.700 177.430 -0.730 25464
1354 1 4 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.222 -1.522 25464
1355 1 4 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.574 0.226 25464
1356 1 4 . 1 1 61 61 GLN H H 61 7.810 7.810 7.926 -0.116 25464
1357 1 4 . 1 1 62 62 HIS N N 62 115.100 115.100 115.844 -0.744 25464
1358 1 4 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.657 -0.277 25464
1359 1 4 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.595 1.705 25464
1360 1 4 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.265 -0.265 25464
1361 1 4 . 1 1 62 62 HIS H H 62 7.730 7.730 7.521 0.209 25464
1362 1 4 . 1 1 63 63 TRP N N 63 121.500 121.500 123.208 -1.708 25464
1363 1 4 . 1 1 63 63 TRP CA C 63 58.800 58.800 61.617 -2.817 25464
1364 1 4 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.389 0.311 25464
1365 1 4 . 1 1 63 63 TRP H H 63 8.180 8.180 7.363 0.817 25464
1366 1 4 . 1 1 64 64 THR N N 64 114.900 114.900 113.490 1.410 25464
1367 1 4 . 1 1 64 64 THR HA H 64 4.180 4.180 4.558 -0.378 25464
1368 1 4 . 1 1 64 64 THR CA C 64 62.100 62.100 63.117 -1.016 25464
1369 1 4 . 1 1 64 64 THR CB C 64 69.500 69.500 68.321 1.179 25464
1370 1 4 . 1 1 64 64 THR H H 64 7.940 7.940 8.170 -0.230 25464
1371 1 4 . 1 1 65 65 ASP N N 65 122.900 122.900 124.939 -2.039 25464
1372 1 4 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.263 0.137 25464
1373 1 4 . 1 1 65 65 ASP CB C 65 41.100 41.100 42.619 -1.519 25464
1374 1 4 . 1 1 65 65 ASP H H 65 8.340 8.340 8.441 -0.101 25464
1375 1 4 . 1 1 66 66 ILE N N 66 122.200 122.200 121.947 0.253 25464
1376 1 4 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.206 -0.046 25464
1377 1 4 . 1 1 66 66 ILE CA C 66 61.100 61.100 61.548 -0.449 25464
1378 1 4 . 1 1 66 66 ILE CB C 66 38.500 38.500 38.007 0.493 25464
1379 1 4 . 1 1 66 66 ILE H H 66 8.250 8.250 7.997 0.253 25464
1380 1 4 . 1 1 67 67 ARG N N 67 124.000 124.000 126.402 -2.402 25464
1381 1 4 . 1 1 67 67 ARG CA C 67 53.900 53.900 54.567 -0.667 25464
1382 1 4 . 1 1 67 67 ARG CB C 67 30.000 30.000 30.106 -0.106 25464
1383 1 4 . 1 1 67 67 ARG H H 67 8.490 8.490 8.662 -0.172 25464
1384 1 4 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.237 0.203 25464
1385 1 4 . 1 1 68 68 PRO CA C 68 63.100 63.100 64.194 -1.093 25464
1386 1 4 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.375 -0.275 25464
1387 1 4 . 1 1 69 69 LYS HA H 69 4.330 4.330 3.929 0.401 25464
1388 1 4 . 1 1 69 69 LYS C C 69 175.900 175.900 176.425 -0.525 25464
1389 1 4 . 1 1 69 69 LYS CA C 69 56.300 56.300 57.921 -1.621 25464
1390 1 4 . 1 1 69 69 LYS CB C 69 33.000 33.000 30.427 2.573 25464
1391 1 4 . 1 1 69 69 LYS H H 69 8.270 8.270 8.680 -0.410 25464
1392 1 4 . 1 1 70 70 SER N N 70 122.300 122.300 114.172 8.128 25464
1393 1 4 . 1 1 70 70 SER HA H 70 4.580 4.580 4.380 0.200 25464
1394 1 4 . 1 1 70 70 SER CA C 70 59.900 59.900 58.567 1.333 25464
1395 1 4 . 1 1 70 70 SER CB C 70 65.100 65.100 63.425 1.675 25464
1396 1 4 . 1 1 70 70 SER H H 70 8.140 8.140 8.177 -0.037 25464
1397 1 4 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.349 -0.029 25464
1398 1 4 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.965 0.435 25464
1399 1 4 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.204 -1.104 25464
1400 1 4 . 1 1 76 76 ALA N N 76 124.000 124.000 129.081 -5.081 25464
1401 1 4 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.688 -0.358 25464
1402 1 4 . 1 1 76 76 ALA CA C 76 52.700 52.700 52.395 0.305 25464
1403 1 4 . 1 1 76 76 ALA CB C 76 19.000 19.000 18.984 0.016 25464
1404 1 4 . 1 1 76 76 ALA H H 76 8.200 8.200 8.406 -0.206 25464
1405 1 4 . 1 1 77 77 SER N N 77 114.100 114.100 118.005 -3.905 25464
1406 1 4 . 1 1 77 77 SER HA H 77 4.450 4.450 4.818 -0.368 25464
1407 1 4 . 1 1 77 77 SER CA C 77 58.200 58.200 58.102 0.098 25464
1408 1 4 . 1 1 77 77 SER CB C 77 63.900 63.900 64.529 -0.629 25464
1409 1 4 . 1 1 77 77 SER H H 77 8.210 8.210 8.418 -0.208 25464
1410 1 4 . 1 1 78 78 GLY N N 78 110.500 110.500 109.247 1.253 25464
1411 1 4 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.416 -0.016 25464
1412 1 4 . 1 1 78 78 GLY H H 78 8.390 8.390 8.551 -0.161 25464
1413 1 4 . 1 1 79 79 GLN N N 79 119.600 119.600 119.519 0.081 25464
1414 1 4 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.747 -0.147 25464
1415 1 4 . 1 1 79 79 GLN CB C 79 29.600 29.600 26.876 2.724 25464
1416 1 4 . 1 1 79 79 GLN H H 79 8.250 8.250 8.464 -0.214 25464
1417 1 5 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.620 -0.160 25464
1418 1 5 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.714 0.686 25464
1419 1 5 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.211 -0.111 25464
1420 1 5 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.823 -0.723 25464
1421 1 5 . 1 1 10 10 ASP N N 10 121.500 121.500 121.226 0.274 25464
1422 1 5 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.473 0.127 25464
1423 1 5 . 1 1 10 10 ASP C C 10 175.300 175.300 176.301 -1.001 25464
1424 1 5 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.830 -0.330 25464
1425 1 5 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.351 -0.451 25464
1426 1 5 . 1 1 10 10 ASP H H 10 8.420 8.420 8.367 0.053 25464
1427 1 5 . 1 1 11 11 ASN N N 11 118.400 118.400 121.935 -3.535 25464
1428 1 5 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.507 0.443 25464
1429 1 5 . 1 1 11 11 ASN CA C 11 50.800 50.800 52.380 -1.580 25464
1430 1 5 . 1 1 11 11 ASN CB C 11 39.100 39.100 39.138 -0.038 25464
1431 1 5 . 1 1 11 11 ASN H H 11 8.270 8.270 8.436 -0.166 25464
1432 1 5 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.344 0.036 25464
1433 1 5 . 1 1 12 12 PRO C C 12 177.100 177.100 175.692 1.408 25464
1434 1 5 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.835 -0.135 25464
1435 1 5 . 1 1 12 12 PRO CB C 12 31.900 31.900 30.985 0.915 25464
1436 1 5 . 1 1 13 13 PHE N N 13 117.500 117.500 116.836 0.664 25464
1437 1 5 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.739 -0.239 25464
1438 1 5 . 1 1 13 13 PHE C C 13 175.700 175.700 175.479 0.221 25464
1439 1 5 . 1 1 13 13 PHE CA C 13 58.300 58.300 55.780 2.520 25464
1440 1 5 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.927 -0.227 25464
1441 1 5 . 1 1 13 13 PHE H H 13 8.120 8.120 7.406 0.714 25464
1442 1 5 . 1 1 14 14 ASP N N 14 120.000 120.000 120.695 -0.695 25464
1443 1 5 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.380 0.240 25464
1444 1 5 . 1 1 14 14 ASP C C 14 175.800 175.800 175.501 0.299 25464
1445 1 5 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.622 -0.222 25464
1446 1 5 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.336 1.065 25464
1447 1 5 . 1 1 14 14 ASP H H 14 8.010 8.010 7.764 0.246 25464
1448 1 5 . 1 1 15 15 ASP N N 15 119.900 119.900 121.001 -1.101 25464
1449 1 5 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.526 0.084 25464
1450 1 5 . 1 1 15 15 ASP C C 15 176.700 176.700 177.798 -1.098 25464
1451 1 5 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.872 -1.372 25464
1452 1 5 . 1 1 15 15 ASP CB C 15 41.200 41.200 40.594 0.606 25464
1453 1 5 . 1 1 15 15 ASP H H 15 7.900 7.900 7.999 -0.099 25464
1454 1 5 . 1 1 16 16 GLU N N 16 122.700 122.700 124.430 -1.730 25464
1455 1 5 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.022 0.208 25464
1456 1 5 . 1 1 16 16 GLU C C 16 176.600 176.600 177.500 -0.900 25464
1457 1 5 . 1 1 16 16 GLU CA C 16 57.400 57.400 59.051 -1.651 25464
1458 1 5 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.450 0.650 25464
1459 1 5 . 1 1 16 16 GLU H H 16 8.610 8.610 8.776 -0.166 25464
1460 1 5 . 1 1 17 17 ASP N N 17 119.500 119.500 118.261 1.239 25464
1461 1 5 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.561 0.289 25464
1462 1 5 . 1 1 17 17 ASP C C 17 176.300 176.300 176.937 -0.637 25464
1463 1 5 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.770 -0.470 25464
1464 1 5 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.740 0.860 25464
1465 1 5 . 1 1 17 17 ASP H H 17 8.490 8.490 8.295 0.195 25464
1466 1 5 . 1 1 18 18 GLY N N 18 107.700 107.700 107.502 0.198 25464
1467 1 5 . 1 1 18 18 GLY C C 18 172.700 172.700 172.938 -0.238 25464
1468 1 5 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.144 0.756 25464
1469 1 5 . 1 1 18 18 GLY H H 18 8.070 8.070 7.682 0.388 25464
1470 1 5 . 1 1 19 19 MET N N 19 117.400 117.400 119.756 -2.356 25464
1471 1 5 . 1 1 19 19 MET HA H 19 4.890 4.890 4.609 0.281 25464
1472 1 5 . 1 1 19 19 MET C C 19 176.000 176.000 174.663 1.337 25464
1473 1 5 . 1 1 19 19 MET CA C 19 53.700 53.700 52.953 0.747 25464
1474 1 5 . 1 1 19 19 MET CB C 19 35.100 35.100 32.620 2.480 25464
1475 1 5 . 1 1 19 19 MET H H 19 7.820 7.820 8.144 -0.324 25464
1476 1 5 . 1 1 20 20 PHE N N 20 120.100 120.100 120.078 0.022 25464
1477 1 5 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.547 0.463 25464
1478 1 5 . 1 1 20 20 PHE C C 20 174.200 174.200 174.672 -0.472 25464
1479 1 5 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.347 2.053 25464
1480 1 5 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.070 3.730 25464
1481 1 5 . 1 1 20 20 PHE H H 20 9.370 9.370 8.643 0.727 25464
1482 1 5 . 1 1 21 21 PHE N N 21 115.200 115.200 117.022 -1.822 25464
1483 1 5 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.123 0.507 25464
1484 1 5 . 1 1 21 21 PHE C C 21 177.500 177.500 174.897 2.603 25464
1485 1 5 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.189 0.311 25464
1486 1 5 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.216 3.884 25464
1487 1 5 . 1 1 21 21 PHE H H 21 9.600 9.600 8.188 1.412 25464
1488 1 5 . 1 1 22 22 VAL N N 22 116.600 116.600 121.848 -5.248 25464
1489 1 5 . 1 1 22 22 VAL C C 22 175.000 175.000 175.632 -0.632 25464
1490 1 5 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.813 0.887 25464
1491 1 5 . 1 1 22 22 VAL CB C 22 32.800 32.800 31.691 1.109 25464
1492 1 5 . 1 1 22 22 VAL H H 22 8.750 8.750 8.531 0.219 25464
1493 1 5 . 1 1 23 23 LEU N N 23 126.500 126.500 127.955 -1.455 25464
1494 1 5 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.614 0.026 25464
1495 1 5 . 1 1 23 23 LEU C C 23 176.200 176.200 176.110 0.090 25464
1496 1 5 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.048 -1.248 25464
1497 1 5 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.283 1.417 25464
1498 1 5 . 1 1 23 23 LEU H H 23 9.530 9.530 8.986 0.544 25464
1499 1 5 . 1 1 24 24 ILE N N 24 117.700 117.700 118.856 -1.156 25464
1500 1 5 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.324 0.366 25464
1501 1 5 . 1 1 24 24 ILE C C 24 174.300 174.300 173.680 0.620 25464
1502 1 5 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.435 -0.535 25464
1503 1 5 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.311 1.289 25464
1504 1 5 . 1 1 24 24 ILE H H 24 9.300 9.300 9.001 0.299 25464
1505 1 5 . 1 1 25 25 ASN N N 25 122.500 122.500 125.839 -3.339 25464
1506 1 5 . 1 1 25 25 ASN HA H 25 4.700 4.700 5.046 -0.346 25464
1507 1 5 . 1 1 25 25 ASN C C 25 177.700 177.700 176.111 1.589 25464
1508 1 5 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.890 -2.190 25464
1509 1 5 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.416 -2.816 25464
1510 1 5 . 1 1 25 25 ASN H H 25 7.300 7.300 8.629 -1.329 25464
1511 1 5 . 1 1 26 26 ASP N N 26 118.100 118.100 124.368 -6.268 25464
1512 1 5 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.369 -0.009 25464
1513 1 5 . 1 1 26 26 ASP C C 26 176.700 176.700 176.886 -0.186 25464
1514 1 5 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.436 0.064 25464
1515 1 5 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.631 -0.731 25464
1516 1 5 . 1 1 26 26 ASP H H 26 8.340 8.340 8.501 -0.161 25464
1517 1 5 . 1 1 27 27 GLU N N 27 117.600 117.600 117.285 0.315 25464
1518 1 5 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.166 0.374 25464
1519 1 5 . 1 1 27 27 GLU C C 27 175.100 175.100 176.125 -1.025 25464
1520 1 5 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.200 -0.500 25464
1521 1 5 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.887 0.613 25464
1522 1 5 . 1 1 27 27 GLU H H 27 7.190 7.190 7.612 -0.422 25464
1523 1 5 . 1 1 28 28 GLU N N 28 112.800 112.800 115.079 -2.279 25464
1524 1 5 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.897 -0.307 25464
1525 1 5 . 1 1 28 28 GLU C C 28 175.200 175.200 174.809 0.391 25464
1526 1 5 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.189 0.611 25464
1527 1 5 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.256 -0.756 25464
1528 1 5 . 1 1 28 28 GLU H H 28 8.050 8.050 8.222 -0.172 25464
1529 1 5 . 1 1 29 29 GLN N N 29 117.200 117.200 117.868 -0.668 25464
1530 1 5 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.583 -0.303 25464
1531 1 5 . 1 1 29 29 GLN C C 29 174.600 174.600 175.069 -0.469 25464
1532 1 5 . 1 1 29 29 GLN CA C 29 54.900 54.900 54.036 0.864 25464
1533 1 5 . 1 1 29 29 GLN CB C 29 29.300 29.300 30.314 -1.014 25464
1534 1 5 . 1 1 29 29 GLN H H 29 7.840 7.840 7.607 0.233 25464
1535 1 5 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.739 0.321 25464
1536 1 5 . 1 1 30 30 HIS C C 30 175.900 175.900 174.920 0.980 25464
1537 1 5 . 1 1 30 30 HIS CA C 30 54.700 54.700 54.160 0.540 25464
1538 1 5 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.269 1.631 25464
1539 1 5 . 1 1 31 31 SER N N 31 113.100 113.100 115.798 -2.698 25464
1540 1 5 . 1 1 31 31 SER HA H 31 4.740 4.740 4.726 0.014 25464
1541 1 5 . 1 1 31 31 SER C C 31 173.200 173.200 172.092 1.108 25464
1542 1 5 . 1 1 31 31 SER CA C 31 57.400 57.400 57.164 0.236 25464
1543 1 5 . 1 1 31 31 SER CB C 31 66.600 66.600 64.384 2.216 25464
1544 1 5 . 1 1 31 31 SER H H 31 8.850 8.850 9.206 -0.356 25464
1545 1 5 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.981 0.379 25464
1546 1 5 . 1 1 32 32 LEU C C 32 178.200 178.200 174.734 3.466 25464
1547 1 5 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.591 1.409 25464
1548 1 5 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.270 -0.570 25464
1549 1 5 . 1 1 33 33 TRP N N 33 123.400 123.400 129.904 -6.504 25464
1550 1 5 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.936 0.364 25464
1551 1 5 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.225 -0.125 25464
1552 1 5 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.750 1.750 25464
1553 1 5 . 1 1 33 33 TRP H H 33 9.170 9.170 9.312 -0.142 25464
1554 1 5 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.458 -0.648 25464
1555 1 5 . 1 1 34 34 PRO C C 34 177.400 177.400 177.220 0.180 25464
1556 1 5 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.211 -0.411 25464
1557 1 5 . 1 1 34 34 PRO CB C 34 32.000 32.000 32.804 -0.805 25464
1558 1 5 . 1 1 35 35 THR N N 35 107.700 107.700 113.526 -5.826 25464
1559 1 5 . 1 1 35 35 THR HA H 35 3.730 3.730 4.301 -0.571 25464
1560 1 5 . 1 1 35 35 THR C C 35 176.100 176.100 175.639 0.461 25464
1561 1 5 . 1 1 35 35 THR CA C 35 63.600 63.600 64.877 -1.277 25464
1562 1 5 . 1 1 35 35 THR CB C 35 68.200 68.200 68.345 -0.145 25464
1563 1 5 . 1 1 35 35 THR H H 35 7.260 7.260 7.932 -0.672 25464
1564 1 5 . 1 1 36 36 PHE N N 36 114.500 114.500 118.410 -3.910 25464
1565 1 5 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.511 -0.001 25464
1566 1 5 . 1 1 36 36 PHE C C 36 174.500 174.500 175.532 -1.032 25464
1567 1 5 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.712 -0.811 25464
1568 1 5 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.244 -0.644 25464
1569 1 5 . 1 1 36 36 PHE H H 36 6.770 6.770 7.273 -0.503 25464
1570 1 5 . 1 1 37 37 ALA N N 37 125.300 125.300 121.040 4.260 25464
1571 1 5 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.616 0.094 25464
1572 1 5 . 1 1 37 37 ALA C C 37 177.300 177.300 174.964 2.336 25464
1573 1 5 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.269 -1.069 25464
1574 1 5 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.490 -1.090 25464
1575 1 5 . 1 1 37 37 ALA H H 37 6.950 6.950 7.440 -0.490 25464
1576 1 5 . 1 1 38 38 ASP N N 38 124.500 124.500 118.103 6.397 25464
1577 1 5 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.930 -0.450 25464
1578 1 5 . 1 1 38 38 ASP C C 38 176.700 176.700 175.731 0.969 25464
1579 1 5 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.078 1.922 25464
1580 1 5 . 1 1 38 38 ASP CB C 38 40.400 40.400 43.282 -2.882 25464
1581 1 5 . 1 1 38 38 ASP H H 38 8.870 8.870 8.596 0.274 25464
1582 1 5 . 1 1 39 39 VAL N N 39 126.000 126.000 123.978 2.022 25464
1583 1 5 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.581 -0.221 25464
1584 1 5 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.772 0.328 25464
1585 1 5 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.772 0.428 25464
1586 1 5 . 1 1 39 39 VAL H H 39 8.650 8.650 8.373 0.277 25464
1587 1 5 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.391 -0.141 25464
1588 1 5 . 1 1 40 40 PRO C C 40 175.800 175.800 176.524 -0.724 25464
1589 1 5 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.201 -0.001 25464
1590 1 5 . 1 1 40 40 PRO CB C 40 31.700 31.700 32.222 -0.522 25464
1591 1 5 . 1 1 41 41 ALA N N 41 122.700 122.700 125.833 -3.133 25464
1592 1 5 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.050 0.130 25464
1593 1 5 . 1 1 41 41 ALA C C 41 179.000 179.000 178.708 0.292 25464
1594 1 5 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.597 -0.297 25464
1595 1 5 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.950 -0.650 25464
1596 1 5 . 1 1 41 41 ALA H H 41 8.280 8.280 8.490 -0.210 25464
1597 1 5 . 1 1 42 42 GLY N N 42 109.800 109.800 111.338 -1.538 25464
1598 1 5 . 1 1 42 42 GLY C C 42 173.800 173.800 173.629 0.171 25464
1599 1 5 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.868 -0.168 25464
1600 1 5 . 1 1 42 42 GLY H H 42 8.770 8.770 8.294 0.476 25464
1601 1 5 . 1 1 43 43 TRP N N 43 120.300 120.300 122.432 -2.132 25464
1602 1 5 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.205 -0.255 25464
1603 1 5 . 1 1 43 43 TRP C C 43 174.900 174.900 175.909 -1.009 25464
1604 1 5 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.251 -0.550 25464
1605 1 5 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.164 1.836 25464
1606 1 5 . 1 1 43 43 TRP H H 43 7.740 7.740 7.938 -0.198 25464
1607 1 5 . 1 1 44 44 ARG N N 44 117.700 117.700 123.252 -5.552 25464
1608 1 5 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.727 -0.007 25464
1609 1 5 . 1 1 44 44 ARG C C 44 174.900 174.900 175.299 -0.399 25464
1610 1 5 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.706 -0.806 25464
1611 1 5 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.302 0.898 25464
1612 1 5 . 1 1 44 44 ARG H H 44 8.990 8.990 9.108 -0.118 25464
1613 1 5 . 1 1 45 45 VAL N N 45 122.800 122.800 125.800 -3.000 25464
1614 1 5 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.177 -0.197 25464
1615 1 5 . 1 1 45 45 VAL C C 45 177.600 177.600 176.817 0.783 25464
1616 1 5 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.288 0.412 25464
1617 1 5 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.548 1.552 25464
1618 1 5 . 1 1 45 45 VAL H H 45 8.720 8.720 8.708 0.012 25464
1619 1 5 . 1 1 46 46 VAL N N 46 120.400 120.400 125.086 -4.686 25464
1620 1 5 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.171 0.509 25464
1621 1 5 . 1 1 46 46 VAL C C 46 174.200 174.200 174.928 -0.728 25464
1622 1 5 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.529 -3.029 25464
1623 1 5 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.878 1.122 25464
1624 1 5 . 1 1 46 46 VAL H H 46 9.060 9.060 8.864 0.196 25464
1625 1 5 . 1 1 47 47 PHE N N 47 121.100 121.100 120.828 0.272 25464
1626 1 5 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.622 -0.172 25464
1627 1 5 . 1 1 47 47 PHE CA C 47 58.700 58.700 55.172 3.528 25464
1628 1 5 . 1 1 47 47 PHE CB C 47 41.700 41.700 40.816 0.884 25464
1629 1 5 . 1 1 47 47 PHE H H 47 7.680 7.680 8.238 -0.558 25464
1630 1 5 . 1 1 48 48 GLY N N 48 112.600 112.600 112.520 0.080 25464
1631 1 5 . 1 1 48 48 GLY C C 48 174.700 174.700 173.551 1.149 25464
1632 1 5 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.479 -2.479 25464
1633 1 5 . 1 1 48 48 GLY H H 48 7.380 7.380 8.528 -1.148 25464
1634 1 5 . 1 1 49 49 GLU N N 49 120.600 120.600 118.605 1.995 25464
1635 1 5 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.148 0.082 25464
1636 1 5 . 1 1 49 49 GLU C C 49 174.900 174.900 175.100 -0.200 25464
1637 1 5 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.020 -0.720 25464
1638 1 5 . 1 1 49 49 GLU CB C 49 31.200 31.200 27.518 3.682 25464
1639 1 5 . 1 1 49 49 GLU H H 49 8.510 8.510 8.435 0.075 25464
1640 1 5 . 1 1 50 50 ALA N N 50 126.600 126.600 128.576 -1.976 25464
1641 1 5 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.569 0.071 25464
1642 1 5 . 1 1 50 50 ALA C C 50 175.100 175.100 175.903 -0.803 25464
1643 1 5 . 1 1 50 50 ALA CA C 50 51.400 51.400 49.850 1.550 25464
1644 1 5 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.400 0.800 25464
1645 1 5 . 1 1 50 50 ALA H H 50 9.440 9.440 8.496 0.944 25464
1646 1 5 . 1 1 51 51 SER N N 51 115.100 115.100 115.006 0.094 25464
1647 1 5 . 1 1 51 51 SER HA H 51 4.740 4.740 4.421 0.319 25464
1648 1 5 . 1 1 51 51 SER C C 51 175.000 175.000 176.045 -1.045 25464
1649 1 5 . 1 1 51 51 SER CA C 51 58.100 58.100 58.228 -0.128 25464
1650 1 5 . 1 1 51 51 SER CB C 51 64.700 64.700 64.153 0.547 25464
1651 1 5 . 1 1 51 51 SER H H 51 8.950 8.950 8.631 0.319 25464
1652 1 5 . 1 1 52 52 ARG N N 52 123.500 123.500 125.032 -1.532 25464
1653 1 5 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.012 -0.602 25464
1654 1 5 . 1 1 52 52 ARG C C 52 178.200 178.200 177.771 0.429 25464
1655 1 5 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.587 1.413 25464
1656 1 5 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.774 0.126 25464
1657 1 5 . 1 1 52 52 ARG H H 52 9.540 9.540 8.190 1.350 25464
1658 1 5 . 1 1 53 53 ALA N N 53 118.000 118.000 119.506 -1.506 25464
1659 1 5 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.151 -0.121 25464
1660 1 5 . 1 1 53 53 ALA C C 53 181.000 181.000 179.865 1.135 25464
1661 1 5 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.229 0.071 25464
1662 1 5 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.852 0.247 25464
1663 1 5 . 1 1 53 53 ALA H H 53 8.770 8.770 8.663 0.107 25464
1664 1 5 . 1 1 54 54 SER N N 54 115.300 115.300 115.001 0.299 25464
1665 1 5 . 1 1 54 54 SER HA H 54 4.350 4.350 4.305 0.045 25464
1666 1 5 . 1 1 54 54 SER C C 54 177.500 177.500 176.997 0.503 25464
1667 1 5 . 1 1 54 54 SER CA C 54 61.900 61.900 62.454 -0.554 25464
1668 1 5 . 1 1 54 54 SER CB C 54 63.100 63.100 63.067 0.033 25464
1669 1 5 . 1 1 54 54 SER H H 54 8.140 8.140 7.919 0.221 25464
1670 1 5 . 1 1 55 55 CYS N N 55 121.900 121.900 120.868 1.032 25464
1671 1 5 . 1 1 55 55 CYS HA H 55 4.160 4.160 4.309 -0.148 25464
1672 1 5 . 1 1 55 55 CYS C C 55 176.300 176.300 176.859 -0.559 25464
1673 1 5 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.574 -0.274 25464
1674 1 5 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.887 0.113 25464
1675 1 5 . 1 1 55 55 CYS H H 55 8.430 8.430 8.359 0.071 25464
1676 1 5 . 1 1 56 56 VAL N N 56 121.100 121.100 120.614 0.486 25464
1677 1 5 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.624 -0.134 25464
1678 1 5 . 1 1 56 56 VAL C C 56 177.800 177.800 177.936 -0.136 25464
1679 1 5 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.546 -0.546 25464
1680 1 5 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.468 0.132 25464
1681 1 5 . 1 1 56 56 VAL H H 56 8.750 8.750 8.553 0.197 25464
1682 1 5 . 1 1 57 57 GLU N N 57 119.200 119.200 120.196 -0.996 25464
1683 1 5 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.946 0.124 25464
1684 1 5 . 1 1 57 57 GLU C C 57 177.900 177.900 178.601 -0.701 25464
1685 1 5 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.846 -0.546 25464
1686 1 5 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.820 -0.320 25464
1687 1 5 . 1 1 57 57 GLU H H 57 7.780 7.780 8.372 -0.592 25464
1688 1 5 . 1 1 58 58 TYR N N 58 119.400 119.400 120.762 -1.362 25464
1689 1 5 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.222 -0.332 25464
1690 1 5 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.169 0.031 25464
1691 1 5 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.751 -1.551 25464
1692 1 5 . 1 1 58 58 TYR H H 58 7.700 7.700 8.309 -0.609 25464
1693 1 5 . 1 1 59 59 VAL N N 59 121.500 121.500 119.543 1.957 25464
1694 1 5 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.643 -0.283 25464
1695 1 5 . 1 1 59 59 VAL C C 59 176.300 176.300 177.371 -1.071 25464
1696 1 5 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.877 0.523 25464
1697 1 5 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.785 -0.385 25464
1698 1 5 . 1 1 59 59 VAL H H 59 8.380 8.380 8.478 -0.098 25464
1699 1 5 . 1 1 60 60 ASP N N 60 120.000 120.000 117.770 2.230 25464
1700 1 5 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.327 0.083 25464
1701 1 5 . 1 1 60 60 ASP C C 60 178.300 178.300 179.598 -1.298 25464
1702 1 5 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.139 -0.039 25464
1703 1 5 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.988 -0.388 25464
1704 1 5 . 1 1 60 60 ASP H H 60 8.580 8.580 8.027 0.553 25464
1705 1 5 . 1 1 61 61 GLN N N 61 114.500 114.500 118.222 -3.722 25464
1706 1 5 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.019 -0.009 25464
1707 1 5 . 1 1 61 61 GLN C C 61 176.700 176.700 178.087 -1.387 25464
1708 1 5 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.285 -1.585 25464
1709 1 5 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.734 0.066 25464
1710 1 5 . 1 1 61 61 GLN H H 61 7.810 7.810 8.249 -0.439 25464
1711 1 5 . 1 1 62 62 HIS N N 62 115.100 115.100 114.900 0.200 25464
1712 1 5 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.603 -0.223 25464
1713 1 5 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.067 1.233 25464
1714 1 5 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.137 -0.137 25464
1715 1 5 . 1 1 62 62 HIS H H 62 7.730 7.730 7.658 0.072 25464
1716 1 5 . 1 1 63 63 TRP N N 63 121.500 121.500 120.943 0.557 25464
1717 1 5 . 1 1 63 63 TRP CA C 63 58.800 58.800 57.903 0.897 25464
1718 1 5 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.374 0.326 25464
1719 1 5 . 1 1 63 63 TRP H H 63 8.180 8.180 7.315 0.865 25464
1720 1 5 . 1 1 64 64 THR N N 64 114.900 114.900 113.250 1.650 25464
1721 1 5 . 1 1 64 64 THR HA H 64 4.180 4.180 4.132 0.048 25464
1722 1 5 . 1 1 64 64 THR CA C 64 62.100 62.100 64.035 -1.935 25464
1723 1 5 . 1 1 64 64 THR CB C 64 69.500 69.500 68.947 0.553 25464
1724 1 5 . 1 1 64 64 THR H H 64 7.940 7.940 7.803 0.137 25464
1725 1 5 . 1 1 65 65 ASP N N 65 122.900 122.900 122.202 0.698 25464
1726 1 5 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.673 0.727 25464
1727 1 5 . 1 1 65 65 ASP CB C 65 41.100 41.100 43.508 -2.408 25464
1728 1 5 . 1 1 65 65 ASP H H 65 8.340 8.340 8.409 -0.069 25464
1729 1 5 . 1 1 66 66 ILE N N 66 122.200 122.200 119.851 2.349 25464
1730 1 5 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.352 -0.192 25464
1731 1 5 . 1 1 66 66 ILE CA C 66 61.100 61.100 59.964 1.136 25464
1732 1 5 . 1 1 66 66 ILE CB C 66 38.500 38.500 41.589 -3.089 25464
1733 1 5 . 1 1 66 66 ILE H H 66 8.250 8.250 8.335 -0.085 25464
1734 1 5 . 1 1 67 67 ARG N N 67 124.000 124.000 124.414 -0.414 25464
1735 1 5 . 1 1 67 67 ARG CA C 67 53.900 53.900 56.469 -2.569 25464
1736 1 5 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.607 1.393 25464
1737 1 5 . 1 1 67 67 ARG H H 67 8.490 8.490 8.134 0.356 25464
1738 1 5 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.460 -0.020 25464
1739 1 5 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.352 0.748 25464
1740 1 5 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.077 0.023 25464
1741 1 5 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.177 0.153 25464
1742 1 5 . 1 1 69 69 LYS C C 69 175.900 175.900 176.632 -0.732 25464
1743 1 5 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.054 0.245 25464
1744 1 5 . 1 1 69 69 LYS CB C 69 33.000 33.000 31.500 1.500 25464
1745 1 5 . 1 1 69 69 LYS H H 69 8.270 8.270 8.354 -0.084 25464
1746 1 5 . 1 1 70 70 SER N N 70 122.300 122.300 120.691 1.609 25464
1747 1 5 . 1 1 70 70 SER HA H 70 4.580 4.580 4.374 0.206 25464
1748 1 5 . 1 1 70 70 SER CA C 70 59.900 59.900 58.605 1.295 25464
1749 1 5 . 1 1 70 70 SER CB C 70 65.100 65.100 63.587 1.513 25464
1750 1 5 . 1 1 70 70 SER H H 70 8.140 8.140 8.265 -0.125 25464
1751 1 5 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.677 -0.357 25464
1752 1 5 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.716 0.684 25464
1753 1 5 . 1 1 75 75 LEU CB C 75 42.100 42.100 44.353 -2.253 25464
1754 1 5 . 1 1 76 76 ALA N N 76 124.000 124.000 126.580 -2.580 25464
1755 1 5 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.673 -0.343 25464
1756 1 5 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.376 1.324 25464
1757 1 5 . 1 1 76 76 ALA CB C 76 19.000 19.000 20.291 -1.291 25464
1758 1 5 . 1 1 76 76 ALA H H 76 8.200 8.200 8.068 0.132 25464
1759 1 5 . 1 1 77 77 SER N N 77 114.100 114.100 113.885 0.215 25464
1760 1 5 . 1 1 77 77 SER HA H 77 4.450 4.450 4.418 0.032 25464
1761 1 5 . 1 1 77 77 SER CA C 77 58.200 58.200 58.262 -0.062 25464
1762 1 5 . 1 1 77 77 SER CB C 77 63.900 63.900 63.857 0.043 25464
1763 1 5 . 1 1 77 77 SER H H 77 8.210 8.210 8.340 -0.130 25464
1764 1 5 . 1 1 78 78 GLY N N 78 110.500 110.500 109.981 0.519 25464
1765 1 5 . 1 1 78 78 GLY CA C 78 45.400 45.400 46.115 -0.715 25464
1766 1 5 . 1 1 78 78 GLY H H 78 8.390 8.390 8.147 0.243 25464
1767 1 5 . 1 1 79 79 GLN N N 79 119.600 119.600 121.998 -2.398 25464
1768 1 5 . 1 1 79 79 GLN CA C 79 55.600 55.600 54.505 1.095 25464
1769 1 5 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.203 -0.603 25464
1770 1 5 . 1 1 79 79 GLN H H 79 8.250 8.250 7.988 0.262 25464
1771 1 6 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.386 0.074 25464
1772 1 6 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.881 0.519 25464
1773 1 6 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.343 0.757 25464
1774 1 6 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.234 -0.134 25464
1775 1 6 . 1 1 10 10 ASP N N 10 121.500 121.500 123.989 -2.489 25464
1776 1 6 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.652 -0.052 25464
1777 1 6 . 1 1 10 10 ASP C C 10 175.300 175.300 174.998 0.302 25464
1778 1 6 . 1 1 10 10 ASP CA C 10 54.500 54.500 53.673 0.827 25464
1779 1 6 . 1 1 10 10 ASP CB C 10 40.900 40.900 42.105 -1.205 25464
1780 1 6 . 1 1 10 10 ASP H H 10 8.420 8.420 8.629 -0.209 25464
1781 1 6 . 1 1 11 11 ASN N N 11 118.400 118.400 118.322 0.078 25464
1782 1 6 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.878 0.072 25464
1783 1 6 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.881 -1.081 25464
1784 1 6 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.058 1.042 25464
1785 1 6 . 1 1 11 11 ASN H H 11 8.270 8.270 8.530 -0.260 25464
1786 1 6 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.319 0.061 25464
1787 1 6 . 1 1 12 12 PRO C C 12 177.100 177.100 175.781 1.319 25464
1788 1 6 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.021 -0.321 25464
1789 1 6 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.749 0.151 25464
1790 1 6 . 1 1 13 13 PHE N N 13 117.500 117.500 110.834 6.666 25464
1791 1 6 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.466 0.034 25464
1792 1 6 . 1 1 13 13 PHE C C 13 175.700 175.700 174.358 1.342 25464
1793 1 6 . 1 1 13 13 PHE CA C 13 58.300 58.300 55.130 3.170 25464
1794 1 6 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.276 0.424 25464
1795 1 6 . 1 1 13 13 PHE H H 13 8.120 8.120 7.215 0.905 25464
1796 1 6 . 1 1 14 14 ASP N N 14 120.000 120.000 121.082 -1.082 25464
1797 1 6 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.369 0.251 25464
1798 1 6 . 1 1 14 14 ASP C C 14 175.800 175.800 176.568 -0.768 25464
1799 1 6 . 1 1 14 14 ASP CA C 14 54.400 54.400 55.333 -0.933 25464
1800 1 6 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.653 -0.253 25464
1801 1 6 . 1 1 14 14 ASP H H 14 8.010 8.010 7.179 0.831 25464
1802 1 6 . 1 1 15 15 ASP N N 15 119.900 119.900 122.141 -2.241 25464
1803 1 6 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.521 0.089 25464
1804 1 6 . 1 1 15 15 ASP C C 15 176.700 176.700 177.273 -0.573 25464
1805 1 6 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.375 -0.875 25464
1806 1 6 . 1 1 15 15 ASP CB C 15 41.200 41.200 40.346 0.854 25464
1807 1 6 . 1 1 15 15 ASP H H 15 7.900 7.900 7.672 0.228 25464
1808 1 6 . 1 1 16 16 GLU N N 16 122.700 122.700 124.036 -1.336 25464
1809 1 6 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.204 0.026 25464
1810 1 6 . 1 1 16 16 GLU C C 16 176.600 176.600 177.220 -0.620 25464
1811 1 6 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.347 -0.947 25464
1812 1 6 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.704 0.396 25464
1813 1 6 . 1 1 16 16 GLU H H 16 8.610 8.610 8.574 0.036 25464
1814 1 6 . 1 1 17 17 ASP N N 17 119.500 119.500 117.070 2.430 25464
1815 1 6 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.485 0.365 25464
1816 1 6 . 1 1 17 17 ASP C C 17 176.300 176.300 177.440 -1.140 25464
1817 1 6 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.518 -1.218 25464
1818 1 6 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.662 0.938 25464
1819 1 6 . 1 1 17 17 ASP H H 17 8.490 8.490 8.287 0.203 25464
1820 1 6 . 1 1 18 18 GLY N N 18 107.700 107.700 107.725 -0.025 25464
1821 1 6 . 1 1 18 18 GLY C C 18 172.700 172.700 172.509 0.191 25464
1822 1 6 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.279 0.621 25464
1823 1 6 . 1 1 18 18 GLY H H 18 8.070 8.070 7.624 0.446 25464
1824 1 6 . 1 1 19 19 MET N N 19 117.400 117.400 118.312 -0.912 25464
1825 1 6 . 1 1 19 19 MET HA H 19 4.890 4.890 4.695 0.195 25464
1826 1 6 . 1 1 19 19 MET C C 19 176.000 176.000 174.584 1.416 25464
1827 1 6 . 1 1 19 19 MET CA C 19 53.700 53.700 54.700 -1.000 25464
1828 1 6 . 1 1 19 19 MET CB C 19 35.100 35.100 34.729 0.371 25464
1829 1 6 . 1 1 19 19 MET H H 19 7.820 7.820 8.220 -0.400 25464
1830 1 6 . 1 1 20 20 PHE N N 20 120.100 120.100 118.903 1.197 25464
1831 1 6 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.610 0.400 25464
1832 1 6 . 1 1 20 20 PHE C C 20 174.200 174.200 174.777 -0.577 25464
1833 1 6 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.219 2.181 25464
1834 1 6 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.102 3.698 25464
1835 1 6 . 1 1 20 20 PHE H H 20 9.370 9.370 8.602 0.768 25464
1836 1 6 . 1 1 21 21 PHE N N 21 115.200 115.200 116.110 -0.910 25464
1837 1 6 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.336 0.294 25464
1838 1 6 . 1 1 21 21 PHE C C 21 177.500 177.500 174.883 2.617 25464
1839 1 6 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.432 0.068 25464
1840 1 6 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.521 3.579 25464
1841 1 6 . 1 1 21 21 PHE H H 21 9.600 9.600 8.457 1.143 25464
1842 1 6 . 1 1 22 22 VAL N N 22 116.600 116.600 121.026 -4.426 25464
1843 1 6 . 1 1 22 22 VAL C C 22 175.000 175.000 175.369 -0.369 25464
1844 1 6 . 1 1 22 22 VAL CA C 22 62.700 62.700 62.215 0.485 25464
1845 1 6 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.191 0.609 25464
1846 1 6 . 1 1 22 22 VAL H H 22 8.750 8.750 8.662 0.088 25464
1847 1 6 . 1 1 23 23 LEU N N 23 126.500 126.500 127.849 -1.349 25464
1848 1 6 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.555 0.085 25464
1849 1 6 . 1 1 23 23 LEU C C 23 176.200 176.200 175.833 0.367 25464
1850 1 6 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.540 -1.740 25464
1851 1 6 . 1 1 23 23 LEU CB C 23 46.700 46.700 46.098 0.602 25464
1852 1 6 . 1 1 23 23 LEU H H 23 9.530 9.530 8.921 0.609 25464
1853 1 6 . 1 1 24 24 ILE N N 24 117.700 117.700 119.151 -1.451 25464
1854 1 6 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.440 0.250 25464
1855 1 6 . 1 1 24 24 ILE C C 24 174.300 174.300 173.410 0.890 25464
1856 1 6 . 1 1 24 24 ILE CA C 24 58.900 58.900 58.790 0.110 25464
1857 1 6 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.638 0.962 25464
1858 1 6 . 1 1 24 24 ILE H H 24 9.300 9.300 9.045 0.255 25464
1859 1 6 . 1 1 25 25 ASN N N 25 122.500 122.500 124.945 -2.445 25464
1860 1 6 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.917 -0.217 25464
1861 1 6 . 1 1 25 25 ASN C C 25 177.700 177.700 176.035 1.665 25464
1862 1 6 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.036 -1.336 25464
1863 1 6 . 1 1 25 25 ASN CB C 25 37.600 37.600 39.994 -2.394 25464
1864 1 6 . 1 1 25 25 ASN H H 25 7.300 7.300 8.388 -1.088 25464
1865 1 6 . 1 1 26 26 ASP N N 26 118.100 118.100 123.510 -5.410 25464
1866 1 6 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.283 0.077 25464
1867 1 6 . 1 1 26 26 ASP C C 26 176.700 176.700 177.306 -0.606 25464
1868 1 6 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.828 -0.328 25464
1869 1 6 . 1 1 26 26 ASP CB C 26 39.900 39.900 41.011 -1.111 25464
1870 1 6 . 1 1 26 26 ASP H H 26 8.340 8.340 8.763 -0.423 25464
1871 1 6 . 1 1 27 27 GLU N N 27 117.600 117.600 119.346 -1.746 25464
1872 1 6 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.259 0.281 25464
1873 1 6 . 1 1 27 27 GLU C C 27 175.100 175.100 175.630 -0.530 25464
1874 1 6 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.489 0.212 25464
1875 1 6 . 1 1 27 27 GLU CB C 27 29.500 29.500 27.837 1.663 25464
1876 1 6 . 1 1 27 27 GLU H H 27 7.190 7.190 7.866 -0.676 25464
1877 1 6 . 1 1 28 28 GLU N N 28 112.800 112.800 114.188 -1.388 25464
1878 1 6 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.901 -0.311 25464
1879 1 6 . 1 1 28 28 GLU C C 28 175.200 175.200 175.482 -0.282 25464
1880 1 6 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.422 0.378 25464
1881 1 6 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.268 -0.768 25464
1882 1 6 . 1 1 28 28 GLU H H 28 8.050 8.050 7.972 0.078 25464
1883 1 6 . 1 1 29 29 GLN N N 29 117.200 117.200 118.086 -0.886 25464
1884 1 6 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.104 0.176 25464
1885 1 6 . 1 1 29 29 GLN C C 29 174.600 174.600 175.141 -0.541 25464
1886 1 6 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.532 -0.632 25464
1887 1 6 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.062 0.238 25464
1888 1 6 . 1 1 29 29 GLN H H 29 7.840 7.840 7.538 0.302 25464
1889 1 6 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.926 0.134 25464
1890 1 6 . 1 1 30 30 HIS C C 30 175.900 175.900 174.852 1.048 25464
1891 1 6 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.719 0.981 25464
1892 1 6 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.308 1.592 25464
1893 1 6 . 1 1 31 31 SER N N 31 113.100 113.100 117.184 -4.084 25464
1894 1 6 . 1 1 31 31 SER HA H 31 4.740 4.740 4.829 -0.088 25464
1895 1 6 . 1 1 31 31 SER C C 31 173.200 173.200 172.006 1.194 25464
1896 1 6 . 1 1 31 31 SER CA C 31 57.400 57.400 57.957 -0.557 25464
1897 1 6 . 1 1 31 31 SER CB C 31 66.600 66.600 64.494 2.106 25464
1898 1 6 . 1 1 31 31 SER H H 31 8.850 8.850 8.910 -0.060 25464
1899 1 6 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.112 0.248 25464
1900 1 6 . 1 1 32 32 LEU C C 32 178.200 178.200 174.979 3.221 25464
1901 1 6 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.686 1.314 25464
1902 1 6 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.096 -1.397 25464
1903 1 6 . 1 1 33 33 TRP N N 33 123.400 123.400 129.243 -5.843 25464
1904 1 6 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.950 0.350 25464
1905 1 6 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.384 -0.284 25464
1906 1 6 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.399 2.101 25464
1907 1 6 . 1 1 33 33 TRP H H 33 9.170 9.170 9.231 -0.061 25464
1908 1 6 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.609 -0.799 25464
1909 1 6 . 1 1 34 34 PRO C C 34 177.400 177.400 177.602 -0.202 25464
1910 1 6 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.285 -0.485 25464
1911 1 6 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.472 -1.472 25464
1912 1 6 . 1 1 35 35 THR N N 35 107.700 107.700 115.517 -7.817 25464
1913 1 6 . 1 1 35 35 THR HA H 35 3.730 3.730 4.301 -0.571 25464
1914 1 6 . 1 1 35 35 THR C C 35 176.100 176.100 175.158 0.942 25464
1915 1 6 . 1 1 35 35 THR CA C 35 63.600 63.600 65.171 -1.571 25464
1916 1 6 . 1 1 35 35 THR CB C 35 68.200 68.200 68.209 -0.009 25464
1917 1 6 . 1 1 35 35 THR H H 35 7.260 7.260 8.103 -0.843 25464
1918 1 6 . 1 1 36 36 PHE N N 36 114.500 114.500 118.161 -3.661 25464
1919 1 6 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.638 -0.128 25464
1920 1 6 . 1 1 36 36 PHE C C 36 174.500 174.500 174.944 -0.444 25464
1921 1 6 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.252 -0.352 25464
1922 1 6 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.596 -0.997 25464
1923 1 6 . 1 1 36 36 PHE H H 36 6.770 6.770 7.538 -0.768 25464
1924 1 6 . 1 1 37 37 ALA N N 37 125.300 125.300 121.656 3.644 25464
1925 1 6 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.627 0.083 25464
1926 1 6 . 1 1 37 37 ALA C C 37 177.300 177.300 175.772 1.528 25464
1927 1 6 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.127 -0.927 25464
1928 1 6 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.300 -0.900 25464
1929 1 6 . 1 1 37 37 ALA H H 37 6.950 6.950 7.441 -0.491 25464
1930 1 6 . 1 1 38 38 ASP N N 38 124.500 124.500 121.449 3.051 25464
1931 1 6 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.824 -0.344 25464
1932 1 6 . 1 1 38 38 ASP C C 38 176.700 176.700 176.102 0.598 25464
1933 1 6 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.983 1.017 25464
1934 1 6 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.278 -1.878 25464
1935 1 6 . 1 1 38 38 ASP H H 38 8.870 8.870 8.666 0.204 25464
1936 1 6 . 1 1 39 39 VAL N N 39 126.000 126.000 123.692 2.308 25464
1937 1 6 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.629 -0.269 25464
1938 1 6 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.416 0.684 25464
1939 1 6 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.225 0.975 25464
1940 1 6 . 1 1 39 39 VAL H H 39 8.650 8.650 8.447 0.203 25464
1941 1 6 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.386 -0.136 25464
1942 1 6 . 1 1 40 40 PRO C C 40 175.800 175.800 176.054 -0.254 25464
1943 1 6 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.492 -0.292 25464
1944 1 6 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.796 -0.096 25464
1945 1 6 . 1 1 41 41 ALA N N 41 122.700 122.700 126.418 -3.718 25464
1946 1 6 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.052 0.128 25464
1947 1 6 . 1 1 41 41 ALA C C 41 179.000 179.000 178.748 0.252 25464
1948 1 6 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.516 -0.215 25464
1949 1 6 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.909 -0.609 25464
1950 1 6 . 1 1 41 41 ALA H H 41 8.280 8.280 8.476 -0.196 25464
1951 1 6 . 1 1 42 42 GLY N N 42 109.800 109.800 111.759 -1.959 25464
1952 1 6 . 1 1 42 42 GLY C C 42 173.800 173.800 173.536 0.264 25464
1953 1 6 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.911 -0.211 25464
1954 1 6 . 1 1 42 42 GLY H H 42 8.770 8.770 8.338 0.432 25464
1955 1 6 . 1 1 43 43 TRP N N 43 120.300 120.300 121.637 -1.337 25464
1956 1 6 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.312 -0.362 25464
1957 1 6 . 1 1 43 43 TRP C C 43 174.900 174.900 175.790 -0.890 25464
1958 1 6 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.106 -0.406 25464
1959 1 6 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.746 1.254 25464
1960 1 6 . 1 1 43 43 TRP H H 43 7.740 7.740 7.941 -0.201 25464
1961 1 6 . 1 1 44 44 ARG N N 44 117.700 117.700 122.898 -5.198 25464
1962 1 6 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.759 -0.039 25464
1963 1 6 . 1 1 44 44 ARG C C 44 174.900 174.900 175.072 -0.172 25464
1964 1 6 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.691 -0.791 25464
1965 1 6 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.840 0.360 25464
1966 1 6 . 1 1 44 44 ARG H H 44 8.990 8.990 8.962 0.028 25464
1967 1 6 . 1 1 45 45 VAL N N 45 122.800 122.800 124.836 -2.036 25464
1968 1 6 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.235 -0.255 25464
1969 1 6 . 1 1 45 45 VAL C C 45 177.600 177.600 176.677 0.923 25464
1970 1 6 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.198 0.502 25464
1971 1 6 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.805 1.295 25464
1972 1 6 . 1 1 45 45 VAL H H 45 8.720 8.720 8.601 0.119 25464
1973 1 6 . 1 1 46 46 VAL N N 46 120.400 120.400 125.925 -5.525 25464
1974 1 6 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.119 0.561 25464
1975 1 6 . 1 1 46 46 VAL C C 46 174.200 174.200 175.058 -0.858 25464
1976 1 6 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.960 -2.460 25464
1977 1 6 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.872 1.128 25464
1978 1 6 . 1 1 46 46 VAL H H 46 9.060 9.060 8.721 0.339 25464
1979 1 6 . 1 1 47 47 PHE N N 47 121.100 121.100 121.909 -0.809 25464
1980 1 6 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.639 -0.189 25464
1981 1 6 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.468 2.232 25464
1982 1 6 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.783 -0.083 25464
1983 1 6 . 1 1 47 47 PHE H H 47 7.680 7.680 8.185 -0.505 25464
1984 1 6 . 1 1 48 48 GLY N N 48 112.600 112.600 113.016 -0.416 25464
1985 1 6 . 1 1 48 48 GLY C C 48 174.700 174.700 173.931 0.769 25464
1986 1 6 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.659 -2.659 25464
1987 1 6 . 1 1 48 48 GLY H H 48 7.380 7.380 8.302 -0.922 25464
1988 1 6 . 1 1 49 49 GLU N N 49 120.600 120.600 119.658 0.942 25464
1989 1 6 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.343 -0.113 25464
1990 1 6 . 1 1 49 49 GLU C C 49 174.900 174.900 175.578 -0.678 25464
1991 1 6 . 1 1 49 49 GLU CA C 49 56.300 56.300 58.186 -1.886 25464
1992 1 6 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.281 2.919 25464
1993 1 6 . 1 1 49 49 GLU H H 49 8.510 8.510 8.650 -0.140 25464
1994 1 6 . 1 1 50 50 ALA N N 50 126.600 126.600 127.625 -1.025 25464
1995 1 6 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.800 -0.160 25464
1996 1 6 . 1 1 50 50 ALA C C 50 175.100 175.100 175.428 -0.328 25464
1997 1 6 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.093 1.307 25464
1998 1 6 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.832 0.367 25464
1999 1 6 . 1 1 50 50 ALA H H 50 9.440 9.440 8.717 0.723 25464
2000 1 6 . 1 1 51 51 SER N N 51 115.100 115.100 114.446 0.654 25464
2001 1 6 . 1 1 51 51 SER HA H 51 4.740 4.740 4.194 0.546 25464
2002 1 6 . 1 1 51 51 SER C C 51 175.000 175.000 176.121 -1.121 25464
2003 1 6 . 1 1 51 51 SER CA C 51 58.100 58.100 57.847 0.253 25464
2004 1 6 . 1 1 51 51 SER CB C 51 64.700 64.700 64.072 0.628 25464
2005 1 6 . 1 1 51 51 SER H H 51 8.950 8.950 8.644 0.306 25464
2006 1 6 . 1 1 52 52 ARG N N 52 123.500 123.500 127.493 -3.993 25464
2007 1 6 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.970 -0.560 25464
2008 1 6 . 1 1 52 52 ARG C C 52 178.200 178.200 177.585 0.615 25464
2009 1 6 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.531 1.469 25464
2010 1 6 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.895 0.005 25464
2011 1 6 . 1 1 52 52 ARG H H 52 9.540 9.540 8.912 0.628 25464
2012 1 6 . 1 1 53 53 ALA N N 53 118.000 118.000 120.373 -2.373 25464
2013 1 6 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.021 0.009 25464
2014 1 6 . 1 1 53 53 ALA C C 53 181.000 181.000 179.478 1.522 25464
2015 1 6 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.398 -0.098 25464
2016 1 6 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.724 0.376 25464
2017 1 6 . 1 1 53 53 ALA H H 53 8.770 8.770 8.333 0.437 25464
2018 1 6 . 1 1 54 54 SER N N 54 115.300 115.300 115.353 -0.053 25464
2019 1 6 . 1 1 54 54 SER HA H 54 4.350 4.350 4.176 0.174 25464
2020 1 6 . 1 1 54 54 SER C C 54 177.500 177.500 176.565 0.935 25464
2021 1 6 . 1 1 54 54 SER CA C 54 61.900 61.900 61.677 0.223 25464
2022 1 6 . 1 1 54 54 SER CB C 54 63.100 63.100 62.191 0.909 25464
2023 1 6 . 1 1 54 54 SER H H 54 8.140 8.140 7.701 0.439 25464
2024 1 6 . 1 1 55 55 CYS N N 55 121.900 121.900 120.826 1.074 25464
2025 1 6 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.726 0.434 25464
2026 1 6 . 1 1 55 55 CYS C C 55 176.300 176.300 176.764 -0.464 25464
2027 1 6 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.322 -0.022 25464
2028 1 6 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.907 0.093 25464
2029 1 6 . 1 1 55 55 CYS H H 55 8.430 8.430 8.044 0.386 25464
2030 1 6 . 1 1 56 56 VAL N N 56 121.100 121.100 120.104 0.996 25464
2031 1 6 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.577 -0.087 25464
2032 1 6 . 1 1 56 56 VAL C C 56 177.800 177.800 177.965 -0.165 25464
2033 1 6 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.038 -0.038 25464
2034 1 6 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.556 0.044 25464
2035 1 6 . 1 1 56 56 VAL H H 56 8.750 8.750 8.599 0.151 25464
2036 1 6 . 1 1 57 57 GLU N N 57 119.200 119.200 120.731 -1.531 25464
2037 1 6 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.983 0.087 25464
2038 1 6 . 1 1 57 57 GLU C C 57 177.900 177.900 178.578 -0.678 25464
2039 1 6 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.781 -0.481 25464
2040 1 6 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.592 -0.092 25464
2041 1 6 . 1 1 57 57 GLU H H 57 7.780 7.780 8.174 -0.394 25464
2042 1 6 . 1 1 58 58 TYR N N 58 119.400 119.400 120.742 -1.342 25464
2043 1 6 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.235 -0.345 25464
2044 1 6 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.043 0.157 25464
2045 1 6 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.728 -1.528 25464
2046 1 6 . 1 1 58 58 TYR H H 58 7.700 7.700 8.243 -0.543 25464
2047 1 6 . 1 1 59 59 VAL N N 59 121.500 121.500 118.821 2.679 25464
2048 1 6 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.525 -0.165 25464
2049 1 6 . 1 1 59 59 VAL C C 59 176.300 176.300 177.726 -1.426 25464
2050 1 6 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.645 0.755 25464
2051 1 6 . 1 1 59 59 VAL CB C 59 31.400 31.400 30.924 0.476 25464
2052 1 6 . 1 1 59 59 VAL H H 59 8.380 8.380 8.085 0.295 25464
2053 1 6 . 1 1 60 60 ASP N N 60 120.000 120.000 118.650 1.350 25464
2054 1 6 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.447 -0.037 25464
2055 1 6 . 1 1 60 60 ASP C C 60 178.300 178.300 179.631 -1.331 25464
2056 1 6 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.625 -0.525 25464
2057 1 6 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.976 -0.376 25464
2058 1 6 . 1 1 60 60 ASP H H 60 8.580 8.580 8.158 0.422 25464
2059 1 6 . 1 1 61 61 GLN N N 61 114.500 114.500 118.458 -3.958 25464
2060 1 6 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.128 -0.118 25464
2061 1 6 . 1 1 61 61 GLN C C 61 176.700 176.700 178.165 -1.465 25464
2062 1 6 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.978 -1.278 25464
2063 1 6 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.842 -0.042 25464
2064 1 6 . 1 1 61 61 GLN H H 61 7.810 7.810 8.135 -0.325 25464
2065 1 6 . 1 1 62 62 HIS N N 62 115.100 115.100 116.688 -1.588 25464
2066 1 6 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.815 -0.435 25464
2067 1 6 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.200 2.100 25464
2068 1 6 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.012 -0.012 25464
2069 1 6 . 1 1 62 62 HIS H H 62 7.730 7.730 8.028 -0.298 25464
2070 1 6 . 1 1 63 63 TRP N N 63 121.500 121.500 122.964 -1.464 25464
2071 1 6 . 1 1 63 63 TRP CA C 63 58.800 58.800 62.201 -3.401 25464
2072 1 6 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.480 0.220 25464
2073 1 6 . 1 1 63 63 TRP H H 63 8.180 8.180 7.395 0.785 25464
2074 1 6 . 1 1 64 64 THR N N 64 114.900 114.900 109.711 5.189 25464
2075 1 6 . 1 1 64 64 THR HA H 64 4.180 4.180 4.166 0.014 25464
2076 1 6 . 1 1 64 64 THR CA C 64 62.100 62.100 63.974 -1.874 25464
2077 1 6 . 1 1 64 64 THR CB C 64 69.500 69.500 68.678 0.822 25464
2078 1 6 . 1 1 64 64 THR H H 64 7.940 7.940 8.164 -0.224 25464
2079 1 6 . 1 1 65 65 ASP N N 65 122.900 122.900 124.191 -1.291 25464
2080 1 6 . 1 1 65 65 ASP CA C 65 54.400 54.400 55.815 -1.415 25464
2081 1 6 . 1 1 65 65 ASP CB C 65 41.100 41.100 39.427 1.673 25464
2082 1 6 . 1 1 65 65 ASP H H 65 8.340 8.340 7.842 0.498 25464
2083 1 6 . 1 1 66 66 ILE N N 66 122.200 122.200 120.583 1.617 25464
2084 1 6 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.410 -0.250 25464
2085 1 6 . 1 1 66 66 ILE CA C 66 61.100 61.100 59.974 1.126 25464
2086 1 6 . 1 1 66 66 ILE CB C 66 38.500 38.500 40.926 -2.426 25464
2087 1 6 . 1 1 66 66 ILE H H 66 8.250 8.250 7.994 0.256 25464
2088 1 6 . 1 1 67 67 ARG N N 67 124.000 124.000 128.586 -4.586 25464
2089 1 6 . 1 1 67 67 ARG CA C 67 53.900 53.900 58.858 -4.958 25464
2090 1 6 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.757 1.243 25464
2091 1 6 . 1 1 67 67 ARG H H 67 8.490 8.490 8.217 0.273 25464
2092 1 6 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.485 -0.045 25464
2093 1 6 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.742 0.358 25464
2094 1 6 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.295 -0.195 25464
2095 1 6 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.635 -0.305 25464
2096 1 6 . 1 1 69 69 LYS C C 69 175.900 175.900 175.831 0.069 25464
2097 1 6 . 1 1 69 69 LYS CA C 69 56.300 56.300 55.439 0.861 25464
2098 1 6 . 1 1 69 69 LYS CB C 69 33.000 33.000 34.574 -1.574 25464
2099 1 6 . 1 1 69 69 LYS H H 69 8.270 8.270 8.271 -0.001 25464
2100 1 6 . 1 1 70 70 SER N N 70 122.300 122.300 117.001 5.299 25464
2101 1 6 . 1 1 70 70 SER HA H 70 4.580 4.580 4.548 0.032 25464
2102 1 6 . 1 1 70 70 SER CA C 70 59.900 59.900 57.581 2.319 25464
2103 1 6 . 1 1 70 70 SER CB C 70 65.100 65.100 64.549 0.551 25464
2104 1 6 . 1 1 70 70 SER H H 70 8.140 8.140 8.457 -0.317 25464
2105 1 6 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.201 0.119 25464
2106 1 6 . 1 1 75 75 LEU CA C 75 55.400 55.400 56.044 -0.644 25464
2107 1 6 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.194 -0.094 25464
2108 1 6 . 1 1 76 76 ALA N N 76 124.000 124.000 121.489 2.511 25464
2109 1 6 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.428 -0.098 25464
2110 1 6 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.117 1.583 25464
2111 1 6 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.941 -0.941 25464
2112 1 6 . 1 1 76 76 ALA H H 76 8.200 8.200 7.465 0.735 25464
2113 1 6 . 1 1 77 77 SER N N 77 114.100 114.100 119.343 -5.243 25464
2114 1 6 . 1 1 77 77 SER HA H 77 4.450 4.450 4.421 0.029 25464
2115 1 6 . 1 1 77 77 SER CA C 77 58.200 58.200 58.597 -0.397 25464
2116 1 6 . 1 1 77 77 SER CB C 77 63.900 63.900 62.927 0.973 25464
2117 1 6 . 1 1 77 77 SER H H 77 8.210 8.210 8.704 -0.494 25464
2118 1 6 . 1 1 78 78 GLY N N 78 110.500 110.500 115.309 -4.809 25464
2119 1 6 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.804 0.596 25464
2120 1 6 . 1 1 78 78 GLY H H 78 8.390 8.390 8.310 0.080 25464
2121 1 6 . 1 1 79 79 GLN N N 79 119.600 119.600 120.990 -1.390 25464
2122 1 6 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.945 -0.345 25464
2123 1 6 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.411 0.189 25464
2124 1 6 . 1 1 79 79 GLN H H 79 8.250 8.250 8.323 -0.073 25464
2125 1 7 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.523 -0.063 25464
2126 1 7 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.706 0.694 25464
2127 1 7 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.560 -0.460 25464
2128 1 7 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.770 0.330 25464
2129 1 7 . 1 1 10 10 ASP N N 10 121.500 121.500 123.290 -1.790 25464
2130 1 7 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.641 -0.041 25464
2131 1 7 . 1 1 10 10 ASP C C 10 175.300 175.300 173.978 1.322 25464
2132 1 7 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.165 0.335 25464
2133 1 7 . 1 1 10 10 ASP CB C 10 40.900 40.900 43.341 -2.441 25464
2134 1 7 . 1 1 10 10 ASP H H 10 8.420 8.420 7.847 0.573 25464
2135 1 7 . 1 1 11 11 ASN N N 11 118.400 118.400 123.375 -4.975 25464
2136 1 7 . 1 1 11 11 ASN HA H 11 4.950 4.950 5.025 -0.075 25464
2137 1 7 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.527 0.273 25464
2138 1 7 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.863 0.237 25464
2139 1 7 . 1 1 11 11 ASN H H 11 8.270 8.270 8.541 -0.271 25464
2140 1 7 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.190 0.190 25464
2141 1 7 . 1 1 12 12 PRO C C 12 177.100 177.100 176.029 1.071 25464
2142 1 7 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.016 -0.316 25464
2143 1 7 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.677 0.223 25464
2144 1 7 . 1 1 13 13 PHE N N 13 117.500 117.500 115.320 2.180 25464
2145 1 7 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.809 -0.309 25464
2146 1 7 . 1 1 13 13 PHE C C 13 175.700 175.700 174.511 1.189 25464
2147 1 7 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.736 1.563 25464
2148 1 7 . 1 1 13 13 PHE CB C 13 38.700 38.700 39.731 -1.031 25464
2149 1 7 . 1 1 13 13 PHE H H 13 8.120 8.120 7.800 0.320 25464
2150 1 7 . 1 1 14 14 ASP N N 14 120.000 120.000 118.917 1.083 25464
2151 1 7 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.692 -0.072 25464
2152 1 7 . 1 1 14 14 ASP C C 14 175.800 175.800 176.068 -0.268 25464
2153 1 7 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.237 0.163 25464
2154 1 7 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.734 0.666 25464
2155 1 7 . 1 1 14 14 ASP H H 14 8.010 8.010 8.146 -0.136 25464
2156 1 7 . 1 1 15 15 ASP N N 15 119.900 119.900 118.188 1.712 25464
2157 1 7 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.560 0.050 25464
2158 1 7 . 1 1 15 15 ASP C C 15 176.700 176.700 176.407 0.293 25464
2159 1 7 . 1 1 15 15 ASP CA C 15 54.500 54.500 53.974 0.526 25464
2160 1 7 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.253 -1.053 25464
2161 1 7 . 1 1 15 15 ASP H H 15 7.900 7.900 7.990 -0.090 25464
2162 1 7 . 1 1 16 16 GLU N N 16 122.700 122.700 116.727 5.973 25464
2163 1 7 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.425 -0.195 25464
2164 1 7 . 1 1 16 16 GLU C C 16 176.600 176.600 176.711 -0.111 25464
2165 1 7 . 1 1 16 16 GLU CA C 16 57.400 57.400 57.019 0.381 25464
2166 1 7 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.454 -0.354 25464
2167 1 7 . 1 1 16 16 GLU H H 16 8.610 8.610 8.613 -0.003 25464
2168 1 7 . 1 1 17 17 ASP N N 17 119.500 119.500 121.601 -2.101 25464
2169 1 7 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.499 0.351 25464
2170 1 7 . 1 1 17 17 ASP C C 17 176.300 176.300 176.893 -0.593 25464
2171 1 7 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.525 -1.225 25464
2172 1 7 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.388 0.212 25464
2173 1 7 . 1 1 17 17 ASP H H 17 8.490 8.490 8.517 -0.027 25464
2174 1 7 . 1 1 18 18 GLY N N 18 107.700 107.700 107.623 0.077 25464
2175 1 7 . 1 1 18 18 GLY C C 18 172.700 172.700 173.072 -0.372 25464
2176 1 7 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.240 0.659 25464
2177 1 7 . 1 1 18 18 GLY H H 18 8.070 8.070 7.567 0.503 25464
2178 1 7 . 1 1 19 19 MET N N 19 117.400 117.400 122.319 -4.919 25464
2179 1 7 . 1 1 19 19 MET HA H 19 4.890 4.890 4.151 0.739 25464
2180 1 7 . 1 1 19 19 MET C C 19 176.000 176.000 175.081 0.919 25464
2181 1 7 . 1 1 19 19 MET CA C 19 53.700 53.700 55.898 -2.198 25464
2182 1 7 . 1 1 19 19 MET CB C 19 35.100 35.100 32.966 2.134 25464
2183 1 7 . 1 1 19 19 MET H H 19 7.820 7.820 8.149 -0.329 25464
2184 1 7 . 1 1 20 20 PHE N N 20 120.100 120.100 120.235 -0.135 25464
2185 1 7 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.936 0.074 25464
2186 1 7 . 1 1 20 20 PHE C C 20 174.200 174.200 175.405 -1.205 25464
2187 1 7 . 1 1 20 20 PHE CA C 20 57.400 57.400 54.828 2.572 25464
2188 1 7 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.449 4.351 25464
2189 1 7 . 1 1 20 20 PHE H H 20 9.370 9.370 8.530 0.840 25464
2190 1 7 . 1 1 21 21 PHE N N 21 115.200 115.200 116.964 -1.764 25464
2191 1 7 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.364 0.266 25464
2192 1 7 . 1 1 21 21 PHE C C 21 177.500 177.500 175.026 2.474 25464
2193 1 7 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.398 0.102 25464
2194 1 7 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.302 3.798 25464
2195 1 7 . 1 1 21 21 PHE H H 21 9.600 9.600 8.486 1.114 25464
2196 1 7 . 1 1 22 22 VAL N N 22 116.600 116.600 121.282 -4.682 25464
2197 1 7 . 1 1 22 22 VAL C C 22 175.000 175.000 175.515 -0.515 25464
2198 1 7 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.949 0.751 25464
2199 1 7 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.031 0.769 25464
2200 1 7 . 1 1 22 22 VAL H H 22 8.750 8.750 8.587 0.163 25464
2201 1 7 . 1 1 23 23 LEU N N 23 126.500 126.500 127.240 -0.740 25464
2202 1 7 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.650 -0.010 25464
2203 1 7 . 1 1 23 23 LEU C C 23 176.200 176.200 176.484 -0.284 25464
2204 1 7 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.188 -1.389 25464
2205 1 7 . 1 1 23 23 LEU CB C 23 46.700 46.700 44.834 1.865 25464
2206 1 7 . 1 1 23 23 LEU H H 23 9.530 9.530 8.760 0.770 25464
2207 1 7 . 1 1 24 24 ILE N N 24 117.700 117.700 117.981 -0.281 25464
2208 1 7 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.509 0.181 25464
2209 1 7 . 1 1 24 24 ILE C C 24 174.300 174.300 173.652 0.648 25464
2210 1 7 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.149 -0.249 25464
2211 1 7 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.685 0.915 25464
2212 1 7 . 1 1 24 24 ILE H H 24 9.300 9.300 9.010 0.290 25464
2213 1 7 . 1 1 25 25 ASN N N 25 122.500 122.500 121.118 1.382 25464
2214 1 7 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.948 -0.248 25464
2215 1 7 . 1 1 25 25 ASN C C 25 177.700 177.700 175.459 2.241 25464
2216 1 7 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.480 -1.780 25464
2217 1 7 . 1 1 25 25 ASN CB C 25 37.600 37.600 41.206 -3.606 25464
2218 1 7 . 1 1 25 25 ASN H H 25 7.300 7.300 8.658 -1.358 25464
2219 1 7 . 1 1 26 26 ASP N N 26 118.100 118.100 121.858 -3.758 25464
2220 1 7 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.346 0.014 25464
2221 1 7 . 1 1 26 26 ASP C C 26 176.700 176.700 176.521 0.179 25464
2222 1 7 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.097 -0.597 25464
2223 1 7 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.333 -0.433 25464
2224 1 7 . 1 1 26 26 ASP H H 26 8.340 8.340 8.771 -0.431 25464
2225 1 7 . 1 1 27 27 GLU N N 27 117.600 117.600 117.586 0.014 25464
2226 1 7 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.354 0.186 25464
2227 1 7 . 1 1 27 27 GLU C C 27 175.100 175.100 176.344 -1.244 25464
2228 1 7 . 1 1 27 27 GLU CA C 27 55.700 55.700 54.986 0.714 25464
2229 1 7 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.762 0.738 25464
2230 1 7 . 1 1 27 27 GLU H H 27 7.190 7.190 7.656 -0.466 25464
2231 1 7 . 1 1 28 28 GLU N N 28 112.800 112.800 114.502 -1.702 25464
2232 1 7 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.921 -0.331 25464
2233 1 7 . 1 1 28 28 GLU C C 28 175.200 175.200 175.047 0.153 25464
2234 1 7 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.752 0.048 25464
2235 1 7 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.118 -0.618 25464
2236 1 7 . 1 1 28 28 GLU H H 28 8.050 8.050 8.086 -0.036 25464
2237 1 7 . 1 1 29 29 GLN N N 29 117.200 117.200 118.994 -1.794 25464
2238 1 7 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.044 0.236 25464
2239 1 7 . 1 1 29 29 GLN C C 29 174.600 174.600 174.842 -0.242 25464
2240 1 7 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.638 -0.738 25464
2241 1 7 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.519 -0.219 25464
2242 1 7 . 1 1 29 29 GLN H H 29 7.840 7.840 7.517 0.323 25464
2243 1 7 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.966 0.094 25464
2244 1 7 . 1 1 30 30 HIS C C 30 175.900 175.900 174.534 1.366 25464
2245 1 7 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.447 1.254 25464
2246 1 7 . 1 1 30 30 HIS CB C 30 32.900 32.900 32.279 0.621 25464
2247 1 7 . 1 1 31 31 SER N N 31 113.100 113.100 115.792 -2.692 25464
2248 1 7 . 1 1 31 31 SER HA H 31 4.740 4.740 4.767 -0.027 25464
2249 1 7 . 1 1 31 31 SER C C 31 173.200 173.200 171.995 1.205 25464
2250 1 7 . 1 1 31 31 SER CA C 31 57.400 57.400 57.859 -0.459 25464
2251 1 7 . 1 1 31 31 SER CB C 31 66.600 66.600 63.988 2.612 25464
2252 1 7 . 1 1 31 31 SER H H 31 8.850 8.850 8.678 0.172 25464
2253 1 7 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.219 0.141 25464
2254 1 7 . 1 1 32 32 LEU C C 32 178.200 178.200 174.667 3.533 25464
2255 1 7 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.449 1.551 25464
2256 1 7 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.272 -1.572 25464
2257 1 7 . 1 1 33 33 TRP N N 33 123.400 123.400 127.695 -4.295 25464
2258 1 7 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.973 0.327 25464
2259 1 7 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.290 -0.190 25464
2260 1 7 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.180 1.320 25464
2261 1 7 . 1 1 33 33 TRP H H 33 9.170 9.170 9.139 0.031 25464
2262 1 7 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.839 -1.029 25464
2263 1 7 . 1 1 34 34 PRO C C 34 177.400 177.400 177.684 -0.284 25464
2264 1 7 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.242 -0.442 25464
2265 1 7 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.604 -1.604 25464
2266 1 7 . 1 1 35 35 THR N N 35 107.700 107.700 114.775 -7.075 25464
2267 1 7 . 1 1 35 35 THR HA H 35 3.730 3.730 4.397 -0.667 25464
2268 1 7 . 1 1 35 35 THR C C 35 176.100 176.100 175.376 0.724 25464
2269 1 7 . 1 1 35 35 THR CA C 35 63.600 63.600 65.175 -1.575 25464
2270 1 7 . 1 1 35 35 THR CB C 35 68.200 68.200 68.580 -0.380 25464
2271 1 7 . 1 1 35 35 THR H H 35 7.260 7.260 7.904 -0.644 25464
2272 1 7 . 1 1 36 36 PHE N N 36 114.500 114.500 118.252 -3.752 25464
2273 1 7 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.430 0.080 25464
2274 1 7 . 1 1 36 36 PHE C C 36 174.500 174.500 175.076 -0.576 25464
2275 1 7 . 1 1 36 36 PHE CA C 36 56.900 56.900 58.738 -1.838 25464
2276 1 7 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.469 -0.869 25464
2277 1 7 . 1 1 36 36 PHE H H 36 6.770 6.770 7.436 -0.666 25464
2278 1 7 . 1 1 37 37 ALA N N 37 125.300 125.300 121.283 4.017 25464
2279 1 7 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.640 0.070 25464
2280 1 7 . 1 1 37 37 ALA C C 37 177.300 177.300 175.456 1.844 25464
2281 1 7 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.834 -0.634 25464
2282 1 7 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.480 -1.080 25464
2283 1 7 . 1 1 37 37 ALA H H 37 6.950 6.950 7.341 -0.391 25464
2284 1 7 . 1 1 38 38 ASP N N 38 124.500 124.500 120.547 3.953 25464
2285 1 7 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.955 -0.475 25464
2286 1 7 . 1 1 38 38 ASP C C 38 176.700 176.700 175.947 0.753 25464
2287 1 7 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.844 1.156 25464
2288 1 7 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.676 -2.276 25464
2289 1 7 . 1 1 38 38 ASP H H 38 8.870 8.870 8.626 0.244 25464
2290 1 7 . 1 1 39 39 VAL N N 39 126.000 126.000 122.446 3.554 25464
2291 1 7 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.629 -0.269 25464
2292 1 7 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.850 0.250 25464
2293 1 7 . 1 1 39 39 VAL CB C 39 32.200 32.200 30.907 1.293 25464
2294 1 7 . 1 1 39 39 VAL H H 39 8.650 8.650 8.343 0.307 25464
2295 1 7 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.354 -0.104 25464
2296 1 7 . 1 1 40 40 PRO C C 40 175.800 175.800 176.200 -0.400 25464
2297 1 7 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.211 -0.011 25464
2298 1 7 . 1 1 40 40 PRO CB C 40 31.700 31.700 32.008 -0.308 25464
2299 1 7 . 1 1 41 41 ALA N N 41 122.700 122.700 125.646 -2.946 25464
2300 1 7 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.158 0.022 25464
2301 1 7 . 1 1 41 41 ALA C C 41 179.000 179.000 178.378 0.622 25464
2302 1 7 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.993 -0.693 25464
2303 1 7 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.124 -0.824 25464
2304 1 7 . 1 1 41 41 ALA H H 41 8.280 8.280 8.238 0.042 25464
2305 1 7 . 1 1 42 42 GLY N N 42 109.800 109.800 111.023 -1.223 25464
2306 1 7 . 1 1 42 42 GLY C C 42 173.800 173.800 174.126 -0.326 25464
2307 1 7 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.503 0.197 25464
2308 1 7 . 1 1 42 42 GLY H H 42 8.770 8.770 8.354 0.416 25464
2309 1 7 . 1 1 43 43 TRP N N 43 120.300 120.300 121.367 -1.067 25464
2310 1 7 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.107 -0.157 25464
2311 1 7 . 1 1 43 43 TRP C C 43 174.900 174.900 175.443 -0.543 25464
2312 1 7 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.702 -1.002 25464
2313 1 7 . 1 1 43 43 TRP CB C 43 32.000 32.000 31.264 0.736 25464
2314 1 7 . 1 1 43 43 TRP H H 43 7.740 7.740 7.836 -0.096 25464
2315 1 7 . 1 1 44 44 ARG N N 44 117.700 117.700 118.106 -0.406 25464
2316 1 7 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.765 -0.045 25464
2317 1 7 . 1 1 44 44 ARG C C 44 174.900 174.900 174.664 0.236 25464
2318 1 7 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.356 -0.456 25464
2319 1 7 . 1 1 44 44 ARG CB C 44 33.200 33.200 33.644 -0.444 25464
2320 1 7 . 1 1 44 44 ARG H H 44 8.990 8.990 8.957 0.033 25464
2321 1 7 . 1 1 45 45 VAL N N 45 122.800 122.800 123.933 -1.133 25464
2322 1 7 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.012 -0.032 25464
2323 1 7 . 1 1 45 45 VAL C C 45 177.600 177.600 176.290 1.310 25464
2324 1 7 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.767 -0.067 25464
2325 1 7 . 1 1 45 45 VAL CB C 45 32.100 32.100 32.377 -0.277 25464
2326 1 7 . 1 1 45 45 VAL H H 45 8.720 8.720 8.619 0.101 25464
2327 1 7 . 1 1 46 46 VAL N N 46 120.400 120.400 124.543 -4.143 25464
2328 1 7 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.384 0.296 25464
2329 1 7 . 1 1 46 46 VAL C C 46 174.200 174.200 175.139 -0.939 25464
2330 1 7 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.876 -2.376 25464
2331 1 7 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.667 0.333 25464
2332 1 7 . 1 1 46 46 VAL H H 46 9.060 9.060 8.947 0.113 25464
2333 1 7 . 1 1 47 47 PHE N N 47 121.100 121.100 122.507 -1.407 25464
2334 1 7 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.677 -0.227 25464
2335 1 7 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.499 2.201 25464
2336 1 7 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.520 0.180 25464
2337 1 7 . 1 1 47 47 PHE H H 47 7.680 7.680 8.211 -0.531 25464
2338 1 7 . 1 1 48 48 GLY N N 48 112.600 112.600 112.731 -0.131 25464
2339 1 7 . 1 1 48 48 GLY C C 48 174.700 174.700 173.815 0.885 25464
2340 1 7 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.523 -2.523 25464
2341 1 7 . 1 1 48 48 GLY H H 48 7.380 7.380 8.318 -0.938 25464
2342 1 7 . 1 1 49 49 GLU N N 49 120.600 120.600 118.740 1.860 25464
2343 1 7 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.305 -0.075 25464
2344 1 7 . 1 1 49 49 GLU C C 49 174.900 174.900 175.402 -0.502 25464
2345 1 7 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.256 -0.956 25464
2346 1 7 . 1 1 49 49 GLU CB C 49 31.200 31.200 27.676 3.524 25464
2347 1 7 . 1 1 49 49 GLU H H 49 8.510 8.510 8.571 -0.061 25464
2348 1 7 . 1 1 50 50 ALA N N 50 126.600 126.600 128.302 -1.702 25464
2349 1 7 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.722 -0.082 25464
2350 1 7 . 1 1 50 50 ALA C C 50 175.100 175.100 175.394 -0.294 25464
2351 1 7 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.447 0.953 25464
2352 1 7 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.468 0.732 25464
2353 1 7 . 1 1 50 50 ALA H H 50 9.440 9.440 8.731 0.709 25464
2354 1 7 . 1 1 51 51 SER N N 51 115.100 115.100 114.162 0.938 25464
2355 1 7 . 1 1 51 51 SER HA H 51 4.740 4.740 4.240 0.500 25464
2356 1 7 . 1 1 51 51 SER C C 51 175.000 175.000 175.693 -0.693 25464
2357 1 7 . 1 1 51 51 SER CA C 51 58.100 58.100 58.425 -0.326 25464
2358 1 7 . 1 1 51 51 SER CB C 51 64.700 64.700 63.621 1.079 25464
2359 1 7 . 1 1 51 51 SER H H 51 8.950 8.950 8.522 0.428 25464
2360 1 7 . 1 1 52 52 ARG N N 52 123.500 123.500 125.275 -1.775 25464
2361 1 7 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.953 -0.543 25464
2362 1 7 . 1 1 52 52 ARG C C 52 178.200 178.200 177.968 0.232 25464
2363 1 7 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.882 1.119 25464
2364 1 7 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.841 0.059 25464
2365 1 7 . 1 1 52 52 ARG H H 52 9.540 9.540 8.745 0.795 25464
2366 1 7 . 1 1 53 53 ALA N N 53 118.000 118.000 119.071 -1.071 25464
2367 1 7 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.067 -0.037 25464
2368 1 7 . 1 1 53 53 ALA C C 53 181.000 181.000 179.638 1.362 25464
2369 1 7 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.160 0.140 25464
2370 1 7 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.724 0.376 25464
2371 1 7 . 1 1 53 53 ALA H H 53 8.770 8.770 8.624 0.146 25464
2372 1 7 . 1 1 54 54 SER N N 54 115.300 115.300 114.562 0.738 25464
2373 1 7 . 1 1 54 54 SER HA H 54 4.350 4.350 4.120 0.230 25464
2374 1 7 . 1 1 54 54 SER C C 54 177.500 177.500 176.453 1.047 25464
2375 1 7 . 1 1 54 54 SER CA C 54 61.900 61.900 61.511 0.389 25464
2376 1 7 . 1 1 54 54 SER CB C 54 63.100 63.100 62.434 0.666 25464
2377 1 7 . 1 1 54 54 SER H H 54 8.140 8.140 7.958 0.182 25464
2378 1 7 . 1 1 55 55 CYS N N 55 121.900 121.900 120.768 1.132 25464
2379 1 7 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.643 0.517 25464
2380 1 7 . 1 1 55 55 CYS C C 55 176.300 176.300 176.831 -0.531 25464
2381 1 7 . 1 1 55 55 CYS CA C 55 64.300 64.300 63.958 0.342 25464
2382 1 7 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.906 0.094 25464
2383 1 7 . 1 1 55 55 CYS H H 55 8.430 8.430 7.629 0.801 25464
2384 1 7 . 1 1 56 56 VAL N N 56 121.100 121.100 119.854 1.246 25464
2385 1 7 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.611 -0.121 25464
2386 1 7 . 1 1 56 56 VAL C C 56 177.800 177.800 178.205 -0.405 25464
2387 1 7 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.834 0.166 25464
2388 1 7 . 1 1 56 56 VAL CB C 56 31.600 31.600 30.910 0.690 25464
2389 1 7 . 1 1 56 56 VAL H H 56 8.750 8.750 8.684 0.066 25464
2390 1 7 . 1 1 57 57 GLU N N 57 119.200 119.200 120.946 -1.746 25464
2391 1 7 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.969 0.101 25464
2392 1 7 . 1 1 57 57 GLU C C 57 177.900 177.900 178.649 -0.749 25464
2393 1 7 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.733 -0.433 25464
2394 1 7 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.583 -0.083 25464
2395 1 7 . 1 1 57 57 GLU H H 57 7.780 7.780 8.140 -0.360 25464
2396 1 7 . 1 1 58 58 TYR N N 58 119.400 119.400 120.574 -1.174 25464
2397 1 7 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.195 -0.305 25464
2398 1 7 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.152 0.048 25464
2399 1 7 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.638 -1.438 25464
2400 1 7 . 1 1 58 58 TYR H H 58 7.700 7.700 8.067 -0.367 25464
2401 1 7 . 1 1 59 59 VAL N N 59 121.500 121.500 118.752 2.748 25464
2402 1 7 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.454 -0.094 25464
2403 1 7 . 1 1 59 59 VAL C C 59 176.300 176.300 177.152 -0.852 25464
2404 1 7 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.820 0.579 25464
2405 1 7 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.688 -0.288 25464
2406 1 7 . 1 1 59 59 VAL H H 59 8.380 8.380 7.996 0.384 25464
2407 1 7 . 1 1 60 60 ASP N N 60 120.000 120.000 116.991 3.009 25464
2408 1 7 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.348 0.062 25464
2409 1 7 . 1 1 60 60 ASP C C 60 178.300 178.300 179.616 -1.316 25464
2410 1 7 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.062 0.038 25464
2411 1 7 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.038 -0.438 25464
2412 1 7 . 1 1 60 60 ASP H H 60 8.580 8.580 7.954 0.626 25464
2413 1 7 . 1 1 61 61 GLN N N 61 114.500 114.500 118.635 -4.135 25464
2414 1 7 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.068 -0.058 25464
2415 1 7 . 1 1 61 61 GLN C C 61 176.700 176.700 178.202 -1.502 25464
2416 1 7 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.342 -1.642 25464
2417 1 7 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.903 -0.103 25464
2418 1 7 . 1 1 61 61 GLN H H 61 7.810 7.810 7.836 -0.026 25464
2419 1 7 . 1 1 62 62 HIS N N 62 115.100 115.100 116.660 -1.560 25464
2420 1 7 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.539 -0.159 25464
2421 1 7 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.096 2.204 25464
2422 1 7 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.718 -0.718 25464
2423 1 7 . 1 1 62 62 HIS H H 62 7.730 7.730 7.592 0.138 25464
2424 1 7 . 1 1 63 63 TRP N N 63 121.500 121.500 122.565 -1.065 25464
2425 1 7 . 1 1 63 63 TRP CA C 63 58.800 58.800 61.048 -2.248 25464
2426 1 7 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.686 0.014 25464
2427 1 7 . 1 1 63 63 TRP H H 63 8.180 8.180 7.447 0.733 25464
2428 1 7 . 1 1 64 64 THR N N 64 114.900 114.900 113.009 1.891 25464
2429 1 7 . 1 1 64 64 THR HA H 64 4.180 4.180 4.064 0.116 25464
2430 1 7 . 1 1 64 64 THR CA C 64 62.100 62.100 62.665 -0.565 25464
2431 1 7 . 1 1 64 64 THR CB C 64 69.500 69.500 67.719 1.781 25464
2432 1 7 . 1 1 64 64 THR H H 64 7.940 7.940 8.304 -0.364 25464
2433 1 7 . 1 1 65 65 ASP N N 65 122.900 122.900 125.284 -2.384 25464
2434 1 7 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.517 0.883 25464
2435 1 7 . 1 1 65 65 ASP CB C 65 41.100 41.100 42.009 -0.909 25464
2436 1 7 . 1 1 65 65 ASP H H 65 8.340 8.340 8.130 0.210 25464
2437 1 7 . 1 1 66 66 ILE N N 66 122.200 122.200 120.591 1.609 25464
2438 1 7 . 1 1 66 66 ILE HA H 66 4.160 4.160 3.789 0.371 25464
2439 1 7 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.768 0.332 25464
2440 1 7 . 1 1 66 66 ILE CB C 66 38.500 38.500 36.033 2.467 25464
2441 1 7 . 1 1 66 66 ILE H H 66 8.250 8.250 7.892 0.358 25464
2442 1 7 . 1 1 67 67 ARG N N 67 124.000 124.000 129.513 -5.513 25464
2443 1 7 . 1 1 67 67 ARG CA C 67 53.900 53.900 58.824 -4.923 25464
2444 1 7 . 1 1 67 67 ARG CB C 67 30.000 30.000 29.010 0.990 25464
2445 1 7 . 1 1 67 67 ARG H H 67 8.490 8.490 8.112 0.378 25464
2446 1 7 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.525 -0.085 25464
2447 1 7 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.231 0.869 25464
2448 1 7 . 1 1 68 68 PRO CB C 68 32.100 32.100 30.776 1.324 25464
2449 1 7 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.264 0.066 25464
2450 1 7 . 1 1 69 69 LYS C C 69 175.900 175.900 176.624 -0.724 25464
2451 1 7 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.312 -0.012 25464
2452 1 7 . 1 1 69 69 LYS CB C 69 33.000 33.000 31.004 1.996 25464
2453 1 7 . 1 1 69 69 LYS H H 69 8.270 8.270 8.130 0.140 25464
2454 1 7 . 1 1 70 70 SER N N 70 122.300 122.300 117.987 4.313 25464
2455 1 7 . 1 1 70 70 SER HA H 70 4.580 4.580 4.179 0.401 25464
2456 1 7 . 1 1 70 70 SER CA C 70 59.900 59.900 60.960 -1.060 25464
2457 1 7 . 1 1 70 70 SER CB C 70 65.100 65.100 63.371 1.729 25464
2458 1 7 . 1 1 70 70 SER H H 70 8.140 8.140 8.426 -0.286 25464
2459 1 7 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.571 -0.251 25464
2460 1 7 . 1 1 75 75 LEU CA C 75 55.400 55.400 56.375 -0.975 25464
2461 1 7 . 1 1 75 75 LEU CB C 75 42.100 42.100 44.591 -2.491 25464
2462 1 7 . 1 1 76 76 ALA N N 76 124.000 124.000 123.989 0.011 25464
2463 1 7 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.299 0.031 25464
2464 1 7 . 1 1 76 76 ALA CA C 76 52.700 52.700 53.355 -0.655 25464
2465 1 7 . 1 1 76 76 ALA CB C 76 19.000 19.000 18.171 0.830 25464
2466 1 7 . 1 1 76 76 ALA H H 76 8.200 8.200 8.316 -0.116 25464
2467 1 7 . 1 1 77 77 SER N N 77 114.100 114.100 121.471 -7.371 25464
2468 1 7 . 1 1 77 77 SER HA H 77 4.450 4.450 4.428 0.022 25464
2469 1 7 . 1 1 77 77 SER CA C 77 58.200 58.200 59.048 -0.848 25464
2470 1 7 . 1 1 77 77 SER CB C 77 63.900 63.900 63.593 0.307 25464
2471 1 7 . 1 1 77 77 SER H H 77 8.210 8.210 8.455 -0.245 25464
2472 1 7 . 1 1 78 78 GLY N N 78 110.500 110.500 110.101 0.399 25464
2473 1 7 . 1 1 78 78 GLY CA C 78 45.400 45.400 46.255 -0.855 25464
2474 1 7 . 1 1 78 78 GLY H H 78 8.390 8.390 8.231 0.159 25464
2475 1 7 . 1 1 79 79 GLN N N 79 119.600 119.600 120.653 -1.053 25464
2476 1 7 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.792 -0.192 25464
2477 1 7 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.716 -1.116 25464
2478 1 7 . 1 1 79 79 GLN H H 79 8.250 8.250 8.419 -0.169 25464
2479 1 8 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.485 -0.025 25464
2480 1 8 . 1 1 2 2 PRO CA C 2 63.400 63.400 63.325 0.076 25464
2481 1 8 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.969 0.131 25464
2482 1 8 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.623 -0.524 25464
2483 1 8 . 1 1 10 10 ASP N N 10 121.500 121.500 122.234 -0.734 25464
2484 1 8 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.556 0.043 25464
2485 1 8 . 1 1 10 10 ASP C C 10 175.300 175.300 175.334 -0.034 25464
2486 1 8 . 1 1 10 10 ASP CA C 10 54.500 54.500 55.035 -0.535 25464
2487 1 8 . 1 1 10 10 ASP CB C 10 40.900 40.900 39.539 1.361 25464
2488 1 8 . 1 1 10 10 ASP H H 10 8.420 8.420 8.509 -0.089 25464
2489 1 8 . 1 1 11 11 ASN N N 11 118.400 118.400 122.360 -3.960 25464
2490 1 8 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.930 0.020 25464
2491 1 8 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.193 -0.393 25464
2492 1 8 . 1 1 11 11 ASN CB C 11 39.100 39.100 40.044 -0.944 25464
2493 1 8 . 1 1 11 11 ASN H H 11 8.270 8.270 7.821 0.449 25464
2494 1 8 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.211 0.169 25464
2495 1 8 . 1 1 12 12 PRO C C 12 177.100 177.100 175.367 1.733 25464
2496 1 8 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.348 0.352 25464
2497 1 8 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.433 0.467 25464
2498 1 8 . 1 1 13 13 PHE N N 13 117.500 117.500 117.017 0.483 25464
2499 1 8 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.664 -0.164 25464
2500 1 8 . 1 1 13 13 PHE C C 13 175.700 175.700 175.621 0.079 25464
2501 1 8 . 1 1 13 13 PHE CA C 13 58.300 58.300 57.101 1.199 25464
2502 1 8 . 1 1 13 13 PHE CB C 13 38.700 38.700 39.446 -0.746 25464
2503 1 8 . 1 1 13 13 PHE H H 13 8.120 8.120 7.617 0.503 25464
2504 1 8 . 1 1 14 14 ASP N N 14 120.000 120.000 119.733 0.267 25464
2505 1 8 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.550 0.070 25464
2506 1 8 . 1 1 14 14 ASP C C 14 175.800 175.800 176.100 -0.300 25464
2507 1 8 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.780 0.620 25464
2508 1 8 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.913 0.487 25464
2509 1 8 . 1 1 14 14 ASP H H 14 8.010 8.010 7.779 0.231 25464
2510 1 8 . 1 1 15 15 ASP N N 15 119.900 119.900 121.022 -1.122 25464
2511 1 8 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.619 -0.009 25464
2512 1 8 . 1 1 15 15 ASP C C 15 176.700 176.700 176.811 -0.111 25464
2513 1 8 . 1 1 15 15 ASP CA C 15 54.500 54.500 54.344 0.156 25464
2514 1 8 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.798 -1.598 25464
2515 1 8 . 1 1 15 15 ASP H H 15 7.900 7.900 8.200 -0.300 25464
2516 1 8 . 1 1 16 16 GLU N N 16 122.700 122.700 119.560 3.140 25464
2517 1 8 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.142 0.088 25464
2518 1 8 . 1 1 16 16 GLU C C 16 176.600 176.600 177.669 -1.069 25464
2519 1 8 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.221 -0.821 25464
2520 1 8 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.134 -0.035 25464
2521 1 8 . 1 1 16 16 GLU H H 16 8.610 8.610 8.653 -0.043 25464
2522 1 8 . 1 1 17 17 ASP N N 17 119.500 119.500 119.763 -0.263 25464
2523 1 8 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.443 0.407 25464
2524 1 8 . 1 1 17 17 ASP C C 17 176.300 176.300 176.438 -0.138 25464
2525 1 8 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.203 -0.903 25464
2526 1 8 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.322 0.278 25464
2527 1 8 . 1 1 17 17 ASP H H 17 8.490 8.490 8.353 0.137 25464
2528 1 8 . 1 1 18 18 GLY N N 18 107.700 107.700 107.226 0.474 25464
2529 1 8 . 1 1 18 18 GLY C C 18 172.700 172.700 173.857 -1.157 25464
2530 1 8 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.701 0.199 25464
2531 1 8 . 1 1 18 18 GLY H H 18 8.070 8.070 7.846 0.224 25464
2532 1 8 . 1 1 19 19 MET N N 19 117.400 117.400 123.012 -5.612 25464
2533 1 8 . 1 1 19 19 MET HA H 19 4.890 4.890 4.283 0.607 25464
2534 1 8 . 1 1 19 19 MET C C 19 176.000 176.000 174.996 1.004 25464
2535 1 8 . 1 1 19 19 MET CA C 19 53.700 53.700 53.681 0.020 25464
2536 1 8 . 1 1 19 19 MET CB C 19 35.100 35.100 31.584 3.517 25464
2537 1 8 . 1 1 19 19 MET H H 19 7.820 7.820 8.229 -0.409 25464
2538 1 8 . 1 1 20 20 PHE N N 20 120.100 120.100 121.289 -1.189 25464
2539 1 8 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.759 0.251 25464
2540 1 8 . 1 1 20 20 PHE C C 20 174.200 174.200 175.145 -0.945 25464
2541 1 8 . 1 1 20 20 PHE CA C 20 57.400 57.400 54.818 2.582 25464
2542 1 8 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.986 3.814 25464
2543 1 8 . 1 1 20 20 PHE H H 20 9.370 9.370 8.575 0.795 25464
2544 1 8 . 1 1 21 21 PHE N N 21 115.200 115.200 116.820 -1.620 25464
2545 1 8 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.593 0.037 25464
2546 1 8 . 1 1 21 21 PHE C C 21 177.500 177.500 174.513 2.987 25464
2547 1 8 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.679 -0.179 25464
2548 1 8 . 1 1 21 21 PHE CB C 21 44.100 44.100 41.142 2.958 25464
2549 1 8 . 1 1 21 21 PHE H H 21 9.600 9.600 8.609 0.991 25464
2550 1 8 . 1 1 22 22 VAL N N 22 116.600 116.600 120.766 -4.166 25464
2551 1 8 . 1 1 22 22 VAL C C 22 175.000 175.000 175.649 -0.649 25464
2552 1 8 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.385 1.315 25464
2553 1 8 . 1 1 22 22 VAL CB C 22 32.800 32.800 33.007 -0.207 25464
2554 1 8 . 1 1 22 22 VAL H H 22 8.750 8.750 8.718 0.032 25464
2555 1 8 . 1 1 23 23 LEU N N 23 126.500 126.500 126.963 -0.463 25464
2556 1 8 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.689 -0.049 25464
2557 1 8 . 1 1 23 23 LEU C C 23 176.200 176.200 176.046 0.154 25464
2558 1 8 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.887 -1.087 25464
2559 1 8 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.363 1.337 25464
2560 1 8 . 1 1 23 23 LEU H H 23 9.530 9.530 9.053 0.477 25464
2561 1 8 . 1 1 24 24 ILE N N 24 117.700 117.700 117.896 -0.196 25464
2562 1 8 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.249 0.441 25464
2563 1 8 . 1 1 24 24 ILE C C 24 174.300 174.300 173.317 0.983 25464
2564 1 8 . 1 1 24 24 ILE CA C 24 58.900 58.900 58.818 0.082 25464
2565 1 8 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.502 1.098 25464
2566 1 8 . 1 1 24 24 ILE H H 24 9.300 9.300 8.767 0.533 25464
2567 1 8 . 1 1 25 25 ASN N N 25 122.500 122.500 123.146 -0.646 25464
2568 1 8 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.824 -0.124 25464
2569 1 8 . 1 1 25 25 ASN C C 25 177.700 177.700 175.820 1.880 25464
2570 1 8 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.398 -0.698 25464
2571 1 8 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.288 -2.688 25464
2572 1 8 . 1 1 25 25 ASN H H 25 7.300 7.300 8.277 -0.977 25464
2573 1 8 . 1 1 26 26 ASP N N 26 118.100 118.100 121.760 -3.660 25464
2574 1 8 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.231 0.129 25464
2575 1 8 . 1 1 26 26 ASP C C 26 176.700 176.700 177.204 -0.504 25464
2576 1 8 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.787 -1.287 25464
2577 1 8 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.658 -0.758 25464
2578 1 8 . 1 1 26 26 ASP H H 26 8.340 8.340 8.742 -0.402 25464
2579 1 8 . 1 1 27 27 GLU N N 27 117.600 117.600 118.686 -1.086 25464
2580 1 8 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.233 0.307 25464
2581 1 8 . 1 1 27 27 GLU C C 27 175.100 175.100 175.539 -0.439 25464
2582 1 8 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.039 -0.339 25464
2583 1 8 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.018 1.482 25464
2584 1 8 . 1 1 27 27 GLU H H 27 7.190 7.190 8.324 -1.134 25464
2585 1 8 . 1 1 28 28 GLU N N 28 112.800 112.800 114.740 -1.940 25464
2586 1 8 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.789 -0.199 25464
2587 1 8 . 1 1 28 28 GLU C C 28 175.200 175.200 175.596 -0.396 25464
2588 1 8 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.700 0.100 25464
2589 1 8 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.131 -0.631 25464
2590 1 8 . 1 1 28 28 GLU H H 28 8.050 8.050 8.081 -0.031 25464
2591 1 8 . 1 1 29 29 GLN N N 29 117.200 117.200 117.846 -0.646 25464
2592 1 8 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.345 -0.065 25464
2593 1 8 . 1 1 29 29 GLN C C 29 174.600 174.600 175.241 -0.641 25464
2594 1 8 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.978 -1.078 25464
2595 1 8 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.331 -0.031 25464
2596 1 8 . 1 1 29 29 GLN H H 29 7.840 7.840 7.605 0.235 25464
2597 1 8 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.825 0.235 25464
2598 1 8 . 1 1 30 30 HIS C C 30 175.900 175.900 174.922 0.978 25464
2599 1 8 . 1 1 30 30 HIS CA C 30 54.700 54.700 55.621 -0.921 25464
2600 1 8 . 1 1 30 30 HIS CB C 30 32.900 32.900 32.693 0.207 25464
2601 1 8 . 1 1 31 31 SER N N 31 113.100 113.100 116.727 -3.627 25464
2602 1 8 . 1 1 31 31 SER HA H 31 4.740 4.740 4.730 0.010 25464
2603 1 8 . 1 1 31 31 SER C C 31 173.200 173.200 172.116 1.084 25464
2604 1 8 . 1 1 31 31 SER CA C 31 57.400 57.400 57.634 -0.234 25464
2605 1 8 . 1 1 31 31 SER CB C 31 66.600 66.600 64.213 2.387 25464
2606 1 8 . 1 1 31 31 SER H H 31 8.850 8.850 8.746 0.104 25464
2607 1 8 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.125 0.235 25464
2608 1 8 . 1 1 32 32 LEU C C 32 178.200 178.200 174.774 3.426 25464
2609 1 8 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.422 1.578 25464
2610 1 8 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.664 -0.964 25464
2611 1 8 . 1 1 33 33 TRP N N 33 123.400 123.400 128.740 -5.340 25464
2612 1 8 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.963 0.337 25464
2613 1 8 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.315 -0.215 25464
2614 1 8 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.193 1.307 25464
2615 1 8 . 1 1 33 33 TRP H H 33 9.170 9.170 9.315 -0.145 25464
2616 1 8 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.650 -0.840 25464
2617 1 8 . 1 1 34 34 PRO C C 34 177.400 177.400 177.175 0.225 25464
2618 1 8 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.268 -0.468 25464
2619 1 8 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.199 -1.199 25464
2620 1 8 . 1 1 35 35 THR N N 35 107.700 107.700 114.861 -7.161 25464
2621 1 8 . 1 1 35 35 THR HA H 35 3.730 3.730 4.389 -0.659 25464
2622 1 8 . 1 1 35 35 THR C C 35 176.100 176.100 175.153 0.947 25464
2623 1 8 . 1 1 35 35 THR CA C 35 63.600 63.600 64.394 -0.794 25464
2624 1 8 . 1 1 35 35 THR CB C 35 68.200 68.200 68.486 -0.286 25464
2625 1 8 . 1 1 35 35 THR H H 35 7.260 7.260 7.913 -0.653 25464
2626 1 8 . 1 1 36 36 PHE N N 36 114.500 114.500 118.550 -4.050 25464
2627 1 8 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.586 -0.076 25464
2628 1 8 . 1 1 36 36 PHE C C 36 174.500 174.500 175.107 -0.607 25464
2629 1 8 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.978 -1.078 25464
2630 1 8 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.645 -1.045 25464
2631 1 8 . 1 1 36 36 PHE H H 36 6.770 6.770 7.277 -0.507 25464
2632 1 8 . 1 1 37 37 ALA N N 37 125.300 125.300 121.823 3.477 25464
2633 1 8 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.562 0.148 25464
2634 1 8 . 1 1 37 37 ALA C C 37 177.300 177.300 175.948 1.352 25464
2635 1 8 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.041 -0.841 25464
2636 1 8 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.228 -0.828 25464
2637 1 8 . 1 1 37 37 ALA H H 37 6.950 6.950 7.390 -0.440 25464
2638 1 8 . 1 1 38 38 ASP N N 38 124.500 124.500 121.078 3.422 25464
2639 1 8 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.743 -0.263 25464
2640 1 8 . 1 1 38 38 ASP C C 38 176.700 176.700 176.332 0.368 25464
2641 1 8 . 1 1 38 38 ASP CA C 38 55.000 55.000 54.457 0.543 25464
2642 1 8 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.023 -1.623 25464
2643 1 8 . 1 1 38 38 ASP H H 38 8.870 8.870 8.587 0.283 25464
2644 1 8 . 1 1 39 39 VAL N N 39 126.000 126.000 123.297 2.703 25464
2645 1 8 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.621 -0.261 25464
2646 1 8 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.615 0.485 25464
2647 1 8 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.881 0.319 25464
2648 1 8 . 1 1 39 39 VAL H H 39 8.650 8.650 8.349 0.301 25464
2649 1 8 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.295 -0.045 25464
2650 1 8 . 1 1 40 40 PRO C C 40 175.800 175.800 176.272 -0.472 25464
2651 1 8 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.742 -0.542 25464
2652 1 8 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.431 0.269 25464
2653 1 8 . 1 1 41 41 ALA N N 41 122.700 122.700 126.269 -3.569 25464
2654 1 8 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.055 0.125 25464
2655 1 8 . 1 1 41 41 ALA C C 41 179.000 179.000 178.717 0.283 25464
2656 1 8 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.508 -0.208 25464
2657 1 8 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.021 -0.721 25464
2658 1 8 . 1 1 41 41 ALA H H 41 8.280 8.280 8.431 -0.151 25464
2659 1 8 . 1 1 42 42 GLY N N 42 109.800 109.800 111.664 -1.864 25464
2660 1 8 . 1 1 42 42 GLY C C 42 173.800 173.800 173.890 -0.090 25464
2661 1 8 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.862 -0.162 25464
2662 1 8 . 1 1 42 42 GLY H H 42 8.770 8.770 8.291 0.479 25464
2663 1 8 . 1 1 43 43 TRP N N 43 120.300 120.300 123.042 -2.742 25464
2664 1 8 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.254 -0.304 25464
2665 1 8 . 1 1 43 43 TRP C C 43 174.900 174.900 176.266 -1.366 25464
2666 1 8 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.400 -0.700 25464
2667 1 8 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.704 2.296 25464
2668 1 8 . 1 1 43 43 TRP H H 43 7.740 7.740 7.949 -0.209 25464
2669 1 8 . 1 1 44 44 ARG N N 44 117.700 117.700 123.515 -5.815 25464
2670 1 8 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.647 0.073 25464
2671 1 8 . 1 1 44 44 ARG C C 44 174.900 174.900 175.335 -0.435 25464
2672 1 8 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.911 -1.011 25464
2673 1 8 . 1 1 44 44 ARG CB C 44 33.200 33.200 31.840 1.360 25464
2674 1 8 . 1 1 44 44 ARG H H 44 8.990 8.990 8.744 0.246 25464
2675 1 8 . 1 1 45 45 VAL N N 45 122.800 122.800 124.202 -1.402 25464
2676 1 8 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.144 -0.164 25464
2677 1 8 . 1 1 45 45 VAL C C 45 177.600 177.600 176.768 0.832 25464
2678 1 8 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.543 0.157 25464
2679 1 8 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.409 0.691 25464
2680 1 8 . 1 1 45 45 VAL H H 45 8.720 8.720 8.522 0.198 25464
2681 1 8 . 1 1 46 46 VAL N N 46 120.400 120.400 124.155 -3.755 25464
2682 1 8 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.277 0.403 25464
2683 1 8 . 1 1 46 46 VAL C C 46 174.200 174.200 175.566 -1.366 25464
2684 1 8 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.398 -2.898 25464
2685 1 8 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.919 1.081 25464
2686 1 8 . 1 1 46 46 VAL H H 46 9.060 9.060 8.764 0.296 25464
2687 1 8 . 1 1 47 47 PHE N N 47 121.100 121.100 122.511 -1.411 25464
2688 1 8 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.703 -0.253 25464
2689 1 8 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.559 2.141 25464
2690 1 8 . 1 1 47 47 PHE CB C 47 41.700 41.700 40.928 0.772 25464
2691 1 8 . 1 1 47 47 PHE H H 47 7.680 7.680 8.323 -0.643 25464
2692 1 8 . 1 1 48 48 GLY N N 48 112.600 112.600 112.946 -0.346 25464
2693 1 8 . 1 1 48 48 GLY C C 48 174.700 174.700 173.858 0.842 25464
2694 1 8 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.601 -2.601 25464
2695 1 8 . 1 1 48 48 GLY H H 48 7.380 7.380 8.360 -0.980 25464
2696 1 8 . 1 1 49 49 GLU N N 49 120.600 120.600 118.646 1.954 25464
2697 1 8 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.334 -0.104 25464
2698 1 8 . 1 1 49 49 GLU C C 49 174.900 174.900 175.889 -0.989 25464
2699 1 8 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.463 -1.163 25464
2700 1 8 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.606 2.594 25464
2701 1 8 . 1 1 49 49 GLU H H 49 8.510 8.510 8.474 0.036 25464
2702 1 8 . 1 1 50 50 ALA N N 50 126.600 126.600 127.526 -0.926 25464
2703 1 8 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.748 -0.108 25464
2704 1 8 . 1 1 50 50 ALA C C 50 175.100 175.100 176.007 -0.907 25464
2705 1 8 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.943 0.457 25464
2706 1 8 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.826 0.374 25464
2707 1 8 . 1 1 50 50 ALA H H 50 9.440 9.440 8.780 0.660 25464
2708 1 8 . 1 1 51 51 SER N N 51 115.100 115.100 115.587 -0.487 25464
2709 1 8 . 1 1 51 51 SER HA H 51 4.740 4.740 4.223 0.517 25464
2710 1 8 . 1 1 51 51 SER C C 51 175.000 175.000 175.974 -0.974 25464
2711 1 8 . 1 1 51 51 SER CA C 51 58.100 58.100 58.987 -0.887 25464
2712 1 8 . 1 1 51 51 SER CB C 51 64.700 64.700 63.728 0.972 25464
2713 1 8 . 1 1 51 51 SER H H 51 8.950 8.950 8.747 0.203 25464
2714 1 8 . 1 1 52 52 ARG N N 52 123.500 123.500 126.234 -2.734 25464
2715 1 8 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.833 -0.423 25464
2716 1 8 . 1 1 52 52 ARG C C 52 178.200 178.200 177.742 0.458 25464
2717 1 8 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.690 1.310 25464
2718 1 8 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.729 0.171 25464
2719 1 8 . 1 1 52 52 ARG H H 52 9.540 9.540 8.816 0.724 25464
2720 1 8 . 1 1 53 53 ALA N N 53 118.000 118.000 119.706 -1.706 25464
2721 1 8 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.107 -0.077 25464
2722 1 8 . 1 1 53 53 ALA C C 53 181.000 181.000 180.071 0.929 25464
2723 1 8 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.031 0.269 25464
2724 1 8 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.660 0.440 25464
2725 1 8 . 1 1 53 53 ALA H H 53 8.770 8.770 8.594 0.176 25464
2726 1 8 . 1 1 54 54 SER N N 54 115.300 115.300 115.232 0.068 25464
2727 1 8 . 1 1 54 54 SER HA H 54 4.350 4.350 4.148 0.202 25464
2728 1 8 . 1 1 54 54 SER C C 54 177.500 177.500 176.614 0.886 25464
2729 1 8 . 1 1 54 54 SER CA C 54 61.900 61.900 62.083 -0.183 25464
2730 1 8 . 1 1 54 54 SER CB C 54 63.100 63.100 62.867 0.233 25464
2731 1 8 . 1 1 54 54 SER H H 54 8.140 8.140 7.651 0.489 25464
2732 1 8 . 1 1 55 55 CYS N N 55 121.900 121.900 120.428 1.472 25464
2733 1 8 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.622 0.538 25464
2734 1 8 . 1 1 55 55 CYS C C 55 176.300 176.300 176.887 -0.587 25464
2735 1 8 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.177 0.123 25464
2736 1 8 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.764 0.236 25464
2737 1 8 . 1 1 55 55 CYS H H 55 8.430 8.430 7.833 0.597 25464
2738 1 8 . 1 1 56 56 VAL N N 56 121.100 121.100 120.461 0.639 25464
2739 1 8 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.538 -0.048 25464
2740 1 8 . 1 1 56 56 VAL C C 56 177.800 177.800 177.834 -0.034 25464
2741 1 8 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.152 -0.152 25464
2742 1 8 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.529 0.071 25464
2743 1 8 . 1 1 56 56 VAL H H 56 8.750 8.750 8.718 0.032 25464
2744 1 8 . 1 1 57 57 GLU N N 57 119.200 119.200 120.492 -1.292 25464
2745 1 8 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.977 0.093 25464
2746 1 8 . 1 1 57 57 GLU C C 57 177.900 177.900 178.936 -1.036 25464
2747 1 8 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.656 -0.356 25464
2748 1 8 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.642 -0.142 25464
2749 1 8 . 1 1 57 57 GLU H H 57 7.780 7.780 8.019 -0.239 25464
2750 1 8 . 1 1 58 58 TYR N N 58 119.400 119.400 120.066 -0.666 25464
2751 1 8 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.258 -0.368 25464
2752 1 8 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.512 0.688 25464
2753 1 8 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.900 -1.700 25464
2754 1 8 . 1 1 58 58 TYR H H 58 7.700 7.700 8.062 -0.362 25464
2755 1 8 . 1 1 59 59 VAL N N 59 121.500 121.500 119.861 1.639 25464
2756 1 8 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.624 -0.264 25464
2757 1 8 . 1 1 59 59 VAL C C 59 176.300 176.300 177.951 -1.651 25464
2758 1 8 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.448 0.952 25464
2759 1 8 . 1 1 59 59 VAL CB C 59 31.400 31.400 30.750 0.650 25464
2760 1 8 . 1 1 59 59 VAL H H 59 8.380 8.380 8.543 -0.163 25464
2761 1 8 . 1 1 60 60 ASP N N 60 120.000 120.000 119.856 0.144 25464
2762 1 8 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.461 -0.051 25464
2763 1 8 . 1 1 60 60 ASP C C 60 178.300 178.300 178.305 -0.005 25464
2764 1 8 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.382 -0.282 25464
2765 1 8 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.800 -0.200 25464
2766 1 8 . 1 1 60 60 ASP H H 60 8.580 8.580 8.470 0.110 25464
2767 1 8 . 1 1 61 61 GLN N N 61 114.500 114.500 117.661 -3.161 25464
2768 1 8 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.028 -0.018 25464
2769 1 8 . 1 1 61 61 GLN C C 61 176.700 176.700 177.543 -0.843 25464
2770 1 8 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.266 -0.566 25464
2771 1 8 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.062 0.738 25464
2772 1 8 . 1 1 61 61 GLN H H 61 7.810 7.810 7.624 0.186 25464
2773 1 8 . 1 1 62 62 HIS N N 62 115.100 115.100 116.694 -1.594 25464
2774 1 8 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.289 0.091 25464
2775 1 8 . 1 1 62 62 HIS CA C 62 57.300 57.300 57.144 0.156 25464
2776 1 8 . 1 1 62 62 HIS CB C 62 29.000 29.000 28.773 0.227 25464
2777 1 8 . 1 1 62 62 HIS H H 62 7.730 7.730 8.051 -0.321 25464
2778 1 8 . 1 1 63 63 TRP N N 63 121.500 121.500 122.191 -0.691 25464
2779 1 8 . 1 1 63 63 TRP CA C 63 58.800 58.800 56.920 1.880 25464
2780 1 8 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.282 0.419 25464
2781 1 8 . 1 1 63 63 TRP H H 63 8.180 8.180 7.270 0.910 25464
2782 1 8 . 1 1 64 64 THR N N 64 114.900 114.900 112.757 2.143 25464
2783 1 8 . 1 1 64 64 THR HA H 64 4.180 4.180 4.174 0.006 25464
2784 1 8 . 1 1 64 64 THR CA C 64 62.100 62.100 61.069 1.030 25464
2785 1 8 . 1 1 64 64 THR CB C 64 69.500 69.500 69.604 -0.104 25464
2786 1 8 . 1 1 64 64 THR H H 64 7.940 7.940 7.374 0.566 25464
2787 1 8 . 1 1 65 65 ASP N N 65 122.900 122.900 121.156 1.744 25464
2788 1 8 . 1 1 65 65 ASP CA C 65 54.400 54.400 55.011 -0.611 25464
2789 1 8 . 1 1 65 65 ASP CB C 65 41.100 41.100 39.818 1.282 25464
2790 1 8 . 1 1 65 65 ASP H H 65 8.340 8.340 8.428 -0.088 25464
2791 1 8 . 1 1 66 66 ILE N N 66 122.200 122.200 124.755 -2.555 25464
2792 1 8 . 1 1 66 66 ILE HA H 66 4.160 4.160 3.929 0.231 25464
2793 1 8 . 1 1 66 66 ILE CA C 66 61.100 61.100 61.880 -0.780 25464
2794 1 8 . 1 1 66 66 ILE CB C 66 38.500 38.500 37.380 1.120 25464
2795 1 8 . 1 1 66 66 ILE H H 66 8.250 8.250 8.012 0.238 25464
2796 1 8 . 1 1 67 67 ARG N N 67 124.000 124.000 127.237 -3.237 25464
2797 1 8 . 1 1 67 67 ARG CA C 67 53.900 53.900 59.041 -5.141 25464
2798 1 8 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.273 1.727 25464
2799 1 8 . 1 1 67 67 ARG H H 67 8.490 8.490 8.784 -0.294 25464
2800 1 8 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.363 0.077 25464
2801 1 8 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.637 -0.537 25464
2802 1 8 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.951 0.149 25464
2803 1 8 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.597 -0.267 25464
2804 1 8 . 1 1 69 69 LYS C C 69 175.900 175.900 175.751 0.149 25464
2805 1 8 . 1 1 69 69 LYS CA C 69 56.300 56.300 55.020 1.280 25464
2806 1 8 . 1 1 69 69 LYS CB C 69 33.000 33.000 33.645 -0.645 25464
2807 1 8 . 1 1 69 69 LYS H H 69 8.270 8.270 8.239 0.031 25464
2808 1 8 . 1 1 70 70 SER N N 70 122.300 122.300 117.579 4.721 25464
2809 1 8 . 1 1 70 70 SER HA H 70 4.580 4.580 4.438 0.142 25464
2810 1 8 . 1 1 70 70 SER CA C 70 59.900 59.900 58.194 1.706 25464
2811 1 8 . 1 1 70 70 SER CB C 70 65.100 65.100 63.943 1.157 25464
2812 1 8 . 1 1 70 70 SER H H 70 8.140 8.140 8.592 -0.452 25464
2813 1 8 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.410 -0.090 25464
2814 1 8 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.517 -0.117 25464
2815 1 8 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.610 -0.510 25464
2816 1 8 . 1 1 76 76 ALA N N 76 124.000 124.000 128.415 -4.415 25464
2817 1 8 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.428 -0.098 25464
2818 1 8 . 1 1 76 76 ALA CA C 76 52.700 52.700 52.310 0.390 25464
2819 1 8 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.711 -0.711 25464
2820 1 8 . 1 1 76 76 ALA H H 76 8.200 8.200 8.761 -0.561 25464
2821 1 8 . 1 1 77 77 SER N N 77 114.100 114.100 116.701 -2.601 25464
2822 1 8 . 1 1 77 77 SER HA H 77 4.450 4.450 4.682 -0.232 25464
2823 1 8 . 1 1 77 77 SER CA C 77 58.200 58.200 58.024 0.176 25464
2824 1 8 . 1 1 77 77 SER CB C 77 63.900 63.900 63.212 0.688 25464
2825 1 8 . 1 1 77 77 SER H H 77 8.210 8.210 8.357 -0.147 25464
2826 1 8 . 1 1 78 78 GLY N N 78 110.500 110.500 111.885 -1.385 25464
2827 1 8 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.881 0.519 25464
2828 1 8 . 1 1 78 78 GLY H H 78 8.390 8.390 8.508 -0.118 25464
2829 1 8 . 1 1 79 79 GLN N N 79 119.600 119.600 122.512 -2.912 25464
2830 1 8 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.583 0.017 25464
2831 1 8 . 1 1 79 79 GLN CB C 79 29.600 29.600 26.644 2.956 25464
2832 1 8 . 1 1 79 79 GLN H H 79 8.250 8.250 8.231 0.019 25464
2833 1 9 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.611 -0.151 25464
2834 1 9 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.757 0.643 25464
2835 1 9 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.928 -0.828 25464
2836 1 9 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.613 -0.513 25464
2837 1 9 . 1 1 10 10 ASP N N 10 121.500 121.500 120.930 0.570 25464
2838 1 9 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.727 -0.127 25464
2839 1 9 . 1 1 10 10 ASP C C 10 175.300 175.300 174.603 0.697 25464
2840 1 9 . 1 1 10 10 ASP CA C 10 54.500 54.500 53.788 0.712 25464
2841 1 9 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.124 -0.224 25464
2842 1 9 . 1 1 10 10 ASP H H 10 8.420 8.420 8.253 0.167 25464
2843 1 9 . 1 1 11 11 ASN N N 11 118.400 118.400 121.025 -2.625 25464
2844 1 9 . 1 1 11 11 ASN HA H 11 4.950 4.950 5.034 -0.084 25464
2845 1 9 . 1 1 11 11 ASN CA C 11 50.800 50.800 49.865 0.935 25464
2846 1 9 . 1 1 11 11 ASN CB C 11 39.100 39.100 40.221 -1.121 25464
2847 1 9 . 1 1 11 11 ASN H H 11 8.270 8.270 7.710 0.560 25464
2848 1 9 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.462 -0.082 25464
2849 1 9 . 1 1 12 12 PRO C C 12 177.100 177.100 175.713 1.387 25464
2850 1 9 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.248 -0.548 25464
2851 1 9 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.796 0.104 25464
2852 1 9 . 1 1 13 13 PHE N N 13 117.500 117.500 112.217 5.283 25464
2853 1 9 . 1 1 13 13 PHE HA H 13 4.500 4.500 5.022 -0.522 25464
2854 1 9 . 1 1 13 13 PHE C C 13 175.700 175.700 174.328 1.372 25464
2855 1 9 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.309 1.992 25464
2856 1 9 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.913 -0.213 25464
2857 1 9 . 1 1 13 13 PHE H H 13 8.120 8.120 7.046 1.074 25464
2858 1 9 . 1 1 14 14 ASP N N 14 120.000 120.000 120.198 -0.198 25464
2859 1 9 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.532 0.088 25464
2860 1 9 . 1 1 14 14 ASP C C 14 175.800 175.800 176.003 -0.203 25464
2861 1 9 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.564 -0.164 25464
2862 1 9 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.389 0.011 25464
2863 1 9 . 1 1 14 14 ASP H H 14 8.010 8.010 7.924 0.086 25464
2864 1 9 . 1 1 15 15 ASP N N 15 119.900 119.900 119.993 -0.093 25464
2865 1 9 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.693 -0.083 25464
2866 1 9 . 1 1 15 15 ASP C C 15 176.700 176.700 177.645 -0.945 25464
2867 1 9 . 1 1 15 15 ASP CA C 15 54.500 54.500 54.666 -0.166 25464
2868 1 9 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.231 -1.031 25464
2869 1 9 . 1 1 15 15 ASP H H 15 7.900 7.900 8.293 -0.393 25464
2870 1 9 . 1 1 16 16 GLU N N 16 122.700 122.700 123.537 -0.837 25464
2871 1 9 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.066 0.164 25464
2872 1 9 . 1 1 16 16 GLU C C 16 176.600 176.600 177.164 -0.564 25464
2873 1 9 . 1 1 16 16 GLU CA C 16 57.400 57.400 59.348 -1.948 25464
2874 1 9 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.252 0.848 25464
2875 1 9 . 1 1 16 16 GLU H H 16 8.610 8.610 8.911 -0.301 25464
2876 1 9 . 1 1 17 17 ASP N N 17 119.500 119.500 118.558 0.942 25464
2877 1 9 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.487 0.363 25464
2878 1 9 . 1 1 17 17 ASP C C 17 176.300 176.300 177.093 -0.793 25464
2879 1 9 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.539 -1.239 25464
2880 1 9 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.627 0.973 25464
2881 1 9 . 1 1 17 17 ASP H H 17 8.490 8.490 8.305 0.185 25464
2882 1 9 . 1 1 18 18 GLY N N 18 107.700 107.700 107.997 -0.297 25464
2883 1 9 . 1 1 18 18 GLY C C 18 172.700 172.700 172.584 0.116 25464
2884 1 9 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.401 0.499 25464
2885 1 9 . 1 1 18 18 GLY H H 18 8.070 8.070 7.790 0.280 25464
2886 1 9 . 1 1 19 19 MET N N 19 117.400 117.400 122.182 -4.782 25464
2887 1 9 . 1 1 19 19 MET HA H 19 4.890 4.890 4.360 0.530 25464
2888 1 9 . 1 1 19 19 MET C C 19 176.000 176.000 174.697 1.303 25464
2889 1 9 . 1 1 19 19 MET CA C 19 53.700 53.700 55.056 -1.356 25464
2890 1 9 . 1 1 19 19 MET CB C 19 35.100 35.100 33.562 1.538 25464
2891 1 9 . 1 1 19 19 MET H H 19 7.820 7.820 8.151 -0.331 25464
2892 1 9 . 1 1 20 20 PHE N N 20 120.100 120.100 119.392 0.708 25464
2893 1 9 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.733 0.277 25464
2894 1 9 . 1 1 20 20 PHE C C 20 174.200 174.200 174.713 -0.513 25464
2895 1 9 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.171 2.229 25464
2896 1 9 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.855 3.945 25464
2897 1 9 . 1 1 20 20 PHE H H 20 9.370 9.370 8.563 0.807 25464
2898 1 9 . 1 1 21 21 PHE N N 21 115.200 115.200 116.539 -1.339 25464
2899 1 9 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.086 0.544 25464
2900 1 9 . 1 1 21 21 PHE C C 21 177.500 177.500 174.918 2.582 25464
2901 1 9 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.236 0.264 25464
2902 1 9 . 1 1 21 21 PHE CB C 21 44.100 44.100 39.845 4.255 25464
2903 1 9 . 1 1 21 21 PHE H H 21 9.600 9.600 8.331 1.269 25464
2904 1 9 . 1 1 22 22 VAL N N 22 116.600 116.600 121.742 -5.142 25464
2905 1 9 . 1 1 22 22 VAL C C 22 175.000 175.000 175.503 -0.503 25464
2906 1 9 . 1 1 22 22 VAL CA C 22 62.700 62.700 62.222 0.478 25464
2907 1 9 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.234 0.565 25464
2908 1 9 . 1 1 22 22 VAL H H 22 8.750 8.750 8.483 0.267 25464
2909 1 9 . 1 1 23 23 LEU N N 23 126.500 126.500 127.078 -0.578 25464
2910 1 9 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.687 -0.047 25464
2911 1 9 . 1 1 23 23 LEU C C 23 176.200 176.200 175.917 0.283 25464
2912 1 9 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.884 -1.084 25464
2913 1 9 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.768 0.932 25464
2914 1 9 . 1 1 23 23 LEU H H 23 9.530 9.530 8.811 0.719 25464
2915 1 9 . 1 1 24 24 ILE N N 24 117.700 117.700 118.337 -0.637 25464
2916 1 9 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.530 0.160 25464
2917 1 9 . 1 1 24 24 ILE C C 24 174.300 174.300 173.584 0.716 25464
2918 1 9 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.284 -0.384 25464
2919 1 9 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.968 0.632 25464
2920 1 9 . 1 1 24 24 ILE H H 24 9.300 9.300 8.957 0.343 25464
2921 1 9 . 1 1 25 25 ASN N N 25 122.500 122.500 123.636 -1.136 25464
2922 1 9 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.914 -0.214 25464
2923 1 9 . 1 1 25 25 ASN C C 25 177.700 177.700 175.845 1.855 25464
2924 1 9 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.812 -1.113 25464
2925 1 9 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.335 -2.735 25464
2926 1 9 . 1 1 25 25 ASN H H 25 7.300 7.300 8.470 -1.170 25464
2927 1 9 . 1 1 26 26 ASP N N 26 118.100 118.100 121.836 -3.736 25464
2928 1 9 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.389 -0.029 25464
2929 1 9 . 1 1 26 26 ASP C C 26 176.700 176.700 175.904 0.796 25464
2930 1 9 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.887 -0.387 25464
2931 1 9 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.598 -0.698 25464
2932 1 9 . 1 1 26 26 ASP H H 26 8.340 8.340 8.718 -0.378 25464
2933 1 9 . 1 1 27 27 GLU N N 27 117.600 117.600 118.032 -0.432 25464
2934 1 9 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.277 0.263 25464
2935 1 9 . 1 1 27 27 GLU C C 27 175.100 175.100 175.325 -0.225 25464
2936 1 9 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.054 -0.354 25464
2937 1 9 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.443 1.057 25464
2938 1 9 . 1 1 27 27 GLU H H 27 7.190 7.190 7.918 -0.728 25464
2939 1 9 . 1 1 28 28 GLU N N 28 112.800 112.800 113.671 -0.871 25464
2940 1 9 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.858 -0.268 25464
2941 1 9 . 1 1 28 28 GLU C C 28 175.200 175.200 175.717 -0.517 25464
2942 1 9 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.659 0.141 25464
2943 1 9 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.719 -0.219 25464
2944 1 9 . 1 1 28 28 GLU H H 28 8.050 8.050 7.783 0.267 25464
2945 1 9 . 1 1 29 29 GLN N N 29 117.200 117.200 117.768 -0.568 25464
2946 1 9 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.225 0.055 25464
2947 1 9 . 1 1 29 29 GLN C C 29 174.600 174.600 175.700 -1.100 25464
2948 1 9 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.615 -0.715 25464
2949 1 9 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.150 0.150 25464
2950 1 9 . 1 1 29 29 GLN H H 29 7.840 7.840 7.642 0.198 25464
2951 1 9 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.151 0.909 25464
2952 1 9 . 1 1 30 30 HIS C C 30 175.900 175.900 174.730 1.170 25464
2953 1 9 . 1 1 30 30 HIS CA C 30 54.700 54.700 54.384 0.316 25464
2954 1 9 . 1 1 30 30 HIS CB C 30 32.900 32.900 30.828 2.072 25464
2955 1 9 . 1 1 31 31 SER N N 31 113.100 113.100 117.997 -4.897 25464
2956 1 9 . 1 1 31 31 SER HA H 31 4.740 4.740 4.663 0.077 25464
2957 1 9 . 1 1 31 31 SER C C 31 173.200 173.200 172.247 0.953 25464
2958 1 9 . 1 1 31 31 SER CA C 31 57.400 57.400 57.330 0.070 25464
2959 1 9 . 1 1 31 31 SER CB C 31 66.600 66.600 64.266 2.334 25464
2960 1 9 . 1 1 31 31 SER H H 31 8.850 8.850 8.759 0.091 25464
2961 1 9 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.865 0.495 25464
2962 1 9 . 1 1 32 32 LEU C C 32 178.200 178.200 175.150 3.050 25464
2963 1 9 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.297 1.703 25464
2964 1 9 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.614 -0.914 25464
2965 1 9 . 1 1 33 33 TRP N N 33 123.400 123.400 128.638 -5.238 25464
2966 1 9 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.884 0.416 25464
2967 1 9 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.104 -0.004 25464
2968 1 9 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.306 2.194 25464
2969 1 9 . 1 1 33 33 TRP H H 33 9.170 9.170 9.107 0.063 25464
2970 1 9 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.544 -0.734 25464
2971 1 9 . 1 1 34 34 PRO C C 34 177.400 177.400 177.483 -0.083 25464
2972 1 9 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.263 -0.463 25464
2973 1 9 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.315 -1.315 25464
2974 1 9 . 1 1 35 35 THR N N 35 107.700 107.700 113.271 -5.571 25464
2975 1 9 . 1 1 35 35 THR HA H 35 3.730 3.730 4.378 -0.648 25464
2976 1 9 . 1 1 35 35 THR C C 35 176.100 176.100 175.310 0.790 25464
2977 1 9 . 1 1 35 35 THR CA C 35 63.600 63.600 64.932 -1.332 25464
2978 1 9 . 1 1 35 35 THR CB C 35 68.200 68.200 68.064 0.136 25464
2979 1 9 . 1 1 35 35 THR H H 35 7.260 7.260 7.904 -0.644 25464
2980 1 9 . 1 1 36 36 PHE N N 36 114.500 114.500 118.467 -3.967 25464
2981 1 9 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.641 -0.131 25464
2982 1 9 . 1 1 36 36 PHE C C 36 174.500 174.500 175.096 -0.596 25464
2983 1 9 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.196 -0.296 25464
2984 1 9 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.251 -0.651 25464
2985 1 9 . 1 1 36 36 PHE H H 36 6.770 6.770 7.289 -0.519 25464
2986 1 9 . 1 1 37 37 ALA N N 37 125.300 125.300 121.459 3.841 25464
2987 1 9 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.623 0.087 25464
2988 1 9 . 1 1 37 37 ALA C C 37 177.300 177.300 175.078 2.222 25464
2989 1 9 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.263 -1.063 25464
2990 1 9 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.654 -1.254 25464
2991 1 9 . 1 1 37 37 ALA H H 37 6.950 6.950 7.451 -0.501 25464
2992 1 9 . 1 1 38 38 ASP N N 38 124.500 124.500 119.578 4.922 25464
2993 1 9 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.978 -0.498 25464
2994 1 9 . 1 1 38 38 ASP C C 38 176.700 176.700 176.055 0.645 25464
2995 1 9 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.833 1.167 25464
2996 1 9 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.702 -2.302 25464
2997 1 9 . 1 1 38 38 ASP H H 38 8.870 8.870 8.587 0.283 25464
2998 1 9 . 1 1 39 39 VAL N N 39 126.000 126.000 122.036 3.964 25464
2999 1 9 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.678 -0.318 25464
3000 1 9 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.951 0.149 25464
3001 1 9 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.749 0.451 25464
3002 1 9 . 1 1 39 39 VAL H H 39 8.650 8.650 8.388 0.262 25464
3003 1 9 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.300 -0.050 25464
3004 1 9 . 1 1 40 40 PRO C C 40 175.800 175.800 176.507 -0.707 25464
3005 1 9 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.592 -0.392 25464
3006 1 9 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.524 0.176 25464
3007 1 9 . 1 1 41 41 ALA N N 41 122.700 122.700 126.032 -3.332 25464
3008 1 9 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.044 0.136 25464
3009 1 9 . 1 1 41 41 ALA C C 41 179.000 179.000 178.731 0.269 25464
3010 1 9 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.598 -0.298 25464
3011 1 9 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.098 -0.798 25464
3012 1 9 . 1 1 41 41 ALA H H 41 8.280 8.280 8.474 -0.194 25464
3013 1 9 . 1 1 42 42 GLY N N 42 109.800 109.800 111.466 -1.666 25464
3014 1 9 . 1 1 42 42 GLY C C 42 173.800 173.800 173.952 -0.152 25464
3015 1 9 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.800 -0.099 25464
3016 1 9 . 1 1 42 42 GLY H H 42 8.770 8.770 8.310 0.460 25464
3017 1 9 . 1 1 43 43 TRP N N 43 120.300 120.300 122.162 -1.862 25464
3018 1 9 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.003 -0.053 25464
3019 1 9 . 1 1 43 43 TRP C C 43 174.900 174.900 176.255 -1.355 25464
3020 1 9 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.819 -1.119 25464
3021 1 9 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.126 1.874 25464
3022 1 9 . 1 1 43 43 TRP H H 43 7.740 7.740 7.940 -0.200 25464
3023 1 9 . 1 1 44 44 ARG N N 44 117.700 117.700 121.825 -4.125 25464
3024 1 9 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.774 -0.054 25464
3025 1 9 . 1 1 44 44 ARG C C 44 174.900 174.900 175.249 -0.349 25464
3026 1 9 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.765 -0.865 25464
3027 1 9 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.581 0.619 25464
3028 1 9 . 1 1 44 44 ARG H H 44 8.990 8.990 9.162 -0.172 25464
3029 1 9 . 1 1 45 45 VAL N N 45 122.800 122.800 125.332 -2.532 25464
3030 1 9 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.228 -0.248 25464
3031 1 9 . 1 1 45 45 VAL C C 45 177.600 177.600 176.577 1.023 25464
3032 1 9 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.538 0.162 25464
3033 1 9 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.663 0.437 25464
3034 1 9 . 1 1 45 45 VAL H H 45 8.720 8.720 8.653 0.067 25464
3035 1 9 . 1 1 46 46 VAL N N 46 120.400 120.400 125.567 -5.167 25464
3036 1 9 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.245 0.435 25464
3037 1 9 . 1 1 46 46 VAL C C 46 174.200 174.200 174.762 -0.562 25464
3038 1 9 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.634 -3.134 25464
3039 1 9 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.325 0.674 25464
3040 1 9 . 1 1 46 46 VAL H H 46 9.060 9.060 8.816 0.244 25464
3041 1 9 . 1 1 47 47 PHE N N 47 121.100 121.100 119.753 1.347 25464
3042 1 9 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.659 -0.209 25464
3043 1 9 . 1 1 47 47 PHE CA C 47 58.700 58.700 55.613 3.087 25464
3044 1 9 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.717 -0.017 25464
3045 1 9 . 1 1 47 47 PHE H H 47 7.680 7.680 8.215 -0.535 25464
3046 1 9 . 1 1 48 48 GLY N N 48 112.600 112.600 112.159 0.441 25464
3047 1 9 . 1 1 48 48 GLY C C 48 174.700 174.700 173.688 1.012 25464
3048 1 9 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.491 -2.491 25464
3049 1 9 . 1 1 48 48 GLY H H 48 7.380 7.380 8.562 -1.182 25464
3050 1 9 . 1 1 49 49 GLU N N 49 120.600 120.600 118.720 1.880 25464
3051 1 9 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.222 0.008 25464
3052 1 9 . 1 1 49 49 GLU C C 49 174.900 174.900 175.172 -0.272 25464
3053 1 9 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.117 -0.818 25464
3054 1 9 . 1 1 49 49 GLU CB C 49 31.200 31.200 27.654 3.546 25464
3055 1 9 . 1 1 49 49 GLU H H 49 8.510 8.510 8.481 0.029 25464
3056 1 9 . 1 1 50 50 ALA N N 50 126.600 126.600 127.197 -0.597 25464
3057 1 9 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.507 0.133 25464
3058 1 9 . 1 1 50 50 ALA C C 50 175.100 175.100 175.416 -0.316 25464
3059 1 9 . 1 1 50 50 ALA CA C 50 51.400 51.400 49.892 1.508 25464
3060 1 9 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.136 1.064 25464
3061 1 9 . 1 1 50 50 ALA H H 50 9.440 9.440 8.525 0.915 25464
3062 1 9 . 1 1 51 51 SER N N 51 115.100 115.100 114.380 0.720 25464
3063 1 9 . 1 1 51 51 SER HA H 51 4.740 4.740 4.251 0.489 25464
3064 1 9 . 1 1 51 51 SER C C 51 175.000 175.000 176.473 -1.473 25464
3065 1 9 . 1 1 51 51 SER CA C 51 58.100 58.100 58.034 0.066 25464
3066 1 9 . 1 1 51 51 SER CB C 51 64.700 64.700 64.027 0.673 25464
3067 1 9 . 1 1 51 51 SER H H 51 8.950 8.950 8.623 0.327 25464
3068 1 9 . 1 1 52 52 ARG N N 52 123.500 123.500 126.074 -2.574 25464
3069 1 9 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.106 -0.696 25464
3070 1 9 . 1 1 52 52 ARG C C 52 178.200 178.200 177.538 0.662 25464
3071 1 9 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.483 1.516 25464
3072 1 9 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.010 -0.110 25464
3073 1 9 . 1 1 52 52 ARG H H 52 9.540 9.540 8.183 1.357 25464
3074 1 9 . 1 1 53 53 ALA N N 53 118.000 118.000 121.300 -3.300 25464
3075 1 9 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.081 -0.051 25464
3076 1 9 . 1 1 53 53 ALA C C 53 181.000 181.000 179.720 1.280 25464
3077 1 9 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.242 0.057 25464
3078 1 9 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.691 0.409 25464
3079 1 9 . 1 1 53 53 ALA H H 53 8.770 8.770 8.314 0.456 25464
3080 1 9 . 1 1 54 54 SER N N 54 115.300 115.300 115.887 -0.587 25464
3081 1 9 . 1 1 54 54 SER HA H 54 4.350 4.350 4.256 0.094 25464
3082 1 9 . 1 1 54 54 SER C C 54 177.500 177.500 176.928 0.572 25464
3083 1 9 . 1 1 54 54 SER CA C 54 61.900 61.900 62.584 -0.684 25464
3084 1 9 . 1 1 54 54 SER CB C 54 63.100 63.100 62.498 0.602 25464
3085 1 9 . 1 1 54 54 SER H H 54 8.140 8.140 8.075 0.065 25464
3086 1 9 . 1 1 55 55 CYS N N 55 121.900 121.900 120.662 1.238 25464
3087 1 9 . 1 1 55 55 CYS HA H 55 4.160 4.160 4.187 -0.027 25464
3088 1 9 . 1 1 55 55 CYS C C 55 176.300 176.300 176.726 -0.426 25464
3089 1 9 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.613 -0.313 25464
3090 1 9 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.263 -0.263 25464
3091 1 9 . 1 1 55 55 CYS H H 55 8.430 8.430 7.933 0.497 25464
3092 1 9 . 1 1 56 56 VAL N N 56 121.100 121.100 120.228 0.872 25464
3093 1 9 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.639 -0.149 25464
3094 1 9 . 1 1 56 56 VAL C C 56 177.800 177.800 178.297 -0.497 25464
3095 1 9 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.802 0.198 25464
3096 1 9 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.030 0.570 25464
3097 1 9 . 1 1 56 56 VAL H H 56 8.750 8.750 8.673 0.077 25464
3098 1 9 . 1 1 57 57 GLU N N 57 119.200 119.200 120.627 -1.427 25464
3099 1 9 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.028 0.042 25464
3100 1 9 . 1 1 57 57 GLU C C 57 177.900 177.900 178.896 -0.996 25464
3101 1 9 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.864 -0.563 25464
3102 1 9 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.730 -0.230 25464
3103 1 9 . 1 1 57 57 GLU H H 57 7.780 7.780 8.378 -0.598 25464
3104 1 9 . 1 1 58 58 TYR N N 58 119.400 119.400 120.742 -1.342 25464
3105 1 9 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.520 -0.630 25464
3106 1 9 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.367 0.833 25464
3107 1 9 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.890 -1.690 25464
3108 1 9 . 1 1 58 58 TYR H H 58 7.700 7.700 8.334 -0.634 25464
3109 1 9 . 1 1 59 59 VAL N N 59 121.500 121.500 118.970 2.530 25464
3110 1 9 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.690 -0.330 25464
3111 1 9 . 1 1 59 59 VAL C C 59 176.300 176.300 178.041 -1.741 25464
3112 1 9 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.586 0.814 25464
3113 1 9 . 1 1 59 59 VAL CB C 59 31.400 31.400 30.922 0.478 25464
3114 1 9 . 1 1 59 59 VAL H H 59 8.380 8.380 8.665 -0.285 25464
3115 1 9 . 1 1 60 60 ASP N N 60 120.000 120.000 118.959 1.041 25464
3116 1 9 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.356 0.054 25464
3117 1 9 . 1 1 60 60 ASP C C 60 178.300 178.300 177.571 0.729 25464
3118 1 9 . 1 1 60 60 ASP CA C 60 57.100 57.100 56.522 0.578 25464
3119 1 9 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.081 -0.481 25464
3120 1 9 . 1 1 60 60 ASP H H 60 8.580 8.580 8.072 0.508 25464
3121 1 9 . 1 1 61 61 GLN N N 61 114.500 114.500 116.206 -1.706 25464
3122 1 9 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.012 -0.002 25464
3123 1 9 . 1 1 61 61 GLN C C 61 176.700 176.700 177.540 -0.840 25464
3124 1 9 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.287 -0.587 25464
3125 1 9 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.187 0.613 25464
3126 1 9 . 1 1 61 61 GLN H H 61 7.810 7.810 7.452 0.358 25464
3127 1 9 . 1 1 62 62 HIS N N 62 115.100 115.100 116.066 -0.966 25464
3128 1 9 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.319 0.061 25464
3129 1 9 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.172 1.128 25464
3130 1 9 . 1 1 62 62 HIS CB C 62 29.000 29.000 28.203 0.797 25464
3131 1 9 . 1 1 62 62 HIS H H 62 7.730 7.730 7.321 0.409 25464
3132 1 9 . 1 1 63 63 TRP N N 63 121.500 121.500 118.514 2.986 25464
3133 1 9 . 1 1 63 63 TRP CA C 63 58.800 58.800 57.859 0.941 25464
3134 1 9 . 1 1 63 63 TRP CB C 63 29.700 29.700 28.859 0.841 25464
3135 1 9 . 1 1 63 63 TRP H H 63 8.180 8.180 7.342 0.838 25464
3136 1 9 . 1 1 64 64 THR N N 64 114.900 114.900 113.950 0.950 25464
3137 1 9 . 1 1 64 64 THR HA H 64 4.180 4.180 4.251 -0.071 25464
3138 1 9 . 1 1 64 64 THR CA C 64 62.100 62.100 64.007 -1.907 25464
3139 1 9 . 1 1 64 64 THR CB C 64 69.500 69.500 69.258 0.242 25464
3140 1 9 . 1 1 64 64 THR H H 64 7.940 7.940 7.647 0.293 25464
3141 1 9 . 1 1 65 65 ASP N N 65 122.900 122.900 119.769 3.131 25464
3142 1 9 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.719 0.681 25464
3143 1 9 . 1 1 65 65 ASP CB C 65 41.100 41.100 43.857 -2.757 25464
3144 1 9 . 1 1 65 65 ASP H H 65 8.340 8.340 8.230 0.110 25464
3145 1 9 . 1 1 66 66 ILE N N 66 122.200 122.200 120.803 1.397 25464
3146 1 9 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.446 -0.286 25464
3147 1 9 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.100 1.000 25464
3148 1 9 . 1 1 66 66 ILE CB C 66 38.500 38.500 40.139 -1.639 25464
3149 1 9 . 1 1 66 66 ILE H H 66 8.250 8.250 8.432 -0.182 25464
3150 1 9 . 1 1 67 67 ARG N N 67 124.000 124.000 125.614 -1.614 25464
3151 1 9 . 1 1 67 67 ARG CA C 67 53.900 53.900 57.937 -4.037 25464
3152 1 9 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.659 1.341 25464
3153 1 9 . 1 1 67 67 ARG H H 67 8.490 8.490 8.741 -0.251 25464
3154 1 9 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.330 0.110 25464
3155 1 9 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.562 -0.462 25464
3156 1 9 . 1 1 68 68 PRO CB C 68 32.100 32.100 30.876 1.224 25464
3157 1 9 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.099 0.231 25464
3158 1 9 . 1 1 69 69 LYS C C 69 175.900 175.900 177.500 -1.600 25464
3159 1 9 . 1 1 69 69 LYS CA C 69 56.300 56.300 57.602 -1.302 25464
3160 1 9 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.324 0.676 25464
3161 1 9 . 1 1 69 69 LYS H H 69 8.270 8.270 8.037 0.233 25464
3162 1 9 . 1 1 70 70 SER N N 70 122.300 122.300 114.890 7.410 25464
3163 1 9 . 1 1 70 70 SER HA H 70 4.580 4.580 4.476 0.104 25464
3164 1 9 . 1 1 70 70 SER CA C 70 59.900 59.900 57.266 2.634 25464
3165 1 9 . 1 1 70 70 SER CB C 70 65.100 65.100 61.494 3.606 25464
3166 1 9 . 1 1 70 70 SER H H 70 8.140 8.140 8.012 0.128 25464
3167 1 9 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.389 -0.069 25464
3168 1 9 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.062 0.338 25464
3169 1 9 . 1 1 75 75 LEU CB C 75 42.100 42.100 41.581 0.519 25464
3170 1 9 . 1 1 76 76 ALA N N 76 124.000 124.000 121.315 2.685 25464
3171 1 9 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.315 0.015 25464
3172 1 9 . 1 1 76 76 ALA CA C 76 52.700 52.700 52.543 0.157 25464
3173 1 9 . 1 1 76 76 ALA CB C 76 19.000 19.000 18.742 0.258 25464
3174 1 9 . 1 1 76 76 ALA H H 76 8.200 8.200 7.923 0.277 25464
3175 1 9 . 1 1 77 77 SER N N 77 114.100 114.100 114.310 -0.210 25464
3176 1 9 . 1 1 77 77 SER HA H 77 4.450 4.450 4.473 -0.023 25464
3177 1 9 . 1 1 77 77 SER CA C 77 58.200 58.200 57.674 0.526 25464
3178 1 9 . 1 1 77 77 SER CB C 77 63.900 63.900 63.578 0.322 25464
3179 1 9 . 1 1 77 77 SER H H 77 8.210 8.210 8.237 -0.027 25464
3180 1 9 . 1 1 78 78 GLY N N 78 110.500 110.500 114.219 -3.719 25464
3181 1 9 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.152 0.248 25464
3182 1 9 . 1 1 78 78 GLY H H 78 8.390 8.390 8.904 -0.514 25464
3183 1 9 . 1 1 79 79 GLN N N 79 119.600 119.600 121.104 -1.504 25464
3184 1 9 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.489 0.111 25464
3185 1 9 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.130 0.470 25464
3186 1 9 . 1 1 79 79 GLN H H 79 8.250 8.250 8.002 0.248 25464
3187 1 10 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.553 -0.093 25464
3188 1 10 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.778 0.622 25464
3189 1 10 . 1 1 2 2 PRO CB C 2 32.100 32.100 30.959 1.141 25464
3190 1 10 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.019 0.081 25464
3191 1 10 . 1 1 10 10 ASP N N 10 121.500 121.500 121.836 -0.336 25464
3192 1 10 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.495 0.105 25464
3193 1 10 . 1 1 10 10 ASP C C 10 175.300 175.300 174.993 0.307 25464
3194 1 10 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.874 -0.374 25464
3195 1 10 . 1 1 10 10 ASP CB C 10 40.900 40.900 39.132 1.768 25464
3196 1 10 . 1 1 10 10 ASP H H 10 8.420 8.420 8.290 0.130 25464
3197 1 10 . 1 1 11 11 ASN N N 11 118.400 118.400 119.291 -0.891 25464
3198 1 10 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.922 0.028 25464
3199 1 10 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.344 -0.545 25464
3200 1 10 . 1 1 11 11 ASN CB C 11 39.100 39.100 41.591 -2.491 25464
3201 1 10 . 1 1 11 11 ASN H H 11 8.270 8.270 8.119 0.151 25464
3202 1 10 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.380 0.000 25464
3203 1 10 . 1 1 12 12 PRO C C 12 177.100 177.100 176.751 0.349 25464
3204 1 10 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.904 -0.204 25464
3205 1 10 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.512 0.388 25464
3206 1 10 . 1 1 13 13 PHE N N 13 117.500 117.500 116.853 0.647 25464
3207 1 10 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.345 0.155 25464
3208 1 10 . 1 1 13 13 PHE C C 13 175.700 175.700 175.826 -0.126 25464
3209 1 10 . 1 1 13 13 PHE CA C 13 58.300 58.300 58.196 0.104 25464
3210 1 10 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.347 0.353 25464
3211 1 10 . 1 1 13 13 PHE H H 13 8.120 8.120 7.286 0.834 25464
3212 1 10 . 1 1 14 14 ASP N N 14 120.000 120.000 117.469 2.531 25464
3213 1 10 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.358 0.262 25464
3214 1 10 . 1 1 14 14 ASP C C 14 175.800 175.800 176.309 -0.509 25464
3215 1 10 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.002 1.398 25464
3216 1 10 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.736 0.664 25464
3217 1 10 . 1 1 14 14 ASP H H 14 8.010 8.010 7.690 0.320 25464
3218 1 10 . 1 1 15 15 ASP N N 15 119.900 119.900 121.024 -1.124 25464
3219 1 10 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.534 0.076 25464
3220 1 10 . 1 1 15 15 ASP C C 15 176.700 176.700 176.806 -0.106 25464
3221 1 10 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.018 -0.518 25464
3222 1 10 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.868 -1.668 25464
3223 1 10 . 1 1 15 15 ASP H H 15 7.900 7.900 7.712 0.188 25464
3224 1 10 . 1 1 16 16 GLU N N 16 122.700 122.700 119.227 3.473 25464
3225 1 10 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.336 -0.106 25464
3226 1 10 . 1 1 16 16 GLU C C 16 176.600 176.600 177.244 -0.644 25464
3227 1 10 . 1 1 16 16 GLU CA C 16 57.400 57.400 57.891 -0.491 25464
3228 1 10 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.214 -0.114 25464
3229 1 10 . 1 1 16 16 GLU H H 16 8.610 8.610 8.766 -0.156 25464
3230 1 10 . 1 1 17 17 ASP N N 17 119.500 119.500 121.821 -2.321 25464
3231 1 10 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.595 0.255 25464
3232 1 10 . 1 1 17 17 ASP C C 17 176.300 176.300 176.520 -0.220 25464
3233 1 10 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.212 -0.912 25464
3234 1 10 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.232 0.368 25464
3235 1 10 . 1 1 17 17 ASP H H 17 8.490 8.490 8.468 0.022 25464
3236 1 10 . 1 1 18 18 GLY N N 18 107.700 107.700 107.621 0.079 25464
3237 1 10 . 1 1 18 18 GLY C C 18 172.700 172.700 173.466 -0.766 25464
3238 1 10 . 1 1 18 18 GLY CA C 18 44.900 44.900 43.782 1.117 25464
3239 1 10 . 1 1 18 18 GLY H H 18 8.070 8.070 7.859 0.211 25464
3240 1 10 . 1 1 19 19 MET N N 19 117.400 117.400 119.861 -2.461 25464
3241 1 10 . 1 1 19 19 MET HA H 19 4.890 4.890 4.469 0.421 25464
3242 1 10 . 1 1 19 19 MET C C 19 176.000 176.000 174.740 1.260 25464
3243 1 10 . 1 1 19 19 MET CA C 19 53.700 53.700 53.569 0.131 25464
3244 1 10 . 1 1 19 19 MET CB C 19 35.100 35.100 31.987 3.113 25464
3245 1 10 . 1 1 19 19 MET H H 19 7.820 7.820 8.229 -0.409 25464
3246 1 10 . 1 1 20 20 PHE N N 20 120.100 120.100 120.379 -0.279 25464
3247 1 10 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.575 0.435 25464
3248 1 10 . 1 1 20 20 PHE C C 20 174.200 174.200 175.119 -0.919 25464
3249 1 10 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.507 1.893 25464
3250 1 10 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.175 3.625 25464
3251 1 10 . 1 1 20 20 PHE H H 20 9.370 9.370 8.632 0.738 25464
3252 1 10 . 1 1 21 21 PHE N N 21 115.200 115.200 116.736 -1.536 25464
3253 1 10 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.417 0.213 25464
3254 1 10 . 1 1 21 21 PHE C C 21 177.500 177.500 174.789 2.711 25464
3255 1 10 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.260 0.240 25464
3256 1 10 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.626 3.474 25464
3257 1 10 . 1 1 21 21 PHE H H 21 9.600 9.600 8.356 1.244 25464
3258 1 10 . 1 1 22 22 VAL N N 22 116.600 116.600 120.578 -3.978 25464
3259 1 10 . 1 1 22 22 VAL C C 22 175.000 175.000 175.733 -0.733 25464
3260 1 10 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.482 1.218 25464
3261 1 10 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.785 0.015 25464
3262 1 10 . 1 1 22 22 VAL H H 22 8.750 8.750 8.592 0.158 25464
3263 1 10 . 1 1 23 23 LEU N N 23 126.500 126.500 127.761 -1.261 25464
3264 1 10 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.520 0.120 25464
3265 1 10 . 1 1 23 23 LEU C C 23 176.200 176.200 175.998 0.202 25464
3266 1 10 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.153 -1.353 25464
3267 1 10 . 1 1 23 23 LEU CB C 23 46.700 46.700 44.869 1.831 25464
3268 1 10 . 1 1 23 23 LEU H H 23 9.530 9.530 9.165 0.365 25464
3269 1 10 . 1 1 24 24 ILE N N 24 117.700 117.700 118.210 -0.510 25464
3270 1 10 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.406 0.284 25464
3271 1 10 . 1 1 24 24 ILE C C 24 174.300 174.300 173.692 0.608 25464
3272 1 10 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.100 -0.200 25464
3273 1 10 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.520 1.080 25464
3274 1 10 . 1 1 24 24 ILE H H 24 9.300 9.300 8.746 0.554 25464
3275 1 10 . 1 1 25 25 ASN N N 25 122.500 122.500 125.402 -2.902 25464
3276 1 10 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.637 0.063 25464
3277 1 10 . 1 1 25 25 ASN C C 25 177.700 177.700 175.740 1.960 25464
3278 1 10 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.827 -1.127 25464
3279 1 10 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.166 -2.566 25464
3280 1 10 . 1 1 25 25 ASN H H 25 7.300 7.300 8.225 -0.924 25464
3281 1 10 . 1 1 26 26 ASP N N 26 118.100 118.100 123.110 -5.010 25464
3282 1 10 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.413 -0.053 25464
3283 1 10 . 1 1 26 26 ASP C C 26 176.700 176.700 176.068 0.632 25464
3284 1 10 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.247 0.253 25464
3285 1 10 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.315 -0.415 25464
3286 1 10 . 1 1 26 26 ASP H H 26 8.340 8.340 8.658 -0.318 25464
3287 1 10 . 1 1 27 27 GLU N N 27 117.600 117.600 117.486 0.114 25464
3288 1 10 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.346 0.194 25464
3289 1 10 . 1 1 27 27 GLU C C 27 175.100 175.100 175.705 -0.605 25464
3290 1 10 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.318 0.382 25464
3291 1 10 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.443 1.057 25464
3292 1 10 . 1 1 27 27 GLU H H 27 7.190 7.190 7.934 -0.744 25464
3293 1 10 . 1 1 28 28 GLU N N 28 112.800 112.800 113.985 -1.185 25464
3294 1 10 . 1 1 28 28 GLU HA H 28 3.590 3.590 4.021 -0.431 25464
3295 1 10 . 1 1 28 28 GLU C C 28 175.200 175.200 175.322 -0.122 25464
3296 1 10 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.556 0.244 25464
3297 1 10 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.066 -0.566 25464
3298 1 10 . 1 1 28 28 GLU H H 28 8.050 8.050 8.007 0.043 25464
3299 1 10 . 1 1 29 29 GLN N N 29 117.200 117.200 117.781 -0.581 25464
3300 1 10 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.111 0.169 25464
3301 1 10 . 1 1 29 29 GLN C C 29 174.600 174.600 175.799 -1.199 25464
3302 1 10 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.850 -0.950 25464
3303 1 10 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.204 0.096 25464
3304 1 10 . 1 1 29 29 GLN H H 29 7.840 7.840 7.613 0.227 25464
3305 1 10 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.720 0.340 25464
3306 1 10 . 1 1 30 30 HIS C C 30 175.900 175.900 175.546 0.354 25464
3307 1 10 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.900 0.800 25464
3308 1 10 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.176 1.724 25464
3309 1 10 . 1 1 31 31 SER N N 31 113.100 113.100 115.443 -2.343 25464
3310 1 10 . 1 1 31 31 SER HA H 31 4.740 4.740 4.710 0.030 25464
3311 1 10 . 1 1 31 31 SER C C 31 173.200 173.200 171.995 1.205 25464
3312 1 10 . 1 1 31 31 SER CA C 31 57.400 57.400 58.592 -1.192 25464
3313 1 10 . 1 1 31 31 SER CB C 31 66.600 66.600 64.078 2.522 25464
3314 1 10 . 1 1 31 31 SER H H 31 8.850 8.850 8.722 0.128 25464
3315 1 10 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.975 0.385 25464
3316 1 10 . 1 1 32 32 LEU C C 32 178.200 178.200 175.246 2.954 25464
3317 1 10 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.673 1.327 25464
3318 1 10 . 1 1 32 32 LEU CB C 32 43.700 43.700 43.157 0.543 25464
3319 1 10 . 1 1 33 33 TRP N N 33 123.400 123.400 130.100 -6.700 25464
3320 1 10 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.979 0.321 25464
3321 1 10 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.276 -0.176 25464
3322 1 10 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.973 1.527 25464
3323 1 10 . 1 1 33 33 TRP H H 33 9.170 9.170 9.417 -0.247 25464
3324 1 10 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.520 -0.710 25464
3325 1 10 . 1 1 34 34 PRO C C 34 177.400 177.400 177.516 -0.116 25464
3326 1 10 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.239 -0.439 25464
3327 1 10 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.246 -1.246 25464
3328 1 10 . 1 1 35 35 THR N N 35 107.700 107.700 114.533 -6.833 25464
3329 1 10 . 1 1 35 35 THR HA H 35 3.730 3.730 4.307 -0.577 25464
3330 1 10 . 1 1 35 35 THR C C 35 176.100 176.100 175.210 0.890 25464
3331 1 10 . 1 1 35 35 THR CA C 35 63.600 63.600 65.045 -1.445 25464
3332 1 10 . 1 1 35 35 THR CB C 35 68.200 68.200 68.525 -0.325 25464
3333 1 10 . 1 1 35 35 THR H H 35 7.260 7.260 7.928 -0.668 25464
3334 1 10 . 1 1 36 36 PHE N N 36 114.500 114.500 117.700 -3.200 25464
3335 1 10 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.517 -0.007 25464
3336 1 10 . 1 1 36 36 PHE C C 36 174.500 174.500 174.812 -0.312 25464
3337 1 10 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.332 -0.432 25464
3338 1 10 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.276 -0.676 25464
3339 1 10 . 1 1 36 36 PHE H H 36 6.770 6.770 7.242 -0.472 25464
3340 1 10 . 1 1 37 37 ALA N N 37 125.300 125.300 121.500 3.800 25464
3341 1 10 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.542 0.168 25464
3342 1 10 . 1 1 37 37 ALA C C 37 177.300 177.300 175.860 1.440 25464
3343 1 10 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.031 -0.831 25464
3344 1 10 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.185 -0.785 25464
3345 1 10 . 1 1 37 37 ALA H H 37 6.950 6.950 7.372 -0.422 25464
3346 1 10 . 1 1 38 38 ASP N N 38 124.500 124.500 120.347 4.153 25464
3347 1 10 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.918 -0.438 25464
3348 1 10 . 1 1 38 38 ASP C C 38 176.700 176.700 175.735 0.965 25464
3349 1 10 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.616 1.384 25464
3350 1 10 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.855 -2.455 25464
3351 1 10 . 1 1 38 38 ASP H H 38 8.870 8.870 8.667 0.203 25464
3352 1 10 . 1 1 39 39 VAL N N 39 126.000 126.000 123.889 2.111 25464
3353 1 10 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.628 -0.268 25464
3354 1 10 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.190 0.910 25464
3355 1 10 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.064 1.136 25464
3356 1 10 . 1 1 39 39 VAL H H 39 8.650 8.650 8.508 0.142 25464
3357 1 10 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.416 -0.166 25464
3358 1 10 . 1 1 40 40 PRO C C 40 175.800 175.800 176.296 -0.496 25464
3359 1 10 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.616 -0.416 25464
3360 1 10 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.903 -0.203 25464
3361 1 10 . 1 1 41 41 ALA N N 41 122.700 122.700 125.268 -2.568 25464
3362 1 10 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.066 0.114 25464
3363 1 10 . 1 1 41 41 ALA C C 41 179.000 179.000 178.731 0.269 25464
3364 1 10 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.493 -0.193 25464
3365 1 10 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.027 -0.727 25464
3366 1 10 . 1 1 41 41 ALA H H 41 8.280 8.280 8.413 -0.133 25464
3367 1 10 . 1 1 42 42 GLY N N 42 109.800 109.800 111.625 -1.825 25464
3368 1 10 . 1 1 42 42 GLY C C 42 173.800 173.800 174.059 -0.259 25464
3369 1 10 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.867 -0.167 25464
3370 1 10 . 1 1 42 42 GLY H H 42 8.770 8.770 8.318 0.452 25464
3371 1 10 . 1 1 43 43 TRP N N 43 120.300 120.300 122.684 -2.384 25464
3372 1 10 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.280 -0.330 25464
3373 1 10 . 1 1 43 43 TRP C C 43 174.900 174.900 176.234 -1.334 25464
3374 1 10 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.684 -0.984 25464
3375 1 10 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.270 1.730 25464
3376 1 10 . 1 1 43 43 TRP H H 43 7.740 7.740 7.971 -0.231 25464
3377 1 10 . 1 1 44 44 ARG N N 44 117.700 117.700 122.120 -4.420 25464
3378 1 10 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.761 -0.041 25464
3379 1 10 . 1 1 44 44 ARG C C 44 174.900 174.900 175.082 -0.182 25464
3380 1 10 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.370 -0.470 25464
3381 1 10 . 1 1 44 44 ARG CB C 44 33.200 33.200 33.076 0.124 25464
3382 1 10 . 1 1 44 44 ARG H H 44 8.990 8.990 8.938 0.052 25464
3383 1 10 . 1 1 45 45 VAL N N 45 122.800 122.800 124.689 -1.889 25464
3384 1 10 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.143 -0.163 25464
3385 1 10 . 1 1 45 45 VAL C C 45 177.600 177.600 176.635 0.965 25464
3386 1 10 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.454 0.246 25464
3387 1 10 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.818 1.282 25464
3388 1 10 . 1 1 45 45 VAL H H 45 8.720 8.720 8.673 0.047 25464
3389 1 10 . 1 1 46 46 VAL N N 46 120.400 120.400 125.446 -5.046 25464
3390 1 10 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.339 0.341 25464
3391 1 10 . 1 1 46 46 VAL C C 46 174.200 174.200 175.357 -1.157 25464
3392 1 10 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.357 -2.857 25464
3393 1 10 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.870 1.130 25464
3394 1 10 . 1 1 46 46 VAL H H 46 9.060 9.060 8.804 0.256 25464
3395 1 10 . 1 1 47 47 PHE N N 47 121.100 121.100 122.326 -1.226 25464
3396 1 10 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.678 -0.228 25464
3397 1 10 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.655 2.045 25464
3398 1 10 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.479 0.221 25464
3399 1 10 . 1 1 47 47 PHE H H 47 7.680 7.680 8.264 -0.584 25464
3400 1 10 . 1 1 48 48 GLY N N 48 112.600 112.600 112.717 -0.117 25464
3401 1 10 . 1 1 48 48 GLY C C 48 174.700 174.700 173.884 0.816 25464
3402 1 10 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.339 -2.339 25464
3403 1 10 . 1 1 48 48 GLY H H 48 7.380 7.380 8.363 -0.983 25464
3404 1 10 . 1 1 49 49 GLU N N 49 120.600 120.600 119.319 1.281 25464
3405 1 10 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.376 -0.146 25464
3406 1 10 . 1 1 49 49 GLU C C 49 174.900 174.900 175.340 -0.440 25464
3407 1 10 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.493 -1.193 25464
3408 1 10 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.510 2.690 25464
3409 1 10 . 1 1 49 49 GLU H H 49 8.510 8.510 8.657 -0.147 25464
3410 1 10 . 1 1 50 50 ALA N N 50 126.600 126.600 128.330 -1.730 25464
3411 1 10 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.713 -0.073 25464
3412 1 10 . 1 1 50 50 ALA C C 50 175.100 175.100 176.056 -0.956 25464
3413 1 10 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.393 1.007 25464
3414 1 10 . 1 1 50 50 ALA CB C 50 23.200 23.200 23.198 0.002 25464
3415 1 10 . 1 1 50 50 ALA H H 50 9.440 9.440 8.876 0.564 25464
3416 1 10 . 1 1 51 51 SER N N 51 115.100 115.100 114.365 0.735 25464
3417 1 10 . 1 1 51 51 SER HA H 51 4.740 4.740 4.090 0.650 25464
3418 1 10 . 1 1 51 51 SER C C 51 175.000 175.000 175.996 -0.996 25464
3419 1 10 . 1 1 51 51 SER CA C 51 58.100 58.100 58.681 -0.582 25464
3420 1 10 . 1 1 51 51 SER CB C 51 64.700 64.700 63.909 0.791 25464
3421 1 10 . 1 1 51 51 SER H H 51 8.950 8.950 8.748 0.202 25464
3422 1 10 . 1 1 52 52 ARG N N 52 123.500 123.500 128.807 -5.307 25464
3423 1 10 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.983 -0.573 25464
3424 1 10 . 1 1 52 52 ARG C C 52 178.200 178.200 177.480 0.720 25464
3425 1 10 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.374 1.626 25464
3426 1 10 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.030 -0.130 25464
3427 1 10 . 1 1 52 52 ARG H H 52 9.540 9.540 8.490 1.050 25464
3428 1 10 . 1 1 53 53 ALA N N 53 118.000 118.000 120.113 -2.113 25464
3429 1 10 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.107 -0.077 25464
3430 1 10 . 1 1 53 53 ALA C C 53 181.000 181.000 179.995 1.005 25464
3431 1 10 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.162 0.138 25464
3432 1 10 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.843 0.258 25464
3433 1 10 . 1 1 53 53 ALA H H 53 8.770 8.770 7.957 0.813 25464
3434 1 10 . 1 1 54 54 SER N N 54 115.300 115.300 115.219 0.081 25464
3435 1 10 . 1 1 54 54 SER HA H 54 4.350 4.350 4.204 0.146 25464
3436 1 10 . 1 1 54 54 SER C C 54 177.500 177.500 176.580 0.920 25464
3437 1 10 . 1 1 54 54 SER CA C 54 61.900 61.900 61.725 0.175 25464
3438 1 10 . 1 1 54 54 SER CB C 54 63.100 63.100 62.572 0.528 25464
3439 1 10 . 1 1 54 54 SER H H 54 8.140 8.140 7.735 0.405 25464
3440 1 10 . 1 1 55 55 CYS N N 55 121.900 121.900 120.166 1.734 25464
3441 1 10 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.510 0.650 25464
3442 1 10 . 1 1 55 55 CYS C C 55 176.300 176.300 176.614 -0.314 25464
3443 1 10 . 1 1 55 55 CYS CA C 55 64.300 64.300 63.840 0.460 25464
3444 1 10 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.870 0.130 25464
3445 1 10 . 1 1 55 55 CYS H H 55 8.430 8.430 7.689 0.741 25464
3446 1 10 . 1 1 56 56 VAL N N 56 121.100 121.100 120.144 0.956 25464
3447 1 10 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.540 -0.050 25464
3448 1 10 . 1 1 56 56 VAL C C 56 177.800 177.800 178.127 -0.327 25464
3449 1 10 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.724 0.276 25464
3450 1 10 . 1 1 56 56 VAL CB C 56 31.600 31.600 30.860 0.740 25464
3451 1 10 . 1 1 56 56 VAL H H 56 8.750 8.750 8.554 0.196 25464
3452 1 10 . 1 1 57 57 GLU N N 57 119.200 119.200 120.706 -1.506 25464
3453 1 10 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.927 0.143 25464
3454 1 10 . 1 1 57 57 GLU C C 57 177.900 177.900 178.863 -0.963 25464
3455 1 10 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.774 -0.474 25464
3456 1 10 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.593 -0.093 25464
3457 1 10 . 1 1 57 57 GLU H H 57 7.780 7.780 8.084 -0.304 25464
3458 1 10 . 1 1 58 58 TYR N N 58 119.400 119.400 120.231 -0.831 25464
3459 1 10 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.306 -0.416 25464
3460 1 10 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.368 0.832 25464
3461 1 10 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.882 -1.682 25464
3462 1 10 . 1 1 58 58 TYR H H 58 7.700 7.700 7.981 -0.281 25464
3463 1 10 . 1 1 59 59 VAL N N 59 121.500 121.500 118.740 2.760 25464
3464 1 10 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.358 0.002 25464
3465 1 10 . 1 1 59 59 VAL C C 59 176.300 176.300 177.384 -1.084 25464
3466 1 10 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.239 1.161 25464
3467 1 10 . 1 1 59 59 VAL CB C 59 31.400 31.400 30.706 0.694 25464
3468 1 10 . 1 1 59 59 VAL H H 59 8.380 8.380 8.289 0.091 25464
3469 1 10 . 1 1 60 60 ASP N N 60 120.000 120.000 117.652 2.348 25464
3470 1 10 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.341 0.069 25464
3471 1 10 . 1 1 60 60 ASP C C 60 178.300 178.300 179.032 -0.732 25464
3472 1 10 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.198 -0.098 25464
3473 1 10 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.196 -0.596 25464
3474 1 10 . 1 1 60 60 ASP H H 60 8.580 8.580 8.178 0.402 25464
3475 1 10 . 1 1 61 61 GLN N N 61 114.500 114.500 118.075 -3.575 25464
3476 1 10 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.168 -0.158 25464
3477 1 10 . 1 1 61 61 GLN C C 61 176.700 176.700 178.252 -1.552 25464
3478 1 10 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.075 -1.375 25464
3479 1 10 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.697 0.103 25464
3480 1 10 . 1 1 61 61 GLN H H 61 7.810 7.810 7.620 0.190 25464
3481 1 10 . 1 1 62 62 HIS N N 62 115.100 115.100 120.914 -5.814 25464
3482 1 10 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.818 -0.438 25464
3483 1 10 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.742 1.558 25464
3484 1 10 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.438 -0.438 25464
3485 1 10 . 1 1 62 62 HIS H H 62 7.730 7.730 7.980 -0.250 25464
3486 1 10 . 1 1 63 63 TRP N N 63 121.500 121.500 122.783 -1.283 25464
3487 1 10 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.141 -0.341 25464
3488 1 10 . 1 1 63 63 TRP CB C 63 29.700 29.700 30.167 -0.467 25464
3489 1 10 . 1 1 63 63 TRP H H 63 8.180 8.180 7.627 0.553 25464
3490 1 10 . 1 1 64 64 THR N N 64 114.900 114.900 110.635 4.265 25464
3491 1 10 . 1 1 64 64 THR HA H 64 4.180 4.180 4.227 -0.047 25464
3492 1 10 . 1 1 64 64 THR CA C 64 62.100 62.100 61.661 0.439 25464
3493 1 10 . 1 1 64 64 THR CB C 64 69.500 69.500 68.968 0.532 25464
3494 1 10 . 1 1 64 64 THR H H 64 7.940 7.940 7.681 0.259 25464
3495 1 10 . 1 1 65 65 ASP N N 65 122.900 122.900 123.493 -0.593 25464
3496 1 10 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.588 -0.188 25464
3497 1 10 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.248 -0.148 25464
3498 1 10 . 1 1 65 65 ASP H H 65 8.340 8.340 7.407 0.933 25464
3499 1 10 . 1 1 66 66 ILE N N 66 122.200 122.200 121.296 0.904 25464
3500 1 10 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.199 -0.039 25464
3501 1 10 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.683 0.417 25464
3502 1 10 . 1 1 66 66 ILE CB C 66 38.500 38.500 40.758 -2.258 25464
3503 1 10 . 1 1 66 66 ILE H H 66 8.250 8.250 8.434 -0.184 25464
3504 1 10 . 1 1 67 67 ARG N N 67 124.000 124.000 126.515 -2.515 25464
3505 1 10 . 1 1 67 67 ARG CA C 67 53.900 53.900 56.253 -2.353 25464
3506 1 10 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.387 1.613 25464
3507 1 10 . 1 1 67 67 ARG H H 67 8.490 8.490 8.741 -0.251 25464
3508 1 10 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.244 0.196 25464
3509 1 10 . 1 1 68 68 PRO CA C 68 63.100 63.100 64.930 -1.830 25464
3510 1 10 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.916 0.184 25464
3511 1 10 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.343 -0.013 25464
3512 1 10 . 1 1 69 69 LYS C C 69 175.900 175.900 174.735 1.165 25464
3513 1 10 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.072 0.229 25464
3514 1 10 . 1 1 69 69 LYS CB C 69 33.000 33.000 33.544 -0.544 25464
3515 1 10 . 1 1 69 69 LYS H H 69 8.270 8.270 8.243 0.027 25464
3516 1 10 . 1 1 70 70 SER N N 70 122.300 122.300 114.692 7.608 25464
3517 1 10 . 1 1 70 70 SER HA H 70 4.580 4.580 4.595 -0.015 25464
3518 1 10 . 1 1 70 70 SER CA C 70 59.900 59.900 57.766 2.134 25464
3519 1 10 . 1 1 70 70 SER CB C 70 65.100 65.100 65.153 -0.053 25464
3520 1 10 . 1 1 70 70 SER H H 70 8.140 8.140 7.997 0.143 25464
3521 1 10 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.312 0.008 25464
3522 1 10 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.797 0.604 25464
3523 1 10 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.612 -0.512 25464
3524 1 10 . 1 1 76 76 ALA N N 76 124.000 124.000 126.684 -2.684 25464
3525 1 10 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.468 -0.138 25464
3526 1 10 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.554 1.146 25464
3527 1 10 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.499 -0.499 25464
3528 1 10 . 1 1 76 76 ALA H H 76 8.200 8.200 8.265 -0.065 25464
3529 1 10 . 1 1 77 77 SER N N 77 114.100 114.100 118.980 -4.880 25464
3530 1 10 . 1 1 77 77 SER HA H 77 4.450 4.450 4.431 0.019 25464
3531 1 10 . 1 1 77 77 SER CA C 77 58.200 58.200 58.004 0.196 25464
3532 1 10 . 1 1 77 77 SER CB C 77 63.900 63.900 62.826 1.074 25464
3533 1 10 . 1 1 77 77 SER H H 77 8.210 8.210 8.723 -0.513 25464
3534 1 10 . 1 1 78 78 GLY N N 78 110.500 110.500 113.700 -3.200 25464
3535 1 10 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.652 0.748 25464
3536 1 10 . 1 1 78 78 GLY H H 78 8.390 8.390 8.101 0.289 25464
3537 1 10 . 1 1 79 79 GLN N N 79 119.600 119.600 118.907 0.693 25464
3538 1 10 . 1 1 79 79 GLN CA C 79 55.600 55.600 56.998 -1.398 25464
3539 1 10 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.094 -0.494 25464
3540 1 10 . 1 1 79 79 GLN H H 79 8.250 8.250 9.315 -1.065 25464
3541 1 11 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.460 0.000 25464
3542 1 11 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.080 1.320 25464
3543 1 11 . 1 1 2 2 PRO CB C 2 32.100 32.100 30.528 1.572 25464
3544 1 11 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.054 0.046 25464
3545 1 11 . 1 1 10 10 ASP N N 10 121.500 121.500 121.384 0.116 25464
3546 1 11 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.770 -0.170 25464
3547 1 11 . 1 1 10 10 ASP C C 10 175.300 175.300 174.374 0.926 25464
3548 1 11 . 1 1 10 10 ASP CA C 10 54.500 54.500 53.402 1.098 25464
3549 1 11 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.615 -0.715 25464
3550 1 11 . 1 1 10 10 ASP H H 10 8.420 8.420 7.910 0.510 25464
3551 1 11 . 1 1 11 11 ASN N N 11 118.400 118.400 121.363 -2.963 25464
3552 1 11 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.931 0.019 25464
3553 1 11 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.638 -0.838 25464
3554 1 11 . 1 1 11 11 ASN CB C 11 39.100 39.100 39.695 -0.595 25464
3555 1 11 . 1 1 11 11 ASN H H 11 8.270 8.270 8.291 -0.021 25464
3556 1 11 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.960 -0.580 25464
3557 1 11 . 1 1 12 12 PRO C C 12 177.100 177.100 175.387 1.713 25464
3558 1 11 . 1 1 12 12 PRO CA C 12 63.700 63.700 62.483 1.217 25464
3559 1 11 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.197 0.703 25464
3560 1 11 . 1 1 13 13 PHE N N 13 117.500 117.500 116.655 0.845 25464
3561 1 11 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.442 0.058 25464
3562 1 11 . 1 1 13 13 PHE C C 13 175.700 175.700 174.947 0.753 25464
3563 1 11 . 1 1 13 13 PHE CA C 13 58.300 58.300 58.520 -0.220 25464
3564 1 11 . 1 1 13 13 PHE CB C 13 38.700 38.700 39.005 -0.305 25464
3565 1 11 . 1 1 13 13 PHE H H 13 8.120 8.120 7.651 0.469 25464
3566 1 11 . 1 1 14 14 ASP N N 14 120.000 120.000 117.935 2.065 25464
3567 1 11 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.588 0.032 25464
3568 1 11 . 1 1 14 14 ASP C C 14 175.800 175.800 175.542 0.258 25464
3569 1 11 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.137 0.263 25464
3570 1 11 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.948 -0.548 25464
3571 1 11 . 1 1 14 14 ASP H H 14 8.010 8.010 7.459 0.551 25464
3572 1 11 . 1 1 15 15 ASP N N 15 119.900 119.900 119.619 0.281 25464
3573 1 11 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.605 0.005 25464
3574 1 11 . 1 1 15 15 ASP C C 15 176.700 176.700 177.606 -0.906 25464
3575 1 11 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.734 -1.234 25464
3576 1 11 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.053 -0.853 25464
3577 1 11 . 1 1 15 15 ASP H H 15 7.900 7.900 8.167 -0.267 25464
3578 1 11 . 1 1 16 16 GLU N N 16 122.700 122.700 121.923 0.777 25464
3579 1 11 . 1 1 16 16 GLU HA H 16 4.230 4.230 3.982 0.248 25464
3580 1 11 . 1 1 16 16 GLU C C 16 176.600 176.600 177.260 -0.660 25464
3581 1 11 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.997 -1.597 25464
3582 1 11 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.564 0.536 25464
3583 1 11 . 1 1 16 16 GLU H H 16 8.610 8.610 8.851 -0.241 25464
3584 1 11 . 1 1 17 17 ASP N N 17 119.500 119.500 117.937 1.563 25464
3585 1 11 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.446 0.404 25464
3586 1 11 . 1 1 17 17 ASP C C 17 176.300 176.300 176.987 -0.687 25464
3587 1 11 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.401 -0.101 25464
3588 1 11 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.368 1.232 25464
3589 1 11 . 1 1 17 17 ASP H H 17 8.490 8.490 8.312 0.178 25464
3590 1 11 . 1 1 18 18 GLY N N 18 107.700 107.700 108.122 -0.422 25464
3591 1 11 . 1 1 18 18 GLY C C 18 172.700 172.700 172.673 0.027 25464
3592 1 11 . 1 1 18 18 GLY CA C 18 44.900 44.900 43.964 0.936 25464
3593 1 11 . 1 1 18 18 GLY H H 18 8.070 8.070 7.475 0.595 25464
3594 1 11 . 1 1 19 19 MET N N 19 117.400 117.400 120.199 -2.799 25464
3595 1 11 . 1 1 19 19 MET HA H 19 4.890 4.890 4.675 0.215 25464
3596 1 11 . 1 1 19 19 MET C C 19 176.000 176.000 174.882 1.118 25464
3597 1 11 . 1 1 19 19 MET CA C 19 53.700 53.700 53.994 -0.294 25464
3598 1 11 . 1 1 19 19 MET CB C 19 35.100 35.100 32.622 2.478 25464
3599 1 11 . 1 1 19 19 MET H H 19 7.820 7.820 8.276 -0.456 25464
3600 1 11 . 1 1 20 20 PHE N N 20 120.100 120.100 120.625 -0.525 25464
3601 1 11 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.643 0.367 25464
3602 1 11 . 1 1 20 20 PHE C C 20 174.200 174.200 174.690 -0.490 25464
3603 1 11 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.294 2.106 25464
3604 1 11 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.266 3.534 25464
3605 1 11 . 1 1 20 20 PHE H H 20 9.370 9.370 8.801 0.569 25464
3606 1 11 . 1 1 21 21 PHE N N 21 115.200 115.200 115.932 -0.732 25464
3607 1 11 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.337 0.293 25464
3608 1 11 . 1 1 21 21 PHE C C 21 177.500 177.500 174.875 2.625 25464
3609 1 11 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.237 0.263 25464
3610 1 11 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.604 3.496 25464
3611 1 11 . 1 1 21 21 PHE H H 21 9.600 9.600 8.466 1.134 25464
3612 1 11 . 1 1 22 22 VAL N N 22 116.600 116.600 121.122 -4.522 25464
3613 1 11 . 1 1 22 22 VAL C C 22 175.000 175.000 175.195 -0.195 25464
3614 1 11 . 1 1 22 22 VAL CA C 22 62.700 62.700 62.078 0.622 25464
3615 1 11 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.598 0.202 25464
3616 1 11 . 1 1 22 22 VAL H H 22 8.750 8.750 8.638 0.112 25464
3617 1 11 . 1 1 23 23 LEU N N 23 126.500 126.500 128.159 -1.659 25464
3618 1 11 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.539 0.101 25464
3619 1 11 . 1 1 23 23 LEU C C 23 176.200 176.200 175.538 0.662 25464
3620 1 11 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.406 -1.606 25464
3621 1 11 . 1 1 23 23 LEU CB C 23 46.700 46.700 46.084 0.616 25464
3622 1 11 . 1 1 23 23 LEU H H 23 9.530 9.530 8.682 0.848 25464
3623 1 11 . 1 1 24 24 ILE N N 24 117.700 117.700 118.248 -0.548 25464
3624 1 11 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.485 0.205 25464
3625 1 11 . 1 1 24 24 ILE C C 24 174.300 174.300 173.655 0.645 25464
3626 1 11 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.057 -0.157 25464
3627 1 11 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.958 0.642 25464
3628 1 11 . 1 1 24 24 ILE H H 24 9.300 9.300 9.128 0.172 25464
3629 1 11 . 1 1 25 25 ASN N N 25 122.500 122.500 124.103 -1.603 25464
3630 1 11 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.935 -0.235 25464
3631 1 11 . 1 1 25 25 ASN C C 25 177.700 177.700 175.684 2.016 25464
3632 1 11 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.444 -1.744 25464
3633 1 11 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.407 -2.807 25464
3634 1 11 . 1 1 25 25 ASN H H 25 7.300 7.300 8.787 -1.487 25464
3635 1 11 . 1 1 26 26 ASP N N 26 118.100 118.100 124.252 -6.152 25464
3636 1 11 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.383 -0.023 25464
3637 1 11 . 1 1 26 26 ASP C C 26 176.700 176.700 176.635 0.065 25464
3638 1 11 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.783 -0.283 25464
3639 1 11 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.902 -1.002 25464
3640 1 11 . 1 1 26 26 ASP H H 26 8.340 8.340 8.948 -0.608 25464
3641 1 11 . 1 1 27 27 GLU N N 27 117.600 117.600 118.071 -0.471 25464
3642 1 11 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.271 0.269 25464
3643 1 11 . 1 1 27 27 GLU C C 27 175.100 175.100 175.613 -0.513 25464
3644 1 11 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.631 -0.931 25464
3645 1 11 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.442 1.058 25464
3646 1 11 . 1 1 27 27 GLU H H 27 7.190 7.190 8.328 -1.138 25464
3647 1 11 . 1 1 28 28 GLU N N 28 112.800 112.800 113.858 -1.058 25464
3648 1 11 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.982 -0.392 25464
3649 1 11 . 1 1 28 28 GLU C C 28 175.200 175.200 175.012 0.188 25464
3650 1 11 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.207 0.593 25464
3651 1 11 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.706 -1.206 25464
3652 1 11 . 1 1 28 28 GLU H H 28 8.050 8.050 8.086 -0.036 25464
3653 1 11 . 1 1 29 29 GLN N N 29 117.200 117.200 118.703 -1.503 25464
3654 1 11 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.301 -0.021 25464
3655 1 11 . 1 1 29 29 GLN C C 29 174.600 174.600 175.594 -0.994 25464
3656 1 11 . 1 1 29 29 GLN CA C 29 54.900 54.900 54.553 0.347 25464
3657 1 11 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.428 -0.128 25464
3658 1 11 . 1 1 29 29 GLN H H 29 7.840 7.840 7.530 0.310 25464
3659 1 11 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.504 0.556 25464
3660 1 11 . 1 1 30 30 HIS C C 30 175.900 175.900 174.898 1.002 25464
3661 1 11 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.887 0.813 25464
3662 1 11 . 1 1 30 30 HIS CB C 30 32.900 32.900 30.785 2.115 25464
3663 1 11 . 1 1 31 31 SER N N 31 113.100 113.100 116.410 -3.310 25464
3664 1 11 . 1 1 31 31 SER HA H 31 4.740 4.740 4.724 0.016 25464
3665 1 11 . 1 1 31 31 SER C C 31 173.200 173.200 172.631 0.569 25464
3666 1 11 . 1 1 31 31 SER CA C 31 57.400 57.400 57.360 0.040 25464
3667 1 11 . 1 1 31 31 SER CB C 31 66.600 66.600 65.586 1.014 25464
3668 1 11 . 1 1 31 31 SER H H 31 8.850 8.850 9.332 -0.482 25464
3669 1 11 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.009 0.351 25464
3670 1 11 . 1 1 32 32 LEU C C 32 178.200 178.200 174.513 3.687 25464
3671 1 11 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.803 1.197 25464
3672 1 11 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.783 -2.083 25464
3673 1 11 . 1 1 33 33 TRP N N 33 123.400 123.400 128.513 -5.113 25464
3674 1 11 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.886 0.414 25464
3675 1 11 . 1 1 33 33 TRP CA C 33 54.100 54.100 53.993 0.107 25464
3676 1 11 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.307 2.193 25464
3677 1 11 . 1 1 33 33 TRP H H 33 9.170 9.170 9.220 -0.050 25464
3678 1 11 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.600 -0.790 25464
3679 1 11 . 1 1 34 34 PRO C C 34 177.400 177.400 177.596 -0.196 25464
3680 1 11 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.267 -0.468 25464
3681 1 11 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.419 -1.419 25464
3682 1 11 . 1 1 35 35 THR N N 35 107.700 107.700 115.318 -7.618 25464
3683 1 11 . 1 1 35 35 THR HA H 35 3.730 3.730 4.417 -0.687 25464
3684 1 11 . 1 1 35 35 THR C C 35 176.100 176.100 175.316 0.784 25464
3685 1 11 . 1 1 35 35 THR CA C 35 63.600 63.600 65.092 -1.492 25464
3686 1 11 . 1 1 35 35 THR CB C 35 68.200 68.200 68.272 -0.072 25464
3687 1 11 . 1 1 35 35 THR H H 35 7.260 7.260 8.127 -0.867 25464
3688 1 11 . 1 1 36 36 PHE N N 36 114.500 114.500 119.098 -4.598 25464
3689 1 11 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.562 -0.052 25464
3690 1 11 . 1 1 36 36 PHE C C 36 174.500 174.500 175.313 -0.813 25464
3691 1 11 . 1 1 36 36 PHE CA C 36 56.900 56.900 58.512 -1.612 25464
3692 1 11 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.717 -1.117 25464
3693 1 11 . 1 1 36 36 PHE H H 36 6.770 6.770 7.536 -0.766 25464
3694 1 11 . 1 1 37 37 ALA N N 37 125.300 125.300 121.743 3.557 25464
3695 1 11 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.678 0.032 25464
3696 1 11 . 1 1 37 37 ALA C C 37 177.300 177.300 175.412 1.888 25464
3697 1 11 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.991 -0.791 25464
3698 1 11 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.195 -0.795 25464
3699 1 11 . 1 1 37 37 ALA H H 37 6.950 6.950 7.311 -0.361 25464
3700 1 11 . 1 1 38 38 ASP N N 38 124.500 124.500 120.534 3.966 25464
3701 1 11 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.803 -0.323 25464
3702 1 11 . 1 1 38 38 ASP C C 38 176.700 176.700 176.763 -0.063 25464
3703 1 11 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.423 1.577 25464
3704 1 11 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.509 -2.109 25464
3705 1 11 . 1 1 38 38 ASP H H 38 8.870 8.870 8.619 0.251 25464
3706 1 11 . 1 1 39 39 VAL N N 39 126.000 126.000 123.289 2.711 25464
3707 1 11 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.875 -0.515 25464
3708 1 11 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.972 -0.872 25464
3709 1 11 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.960 0.239 25464
3710 1 11 . 1 1 39 39 VAL H H 39 8.650 8.650 8.396 0.254 25464
3711 1 11 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.316 -0.066 25464
3712 1 11 . 1 1 40 40 PRO C C 40 175.800 175.800 176.396 -0.596 25464
3713 1 11 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.343 -0.143 25464
3714 1 11 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.607 0.093 25464
3715 1 11 . 1 1 41 41 ALA N N 41 122.700 122.700 126.981 -4.281 25464
3716 1 11 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.015 0.165 25464
3717 1 11 . 1 1 41 41 ALA C C 41 179.000 179.000 178.707 0.293 25464
3718 1 11 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.614 -0.314 25464
3719 1 11 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.923 -0.623 25464
3720 1 11 . 1 1 41 41 ALA H H 41 8.280 8.280 8.510 -0.230 25464
3721 1 11 . 1 1 42 42 GLY N N 42 109.800 109.800 111.708 -1.908 25464
3722 1 11 . 1 1 42 42 GLY C C 42 173.800 173.800 173.589 0.211 25464
3723 1 11 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.770 -0.070 25464
3724 1 11 . 1 1 42 42 GLY H H 42 8.770 8.770 8.298 0.472 25464
3725 1 11 . 1 1 43 43 TRP N N 43 120.300 120.300 120.911 -0.611 25464
3726 1 11 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.089 -0.139 25464
3727 1 11 . 1 1 43 43 TRP C C 43 174.900 174.900 175.721 -0.821 25464
3728 1 11 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.369 -0.669 25464
3729 1 11 . 1 1 43 43 TRP CB C 43 32.000 32.000 31.197 0.803 25464
3730 1 11 . 1 1 43 43 TRP H H 43 7.740 7.740 7.864 -0.124 25464
3731 1 11 . 1 1 44 44 ARG N N 44 117.700 117.700 120.175 -2.475 25464
3732 1 11 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.845 -0.125 25464
3733 1 11 . 1 1 44 44 ARG C C 44 174.900 174.900 174.855 0.045 25464
3734 1 11 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.709 -0.809 25464
3735 1 11 . 1 1 44 44 ARG CB C 44 33.200 33.200 33.521 -0.321 25464
3736 1 11 . 1 1 44 44 ARG H H 44 8.990 8.990 9.156 -0.166 25464
3737 1 11 . 1 1 45 45 VAL N N 45 122.800 122.800 125.594 -2.794 25464
3738 1 11 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.252 -0.272 25464
3739 1 11 . 1 1 45 45 VAL C C 45 177.600 177.600 176.536 1.064 25464
3740 1 11 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.239 0.461 25464
3741 1 11 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.800 0.300 25464
3742 1 11 . 1 1 45 45 VAL H H 45 8.720 8.720 8.723 -0.003 25464
3743 1 11 . 1 1 46 46 VAL N N 46 120.400 120.400 124.735 -4.335 25464
3744 1 11 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.246 0.434 25464
3745 1 11 . 1 1 46 46 VAL C C 46 174.200 174.200 175.498 -1.298 25464
3746 1 11 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.288 -2.788 25464
3747 1 11 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.975 1.025 25464
3748 1 11 . 1 1 46 46 VAL H H 46 9.060 9.060 8.766 0.294 25464
3749 1 11 . 1 1 47 47 PHE N N 47 121.100 121.100 122.187 -1.087 25464
3750 1 11 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.682 -0.232 25464
3751 1 11 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.284 2.416 25464
3752 1 11 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.289 0.411 25464
3753 1 11 . 1 1 47 47 PHE H H 47 7.680 7.680 8.260 -0.580 25464
3754 1 11 . 1 1 48 48 GLY N N 48 112.600 112.600 113.050 -0.450 25464
3755 1 11 . 1 1 48 48 GLY C C 48 174.700 174.700 173.842 0.858 25464
3756 1 11 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.698 -2.698 25464
3757 1 11 . 1 1 48 48 GLY H H 48 7.380 7.380 8.411 -1.031 25464
3758 1 11 . 1 1 49 49 GLU N N 49 120.600 120.600 118.385 2.215 25464
3759 1 11 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.271 -0.041 25464
3760 1 11 . 1 1 49 49 GLU C C 49 174.900 174.900 175.787 -0.887 25464
3761 1 11 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.330 -1.030 25464
3762 1 11 . 1 1 49 49 GLU CB C 49 31.200 31.200 29.020 2.180 25464
3763 1 11 . 1 1 49 49 GLU H H 49 8.510 8.510 8.410 0.100 25464
3764 1 11 . 1 1 50 50 ALA N N 50 126.600 126.600 127.702 -1.102 25464
3765 1 11 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.698 -0.058 25464
3766 1 11 . 1 1 50 50 ALA C C 50 175.100 175.100 175.688 -0.588 25464
3767 1 11 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.739 0.661 25464
3768 1 11 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.622 0.578 25464
3769 1 11 . 1 1 50 50 ALA H H 50 9.440 9.440 8.561 0.879 25464
3770 1 11 . 1 1 51 51 SER N N 51 115.100 115.100 115.716 -0.616 25464
3771 1 11 . 1 1 51 51 SER HA H 51 4.740 4.740 4.082 0.658 25464
3772 1 11 . 1 1 51 51 SER C C 51 175.000 175.000 175.631 -0.631 25464
3773 1 11 . 1 1 51 51 SER CA C 51 58.100 58.100 58.535 -0.435 25464
3774 1 11 . 1 1 51 51 SER CB C 51 64.700 64.700 63.604 1.096 25464
3775 1 11 . 1 1 51 51 SER H H 51 8.950 8.950 8.764 0.186 25464
3776 1 11 . 1 1 52 52 ARG N N 52 123.500 123.500 126.707 -3.207 25464
3777 1 11 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.912 -0.502 25464
3778 1 11 . 1 1 52 52 ARG C C 52 178.200 178.200 177.645 0.555 25464
3779 1 11 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.487 1.513 25464
3780 1 11 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.833 0.067 25464
3781 1 11 . 1 1 52 52 ARG H H 52 9.540 9.540 7.985 1.555 25464
3782 1 11 . 1 1 53 53 ALA N N 53 118.000 118.000 119.641 -1.641 25464
3783 1 11 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.074 -0.044 25464
3784 1 11 . 1 1 53 53 ALA C C 53 181.000 181.000 179.734 1.266 25464
3785 1 11 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.162 0.138 25464
3786 1 11 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.880 0.220 25464
3787 1 11 . 1 1 53 53 ALA H H 53 8.770 8.770 8.613 0.157 25464
3788 1 11 . 1 1 54 54 SER N N 54 115.300 115.300 114.802 0.498 25464
3789 1 11 . 1 1 54 54 SER HA H 54 4.350 4.350 4.114 0.236 25464
3790 1 11 . 1 1 54 54 SER C C 54 177.500 177.500 176.620 0.880 25464
3791 1 11 . 1 1 54 54 SER CA C 54 61.900 61.900 62.016 -0.116 25464
3792 1 11 . 1 1 54 54 SER CB C 54 63.100 63.100 62.805 0.295 25464
3793 1 11 . 1 1 54 54 SER H H 54 8.140 8.140 7.855 0.285 25464
3794 1 11 . 1 1 55 55 CYS N N 55 121.900 121.900 120.771 1.129 25464
3795 1 11 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.780 0.380 25464
3796 1 11 . 1 1 55 55 CYS C C 55 176.300 176.300 176.629 -0.329 25464
3797 1 11 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.225 0.076 25464
3798 1 11 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.615 0.385 25464
3799 1 11 . 1 1 55 55 CYS H H 55 8.430 8.430 8.156 0.274 25464
3800 1 11 . 1 1 56 56 VAL N N 56 121.100 121.100 120.059 1.041 25464
3801 1 11 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.590 -0.100 25464
3802 1 11 . 1 1 56 56 VAL C C 56 177.800 177.800 177.851 -0.051 25464
3803 1 11 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.261 -0.261 25464
3804 1 11 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.408 0.192 25464
3805 1 11 . 1 1 56 56 VAL H H 56 8.750 8.750 8.571 0.179 25464
3806 1 11 . 1 1 57 57 GLU N N 57 119.200 119.200 120.911 -1.711 25464
3807 1 11 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.858 0.212 25464
3808 1 11 . 1 1 57 57 GLU C C 57 177.900 177.900 178.485 -0.585 25464
3809 1 11 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.800 -0.500 25464
3810 1 11 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.616 -0.116 25464
3811 1 11 . 1 1 57 57 GLU H H 57 7.780 7.780 8.267 -0.487 25464
3812 1 11 . 1 1 58 58 TYR N N 58 119.400 119.400 120.412 -1.012 25464
3813 1 11 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.164 -0.274 25464
3814 1 11 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.932 0.268 25464
3815 1 11 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.734 -1.534 25464
3816 1 11 . 1 1 58 58 TYR H H 58 7.700 7.700 8.114 -0.414 25464
3817 1 11 . 1 1 59 59 VAL N N 59 121.500 121.500 119.295 2.205 25464
3818 1 11 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.647 -0.287 25464
3819 1 11 . 1 1 59 59 VAL C C 59 176.300 176.300 177.095 -0.795 25464
3820 1 11 . 1 1 59 59 VAL CA C 59 67.400 67.400 67.201 0.199 25464
3821 1 11 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.760 -0.360 25464
3822 1 11 . 1 1 59 59 VAL H H 59 8.380 8.380 8.251 0.129 25464
3823 1 11 . 1 1 60 60 ASP N N 60 120.000 120.000 117.317 2.683 25464
3824 1 11 . 1 1 60 60 ASP HA H 60 4.410 4.410 2.836 1.574 25464
3825 1 11 . 1 1 60 60 ASP C C 60 178.300 178.300 178.680 -0.380 25464
3826 1 11 . 1 1 60 60 ASP CA C 60 57.100 57.100 56.441 0.659 25464
3827 1 11 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.650 -0.050 25464
3828 1 11 . 1 1 60 60 ASP H H 60 8.580 8.580 7.836 0.744 25464
3829 1 11 . 1 1 61 61 GLN N N 61 114.500 114.500 117.536 -3.036 25464
3830 1 11 . 1 1 61 61 GLN HA H 61 4.010 4.010 3.904 0.106 25464
3831 1 11 . 1 1 61 61 GLN C C 61 176.700 176.700 177.725 -1.025 25464
3832 1 11 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.062 -1.362 25464
3833 1 11 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.542 0.258 25464
3834 1 11 . 1 1 61 61 GLN H H 61 7.810 7.810 7.904 -0.094 25464
3835 1 11 . 1 1 62 62 HIS N N 62 115.100 115.100 118.799 -3.699 25464
3836 1 11 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.530 -0.150 25464
3837 1 11 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.097 1.203 25464
3838 1 11 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.754 -0.754 25464
3839 1 11 . 1 1 62 62 HIS H H 62 7.730 7.730 7.675 0.055 25464
3840 1 11 . 1 1 63 63 TRP N N 63 121.500 121.500 120.351 1.149 25464
3841 1 11 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.015 -0.215 25464
3842 1 11 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.188 0.512 25464
3843 1 11 . 1 1 63 63 TRP H H 63 8.180 8.180 7.474 0.706 25464
3844 1 11 . 1 1 64 64 THR N N 64 114.900 114.900 108.516 6.384 25464
3845 1 11 . 1 1 64 64 THR HA H 64 4.180 4.180 3.944 0.236 25464
3846 1 11 . 1 1 64 64 THR CA C 64 62.100 62.100 64.156 -2.055 25464
3847 1 11 . 1 1 64 64 THR CB C 64 69.500 69.500 67.581 1.919 25464
3848 1 11 . 1 1 64 64 THR H H 64 7.940 7.940 8.300 -0.360 25464
3849 1 11 . 1 1 65 65 ASP N N 65 122.900 122.900 121.269 1.631 25464
3850 1 11 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.533 0.867 25464
3851 1 11 . 1 1 65 65 ASP CB C 65 41.100 41.100 42.099 -0.999 25464
3852 1 11 . 1 1 65 65 ASP H H 65 8.340 8.340 8.143 0.197 25464
3853 1 11 . 1 1 66 66 ILE N N 66 122.200 122.200 121.553 0.647 25464
3854 1 11 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.108 0.052 25464
3855 1 11 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.808 0.292 25464
3856 1 11 . 1 1 66 66 ILE CB C 66 38.500 38.500 38.559 -0.058 25464
3857 1 11 . 1 1 66 66 ILE H H 66 8.250 8.250 8.126 0.124 25464
3858 1 11 . 1 1 67 67 ARG N N 67 124.000 124.000 126.224 -2.224 25464
3859 1 11 . 1 1 67 67 ARG CA C 67 53.900 53.900 57.198 -3.298 25464
3860 1 11 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.201 1.799 25464
3861 1 11 . 1 1 67 67 ARG H H 67 8.490 8.490 8.352 0.138 25464
3862 1 11 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.358 0.082 25464
3863 1 11 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.268 -0.168 25464
3864 1 11 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.935 0.165 25464
3865 1 11 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.046 0.284 25464
3866 1 11 . 1 1 69 69 LYS C C 69 175.900 175.900 177.356 -1.456 25464
3867 1 11 . 1 1 69 69 LYS CA C 69 56.300 56.300 57.546 -1.246 25464
3868 1 11 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.219 0.780 25464
3869 1 11 . 1 1 69 69 LYS H H 69 8.270 8.270 8.472 -0.202 25464
3870 1 11 . 1 1 70 70 SER N N 70 122.300 122.300 112.783 9.517 25464
3871 1 11 . 1 1 70 70 SER HA H 70 4.580 4.580 4.268 0.312 25464
3872 1 11 . 1 1 70 70 SER CA C 70 59.900 59.900 58.512 1.388 25464
3873 1 11 . 1 1 70 70 SER CB C 70 65.100 65.100 62.292 2.808 25464
3874 1 11 . 1 1 70 70 SER H H 70 8.140 8.140 7.785 0.355 25464
3875 1 11 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.529 -0.209 25464
3876 1 11 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.156 0.244 25464
3877 1 11 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.751 -0.651 25464
3878 1 11 . 1 1 76 76 ALA N N 76 124.000 124.000 126.191 -2.191 25464
3879 1 11 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.543 -0.213 25464
3880 1 11 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.861 0.839 25464
3881 1 11 . 1 1 76 76 ALA CB C 76 19.000 19.000 20.651 -1.651 25464
3882 1 11 . 1 1 76 76 ALA H H 76 8.200 8.200 8.142 0.058 25464
3883 1 11 . 1 1 77 77 SER N N 77 114.100 114.100 116.102 -2.002 25464
3884 1 11 . 1 1 77 77 SER HA H 77 4.450 4.450 4.433 0.017 25464
3885 1 11 . 1 1 77 77 SER CA C 77 58.200 58.200 58.454 -0.254 25464
3886 1 11 . 1 1 77 77 SER CB C 77 63.900 63.900 63.915 -0.015 25464
3887 1 11 . 1 1 77 77 SER H H 77 8.210 8.210 8.822 -0.612 25464
3888 1 11 . 1 1 78 78 GLY N N 78 110.500 110.500 111.302 -0.802 25464
3889 1 11 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.207 0.193 25464
3890 1 11 . 1 1 78 78 GLY H H 78 8.390 8.390 8.074 0.316 25464
3891 1 11 . 1 1 79 79 GLN N N 79 119.600 119.600 118.667 0.933 25464
3892 1 11 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.608 -0.008 25464
3893 1 11 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.257 0.343 25464
3894 1 11 . 1 1 79 79 GLN H H 79 8.250 8.250 7.966 0.284 25464
3895 1 12 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.288 0.172 25464
3896 1 12 . 1 1 2 2 PRO CA C 2 63.400 63.400 63.289 0.111 25464
3897 1 12 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.500 0.600 25464
3898 1 12 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.787 0.313 25464
3899 1 12 . 1 1 10 10 ASP N N 10 121.500 121.500 125.551 -4.051 25464
3900 1 12 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.472 0.128 25464
3901 1 12 . 1 1 10 10 ASP C C 10 175.300 175.300 175.074 0.226 25464
3902 1 12 . 1 1 10 10 ASP CA C 10 54.500 54.500 55.550 -1.050 25464
3903 1 12 . 1 1 10 10 ASP CB C 10 40.900 40.900 40.616 0.284 25464
3904 1 12 . 1 1 10 10 ASP H H 10 8.420 8.420 8.025 0.395 25464
3905 1 12 . 1 1 11 11 ASN N N 11 118.400 118.400 123.116 -4.716 25464
3906 1 12 . 1 1 11 11 ASN HA H 11 4.950 4.950 5.019 -0.069 25464
3907 1 12 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.894 -0.094 25464
3908 1 12 . 1 1 11 11 ASN CB C 11 39.100 39.100 39.183 -0.083 25464
3909 1 12 . 1 1 11 11 ASN H H 11 8.270 8.270 8.253 0.017 25464
3910 1 12 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.135 0.245 25464
3911 1 12 . 1 1 12 12 PRO C C 12 177.100 177.100 177.311 -0.211 25464
3912 1 12 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.520 -0.820 25464
3913 1 12 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.382 0.518 25464
3914 1 12 . 1 1 13 13 PHE N N 13 117.500 117.500 113.725 3.775 25464
3915 1 12 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.209 0.291 25464
3916 1 12 . 1 1 13 13 PHE C C 13 175.700 175.700 174.806 0.894 25464
3917 1 12 . 1 1 13 13 PHE CA C 13 58.300 58.300 57.850 0.450 25464
3918 1 12 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.069 0.631 25464
3919 1 12 . 1 1 13 13 PHE H H 13 8.120 8.120 7.712 0.408 25464
3920 1 12 . 1 1 14 14 ASP N N 14 120.000 120.000 117.647 2.353 25464
3921 1 12 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.614 0.006 25464
3922 1 12 . 1 1 14 14 ASP C C 14 175.800 175.800 175.876 -0.076 25464
3923 1 12 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.897 0.503 25464
3924 1 12 . 1 1 14 14 ASP CB C 14 41.400 41.400 42.027 -0.627 25464
3925 1 12 . 1 1 14 14 ASP H H 14 8.010 8.010 7.564 0.446 25464
3926 1 12 . 1 1 15 15 ASP N N 15 119.900 119.900 121.498 -1.598 25464
3927 1 12 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.546 0.064 25464
3928 1 12 . 1 1 15 15 ASP C C 15 176.700 176.700 176.352 0.348 25464
3929 1 12 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.202 -0.702 25464
3930 1 12 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.216 -1.016 25464
3931 1 12 . 1 1 15 15 ASP H H 15 7.900 7.900 7.542 0.358 25464
3932 1 12 . 1 1 16 16 GLU N N 16 122.700 122.700 122.460 0.240 25464
3933 1 12 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.188 0.042 25464
3934 1 12 . 1 1 16 16 GLU C C 16 176.600 176.600 176.754 -0.154 25464
3935 1 12 . 1 1 16 16 GLU CA C 16 57.400 57.400 57.854 -0.454 25464
3936 1 12 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.707 0.393 25464
3937 1 12 . 1 1 16 16 GLU H H 16 8.610 8.610 8.541 0.069 25464
3938 1 12 . 1 1 17 17 ASP N N 17 119.500 119.500 121.118 -1.618 25464
3939 1 12 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.537 0.313 25464
3940 1 12 . 1 1 17 17 ASP C C 17 176.300 176.300 176.722 -0.422 25464
3941 1 12 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.021 -0.721 25464
3942 1 12 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.393 0.207 25464
3943 1 12 . 1 1 17 17 ASP H H 17 8.490 8.490 8.412 0.078 25464
3944 1 12 . 1 1 18 18 GLY N N 18 107.700 107.700 107.618 0.082 25464
3945 1 12 . 1 1 18 18 GLY C C 18 172.700 172.700 173.507 -0.807 25464
3946 1 12 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.420 0.479 25464
3947 1 12 . 1 1 18 18 GLY H H 18 8.070 8.070 7.515 0.555 25464
3948 1 12 . 1 1 19 19 MET N N 19 117.400 117.400 122.485 -5.085 25464
3949 1 12 . 1 1 19 19 MET HA H 19 4.890 4.890 4.307 0.583 25464
3950 1 12 . 1 1 19 19 MET C C 19 176.000 176.000 174.864 1.136 25464
3951 1 12 . 1 1 19 19 MET CA C 19 53.700 53.700 53.385 0.315 25464
3952 1 12 . 1 1 19 19 MET CB C 19 35.100 35.100 31.807 3.293 25464
3953 1 12 . 1 1 19 19 MET H H 19 7.820 7.820 8.238 -0.417 25464
3954 1 12 . 1 1 20 20 PHE N N 20 120.100 120.100 120.669 -0.569 25464
3955 1 12 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.505 0.505 25464
3956 1 12 . 1 1 20 20 PHE C C 20 174.200 174.200 174.796 -0.596 25464
3957 1 12 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.290 2.110 25464
3958 1 12 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.956 3.844 25464
3959 1 12 . 1 1 20 20 PHE H H 20 9.370 9.370 8.662 0.708 25464
3960 1 12 . 1 1 21 21 PHE N N 21 115.200 115.200 116.295 -1.095 25464
3961 1 12 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.042 0.588 25464
3962 1 12 . 1 1 21 21 PHE C C 21 177.500 177.500 174.530 2.970 25464
3963 1 12 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.277 0.223 25464
3964 1 12 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.510 3.590 25464
3965 1 12 . 1 1 21 21 PHE H H 21 9.600 9.600 8.516 1.084 25464
3966 1 12 . 1 1 22 22 VAL N N 22 116.600 116.600 120.308 -3.708 25464
3967 1 12 . 1 1 22 22 VAL C C 22 175.000 175.000 175.267 -0.267 25464
3968 1 12 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.720 0.980 25464
3969 1 12 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.595 0.205 25464
3970 1 12 . 1 1 22 22 VAL H H 22 8.750 8.750 8.647 0.103 25464
3971 1 12 . 1 1 23 23 LEU N N 23 126.500 126.500 126.795 -0.295 25464
3972 1 12 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.578 0.062 25464
3973 1 12 . 1 1 23 23 LEU C C 23 176.200 176.200 175.795 0.405 25464
3974 1 12 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.893 -1.093 25464
3975 1 12 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.599 1.101 25464
3976 1 12 . 1 1 23 23 LEU H H 23 9.530 9.530 8.736 0.794 25464
3977 1 12 . 1 1 24 24 ILE N N 24 117.700 117.700 117.672 0.028 25464
3978 1 12 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.364 0.326 25464
3979 1 12 . 1 1 24 24 ILE C C 24 174.300 174.300 173.551 0.749 25464
3980 1 12 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.365 -0.465 25464
3981 1 12 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.497 1.103 25464
3982 1 12 . 1 1 24 24 ILE H H 24 9.300 9.300 8.873 0.427 25464
3983 1 12 . 1 1 25 25 ASN N N 25 122.500 122.500 123.648 -1.148 25464
3984 1 12 . 1 1 25 25 ASN HA H 25 4.700 4.700 5.141 -0.441 25464
3985 1 12 . 1 1 25 25 ASN C C 25 177.700 177.700 176.544 1.156 25464
3986 1 12 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.091 -1.391 25464
3987 1 12 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.923 -3.323 25464
3988 1 12 . 1 1 25 25 ASN H H 25 7.300 7.300 8.559 -1.259 25464
3989 1 12 . 1 1 26 26 ASP N N 26 118.100 118.100 123.494 -5.394 25464
3990 1 12 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.336 0.024 25464
3991 1 12 . 1 1 26 26 ASP C C 26 176.700 176.700 177.403 -0.703 25464
3992 1 12 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.225 -0.725 25464
3993 1 12 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.660 -0.760 25464
3994 1 12 . 1 1 26 26 ASP H H 26 8.340 8.340 8.875 -0.535 25464
3995 1 12 . 1 1 27 27 GLU N N 27 117.600 117.600 117.614 -0.014 25464
3996 1 12 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.386 0.154 25464
3997 1 12 . 1 1 27 27 GLU C C 27 175.100 175.100 175.568 -0.468 25464
3998 1 12 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.482 0.218 25464
3999 1 12 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.475 1.025 25464
4000 1 12 . 1 1 27 27 GLU H H 27 7.190 7.190 7.822 -0.632 25464
4001 1 12 . 1 1 28 28 GLU N N 28 112.800 112.800 114.336 -1.536 25464
4002 1 12 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.946 -0.356 25464
4003 1 12 . 1 1 28 28 GLU C C 28 175.200 175.200 175.313 -0.113 25464
4004 1 12 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.206 0.594 25464
4005 1 12 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.233 -0.733 25464
4006 1 12 . 1 1 28 28 GLU H H 28 8.050 8.050 7.514 0.536 25464
4007 1 12 . 1 1 29 29 GLN N N 29 117.200 117.200 117.671 -0.471 25464
4008 1 12 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.333 -0.053 25464
4009 1 12 . 1 1 29 29 GLN C C 29 174.600 174.600 175.355 -0.755 25464
4010 1 12 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.056 -0.156 25464
4011 1 12 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.931 -0.631 25464
4012 1 12 . 1 1 29 29 GLN H H 29 7.840 7.840 7.628 0.212 25464
4013 1 12 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.747 0.313 25464
4014 1 12 . 1 1 30 30 HIS C C 30 175.900 175.900 174.936 0.964 25464
4015 1 12 . 1 1 30 30 HIS CA C 30 54.700 54.700 54.279 0.421 25464
4016 1 12 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.408 1.492 25464
4017 1 12 . 1 1 31 31 SER N N 31 113.100 113.100 115.459 -2.359 25464
4018 1 12 . 1 1 31 31 SER HA H 31 4.740 4.740 4.670 0.070 25464
4019 1 12 . 1 1 31 31 SER C C 31 173.200 173.200 172.503 0.697 25464
4020 1 12 . 1 1 31 31 SER CA C 31 57.400 57.400 57.574 -0.173 25464
4021 1 12 . 1 1 31 31 SER CB C 31 66.600 66.600 65.322 1.278 25464
4022 1 12 . 1 1 31 31 SER H H 31 8.850 8.850 8.979 -0.129 25464
4023 1 12 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.885 0.475 25464
4024 1 12 . 1 1 32 32 LEU C C 32 178.200 178.200 175.405 2.795 25464
4025 1 12 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.449 1.551 25464
4026 1 12 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.313 -1.613 25464
4027 1 12 . 1 1 33 33 TRP N N 33 123.400 123.400 128.185 -4.785 25464
4028 1 12 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.927 0.373 25464
4029 1 12 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.299 -0.199 25464
4030 1 12 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.511 1.989 25464
4031 1 12 . 1 1 33 33 TRP H H 33 9.170 9.170 9.216 -0.046 25464
4032 1 12 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.582 -0.772 25464
4033 1 12 . 1 1 34 34 PRO C C 34 177.400 177.400 177.569 -0.169 25464
4034 1 12 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.190 -0.390 25464
4035 1 12 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.709 -1.709 25464
4036 1 12 . 1 1 35 35 THR N N 35 107.700 107.700 114.974 -7.274 25464
4037 1 12 . 1 1 35 35 THR HA H 35 3.730 3.730 4.291 -0.561 25464
4038 1 12 . 1 1 35 35 THR C C 35 176.100 176.100 175.248 0.852 25464
4039 1 12 . 1 1 35 35 THR CA C 35 63.600 63.600 65.124 -1.524 25464
4040 1 12 . 1 1 35 35 THR CB C 35 68.200 68.200 68.230 -0.030 25464
4041 1 12 . 1 1 35 35 THR H H 35 7.260 7.260 8.047 -0.787 25464
4042 1 12 . 1 1 36 36 PHE N N 36 114.500 114.500 118.305 -3.805 25464
4043 1 12 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.537 -0.027 25464
4044 1 12 . 1 1 36 36 PHE C C 36 174.500 174.500 175.238 -0.738 25464
4045 1 12 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.961 -1.061 25464
4046 1 12 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.698 -1.098 25464
4047 1 12 . 1 1 36 36 PHE H H 36 6.770 6.770 7.546 -0.776 25464
4048 1 12 . 1 1 37 37 ALA N N 37 125.300 125.300 121.582 3.718 25464
4049 1 12 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.610 0.100 25464
4050 1 12 . 1 1 37 37 ALA C C 37 177.300 177.300 175.802 1.498 25464
4051 1 12 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.096 -0.895 25464
4052 1 12 . 1 1 37 37 ALA CB C 37 20.400 20.400 20.986 -0.586 25464
4053 1 12 . 1 1 37 37 ALA H H 37 6.950 6.950 7.448 -0.498 25464
4054 1 12 . 1 1 38 38 ASP N N 38 124.500 124.500 121.421 3.079 25464
4055 1 12 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.823 -0.343 25464
4056 1 12 . 1 1 38 38 ASP C C 38 176.700 176.700 176.396 0.304 25464
4057 1 12 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.893 1.107 25464
4058 1 12 . 1 1 38 38 ASP CB C 38 40.400 40.400 41.964 -1.564 25464
4059 1 12 . 1 1 38 38 ASP H H 38 8.870 8.870 8.675 0.195 25464
4060 1 12 . 1 1 39 39 VAL N N 39 126.000 126.000 124.218 1.782 25464
4061 1 12 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.662 -0.302 25464
4062 1 12 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.209 -0.109 25464
4063 1 12 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.186 1.014 25464
4064 1 12 . 1 1 39 39 VAL H H 39 8.650 8.650 8.564 0.086 25464
4065 1 12 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.457 -0.207 25464
4066 1 12 . 1 1 40 40 PRO C C 40 175.800 175.800 176.105 -0.305 25464
4067 1 12 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.537 -0.337 25464
4068 1 12 . 1 1 40 40 PRO CB C 40 31.700 31.700 32.027 -0.327 25464
4069 1 12 . 1 1 41 41 ALA N N 41 122.700 122.700 126.065 -3.365 25464
4070 1 12 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.069 0.111 25464
4071 1 12 . 1 1 41 41 ALA C C 41 179.000 179.000 178.609 0.391 25464
4072 1 12 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.496 -0.196 25464
4073 1 12 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.913 -0.613 25464
4074 1 12 . 1 1 41 41 ALA H H 41 8.280 8.280 8.486 -0.206 25464
4075 1 12 . 1 1 42 42 GLY N N 42 109.800 109.800 111.360 -1.560 25464
4076 1 12 . 1 1 42 42 GLY C C 42 173.800 173.800 173.399 0.401 25464
4077 1 12 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.831 -0.131 25464
4078 1 12 . 1 1 42 42 GLY H H 42 8.770 8.770 8.279 0.491 25464
4079 1 12 . 1 1 43 43 TRP N N 43 120.300 120.300 122.085 -1.785 25464
4080 1 12 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.259 -0.309 25464
4081 1 12 . 1 1 43 43 TRP C C 43 174.900 174.900 175.786 -0.886 25464
4082 1 12 . 1 1 43 43 TRP CA C 43 55.700 55.700 55.667 0.033 25464
4083 1 12 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.863 2.137 25464
4084 1 12 . 1 1 43 43 TRP H H 43 7.740 7.740 7.851 -0.111 25464
4085 1 12 . 1 1 44 44 ARG N N 44 117.700 117.700 123.147 -5.447 25464
4086 1 12 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.586 0.134 25464
4087 1 12 . 1 1 44 44 ARG C C 44 174.900 174.900 175.195 -0.295 25464
4088 1 12 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.929 -1.029 25464
4089 1 12 . 1 1 44 44 ARG CB C 44 33.200 33.200 31.773 1.427 25464
4090 1 12 . 1 1 44 44 ARG H H 44 8.990 8.990 8.703 0.287 25464
4091 1 12 . 1 1 45 45 VAL N N 45 122.800 122.800 123.276 -0.476 25464
4092 1 12 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.008 -0.028 25464
4093 1 12 . 1 1 45 45 VAL C C 45 177.600 177.600 176.518 1.082 25464
4094 1 12 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.676 0.024 25464
4095 1 12 . 1 1 45 45 VAL CB C 45 32.100 32.100 32.149 -0.049 25464
4096 1 12 . 1 1 45 45 VAL H H 45 8.720 8.720 8.368 0.352 25464
4097 1 12 . 1 1 46 46 VAL N N 46 120.400 120.400 124.361 -3.961 25464
4098 1 12 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.375 0.305 25464
4099 1 12 . 1 1 46 46 VAL C C 46 174.200 174.200 174.758 -0.558 25464
4100 1 12 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.587 -2.087 25464
4101 1 12 . 1 1 46 46 VAL CB C 46 34.000 34.000 34.073 -0.073 25464
4102 1 12 . 1 1 46 46 VAL H H 46 9.060 9.060 9.023 0.037 25464
4103 1 12 . 1 1 47 47 PHE N N 47 121.100 121.100 122.084 -0.984 25464
4104 1 12 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.670 -0.220 25464
4105 1 12 . 1 1 47 47 PHE CA C 47 58.700 58.700 55.431 3.269 25464
4106 1 12 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.150 0.550 25464
4107 1 12 . 1 1 47 47 PHE H H 47 7.680 7.680 8.244 -0.564 25464
4108 1 12 . 1 1 48 48 GLY N N 48 112.600 112.600 113.066 -0.466 25464
4109 1 12 . 1 1 48 48 GLY C C 48 174.700 174.700 173.620 1.080 25464
4110 1 12 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.307 -2.307 25464
4111 1 12 . 1 1 48 48 GLY H H 48 7.380 7.380 8.573 -1.193 25464
4112 1 12 . 1 1 49 49 GLU N N 49 120.600 120.600 118.671 1.929 25464
4113 1 12 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.167 0.063 25464
4114 1 12 . 1 1 49 49 GLU C C 49 174.900 174.900 175.129 -0.229 25464
4115 1 12 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.415 -1.115 25464
4116 1 12 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.654 2.546 25464
4117 1 12 . 1 1 49 49 GLU H H 49 8.510 8.510 8.539 -0.029 25464
4118 1 12 . 1 1 50 50 ALA N N 50 126.600 126.600 127.724 -1.124 25464
4119 1 12 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.497 0.143 25464
4120 1 12 . 1 1 50 50 ALA C C 50 175.100 175.100 175.845 -0.745 25464
4121 1 12 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.159 1.241 25464
4122 1 12 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.691 0.509 25464
4123 1 12 . 1 1 50 50 ALA H H 50 9.440 9.440 8.621 0.819 25464
4124 1 12 . 1 1 51 51 SER N N 51 115.100 115.100 114.599 0.501 25464
4125 1 12 . 1 1 51 51 SER HA H 51 4.740 4.740 4.004 0.736 25464
4126 1 12 . 1 1 51 51 SER C C 51 175.000 175.000 176.269 -1.269 25464
4127 1 12 . 1 1 51 51 SER CA C 51 58.100 58.100 58.304 -0.204 25464
4128 1 12 . 1 1 51 51 SER CB C 51 64.700 64.700 63.933 0.767 25464
4129 1 12 . 1 1 51 51 SER H H 51 8.950 8.950 8.615 0.335 25464
4130 1 12 . 1 1 52 52 ARG N N 52 123.500 123.500 129.123 -5.623 25464
4131 1 12 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.014 -0.604 25464
4132 1 12 . 1 1 52 52 ARG C C 52 178.200 178.200 177.746 0.454 25464
4133 1 12 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.453 1.547 25464
4134 1 12 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.072 -0.172 25464
4135 1 12 . 1 1 52 52 ARG H H 52 9.540 9.540 8.004 1.536 25464
4136 1 12 . 1 1 53 53 ALA N N 53 118.000 118.000 120.116 -2.116 25464
4137 1 12 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.142 -0.112 25464
4138 1 12 . 1 1 53 53 ALA C C 53 181.000 181.000 180.142 0.858 25464
4139 1 12 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.239 0.061 25464
4140 1 12 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.782 0.318 25464
4141 1 12 . 1 1 53 53 ALA H H 53 8.770 8.770 8.179 0.591 25464
4142 1 12 . 1 1 54 54 SER N N 54 115.300 115.300 115.068 0.232 25464
4143 1 12 . 1 1 54 54 SER HA H 54 4.350 4.350 4.394 -0.044 25464
4144 1 12 . 1 1 54 54 SER C C 54 177.500 177.500 176.986 0.514 25464
4145 1 12 . 1 1 54 54 SER CA C 54 61.900 61.900 61.707 0.193 25464
4146 1 12 . 1 1 54 54 SER CB C 54 63.100 63.100 62.670 0.430 25464
4147 1 12 . 1 1 54 54 SER H H 54 8.140 8.140 7.818 0.322 25464
4148 1 12 . 1 1 55 55 CYS N N 55 121.900 121.900 120.512 1.388 25464
4149 1 12 . 1 1 55 55 CYS HA H 55 4.160 4.160 4.214 -0.054 25464
4150 1 12 . 1 1 55 55 CYS C C 55 176.300 176.300 176.780 -0.480 25464
4151 1 12 . 1 1 55 55 CYS CA C 55 64.300 64.300 63.960 0.340 25464
4152 1 12 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.983 0.017 25464
4153 1 12 . 1 1 55 55 CYS H H 55 8.430 8.430 7.969 0.461 25464
4154 1 12 . 1 1 56 56 VAL N N 56 121.100 121.100 120.722 0.378 25464
4155 1 12 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.694 -0.204 25464
4156 1 12 . 1 1 56 56 VAL C C 56 177.800 177.800 178.486 -0.686 25464
4157 1 12 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.918 0.082 25464
4158 1 12 . 1 1 56 56 VAL CB C 56 31.600 31.600 30.976 0.624 25464
4159 1 12 . 1 1 56 56 VAL H H 56 8.750 8.750 8.846 -0.096 25464
4160 1 12 . 1 1 57 57 GLU N N 57 119.200 119.200 121.021 -1.821 25464
4161 1 12 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.068 0.002 25464
4162 1 12 . 1 1 57 57 GLU C C 57 177.900 177.900 178.598 -0.698 25464
4163 1 12 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.470 -0.170 25464
4164 1 12 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.291 0.209 25464
4165 1 12 . 1 1 57 57 GLU H H 57 7.780 7.780 8.390 -0.610 25464
4166 1 12 . 1 1 58 58 TYR N N 58 119.400 119.400 120.530 -1.130 25464
4167 1 12 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.131 -0.241 25464
4168 1 12 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.052 0.148 25464
4169 1 12 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.749 -1.550 25464
4170 1 12 . 1 1 58 58 TYR H H 58 7.700 7.700 8.264 -0.564 25464
4171 1 12 . 1 1 59 59 VAL N N 59 121.500 121.500 117.922 3.578 25464
4172 1 12 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.487 -0.127 25464
4173 1 12 . 1 1 59 59 VAL C C 59 176.300 176.300 176.860 -0.560 25464
4174 1 12 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.542 0.858 25464
4175 1 12 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.705 -0.305 25464
4176 1 12 . 1 1 59 59 VAL H H 59 8.380 8.380 8.421 -0.041 25464
4177 1 12 . 1 1 60 60 ASP N N 60 120.000 120.000 117.527 2.473 25464
4178 1 12 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.301 0.109 25464
4179 1 12 . 1 1 60 60 ASP C C 60 178.300 178.300 179.030 -0.730 25464
4180 1 12 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.057 0.043 25464
4181 1 12 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.344 -0.744 25464
4182 1 12 . 1 1 60 60 ASP H H 60 8.580 8.580 7.911 0.669 25464
4183 1 12 . 1 1 61 61 GLN N N 61 114.500 114.500 116.899 -2.399 25464
4184 1 12 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.167 -0.157 25464
4185 1 12 . 1 1 61 61 GLN C C 61 176.700 176.700 178.240 -1.540 25464
4186 1 12 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.582 -0.882 25464
4187 1 12 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.229 0.571 25464
4188 1 12 . 1 1 61 61 GLN H H 61 7.810 7.810 8.167 -0.357 25464
4189 1 12 . 1 1 62 62 HIS N N 62 115.100 115.100 117.783 -2.683 25464
4190 1 12 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.469 -0.089 25464
4191 1 12 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.487 1.813 25464
4192 1 12 . 1 1 62 62 HIS CB C 62 29.000 29.000 28.808 0.192 25464
4193 1 12 . 1 1 62 62 HIS H H 62 7.730 7.730 7.483 0.247 25464
4194 1 12 . 1 1 63 63 TRP N N 63 121.500 121.500 121.342 0.158 25464
4195 1 12 . 1 1 63 63 TRP CA C 63 58.800 58.800 60.637 -1.837 25464
4196 1 12 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.515 0.185 25464
4197 1 12 . 1 1 63 63 TRP H H 63 8.180 8.180 7.794 0.386 25464
4198 1 12 . 1 1 64 64 THR N N 64 114.900 114.900 107.519 7.381 25464
4199 1 12 . 1 1 64 64 THR HA H 64 4.180 4.180 4.346 -0.166 25464
4200 1 12 . 1 1 64 64 THR CA C 64 62.100 62.100 62.395 -0.296 25464
4201 1 12 . 1 1 64 64 THR CB C 64 69.500 69.500 68.935 0.565 25464
4202 1 12 . 1 1 64 64 THR H H 64 7.940 7.940 7.907 0.033 25464
4203 1 12 . 1 1 65 65 ASP N N 65 122.900 122.900 123.494 -0.594 25464
4204 1 12 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.471 -0.071 25464
4205 1 12 . 1 1 65 65 ASP CB C 65 41.100 41.100 39.619 1.481 25464
4206 1 12 . 1 1 65 65 ASP H H 65 8.340 8.340 7.727 0.613 25464
4207 1 12 . 1 1 66 66 ILE N N 66 122.200 122.200 122.522 -0.322 25464
4208 1 12 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.673 -0.513 25464
4209 1 12 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.186 0.914 25464
4210 1 12 . 1 1 66 66 ILE CB C 66 38.500 38.500 41.713 -3.213 25464
4211 1 12 . 1 1 66 66 ILE H H 66 8.250 8.250 8.035 0.215 25464
4212 1 12 . 1 1 67 67 ARG N N 67 124.000 124.000 129.764 -5.764 25464
4213 1 12 . 1 1 67 67 ARG CA C 67 53.900 53.900 58.477 -4.577 25464
4214 1 12 . 1 1 67 67 ARG CB C 67 30.000 30.000 29.222 0.778 25464
4215 1 12 . 1 1 67 67 ARG H H 67 8.490 8.490 8.619 -0.129 25464
4216 1 12 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.566 -0.126 25464
4217 1 12 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.275 0.825 25464
4218 1 12 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.647 -0.547 25464
4219 1 12 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.531 -0.201 25464
4220 1 12 . 1 1 69 69 LYS C C 69 175.900 175.900 176.052 -0.152 25464
4221 1 12 . 1 1 69 69 LYS CA C 69 56.300 56.300 55.503 0.797 25464
4222 1 12 . 1 1 69 69 LYS CB C 69 33.000 33.000 30.376 2.624 25464
4223 1 12 . 1 1 69 69 LYS H H 69 8.270 8.270 8.565 -0.295 25464
4224 1 12 . 1 1 70 70 SER N N 70 122.300 122.300 115.844 6.456 25464
4225 1 12 . 1 1 70 70 SER HA H 70 4.580 4.580 4.334 0.246 25464
4226 1 12 . 1 1 70 70 SER CA C 70 59.900 59.900 60.181 -0.281 25464
4227 1 12 . 1 1 70 70 SER CB C 70 65.100 65.100 63.611 1.489 25464
4228 1 12 . 1 1 70 70 SER H H 70 8.140 8.140 7.702 0.438 25464
4229 1 12 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.579 -0.259 25464
4230 1 12 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.010 1.390 25464
4231 1 12 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.794 -1.694 25464
4232 1 12 . 1 1 76 76 ALA N N 76 124.000 124.000 127.686 -3.686 25464
4233 1 12 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.175 0.155 25464
4234 1 12 . 1 1 76 76 ALA CA C 76 52.700 52.700 53.511 -0.812 25464
4235 1 12 . 1 1 76 76 ALA CB C 76 19.000 19.000 17.576 1.424 25464
4236 1 12 . 1 1 76 76 ALA H H 76 8.200 8.200 8.638 -0.438 25464
4237 1 12 . 1 1 77 77 SER N N 77 114.100 114.100 116.918 -2.818 25464
4238 1 12 . 1 1 77 77 SER HA H 77 4.450 4.450 4.332 0.118 25464
4239 1 12 . 1 1 77 77 SER CA C 77 58.200 58.200 58.532 -0.332 25464
4240 1 12 . 1 1 77 77 SER CB C 77 63.900 63.900 63.266 0.634 25464
4241 1 12 . 1 1 77 77 SER H H 77 8.210 8.210 8.454 -0.244 25464
4242 1 12 . 1 1 78 78 GLY N N 78 110.500 110.500 111.849 -1.349 25464
4243 1 12 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.237 0.163 25464
4244 1 12 . 1 1 78 78 GLY H H 78 8.390 8.390 8.125 0.265 25464
4245 1 12 . 1 1 79 79 GLN N N 79 119.600 119.600 126.512 -6.912 25464
4246 1 12 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.793 -0.193 25464
4247 1 12 . 1 1 79 79 GLN CB C 79 29.600 29.600 28.446 1.154 25464
4248 1 12 . 1 1 79 79 GLN H H 79 8.250 8.250 8.386 -0.136 25464
4249 1 13 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.539 -0.079 25464
4250 1 13 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.998 0.402 25464
4251 1 13 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.881 0.219 25464
4252 1 13 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.130 -0.030 25464
4253 1 13 . 1 1 10 10 ASP N N 10 121.500 121.500 121.573 -0.073 25464
4254 1 13 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.302 0.298 25464
4255 1 13 . 1 1 10 10 ASP C C 10 175.300 175.300 175.893 -0.593 25464
4256 1 13 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.959 -0.459 25464
4257 1 13 . 1 1 10 10 ASP CB C 10 40.900 40.900 40.933 -0.033 25464
4258 1 13 . 1 1 10 10 ASP H H 10 8.420 8.420 8.348 0.072 25464
4259 1 13 . 1 1 11 11 ASN N N 11 118.400 118.400 122.354 -3.954 25464
4260 1 13 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.655 0.295 25464
4261 1 13 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.593 -0.793 25464
4262 1 13 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.225 0.875 25464
4263 1 13 . 1 1 11 11 ASN H H 11 8.270 8.270 8.464 -0.194 25464
4264 1 13 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.386 -0.006 25464
4265 1 13 . 1 1 12 12 PRO C C 12 177.100 177.100 176.230 0.870 25464
4266 1 13 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.386 -0.686 25464
4267 1 13 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.447 0.453 25464
4268 1 13 . 1 1 13 13 PHE N N 13 117.500 117.500 109.872 7.628 25464
4269 1 13 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.865 -0.365 25464
4270 1 13 . 1 1 13 13 PHE C C 13 175.700 175.700 175.019 0.681 25464
4271 1 13 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.426 1.874 25464
4272 1 13 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.101 0.599 25464
4273 1 13 . 1 1 13 13 PHE H H 13 8.120 8.120 6.944 1.176 25464
4274 1 13 . 1 1 14 14 ASP N N 14 120.000 120.000 120.575 -0.575 25464
4275 1 13 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.665 -0.045 25464
4276 1 13 . 1 1 14 14 ASP C C 14 175.800 175.800 176.232 -0.432 25464
4277 1 13 . 1 1 14 14 ASP CA C 14 54.400 54.400 55.065 -0.665 25464
4278 1 13 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.082 0.318 25464
4279 1 13 . 1 1 14 14 ASP H H 14 8.010 8.010 7.754 0.256 25464
4280 1 13 . 1 1 15 15 ASP N N 15 119.900 119.900 120.194 -0.294 25464
4281 1 13 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.834 -0.224 25464
4282 1 13 . 1 1 15 15 ASP C C 15 176.700 176.700 176.058 0.642 25464
4283 1 13 . 1 1 15 15 ASP CA C 15 54.500 54.500 53.686 0.814 25464
4284 1 13 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.645 -1.445 25464
4285 1 13 . 1 1 15 15 ASP H H 15 7.900 7.900 7.723 0.177 25464
4286 1 13 . 1 1 16 16 GLU N N 16 122.700 122.700 116.977 5.723 25464
4287 1 13 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.478 -0.248 25464
4288 1 13 . 1 1 16 16 GLU C C 16 176.600 176.600 176.912 -0.312 25464
4289 1 13 . 1 1 16 16 GLU CA C 16 57.400 57.400 57.492 -0.092 25464
4290 1 13 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.841 -0.741 25464
4291 1 13 . 1 1 16 16 GLU H H 16 8.610 8.610 8.588 0.022 25464
4292 1 13 . 1 1 17 17 ASP N N 17 119.500 119.500 119.865 -0.365 25464
4293 1 13 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.518 0.332 25464
4294 1 13 . 1 1 17 17 ASP C C 17 176.300 176.300 177.453 -1.153 25464
4295 1 13 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.734 -0.434 25464
4296 1 13 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.222 1.378 25464
4297 1 13 . 1 1 17 17 ASP H H 17 8.490 8.490 8.212 0.278 25464
4298 1 13 . 1 1 18 18 GLY N N 18 107.700 107.700 107.911 -0.211 25464
4299 1 13 . 1 1 18 18 GLY C C 18 172.700 172.700 172.667 0.033 25464
4300 1 13 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.301 0.599 25464
4301 1 13 . 1 1 18 18 GLY H H 18 8.070 8.070 7.832 0.238 25464
4302 1 13 . 1 1 19 19 MET N N 19 117.400 117.400 119.745 -2.345 25464
4303 1 13 . 1 1 19 19 MET HA H 19 4.890 4.890 4.674 0.216 25464
4304 1 13 . 1 1 19 19 MET C C 19 176.000 176.000 174.880 1.120 25464
4305 1 13 . 1 1 19 19 MET CA C 19 53.700 53.700 55.067 -1.367 25464
4306 1 13 . 1 1 19 19 MET CB C 19 35.100 35.100 33.567 1.533 25464
4307 1 13 . 1 1 19 19 MET H H 19 7.820 7.820 8.200 -0.380 25464
4308 1 13 . 1 1 20 20 PHE N N 20 120.100 120.100 119.315 0.785 25464
4309 1 13 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.577 0.433 25464
4310 1 13 . 1 1 20 20 PHE C C 20 174.200 174.200 174.710 -0.510 25464
4311 1 13 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.366 2.034 25464
4312 1 13 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.028 3.772 25464
4313 1 13 . 1 1 20 20 PHE H H 20 9.370 9.370 8.684 0.686 25464
4314 1 13 . 1 1 21 21 PHE N N 21 115.200 115.200 116.016 -0.816 25464
4315 1 13 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.295 0.335 25464
4316 1 13 . 1 1 21 21 PHE C C 21 177.500 177.500 174.953 2.547 25464
4317 1 13 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.487 0.013 25464
4318 1 13 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.391 3.709 25464
4319 1 13 . 1 1 21 21 PHE H H 21 9.600 9.600 8.471 1.129 25464
4320 1 13 . 1 1 22 22 VAL N N 22 116.600 116.600 121.082 -4.482 25464
4321 1 13 . 1 1 22 22 VAL C C 22 175.000 175.000 175.321 -0.321 25464
4322 1 13 . 1 1 22 22 VAL CA C 22 62.700 62.700 62.377 0.323 25464
4323 1 13 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.068 0.732 25464
4324 1 13 . 1 1 22 22 VAL H H 22 8.750 8.750 8.677 0.073 25464
4325 1 13 . 1 1 23 23 LEU N N 23 126.500 126.500 128.072 -1.572 25464
4326 1 13 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.463 0.177 25464
4327 1 13 . 1 1 23 23 LEU C C 23 176.200 176.200 176.077 0.123 25464
4328 1 13 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.599 -1.798 25464
4329 1 13 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.636 1.064 25464
4330 1 13 . 1 1 23 23 LEU H H 23 9.530 9.530 9.007 0.523 25464
4331 1 13 . 1 1 24 24 ILE N N 24 117.700 117.700 118.232 -0.532 25464
4332 1 13 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.450 0.240 25464
4333 1 13 . 1 1 24 24 ILE C C 24 174.300 174.300 173.383 0.917 25464
4334 1 13 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.315 -0.415 25464
4335 1 13 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.754 0.846 25464
4336 1 13 . 1 1 24 24 ILE H H 24 9.300 9.300 9.012 0.288 25464
4337 1 13 . 1 1 25 25 ASN N N 25 122.500 122.500 122.677 -0.177 25464
4338 1 13 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.975 -0.275 25464
4339 1 13 . 1 1 25 25 ASN C C 25 177.700 177.700 175.229 2.471 25464
4340 1 13 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.046 -1.346 25464
4341 1 13 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.499 -2.899 25464
4342 1 13 . 1 1 25 25 ASN H H 25 7.300 7.300 8.501 -1.201 25464
4343 1 13 . 1 1 26 26 ASP N N 26 118.100 118.100 122.473 -4.373 25464
4344 1 13 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.228 0.132 25464
4345 1 13 . 1 1 26 26 ASP C C 26 176.700 176.700 176.700 0.000 25464
4346 1 13 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.695 -1.195 25464
4347 1 13 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.989 -1.089 25464
4348 1 13 . 1 1 26 26 ASP H H 26 8.340 8.340 8.826 -0.486 25464
4349 1 13 . 1 1 27 27 GLU N N 27 117.600 117.600 117.850 -0.250 25464
4350 1 13 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.238 0.302 25464
4351 1 13 . 1 1 27 27 GLU C C 27 175.100 175.100 175.726 -0.626 25464
4352 1 13 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.267 -0.566 25464
4353 1 13 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.074 1.426 25464
4354 1 13 . 1 1 27 27 GLU H H 27 7.190 7.190 8.332 -1.142 25464
4355 1 13 . 1 1 28 28 GLU N N 28 112.800 112.800 113.981 -1.181 25464
4356 1 13 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.962 -0.372 25464
4357 1 13 . 1 1 28 28 GLU C C 28 175.200 175.200 175.537 -0.337 25464
4358 1 13 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.541 0.259 25464
4359 1 13 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.399 -0.899 25464
4360 1 13 . 1 1 28 28 GLU H H 28 8.050 8.050 8.026 0.024 25464
4361 1 13 . 1 1 29 29 GLN N N 29 117.200 117.200 118.849 -1.649 25464
4362 1 13 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.119 0.161 25464
4363 1 13 . 1 1 29 29 GLN C C 29 174.600 174.600 175.107 -0.507 25464
4364 1 13 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.770 -0.870 25464
4365 1 13 . 1 1 29 29 GLN CB C 29 29.300 29.300 28.982 0.318 25464
4366 1 13 . 1 1 29 29 GLN H H 29 7.840 7.840 7.706 0.134 25464
4367 1 13 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.465 0.595 25464
4368 1 13 . 1 1 30 30 HIS C C 30 175.900 175.900 174.805 1.095 25464
4369 1 13 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.772 0.928 25464
4370 1 13 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.139 1.761 25464
4371 1 13 . 1 1 31 31 SER N N 31 113.100 113.100 117.902 -4.802 25464
4372 1 13 . 1 1 31 31 SER HA H 31 4.740 4.740 4.879 -0.139 25464
4373 1 13 . 1 1 31 31 SER C C 31 173.200 173.200 172.401 0.799 25464
4374 1 13 . 1 1 31 31 SER CA C 31 57.400 57.400 57.004 0.396 25464
4375 1 13 . 1 1 31 31 SER CB C 31 66.600 66.600 64.578 2.022 25464
4376 1 13 . 1 1 31 31 SER H H 31 8.850 8.850 8.988 -0.138 25464
4377 1 13 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.962 0.398 25464
4378 1 13 . 1 1 32 32 LEU C C 32 178.200 178.200 175.109 3.091 25464
4379 1 13 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.517 1.484 25464
4380 1 13 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.923 -1.223 25464
4381 1 13 . 1 1 33 33 TRP N N 33 123.400 123.400 128.377 -4.977 25464
4382 1 13 . 1 1 33 33 TRP HA H 33 5.300 5.300 5.034 0.266 25464
4383 1 13 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.366 -0.266 25464
4384 1 13 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.869 1.631 25464
4385 1 13 . 1 1 33 33 TRP H H 33 9.170 9.170 9.372 -0.202 25464
4386 1 13 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.625 -0.815 25464
4387 1 13 . 1 1 34 34 PRO C C 34 177.400 177.400 177.519 -0.119 25464
4388 1 13 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.336 -0.536 25464
4389 1 13 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.295 -1.295 25464
4390 1 13 . 1 1 35 35 THR N N 35 107.700 107.700 114.337 -6.637 25464
4391 1 13 . 1 1 35 35 THR HA H 35 3.730 3.730 4.236 -0.506 25464
4392 1 13 . 1 1 35 35 THR C C 35 176.100 176.100 175.208 0.892 25464
4393 1 13 . 1 1 35 35 THR CA C 35 63.600 63.600 65.037 -1.437 25464
4394 1 13 . 1 1 35 35 THR CB C 35 68.200 68.200 68.515 -0.315 25464
4395 1 13 . 1 1 35 35 THR H H 35 7.260 7.260 7.968 -0.708 25464
4396 1 13 . 1 1 36 36 PHE N N 36 114.500 114.500 117.900 -3.400 25464
4397 1 13 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.598 -0.088 25464
4398 1 13 . 1 1 36 36 PHE C C 36 174.500 174.500 174.728 -0.228 25464
4399 1 13 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.516 -0.616 25464
4400 1 13 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.544 -0.944 25464
4401 1 13 . 1 1 36 36 PHE H H 36 6.770 6.770 7.551 -0.781 25464
4402 1 13 . 1 1 37 37 ALA N N 37 125.300 125.300 121.582 3.718 25464
4403 1 13 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.595 0.115 25464
4404 1 13 . 1 1 37 37 ALA C C 37 177.300 177.300 175.119 2.181 25464
4405 1 13 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.166 -0.966 25464
4406 1 13 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.584 -1.185 25464
4407 1 13 . 1 1 37 37 ALA H H 37 6.950 6.950 7.421 -0.471 25464
4408 1 13 . 1 1 38 38 ASP N N 38 124.500 124.500 120.505 3.995 25464
4409 1 13 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.951 -0.471 25464
4410 1 13 . 1 1 38 38 ASP C C 38 176.700 176.700 176.328 0.372 25464
4411 1 13 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.913 1.087 25464
4412 1 13 . 1 1 38 38 ASP CB C 38 40.400 40.400 43.035 -2.635 25464
4413 1 13 . 1 1 38 38 ASP H H 38 8.870 8.870 8.581 0.289 25464
4414 1 13 . 1 1 39 39 VAL N N 39 126.000 126.000 122.278 3.722 25464
4415 1 13 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.719 -0.359 25464
4416 1 13 . 1 1 39 39 VAL CA C 39 61.100 61.100 61.494 -0.394 25464
4417 1 13 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.794 0.406 25464
4418 1 13 . 1 1 39 39 VAL H H 39 8.650 8.650 8.337 0.313 25464
4419 1 13 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.291 -0.041 25464
4420 1 13 . 1 1 40 40 PRO C C 40 175.800 175.800 176.287 -0.487 25464
4421 1 13 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.507 -0.307 25464
4422 1 13 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.442 0.258 25464
4423 1 13 . 1 1 41 41 ALA N N 41 122.700 122.700 126.732 -4.032 25464
4424 1 13 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.036 0.144 25464
4425 1 13 . 1 1 41 41 ALA C C 41 179.000 179.000 178.716 0.284 25464
4426 1 13 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.610 -0.310 25464
4427 1 13 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.058 -0.758 25464
4428 1 13 . 1 1 41 41 ALA H H 41 8.280 8.280 8.500 -0.220 25464
4429 1 13 . 1 1 42 42 GLY N N 42 109.800 109.800 111.547 -1.747 25464
4430 1 13 . 1 1 42 42 GLY C C 42 173.800 173.800 173.970 -0.170 25464
4431 1 13 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.785 -0.085 25464
4432 1 13 . 1 1 42 42 GLY H H 42 8.770 8.770 8.392 0.378 25464
4433 1 13 . 1 1 43 43 TRP N N 43 120.300 120.300 122.805 -2.505 25464
4434 1 13 . 1 1 43 43 TRP HA H 43 4.950 4.950 4.851 0.099 25464
4435 1 13 . 1 1 43 43 TRP C C 43 174.900 174.900 176.174 -1.274 25464
4436 1 13 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.999 -1.300 25464
4437 1 13 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.083 1.917 25464
4438 1 13 . 1 1 43 43 TRP H H 43 7.740 7.740 7.976 -0.236 25464
4439 1 13 . 1 1 44 44 ARG N N 44 117.700 117.700 122.745 -5.045 25464
4440 1 13 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.733 -0.013 25464
4441 1 13 . 1 1 44 44 ARG C C 44 174.900 174.900 175.121 -0.221 25464
4442 1 13 . 1 1 44 44 ARG CA C 44 53.900 53.900 55.093 -1.193 25464
4443 1 13 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.191 1.008 25464
4444 1 13 . 1 1 44 44 ARG H H 44 8.990 8.990 9.000 -0.010 25464
4445 1 13 . 1 1 45 45 VAL N N 45 122.800 122.800 125.714 -2.914 25464
4446 1 13 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.153 -0.173 25464
4447 1 13 . 1 1 45 45 VAL C C 45 177.600 177.600 176.591 1.009 25464
4448 1 13 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.565 0.135 25464
4449 1 13 . 1 1 45 45 VAL CB C 45 32.100 32.100 32.058 0.042 25464
4450 1 13 . 1 1 45 45 VAL H H 45 8.720 8.720 8.653 0.067 25464
4451 1 13 . 1 1 46 46 VAL N N 46 120.400 120.400 125.208 -4.808 25464
4452 1 13 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.388 0.292 25464
4453 1 13 . 1 1 46 46 VAL C C 46 174.200 174.200 175.310 -1.110 25464
4454 1 13 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.487 -2.987 25464
4455 1 13 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.180 0.820 25464
4456 1 13 . 1 1 46 46 VAL H H 46 9.060 9.060 8.913 0.147 25464
4457 1 13 . 1 1 47 47 PHE N N 47 121.100 121.100 122.347 -1.247 25464
4458 1 13 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.680 -0.230 25464
4459 1 13 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.553 2.147 25464
4460 1 13 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.434 0.265 25464
4461 1 13 . 1 1 47 47 PHE H H 47 7.680 7.680 8.246 -0.566 25464
4462 1 13 . 1 1 48 48 GLY N N 48 112.600 112.600 112.710 -0.110 25464
4463 1 13 . 1 1 48 48 GLY C C 48 174.700 174.700 174.128 0.572 25464
4464 1 13 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.491 -2.491 25464
4465 1 13 . 1 1 48 48 GLY H H 48 7.380 7.380 8.435 -1.055 25464
4466 1 13 . 1 1 49 49 GLU N N 49 120.600 120.600 119.052 1.548 25464
4467 1 13 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.302 -0.072 25464
4468 1 13 . 1 1 49 49 GLU C C 49 174.900 174.900 175.210 -0.310 25464
4469 1 13 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.442 -1.142 25464
4470 1 13 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.273 2.927 25464
4471 1 13 . 1 1 49 49 GLU H H 49 8.510 8.510 8.508 0.002 25464
4472 1 13 . 1 1 50 50 ALA N N 50 126.600 126.600 127.896 -1.296 25464
4473 1 13 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.587 0.053 25464
4474 1 13 . 1 1 50 50 ALA C C 50 175.100 175.100 175.154 -0.054 25464
4475 1 13 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.449 0.951 25464
4476 1 13 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.149 1.051 25464
4477 1 13 . 1 1 50 50 ALA H H 50 9.440 9.440 8.783 0.657 25464
4478 1 13 . 1 1 51 51 SER N N 51 115.100 115.100 114.634 0.466 25464
4479 1 13 . 1 1 51 51 SER HA H 51 4.740 4.740 4.187 0.553 25464
4480 1 13 . 1 1 51 51 SER C C 51 175.000 175.000 176.360 -1.360 25464
4481 1 13 . 1 1 51 51 SER CA C 51 58.100 58.100 57.942 0.158 25464
4482 1 13 . 1 1 51 51 SER CB C 51 64.700 64.700 64.226 0.474 25464
4483 1 13 . 1 1 51 51 SER H H 51 8.950 8.950 8.402 0.548 25464
4484 1 13 . 1 1 52 52 ARG N N 52 123.500 123.500 129.232 -5.732 25464
4485 1 13 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.030 -0.620 25464
4486 1 13 . 1 1 52 52 ARG C C 52 178.200 178.200 177.587 0.613 25464
4487 1 13 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.520 1.480 25464
4488 1 13 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.223 -0.323 25464
4489 1 13 . 1 1 52 52 ARG H H 52 9.540 9.540 8.336 1.204 25464
4490 1 13 . 1 1 53 53 ALA N N 53 118.000 118.000 119.965 -1.965 25464
4491 1 13 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.127 -0.097 25464
4492 1 13 . 1 1 53 53 ALA C C 53 181.000 181.000 179.788 1.212 25464
4493 1 13 . 1 1 53 53 ALA CA C 53 55.300 55.300 54.948 0.352 25464
4494 1 13 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.992 0.108 25464
4495 1 13 . 1 1 53 53 ALA H H 53 8.770 8.770 8.035 0.735 25464
4496 1 13 . 1 1 54 54 SER N N 54 115.300 115.300 114.576 0.724 25464
4497 1 13 . 1 1 54 54 SER HA H 54 4.350 4.350 4.175 0.175 25464
4498 1 13 . 1 1 54 54 SER C C 54 177.500 177.500 176.672 0.828 25464
4499 1 13 . 1 1 54 54 SER CA C 54 61.900 61.900 61.035 0.865 25464
4500 1 13 . 1 1 54 54 SER CB C 54 63.100 63.100 63.009 0.091 25464
4501 1 13 . 1 1 54 54 SER H H 54 8.140 8.140 7.781 0.359 25464
4502 1 13 . 1 1 55 55 CYS N N 55 121.900 121.900 120.873 1.027 25464
4503 1 13 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.740 0.420 25464
4504 1 13 . 1 1 55 55 CYS C C 55 176.300 176.300 176.824 -0.524 25464
4505 1 13 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.606 -0.306 25464
4506 1 13 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.983 0.017 25464
4507 1 13 . 1 1 55 55 CYS H H 55 8.430 8.430 8.384 0.046 25464
4508 1 13 . 1 1 56 56 VAL N N 56 121.100 121.100 120.028 1.072 25464
4509 1 13 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.629 -0.139 25464
4510 1 13 . 1 1 56 56 VAL C C 56 177.800 177.800 177.959 -0.159 25464
4511 1 13 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.228 -0.228 25464
4512 1 13 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.341 0.259 25464
4513 1 13 . 1 1 56 56 VAL H H 56 8.750 8.750 8.567 0.183 25464
4514 1 13 . 1 1 57 57 GLU N N 57 119.200 119.200 120.651 -1.451 25464
4515 1 13 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.982 0.088 25464
4516 1 13 . 1 1 57 57 GLU C C 57 177.900 177.900 178.395 -0.495 25464
4517 1 13 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.437 -0.137 25464
4518 1 13 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.296 0.204 25464
4519 1 13 . 1 1 57 57 GLU H H 57 7.780 7.780 7.988 -0.208 25464
4520 1 13 . 1 1 58 58 TYR N N 58 119.400 119.400 120.117 -0.717 25464
4521 1 13 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.304 -0.414 25464
4522 1 13 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.869 0.331 25464
4523 1 13 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.845 -1.645 25464
4524 1 13 . 1 1 58 58 TYR H H 58 7.700 7.700 8.056 -0.356 25464
4525 1 13 . 1 1 59 59 VAL N N 59 121.500 121.500 119.415 2.085 25464
4526 1 13 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.460 -0.100 25464
4527 1 13 . 1 1 59 59 VAL C C 59 176.300 176.300 177.855 -1.555 25464
4528 1 13 . 1 1 59 59 VAL CA C 59 67.400 67.400 67.358 0.042 25464
4529 1 13 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.421 -0.021 25464
4530 1 13 . 1 1 59 59 VAL H H 59 8.380 8.380 8.477 -0.097 25464
4531 1 13 . 1 1 60 60 ASP N N 60 120.000 120.000 118.351 1.649 25464
4532 1 13 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.223 0.187 25464
4533 1 13 . 1 1 60 60 ASP C C 60 178.300 178.300 178.056 0.244 25464
4534 1 13 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.653 -0.553 25464
4535 1 13 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.879 -0.279 25464
4536 1 13 . 1 1 60 60 ASP H H 60 8.580 8.580 8.286 0.294 25464
4537 1 13 . 1 1 61 61 GLN N N 61 114.500 114.500 116.898 -2.398 25464
4538 1 13 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.064 -0.054 25464
4539 1 13 . 1 1 61 61 GLN C C 61 176.700 176.700 178.561 -1.861 25464
4540 1 13 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.132 -1.431 25464
4541 1 13 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.647 0.153 25464
4542 1 13 . 1 1 61 61 GLN H H 61 7.810 7.810 7.550 0.260 25464
4543 1 13 . 1 1 62 62 HIS N N 62 115.100 115.100 119.480 -4.380 25464
4544 1 13 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.708 -0.328 25464
4545 1 13 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.396 0.904 25464
4546 1 13 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.705 -0.705 25464
4547 1 13 . 1 1 62 62 HIS H H 62 7.730 7.730 7.868 -0.138 25464
4548 1 13 . 1 1 63 63 TRP N N 63 121.500 121.500 121.967 -0.467 25464
4549 1 13 . 1 1 63 63 TRP CA C 63 58.800 58.800 60.270 -1.470 25464
4550 1 13 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.156 0.544 25464
4551 1 13 . 1 1 63 63 TRP H H 63 8.180 8.180 8.091 0.089 25464
4552 1 13 . 1 1 64 64 THR N N 64 114.900 114.900 114.803 0.097 25464
4553 1 13 . 1 1 64 64 THR HA H 64 4.180 4.180 4.072 0.108 25464
4554 1 13 . 1 1 64 64 THR CA C 64 62.100 62.100 63.937 -1.837 25464
4555 1 13 . 1 1 64 64 THR CB C 64 69.500 69.500 68.924 0.577 25464
4556 1 13 . 1 1 64 64 THR H H 64 7.940 7.940 7.560 0.380 25464
4557 1 13 . 1 1 65 65 ASP N N 65 122.900 122.900 122.987 -0.087 25464
4558 1 13 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.598 -0.198 25464
4559 1 13 . 1 1 65 65 ASP CB C 65 41.100 41.100 40.594 0.506 25464
4560 1 13 . 1 1 65 65 ASP H H 65 8.340 8.340 7.396 0.944 25464
4561 1 13 . 1 1 66 66 ILE N N 66 122.200 122.200 123.312 -1.112 25464
4562 1 13 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.219 -0.059 25464
4563 1 13 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.967 0.133 25464
4564 1 13 . 1 1 66 66 ILE CB C 66 38.500 38.500 38.475 0.025 25464
4565 1 13 . 1 1 66 66 ILE H H 66 8.250 8.250 8.104 0.146 25464
4566 1 13 . 1 1 67 67 ARG N N 67 124.000 124.000 128.804 -4.804 25464
4567 1 13 . 1 1 67 67 ARG CA C 67 53.900 53.900 56.957 -3.057 25464
4568 1 13 . 1 1 67 67 ARG CB C 67 30.000 30.000 29.314 0.686 25464
4569 1 13 . 1 1 67 67 ARG H H 67 8.490 8.490 8.838 -0.348 25464
4570 1 13 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.418 0.022 25464
4571 1 13 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.355 0.745 25464
4572 1 13 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.044 1.056 25464
4573 1 13 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.296 0.034 25464
4574 1 13 . 1 1 69 69 LYS C C 69 175.900 175.900 175.963 -0.063 25464
4575 1 13 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.111 0.189 25464
4576 1 13 . 1 1 69 69 LYS CB C 69 33.000 33.000 30.822 2.179 25464
4577 1 13 . 1 1 69 69 LYS H H 69 8.270 8.270 8.439 -0.169 25464
4578 1 13 . 1 1 70 70 SER N N 70 122.300 122.300 119.656 2.644 25464
4579 1 13 . 1 1 70 70 SER HA H 70 4.580 4.580 4.469 0.111 25464
4580 1 13 . 1 1 70 70 SER CA C 70 59.900 59.900 58.060 1.840 25464
4581 1 13 . 1 1 70 70 SER CB C 70 65.100 65.100 63.600 1.500 25464
4582 1 13 . 1 1 70 70 SER H H 70 8.140 8.140 8.288 -0.148 25464
4583 1 13 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.623 -0.303 25464
4584 1 13 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.227 1.173 25464
4585 1 13 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.239 -1.139 25464
4586 1 13 . 1 1 76 76 ALA N N 76 124.000 124.000 123.645 0.355 25464
4587 1 13 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.493 -0.163 25464
4588 1 13 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.535 1.165 25464
4589 1 13 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.362 -0.362 25464
4590 1 13 . 1 1 76 76 ALA H H 76 8.200 8.200 8.306 -0.106 25464
4591 1 13 . 1 1 77 77 SER N N 77 114.100 114.100 118.871 -4.771 25464
4592 1 13 . 1 1 77 77 SER HA H 77 4.450 4.450 4.475 -0.025 25464
4593 1 13 . 1 1 77 77 SER CA C 77 58.200 58.200 58.234 -0.034 25464
4594 1 13 . 1 1 77 77 SER CB C 77 63.900 63.900 62.111 1.789 25464
4595 1 13 . 1 1 77 77 SER H H 77 8.210 8.210 8.872 -0.662 25464
4596 1 13 . 1 1 78 78 GLY N N 78 110.500 110.500 113.753 -3.253 25464
4597 1 13 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.300 0.100 25464
4598 1 13 . 1 1 78 78 GLY H H 78 8.390 8.390 7.976 0.414 25464
4599 1 13 . 1 1 79 79 GLN N N 79 119.600 119.600 120.190 -0.590 25464
4600 1 13 . 1 1 79 79 GLN CA C 79 55.600 55.600 57.204 -1.604 25464
4601 1 13 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.880 -1.280 25464
4602 1 13 . 1 1 79 79 GLN H H 79 8.250 8.250 9.029 -0.779 25464
4603 1 14 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.470 -0.010 25464
4604 1 14 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.608 0.792 25464
4605 1 14 . 1 1 2 2 PRO CB C 2 32.100 32.100 30.393 1.707 25464
4606 1 14 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.895 0.205 25464
4607 1 14 . 1 1 10 10 ASP N N 10 121.500 121.500 122.396 -0.896 25464
4608 1 14 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.607 -0.007 25464
4609 1 14 . 1 1 10 10 ASP C C 10 175.300 175.300 174.906 0.394 25464
4610 1 14 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.304 0.196 25464
4611 1 14 . 1 1 10 10 ASP CB C 10 40.900 40.900 40.045 0.855 25464
4612 1 14 . 1 1 10 10 ASP H H 10 8.420 8.420 8.629 -0.209 25464
4613 1 14 . 1 1 11 11 ASN N N 11 118.400 118.400 119.730 -1.330 25464
4614 1 14 . 1 1 11 11 ASN HA H 11 4.950 4.950 5.015 -0.065 25464
4615 1 14 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.428 0.372 25464
4616 1 14 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.355 0.745 25464
4617 1 14 . 1 1 11 11 ASN H H 11 8.270 8.270 7.770 0.500 25464
4618 1 14 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.220 0.160 25464
4619 1 14 . 1 1 12 12 PRO C C 12 177.100 177.100 176.550 0.550 25464
4620 1 14 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.357 -0.657 25464
4621 1 14 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.867 0.033 25464
4622 1 14 . 1 1 13 13 PHE N N 13 117.500 117.500 109.626 7.874 25464
4623 1 14 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.480 0.020 25464
4624 1 14 . 1 1 13 13 PHE C C 13 175.700 175.700 174.551 1.149 25464
4625 1 14 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.767 1.533 25464
4626 1 14 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.478 0.222 25464
4627 1 14 . 1 1 13 13 PHE H H 13 8.120 8.120 7.080 1.040 25464
4628 1 14 . 1 1 14 14 ASP N N 14 120.000 120.000 120.076 -0.076 25464
4629 1 14 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.275 0.345 25464
4630 1 14 . 1 1 14 14 ASP C C 14 175.800 175.800 176.408 -0.608 25464
4631 1 14 . 1 1 14 14 ASP CA C 14 54.400 54.400 55.835 -1.435 25464
4632 1 14 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.263 1.137 25464
4633 1 14 . 1 1 14 14 ASP H H 14 8.010 8.010 7.790 0.220 25464
4634 1 14 . 1 1 15 15 ASP N N 15 119.900 119.900 119.623 0.277 25464
4635 1 14 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.538 0.072 25464
4636 1 14 . 1 1 15 15 ASP C C 15 176.700 176.700 176.401 0.299 25464
4637 1 14 . 1 1 15 15 ASP CA C 15 54.500 54.500 54.435 0.065 25464
4638 1 14 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.939 -1.739 25464
4639 1 14 . 1 1 15 15 ASP H H 15 7.900 7.900 7.857 0.043 25464
4640 1 14 . 1 1 16 16 GLU N N 16 122.700 122.700 119.502 3.198 25464
4641 1 14 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.383 -0.153 25464
4642 1 14 . 1 1 16 16 GLU C C 16 176.600 176.600 177.855 -1.255 25464
4643 1 14 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.070 -0.670 25464
4644 1 14 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.930 -0.830 25464
4645 1 14 . 1 1 16 16 GLU H H 16 8.610 8.610 8.585 0.025 25464
4646 1 14 . 1 1 17 17 ASP N N 17 119.500 119.500 121.665 -2.165 25464
4647 1 14 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.584 0.266 25464
4648 1 14 . 1 1 17 17 ASP C C 17 176.300 176.300 177.419 -1.119 25464
4649 1 14 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.765 -1.465 25464
4650 1 14 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.418 0.182 25464
4651 1 14 . 1 1 17 17 ASP H H 17 8.490 8.490 8.529 -0.039 25464
4652 1 14 . 1 1 18 18 GLY N N 18 107.700 107.700 108.966 -1.266 25464
4653 1 14 . 1 1 18 18 GLY C C 18 172.700 172.700 173.116 -0.416 25464
4654 1 14 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.549 0.351 25464
4655 1 14 . 1 1 18 18 GLY H H 18 8.070 8.070 8.058 0.012 25464
4656 1 14 . 1 1 19 19 MET N N 19 117.400 117.400 121.868 -4.468 25464
4657 1 14 . 1 1 19 19 MET HA H 19 4.890 4.890 4.223 0.667 25464
4658 1 14 . 1 1 19 19 MET C C 19 176.000 176.000 174.741 1.259 25464
4659 1 14 . 1 1 19 19 MET CA C 19 53.700 53.700 53.421 0.279 25464
4660 1 14 . 1 1 19 19 MET CB C 19 35.100 35.100 31.749 3.351 25464
4661 1 14 . 1 1 19 19 MET H H 19 7.820 7.820 8.192 -0.372 25464
4662 1 14 . 1 1 20 20 PHE N N 20 120.100 120.100 120.277 -0.177 25464
4663 1 14 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.649 0.361 25464
4664 1 14 . 1 1 20 20 PHE C C 20 174.200 174.200 174.997 -0.797 25464
4665 1 14 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.414 1.986 25464
4666 1 14 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.977 3.823 25464
4667 1 14 . 1 1 20 20 PHE H H 20 9.370 9.370 8.638 0.732 25464
4668 1 14 . 1 1 21 21 PHE N N 21 115.200 115.200 116.912 -1.712 25464
4669 1 14 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.194 0.436 25464
4670 1 14 . 1 1 21 21 PHE C C 21 177.500 177.500 174.926 2.574 25464
4671 1 14 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.192 0.308 25464
4672 1 14 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.425 3.675 25464
4673 1 14 . 1 1 21 21 PHE H H 21 9.600 9.600 8.458 1.142 25464
4674 1 14 . 1 1 22 22 VAL N N 22 116.600 116.600 121.295 -4.695 25464
4675 1 14 . 1 1 22 22 VAL C C 22 175.000 175.000 175.686 -0.686 25464
4676 1 14 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.821 0.880 25464
4677 1 14 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.505 0.295 25464
4678 1 14 . 1 1 22 22 VAL H H 22 8.750 8.750 8.522 0.228 25464
4679 1 14 . 1 1 23 23 LEU N N 23 126.500 126.500 127.720 -1.220 25464
4680 1 14 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.572 0.068 25464
4681 1 14 . 1 1 23 23 LEU C C 23 176.200 176.200 175.974 0.226 25464
4682 1 14 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.997 -1.197 25464
4683 1 14 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.340 1.360 25464
4684 1 14 . 1 1 23 23 LEU H H 23 9.530 9.530 8.914 0.616 25464
4685 1 14 . 1 1 24 24 ILE N N 24 117.700 117.700 118.115 -0.415 25464
4686 1 14 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.510 0.180 25464
4687 1 14 . 1 1 24 24 ILE C C 24 174.300 174.300 173.484 0.816 25464
4688 1 14 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.069 -0.169 25464
4689 1 14 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.835 0.765 25464
4690 1 14 . 1 1 24 24 ILE H H 24 9.300 9.300 8.871 0.429 25464
4691 1 14 . 1 1 25 25 ASN N N 25 122.500 122.500 123.008 -0.508 25464
4692 1 14 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.833 -0.133 25464
4693 1 14 . 1 1 25 25 ASN C C 25 177.700 177.700 175.566 2.134 25464
4694 1 14 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.646 -0.946 25464
4695 1 14 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.373 -2.773 25464
4696 1 14 . 1 1 25 25 ASN H H 25 7.300 7.300 8.598 -1.298 25464
4697 1 14 . 1 1 26 26 ASP N N 26 118.100 118.100 122.729 -4.629 25464
4698 1 14 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.306 0.054 25464
4699 1 14 . 1 1 26 26 ASP C C 26 176.700 176.700 176.287 0.413 25464
4700 1 14 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.244 -0.744 25464
4701 1 14 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.405 -0.505 25464
4702 1 14 . 1 1 26 26 ASP H H 26 8.340 8.340 8.736 -0.396 25464
4703 1 14 . 1 1 27 27 GLU N N 27 117.600 117.600 117.602 -0.002 25464
4704 1 14 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.301 0.239 25464
4705 1 14 . 1 1 27 27 GLU C C 27 175.100 175.100 175.936 -0.836 25464
4706 1 14 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.086 -0.386 25464
4707 1 14 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.833 0.667 25464
4708 1 14 . 1 1 27 27 GLU H H 27 7.190 7.190 8.360 -1.170 25464
4709 1 14 . 1 1 28 28 GLU N N 28 112.800 112.800 114.401 -1.601 25464
4710 1 14 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.885 -0.295 25464
4711 1 14 . 1 1 28 28 GLU C C 28 175.200 175.200 175.530 -0.330 25464
4712 1 14 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.477 0.323 25464
4713 1 14 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.467 -0.967 25464
4714 1 14 . 1 1 28 28 GLU H H 28 8.050 8.050 8.107 -0.057 25464
4715 1 14 . 1 1 29 29 GLN N N 29 117.200 117.200 117.941 -0.741 25464
4716 1 14 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.199 0.081 25464
4717 1 14 . 1 1 29 29 GLN C C 29 174.600 174.600 174.864 -0.264 25464
4718 1 14 . 1 1 29 29 GLN CA C 29 54.900 54.900 56.254 -1.354 25464
4719 1 14 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.251 0.049 25464
4720 1 14 . 1 1 29 29 GLN H H 29 7.840 7.840 7.740 0.100 25464
4721 1 14 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.944 0.116 25464
4722 1 14 . 1 1 30 30 HIS C C 30 175.900 175.900 174.611 1.289 25464
4723 1 14 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.488 1.212 25464
4724 1 14 . 1 1 30 30 HIS CB C 30 32.900 32.900 32.711 0.189 25464
4725 1 14 . 1 1 31 31 SER N N 31 113.100 113.100 116.064 -2.964 25464
4726 1 14 . 1 1 31 31 SER HA H 31 4.740 4.740 4.762 -0.022 25464
4727 1 14 . 1 1 31 31 SER C C 31 173.200 173.200 171.967 1.233 25464
4728 1 14 . 1 1 31 31 SER CA C 31 57.400 57.400 58.041 -0.641 25464
4729 1 14 . 1 1 31 31 SER CB C 31 66.600 66.600 64.382 2.217 25464
4730 1 14 . 1 1 31 31 SER H H 31 8.850 8.850 8.664 0.186 25464
4731 1 14 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.092 0.268 25464
4732 1 14 . 1 1 32 32 LEU C C 32 178.200 178.200 174.844 3.356 25464
4733 1 14 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.353 1.647 25464
4734 1 14 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.654 -0.953 25464
4735 1 14 . 1 1 33 33 TRP N N 33 123.400 123.400 128.541 -5.141 25464
4736 1 14 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.977 0.323 25464
4737 1 14 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.347 -0.247 25464
4738 1 14 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.022 1.478 25464
4739 1 14 . 1 1 33 33 TRP H H 33 9.170 9.170 9.334 -0.164 25464
4740 1 14 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.738 -0.928 25464
4741 1 14 . 1 1 34 34 PRO C C 34 177.400 177.400 177.609 -0.209 25464
4742 1 14 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.406 -0.606 25464
4743 1 14 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.501 -1.501 25464
4744 1 14 . 1 1 35 35 THR N N 35 107.700 107.700 114.378 -6.678 25464
4745 1 14 . 1 1 35 35 THR HA H 35 3.730 3.730 4.315 -0.585 25464
4746 1 14 . 1 1 35 35 THR C C 35 176.100 176.100 175.221 0.879 25464
4747 1 14 . 1 1 35 35 THR CA C 35 63.600 63.600 64.950 -1.350 25464
4748 1 14 . 1 1 35 35 THR CB C 35 68.200 68.200 68.566 -0.366 25464
4749 1 14 . 1 1 35 35 THR H H 35 7.260 7.260 7.969 -0.709 25464
4750 1 14 . 1 1 36 36 PHE N N 36 114.500 114.500 118.090 -3.590 25464
4751 1 14 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.563 -0.053 25464
4752 1 14 . 1 1 36 36 PHE C C 36 174.500 174.500 174.934 -0.434 25464
4753 1 14 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.657 -0.757 25464
4754 1 14 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.531 -0.931 25464
4755 1 14 . 1 1 36 36 PHE H H 36 6.770 6.770 7.533 -0.763 25464
4756 1 14 . 1 1 37 37 ALA N N 37 125.300 125.300 121.796 3.504 25464
4757 1 14 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.624 0.086 25464
4758 1 14 . 1 1 37 37 ALA C C 37 177.300 177.300 175.176 2.124 25464
4759 1 14 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.249 -1.049 25464
4760 1 14 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.260 -0.860 25464
4761 1 14 . 1 1 37 37 ALA H H 37 6.950 6.950 7.475 -0.525 25464
4762 1 14 . 1 1 38 38 ASP N N 38 124.500 124.500 119.106 5.394 25464
4763 1 14 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.884 -0.404 25464
4764 1 14 . 1 1 38 38 ASP C C 38 176.700 176.700 176.296 0.404 25464
4765 1 14 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.398 1.602 25464
4766 1 14 . 1 1 38 38 ASP CB C 38 40.400 40.400 43.085 -2.685 25464
4767 1 14 . 1 1 38 38 ASP H H 38 8.870 8.870 8.604 0.266 25464
4768 1 14 . 1 1 39 39 VAL N N 39 126.000 126.000 123.247 2.753 25464
4769 1 14 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.792 -0.432 25464
4770 1 14 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.292 0.808 25464
4771 1 14 . 1 1 39 39 VAL CB C 39 32.200 32.200 32.279 -0.079 25464
4772 1 14 . 1 1 39 39 VAL H H 39 8.650 8.650 8.356 0.294 25464
4773 1 14 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.340 -0.090 25464
4774 1 14 . 1 1 40 40 PRO C C 40 175.800 175.800 176.610 -0.810 25464
4775 1 14 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.600 -0.400 25464
4776 1 14 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.757 -0.057 25464
4777 1 14 . 1 1 41 41 ALA N N 41 122.700 122.700 126.392 -3.692 25464
4778 1 14 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.080 0.100 25464
4779 1 14 . 1 1 41 41 ALA C C 41 179.000 179.000 178.759 0.241 25464
4780 1 14 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.505 -0.205 25464
4781 1 14 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.071 -0.771 25464
4782 1 14 . 1 1 41 41 ALA H H 41 8.280 8.280 8.474 -0.194 25464
4783 1 14 . 1 1 42 42 GLY N N 42 109.800 109.800 111.770 -1.970 25464
4784 1 14 . 1 1 42 42 GLY C C 42 173.800 173.800 173.980 -0.180 25464
4785 1 14 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.826 -0.126 25464
4786 1 14 . 1 1 42 42 GLY H H 42 8.770 8.770 8.410 0.360 25464
4787 1 14 . 1 1 43 43 TRP N N 43 120.300 120.300 123.042 -2.742 25464
4788 1 14 . 1 1 43 43 TRP HA H 43 4.950 4.950 4.926 0.024 25464
4789 1 14 . 1 1 43 43 TRP C C 43 174.900 174.900 176.302 -1.402 25464
4790 1 14 . 1 1 43 43 TRP CA C 43 55.700 55.700 57.072 -1.372 25464
4791 1 14 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.096 1.904 25464
4792 1 14 . 1 1 43 43 TRP H H 43 7.740 7.740 8.000 -0.260 25464
4793 1 14 . 1 1 44 44 ARG N N 44 117.700 117.700 122.640 -4.940 25464
4794 1 14 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.740 -0.020 25464
4795 1 14 . 1 1 44 44 ARG C C 44 174.900 174.900 175.159 -0.259 25464
4796 1 14 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.634 -0.734 25464
4797 1 14 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.595 0.605 25464
4798 1 14 . 1 1 44 44 ARG H H 44 8.990 8.990 8.950 0.040 25464
4799 1 14 . 1 1 45 45 VAL N N 45 122.800 122.800 125.326 -2.526 25464
4800 1 14 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.143 -0.163 25464
4801 1 14 . 1 1 45 45 VAL C C 45 177.600 177.600 176.887 0.713 25464
4802 1 14 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.192 0.508 25464
4803 1 14 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.658 1.442 25464
4804 1 14 . 1 1 45 45 VAL H H 45 8.720 8.720 8.683 0.037 25464
4805 1 14 . 1 1 46 46 VAL N N 46 120.400 120.400 124.009 -3.609 25464
4806 1 14 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.159 0.521 25464
4807 1 14 . 1 1 46 46 VAL C C 46 174.200 174.200 175.314 -1.114 25464
4808 1 14 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.510 -3.010 25464
4809 1 14 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.870 1.130 25464
4810 1 14 . 1 1 46 46 VAL H H 46 9.060 9.060 8.693 0.367 25464
4811 1 14 . 1 1 47 47 PHE N N 47 121.100 121.100 121.631 -0.531 25464
4812 1 14 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.643 -0.193 25464
4813 1 14 . 1 1 47 47 PHE CA C 47 58.700 58.700 55.377 3.323 25464
4814 1 14 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.239 0.461 25464
4815 1 14 . 1 1 47 47 PHE H H 47 7.680 7.680 8.227 -0.547 25464
4816 1 14 . 1 1 48 48 GLY N N 48 112.600 112.600 112.668 -0.068 25464
4817 1 14 . 1 1 48 48 GLY C C 48 174.700 174.700 173.888 0.812 25464
4818 1 14 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.383 -2.383 25464
4819 1 14 . 1 1 48 48 GLY H H 48 7.380 7.380 8.669 -1.289 25464
4820 1 14 . 1 1 49 49 GLU N N 49 120.600 120.600 119.003 1.597 25464
4821 1 14 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.198 0.032 25464
4822 1 14 . 1 1 49 49 GLU C C 49 174.900 174.900 174.959 -0.059 25464
4823 1 14 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.204 -0.904 25464
4824 1 14 . 1 1 49 49 GLU CB C 49 31.200 31.200 27.993 3.207 25464
4825 1 14 . 1 1 49 49 GLU H H 49 8.510 8.510 8.428 0.082 25464
4826 1 14 . 1 1 50 50 ALA N N 50 126.600 126.600 128.222 -1.622 25464
4827 1 14 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.475 0.165 25464
4828 1 14 . 1 1 50 50 ALA C C 50 175.100 175.100 175.811 -0.711 25464
4829 1 14 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.103 1.296 25464
4830 1 14 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.552 0.648 25464
4831 1 14 . 1 1 50 50 ALA H H 50 9.440 9.440 8.566 0.874 25464
4832 1 14 . 1 1 51 51 SER N N 51 115.100 115.100 114.656 0.444 25464
4833 1 14 . 1 1 51 51 SER HA H 51 4.740 4.740 4.083 0.657 25464
4834 1 14 . 1 1 51 51 SER C C 51 175.000 175.000 176.296 -1.296 25464
4835 1 14 . 1 1 51 51 SER CA C 51 58.100 58.100 58.096 0.003 25464
4836 1 14 . 1 1 51 51 SER CB C 51 64.700 64.700 64.127 0.572 25464
4837 1 14 . 1 1 51 51 SER H H 51 8.950 8.950 8.646 0.304 25464
4838 1 14 . 1 1 52 52 ARG N N 52 123.500 123.500 127.788 -4.288 25464
4839 1 14 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.096 -0.686 25464
4840 1 14 . 1 1 52 52 ARG C C 52 178.200 178.200 177.765 0.435 25464
4841 1 14 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.546 1.454 25464
4842 1 14 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.109 -0.209 25464
4843 1 14 . 1 1 52 52 ARG H H 52 9.540 9.540 8.239 1.301 25464
4844 1 14 . 1 1 53 53 ALA N N 53 118.000 118.000 120.759 -2.759 25464
4845 1 14 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.132 -0.102 25464
4846 1 14 . 1 1 53 53 ALA C C 53 181.000 181.000 179.933 1.067 25464
4847 1 14 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.467 -0.167 25464
4848 1 14 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.631 0.469 25464
4849 1 14 . 1 1 53 53 ALA H H 53 8.770 8.770 7.987 0.783 25464
4850 1 14 . 1 1 54 54 SER N N 54 115.300 115.300 115.451 -0.151 25464
4851 1 14 . 1 1 54 54 SER HA H 54 4.350 4.350 4.318 0.032 25464
4852 1 14 . 1 1 54 54 SER C C 54 177.500 177.500 177.118 0.382 25464
4853 1 14 . 1 1 54 54 SER CA C 54 61.900 61.900 62.377 -0.477 25464
4854 1 14 . 1 1 54 54 SER CB C 54 63.100 63.100 62.771 0.329 25464
4855 1 14 . 1 1 54 54 SER H H 54 8.140 8.140 7.827 0.313 25464
4856 1 14 . 1 1 55 55 CYS N N 55 121.900 121.900 120.896 1.004 25464
4857 1 14 . 1 1 55 55 CYS HA H 55 4.160 4.160 4.241 -0.081 25464
4858 1 14 . 1 1 55 55 CYS C C 55 176.300 176.300 176.967 -0.667 25464
4859 1 14 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.678 -0.378 25464
4860 1 14 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.197 -0.197 25464
4861 1 14 . 1 1 55 55 CYS H H 55 8.430 8.430 8.191 0.239 25464
4862 1 14 . 1 1 56 56 VAL N N 56 121.100 121.100 120.920 0.180 25464
4863 1 14 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.601 -0.111 25464
4864 1 14 . 1 1 56 56 VAL C C 56 177.800 177.800 178.088 -0.288 25464
4865 1 14 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.193 -0.193 25464
4866 1 14 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.684 -0.084 25464
4867 1 14 . 1 1 56 56 VAL H H 56 8.750 8.750 8.721 0.029 25464
4868 1 14 . 1 1 57 57 GLU N N 57 119.200 119.200 120.418 -1.218 25464
4869 1 14 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.049 0.021 25464
4870 1 14 . 1 1 57 57 GLU C C 57 177.900 177.900 178.599 -0.699 25464
4871 1 14 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.363 -0.063 25464
4872 1 14 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.297 0.203 25464
4873 1 14 . 1 1 57 57 GLU H H 57 7.780 7.780 8.306 -0.526 25464
4874 1 14 . 1 1 58 58 TYR N N 58 119.400 119.400 120.106 -0.706 25464
4875 1 14 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.195 -0.305 25464
4876 1 14 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.188 0.012 25464
4877 1 14 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.873 -1.673 25464
4878 1 14 . 1 1 58 58 TYR H H 58 7.700 7.700 8.269 -0.569 25464
4879 1 14 . 1 1 59 59 VAL N N 59 121.500 121.500 118.212 3.288 25464
4880 1 14 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.711 -0.351 25464
4881 1 14 . 1 1 59 59 VAL C C 59 176.300 176.300 177.467 -1.167 25464
4882 1 14 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.909 0.491 25464
4883 1 14 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.864 -0.464 25464
4884 1 14 . 1 1 59 59 VAL H H 59 8.380 8.380 8.471 -0.091 25464
4885 1 14 . 1 1 60 60 ASP N N 60 120.000 120.000 117.685 2.315 25464
4886 1 14 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.366 0.044 25464
4887 1 14 . 1 1 60 60 ASP C C 60 178.300 178.300 179.124 -0.824 25464
4888 1 14 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.000 0.100 25464
4889 1 14 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.137 -0.537 25464
4890 1 14 . 1 1 60 60 ASP H H 60 8.580 8.580 7.997 0.583 25464
4891 1 14 . 1 1 61 61 GLN N N 61 114.500 114.500 117.836 -3.336 25464
4892 1 14 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.213 -0.203 25464
4893 1 14 . 1 1 61 61 GLN C C 61 176.700 176.700 177.669 -0.969 25464
4894 1 14 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.782 -1.082 25464
4895 1 14 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.882 -0.082 25464
4896 1 14 . 1 1 61 61 GLN H H 61 7.810 7.810 7.774 0.036 25464
4897 1 14 . 1 1 62 62 HIS N N 62 115.100 115.100 117.410 -2.310 25464
4898 1 14 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.466 -0.086 25464
4899 1 14 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.540 1.760 25464
4900 1 14 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.494 -0.494 25464
4901 1 14 . 1 1 62 62 HIS H H 62 7.730 7.730 7.515 0.215 25464
4902 1 14 . 1 1 63 63 TRP N N 63 121.500 121.500 121.310 0.190 25464
4903 1 14 . 1 1 63 63 TRP CA C 63 58.800 58.800 57.641 1.159 25464
4904 1 14 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.526 0.174 25464
4905 1 14 . 1 1 63 63 TRP H H 63 8.180 8.180 7.250 0.930 25464
4906 1 14 . 1 1 64 64 THR N N 64 114.900 114.900 111.281 3.619 25464
4907 1 14 . 1 1 64 64 THR HA H 64 4.180 4.180 4.039 0.141 25464
4908 1 14 . 1 1 64 64 THR CA C 64 62.100 62.100 61.855 0.245 25464
4909 1 14 . 1 1 64 64 THR CB C 64 69.500 69.500 69.274 0.226 25464
4910 1 14 . 1 1 64 64 THR H H 64 7.940 7.940 7.303 0.637 25464
4911 1 14 . 1 1 65 65 ASP N N 65 122.900 122.900 120.369 2.531 25464
4912 1 14 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.611 -0.211 25464
4913 1 14 . 1 1 65 65 ASP CB C 65 41.100 41.100 40.729 0.371 25464
4914 1 14 . 1 1 65 65 ASP H H 65 8.340 8.340 8.320 0.020 25464
4915 1 14 . 1 1 66 66 ILE N N 66 122.200 122.200 121.870 0.330 25464
4916 1 14 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.209 -0.049 25464
4917 1 14 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.523 0.577 25464
4918 1 14 . 1 1 66 66 ILE CB C 66 38.500 38.500 39.312 -0.812 25464
4919 1 14 . 1 1 66 66 ILE H H 66 8.250 8.250 8.153 0.097 25464
4920 1 14 . 1 1 67 67 ARG N N 67 124.000 124.000 123.105 0.895 25464
4921 1 14 . 1 1 67 67 ARG CA C 67 53.900 53.900 56.632 -2.732 25464
4922 1 14 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.506 1.494 25464
4923 1 14 . 1 1 67 67 ARG H H 67 8.490 8.490 8.592 -0.102 25464
4924 1 14 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.520 -0.080 25464
4925 1 14 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.630 0.470 25464
4926 1 14 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.525 -0.425 25464
4927 1 14 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.402 -0.072 25464
4928 1 14 . 1 1 69 69 LYS C C 69 175.900 175.900 176.871 -0.971 25464
4929 1 14 . 1 1 69 69 LYS CA C 69 56.300 56.300 55.614 0.686 25464
4930 1 14 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.149 0.851 25464
4931 1 14 . 1 1 69 69 LYS H H 69 8.270 8.270 8.486 -0.216 25464
4932 1 14 . 1 1 70 70 SER N N 70 122.300 122.300 116.407 5.893 25464
4933 1 14 . 1 1 70 70 SER HA H 70 4.580 4.580 4.404 0.176 25464
4934 1 14 . 1 1 70 70 SER CA C 70 59.900 59.900 58.389 1.511 25464
4935 1 14 . 1 1 70 70 SER CB C 70 65.100 65.100 62.092 3.008 25464
4936 1 14 . 1 1 70 70 SER H H 70 8.140 8.140 8.044 0.096 25464
4937 1 14 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.313 0.007 25464
4938 1 14 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.802 -0.402 25464
4939 1 14 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.060 0.039 25464
4940 1 14 . 1 1 76 76 ALA N N 76 124.000 124.000 121.613 2.387 25464
4941 1 14 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.240 0.090 25464
4942 1 14 . 1 1 76 76 ALA CA C 76 52.700 52.700 52.708 -0.007 25464
4943 1 14 . 1 1 76 76 ALA CB C 76 19.000 19.000 17.127 1.873 25464
4944 1 14 . 1 1 76 76 ALA H H 76 8.200 8.200 8.079 0.121 25464
4945 1 14 . 1 1 77 77 SER N N 77 114.100 114.100 118.895 -4.795 25464
4946 1 14 . 1 1 77 77 SER HA H 77 4.450 4.450 4.034 0.416 25464
4947 1 14 . 1 1 77 77 SER CA C 77 58.200 58.200 61.056 -2.856 25464
4948 1 14 . 1 1 77 77 SER CB C 77 63.900 63.900 61.818 2.082 25464
4949 1 14 . 1 1 77 77 SER H H 77 8.210 8.210 8.689 -0.479 25464
4950 1 14 . 1 1 78 78 GLY N N 78 110.500 110.500 109.285 1.215 25464
4951 1 14 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.811 -0.411 25464
4952 1 14 . 1 1 78 78 GLY H H 78 8.390 8.390 8.262 0.128 25464
4953 1 14 . 1 1 79 79 GLN N N 79 119.600 119.600 121.058 -1.458 25464
4954 1 14 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.136 0.464 25464
4955 1 14 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.503 0.097 25464
4956 1 14 . 1 1 79 79 GLN H H 79 8.250 8.250 7.717 0.533 25464
4957 1 15 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.909 -0.449 25464
4958 1 15 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.210 1.190 25464
4959 1 15 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.873 -0.773 25464
4960 1 15 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.857 0.243 25464
4961 1 15 . 1 1 10 10 ASP N N 10 121.500 121.500 120.839 0.661 25464
4962 1 15 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.474 0.126 25464
4963 1 15 . 1 1 10 10 ASP C C 10 175.300 175.300 175.239 0.061 25464
4964 1 15 . 1 1 10 10 ASP CA C 10 54.500 54.500 55.012 -0.512 25464
4965 1 15 . 1 1 10 10 ASP CB C 10 40.900 40.900 40.963 -0.063 25464
4966 1 15 . 1 1 10 10 ASP H H 10 8.420 8.420 8.304 0.116 25464
4967 1 15 . 1 1 11 11 ASN N N 11 118.400 118.400 121.077 -2.677 25464
4968 1 15 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.783 0.167 25464
4969 1 15 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.888 -0.088 25464
4970 1 15 . 1 1 11 11 ASN CB C 11 39.100 39.100 40.484 -1.384 25464
4971 1 15 . 1 1 11 11 ASN H H 11 8.270 8.270 8.134 0.136 25464
4972 1 15 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.321 0.059 25464
4973 1 15 . 1 1 12 12 PRO C C 12 177.100 177.100 177.559 -0.459 25464
4974 1 15 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.418 -0.718 25464
4975 1 15 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.756 0.144 25464
4976 1 15 . 1 1 13 13 PHE N N 13 117.500 117.500 112.076 5.424 25464
4977 1 15 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.407 0.093 25464
4978 1 15 . 1 1 13 13 PHE C C 13 175.700 175.700 175.107 0.593 25464
4979 1 15 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.513 1.787 25464
4980 1 15 . 1 1 13 13 PHE CB C 13 38.700 38.700 37.441 1.259 25464
4981 1 15 . 1 1 13 13 PHE H H 13 8.120 8.120 7.180 0.940 25464
4982 1 15 . 1 1 14 14 ASP N N 14 120.000 120.000 119.576 0.424 25464
4983 1 15 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.390 0.230 25464
4984 1 15 . 1 1 14 14 ASP C C 14 175.800 175.800 175.582 0.218 25464
4985 1 15 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.050 1.350 25464
4986 1 15 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.700 -0.300 25464
4987 1 15 . 1 1 14 14 ASP H H 14 8.010 8.010 7.405 0.605 25464
4988 1 15 . 1 1 15 15 ASP N N 15 119.900 119.900 121.249 -1.349 25464
4989 1 15 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.532 0.078 25464
4990 1 15 . 1 1 15 15 ASP C C 15 176.700 176.700 177.836 -1.136 25464
4991 1 15 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.009 -0.509 25464
4992 1 15 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.695 -1.495 25464
4993 1 15 . 1 1 15 15 ASP H H 15 7.900 7.900 7.573 0.327 25464
4994 1 15 . 1 1 16 16 GLU N N 16 122.700 122.700 125.587 -2.887 25464
4995 1 15 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.061 0.169 25464
4996 1 15 . 1 1 16 16 GLU C C 16 176.600 176.600 177.037 -0.437 25464
4997 1 15 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.947 -1.547 25464
4998 1 15 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.382 0.718 25464
4999 1 15 . 1 1 16 16 GLU H H 16 8.610 8.610 8.815 -0.205 25464
5000 1 15 . 1 1 17 17 ASP N N 17 119.500 119.500 118.897 0.603 25464
5001 1 15 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.562 0.288 25464
5002 1 15 . 1 1 17 17 ASP C C 17 176.300 176.300 176.904 -0.604 25464
5003 1 15 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.175 -0.875 25464
5004 1 15 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.938 0.662 25464
5005 1 15 . 1 1 17 17 ASP H H 17 8.490 8.490 8.339 0.151 25464
5006 1 15 . 1 1 18 18 GLY N N 18 107.700 107.700 108.168 -0.468 25464
5007 1 15 . 1 1 18 18 GLY C C 18 172.700 172.700 172.900 -0.200 25464
5008 1 15 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.510 0.390 25464
5009 1 15 . 1 1 18 18 GLY H H 18 8.070 8.070 7.713 0.357 25464
5010 1 15 . 1 1 19 19 MET N N 19 117.400 117.400 123.289 -5.889 25464
5011 1 15 . 1 1 19 19 MET HA H 19 4.890 4.890 4.143 0.747 25464
5012 1 15 . 1 1 19 19 MET C C 19 176.000 176.000 175.178 0.822 25464
5013 1 15 . 1 1 19 19 MET CA C 19 53.700 53.700 56.367 -2.667 25464
5014 1 15 . 1 1 19 19 MET CB C 19 35.100 35.100 32.596 2.504 25464
5015 1 15 . 1 1 19 19 MET H H 19 7.820 7.820 8.107 -0.287 25464
5016 1 15 . 1 1 20 20 PHE N N 20 120.100 120.100 120.302 -0.202 25464
5017 1 15 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.580 0.430 25464
5018 1 15 . 1 1 20 20 PHE C C 20 174.200 174.200 174.911 -0.711 25464
5019 1 15 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.081 2.319 25464
5020 1 15 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.149 3.651 25464
5021 1 15 . 1 1 20 20 PHE H H 20 9.370 9.370 8.720 0.650 25464
5022 1 15 . 1 1 21 21 PHE N N 21 115.200 115.200 116.209 -1.009 25464
5023 1 15 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.374 0.256 25464
5024 1 15 . 1 1 21 21 PHE C C 21 177.500 177.500 175.004 2.496 25464
5025 1 15 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.215 0.285 25464
5026 1 15 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.635 3.465 25464
5027 1 15 . 1 1 21 21 PHE H H 21 9.600 9.600 8.379 1.221 25464
5028 1 15 . 1 1 22 22 VAL N N 22 116.600 116.600 120.931 -4.331 25464
5029 1 15 . 1 1 22 22 VAL C C 22 175.000 175.000 175.286 -0.286 25464
5030 1 15 . 1 1 22 22 VAL CA C 22 62.700 62.700 62.077 0.623 25464
5031 1 15 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.410 0.390 25464
5032 1 15 . 1 1 22 22 VAL H H 22 8.750 8.750 8.618 0.132 25464
5033 1 15 . 1 1 23 23 LEU N N 23 126.500 126.500 128.181 -1.681 25464
5034 1 15 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.437 0.203 25464
5035 1 15 . 1 1 23 23 LEU C C 23 176.200 176.200 175.539 0.661 25464
5036 1 15 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.407 -1.607 25464
5037 1 15 . 1 1 23 23 LEU CB C 23 46.700 46.700 46.111 0.589 25464
5038 1 15 . 1 1 23 23 LEU H H 23 9.530 9.530 8.925 0.605 25464
5039 1 15 . 1 1 24 24 ILE N N 24 117.700 117.700 118.840 -1.140 25464
5040 1 15 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.322 0.368 25464
5041 1 15 . 1 1 24 24 ILE C C 24 174.300 174.300 173.390 0.910 25464
5042 1 15 . 1 1 24 24 ILE CA C 24 58.900 58.900 58.985 -0.085 25464
5043 1 15 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.465 1.135 25464
5044 1 15 . 1 1 24 24 ILE H H 24 9.300 9.300 8.991 0.309 25464
5045 1 15 . 1 1 25 25 ASN N N 25 122.500 122.500 125.601 -3.101 25464
5046 1 15 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.950 -0.250 25464
5047 1 15 . 1 1 25 25 ASN C C 25 177.700 177.700 176.114 1.586 25464
5048 1 15 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.856 -1.156 25464
5049 1 15 . 1 1 25 25 ASN CB C 25 37.600 37.600 39.503 -1.903 25464
5050 1 15 . 1 1 25 25 ASN H H 25 7.300 7.300 8.504 -1.204 25464
5051 1 15 . 1 1 26 26 ASP N N 26 118.100 118.100 123.350 -5.250 25464
5052 1 15 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.338 0.022 25464
5053 1 15 . 1 1 26 26 ASP C C 26 176.700 176.700 176.012 0.688 25464
5054 1 15 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.739 -0.238 25464
5055 1 15 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.507 -0.607 25464
5056 1 15 . 1 1 26 26 ASP H H 26 8.340 8.340 8.482 -0.142 25464
5057 1 15 . 1 1 27 27 GLU N N 27 117.600 117.600 117.392 0.208 25464
5058 1 15 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.289 0.251 25464
5059 1 15 . 1 1 27 27 GLU C C 27 175.100 175.100 175.777 -0.677 25464
5060 1 15 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.941 -0.241 25464
5061 1 15 . 1 1 27 27 GLU CB C 27 29.500 29.500 29.035 0.465 25464
5062 1 15 . 1 1 27 27 GLU H H 27 7.190 7.190 8.271 -1.081 25464
5063 1 15 . 1 1 28 28 GLU N N 28 112.800 112.800 114.305 -1.505 25464
5064 1 15 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.672 -0.082 25464
5065 1 15 . 1 1 28 28 GLU C C 28 175.200 175.200 175.111 0.089 25464
5066 1 15 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.134 0.666 25464
5067 1 15 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.887 -0.387 25464
5068 1 15 . 1 1 28 28 GLU H H 28 8.050 8.050 8.117 -0.067 25464
5069 1 15 . 1 1 29 29 GLN N N 29 117.200 117.200 117.707 -0.507 25464
5070 1 15 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.442 -0.162 25464
5071 1 15 . 1 1 29 29 GLN C C 29 174.600 174.600 174.969 -0.369 25464
5072 1 15 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.087 -0.187 25464
5073 1 15 . 1 1 29 29 GLN CB C 29 29.300 29.300 30.019 -0.719 25464
5074 1 15 . 1 1 29 29 GLN H H 29 7.840 7.840 7.401 0.439 25464
5075 1 15 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.435 0.625 25464
5076 1 15 . 1 1 30 30 HIS C C 30 175.900 175.900 174.877 1.023 25464
5077 1 15 . 1 1 30 30 HIS CA C 30 54.700 54.700 56.306 -1.606 25464
5078 1 15 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.218 1.681 25464
5079 1 15 . 1 1 31 31 SER N N 31 113.100 113.100 116.131 -3.031 25464
5080 1 15 . 1 1 31 31 SER HA H 31 4.740 4.740 4.760 -0.020 25464
5081 1 15 . 1 1 31 31 SER C C 31 173.200 173.200 172.124 1.076 25464
5082 1 15 . 1 1 31 31 SER CA C 31 57.400 57.400 57.197 0.203 25464
5083 1 15 . 1 1 31 31 SER CB C 31 66.600 66.600 65.257 1.343 25464
5084 1 15 . 1 1 31 31 SER H H 31 8.850 8.850 8.956 -0.106 25464
5085 1 15 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.060 0.300 25464
5086 1 15 . 1 1 32 32 LEU C C 32 178.200 178.200 174.891 3.309 25464
5087 1 15 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.529 1.471 25464
5088 1 15 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.085 -1.385 25464
5089 1 15 . 1 1 33 33 TRP N N 33 123.400 123.400 129.043 -5.643 25464
5090 1 15 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.936 0.364 25464
5091 1 15 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.181 -0.081 25464
5092 1 15 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.466 2.034 25464
5093 1 15 . 1 1 33 33 TRP H H 33 9.170 9.170 9.189 -0.019 25464
5094 1 15 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.408 -0.598 25464
5095 1 15 . 1 1 34 34 PRO C C 34 177.400 177.400 177.181 0.219 25464
5096 1 15 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.296 -0.496 25464
5097 1 15 . 1 1 34 34 PRO CB C 34 32.000 32.000 32.939 -0.939 25464
5098 1 15 . 1 1 35 35 THR N N 35 107.700 107.700 115.937 -8.237 25464
5099 1 15 . 1 1 35 35 THR HA H 35 3.730 3.730 4.230 -0.500 25464
5100 1 15 . 1 1 35 35 THR C C 35 176.100 176.100 175.575 0.525 25464
5101 1 15 . 1 1 35 35 THR CA C 35 63.600 63.600 64.853 -1.253 25464
5102 1 15 . 1 1 35 35 THR CB C 35 68.200 68.200 68.409 -0.209 25464
5103 1 15 . 1 1 35 35 THR H H 35 7.260 7.260 8.036 -0.776 25464
5104 1 15 . 1 1 36 36 PHE N N 36 114.500 114.500 118.155 -3.655 25464
5105 1 15 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.469 0.041 25464
5106 1 15 . 1 1 36 36 PHE C C 36 174.500 174.500 175.408 -0.908 25464
5107 1 15 . 1 1 36 36 PHE CA C 36 56.900 56.900 58.399 -1.499 25464
5108 1 15 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.399 -0.799 25464
5109 1 15 . 1 1 36 36 PHE H H 36 6.770 6.770 7.359 -0.589 25464
5110 1 15 . 1 1 37 37 ALA N N 37 125.300 125.300 120.902 4.398 25464
5111 1 15 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.430 0.280 25464
5112 1 15 . 1 1 37 37 ALA C C 37 177.300 177.300 176.103 1.197 25464
5113 1 15 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.637 -0.437 25464
5114 1 15 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.173 -0.773 25464
5115 1 15 . 1 1 37 37 ALA H H 37 6.950 6.950 7.184 -0.234 25464
5116 1 15 . 1 1 38 38 ASP N N 38 124.500 124.500 120.782 3.718 25464
5117 1 15 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.911 -0.431 25464
5118 1 15 . 1 1 38 38 ASP C C 38 176.700 176.700 176.509 0.191 25464
5119 1 15 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.889 1.111 25464
5120 1 15 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.443 -2.043 25464
5121 1 15 . 1 1 38 38 ASP H H 38 8.870 8.870 8.729 0.141 25464
5122 1 15 . 1 1 39 39 VAL N N 39 126.000 126.000 123.089 2.911 25464
5123 1 15 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.717 -0.357 25464
5124 1 15 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.905 0.195 25464
5125 1 15 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.459 0.742 25464
5126 1 15 . 1 1 39 39 VAL H H 39 8.650 8.650 8.425 0.225 25464
5127 1 15 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.384 -0.134 25464
5128 1 15 . 1 1 40 40 PRO C C 40 175.800 175.800 176.064 -0.264 25464
5129 1 15 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.435 -0.235 25464
5130 1 15 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.818 -0.118 25464
5131 1 15 . 1 1 41 41 ALA N N 41 122.700 122.700 125.917 -3.217 25464
5132 1 15 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.053 0.127 25464
5133 1 15 . 1 1 41 41 ALA C C 41 179.000 179.000 178.582 0.418 25464
5134 1 15 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.548 -0.248 25464
5135 1 15 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.932 -0.632 25464
5136 1 15 . 1 1 41 41 ALA H H 41 8.280 8.280 8.457 -0.177 25464
5137 1 15 . 1 1 42 42 GLY N N 42 109.800 109.800 111.354 -1.554 25464
5138 1 15 . 1 1 42 42 GLY C C 42 173.800 173.800 173.972 -0.172 25464
5139 1 15 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.832 -0.132 25464
5140 1 15 . 1 1 42 42 GLY H H 42 8.770 8.770 8.260 0.510 25464
5141 1 15 . 1 1 43 43 TRP N N 43 120.300 120.300 123.240 -2.940 25464
5142 1 15 . 1 1 43 43 TRP HA H 43 4.950 4.950 4.994 -0.044 25464
5143 1 15 . 1 1 43 43 TRP C C 43 174.900 174.900 176.005 -1.105 25464
5144 1 15 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.779 -1.079 25464
5145 1 15 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.523 2.477 25464
5146 1 15 . 1 1 43 43 TRP H H 43 7.740 7.740 7.912 -0.172 25464
5147 1 15 . 1 1 44 44 ARG N N 44 117.700 117.700 123.095 -5.395 25464
5148 1 15 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.731 -0.011 25464
5149 1 15 . 1 1 44 44 ARG C C 44 174.900 174.900 175.236 -0.336 25464
5150 1 15 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.676 -0.776 25464
5151 1 15 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.223 0.977 25464
5152 1 15 . 1 1 44 44 ARG H H 44 8.990 8.990 9.039 -0.049 25464
5153 1 15 . 1 1 45 45 VAL N N 45 122.800 122.800 125.453 -2.653 25464
5154 1 15 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.086 -0.106 25464
5155 1 15 . 1 1 45 45 VAL C C 45 177.600 177.600 176.532 1.068 25464
5156 1 15 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.697 0.003 25464
5157 1 15 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.913 0.187 25464
5158 1 15 . 1 1 45 45 VAL H H 45 8.720 8.720 8.644 0.076 25464
5159 1 15 . 1 1 46 46 VAL N N 46 120.400 120.400 124.425 -4.025 25464
5160 1 15 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.228 0.452 25464
5161 1 15 . 1 1 46 46 VAL C C 46 174.200 174.200 175.090 -0.890 25464
5162 1 15 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.581 -2.081 25464
5163 1 15 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.232 0.768 25464
5164 1 15 . 1 1 46 46 VAL H H 46 9.060 9.060 8.821 0.239 25464
5165 1 15 . 1 1 47 47 PHE N N 47 121.100 121.100 122.195 -1.095 25464
5166 1 15 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.643 -0.193 25464
5167 1 15 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.623 2.077 25464
5168 1 15 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.573 0.127 25464
5169 1 15 . 1 1 47 47 PHE H H 47 7.680 7.680 8.236 -0.556 25464
5170 1 15 . 1 1 48 48 GLY N N 48 112.600 112.600 112.836 -0.236 25464
5171 1 15 . 1 1 48 48 GLY C C 48 174.700 174.700 173.905 0.795 25464
5172 1 15 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.317 -2.317 25464
5173 1 15 . 1 1 48 48 GLY H H 48 7.380 7.380 8.311 -0.931 25464
5174 1 15 . 1 1 49 49 GLU N N 49 120.600 120.600 119.804 0.796 25464
5175 1 15 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.408 -0.178 25464
5176 1 15 . 1 1 49 49 GLU C C 49 174.900 174.900 175.512 -0.612 25464
5177 1 15 . 1 1 49 49 GLU CA C 49 56.300 56.300 58.117 -1.817 25464
5178 1 15 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.951 2.249 25464
5179 1 15 . 1 1 49 49 GLU H H 49 8.510 8.510 8.677 -0.167 25464
5180 1 15 . 1 1 50 50 ALA N N 50 126.600 126.600 127.793 -1.193 25464
5181 1 15 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.769 -0.129 25464
5182 1 15 . 1 1 50 50 ALA C C 50 175.100 175.100 175.414 -0.314 25464
5183 1 15 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.411 0.989 25464
5184 1 15 . 1 1 50 50 ALA CB C 50 23.200 23.200 23.143 0.057 25464
5185 1 15 . 1 1 50 50 ALA H H 50 9.440 9.440 8.632 0.808 25464
5186 1 15 . 1 1 51 51 SER N N 51 115.100 115.100 114.880 0.220 25464
5187 1 15 . 1 1 51 51 SER HA H 51 4.740 4.740 4.236 0.504 25464
5188 1 15 . 1 1 51 51 SER C C 51 175.000 175.000 175.705 -0.705 25464
5189 1 15 . 1 1 51 51 SER CA C 51 58.100 58.100 57.994 0.106 25464
5190 1 15 . 1 1 51 51 SER CB C 51 64.700 64.700 63.662 1.038 25464
5191 1 15 . 1 1 51 51 SER H H 51 8.950 8.950 8.718 0.232 25464
5192 1 15 . 1 1 52 52 ARG N N 52 123.500 123.500 126.309 -2.809 25464
5193 1 15 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.862 -0.452 25464
5194 1 15 . 1 1 52 52 ARG C C 52 178.200 178.200 177.807 0.393 25464
5195 1 15 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.680 1.320 25464
5196 1 15 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.725 0.175 25464
5197 1 15 . 1 1 52 52 ARG H H 52 9.540 9.540 8.516 1.024 25464
5198 1 15 . 1 1 53 53 ALA N N 53 118.000 118.000 119.691 -1.691 25464
5199 1 15 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.085 -0.055 25464
5200 1 15 . 1 1 53 53 ALA C C 53 181.000 181.000 179.958 1.042 25464
5201 1 15 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.130 0.170 25464
5202 1 15 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.645 0.455 25464
5203 1 15 . 1 1 53 53 ALA H H 53 8.770 8.770 8.652 0.118 25464
5204 1 15 . 1 1 54 54 SER N N 54 115.300 115.300 115.329 -0.029 25464
5205 1 15 . 1 1 54 54 SER HA H 54 4.350 4.350 4.123 0.227 25464
5206 1 15 . 1 1 54 54 SER C C 54 177.500 177.500 176.468 1.032 25464
5207 1 15 . 1 1 54 54 SER CA C 54 61.900 61.900 62.027 -0.127 25464
5208 1 15 . 1 1 54 54 SER CB C 54 63.100 63.100 62.464 0.636 25464
5209 1 15 . 1 1 54 54 SER H H 54 8.140 8.140 7.672 0.468 25464
5210 1 15 . 1 1 55 55 CYS N N 55 121.900 121.900 120.113 1.787 25464
5211 1 15 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.730 0.430 25464
5212 1 15 . 1 1 55 55 CYS C C 55 176.300 176.300 176.730 -0.430 25464
5213 1 15 . 1 1 55 55 CYS CA C 55 64.300 64.300 63.928 0.372 25464
5214 1 15 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.858 0.142 25464
5215 1 15 . 1 1 55 55 CYS H H 55 8.430 8.430 7.803 0.627 25464
5216 1 15 . 1 1 56 56 VAL N N 56 121.100 121.100 120.258 0.842 25464
5217 1 15 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.605 -0.115 25464
5218 1 15 . 1 1 56 56 VAL C C 56 177.800 177.800 178.224 -0.424 25464
5219 1 15 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.980 0.021 25464
5220 1 15 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.011 0.589 25464
5221 1 15 . 1 1 56 56 VAL H H 56 8.750 8.750 8.511 0.239 25464
5222 1 15 . 1 1 57 57 GLU N N 57 119.200 119.200 120.318 -1.118 25464
5223 1 15 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.956 0.114 25464
5224 1 15 . 1 1 57 57 GLU C C 57 177.900 177.900 178.560 -0.660 25464
5225 1 15 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.804 -0.504 25464
5226 1 15 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.710 -0.210 25464
5227 1 15 . 1 1 57 57 GLU H H 57 7.780 7.780 8.182 -0.402 25464
5228 1 15 . 1 1 58 58 TYR N N 58 119.400 119.400 120.124 -0.724 25464
5229 1 15 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.207 -0.317 25464
5230 1 15 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.993 0.207 25464
5231 1 15 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.624 -1.424 25464
5232 1 15 . 1 1 58 58 TYR H H 58 7.700 7.700 8.124 -0.424 25464
5233 1 15 . 1 1 59 59 VAL N N 59 121.500 121.500 119.385 2.115 25464
5234 1 15 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.269 0.091 25464
5235 1 15 . 1 1 59 59 VAL C C 59 176.300 176.300 177.378 -1.078 25464
5236 1 15 . 1 1 59 59 VAL CA C 59 67.400 67.400 67.009 0.391 25464
5237 1 15 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.315 0.085 25464
5238 1 15 . 1 1 59 59 VAL H H 59 8.380 8.380 8.148 0.232 25464
5239 1 15 . 1 1 60 60 ASP N N 60 120.000 120.000 118.119 1.881 25464
5240 1 15 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.730 -0.320 25464
5241 1 15 . 1 1 60 60 ASP C C 60 178.300 178.300 178.770 -0.470 25464
5242 1 15 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.225 -0.126 25464
5243 1 15 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.091 -0.491 25464
5244 1 15 . 1 1 60 60 ASP H H 60 8.580 8.580 8.141 0.439 25464
5245 1 15 . 1 1 61 61 GLN N N 61 114.500 114.500 116.362 -1.862 25464
5246 1 15 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.225 -0.215 25464
5247 1 15 . 1 1 61 61 GLN C C 61 176.700 176.700 177.658 -0.958 25464
5248 1 15 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.655 -0.955 25464
5249 1 15 . 1 1 61 61 GLN CB C 61 28.800 28.800 29.046 -0.246 25464
5250 1 15 . 1 1 61 61 GLN H H 61 7.810 7.810 7.769 0.041 25464
5251 1 15 . 1 1 62 62 HIS N N 62 115.100 115.100 118.324 -3.224 25464
5252 1 15 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.467 -0.087 25464
5253 1 15 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.394 0.906 25464
5254 1 15 . 1 1 62 62 HIS CB C 62 29.000 29.000 28.610 0.390 25464
5255 1 15 . 1 1 62 62 HIS H H 62 7.730 7.730 7.538 0.192 25464
5256 1 15 . 1 1 63 63 TRP N N 63 121.500 121.500 119.551 1.949 25464
5257 1 15 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.569 -0.769 25464
5258 1 15 . 1 1 63 63 TRP CB C 63 29.700 29.700 28.842 0.858 25464
5259 1 15 . 1 1 63 63 TRP H H 63 8.180 8.180 7.600 0.580 25464
5260 1 15 . 1 1 64 64 THR N N 64 114.900 114.900 113.663 1.237 25464
5261 1 15 . 1 1 64 64 THR HA H 64 4.180 4.180 4.028 0.152 25464
5262 1 15 . 1 1 64 64 THR CA C 64 62.100 62.100 64.680 -2.580 25464
5263 1 15 . 1 1 64 64 THR CB C 64 69.500 69.500 68.936 0.564 25464
5264 1 15 . 1 1 64 64 THR H H 64 7.940 7.940 7.922 0.018 25464
5265 1 15 . 1 1 65 65 ASP N N 65 122.900 122.900 121.619 1.281 25464
5266 1 15 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.433 -0.033 25464
5267 1 15 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.771 -0.671 25464
5268 1 15 . 1 1 65 65 ASP H H 65 8.340 8.340 8.328 0.012 25464
5269 1 15 . 1 1 66 66 ILE N N 66 122.200 122.200 122.161 0.039 25464
5270 1 15 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.604 -0.444 25464
5271 1 15 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.404 0.696 25464
5272 1 15 . 1 1 66 66 ILE CB C 66 38.500 38.500 40.284 -1.784 25464
5273 1 15 . 1 1 66 66 ILE H H 66 8.250 8.250 8.550 -0.300 25464
5274 1 15 . 1 1 67 67 ARG N N 67 124.000 124.000 129.644 -5.644 25464
5275 1 15 . 1 1 67 67 ARG CA C 67 53.900 53.900 59.441 -5.541 25464
5276 1 15 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.258 1.742 25464
5277 1 15 . 1 1 67 67 ARG H H 67 8.490 8.490 8.470 0.020 25464
5278 1 15 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.285 0.155 25464
5279 1 15 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.403 -0.303 25464
5280 1 15 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.819 0.281 25464
5281 1 15 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.047 0.283 25464
5282 1 15 . 1 1 69 69 LYS C C 69 175.900 175.900 175.228 0.672 25464
5283 1 15 . 1 1 69 69 LYS CA C 69 56.300 56.300 57.110 -0.810 25464
5284 1 15 . 1 1 69 69 LYS CB C 69 33.000 33.000 31.129 1.871 25464
5285 1 15 . 1 1 69 69 LYS H H 69 8.270 8.270 7.979 0.291 25464
5286 1 15 . 1 1 70 70 SER N N 70 122.300 122.300 118.763 3.537 25464
5287 1 15 . 1 1 70 70 SER HA H 70 4.580 4.580 4.638 -0.058 25464
5288 1 15 . 1 1 70 70 SER CA C 70 59.900 59.900 57.605 2.295 25464
5289 1 15 . 1 1 70 70 SER CB C 70 65.100 65.100 64.264 0.836 25464
5290 1 15 . 1 1 70 70 SER H H 70 8.140 8.140 8.183 -0.043 25464
5291 1 15 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.340 -0.020 25464
5292 1 15 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.809 0.591 25464
5293 1 15 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.468 -1.369 25464
5294 1 15 . 1 1 76 76 ALA N N 76 124.000 124.000 127.995 -3.995 25464
5295 1 15 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.440 -0.110 25464
5296 1 15 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.205 1.495 25464
5297 1 15 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.601 -0.601 25464
5298 1 15 . 1 1 76 76 ALA H H 76 8.200 8.200 8.253 -0.053 25464
5299 1 15 . 1 1 77 77 SER N N 77 114.100 114.100 114.441 -0.341 25464
5300 1 15 . 1 1 77 77 SER HA H 77 4.450 4.450 4.288 0.162 25464
5301 1 15 . 1 1 77 77 SER CA C 77 58.200 58.200 57.850 0.350 25464
5302 1 15 . 1 1 77 77 SER CB C 77 63.900 63.900 63.759 0.141 25464
5303 1 15 . 1 1 77 77 SER H H 77 8.210 8.210 8.032 0.178 25464
5304 1 15 . 1 1 78 78 GLY N N 78 110.500 110.500 114.091 -3.591 25464
5305 1 15 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.973 0.427 25464
5306 1 15 . 1 1 78 78 GLY H H 78 8.390 8.390 8.601 -0.211 25464
5307 1 15 . 1 1 79 79 GLN N N 79 119.600 119.600 121.441 -1.841 25464
5308 1 15 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.227 0.373 25464
5309 1 15 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.785 -1.185 25464
5310 1 15 . 1 1 79 79 GLN H H 79 8.250 8.250 8.001 0.249 25464
5311 1 16 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.673 -0.213 25464
5312 1 16 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.867 0.534 25464
5313 1 16 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.341 -0.241 25464
5314 1 16 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.842 0.258 25464
5315 1 16 . 1 1 10 10 ASP N N 10 121.500 121.500 123.562 -2.062 25464
5316 1 16 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.409 0.191 25464
5317 1 16 . 1 1 10 10 ASP C C 10 175.300 175.300 175.710 -0.410 25464
5318 1 16 . 1 1 10 10 ASP CA C 10 54.500 54.500 55.703 -1.203 25464
5319 1 16 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.130 -0.230 25464
5320 1 16 . 1 1 10 10 ASP H H 10 8.420 8.420 8.587 -0.167 25464
5321 1 16 . 1 1 11 11 ASN N N 11 118.400 118.400 116.436 1.964 25464
5322 1 16 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.876 0.074 25464
5323 1 16 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.339 0.461 25464
5324 1 16 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.731 0.369 25464
5325 1 16 . 1 1 11 11 ASN H H 11 8.270 8.270 7.941 0.329 25464
5326 1 16 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.399 -0.019 25464
5327 1 16 . 1 1 12 12 PRO C C 12 177.100 177.100 175.359 1.741 25464
5328 1 16 . 1 1 12 12 PRO CA C 12 63.700 63.700 62.984 0.716 25464
5329 1 16 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.600 0.300 25464
5330 1 16 . 1 1 13 13 PHE N N 13 117.500 117.500 117.570 -0.070 25464
5331 1 16 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.652 -0.152 25464
5332 1 16 . 1 1 13 13 PHE C C 13 175.700 175.700 175.257 0.443 25464
5333 1 16 . 1 1 13 13 PHE CA C 13 58.300 58.300 55.856 2.444 25464
5334 1 16 . 1 1 13 13 PHE CB C 13 38.700 38.700 39.073 -0.373 25464
5335 1 16 . 1 1 13 13 PHE H H 13 8.120 8.120 7.409 0.711 25464
5336 1 16 . 1 1 14 14 ASP N N 14 120.000 120.000 118.478 1.522 25464
5337 1 16 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.557 0.063 25464
5338 1 16 . 1 1 14 14 ASP C C 14 175.800 175.800 175.728 0.072 25464
5339 1 16 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.780 0.620 25464
5340 1 16 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.616 0.784 25464
5341 1 16 . 1 1 14 14 ASP H H 14 8.010 8.010 8.151 -0.141 25464
5342 1 16 . 1 1 15 15 ASP N N 15 119.900 119.900 121.358 -1.458 25464
5343 1 16 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.757 -0.147 25464
5344 1 16 . 1 1 15 15 ASP C C 15 176.700 176.700 177.508 -0.808 25464
5345 1 16 . 1 1 15 15 ASP CA C 15 54.500 54.500 55.086 -0.586 25464
5346 1 16 . 1 1 15 15 ASP CB C 15 41.200 41.200 41.945 -0.745 25464
5347 1 16 . 1 1 15 15 ASP H H 15 7.900 7.900 8.141 -0.241 25464
5348 1 16 . 1 1 16 16 GLU N N 16 122.700 122.700 124.535 -1.835 25464
5349 1 16 . 1 1 16 16 GLU HA H 16 4.230 4.230 3.990 0.240 25464
5350 1 16 . 1 1 16 16 GLU C C 16 176.600 176.600 177.058 -0.458 25464
5351 1 16 . 1 1 16 16 GLU CA C 16 57.400 57.400 59.244 -1.844 25464
5352 1 16 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.422 0.678 25464
5353 1 16 . 1 1 16 16 GLU H H 16 8.610 8.610 8.879 -0.269 25464
5354 1 16 . 1 1 17 17 ASP N N 17 119.500 119.500 116.457 3.043 25464
5355 1 16 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.417 0.433 25464
5356 1 16 . 1 1 17 17 ASP C C 17 176.300 176.300 176.876 -0.576 25464
5357 1 16 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.525 -0.225 25464
5358 1 16 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.326 1.274 25464
5359 1 16 . 1 1 17 17 ASP H H 17 8.490 8.490 8.375 0.115 25464
5360 1 16 . 1 1 18 18 GLY N N 18 107.700 107.700 108.395 -0.695 25464
5361 1 16 . 1 1 18 18 GLY C C 18 172.700 172.700 173.077 -0.377 25464
5362 1 16 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.656 0.244 25464
5363 1 16 . 1 1 18 18 GLY H H 18 8.070 8.070 7.544 0.526 25464
5364 1 16 . 1 1 19 19 MET N N 19 117.400 117.400 123.391 -5.991 25464
5365 1 16 . 1 1 19 19 MET HA H 19 4.890 4.890 4.168 0.722 25464
5366 1 16 . 1 1 19 19 MET C C 19 176.000 176.000 175.210 0.790 25464
5367 1 16 . 1 1 19 19 MET CA C 19 53.700 53.700 56.065 -2.365 25464
5368 1 16 . 1 1 19 19 MET CB C 19 35.100 35.100 32.797 2.303 25464
5369 1 16 . 1 1 19 19 MET H H 19 7.820 7.820 8.097 -0.277 25464
5370 1 16 . 1 1 20 20 PHE N N 20 120.100 120.100 120.204 -0.104 25464
5371 1 16 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.579 0.431 25464
5372 1 16 . 1 1 20 20 PHE C C 20 174.200 174.200 174.812 -0.612 25464
5373 1 16 . 1 1 20 20 PHE CA C 20 57.400 57.400 54.889 2.510 25464
5374 1 16 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.953 3.847 25464
5375 1 16 . 1 1 20 20 PHE H H 20 9.370 9.370 8.521 0.849 25464
5376 1 16 . 1 1 21 21 PHE N N 21 115.200 115.200 115.567 -0.367 25464
5377 1 16 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.068 0.562 25464
5378 1 16 . 1 1 21 21 PHE C C 21 177.500 177.500 174.483 3.017 25464
5379 1 16 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.308 0.192 25464
5380 1 16 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.709 3.391 25464
5381 1 16 . 1 1 21 21 PHE H H 21 9.600 9.600 8.485 1.115 25464
5382 1 16 . 1 1 22 22 VAL N N 22 116.600 116.600 120.690 -4.090 25464
5383 1 16 . 1 1 22 22 VAL C C 22 175.000 175.000 175.297 -0.297 25464
5384 1 16 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.818 0.882 25464
5385 1 16 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.940 -0.140 25464
5386 1 16 . 1 1 22 22 VAL H H 22 8.750 8.750 8.563 0.187 25464
5387 1 16 . 1 1 23 23 LEU N N 23 126.500 126.500 127.671 -1.171 25464
5388 1 16 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.541 0.099 25464
5389 1 16 . 1 1 23 23 LEU C C 23 176.200 176.200 175.714 0.486 25464
5390 1 16 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.469 -1.669 25464
5391 1 16 . 1 1 23 23 LEU CB C 23 46.700 46.700 46.120 0.580 25464
5392 1 16 . 1 1 23 23 LEU H H 23 9.530 9.530 8.794 0.736 25464
5393 1 16 . 1 1 24 24 ILE N N 24 117.700 117.700 119.025 -1.325 25464
5394 1 16 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.453 0.237 25464
5395 1 16 . 1 1 24 24 ILE C C 24 174.300 174.300 173.486 0.814 25464
5396 1 16 . 1 1 24 24 ILE CA C 24 58.900 58.900 58.780 0.120 25464
5397 1 16 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.653 0.947 25464
5398 1 16 . 1 1 24 24 ILE H H 24 9.300 9.300 9.054 0.246 25464
5399 1 16 . 1 1 25 25 ASN N N 25 122.500 122.500 122.483 0.017 25464
5400 1 16 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.909 -0.209 25464
5401 1 16 . 1 1 25 25 ASN C C 25 177.700 177.700 175.409 2.291 25464
5402 1 16 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.681 -1.980 25464
5403 1 16 . 1 1 25 25 ASN CB C 25 37.600 37.600 41.346 -3.746 25464
5404 1 16 . 1 1 25 25 ASN H H 25 7.300 7.300 8.572 -1.272 25464
5405 1 16 . 1 1 26 26 ASP N N 26 118.100 118.100 122.279 -4.179 25464
5406 1 16 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.185 0.175 25464
5407 1 16 . 1 1 26 26 ASP C C 26 176.700 176.700 176.894 -0.194 25464
5408 1 16 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.703 -1.203 25464
5409 1 16 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.736 -0.835 25464
5410 1 16 . 1 1 26 26 ASP H H 26 8.340 8.340 8.851 -0.511 25464
5411 1 16 . 1 1 27 27 GLU N N 27 117.600 117.600 117.543 0.057 25464
5412 1 16 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.170 0.370 25464
5413 1 16 . 1 1 27 27 GLU C C 27 175.100 175.100 175.762 -0.662 25464
5414 1 16 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.845 -0.145 25464
5415 1 16 . 1 1 27 27 GLU CB C 27 29.500 29.500 27.446 2.054 25464
5416 1 16 . 1 1 27 27 GLU H H 27 7.190 7.190 8.453 -1.263 25464
5417 1 16 . 1 1 28 28 GLU N N 28 112.800 112.800 115.035 -2.235 25464
5418 1 16 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.901 -0.311 25464
5419 1 16 . 1 1 28 28 GLU C C 28 175.200 175.200 175.094 0.106 25464
5420 1 16 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.512 0.288 25464
5421 1 16 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.254 -0.754 25464
5422 1 16 . 1 1 28 28 GLU H H 28 8.050 8.050 7.918 0.132 25464
5423 1 16 . 1 1 29 29 GLN N N 29 117.200 117.200 117.964 -0.764 25464
5424 1 16 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.066 0.214 25464
5425 1 16 . 1 1 29 29 GLN C C 29 174.600 174.600 174.952 -0.352 25464
5426 1 16 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.500 -0.600 25464
5427 1 16 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.420 -0.120 25464
5428 1 16 . 1 1 29 29 GLN H H 29 7.840 7.840 7.675 0.165 25464
5429 1 16 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.824 0.236 25464
5430 1 16 . 1 1 30 30 HIS C C 30 175.900 175.900 174.591 1.309 25464
5431 1 16 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.554 1.146 25464
5432 1 16 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.997 0.904 25464
5433 1 16 . 1 1 31 31 SER N N 31 113.100 113.100 117.236 -4.136 25464
5434 1 16 . 1 1 31 31 SER HA H 31 4.740 4.740 4.901 -0.161 25464
5435 1 16 . 1 1 31 31 SER C C 31 173.200 173.200 172.385 0.815 25464
5436 1 16 . 1 1 31 31 SER CA C 31 57.400 57.400 57.156 0.244 25464
5437 1 16 . 1 1 31 31 SER CB C 31 66.600 66.600 64.649 1.951 25464
5438 1 16 . 1 1 31 31 SER H H 31 8.850 8.850 9.205 -0.355 25464
5439 1 16 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.899 0.461 25464
5440 1 16 . 1 1 32 32 LEU C C 32 178.200 178.200 174.906 3.294 25464
5441 1 16 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.668 1.332 25464
5442 1 16 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.967 -1.267 25464
5443 1 16 . 1 1 33 33 TRP N N 33 123.400 123.400 128.133 -4.733 25464
5444 1 16 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.958 0.342 25464
5445 1 16 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.266 -0.166 25464
5446 1 16 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.755 1.745 25464
5447 1 16 . 1 1 33 33 TRP H H 33 9.170 9.170 9.359 -0.189 25464
5448 1 16 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.448 -0.638 25464
5449 1 16 . 1 1 34 34 PRO C C 34 177.400 177.400 177.364 0.036 25464
5450 1 16 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.202 -0.402 25464
5451 1 16 . 1 1 34 34 PRO CB C 34 32.000 32.000 32.969 -0.969 25464
5452 1 16 . 1 1 35 35 THR N N 35 107.700 107.700 114.468 -6.768 25464
5453 1 16 . 1 1 35 35 THR HA H 35 3.730 3.730 4.255 -0.525 25464
5454 1 16 . 1 1 35 35 THR C C 35 176.100 176.100 175.017 1.083 25464
5455 1 16 . 1 1 35 35 THR CA C 35 63.600 63.600 64.961 -1.361 25464
5456 1 16 . 1 1 35 35 THR CB C 35 68.200 68.200 68.469 -0.269 25464
5457 1 16 . 1 1 35 35 THR H H 35 7.260 7.260 7.841 -0.581 25464
5458 1 16 . 1 1 36 36 PHE N N 36 114.500 114.500 117.399 -2.899 25464
5459 1 16 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.556 -0.046 25464
5460 1 16 . 1 1 36 36 PHE C C 36 174.500 174.500 174.561 -0.061 25464
5461 1 16 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.019 -0.119 25464
5462 1 16 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.363 -0.763 25464
5463 1 16 . 1 1 36 36 PHE H H 36 6.770 6.770 7.180 -0.410 25464
5464 1 16 . 1 1 37 37 ALA N N 37 125.300 125.300 121.706 3.594 25464
5465 1 16 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.554 0.156 25464
5466 1 16 . 1 1 37 37 ALA C C 37 177.300 177.300 175.025 2.275 25464
5467 1 16 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.846 -0.646 25464
5468 1 16 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.174 -0.774 25464
5469 1 16 . 1 1 37 37 ALA H H 37 6.950 6.950 7.346 -0.396 25464
5470 1 16 . 1 1 38 38 ASP N N 38 124.500 124.500 120.093 4.407 25464
5471 1 16 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.809 -0.329 25464
5472 1 16 . 1 1 38 38 ASP C C 38 176.700 176.700 176.075 0.625 25464
5473 1 16 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.406 1.594 25464
5474 1 16 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.513 -2.113 25464
5475 1 16 . 1 1 38 38 ASP H H 38 8.870 8.870 8.486 0.384 25464
5476 1 16 . 1 1 39 39 VAL N N 39 126.000 126.000 120.439 5.561 25464
5477 1 16 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.603 -0.243 25464
5478 1 16 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.704 0.396 25464
5479 1 16 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.929 0.271 25464
5480 1 16 . 1 1 39 39 VAL H H 39 8.650 8.650 8.408 0.242 25464
5481 1 16 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.277 -0.027 25464
5482 1 16 . 1 1 40 40 PRO C C 40 175.800 175.800 176.636 -0.836 25464
5483 1 16 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.405 -0.205 25464
5484 1 16 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.583 0.117 25464
5485 1 16 . 1 1 41 41 ALA N N 41 122.700 122.700 126.165 -3.465 25464
5486 1 16 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.039 0.141 25464
5487 1 16 . 1 1 41 41 ALA C C 41 179.000 179.000 178.634 0.366 25464
5488 1 16 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.595 -0.295 25464
5489 1 16 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.929 -0.629 25464
5490 1 16 . 1 1 41 41 ALA H H 41 8.280 8.280 8.458 -0.178 25464
5491 1 16 . 1 1 42 42 GLY N N 42 109.800 109.800 111.372 -1.572 25464
5492 1 16 . 1 1 42 42 GLY C C 42 173.800 173.800 173.958 -0.158 25464
5493 1 16 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.861 -0.161 25464
5494 1 16 . 1 1 42 42 GLY H H 42 8.770 8.770 8.278 0.492 25464
5495 1 16 . 1 1 43 43 TRP N N 43 120.300 120.300 122.979 -2.679 25464
5496 1 16 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.021 -0.071 25464
5497 1 16 . 1 1 43 43 TRP C C 43 174.900 174.900 176.186 -1.286 25464
5498 1 16 . 1 1 43 43 TRP CA C 43 55.700 55.700 57.252 -1.552 25464
5499 1 16 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.523 2.477 25464
5500 1 16 . 1 1 43 43 TRP H H 43 7.740 7.740 7.891 -0.151 25464
5501 1 16 . 1 1 44 44 ARG N N 44 117.700 117.700 123.246 -5.546 25464
5502 1 16 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.699 0.021 25464
5503 1 16 . 1 1 44 44 ARG C C 44 174.900 174.900 175.268 -0.368 25464
5504 1 16 . 1 1 44 44 ARG CA C 44 53.900 53.900 55.042 -1.142 25464
5505 1 16 . 1 1 44 44 ARG CB C 44 33.200 33.200 31.924 1.276 25464
5506 1 16 . 1 1 44 44 ARG H H 44 8.990 8.990 8.971 0.019 25464
5507 1 16 . 1 1 45 45 VAL N N 45 122.800 122.800 126.644 -3.844 25464
5508 1 16 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.164 -0.184 25464
5509 1 16 . 1 1 45 45 VAL C C 45 177.600 177.600 176.743 0.857 25464
5510 1 16 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.845 -0.145 25464
5511 1 16 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.447 0.653 25464
5512 1 16 . 1 1 45 45 VAL H H 45 8.720 8.720 8.729 -0.009 25464
5513 1 16 . 1 1 46 46 VAL N N 46 120.400 120.400 126.161 -5.761 25464
5514 1 16 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.342 0.338 25464
5515 1 16 . 1 1 46 46 VAL C C 46 174.200 174.200 175.325 -1.125 25464
5516 1 16 . 1 1 46 46 VAL CA C 46 60.500 60.500 64.196 -3.696 25464
5517 1 16 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.960 1.040 25464
5518 1 16 . 1 1 46 46 VAL H H 46 9.060 9.060 8.700 0.360 25464
5519 1 16 . 1 1 47 47 PHE N N 47 121.100 121.100 121.546 -0.446 25464
5520 1 16 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.631 -0.181 25464
5521 1 16 . 1 1 47 47 PHE CA C 47 58.700 58.700 55.180 3.520 25464
5522 1 16 . 1 1 47 47 PHE CB C 47 41.700 41.700 40.453 1.247 25464
5523 1 16 . 1 1 47 47 PHE H H 47 7.680 7.680 8.215 -0.535 25464
5524 1 16 . 1 1 48 48 GLY N N 48 112.600 112.600 113.263 -0.663 25464
5525 1 16 . 1 1 48 48 GLY C C 48 174.700 174.700 173.489 1.211 25464
5526 1 16 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.477 -2.478 25464
5527 1 16 . 1 1 48 48 GLY H H 48 7.380 7.380 8.533 -1.153 25464
5528 1 16 . 1 1 49 49 GLU N N 49 120.600 120.600 118.408 2.192 25464
5529 1 16 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.100 0.130 25464
5530 1 16 . 1 1 49 49 GLU C C 49 174.900 174.900 175.633 -0.733 25464
5531 1 16 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.173 -0.873 25464
5532 1 16 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.509 2.691 25464
5533 1 16 . 1 1 49 49 GLU H H 49 8.510 8.510 8.320 0.190 25464
5534 1 16 . 1 1 50 50 ALA N N 50 126.600 126.600 126.920 -0.320 25464
5535 1 16 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.541 0.099 25464
5536 1 16 . 1 1 50 50 ALA C C 50 175.100 175.100 175.428 -0.328 25464
5537 1 16 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.157 1.243 25464
5538 1 16 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.062 1.138 25464
5539 1 16 . 1 1 50 50 ALA H H 50 9.440 9.440 8.381 1.059 25464
5540 1 16 . 1 1 51 51 SER N N 51 115.100 115.100 114.737 0.363 25464
5541 1 16 . 1 1 51 51 SER HA H 51 4.740 4.740 4.087 0.653 25464
5542 1 16 . 1 1 51 51 SER C C 51 175.000 175.000 176.006 -1.006 25464
5543 1 16 . 1 1 51 51 SER CA C 51 58.100 58.100 58.422 -0.322 25464
5544 1 16 . 1 1 51 51 SER CB C 51 64.700 64.700 63.855 0.845 25464
5545 1 16 . 1 1 51 51 SER H H 51 8.950 8.950 8.579 0.371 25464
5546 1 16 . 1 1 52 52 ARG N N 52 123.500 123.500 128.878 -5.378 25464
5547 1 16 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.938 -0.528 25464
5548 1 16 . 1 1 52 52 ARG C C 52 178.200 178.200 177.740 0.460 25464
5549 1 16 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.534 1.466 25464
5550 1 16 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.082 -0.182 25464
5551 1 16 . 1 1 52 52 ARG H H 52 9.540 9.540 8.129 1.411 25464
5552 1 16 . 1 1 53 53 ALA N N 53 118.000 118.000 121.065 -3.065 25464
5553 1 16 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.166 -0.136 25464
5554 1 16 . 1 1 53 53 ALA C C 53 181.000 181.000 180.000 1.000 25464
5555 1 16 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.422 -0.122 25464
5556 1 16 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.661 0.439 25464
5557 1 16 . 1 1 53 53 ALA H H 53 8.770 8.770 8.305 0.465 25464
5558 1 16 . 1 1 54 54 SER N N 54 115.300 115.300 115.345 -0.045 25464
5559 1 16 . 1 1 54 54 SER HA H 54 4.350 4.350 4.321 0.029 25464
5560 1 16 . 1 1 54 54 SER C C 54 177.500 177.500 176.973 0.527 25464
5561 1 16 . 1 1 54 54 SER CA C 54 61.900 61.900 62.088 -0.188 25464
5562 1 16 . 1 1 54 54 SER CB C 54 63.100 63.100 62.494 0.606 25464
5563 1 16 . 1 1 54 54 SER H H 54 8.140 8.140 7.882 0.258 25464
5564 1 16 . 1 1 55 55 CYS N N 55 121.900 121.900 121.221 0.679 25464
5565 1 16 . 1 1 55 55 CYS HA H 55 4.160 4.160 4.350 -0.190 25464
5566 1 16 . 1 1 55 55 CYS C C 55 176.300 176.300 176.969 -0.669 25464
5567 1 16 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.774 -0.474 25464
5568 1 16 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.178 -0.178 25464
5569 1 16 . 1 1 55 55 CYS H H 55 8.430 8.430 8.384 0.046 25464
5570 1 16 . 1 1 56 56 VAL N N 56 121.100 121.100 120.616 0.484 25464
5571 1 16 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.699 -0.209 25464
5572 1 16 . 1 1 56 56 VAL C C 56 177.800 177.800 178.036 -0.236 25464
5573 1 16 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.347 -0.347 25464
5574 1 16 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.665 -0.065 25464
5575 1 16 . 1 1 56 56 VAL H H 56 8.750 8.750 8.668 0.082 25464
5576 1 16 . 1 1 57 57 GLU N N 57 119.200 119.200 120.325 -1.125 25464
5577 1 16 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.069 0.001 25464
5578 1 16 . 1 1 57 57 GLU C C 57 177.900 177.900 178.797 -0.897 25464
5579 1 16 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.489 -0.189 25464
5580 1 16 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.709 -0.209 25464
5581 1 16 . 1 1 57 57 GLU H H 57 7.780 7.780 8.437 -0.657 25464
5582 1 16 . 1 1 58 58 TYR N N 58 119.400 119.400 120.998 -1.598 25464
5583 1 16 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.257 -0.367 25464
5584 1 16 . 1 1 58 58 TYR CA C 58 62.200 62.200 62.159 0.041 25464
5585 1 16 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.847 -1.647 25464
5586 1 16 . 1 1 58 58 TYR H H 58 7.700 7.700 8.275 -0.575 25464
5587 1 16 . 1 1 59 59 VAL N N 59 121.500 121.500 119.772 1.728 25464
5588 1 16 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.765 -0.405 25464
5589 1 16 . 1 1 59 59 VAL C C 59 176.300 176.300 177.697 -1.397 25464
5590 1 16 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.711 0.689 25464
5591 1 16 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.320 0.080 25464
5592 1 16 . 1 1 59 59 VAL H H 59 8.380 8.380 8.488 -0.108 25464
5593 1 16 . 1 1 60 60 ASP N N 60 120.000 120.000 118.288 1.712 25464
5594 1 16 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.539 -0.129 25464
5595 1 16 . 1 1 60 60 ASP C C 60 178.300 178.300 179.566 -1.266 25464
5596 1 16 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.193 -0.093 25464
5597 1 16 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.084 -0.485 25464
5598 1 16 . 1 1 60 60 ASP H H 60 8.580 8.580 8.331 0.249 25464
5599 1 16 . 1 1 61 61 GLN N N 61 114.500 114.500 117.698 -3.198 25464
5600 1 16 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.057 -0.047 25464
5601 1 16 . 1 1 61 61 GLN C C 61 176.700 176.700 177.537 -0.837 25464
5602 1 16 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.972 -1.272 25464
5603 1 16 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.534 0.266 25464
5604 1 16 . 1 1 61 61 GLN H H 61 7.810 7.810 7.811 -0.001 25464
5605 1 16 . 1 1 62 62 HIS N N 62 115.100 115.100 115.239 -0.139 25464
5606 1 16 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.559 -0.179 25464
5607 1 16 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.195 2.105 25464
5608 1 16 . 1 1 62 62 HIS CB C 62 29.000 29.000 28.810 0.190 25464
5609 1 16 . 1 1 62 62 HIS H H 62 7.730 7.730 7.328 0.402 25464
5610 1 16 . 1 1 63 63 TRP N N 63 121.500 121.500 120.321 1.179 25464
5611 1 16 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.133 -0.333 25464
5612 1 16 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.909 -0.209 25464
5613 1 16 . 1 1 63 63 TRP H H 63 8.180 8.180 7.165 1.015 25464
5614 1 16 . 1 1 64 64 THR N N 64 114.900 114.900 111.717 3.183 25464
5615 1 16 . 1 1 64 64 THR HA H 64 4.180 4.180 4.307 -0.127 25464
5616 1 16 . 1 1 64 64 THR CA C 64 62.100 62.100 63.490 -1.390 25464
5617 1 16 . 1 1 64 64 THR CB C 64 69.500 69.500 69.613 -0.113 25464
5618 1 16 . 1 1 64 64 THR H H 64 7.940 7.940 7.863 0.077 25464
5619 1 16 . 1 1 65 65 ASP N N 65 122.900 122.900 121.240 1.660 25464
5620 1 16 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.236 1.164 25464
5621 1 16 . 1 1 65 65 ASP CB C 65 41.100 41.100 43.152 -2.052 25464
5622 1 16 . 1 1 65 65 ASP H H 65 8.340 8.340 7.963 0.377 25464
5623 1 16 . 1 1 66 66 ILE N N 66 122.200 122.200 118.795 3.405 25464
5624 1 16 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.169 -0.009 25464
5625 1 16 . 1 1 66 66 ILE CA C 66 61.100 61.100 62.005 -0.905 25464
5626 1 16 . 1 1 66 66 ILE CB C 66 38.500 38.500 38.671 -0.171 25464
5627 1 16 . 1 1 66 66 ILE H H 66 8.250 8.250 8.207 0.043 25464
5628 1 16 . 1 1 67 67 ARG N N 67 124.000 124.000 119.086 4.914 25464
5629 1 16 . 1 1 67 67 ARG CA C 67 53.900 53.900 56.611 -2.711 25464
5630 1 16 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.585 1.415 25464
5631 1 16 . 1 1 67 67 ARG H H 67 8.490 8.490 7.983 0.507 25464
5632 1 16 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.487 -0.047 25464
5633 1 16 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.350 -0.250 25464
5634 1 16 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.411 -0.311 25464
5635 1 16 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.404 -0.074 25464
5636 1 16 . 1 1 69 69 LYS C C 69 175.900 175.900 174.015 1.885 25464
5637 1 16 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.211 0.089 25464
5638 1 16 . 1 1 69 69 LYS CB C 69 33.000 33.000 34.354 -1.354 25464
5639 1 16 . 1 1 69 69 LYS H H 69 8.270 8.270 7.404 0.866 25464
5640 1 16 . 1 1 70 70 SER N N 70 122.300 122.300 117.070 5.230 25464
5641 1 16 . 1 1 70 70 SER HA H 70 4.580 4.580 4.514 0.066 25464
5642 1 16 . 1 1 70 70 SER CA C 70 59.900 59.900 58.446 1.454 25464
5643 1 16 . 1 1 70 70 SER CB C 70 65.100 65.100 63.292 1.808 25464
5644 1 16 . 1 1 70 70 SER H H 70 8.140 8.140 8.439 -0.299 25464
5645 1 16 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.410 -0.090 25464
5646 1 16 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.362 1.038 25464
5647 1 16 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.499 -0.399 25464
5648 1 16 . 1 1 76 76 ALA N N 76 124.000 124.000 126.304 -2.304 25464
5649 1 16 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.573 -0.243 25464
5650 1 16 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.136 1.564 25464
5651 1 16 . 1 1 76 76 ALA CB C 76 19.000 19.000 20.301 -1.301 25464
5652 1 16 . 1 1 76 76 ALA H H 76 8.200 8.200 8.414 -0.214 25464
5653 1 16 . 1 1 77 77 SER N N 77 114.100 114.100 120.899 -6.799 25464
5654 1 16 . 1 1 77 77 SER HA H 77 4.450 4.450 3.857 0.593 25464
5655 1 16 . 1 1 77 77 SER CA C 77 58.200 58.200 59.071 -0.871 25464
5656 1 16 . 1 1 77 77 SER CB C 77 63.900 63.900 62.526 1.374 25464
5657 1 16 . 1 1 77 77 SER H H 77 8.210 8.210 8.661 -0.451 25464
5658 1 16 . 1 1 78 78 GLY N N 78 110.500 110.500 112.086 -1.586 25464
5659 1 16 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.683 -0.283 25464
5660 1 16 . 1 1 78 78 GLY H H 78 8.390 8.390 8.144 0.246 25464
5661 1 16 . 1 1 79 79 GLN N N 79 119.600 119.600 123.546 -3.946 25464
5662 1 16 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.668 -0.068 25464
5663 1 16 . 1 1 79 79 GLN CB C 79 29.600 29.600 27.715 1.885 25464
5664 1 16 . 1 1 79 79 GLN H H 79 8.250 8.250 8.562 -0.312 25464
5665 1 17 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.417 0.043 25464
5666 1 17 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.655 0.745 25464
5667 1 17 . 1 1 2 2 PRO CB C 2 32.100 32.100 32.334 -0.234 25464
5668 1 17 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.067 0.033 25464
5669 1 17 . 1 1 10 10 ASP N N 10 121.500 121.500 123.923 -2.423 25464
5670 1 17 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.629 -0.029 25464
5671 1 17 . 1 1 10 10 ASP C C 10 175.300 175.300 176.074 -0.774 25464
5672 1 17 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.837 -0.337 25464
5673 1 17 . 1 1 10 10 ASP CB C 10 40.900 40.900 39.364 1.536 25464
5674 1 17 . 1 1 10 10 ASP H H 10 8.420 8.420 8.418 0.002 25464
5675 1 17 . 1 1 11 11 ASN N N 11 118.400 118.400 121.628 -3.228 25464
5676 1 17 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.917 0.033 25464
5677 1 17 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.004 -0.204 25464
5678 1 17 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.982 0.118 25464
5679 1 17 . 1 1 11 11 ASN H H 11 8.270 8.270 8.016 0.254 25464
5680 1 17 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.260 0.120 25464
5681 1 17 . 1 1 12 12 PRO C C 12 177.100 177.100 177.359 -0.259 25464
5682 1 17 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.165 -0.465 25464
5683 1 17 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.274 0.626 25464
5684 1 17 . 1 1 13 13 PHE N N 13 117.500 117.500 117.480 0.020 25464
5685 1 17 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.340 0.160 25464
5686 1 17 . 1 1 13 13 PHE C C 13 175.700 175.700 176.149 -0.449 25464
5687 1 17 . 1 1 13 13 PHE CA C 13 58.300 58.300 58.325 -0.025 25464
5688 1 17 . 1 1 13 13 PHE CB C 13 38.700 38.700 37.396 1.304 25464
5689 1 17 . 1 1 13 13 PHE H H 13 8.120 8.120 7.579 0.541 25464
5690 1 17 . 1 1 14 14 ASP N N 14 120.000 120.000 118.595 1.405 25464
5691 1 17 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.515 0.105 25464
5692 1 17 . 1 1 14 14 ASP C C 14 175.800 175.800 176.204 -0.404 25464
5693 1 17 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.626 -0.226 25464
5694 1 17 . 1 1 14 14 ASP CB C 14 41.400 41.400 40.397 1.003 25464
5695 1 17 . 1 1 14 14 ASP H H 14 8.010 8.010 7.598 0.412 25464
5696 1 17 . 1 1 15 15 ASP N N 15 119.900 119.900 120.403 -0.503 25464
5697 1 17 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.521 0.089 25464
5698 1 17 . 1 1 15 15 ASP C C 15 176.700 176.700 176.661 0.039 25464
5699 1 17 . 1 1 15 15 ASP CA C 15 54.500 54.500 54.999 -0.499 25464
5700 1 17 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.809 -1.609 25464
5701 1 17 . 1 1 15 15 ASP H H 15 7.900 7.900 7.602 0.298 25464
5702 1 17 . 1 1 16 16 GLU N N 16 122.700 122.700 121.841 0.859 25464
5703 1 17 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.281 -0.051 25464
5704 1 17 . 1 1 16 16 GLU C C 16 176.600 176.600 177.621 -1.021 25464
5705 1 17 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.142 -0.743 25464
5706 1 17 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.494 -0.394 25464
5707 1 17 . 1 1 16 16 GLU H H 16 8.610 8.610 8.646 -0.036 25464
5708 1 17 . 1 1 17 17 ASP N N 17 119.500 119.500 122.263 -2.763 25464
5709 1 17 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.669 0.181 25464
5710 1 17 . 1 1 17 17 ASP C C 17 176.300 176.300 177.281 -0.981 25464
5711 1 17 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.201 0.099 25464
5712 1 17 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.809 -0.209 25464
5713 1 17 . 1 1 17 17 ASP H H 17 8.490 8.490 8.426 0.064 25464
5714 1 17 . 1 1 18 18 GLY N N 18 107.700 107.700 108.520 -0.820 25464
5715 1 17 . 1 1 18 18 GLY C C 18 172.700 172.700 173.440 -0.740 25464
5716 1 17 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.571 0.330 25464
5717 1 17 . 1 1 18 18 GLY H H 18 8.070 8.070 8.389 -0.319 25464
5718 1 17 . 1 1 19 19 MET N N 19 117.400 117.400 121.455 -4.055 25464
5719 1 17 . 1 1 19 19 MET HA H 19 4.890 4.890 4.338 0.552 25464
5720 1 17 . 1 1 19 19 MET C C 19 176.000 176.000 174.791 1.209 25464
5721 1 17 . 1 1 19 19 MET CA C 19 53.700 53.700 53.355 0.345 25464
5722 1 17 . 1 1 19 19 MET CB C 19 35.100 35.100 31.777 3.322 25464
5723 1 17 . 1 1 19 19 MET H H 19 7.820 7.820 8.154 -0.334 25464
5724 1 17 . 1 1 20 20 PHE N N 20 120.100 120.100 120.534 -0.434 25464
5725 1 17 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.557 0.453 25464
5726 1 17 . 1 1 20 20 PHE C C 20 174.200 174.200 174.852 -0.652 25464
5727 1 17 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.710 1.690 25464
5728 1 17 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.060 3.740 25464
5729 1 17 . 1 1 20 20 PHE H H 20 9.370 9.370 8.670 0.700 25464
5730 1 17 . 1 1 21 21 PHE N N 21 115.200 115.200 116.307 -1.107 25464
5731 1 17 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.406 0.224 25464
5732 1 17 . 1 1 21 21 PHE C C 21 177.500 177.500 174.867 2.633 25464
5733 1 17 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.190 0.310 25464
5734 1 17 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.715 3.385 25464
5735 1 17 . 1 1 21 21 PHE H H 21 9.600 9.600 8.406 1.194 25464
5736 1 17 . 1 1 22 22 VAL N N 22 116.600 116.600 120.288 -3.688 25464
5737 1 17 . 1 1 22 22 VAL C C 22 175.000 175.000 175.495 -0.495 25464
5738 1 17 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.484 1.216 25464
5739 1 17 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.865 -0.065 25464
5740 1 17 . 1 1 22 22 VAL H H 22 8.750 8.750 8.615 0.135 25464
5741 1 17 . 1 1 23 23 LEU N N 23 126.500 126.500 127.260 -0.760 25464
5742 1 17 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.682 -0.042 25464
5743 1 17 . 1 1 23 23 LEU C C 23 176.200 176.200 175.859 0.341 25464
5744 1 17 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.788 -0.988 25464
5745 1 17 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.485 1.215 25464
5746 1 17 . 1 1 23 23 LEU H H 23 9.530 9.530 8.736 0.794 25464
5747 1 17 . 1 1 24 24 ILE N N 24 117.700 117.700 117.886 -0.186 25464
5748 1 17 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.462 0.228 25464
5749 1 17 . 1 1 24 24 ILE C C 24 174.300 174.300 173.535 0.765 25464
5750 1 17 . 1 1 24 24 ILE CA C 24 58.900 58.900 58.924 -0.024 25464
5751 1 17 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.682 0.917 25464
5752 1 17 . 1 1 24 24 ILE H H 24 9.300 9.300 8.834 0.466 25464
5753 1 17 . 1 1 25 25 ASN N N 25 122.500 122.500 123.698 -1.198 25464
5754 1 17 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.797 -0.097 25464
5755 1 17 . 1 1 25 25 ASN C C 25 177.700 177.700 175.504 2.196 25464
5756 1 17 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.871 -1.171 25464
5757 1 17 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.292 -2.692 25464
5758 1 17 . 1 1 25 25 ASN H H 25 7.300 7.300 8.055 -0.755 25464
5759 1 17 . 1 1 26 26 ASP N N 26 118.100 118.100 122.570 -4.470 25464
5760 1 17 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.221 0.139 25464
5761 1 17 . 1 1 26 26 ASP C C 26 176.700 176.700 176.589 0.111 25464
5762 1 17 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.590 -0.090 25464
5763 1 17 . 1 1 26 26 ASP CB C 26 39.900 39.900 41.039 -1.139 25464
5764 1 17 . 1 1 26 26 ASP H H 26 8.340 8.340 8.826 -0.486 25464
5765 1 17 . 1 1 27 27 GLU N N 27 117.600 117.600 117.777 -0.177 25464
5766 1 17 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.129 0.411 25464
5767 1 17 . 1 1 27 27 GLU C C 27 175.100 175.100 176.035 -0.935 25464
5768 1 17 . 1 1 27 27 GLU CA C 27 55.700 55.700 57.011 -1.311 25464
5769 1 17 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.193 1.307 25464
5770 1 17 . 1 1 27 27 GLU H H 27 7.190 7.190 8.325 -1.135 25464
5771 1 17 . 1 1 28 28 GLU N N 28 112.800 112.800 113.856 -1.056 25464
5772 1 17 . 1 1 28 28 GLU HA H 28 3.590 3.590 4.040 -0.450 25464
5773 1 17 . 1 1 28 28 GLU C C 28 175.200 175.200 175.445 -0.245 25464
5774 1 17 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.677 0.123 25464
5775 1 17 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.997 -0.497 25464
5776 1 17 . 1 1 28 28 GLU H H 28 8.050 8.050 7.844 0.206 25464
5777 1 17 . 1 1 29 29 GLN N N 29 117.200 117.200 117.999 -0.799 25464
5778 1 17 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.385 -0.105 25464
5779 1 17 . 1 1 29 29 GLN C C 29 174.600 174.600 175.558 -0.958 25464
5780 1 17 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.175 -0.274 25464
5781 1 17 . 1 1 29 29 GLN CB C 29 29.300 29.300 28.710 0.590 25464
5782 1 17 . 1 1 29 29 GLN H H 29 7.840 7.840 7.625 0.215 25464
5783 1 17 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.281 0.779 25464
5784 1 17 . 1 1 30 30 HIS C C 30 175.900 175.900 175.108 0.792 25464
5785 1 17 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.946 0.754 25464
5786 1 17 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.171 1.729 25464
5787 1 17 . 1 1 31 31 SER N N 31 113.100 113.100 117.041 -3.941 25464
5788 1 17 . 1 1 31 31 SER HA H 31 4.740 4.740 4.712 0.028 25464
5789 1 17 . 1 1 31 31 SER C C 31 173.200 173.200 172.248 0.952 25464
5790 1 17 . 1 1 31 31 SER CA C 31 57.400 57.400 57.926 -0.526 25464
5791 1 17 . 1 1 31 31 SER CB C 31 66.600 66.600 64.809 1.791 25464
5792 1 17 . 1 1 31 31 SER H H 31 8.850 8.850 8.684 0.166 25464
5793 1 17 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.037 0.323 25464
5794 1 17 . 1 1 32 32 LEU C C 32 178.200 178.200 175.125 3.075 25464
5795 1 17 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.135 1.865 25464
5796 1 17 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.352 -1.652 25464
5797 1 17 . 1 1 33 33 TRP N N 33 123.400 123.400 128.138 -4.738 25464
5798 1 17 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.906 0.394 25464
5799 1 17 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.191 -0.091 25464
5800 1 17 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.612 1.888 25464
5801 1 17 . 1 1 33 33 TRP H H 33 9.170 9.170 9.241 -0.071 25464
5802 1 17 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.545 -0.735 25464
5803 1 17 . 1 1 34 34 PRO C C 34 177.400 177.400 177.041 0.359 25464
5804 1 17 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.296 -0.496 25464
5805 1 17 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.048 -1.048 25464
5806 1 17 . 1 1 35 35 THR N N 35 107.700 107.700 114.450 -6.750 25464
5807 1 17 . 1 1 35 35 THR HA H 35 3.730 3.730 4.296 -0.566 25464
5808 1 17 . 1 1 35 35 THR C C 35 176.100 176.100 175.132 0.968 25464
5809 1 17 . 1 1 35 35 THR CA C 35 63.600 63.600 64.276 -0.676 25464
5810 1 17 . 1 1 35 35 THR CB C 35 68.200 68.200 68.461 -0.261 25464
5811 1 17 . 1 1 35 35 THR H H 35 7.260 7.260 7.917 -0.657 25464
5812 1 17 . 1 1 36 36 PHE N N 36 114.500 114.500 118.172 -3.672 25464
5813 1 17 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.613 -0.103 25464
5814 1 17 . 1 1 36 36 PHE C C 36 174.500 174.500 175.101 -0.601 25464
5815 1 17 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.198 -0.298 25464
5816 1 17 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.537 -0.937 25464
5817 1 17 . 1 1 36 36 PHE H H 36 6.770 6.770 7.287 -0.517 25464
5818 1 17 . 1 1 37 37 ALA N N 37 125.300 125.300 121.606 3.694 25464
5819 1 17 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.664 0.046 25464
5820 1 17 . 1 1 37 37 ALA C C 37 177.300 177.300 175.220 2.080 25464
5821 1 17 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.198 -0.998 25464
5822 1 17 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.619 -1.220 25464
5823 1 17 . 1 1 37 37 ALA H H 37 6.950 6.950 7.514 -0.564 25464
5824 1 17 . 1 1 38 38 ASP N N 38 124.500 124.500 119.861 4.639 25464
5825 1 17 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.935 -0.455 25464
5826 1 17 . 1 1 38 38 ASP C C 38 176.700 176.700 176.035 0.665 25464
5827 1 17 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.816 1.184 25464
5828 1 17 . 1 1 38 38 ASP CB C 38 40.400 40.400 43.115 -2.715 25464
5829 1 17 . 1 1 38 38 ASP H H 38 8.870 8.870 8.601 0.269 25464
5830 1 17 . 1 1 39 39 VAL N N 39 126.000 126.000 122.080 3.920 25464
5831 1 17 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.627 -0.267 25464
5832 1 17 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.335 0.765 25464
5833 1 17 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.838 0.362 25464
5834 1 17 . 1 1 39 39 VAL H H 39 8.650 8.650 8.329 0.321 25464
5835 1 17 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.361 -0.111 25464
5836 1 17 . 1 1 40 40 PRO C C 40 175.800 175.800 176.290 -0.490 25464
5837 1 17 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.704 -0.504 25464
5838 1 17 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.674 0.026 25464
5839 1 17 . 1 1 41 41 ALA N N 41 122.700 122.700 125.704 -3.004 25464
5840 1 17 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.045 0.135 25464
5841 1 17 . 1 1 41 41 ALA C C 41 179.000 179.000 178.753 0.247 25464
5842 1 17 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.475 -0.175 25464
5843 1 17 . 1 1 41 41 ALA CB C 41 18.300 18.300 19.049 -0.749 25464
5844 1 17 . 1 1 41 41 ALA H H 41 8.280 8.280 8.415 -0.135 25464
5845 1 17 . 1 1 42 42 GLY N N 42 109.800 109.800 111.932 -2.132 25464
5846 1 17 . 1 1 42 42 GLY C C 42 173.800 173.800 173.873 -0.073 25464
5847 1 17 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.903 -0.203 25464
5848 1 17 . 1 1 42 42 GLY H H 42 8.770 8.770 8.340 0.430 25464
5849 1 17 . 1 1 43 43 TRP N N 43 120.300 120.300 122.259 -1.959 25464
5850 1 17 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.301 -0.351 25464
5851 1 17 . 1 1 43 43 TRP C C 43 174.900 174.900 175.481 -0.581 25464
5852 1 17 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.535 -0.835 25464
5853 1 17 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.893 1.107 25464
5854 1 17 . 1 1 43 43 TRP H H 43 7.740 7.740 7.994 -0.254 25464
5855 1 17 . 1 1 44 44 ARG N N 44 117.700 117.700 119.865 -2.165 25464
5856 1 17 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.803 -0.083 25464
5857 1 17 . 1 1 44 44 ARG C C 44 174.900 174.900 174.891 0.009 25464
5858 1 17 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.263 -0.363 25464
5859 1 17 . 1 1 44 44 ARG CB C 44 33.200 33.200 33.575 -0.375 25464
5860 1 17 . 1 1 44 44 ARG H H 44 8.990 8.990 8.950 0.040 25464
5861 1 17 . 1 1 45 45 VAL N N 45 122.800 122.800 123.865 -1.065 25464
5862 1 17 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.125 -0.145 25464
5863 1 17 . 1 1 45 45 VAL C C 45 177.600 177.600 176.623 0.977 25464
5864 1 17 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.345 0.355 25464
5865 1 17 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.283 0.817 25464
5866 1 17 . 1 1 45 45 VAL H H 45 8.720 8.720 8.590 0.130 25464
5867 1 17 . 1 1 46 46 VAL N N 46 120.400 120.400 123.382 -2.982 25464
5868 1 17 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.228 0.452 25464
5869 1 17 . 1 1 46 46 VAL C C 46 174.200 174.200 175.178 -0.978 25464
5870 1 17 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.556 -2.056 25464
5871 1 17 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.216 0.784 25464
5872 1 17 . 1 1 46 46 VAL H H 46 9.060 9.060 8.798 0.262 25464
5873 1 17 . 1 1 47 47 PHE N N 47 121.100 121.100 122.095 -0.995 25464
5874 1 17 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.673 -0.223 25464
5875 1 17 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.680 2.020 25464
5876 1 17 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.850 -0.150 25464
5877 1 17 . 1 1 47 47 PHE H H 47 7.680 7.680 8.266 -0.586 25464
5878 1 17 . 1 1 48 48 GLY N N 48 112.600 112.600 112.204 0.396 25464
5879 1 17 . 1 1 48 48 GLY C C 48 174.700 174.700 173.834 0.866 25464
5880 1 17 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.290 -2.290 25464
5881 1 17 . 1 1 48 48 GLY H H 48 7.380 7.380 8.328 -0.948 25464
5882 1 17 . 1 1 49 49 GLU N N 49 120.600 120.600 118.887 1.713 25464
5883 1 17 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.347 -0.117 25464
5884 1 17 . 1 1 49 49 GLU C C 49 174.900 174.900 175.310 -0.410 25464
5885 1 17 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.436 -1.136 25464
5886 1 17 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.493 2.707 25464
5887 1 17 . 1 1 49 49 GLU H H 49 8.510 8.510 8.642 -0.132 25464
5888 1 17 . 1 1 50 50 ALA N N 50 126.600 126.600 128.583 -1.983 25464
5889 1 17 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.729 -0.089 25464
5890 1 17 . 1 1 50 50 ALA C C 50 175.100 175.100 176.026 -0.926 25464
5891 1 17 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.194 1.206 25464
5892 1 17 . 1 1 50 50 ALA CB C 50 23.200 23.200 23.074 0.126 25464
5893 1 17 . 1 1 50 50 ALA H H 50 9.440 9.440 8.912 0.528 25464
5894 1 17 . 1 1 51 51 SER N N 51 115.100 115.100 114.664 0.436 25464
5895 1 17 . 1 1 51 51 SER HA H 51 4.740 4.740 4.064 0.676 25464
5896 1 17 . 1 1 51 51 SER C C 51 175.000 175.000 176.350 -1.350 25464
5897 1 17 . 1 1 51 51 SER CA C 51 58.100 58.100 58.344 -0.244 25464
5898 1 17 . 1 1 51 51 SER CB C 51 64.700 64.700 63.835 0.865 25464
5899 1 17 . 1 1 51 51 SER H H 51 8.950 8.950 8.653 0.297 25464
5900 1 17 . 1 1 52 52 ARG N N 52 123.500 123.500 127.063 -3.563 25464
5901 1 17 . 1 1 52 52 ARG HA H 52 3.410 3.410 4.115 -0.705 25464
5902 1 17 . 1 1 52 52 ARG C C 52 178.200 178.200 177.519 0.681 25464
5903 1 17 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.388 1.612 25464
5904 1 17 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.995 -0.096 25464
5905 1 17 . 1 1 52 52 ARG H H 52 9.540 9.540 8.189 1.351 25464
5906 1 17 . 1 1 53 53 ALA N N 53 118.000 118.000 121.201 -3.201 25464
5907 1 17 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.043 -0.013 25464
5908 1 17 . 1 1 53 53 ALA C C 53 181.000 181.000 179.688 1.312 25464
5909 1 17 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.278 0.022 25464
5910 1 17 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.666 0.434 25464
5911 1 17 . 1 1 53 53 ALA H H 53 8.770 8.770 7.911 0.859 25464
5912 1 17 . 1 1 54 54 SER N N 54 115.300 115.300 115.336 -0.036 25464
5913 1 17 . 1 1 54 54 SER HA H 54 4.350 4.350 4.096 0.254 25464
5914 1 17 . 1 1 54 54 SER C C 54 177.500 177.500 176.455 1.045 25464
5915 1 17 . 1 1 54 54 SER CA C 54 61.900 61.900 62.308 -0.408 25464
5916 1 17 . 1 1 54 54 SER CB C 54 63.100 63.100 62.158 0.942 25464
5917 1 17 . 1 1 54 54 SER H H 54 8.140 8.140 8.025 0.115 25464
5918 1 17 . 1 1 55 55 CYS N N 55 121.900 121.900 120.813 1.087 25464
5919 1 17 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.712 0.448 25464
5920 1 17 . 1 1 55 55 CYS C C 55 176.300 176.300 176.568 -0.268 25464
5921 1 17 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.493 -0.193 25464
5922 1 17 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.282 -0.282 25464
5923 1 17 . 1 1 55 55 CYS H H 55 8.430 8.430 7.798 0.632 25464
5924 1 17 . 1 1 56 56 VAL N N 56 121.100 121.100 120.020 1.080 25464
5925 1 17 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.528 -0.038 25464
5926 1 17 . 1 1 56 56 VAL C C 56 177.800 177.800 177.822 -0.022 25464
5927 1 17 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.316 -0.316 25464
5928 1 17 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.413 0.187 25464
5929 1 17 . 1 1 56 56 VAL H H 56 8.750 8.750 8.553 0.197 25464
5930 1 17 . 1 1 57 57 GLU N N 57 119.200 119.200 120.668 -1.468 25464
5931 1 17 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.998 0.072 25464
5932 1 17 . 1 1 57 57 GLU C C 57 177.900 177.900 178.582 -0.682 25464
5933 1 17 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.776 -0.476 25464
5934 1 17 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.698 -0.198 25464
5935 1 17 . 1 1 57 57 GLU H H 57 7.780 7.780 8.219 -0.439 25464
5936 1 17 . 1 1 58 58 TYR N N 58 119.400 119.400 120.842 -1.442 25464
5937 1 17 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.550 -0.660 25464
5938 1 17 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.361 0.839 25464
5939 1 17 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.926 -1.726 25464
5940 1 17 . 1 1 58 58 TYR H H 58 7.700 7.700 8.093 -0.393 25464
5941 1 17 . 1 1 59 59 VAL N N 59 121.500 121.500 118.758 2.742 25464
5942 1 17 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.761 -0.401 25464
5943 1 17 . 1 1 59 59 VAL C C 59 176.300 176.300 178.157 -1.857 25464
5944 1 17 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.914 0.486 25464
5945 1 17 . 1 1 59 59 VAL CB C 59 31.400 31.400 30.957 0.443 25464
5946 1 17 . 1 1 59 59 VAL H H 59 8.380 8.380 8.598 -0.218 25464
5947 1 17 . 1 1 60 60 ASP N N 60 120.000 120.000 120.318 -0.318 25464
5948 1 17 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.505 -0.095 25464
5949 1 17 . 1 1 60 60 ASP C C 60 178.300 178.300 178.785 -0.485 25464
5950 1 17 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.889 -0.789 25464
5951 1 17 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.086 -0.486 25464
5952 1 17 . 1 1 60 60 ASP H H 60 8.580 8.580 8.199 0.381 25464
5953 1 17 . 1 1 61 61 GLN N N 61 114.500 114.500 117.953 -3.453 25464
5954 1 17 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.212 -0.202 25464
5955 1 17 . 1 1 61 61 GLN C C 61 176.700 176.700 178.330 -1.630 25464
5956 1 17 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.627 -1.927 25464
5957 1 17 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.351 0.449 25464
5958 1 17 . 1 1 61 61 GLN H H 61 7.810 7.810 8.119 -0.309 25464
5959 1 17 . 1 1 62 62 HIS N N 62 115.100 115.100 120.120 -5.020 25464
5960 1 17 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.396 -0.016 25464
5961 1 17 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.417 0.883 25464
5962 1 17 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.583 -0.583 25464
5963 1 17 . 1 1 62 62 HIS H H 62 7.730 7.730 7.652 0.078 25464
5964 1 17 . 1 1 63 63 TRP N N 63 121.500 121.500 121.016 0.484 25464
5965 1 17 . 1 1 63 63 TRP CA C 63 58.800 58.800 57.581 1.220 25464
5966 1 17 . 1 1 63 63 TRP CB C 63 29.700 29.700 28.654 1.046 25464
5967 1 17 . 1 1 63 63 TRP H H 63 8.180 8.180 8.059 0.121 25464
5968 1 17 . 1 1 64 64 THR N N 64 114.900 114.900 112.781 2.119 25464
5969 1 17 . 1 1 64 64 THR HA H 64 4.180 4.180 2.787 1.393 25464
5970 1 17 . 1 1 64 64 THR CA C 64 62.100 62.100 63.875 -1.775 25464
5971 1 17 . 1 1 64 64 THR CB C 64 69.500 69.500 68.266 1.234 25464
5972 1 17 . 1 1 64 64 THR H H 64 7.940 7.940 6.999 0.941 25464
5973 1 17 . 1 1 65 65 ASP N N 65 122.900 122.900 120.031 2.869 25464
5974 1 17 . 1 1 65 65 ASP CA C 65 54.400 54.400 52.996 1.404 25464
5975 1 17 . 1 1 65 65 ASP CB C 65 41.100 41.100 43.034 -1.934 25464
5976 1 17 . 1 1 65 65 ASP H H 65 8.340 8.340 7.880 0.460 25464
5977 1 17 . 1 1 66 66 ILE N N 66 122.200 122.200 118.636 3.564 25464
5978 1 17 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.375 -0.215 25464
5979 1 17 . 1 1 66 66 ILE CA C 66 61.100 61.100 59.394 1.706 25464
5980 1 17 . 1 1 66 66 ILE CB C 66 38.500 38.500 38.661 -0.161 25464
5981 1 17 . 1 1 66 66 ILE H H 66 8.250 8.250 8.156 0.094 25464
5982 1 17 . 1 1 67 67 ARG N N 67 124.000 124.000 122.362 1.638 25464
5983 1 17 . 1 1 67 67 ARG CA C 67 53.900 53.900 59.523 -5.623 25464
5984 1 17 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.468 1.532 25464
5985 1 17 . 1 1 67 67 ARG H H 67 8.490 8.490 8.585 -0.095 25464
5986 1 17 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.457 -0.017 25464
5987 1 17 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.486 0.614 25464
5988 1 17 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.308 -0.208 25464
5989 1 17 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.355 -0.025 25464
5990 1 17 . 1 1 69 69 LYS C C 69 175.900 175.900 177.141 -1.241 25464
5991 1 17 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.444 -0.144 25464
5992 1 17 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.249 0.750 25464
5993 1 17 . 1 1 69 69 LYS H H 69 8.270 8.270 8.436 -0.166 25464
5994 1 17 . 1 1 70 70 SER N N 70 122.300 122.300 117.935 4.365 25464
5995 1 17 . 1 1 70 70 SER HA H 70 4.580 4.580 4.396 0.184 25464
5996 1 17 . 1 1 70 70 SER CA C 70 59.900 59.900 58.285 1.615 25464
5997 1 17 . 1 1 70 70 SER CB C 70 65.100 65.100 63.902 1.198 25464
5998 1 17 . 1 1 70 70 SER H H 70 8.140 8.140 8.319 -0.179 25464
5999 1 17 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.631 -0.311 25464
6000 1 17 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.133 0.267 25464
6001 1 17 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.267 -1.167 25464
6002 1 17 . 1 1 76 76 ALA N N 76 124.000 124.000 118.855 5.145 25464
6003 1 17 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.251 0.079 25464
6004 1 17 . 1 1 76 76 ALA CA C 76 52.700 52.700 52.224 0.476 25464
6005 1 17 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.583 -0.583 25464
6006 1 17 . 1 1 76 76 ALA H H 76 8.200 8.200 8.120 0.080 25464
6007 1 17 . 1 1 77 77 SER N N 77 114.100 114.100 111.419 2.681 25464
6008 1 17 . 1 1 77 77 SER HA H 77 4.450 4.450 4.567 -0.117 25464
6009 1 17 . 1 1 77 77 SER CA C 77 58.200 58.200 57.303 0.897 25464
6010 1 17 . 1 1 77 77 SER CB C 77 63.900 63.900 63.648 0.252 25464
6011 1 17 . 1 1 77 77 SER H H 77 8.210 8.210 7.758 0.452 25464
6012 1 17 . 1 1 78 78 GLY N N 78 110.500 110.500 107.466 3.034 25464
6013 1 17 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.904 -0.504 25464
6014 1 17 . 1 1 78 78 GLY H H 78 8.390 8.390 8.821 -0.431 25464
6015 1 17 . 1 1 79 79 GLN N N 79 119.600 119.600 118.022 1.578 25464
6016 1 17 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.682 -0.082 25464
6017 1 17 . 1 1 79 79 GLN CB C 79 29.600 29.600 32.054 -2.454 25464
6018 1 17 . 1 1 79 79 GLN H H 79 8.250 8.250 8.412 -0.162 25464
6019 1 18 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.732 -0.272 25464
6020 1 18 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.750 0.650 25464
6021 1 18 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.013 1.087 25464
6022 1 18 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.115 -0.015 25464
6023 1 18 . 1 1 10 10 ASP N N 10 121.500 121.500 122.930 -1.430 25464
6024 1 18 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.554 0.046 25464
6025 1 18 . 1 1 10 10 ASP C C 10 175.300 175.300 175.119 0.181 25464
6026 1 18 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.667 -0.167 25464
6027 1 18 . 1 1 10 10 ASP CB C 10 40.900 40.900 39.465 1.435 25464
6028 1 18 . 1 1 10 10 ASP H H 10 8.420 8.420 8.512 -0.092 25464
6029 1 18 . 1 1 11 11 ASN N N 11 118.400 118.400 121.457 -3.057 25464
6030 1 18 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.745 0.205 25464
6031 1 18 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.853 -0.053 25464
6032 1 18 . 1 1 11 11 ASN CB C 11 39.100 39.100 39.948 -0.848 25464
6033 1 18 . 1 1 11 11 ASN H H 11 8.270 8.270 7.694 0.576 25464
6034 1 18 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.513 -0.133 25464
6035 1 18 . 1 1 12 12 PRO C C 12 177.100 177.100 176.503 0.597 25464
6036 1 18 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.164 0.535 25464
6037 1 18 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.588 0.312 25464
6038 1 18 . 1 1 13 13 PHE N N 13 117.500 117.500 119.994 -2.494 25464
6039 1 18 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.191 0.309 25464
6040 1 18 . 1 1 13 13 PHE C C 13 175.700 175.700 176.043 -0.343 25464
6041 1 18 . 1 1 13 13 PHE CA C 13 58.300 58.300 58.578 -0.278 25464
6042 1 18 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.188 0.512 25464
6043 1 18 . 1 1 13 13 PHE H H 13 8.120 8.120 7.369 0.751 25464
6044 1 18 . 1 1 14 14 ASP N N 14 120.000 120.000 118.869 1.131 25464
6045 1 18 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.687 -0.067 25464
6046 1 18 . 1 1 14 14 ASP C C 14 175.800 175.800 174.906 0.894 25464
6047 1 18 . 1 1 14 14 ASP CA C 14 54.400 54.400 53.660 0.740 25464
6048 1 18 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.805 -0.405 25464
6049 1 18 . 1 1 14 14 ASP H H 14 8.010 8.010 8.056 -0.046 25464
6050 1 18 . 1 1 15 15 ASP N N 15 119.900 119.900 118.863 1.037 25464
6051 1 18 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.695 -0.085 25464
6052 1 18 . 1 1 15 15 ASP C C 15 176.700 176.700 177.023 -0.323 25464
6053 1 18 . 1 1 15 15 ASP CA C 15 54.500 54.500 52.732 1.768 25464
6054 1 18 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.864 -1.664 25464
6055 1 18 . 1 1 15 15 ASP H H 15 7.900 7.900 7.458 0.442 25464
6056 1 18 . 1 1 16 16 GLU N N 16 122.700 122.700 120.296 2.404 25464
6057 1 18 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.128 0.102 25464
6058 1 18 . 1 1 16 16 GLU C C 16 176.600 176.600 177.032 -0.432 25464
6059 1 18 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.437 -1.037 25464
6060 1 18 . 1 1 16 16 GLU CB C 16 30.100 30.100 29.802 0.298 25464
6061 1 18 . 1 1 16 16 GLU H H 16 8.610 8.610 8.700 -0.090 25464
6062 1 18 . 1 1 17 17 ASP N N 17 119.500 119.500 121.379 -1.879 25464
6063 1 18 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.544 0.306 25464
6064 1 18 . 1 1 17 17 ASP C C 17 176.300 176.300 176.495 -0.195 25464
6065 1 18 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.850 -0.550 25464
6066 1 18 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.272 0.328 25464
6067 1 18 . 1 1 17 17 ASP H H 17 8.490 8.490 8.173 0.317 25464
6068 1 18 . 1 1 18 18 GLY N N 18 107.700 107.700 106.768 0.932 25464
6069 1 18 . 1 1 18 18 GLY C C 18 172.700 172.700 172.731 -0.031 25464
6070 1 18 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.382 0.518 25464
6071 1 18 . 1 1 18 18 GLY H H 18 8.070 8.070 7.752 0.319 25464
6072 1 18 . 1 1 19 19 MET N N 19 117.400 117.400 120.753 -3.353 25464
6073 1 18 . 1 1 19 19 MET HA H 19 4.890 4.890 4.571 0.319 25464
6074 1 18 . 1 1 19 19 MET C C 19 176.000 176.000 174.784 1.216 25464
6075 1 18 . 1 1 19 19 MET CA C 19 53.700 53.700 54.764 -1.064 25464
6076 1 18 . 1 1 19 19 MET CB C 19 35.100 35.100 33.940 1.160 25464
6077 1 18 . 1 1 19 19 MET H H 19 7.820 7.820 8.134 -0.314 25464
6078 1 18 . 1 1 20 20 PHE N N 20 120.100 120.100 119.736 0.364 25464
6079 1 18 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.653 0.357 25464
6080 1 18 . 1 1 20 20 PHE C C 20 174.200 174.200 174.432 -0.232 25464
6081 1 18 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.585 1.815 25464
6082 1 18 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.029 3.772 25464
6083 1 18 . 1 1 20 20 PHE H H 20 9.370 9.370 8.553 0.817 25464
6084 1 18 . 1 1 21 21 PHE N N 21 115.200 115.200 115.607 -0.407 25464
6085 1 18 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.316 0.314 25464
6086 1 18 . 1 1 21 21 PHE C C 21 177.500 177.500 174.986 2.514 25464
6087 1 18 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.304 0.196 25464
6088 1 18 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.662 3.438 25464
6089 1 18 . 1 1 21 21 PHE H H 21 9.600 9.600 8.423 1.177 25464
6090 1 18 . 1 1 22 22 VAL N N 22 116.600 116.600 120.766 -4.166 25464
6091 1 18 . 1 1 22 22 VAL C C 22 175.000 175.000 175.504 -0.504 25464
6092 1 18 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.629 1.071 25464
6093 1 18 . 1 1 22 22 VAL CB C 22 32.800 32.800 31.976 0.824 25464
6094 1 18 . 1 1 22 22 VAL H H 22 8.750 8.750 8.657 0.093 25464
6095 1 18 . 1 1 23 23 LEU N N 23 126.500 126.500 127.682 -1.182 25464
6096 1 18 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.477 0.163 25464
6097 1 18 . 1 1 23 23 LEU C C 23 176.200 176.200 175.688 0.512 25464
6098 1 18 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.069 -1.269 25464
6099 1 18 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.787 0.913 25464
6100 1 18 . 1 1 23 23 LEU H H 23 9.530 9.530 9.016 0.514 25464
6101 1 18 . 1 1 24 24 ILE N N 24 117.700 117.700 119.095 -1.395 25464
6102 1 18 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.374 0.316 25464
6103 1 18 . 1 1 24 24 ILE C C 24 174.300 174.300 173.512 0.788 25464
6104 1 18 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.196 -0.296 25464
6105 1 18 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.518 1.082 25464
6106 1 18 . 1 1 24 24 ILE H H 24 9.300 9.300 8.880 0.420 25464
6107 1 18 . 1 1 25 25 ASN N N 25 122.500 122.500 126.407 -3.907 25464
6108 1 18 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.865 -0.165 25464
6109 1 18 . 1 1 25 25 ASN C C 25 177.700 177.700 176.060 1.640 25464
6110 1 18 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.131 -1.431 25464
6111 1 18 . 1 1 25 25 ASN CB C 25 37.600 37.600 39.434 -1.834 25464
6112 1 18 . 1 1 25 25 ASN H H 25 7.300 7.300 8.527 -1.227 25464
6113 1 18 . 1 1 26 26 ASP N N 26 118.100 118.100 122.301 -4.201 25464
6114 1 18 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.190 0.170 25464
6115 1 18 . 1 1 26 26 ASP C C 26 176.700 176.700 176.321 0.379 25464
6116 1 18 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.327 -0.827 25464
6117 1 18 . 1 1 26 26 ASP CB C 26 39.900 39.900 41.109 -1.209 25464
6118 1 18 . 1 1 26 26 ASP H H 26 8.340 8.340 8.556 -0.216 25464
6119 1 18 . 1 1 27 27 GLU N N 27 117.600 117.600 117.247 0.353 25464
6120 1 18 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.173 0.367 25464
6121 1 18 . 1 1 27 27 GLU C C 27 175.100 175.100 175.845 -0.745 25464
6122 1 18 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.415 -0.715 25464
6123 1 18 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.024 1.476 25464
6124 1 18 . 1 1 27 27 GLU H H 27 7.190 7.190 8.384 -1.194 25464
6125 1 18 . 1 1 28 28 GLU N N 28 112.800 112.800 114.130 -1.330 25464
6126 1 18 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.877 -0.287 25464
6127 1 18 . 1 1 28 28 GLU C C 28 175.200 175.200 175.596 -0.396 25464
6128 1 18 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.676 0.124 25464
6129 1 18 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.955 -0.455 25464
6130 1 18 . 1 1 28 28 GLU H H 28 8.050 8.050 7.669 0.381 25464
6131 1 18 . 1 1 29 29 GLN N N 29 117.200 117.200 118.045 -0.845 25464
6132 1 18 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.122 0.158 25464
6133 1 18 . 1 1 29 29 GLN C C 29 174.600 174.600 175.017 -0.417 25464
6134 1 18 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.527 -0.627 25464
6135 1 18 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.301 -0.001 25464
6136 1 18 . 1 1 29 29 GLN H H 29 7.840 7.840 7.636 0.204 25464
6137 1 18 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.822 0.238 25464
6138 1 18 . 1 1 30 30 HIS C C 30 175.900 175.900 174.810 1.090 25464
6139 1 18 . 1 1 30 30 HIS CA C 30 54.700 54.700 53.840 0.860 25464
6140 1 18 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.546 1.354 25464
6141 1 18 . 1 1 31 31 SER N N 31 113.100 113.100 117.792 -4.692 25464
6142 1 18 . 1 1 31 31 SER HA H 31 4.740 4.740 4.922 -0.182 25464
6143 1 18 . 1 1 31 31 SER C C 31 173.200 173.200 172.318 0.882 25464
6144 1 18 . 1 1 31 31 SER CA C 31 57.400 57.400 57.474 -0.074 25464
6145 1 18 . 1 1 31 31 SER CB C 31 66.600 66.600 64.736 1.864 25464
6146 1 18 . 1 1 31 31 SER H H 31 8.850 8.850 9.079 -0.229 25464
6147 1 18 . 1 1 32 32 LEU HA H 32 5.360 5.360 4.971 0.389 25464
6148 1 18 . 1 1 32 32 LEU C C 32 178.200 178.200 174.999 3.201 25464
6149 1 18 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.346 1.654 25464
6150 1 18 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.839 -2.139 25464
6151 1 18 . 1 1 33 33 TRP N N 33 123.400 123.400 126.839 -3.439 25464
6152 1 18 . 1 1 33 33 TRP HA H 33 5.300 5.300 5.010 0.290 25464
6153 1 18 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.300 -0.201 25464
6154 1 18 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.107 1.393 25464
6155 1 18 . 1 1 33 33 TRP H H 33 9.170 9.170 9.368 -0.198 25464
6156 1 18 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.695 -0.885 25464
6157 1 18 . 1 1 34 34 PRO C C 34 177.400 177.400 177.601 -0.201 25464
6158 1 18 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.372 -0.572 25464
6159 1 18 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.324 -1.324 25464
6160 1 18 . 1 1 35 35 THR N N 35 107.700 107.700 114.670 -6.970 25464
6161 1 18 . 1 1 35 35 THR HA H 35 3.730 3.730 4.261 -0.531 25464
6162 1 18 . 1 1 35 35 THR C C 35 176.100 176.100 175.366 0.734 25464
6163 1 18 . 1 1 35 35 THR CA C 35 63.600 63.600 65.237 -1.637 25464
6164 1 18 . 1 1 35 35 THR CB C 35 68.200 68.200 68.506 -0.306 25464
6165 1 18 . 1 1 35 35 THR H H 35 7.260 7.260 7.938 -0.678 25464
6166 1 18 . 1 1 36 36 PHE N N 36 114.500 114.500 118.123 -3.623 25464
6167 1 18 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.564 -0.054 25464
6168 1 18 . 1 1 36 36 PHE C C 36 174.500 174.500 175.173 -0.673 25464
6169 1 18 . 1 1 36 36 PHE CA C 36 56.900 56.900 58.435 -1.535 25464
6170 1 18 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.715 -1.115 25464
6171 1 18 . 1 1 36 36 PHE H H 36 6.770 6.770 7.413 -0.643 25464
6172 1 18 . 1 1 37 37 ALA N N 37 125.300 125.300 121.664 3.636 25464
6173 1 18 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.548 0.162 25464
6174 1 18 . 1 1 37 37 ALA C C 37 177.300 177.300 175.870 1.430 25464
6175 1 18 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.996 -0.796 25464
6176 1 18 . 1 1 37 37 ALA CB C 37 20.400 20.400 20.746 -0.346 25464
6177 1 18 . 1 1 37 37 ALA H H 37 6.950 6.950 7.337 -0.387 25464
6178 1 18 . 1 1 38 38 ASP N N 38 124.500 124.500 120.196 4.304 25464
6179 1 18 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.816 -0.336 25464
6180 1 18 . 1 1 38 38 ASP C C 38 176.700 176.700 176.610 0.090 25464
6181 1 18 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.325 1.675 25464
6182 1 18 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.702 -2.301 25464
6183 1 18 . 1 1 38 38 ASP H H 38 8.870 8.870 8.593 0.277 25464
6184 1 18 . 1 1 39 39 VAL N N 39 126.000 126.000 123.504 2.496 25464
6185 1 18 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.799 -0.439 25464
6186 1 18 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.821 0.279 25464
6187 1 18 . 1 1 39 39 VAL CB C 39 32.200 32.200 32.106 0.094 25464
6188 1 18 . 1 1 39 39 VAL H H 39 8.650 8.650 8.359 0.291 25464
6189 1 18 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.373 -0.123 25464
6190 1 18 . 1 1 40 40 PRO C C 40 175.800 175.800 176.660 -0.860 25464
6191 1 18 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.485 -0.285 25464
6192 1 18 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.925 -0.225 25464
6193 1 18 . 1 1 41 41 ALA N N 41 122.700 122.700 125.680 -2.980 25464
6194 1 18 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.087 0.093 25464
6195 1 18 . 1 1 41 41 ALA C C 41 179.000 179.000 178.631 0.369 25464
6196 1 18 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.495 -0.195 25464
6197 1 18 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.912 -0.612 25464
6198 1 18 . 1 1 41 41 ALA H H 41 8.280 8.280 8.441 -0.161 25464
6199 1 18 . 1 1 42 42 GLY N N 42 109.800 109.800 111.482 -1.682 25464
6200 1 18 . 1 1 42 42 GLY C C 42 173.800 173.800 174.182 -0.382 25464
6201 1 18 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.889 -0.189 25464
6202 1 18 . 1 1 42 42 GLY H H 42 8.770 8.770 8.278 0.492 25464
6203 1 18 . 1 1 43 43 TRP N N 43 120.300 120.300 123.655 -3.355 25464
6204 1 18 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.062 -0.112 25464
6205 1 18 . 1 1 43 43 TRP C C 43 174.900 174.900 176.006 -1.106 25464
6206 1 18 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.591 -0.891 25464
6207 1 18 . 1 1 43 43 TRP CB C 43 32.000 32.000 28.954 3.046 25464
6208 1 18 . 1 1 43 43 TRP H H 43 7.740 7.740 7.946 -0.206 25464
6209 1 18 . 1 1 44 44 ARG N N 44 117.700 117.700 123.006 -5.306 25464
6210 1 18 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.589 0.131 25464
6211 1 18 . 1 1 44 44 ARG C C 44 174.900 174.900 175.293 -0.393 25464
6212 1 18 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.827 -0.927 25464
6213 1 18 . 1 1 44 44 ARG CB C 44 33.200 33.200 31.607 1.593 25464
6214 1 18 . 1 1 44 44 ARG H H 44 8.990 8.990 8.665 0.325 25464
6215 1 18 . 1 1 45 45 VAL N N 45 122.800 122.800 124.455 -1.655 25464
6216 1 18 . 1 1 45 45 VAL HA H 45 3.980 3.980 3.987 -0.007 25464
6217 1 18 . 1 1 45 45 VAL C C 45 177.600 177.600 176.651 0.949 25464
6218 1 18 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.704 -0.004 25464
6219 1 18 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.846 0.254 25464
6220 1 18 . 1 1 45 45 VAL H H 45 8.720 8.720 8.511 0.209 25464
6221 1 18 . 1 1 46 46 VAL N N 46 120.400 120.400 123.410 -3.010 25464
6222 1 18 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.294 0.386 25464
6223 1 18 . 1 1 46 46 VAL C C 46 174.200 174.200 174.944 -0.744 25464
6224 1 18 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.617 -2.118 25464
6225 1 18 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.572 0.428 25464
6226 1 18 . 1 1 46 46 VAL H H 46 9.060 9.060 8.803 0.257 25464
6227 1 18 . 1 1 47 47 PHE N N 47 121.100 121.100 121.177 -0.077 25464
6228 1 18 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.659 -0.209 25464
6229 1 18 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.620 2.080 25464
6230 1 18 . 1 1 47 47 PHE CB C 47 41.700 41.700 42.212 -0.512 25464
6231 1 18 . 1 1 47 47 PHE H H 47 7.680 7.680 8.201 -0.521 25464
6232 1 18 . 1 1 48 48 GLY N N 48 112.600 112.600 111.463 1.137 25464
6233 1 18 . 1 1 48 48 GLY C C 48 174.700 174.700 173.808 0.892 25464
6234 1 18 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.150 -2.150 25464
6235 1 18 . 1 1 48 48 GLY H H 48 7.380 7.380 8.297 -0.917 25464
6236 1 18 . 1 1 49 49 GLU N N 49 120.600 120.600 118.627 1.973 25464
6237 1 18 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.352 -0.122 25464
6238 1 18 . 1 1 49 49 GLU C C 49 174.900 174.900 175.295 -0.395 25464
6239 1 18 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.630 -1.330 25464
6240 1 18 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.696 2.504 25464
6241 1 18 . 1 1 49 49 GLU H H 49 8.510 8.510 8.668 -0.158 25464
6242 1 18 . 1 1 50 50 ALA N N 50 126.600 126.600 128.230 -1.630 25464
6243 1 18 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.767 -0.127 25464
6244 1 18 . 1 1 50 50 ALA C C 50 175.100 175.100 175.618 -0.518 25464
6245 1 18 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.546 0.854 25464
6246 1 18 . 1 1 50 50 ALA CB C 50 23.200 23.200 23.080 0.120 25464
6247 1 18 . 1 1 50 50 ALA H H 50 9.440 9.440 8.522 0.918 25464
6248 1 18 . 1 1 51 51 SER N N 51 115.100 115.100 115.227 -0.127 25464
6249 1 18 . 1 1 51 51 SER HA H 51 4.740 4.740 4.075 0.665 25464
6250 1 18 . 1 1 51 51 SER C C 51 175.000 175.000 176.014 -1.014 25464
6251 1 18 . 1 1 51 51 SER CA C 51 58.100 58.100 58.532 -0.432 25464
6252 1 18 . 1 1 51 51 SER CB C 51 64.700 64.700 63.456 1.244 25464
6253 1 18 . 1 1 51 51 SER H H 51 8.950 8.950 8.643 0.307 25464
6254 1 18 . 1 1 52 52 ARG N N 52 123.500 123.500 127.829 -4.329 25464
6255 1 18 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.998 -0.588 25464
6256 1 18 . 1 1 52 52 ARG C C 52 178.200 178.200 177.723 0.477 25464
6257 1 18 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.647 1.353 25464
6258 1 18 . 1 1 52 52 ARG CB C 52 29.900 29.900 30.151 -0.251 25464
6259 1 18 . 1 1 52 52 ARG H H 52 9.540 9.540 8.327 1.213 25464
6260 1 18 . 1 1 53 53 ALA N N 53 118.000 118.000 119.959 -1.959 25464
6261 1 18 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.144 -0.114 25464
6262 1 18 . 1 1 53 53 ALA C C 53 181.000 181.000 180.101 0.899 25464
6263 1 18 . 1 1 53 53 ALA CA C 53 55.300 55.300 54.924 0.376 25464
6264 1 18 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.887 0.213 25464
6265 1 18 . 1 1 53 53 ALA H H 53 8.770 8.770 8.612 0.158 25464
6266 1 18 . 1 1 54 54 SER N N 54 115.300 115.300 115.207 0.093 25464
6267 1 18 . 1 1 54 54 SER HA H 54 4.350 4.350 4.142 0.208 25464
6268 1 18 . 1 1 54 54 SER C C 54 177.500 177.500 176.699 0.801 25464
6269 1 18 . 1 1 54 54 SER CA C 54 61.900 61.900 61.844 0.056 25464
6270 1 18 . 1 1 54 54 SER CB C 54 63.100 63.100 62.897 0.203 25464
6271 1 18 . 1 1 54 54 SER H H 54 8.140 8.140 7.711 0.429 25464
6272 1 18 . 1 1 55 55 CYS N N 55 121.900 121.900 121.032 0.868 25464
6273 1 18 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.754 0.406 25464
6274 1 18 . 1 1 55 55 CYS C C 55 176.300 176.300 176.783 -0.483 25464
6275 1 18 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.407 -0.107 25464
6276 1 18 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.823 0.177 25464
6277 1 18 . 1 1 55 55 CYS H H 55 8.430 8.430 7.988 0.442 25464
6278 1 18 . 1 1 56 56 VAL N N 56 121.100 121.100 120.185 0.915 25464
6279 1 18 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.641 -0.151 25464
6280 1 18 . 1 1 56 56 VAL C C 56 177.800 177.800 178.100 -0.300 25464
6281 1 18 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.315 -0.315 25464
6282 1 18 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.400 0.200 25464
6283 1 18 . 1 1 56 56 VAL H H 56 8.750 8.750 8.545 0.205 25464
6284 1 18 . 1 1 57 57 GLU N N 57 119.200 119.200 120.641 -1.441 25464
6285 1 18 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.008 0.062 25464
6286 1 18 . 1 1 57 57 GLU C C 57 177.900 177.900 178.685 -0.785 25464
6287 1 18 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.360 -0.060 25464
6288 1 18 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.344 0.156 25464
6289 1 18 . 1 1 57 57 GLU H H 57 7.780 7.780 8.050 -0.270 25464
6290 1 18 . 1 1 58 58 TYR N N 58 119.400 119.400 120.659 -1.259 25464
6291 1 18 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.347 -0.457 25464
6292 1 18 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.631 0.569 25464
6293 1 18 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.842 -1.642 25464
6294 1 18 . 1 1 58 58 TYR H H 58 7.700 7.700 8.105 -0.405 25464
6295 1 18 . 1 1 59 59 VAL N N 59 121.500 121.500 119.323 2.177 25464
6296 1 18 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.652 -0.292 25464
6297 1 18 . 1 1 59 59 VAL C C 59 176.300 176.300 177.366 -1.066 25464
6298 1 18 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.787 0.614 25464
6299 1 18 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.774 -0.374 25464
6300 1 18 . 1 1 59 59 VAL H H 59 8.380 8.380 8.433 -0.053 25464
6301 1 18 . 1 1 60 60 ASP N N 60 120.000 120.000 118.445 1.555 25464
6302 1 18 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.375 0.034 25464
6303 1 18 . 1 1 60 60 ASP C C 60 178.300 178.300 179.143 -0.843 25464
6304 1 18 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.224 -0.124 25464
6305 1 18 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.099 -0.499 25464
6306 1 18 . 1 1 60 60 ASP H H 60 8.580 8.580 8.053 0.527 25464
6307 1 18 . 1 1 61 61 GLN N N 61 114.500 114.500 118.073 -3.573 25464
6308 1 18 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.052 -0.042 25464
6309 1 18 . 1 1 61 61 GLN C C 61 176.700 176.700 178.117 -1.417 25464
6310 1 18 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.693 -1.993 25464
6311 1 18 . 1 1 61 61 GLN CB C 61 28.800 28.800 29.120 -0.320 25464
6312 1 18 . 1 1 61 61 GLN H H 61 7.810 7.810 7.669 0.141 25464
6313 1 18 . 1 1 62 62 HIS N N 62 115.100 115.100 115.536 -0.436 25464
6314 1 18 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.388 -0.008 25464
6315 1 18 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.495 1.805 25464
6316 1 18 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.300 -0.300 25464
6317 1 18 . 1 1 62 62 HIS H H 62 7.730 7.730 7.854 -0.124 25464
6318 1 18 . 1 1 63 63 TRP N N 63 121.500 121.500 120.414 1.086 25464
6319 1 18 . 1 1 63 63 TRP CA C 63 58.800 58.800 58.659 0.141 25464
6320 1 18 . 1 1 63 63 TRP CB C 63 29.700 29.700 30.351 -0.651 25464
6321 1 18 . 1 1 63 63 TRP H H 63 8.180 8.180 7.326 0.854 25464
6322 1 18 . 1 1 64 64 THR N N 64 114.900 114.900 116.238 -1.338 25464
6323 1 18 . 1 1 64 64 THR HA H 64 4.180 4.180 4.070 0.110 25464
6324 1 18 . 1 1 64 64 THR CA C 64 62.100 62.100 64.499 -2.399 25464
6325 1 18 . 1 1 64 64 THR CB C 64 69.500 69.500 69.085 0.415 25464
6326 1 18 . 1 1 64 64 THR H H 64 7.940 7.940 7.664 0.276 25464
6327 1 18 . 1 1 65 65 ASP N N 65 122.900 122.900 122.474 0.426 25464
6328 1 18 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.869 -0.469 25464
6329 1 18 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.009 0.091 25464
6330 1 18 . 1 1 65 65 ASP H H 65 8.340 8.340 8.429 -0.089 25464
6331 1 18 . 1 1 66 66 ILE N N 66 122.200 122.200 121.081 1.119 25464
6332 1 18 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.289 -0.129 25464
6333 1 18 . 1 1 66 66 ILE CA C 66 61.100 61.100 58.666 2.434 25464
6334 1 18 . 1 1 66 66 ILE CB C 66 38.500 38.500 40.177 -1.677 25464
6335 1 18 . 1 1 66 66 ILE H H 66 8.250 8.250 7.988 0.262 25464
6336 1 18 . 1 1 67 67 ARG N N 67 124.000 124.000 125.592 -1.592 25464
6337 1 18 . 1 1 67 67 ARG CA C 67 53.900 53.900 57.731 -3.831 25464
6338 1 18 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.902 1.098 25464
6339 1 18 . 1 1 67 67 ARG H H 67 8.490 8.490 8.562 -0.072 25464
6340 1 18 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.568 -0.128 25464
6341 1 18 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.388 0.712 25464
6342 1 18 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.249 -0.150 25464
6343 1 18 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.373 -0.043 25464
6344 1 18 . 1 1 69 69 LYS C C 69 175.900 175.900 176.425 -0.525 25464
6345 1 18 . 1 1 69 69 LYS CA C 69 56.300 56.300 54.722 1.578 25464
6346 1 18 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.046 0.954 25464
6347 1 18 . 1 1 69 69 LYS H H 69 8.270 8.270 8.363 -0.093 25464
6348 1 18 . 1 1 70 70 SER N N 70 122.300 122.300 116.064 6.236 25464
6349 1 18 . 1 1 70 70 SER HA H 70 4.580 4.580 4.413 0.167 25464
6350 1 18 . 1 1 70 70 SER CA C 70 59.900 59.900 58.605 1.295 25464
6351 1 18 . 1 1 70 70 SER CB C 70 65.100 65.100 62.414 2.686 25464
6352 1 18 . 1 1 70 70 SER H H 70 8.140 8.140 7.820 0.320 25464
6353 1 18 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.344 -0.024 25464
6354 1 18 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.569 -0.169 25464
6355 1 18 . 1 1 75 75 LEU CB C 75 42.100 42.100 41.999 0.101 25464
6356 1 18 . 1 1 76 76 ALA N N 76 124.000 124.000 121.442 2.558 25464
6357 1 18 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.404 -0.074 25464
6358 1 18 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.966 0.734 25464
6359 1 18 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.560 -0.560 25464
6360 1 18 . 1 1 76 76 ALA H H 76 8.200 8.200 8.124 0.076 25464
6361 1 18 . 1 1 77 77 SER N N 77 114.100 114.100 119.908 -5.808 25464
6362 1 18 . 1 1 77 77 SER HA H 77 4.450 4.450 4.349 0.101 25464
6363 1 18 . 1 1 77 77 SER CA C 77 58.200 58.200 58.935 -0.736 25464
6364 1 18 . 1 1 77 77 SER CB C 77 63.900 63.900 63.577 0.324 25464
6365 1 18 . 1 1 77 77 SER H H 77 8.210 8.210 8.755 -0.545 25464
6366 1 18 . 1 1 78 78 GLY N N 78 110.500 110.500 108.932 1.568 25464
6367 1 18 . 1 1 78 78 GLY CA C 78 45.400 45.400 44.846 0.554 25464
6368 1 18 . 1 1 78 78 GLY H H 78 8.390 8.390 8.090 0.300 25464
6369 1 18 . 1 1 79 79 GLN N N 79 119.600 119.600 118.824 0.776 25464
6370 1 18 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.442 0.158 25464
6371 1 18 . 1 1 79 79 GLN CB C 79 29.600 29.600 30.351 -0.751 25464
6372 1 18 . 1 1 79 79 GLN H H 79 8.250 8.250 8.030 0.220 25464
6373 1 19 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.355 0.105 25464
6374 1 19 . 1 1 2 2 PRO CA C 2 63.400 63.400 63.252 0.148 25464
6375 1 19 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.505 0.595 25464
6376 1 19 . 1 1 3 3 GLY CA C 3 45.100 45.100 46.544 -1.444 25464
6377 1 19 . 1 1 10 10 ASP N N 10 121.500 121.500 119.781 1.719 25464
6378 1 19 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.715 -0.115 25464
6379 1 19 . 1 1 10 10 ASP C C 10 175.300 175.300 174.465 0.835 25464
6380 1 19 . 1 1 10 10 ASP CA C 10 54.500 54.500 53.748 0.752 25464
6381 1 19 . 1 1 10 10 ASP CB C 10 40.900 40.900 44.172 -3.272 25464
6382 1 19 . 1 1 10 10 ASP H H 10 8.420 8.420 8.285 0.135 25464
6383 1 19 . 1 1 11 11 ASN N N 11 118.400 118.400 121.780 -3.380 25464
6384 1 19 . 1 1 11 11 ASN HA H 11 4.950 4.950 5.200 -0.250 25464
6385 1 19 . 1 1 11 11 ASN CA C 11 50.800 50.800 50.929 -0.129 25464
6386 1 19 . 1 1 11 11 ASN CB C 11 39.100 39.100 38.746 0.354 25464
6387 1 19 . 1 1 11 11 ASN H H 11 8.270 8.270 8.761 -0.491 25464
6388 1 19 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.409 -0.029 25464
6389 1 19 . 1 1 12 12 PRO C C 12 177.100 177.100 177.336 -0.236 25464
6390 1 19 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.143 -0.443 25464
6391 1 19 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.830 0.070 25464
6392 1 19 . 1 1 13 13 PHE N N 13 117.500 117.500 115.941 1.559 25464
6393 1 19 . 1 1 13 13 PHE HA H 13 4.500 4.500 3.442 1.058 25464
6394 1 19 . 1 1 13 13 PHE C C 13 175.700 175.700 175.128 0.572 25464
6395 1 19 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.370 1.930 25464
6396 1 19 . 1 1 13 13 PHE CB C 13 38.700 38.700 37.003 1.697 25464
6397 1 19 . 1 1 13 13 PHE H H 13 8.120 8.120 8.242 -0.122 25464
6398 1 19 . 1 1 14 14 ASP N N 14 120.000 120.000 120.379 -0.379 25464
6399 1 19 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.305 0.315 25464
6400 1 19 . 1 1 14 14 ASP C C 14 175.800 175.800 176.299 -0.499 25464
6401 1 19 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.480 -0.080 25464
6402 1 19 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.134 0.266 25464
6403 1 19 . 1 1 14 14 ASP H H 14 8.010 8.010 7.271 0.739 25464
6404 1 19 . 1 1 15 15 ASP N N 15 119.900 119.900 118.412 1.488 25464
6405 1 19 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.570 0.040 25464
6406 1 19 . 1 1 15 15 ASP C C 15 176.700 176.700 176.379 0.321 25464
6407 1 19 . 1 1 15 15 ASP CA C 15 54.500 54.500 54.805 -0.305 25464
6408 1 19 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.642 -1.442 25464
6409 1 19 . 1 1 15 15 ASP H H 15 7.900 7.900 7.478 0.422 25464
6410 1 19 . 1 1 16 16 GLU N N 16 122.700 122.700 119.288 3.412 25464
6411 1 19 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.335 -0.105 25464
6412 1 19 . 1 1 16 16 GLU C C 16 176.600 176.600 176.830 -0.230 25464
6413 1 19 . 1 1 16 16 GLU CA C 16 57.400 57.400 57.283 0.117 25464
6414 1 19 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.605 -0.505 25464
6415 1 19 . 1 1 16 16 GLU H H 16 8.610 8.610 8.546 0.064 25464
6416 1 19 . 1 1 17 17 ASP N N 17 119.500 119.500 121.578 -2.078 25464
6417 1 19 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.606 0.244 25464
6418 1 19 . 1 1 17 17 ASP C C 17 176.300 176.300 177.241 -0.941 25464
6419 1 19 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.343 -1.043 25464
6420 1 19 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.428 0.172 25464
6421 1 19 . 1 1 17 17 ASP H H 17 8.490 8.490 8.332 0.158 25464
6422 1 19 . 1 1 18 18 GLY N N 18 107.700 107.700 108.008 -0.308 25464
6423 1 19 . 1 1 18 18 GLY C C 18 172.700 172.700 172.034 0.666 25464
6424 1 19 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.343 0.558 25464
6425 1 19 . 1 1 18 18 GLY H H 18 8.070 8.070 8.158 -0.088 25464
6426 1 19 . 1 1 19 19 MET N N 19 117.400 117.400 118.801 -1.401 25464
6427 1 19 . 1 1 19 19 MET HA H 19 4.890 4.890 4.582 0.308 25464
6428 1 19 . 1 1 19 19 MET C C 19 176.000 176.000 174.713 1.287 25464
6429 1 19 . 1 1 19 19 MET CA C 19 53.700 53.700 54.748 -1.048 25464
6430 1 19 . 1 1 19 19 MET CB C 19 35.100 35.100 34.045 1.055 25464
6431 1 19 . 1 1 19 19 MET H H 19 7.820 7.820 8.164 -0.344 25464
6432 1 19 . 1 1 20 20 PHE N N 20 120.100 120.100 119.438 0.662 25464
6433 1 19 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.619 0.391 25464
6434 1 19 . 1 1 20 20 PHE C C 20 174.200 174.200 174.738 -0.538 25464
6435 1 19 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.424 1.976 25464
6436 1 19 . 1 1 20 20 PHE CB C 20 45.800 45.800 42.093 3.707 25464
6437 1 19 . 1 1 20 20 PHE H H 20 9.370 9.370 8.589 0.781 25464
6438 1 19 . 1 1 21 21 PHE N N 21 115.200 115.200 116.177 -0.977 25464
6439 1 19 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.349 0.281 25464
6440 1 19 . 1 1 21 21 PHE C C 21 177.500 177.500 174.657 2.843 25464
6441 1 19 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.353 0.146 25464
6442 1 19 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.915 3.185 25464
6443 1 19 . 1 1 21 21 PHE H H 21 9.600 9.600 8.362 1.238 25464
6444 1 19 . 1 1 22 22 VAL N N 22 116.600 116.600 120.644 -4.044 25464
6445 1 19 . 1 1 22 22 VAL C C 22 175.000 175.000 175.781 -0.781 25464
6446 1 19 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.393 1.307 25464
6447 1 19 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.194 0.606 25464
6448 1 19 . 1 1 22 22 VAL H H 22 8.750 8.750 8.660 0.090 25464
6449 1 19 . 1 1 23 23 LEU N N 23 126.500 126.500 128.085 -1.585 25464
6450 1 19 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.571 0.069 25464
6451 1 19 . 1 1 23 23 LEU C C 23 176.200 176.200 176.199 0.001 25464
6452 1 19 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.234 -1.434 25464
6453 1 19 . 1 1 23 23 LEU CB C 23 46.700 46.700 44.669 2.031 25464
6454 1 19 . 1 1 23 23 LEU H H 23 9.530 9.530 9.224 0.306 25464
6455 1 19 . 1 1 24 24 ILE N N 24 117.700 117.700 117.560 0.140 25464
6456 1 19 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.093 0.597 25464
6457 1 19 . 1 1 24 24 ILE C C 24 174.300 174.300 173.343 0.957 25464
6458 1 19 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.402 -0.502 25464
6459 1 19 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.564 1.036 25464
6460 1 19 . 1 1 24 24 ILE H H 24 9.300 9.300 8.739 0.561 25464
6461 1 19 . 1 1 25 25 ASN N N 25 122.500 122.500 124.001 -1.501 25464
6462 1 19 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.677 0.023 25464
6463 1 19 . 1 1 25 25 ASN C C 25 177.700 177.700 175.728 1.972 25464
6464 1 19 . 1 1 25 25 ASN CA C 25 49.700 49.700 50.968 -1.268 25464
6465 1 19 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.037 -2.437 25464
6466 1 19 . 1 1 25 25 ASN H H 25 7.300 7.300 8.432 -1.132 25464
6467 1 19 . 1 1 26 26 ASP N N 26 118.100 118.100 123.190 -5.090 25464
6468 1 19 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.263 0.097 25464
6469 1 19 . 1 1 26 26 ASP C C 26 176.700 176.700 176.303 0.397 25464
6470 1 19 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.045 -0.545 25464
6471 1 19 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.596 -0.696 25464
6472 1 19 . 1 1 26 26 ASP H H 26 8.340 8.340 8.762 -0.422 25464
6473 1 19 . 1 1 27 27 GLU N N 27 117.600 117.600 117.078 0.522 25464
6474 1 19 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.224 0.316 25464
6475 1 19 . 1 1 27 27 GLU C C 27 175.100 175.100 176.256 -1.156 25464
6476 1 19 . 1 1 27 27 GLU CA C 27 55.700 55.700 55.832 -0.132 25464
6477 1 19 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.451 1.049 25464
6478 1 19 . 1 1 27 27 GLU H H 27 7.190 7.190 7.485 -0.295 25464
6479 1 19 . 1 1 28 28 GLU N N 28 112.800 112.800 115.010 -2.210 25464
6480 1 19 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.689 -0.099 25464
6481 1 19 . 1 1 28 28 GLU C C 28 175.200 175.200 175.409 -0.209 25464
6482 1 19 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.302 0.498 25464
6483 1 19 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.378 -0.878 25464
6484 1 19 . 1 1 28 28 GLU H H 28 8.050 8.050 8.118 -0.068 25464
6485 1 19 . 1 1 29 29 GLN N N 29 117.200 117.200 117.589 -0.389 25464
6486 1 19 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.385 -0.105 25464
6487 1 19 . 1 1 29 29 GLN C C 29 174.600 174.600 175.171 -0.571 25464
6488 1 19 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.485 -0.585 25464
6489 1 19 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.750 -0.450 25464
6490 1 19 . 1 1 29 29 GLN H H 29 7.840 7.840 7.456 0.384 25464
6491 1 19 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.570 0.490 25464
6492 1 19 . 1 1 30 30 HIS C C 30 175.900 175.900 175.027 0.873 25464
6493 1 19 . 1 1 30 30 HIS CA C 30 54.700 54.700 56.007 -1.307 25464
6494 1 19 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.980 0.920 25464
6495 1 19 . 1 1 31 31 SER N N 31 113.100 113.100 113.956 -0.856 25464
6496 1 19 . 1 1 31 31 SER HA H 31 4.740 4.740 4.999 -0.259 25464
6497 1 19 . 1 1 31 31 SER C C 31 173.200 173.200 172.340 0.860 25464
6498 1 19 . 1 1 31 31 SER CA C 31 57.400 57.400 57.614 -0.214 25464
6499 1 19 . 1 1 31 31 SER CB C 31 66.600 66.600 66.110 0.490 25464
6500 1 19 . 1 1 31 31 SER H H 31 8.850 8.850 8.493 0.357 25464
6501 1 19 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.045 0.315 25464
6502 1 19 . 1 1 32 32 LEU C C 32 178.200 178.200 175.333 2.867 25464
6503 1 19 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.073 1.927 25464
6504 1 19 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.907 -1.207 25464
6505 1 19 . 1 1 33 33 TRP N N 33 123.400 123.400 128.777 -5.377 25464
6506 1 19 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.969 0.331 25464
6507 1 19 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.412 -0.312 25464
6508 1 19 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.158 1.342 25464
6509 1 19 . 1 1 33 33 TRP H H 33 9.170 9.170 9.383 -0.213 25464
6510 1 19 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.608 -0.798 25464
6511 1 19 . 1 1 34 34 PRO C C 34 177.400 177.400 177.641 -0.241 25464
6512 1 19 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.033 -0.233 25464
6513 1 19 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.700 -1.700 25464
6514 1 19 . 1 1 35 35 THR N N 35 107.700 107.700 115.778 -8.078 25464
6515 1 19 . 1 1 35 35 THR HA H 35 3.730 3.730 4.345 -0.615 25464
6516 1 19 . 1 1 35 35 THR C C 35 176.100 176.100 175.360 0.740 25464
6517 1 19 . 1 1 35 35 THR CA C 35 63.600 63.600 65.173 -1.573 25464
6518 1 19 . 1 1 35 35 THR CB C 35 68.200 68.200 68.268 -0.068 25464
6519 1 19 . 1 1 35 35 THR H H 35 7.260 7.260 8.160 -0.900 25464
6520 1 19 . 1 1 36 36 PHE N N 36 114.500 114.500 119.033 -4.533 25464
6521 1 19 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.523 -0.013 25464
6522 1 19 . 1 1 36 36 PHE C C 36 174.500 174.500 175.634 -1.134 25464
6523 1 19 . 1 1 36 36 PHE CA C 36 56.900 56.900 58.662 -1.762 25464
6524 1 19 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.723 -1.123 25464
6525 1 19 . 1 1 36 36 PHE H H 36 6.770 6.770 7.369 -0.599 25464
6526 1 19 . 1 1 37 37 ALA N N 37 125.300 125.300 121.435 3.865 25464
6527 1 19 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.598 0.112 25464
6528 1 19 . 1 1 37 37 ALA C C 37 177.300 177.300 176.249 1.051 25464
6529 1 19 . 1 1 37 37 ALA CA C 37 50.200 50.200 50.825 -0.625 25464
6530 1 19 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.138 -0.738 25464
6531 1 19 . 1 1 37 37 ALA H H 37 6.950 6.950 7.499 -0.549 25464
6532 1 19 . 1 1 38 38 ASP N N 38 124.500 124.500 120.309 4.191 25464
6533 1 19 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.842 -0.362 25464
6534 1 19 . 1 1 38 38 ASP C C 38 176.700 176.700 175.955 0.745 25464
6535 1 19 . 1 1 38 38 ASP CA C 38 55.000 55.000 54.096 0.904 25464
6536 1 19 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.831 -2.431 25464
6537 1 19 . 1 1 38 38 ASP H H 38 8.870 8.870 8.625 0.245 25464
6538 1 19 . 1 1 39 39 VAL N N 39 126.000 126.000 123.297 2.703 25464
6539 1 19 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.501 -0.141 25464
6540 1 19 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.754 0.346 25464
6541 1 19 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.815 0.385 25464
6542 1 19 . 1 1 39 39 VAL H H 39 8.650 8.650 8.365 0.285 25464
6543 1 19 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.337 -0.087 25464
6544 1 19 . 1 1 40 40 PRO C C 40 175.800 175.800 175.973 -0.173 25464
6545 1 19 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.465 -0.265 25464
6546 1 19 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.561 0.139 25464
6547 1 19 . 1 1 41 41 ALA N N 41 122.700 122.700 126.970 -4.270 25464
6548 1 19 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.031 0.149 25464
6549 1 19 . 1 1 41 41 ALA C C 41 179.000 179.000 178.698 0.302 25464
6550 1 19 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.614 -0.314 25464
6551 1 19 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.989 -0.689 25464
6552 1 19 . 1 1 41 41 ALA H H 41 8.280 8.280 8.518 -0.238 25464
6553 1 19 . 1 1 42 42 GLY N N 42 109.800 109.800 111.529 -1.729 25464
6554 1 19 . 1 1 42 42 GLY C C 42 173.800 173.800 174.079 -0.279 25464
6555 1 19 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.884 -0.184 25464
6556 1 19 . 1 1 42 42 GLY H H 42 8.770 8.770 8.322 0.448 25464
6557 1 19 . 1 1 43 43 TRP N N 43 120.300 120.300 122.803 -2.503 25464
6558 1 19 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.175 -0.225 25464
6559 1 19 . 1 1 43 43 TRP C C 43 174.900 174.900 176.216 -1.316 25464
6560 1 19 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.544 -0.844 25464
6561 1 19 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.840 2.160 25464
6562 1 19 . 1 1 43 43 TRP H H 43 7.740 7.740 7.998 -0.258 25464
6563 1 19 . 1 1 44 44 ARG N N 44 117.700 117.700 122.956 -5.256 25464
6564 1 19 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.691 0.029 25464
6565 1 19 . 1 1 44 44 ARG C C 44 174.900 174.900 175.268 -0.368 25464
6566 1 19 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.761 -0.861 25464
6567 1 19 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.357 0.843 25464
6568 1 19 . 1 1 44 44 ARG H H 44 8.990 8.990 8.996 -0.006 25464
6569 1 19 . 1 1 45 45 VAL N N 45 122.800 122.800 124.865 -2.065 25464
6570 1 19 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.001 -0.021 25464
6571 1 19 . 1 1 45 45 VAL C C 45 177.600 177.600 176.730 0.870 25464
6572 1 19 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.523 0.177 25464
6573 1 19 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.828 1.272 25464
6574 1 19 . 1 1 45 45 VAL H H 45 8.720 8.720 8.631 0.089 25464
6575 1 19 . 1 1 46 46 VAL N N 46 120.400 120.400 124.088 -3.688 25464
6576 1 19 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.289 0.391 25464
6577 1 19 . 1 1 46 46 VAL C C 46 174.200 174.200 175.590 -1.390 25464
6578 1 19 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.325 -2.825 25464
6579 1 19 . 1 1 46 46 VAL CB C 46 34.000 34.000 32.950 1.050 25464
6580 1 19 . 1 1 46 46 VAL H H 46 9.060 9.060 8.773 0.287 25464
6581 1 19 . 1 1 47 47 PHE N N 47 121.100 121.100 122.225 -1.125 25464
6582 1 19 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.701 -0.251 25464
6583 1 19 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.484 2.216 25464
6584 1 19 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.216 0.484 25464
6585 1 19 . 1 1 47 47 PHE H H 47 7.680 7.680 8.284 -0.604 25464
6586 1 19 . 1 1 48 48 GLY N N 48 112.600 112.600 112.832 -0.232 25464
6587 1 19 . 1 1 48 48 GLY C C 48 174.700 174.700 173.889 0.811 25464
6588 1 19 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.421 -2.421 25464
6589 1 19 . 1 1 48 48 GLY H H 48 7.380 7.380 8.467 -1.087 25464
6590 1 19 . 1 1 49 49 GLU N N 49 120.600 120.600 119.005 1.595 25464
6591 1 19 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.376 -0.146 25464
6592 1 19 . 1 1 49 49 GLU C C 49 174.900 174.900 175.348 -0.448 25464
6593 1 19 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.505 -1.205 25464
6594 1 19 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.559 2.640 25464
6595 1 19 . 1 1 49 49 GLU H H 49 8.510 8.510 8.648 -0.138 25464
6596 1 19 . 1 1 50 50 ALA N N 50 126.600 126.600 128.732 -2.132 25464
6597 1 19 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.766 -0.126 25464
6598 1 19 . 1 1 50 50 ALA C C 50 175.100 175.100 175.868 -0.768 25464
6599 1 19 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.233 1.167 25464
6600 1 19 . 1 1 50 50 ALA CB C 50 23.200 23.200 23.071 0.129 25464
6601 1 19 . 1 1 50 50 ALA H H 50 9.440 9.440 8.742 0.698 25464
6602 1 19 . 1 1 51 51 SER N N 51 115.100 115.100 114.541 0.559 25464
6603 1 19 . 1 1 51 51 SER HA H 51 4.740 4.740 4.120 0.620 25464
6604 1 19 . 1 1 51 51 SER C C 51 175.000 175.000 176.169 -1.169 25464
6605 1 19 . 1 1 51 51 SER CA C 51 58.100 58.100 58.508 -0.408 25464
6606 1 19 . 1 1 51 51 SER CB C 51 64.700 64.700 63.329 1.371 25464
6607 1 19 . 1 1 51 51 SER H H 51 8.950 8.950 8.659 0.291 25464
6608 1 19 . 1 1 52 52 ARG N N 52 123.500 123.500 128.167 -4.667 25464
6609 1 19 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.933 -0.523 25464
6610 1 19 . 1 1 52 52 ARG C C 52 178.200 178.200 177.610 0.590 25464
6611 1 19 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.306 1.694 25464
6612 1 19 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.737 0.163 25464
6613 1 19 . 1 1 52 52 ARG H H 52 9.540 9.540 8.519 1.021 25464
6614 1 19 . 1 1 53 53 ALA N N 53 118.000 118.000 120.096 -2.096 25464
6615 1 19 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.113 -0.083 25464
6616 1 19 . 1 1 53 53 ALA C C 53 181.000 181.000 179.945 1.055 25464
6617 1 19 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.120 0.180 25464
6618 1 19 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.684 0.416 25464
6619 1 19 . 1 1 53 53 ALA H H 53 8.770 8.770 8.616 0.154 25464
6620 1 19 . 1 1 54 54 SER N N 54 115.300 115.300 115.345 -0.045 25464
6621 1 19 . 1 1 54 54 SER HA H 54 4.350 4.350 4.143 0.207 25464
6622 1 19 . 1 1 54 54 SER C C 54 177.500 177.500 176.499 1.001 25464
6623 1 19 . 1 1 54 54 SER CA C 54 61.900 61.900 62.026 -0.126 25464
6624 1 19 . 1 1 54 54 SER CB C 54 63.100 63.100 62.474 0.626 25464
6625 1 19 . 1 1 54 54 SER H H 54 8.140 8.140 7.711 0.429 25464
6626 1 19 . 1 1 55 55 CYS N N 55 121.900 121.900 120.296 1.604 25464
6627 1 19 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.781 0.379 25464
6628 1 19 . 1 1 55 55 CYS C C 55 176.300 176.300 176.807 -0.507 25464
6629 1 19 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.104 0.196 25464
6630 1 19 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.887 0.113 25464
6631 1 19 . 1 1 55 55 CYS H H 55 8.430 8.430 7.617 0.812 25464
6632 1 19 . 1 1 56 56 VAL N N 56 121.100 121.100 120.467 0.633 25464
6633 1 19 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.594 -0.104 25464
6634 1 19 . 1 1 56 56 VAL C C 56 177.800 177.800 177.920 -0.120 25464
6635 1 19 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.404 -0.404 25464
6636 1 19 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.393 0.207 25464
6637 1 19 . 1 1 56 56 VAL H H 56 8.750 8.750 8.524 0.226 25464
6638 1 19 . 1 1 57 57 GLU N N 57 119.200 119.200 120.515 -1.315 25464
6639 1 19 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.960 0.110 25464
6640 1 19 . 1 1 57 57 GLU C C 57 177.900 177.900 178.747 -0.847 25464
6641 1 19 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.803 -0.503 25464
6642 1 19 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.684 -0.184 25464
6643 1 19 . 1 1 57 57 GLU H H 57 7.780 7.780 8.138 -0.358 25464
6644 1 19 . 1 1 58 58 TYR N N 58 119.400 119.400 119.587 -0.187 25464
6645 1 19 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.277 -0.387 25464
6646 1 19 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.297 0.903 25464
6647 1 19 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.937 -1.737 25464
6648 1 19 . 1 1 58 58 TYR H H 58 7.700 7.700 7.990 -0.290 25464
6649 1 19 . 1 1 59 59 VAL N N 59 121.500 121.500 116.454 5.046 25464
6650 1 19 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.663 -0.303 25464
6651 1 19 . 1 1 59 59 VAL C C 59 176.300 176.300 177.924 -1.624 25464
6652 1 19 . 1 1 59 59 VAL CA C 59 67.400 67.400 65.518 1.882 25464
6653 1 19 . 1 1 59 59 VAL CB C 59 31.400 31.400 32.068 -0.668 25464
6654 1 19 . 1 1 59 59 VAL H H 59 8.380 8.380 8.263 0.117 25464
6655 1 19 . 1 1 60 60 ASP N N 60 120.000 120.000 120.063 -0.063 25464
6656 1 19 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.536 -0.126 25464
6657 1 19 . 1 1 60 60 ASP C C 60 178.300 178.300 178.389 -0.089 25464
6658 1 19 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.370 -0.270 25464
6659 1 19 . 1 1 60 60 ASP CB C 60 40.600 40.600 40.892 -0.293 25464
6660 1 19 . 1 1 60 60 ASP H H 60 8.580 8.580 8.370 0.210 25464
6661 1 19 . 1 1 61 61 GLN N N 61 114.500 114.500 117.557 -3.057 25464
6662 1 19 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.050 -0.040 25464
6663 1 19 . 1 1 61 61 GLN C C 61 176.700 176.700 177.456 -0.756 25464
6664 1 19 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.547 -0.847 25464
6665 1 19 . 1 1 61 61 GLN CB C 61 28.800 28.800 27.763 1.037 25464
6666 1 19 . 1 1 61 61 GLN H H 61 7.810 7.810 7.740 0.070 25464
6667 1 19 . 1 1 62 62 HIS N N 62 115.100 115.100 118.006 -2.906 25464
6668 1 19 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.192 0.188 25464
6669 1 19 . 1 1 62 62 HIS CA C 62 57.300 57.300 57.413 -0.113 25464
6670 1 19 . 1 1 62 62 HIS CB C 62 29.000 29.000 28.396 0.604 25464
6671 1 19 . 1 1 62 62 HIS H H 62 7.730 7.730 7.873 -0.143 25464
6672 1 19 . 1 1 63 63 TRP N N 63 121.500 121.500 121.353 0.147 25464
6673 1 19 . 1 1 63 63 TRP CA C 63 58.800 58.800 58.544 0.256 25464
6674 1 19 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.220 0.480 25464
6675 1 19 . 1 1 63 63 TRP H H 63 8.180 8.180 7.214 0.966 25464
6676 1 19 . 1 1 64 64 THR N N 64 114.900 114.900 116.988 -2.088 25464
6677 1 19 . 1 1 64 64 THR HA H 64 4.180 4.180 3.826 0.354 25464
6678 1 19 . 1 1 64 64 THR CA C 64 62.100 62.100 64.226 -2.126 25464
6679 1 19 . 1 1 64 64 THR CB C 64 69.500 69.500 69.186 0.314 25464
6680 1 19 . 1 1 64 64 THR H H 64 7.940 7.940 7.561 0.379 25464
6681 1 19 . 1 1 65 65 ASP N N 65 122.900 122.900 124.250 -1.350 25464
6682 1 19 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.599 -0.199 25464
6683 1 19 . 1 1 65 65 ASP CB C 65 41.100 41.100 40.566 0.534 25464
6684 1 19 . 1 1 65 65 ASP H H 65 8.340 8.340 8.294 0.046 25464
6685 1 19 . 1 1 66 66 ILE N N 66 122.200 122.200 125.158 -2.958 25464
6686 1 19 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.083 0.077 25464
6687 1 19 . 1 1 66 66 ILE CA C 66 61.100 61.100 59.434 1.666 25464
6688 1 19 . 1 1 66 66 ILE CB C 66 38.500 38.500 37.605 0.895 25464
6689 1 19 . 1 1 66 66 ILE H H 66 8.250 8.250 7.998 0.252 25464
6690 1 19 . 1 1 67 67 ARG N N 67 124.000 124.000 127.297 -3.297 25464
6691 1 19 . 1 1 67 67 ARG CA C 67 53.900 53.900 60.978 -7.078 25464
6692 1 19 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.552 1.448 25464
6693 1 19 . 1 1 67 67 ARG H H 67 8.490 8.490 8.497 -0.007 25464
6694 1 19 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.410 0.030 25464
6695 1 19 . 1 1 68 68 PRO CA C 68 63.100 63.100 64.064 -0.964 25464
6696 1 19 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.133 0.967 25464
6697 1 19 . 1 1 69 69 LYS HA H 69 4.330 4.330 3.907 0.423 25464
6698 1 19 . 1 1 69 69 LYS C C 69 175.900 175.900 177.195 -1.295 25464
6699 1 19 . 1 1 69 69 LYS CA C 69 56.300 56.300 58.573 -2.273 25464
6700 1 19 . 1 1 69 69 LYS CB C 69 33.000 33.000 30.155 2.845 25464
6701 1 19 . 1 1 69 69 LYS H H 69 8.270 8.270 7.902 0.368 25464
6702 1 19 . 1 1 70 70 SER N N 70 122.300 122.300 119.310 2.990 25464
6703 1 19 . 1 1 70 70 SER HA H 70 4.580 4.580 4.497 0.083 25464
6704 1 19 . 1 1 70 70 SER CA C 70 59.900 59.900 58.583 1.317 25464
6705 1 19 . 1 1 70 70 SER CB C 70 65.100 65.100 62.026 3.074 25464
6706 1 19 . 1 1 70 70 SER H H 70 8.140 8.140 8.233 -0.093 25464
6707 1 19 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.141 0.179 25464
6708 1 19 . 1 1 75 75 LEU CA C 75 55.400 55.400 54.368 1.032 25464
6709 1 19 . 1 1 75 75 LEU CB C 75 42.100 42.100 42.608 -0.508 25464
6710 1 19 . 1 1 76 76 ALA N N 76 124.000 124.000 129.937 -5.937 25464
6711 1 19 . 1 1 76 76 ALA HA H 76 4.330 4.330 2.736 1.594 25464
6712 1 19 . 1 1 76 76 ALA CA C 76 52.700 52.700 50.558 2.142 25464
6713 1 19 . 1 1 76 76 ALA CB C 76 19.000 19.000 16.366 2.634 25464
6714 1 19 . 1 1 76 76 ALA H H 76 8.200 8.200 7.954 0.246 25464
6715 1 19 . 1 1 77 77 SER N N 77 114.100 114.100 114.835 -0.735 25464
6716 1 19 . 1 1 77 77 SER HA H 77 4.450 4.450 4.406 0.044 25464
6717 1 19 . 1 1 77 77 SER CA C 77 58.200 58.200 57.506 0.694 25464
6718 1 19 . 1 1 77 77 SER CB C 77 63.900 63.900 64.266 -0.366 25464
6719 1 19 . 1 1 77 77 SER H H 77 8.210 8.210 7.328 0.882 25464
6720 1 19 . 1 1 78 78 GLY N N 78 110.500 110.500 108.832 1.668 25464
6721 1 19 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.053 0.347 25464
6722 1 19 . 1 1 78 78 GLY H H 78 8.390 8.390 8.056 0.334 25464
6723 1 19 . 1 1 79 79 GLN N N 79 119.600 119.600 119.189 0.411 25464
6724 1 19 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.302 0.298 25464
6725 1 19 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.984 -0.384 25464
6726 1 19 . 1 1 79 79 GLN H H 79 8.250 8.250 8.428 -0.178 25464
6727 1 20 . 1 1 2 2 PRO HA H 2 4.460 4.460 4.762 -0.302 25464
6728 1 20 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.631 0.769 25464
6729 1 20 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.521 0.579 25464
6730 1 20 . 1 1 3 3 GLY CA C 3 45.100 45.100 44.670 0.430 25464
6731 1 20 . 1 1 10 10 ASP N N 10 121.500 121.500 125.385 -3.885 25464
6732 1 20 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.544 0.056 25464
6733 1 20 . 1 1 10 10 ASP C C 10 175.300 175.300 175.569 -0.269 25464
6734 1 20 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.062 0.438 25464
6735 1 20 . 1 1 10 10 ASP CB C 10 40.900 40.900 42.044 -1.143 25464
6736 1 20 . 1 1 10 10 ASP H H 10 8.420 8.420 8.512 -0.092 25464
6737 1 20 . 1 1 11 11 ASN N N 11 118.400 118.400 120.227 -1.827 25464
6738 1 20 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.612 0.338 25464
6739 1 20 . 1 1 11 11 ASN CA C 11 50.800 50.800 52.346 -1.546 25464
6740 1 20 . 1 1 11 11 ASN CB C 11 39.100 39.100 37.741 1.359 25464
6741 1 20 . 1 1 11 11 ASN H H 11 8.270 8.270 8.500 -0.230 25464
6742 1 20 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.326 0.054 25464
6743 1 20 . 1 1 12 12 PRO C C 12 177.100 177.100 177.612 -0.512 25464
6744 1 20 . 1 1 12 12 PRO CA C 12 63.700 63.700 64.304 -0.604 25464
6745 1 20 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.942 -0.042 25464
6746 1 20 . 1 1 13 13 PHE N N 13 117.500 117.500 113.430 4.070 25464
6747 1 20 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.277 0.223 25464
6748 1 20 . 1 1 13 13 PHE C C 13 175.700 175.700 175.331 0.369 25464
6749 1 20 . 1 1 13 13 PHE CA C 13 58.300 58.300 55.504 2.796 25464
6750 1 20 . 1 1 13 13 PHE CB C 13 38.700 38.700 37.569 1.131 25464
6751 1 20 . 1 1 13 13 PHE H H 13 8.120 8.120 7.737 0.383 25464
6752 1 20 . 1 1 14 14 ASP N N 14 120.000 120.000 121.046 -1.046 25464
6753 1 20 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.286 0.334 25464
6754 1 20 . 1 1 14 14 ASP C C 14 175.800 175.800 176.232 -0.432 25464
6755 1 20 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.773 -0.373 25464
6756 1 20 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.100 0.300 25464
6757 1 20 . 1 1 14 14 ASP H H 14 8.010 8.010 7.422 0.588 25464
6758 1 20 . 1 1 15 15 ASP N N 15 119.900 119.900 119.176 0.724 25464
6759 1 20 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.649 -0.039 25464
6760 1 20 . 1 1 15 15 ASP C C 15 176.700 176.700 176.468 0.232 25464
6761 1 20 . 1 1 15 15 ASP CA C 15 54.500 54.500 53.731 0.769 25464
6762 1 20 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.782 -1.581 25464
6763 1 20 . 1 1 15 15 ASP H H 15 7.900 7.900 7.577 0.323 25464
6764 1 20 . 1 1 16 16 GLU N N 16 122.700 122.700 119.092 3.608 25464
6765 1 20 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.423 -0.193 25464
6766 1 20 . 1 1 16 16 GLU C C 16 176.600 176.600 176.828 -0.228 25464
6767 1 20 . 1 1 16 16 GLU CA C 16 57.400 57.400 57.335 0.065 25464
6768 1 20 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.883 -0.783 25464
6769 1 20 . 1 1 16 16 GLU H H 16 8.610 8.610 8.725 -0.115 25464
6770 1 20 . 1 1 17 17 ASP N N 17 119.500 119.500 121.556 -2.056 25464
6771 1 20 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.526 0.324 25464
6772 1 20 . 1 1 17 17 ASP C C 17 176.300 176.300 176.845 -0.545 25464
6773 1 20 . 1 1 17 17 ASP CA C 17 54.300 54.300 54.789 -0.490 25464
6774 1 20 . 1 1 17 17 ASP CB C 17 41.600 41.600 41.333 0.267 25464
6775 1 20 . 1 1 17 17 ASP H H 17 8.490 8.490 8.051 0.439 25464
6776 1 20 . 1 1 18 18 GLY N N 18 107.700 107.700 107.600 0.100 25464
6777 1 20 . 1 1 18 18 GLY C C 18 172.700 172.700 173.502 -0.802 25464
6778 1 20 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.323 0.577 25464
6779 1 20 . 1 1 18 18 GLY H H 18 8.070 8.070 8.045 0.025 25464
6780 1 20 . 1 1 19 19 MET N N 19 117.400 117.400 120.788 -3.388 25464
6781 1 20 . 1 1 19 19 MET HA H 19 4.890 4.890 4.277 0.613 25464
6782 1 20 . 1 1 19 19 MET C C 19 176.000 176.000 174.793 1.207 25464
6783 1 20 . 1 1 19 19 MET CA C 19 53.700 53.700 53.156 0.544 25464
6784 1 20 . 1 1 19 19 MET CB C 19 35.100 35.100 31.885 3.215 25464
6785 1 20 . 1 1 19 19 MET H H 19 7.820 7.820 8.067 -0.247 25464
6786 1 20 . 1 1 20 20 PHE N N 20 120.100 120.100 120.494 -0.394 25464
6787 1 20 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.664 0.346 25464
6788 1 20 . 1 1 20 20 PHE C C 20 174.200 174.200 175.311 -1.111 25464
6789 1 20 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.503 1.897 25464
6790 1 20 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.865 3.935 25464
6791 1 20 . 1 1 20 20 PHE H H 20 9.370 9.370 8.516 0.854 25464
6792 1 20 . 1 1 21 21 PHE N N 21 115.200 115.200 117.246 -2.046 25464
6793 1 20 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.464 0.166 25464
6794 1 20 . 1 1 21 21 PHE C C 21 177.500 177.500 175.003 2.497 25464
6795 1 20 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.069 0.431 25464
6796 1 20 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.422 3.678 25464
6797 1 20 . 1 1 21 21 PHE H H 21 9.600 9.600 8.363 1.237 25464
6798 1 20 . 1 1 22 22 VAL N N 22 116.600 116.600 120.592 -3.992 25464
6799 1 20 . 1 1 22 22 VAL C C 22 175.000 175.000 175.448 -0.448 25464
6800 1 20 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.567 1.133 25464
6801 1 20 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.679 0.121 25464
6802 1 20 . 1 1 22 22 VAL H H 22 8.750 8.750 8.562 0.188 25464
6803 1 20 . 1 1 23 23 LEU N N 23 126.500 126.500 127.335 -0.835 25464
6804 1 20 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.620 0.020 25464
6805 1 20 . 1 1 23 23 LEU C C 23 176.200 176.200 175.771 0.429 25464
6806 1 20 . 1 1 23 23 LEU CA C 23 51.800 51.800 52.831 -1.031 25464
6807 1 20 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.798 0.902 25464
6808 1 20 . 1 1 23 23 LEU H H 23 9.530 9.530 8.768 0.762 25464
6809 1 20 . 1 1 24 24 ILE N N 24 117.700 117.700 118.135 -0.435 25464
6810 1 20 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.425 0.265 25464
6811 1 20 . 1 1 24 24 ILE C C 24 174.300 174.300 173.564 0.736 25464
6812 1 20 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.312 -0.412 25464
6813 1 20 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.919 0.681 25464
6814 1 20 . 1 1 24 24 ILE H H 24 9.300 9.300 8.972 0.328 25464
6815 1 20 . 1 1 25 25 ASN N N 25 122.500 122.500 124.753 -2.253 25464
6816 1 20 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.769 -0.069 25464
6817 1 20 . 1 1 25 25 ASN C C 25 177.700 177.700 175.575 2.125 25464
6818 1 20 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.325 -1.625 25464
6819 1 20 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.062 -2.462 25464
6820 1 20 . 1 1 25 25 ASN H H 25 7.300 7.300 8.685 -1.385 25464
6821 1 20 . 1 1 26 26 ASP N N 26 118.100 118.100 122.789 -4.689 25464
6822 1 20 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.325 0.035 25464
6823 1 20 . 1 1 26 26 ASP C C 26 176.700 176.700 176.109 0.591 25464
6824 1 20 . 1 1 26 26 ASP CA C 26 56.500 56.500 56.279 0.221 25464
6825 1 20 . 1 1 26 26 ASP CB C 26 39.900 39.900 41.148 -1.248 25464
6826 1 20 . 1 1 26 26 ASP H H 26 8.340 8.340 8.798 -0.458 25464
6827 1 20 . 1 1 27 27 GLU N N 27 117.600 117.600 117.912 -0.312 25464
6828 1 20 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.206 0.334 25464
6829 1 20 . 1 1 27 27 GLU C C 27 175.100 175.100 176.012 -0.912 25464
6830 1 20 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.374 -0.674 25464
6831 1 20 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.442 1.058 25464
6832 1 20 . 1 1 27 27 GLU H H 27 7.190 7.190 8.350 -1.160 25464
6833 1 20 . 1 1 28 28 GLU N N 28 112.800 112.800 114.429 -1.629 25464
6834 1 20 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.967 -0.377 25464
6835 1 20 . 1 1 28 28 GLU C C 28 175.200 175.200 175.306 -0.106 25464
6836 1 20 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.636 0.164 25464
6837 1 20 . 1 1 28 28 GLU CB C 28 26.500 26.500 26.670 -0.170 25464
6838 1 20 . 1 1 28 28 GLU H H 28 8.050 8.050 7.994 0.056 25464
6839 1 20 . 1 1 29 29 GLN N N 29 117.200 117.200 117.746 -0.546 25464
6840 1 20 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.419 -0.139 25464
6841 1 20 . 1 1 29 29 GLN C C 29 174.600 174.600 175.301 -0.701 25464
6842 1 20 . 1 1 29 29 GLN CA C 29 54.900 54.900 54.842 0.058 25464
6843 1 20 . 1 1 29 29 GLN CB C 29 29.300 29.300 30.148 -0.848 25464
6844 1 20 . 1 1 29 29 GLN H H 29 7.840 7.840 7.765 0.075 25464
6845 1 20 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.612 0.448 25464
6846 1 20 . 1 1 30 30 HIS C C 30 175.900 175.900 174.947 0.953 25464
6847 1 20 . 1 1 30 30 HIS CA C 30 54.700 54.700 54.111 0.589 25464
6848 1 20 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.041 1.859 25464
6849 1 20 . 1 1 31 31 SER N N 31 113.100 113.100 115.895 -2.795 25464
6850 1 20 . 1 1 31 31 SER HA H 31 4.740 4.740 4.808 -0.068 25464
6851 1 20 . 1 1 31 31 SER C C 31 173.200 173.200 172.156 1.044 25464
6852 1 20 . 1 1 31 31 SER CA C 31 57.400 57.400 58.022 -0.622 25464
6853 1 20 . 1 1 31 31 SER CB C 31 66.600 66.600 64.462 2.138 25464
6854 1 20 . 1 1 31 31 SER H H 31 8.850 8.850 8.905 -0.055 25464
6855 1 20 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.054 0.306 25464
6856 1 20 . 1 1 32 32 LEU C C 32 178.200 178.200 174.885 3.315 25464
6857 1 20 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.483 1.517 25464
6858 1 20 . 1 1 32 32 LEU CB C 32 43.700 43.700 45.488 -1.788 25464
6859 1 20 . 1 1 33 33 TRP N N 33 123.400 123.400 127.000 -3.600 25464
6860 1 20 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.930 0.370 25464
6861 1 20 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.226 -0.126 25464
6862 1 20 . 1 1 33 33 TRP CB C 33 35.500 35.500 34.240 1.260 25464
6863 1 20 . 1 1 33 33 TRP H H 33 9.170 9.170 9.237 -0.067 25464
6864 1 20 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.635 -0.825 25464
6865 1 20 . 1 1 34 34 PRO C C 34 177.400 177.400 177.410 -0.010 25464
6866 1 20 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.132 -0.332 25464
6867 1 20 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.603 -1.603 25464
6868 1 20 . 1 1 35 35 THR N N 35 107.700 107.700 114.980 -7.280 25464
6869 1 20 . 1 1 35 35 THR HA H 35 3.730 3.730 4.409 -0.679 25464
6870 1 20 . 1 1 35 35 THR C C 35 176.100 176.100 175.059 1.041 25464
6871 1 20 . 1 1 35 35 THR CA C 35 63.600 63.600 64.895 -1.295 25464
6872 1 20 . 1 1 35 35 THR CB C 35 68.200 68.200 68.261 -0.061 25464
6873 1 20 . 1 1 35 35 THR H H 35 7.260 7.260 8.075 -0.815 25464
6874 1 20 . 1 1 36 36 PHE N N 36 114.500 114.500 118.215 -3.715 25464
6875 1 20 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.608 -0.098 25464
6876 1 20 . 1 1 36 36 PHE C C 36 174.500 174.500 174.874 -0.374 25464
6877 1 20 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.227 -0.327 25464
6878 1 20 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.340 -0.740 25464
6879 1 20 . 1 1 36 36 PHE H H 36 6.770 6.770 7.419 -0.649 25464
6880 1 20 . 1 1 37 37 ALA N N 37 125.300 125.300 121.595 3.705 25464
6881 1 20 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.680 0.030 25464
6882 1 20 . 1 1 37 37 ALA C C 37 177.300 177.300 175.130 2.170 25464
6883 1 20 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.319 -1.119 25464
6884 1 20 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.729 -1.329 25464
6885 1 20 . 1 1 37 37 ALA H H 37 6.950 6.950 7.530 -0.580 25464
6886 1 20 . 1 1 38 38 ASP N N 38 124.500 124.500 120.352 4.148 25464
6887 1 20 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.940 -0.460 25464
6888 1 20 . 1 1 38 38 ASP C C 38 176.700 176.700 175.825 0.875 25464
6889 1 20 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.678 1.322 25464
6890 1 20 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.871 -2.471 25464
6891 1 20 . 1 1 38 38 ASP H H 38 8.870 8.870 8.624 0.246 25464
6892 1 20 . 1 1 39 39 VAL N N 39 126.000 126.000 122.912 3.088 25464
6893 1 20 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.729 -0.369 25464
6894 1 20 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.124 0.976 25464
6895 1 20 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.258 0.942 25464
6896 1 20 . 1 1 39 39 VAL H H 39 8.650 8.650 8.483 0.167 25464
6897 1 20 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.354 -0.104 25464
6898 1 20 . 1 1 40 40 PRO C C 40 175.800 175.800 176.201 -0.401 25464
6899 1 20 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.412 -0.212 25464
6900 1 20 . 1 1 40 40 PRO CB C 40 31.700 31.700 32.001 -0.301 25464
6901 1 20 . 1 1 41 41 ALA N N 41 122.700 122.700 125.841 -3.141 25464
6902 1 20 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.066 0.114 25464
6903 1 20 . 1 1 41 41 ALA C C 41 179.000 179.000 178.558 0.442 25464
6904 1 20 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.635 -0.335 25464
6905 1 20 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.927 -0.627 25464
6906 1 20 . 1 1 41 41 ALA H H 41 8.280 8.280 8.327 -0.047 25464
6907 1 20 . 1 1 42 42 GLY N N 42 109.800 109.800 111.417 -1.617 25464
6908 1 20 . 1 1 42 42 GLY C C 42 173.800 173.800 174.045 -0.245 25464
6909 1 20 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.823 -0.123 25464
6910 1 20 . 1 1 42 42 GLY H H 42 8.770 8.770 8.286 0.484 25464
6911 1 20 . 1 1 43 43 TRP N N 43 120.300 120.300 122.797 -2.497 25464
6912 1 20 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.044 -0.094 25464
6913 1 20 . 1 1 43 43 TRP C C 43 174.900 174.900 176.227 -1.327 25464
6914 1 20 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.839 -1.139 25464
6915 1 20 . 1 1 43 43 TRP CB C 43 32.000 32.000 29.923 2.077 25464
6916 1 20 . 1 1 43 43 TRP H H 43 7.740 7.740 7.891 -0.151 25464
6917 1 20 . 1 1 44 44 ARG N N 44 117.700 117.700 123.025 -5.325 25464
6918 1 20 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.733 -0.013 25464
6919 1 20 . 1 1 44 44 ARG C C 44 174.900 174.900 175.109 -0.209 25464
6920 1 20 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.649 -0.749 25464
6921 1 20 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.506 0.694 25464
6922 1 20 . 1 1 44 44 ARG H H 44 8.990 8.990 9.072 -0.082 25464
6923 1 20 . 1 1 45 45 VAL N N 45 122.800 122.800 124.602 -1.802 25464
6924 1 20 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.188 -0.208 25464
6925 1 20 . 1 1 45 45 VAL C C 45 177.600 177.600 176.731 0.869 25464
6926 1 20 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.419 0.281 25464
6927 1 20 . 1 1 45 45 VAL CB C 45 32.100 32.100 30.989 1.111 25464
6928 1 20 . 1 1 45 45 VAL H H 45 8.720 8.720 8.602 0.118 25464
6929 1 20 . 1 1 46 46 VAL N N 46 120.400 120.400 125.037 -4.637 25464
6930 1 20 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.223 0.457 25464
6931 1 20 . 1 1 46 46 VAL C C 46 174.200 174.200 174.845 -0.645 25464
6932 1 20 . 1 1 46 46 VAL CA C 46 60.500 60.500 62.730 -2.229 25464
6933 1 20 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.338 0.662 25464
6934 1 20 . 1 1 46 46 VAL H H 46 9.060 9.060 8.803 0.257 25464
6935 1 20 . 1 1 47 47 PHE N N 47 121.100 121.100 120.748 0.352 25464
6936 1 20 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.674 -0.224 25464
6937 1 20 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.578 2.122 25464
6938 1 20 . 1 1 47 47 PHE CB C 47 41.700 41.700 42.261 -0.561 25464
6939 1 20 . 1 1 47 47 PHE H H 47 7.680 7.680 8.143 -0.463 25464
6940 1 20 . 1 1 48 48 GLY N N 48 112.600 112.600 111.893 0.707 25464
6941 1 20 . 1 1 48 48 GLY C C 48 174.700 174.700 173.838 0.862 25464
6942 1 20 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.617 -2.617 25464
6943 1 20 . 1 1 48 48 GLY H H 48 7.380 7.380 8.332 -0.952 25464
6944 1 20 . 1 1 49 49 GLU N N 49 120.600 120.600 118.951 1.649 25464
6945 1 20 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.391 -0.161 25464
6946 1 20 . 1 1 49 49 GLU C C 49 174.900 174.900 175.344 -0.444 25464
6947 1 20 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.209 -0.909 25464
6948 1 20 . 1 1 49 49 GLU CB C 49 31.200 31.200 27.729 3.471 25464
6949 1 20 . 1 1 49 49 GLU H H 49 8.510 8.510 8.596 -0.086 25464
6950 1 20 . 1 1 50 50 ALA N N 50 126.600 126.600 128.716 -2.116 25464
6951 1 20 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.775 -0.135 25464
6952 1 20 . 1 1 50 50 ALA C C 50 175.100 175.100 176.091 -0.991 25464
6953 1 20 . 1 1 50 50 ALA CA C 50 51.400 51.400 49.932 1.468 25464
6954 1 20 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.625 0.575 25464
6955 1 20 . 1 1 50 50 ALA H H 50 9.440 9.440 8.615 0.825 25464
6956 1 20 . 1 1 51 51 SER N N 51 115.100 115.100 114.796 0.304 25464
6957 1 20 . 1 1 51 51 SER HA H 51 4.740 4.740 4.099 0.641 25464
6958 1 20 . 1 1 51 51 SER C C 51 175.000 175.000 175.683 -0.683 25464
6959 1 20 . 1 1 51 51 SER CA C 51 58.100 58.100 58.855 -0.755 25464
6960 1 20 . 1 1 51 51 SER CB C 51 64.700 64.700 63.849 0.851 25464
6961 1 20 . 1 1 51 51 SER H H 51 8.950 8.950 8.609 0.341 25464
6962 1 20 . 1 1 52 52 ARG N N 52 123.500 123.500 125.433 -1.933 25464
6963 1 20 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.976 -0.566 25464
6964 1 20 . 1 1 52 52 ARG C C 52 178.200 178.200 177.933 0.267 25464
6965 1 20 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.577 1.423 25464
6966 1 20 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.846 0.054 25464
6967 1 20 . 1 1 52 52 ARG H H 52 9.540 9.540 8.217 1.323 25464
6968 1 20 . 1 1 53 53 ALA N N 53 118.000 118.000 119.790 -1.790 25464
6969 1 20 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.120 -0.090 25464
6970 1 20 . 1 1 53 53 ALA C C 53 181.000 181.000 179.951 1.049 25464
6971 1 20 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.167 0.133 25464
6972 1 20 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.710 0.390 25464
6973 1 20 . 1 1 53 53 ALA H H 53 8.770 8.770 8.570 0.200 25464
6974 1 20 . 1 1 54 54 SER N N 54 115.300 115.300 115.282 0.018 25464
6975 1 20 . 1 1 54 54 SER HA H 54 4.350 4.350 4.173 0.177 25464
6976 1 20 . 1 1 54 54 SER C C 54 177.500 177.500 176.488 1.012 25464
6977 1 20 . 1 1 54 54 SER CA C 54 61.900 61.900 61.874 0.026 25464
6978 1 20 . 1 1 54 54 SER CB C 54 63.100 63.100 62.269 0.831 25464
6979 1 20 . 1 1 54 54 SER H H 54 8.140 8.140 7.914 0.226 25464
6980 1 20 . 1 1 55 55 CYS N N 55 121.900 121.900 120.452 1.448 25464
6981 1 20 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.717 0.443 25464
6982 1 20 . 1 1 55 55 CYS C C 55 176.300 176.300 176.648 -0.348 25464
6983 1 20 . 1 1 55 55 CYS CA C 55 64.300 64.300 63.922 0.378 25464
6984 1 20 . 1 1 55 55 CYS CB C 55 27.000 27.000 27.271 -0.271 25464
6985 1 20 . 1 1 55 55 CYS H H 55 8.430 8.430 7.959 0.471 25464
6986 1 20 . 1 1 56 56 VAL N N 56 121.100 121.100 120.208 0.892 25464
6987 1 20 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.545 -0.055 25464
6988 1 20 . 1 1 56 56 VAL C C 56 177.800 177.800 178.078 -0.278 25464
6989 1 20 . 1 1 56 56 VAL CA C 56 67.000 67.000 66.863 0.137 25464
6990 1 20 . 1 1 56 56 VAL CB C 56 31.600 31.600 30.972 0.628 25464
6991 1 20 . 1 1 56 56 VAL H H 56 8.750 8.750 8.666 0.084 25464
6992 1 20 . 1 1 57 57 GLU N N 57 119.200 119.200 120.434 -1.234 25464
6993 1 20 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.964 0.106 25464
6994 1 20 . 1 1 57 57 GLU C C 57 177.900 177.900 178.638 -0.738 25464
6995 1 20 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.863 -0.563 25464
6996 1 20 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.657 -0.157 25464
6997 1 20 . 1 1 57 57 GLU H H 57 7.780 7.780 8.134 -0.354 25464
6998 1 20 . 1 1 58 58 TYR N N 58 119.400 119.400 120.771 -1.371 25464
6999 1 20 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.323 -0.433 25464
7000 1 20 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.533 0.667 25464
7001 1 20 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.751 -1.551 25464
7002 1 20 . 1 1 58 58 TYR H H 58 7.700 7.700 8.110 -0.410 25464
7003 1 20 . 1 1 59 59 VAL N N 59 121.500 121.500 118.016 3.484 25464
7004 1 20 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.527 -0.167 25464
7005 1 20 . 1 1 59 59 VAL C C 59 176.300 176.300 178.242 -1.942 25464
7006 1 20 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.535 0.865 25464
7007 1 20 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.540 -0.140 25464
7008 1 20 . 1 1 59 59 VAL H H 59 8.380 8.380 8.424 -0.044 25464
7009 1 20 . 1 1 60 60 ASP N N 60 120.000 120.000 120.208 -0.208 25464
7010 1 20 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.335 0.075 25464
7011 1 20 . 1 1 60 60 ASP C C 60 178.300 178.300 178.313 -0.013 25464
7012 1 20 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.378 -0.278 25464
7013 1 20 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.134 -0.534 25464
7014 1 20 . 1 1 60 60 ASP H H 60 8.580 8.580 7.949 0.631 25464
7015 1 20 . 1 1 61 61 GLN N N 61 114.500 114.500 116.412 -1.912 25464
7016 1 20 . 1 1 61 61 GLN HA H 61 4.010 4.010 3.784 0.226 25464
7017 1 20 . 1 1 61 61 GLN C C 61 176.700 176.700 178.199 -1.499 25464
7018 1 20 . 1 1 61 61 GLN CA C 61 56.700 56.700 58.081 -1.381 25464
7019 1 20 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.517 0.283 25464
7020 1 20 . 1 1 61 61 GLN H H 61 7.810 7.810 7.929 -0.119 25464
7021 1 20 . 1 1 62 62 HIS N N 62 115.100 115.100 117.860 -2.760 25464
7022 1 20 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.565 -0.185 25464
7023 1 20 . 1 1 62 62 HIS CA C 62 57.300 57.300 56.576 0.724 25464
7024 1 20 . 1 1 62 62 HIS CB C 62 29.000 29.000 30.049 -1.048 25464
7025 1 20 . 1 1 62 62 HIS H H 62 7.730 7.730 7.550 0.180 25464
7026 1 20 . 1 1 63 63 TRP N N 63 121.500 121.500 119.776 1.724 25464
7027 1 20 . 1 1 63 63 TRP CA C 63 58.800 58.800 57.114 1.686 25464
7028 1 20 . 1 1 63 63 TRP CB C 63 29.700 29.700 28.735 0.965 25464
7029 1 20 . 1 1 63 63 TRP H H 63 8.180 8.180 8.205 -0.025 25464
7030 1 20 . 1 1 64 64 THR N N 64 114.900 114.900 114.833 0.067 25464
7031 1 20 . 1 1 64 64 THR HA H 64 4.180 4.180 3.645 0.535 25464
7032 1 20 . 1 1 64 64 THR CA C 64 62.100 62.100 64.410 -2.310 25464
7033 1 20 . 1 1 64 64 THR CB C 64 69.500 69.500 68.721 0.780 25464
7034 1 20 . 1 1 64 64 THR H H 64 7.940 7.940 7.249 0.691 25464
7035 1 20 . 1 1 65 65 ASP N N 65 122.900 122.900 120.378 2.522 25464
7036 1 20 . 1 1 65 65 ASP CA C 65 54.400 54.400 53.898 0.502 25464
7037 1 20 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.990 -0.890 25464
7038 1 20 . 1 1 65 65 ASP H H 65 8.340 8.340 7.741 0.599 25464
7039 1 20 . 1 1 66 66 ILE N N 66 122.200 122.200 123.241 -1.041 25464
7040 1 20 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.236 -0.076 25464
7041 1 20 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.390 0.710 25464
7042 1 20 . 1 1 66 66 ILE CB C 66 38.500 38.500 39.017 -0.517 25464
7043 1 20 . 1 1 66 66 ILE H H 66 8.250 8.250 8.574 -0.324 25464
7044 1 20 . 1 1 67 67 ARG N N 67 124.000 124.000 126.852 -2.852 25464
7045 1 20 . 1 1 67 67 ARG CA C 67 53.900 53.900 57.448 -3.548 25464
7046 1 20 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.634 1.366 25464
7047 1 20 . 1 1 67 67 ARG H H 67 8.490 8.490 8.314 0.176 25464
7048 1 20 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.404 0.036 25464
7049 1 20 . 1 1 68 68 PRO CA C 68 63.100 63.100 62.678 0.421 25464
7050 1 20 . 1 1 68 68 PRO CB C 68 32.100 32.100 32.131 -0.031 25464
7051 1 20 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.164 0.166 25464
7052 1 20 . 1 1 69 69 LYS C C 69 175.900 175.900 176.130 -0.230 25464
7053 1 20 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.593 -0.293 25464
7054 1 20 . 1 1 69 69 LYS CB C 69 33.000 33.000 31.253 1.747 25464
7055 1 20 . 1 1 69 69 LYS H H 69 8.270 8.270 8.618 -0.348 25464
7056 1 20 . 1 1 70 70 SER N N 70 122.300 122.300 120.952 1.348 25464
7057 1 20 . 1 1 70 70 SER HA H 70 4.580 4.580 4.473 0.107 25464
7058 1 20 . 1 1 70 70 SER CA C 70 59.900 59.900 58.456 1.444 25464
7059 1 20 . 1 1 70 70 SER CB C 70 65.100 65.100 62.808 2.292 25464
7060 1 20 . 1 1 70 70 SER H H 70 8.140 8.140 8.384 -0.244 25464
7061 1 20 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.169 0.151 25464
7062 1 20 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.241 0.159 25464
7063 1 20 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.676 -1.576 25464
7064 1 20 . 1 1 76 76 ALA N N 76 124.000 124.000 127.793 -3.793 25464
7065 1 20 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.517 -0.187 25464
7066 1 20 . 1 1 76 76 ALA CA C 76 52.700 52.700 50.857 1.843 25464
7067 1 20 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.193 -0.193 25464
7068 1 20 . 1 1 76 76 ALA H H 76 8.200 8.200 8.220 -0.020 25464
7069 1 20 . 1 1 77 77 SER N N 77 114.100 114.100 119.415 -5.315 25464
7070 1 20 . 1 1 77 77 SER HA H 77 4.450 4.450 4.274 0.176 25464
7071 1 20 . 1 1 77 77 SER CA C 77 58.200 58.200 58.342 -0.142 25464
7072 1 20 . 1 1 77 77 SER CB C 77 63.900 63.900 63.599 0.301 25464
7073 1 20 . 1 1 77 77 SER H H 77 8.210 8.210 8.894 -0.684 25464
7074 1 20 . 1 1 78 78 GLY N N 78 110.500 110.500 115.036 -4.536 25464
7075 1 20 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.344 0.056 25464
7076 1 20 . 1 1 78 78 GLY H H 78 8.390 8.390 8.766 -0.376 25464
7077 1 20 . 1 1 79 79 GLN N N 79 119.600 119.600 120.342 -0.742 25464
7078 1 20 . 1 1 79 79 GLN CA C 79 55.600 55.600 56.732 -1.132 25464
7079 1 20 . 1 1 79 79 GLN CB C 79 29.600 29.600 27.779 1.821 25464
7080 1 20 . 1 1 79 79 GLN H H 79 8.250 8.250 8.116 0.134 25464
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 58 2.854 0.578 2.820 25464
2 1 1 "Average Difference" HA 66 0.344 0.062 0.341 25464
3 1 1 "Average Difference" C 48 1.057 -0.207 1.048 25464
4 1 1 "Average Difference" CA 68 1.101 0.031 1.108 25464
5 1 1 "Average Difference" CB 63 1.224 -0.236 1.211 25464
6 1 1 "Average Difference" HN 59 0.490 -0.015 0.494 25464
7 1 2 "Average Difference" N 58 2.922 0.620 2.881 25464
8 1 2 "Average Difference" HA 66 0.335 0.031 0.336 25464
9 1 2 "Average Difference" C 48 1.102 -0.215 1.092 25464
10 1 2 "Average Difference" CA 68 1.201 -0.010 1.210 25464
11 1 2 "Average Difference" CB 63 1.246 -0.164 1.245 25464
12 1 2 "Average Difference" HN 59 0.544 -0.122 0.535 25464
13 1 3 "Average Difference" N 58 2.882 0.764 2.804 25464
14 1 3 "Average Difference" HA 66 0.334 -0.007 0.336 25464
15 1 3 "Average Difference" C 48 1.123 -0.142 1.126 25464
16 1 3 "Average Difference" CA 68 1.293 0.162 1.292 25464
17 1 3 "Average Difference" CB 63 1.304 -0.248 1.290 25464
18 1 3 "Average Difference" HN 59 0.535 -0.087 0.533 25464
19 1 4 "Average Difference" N 58 3.184 0.954 3.064 25464
20 1 4 "Average Difference" HA 66 0.379 0.015 0.381 25464
21 1 4 "Average Difference" C 48 1.048 -0.157 1.047 25464
22 1 4 "Average Difference" CA 68 1.197 0.113 1.201 25464
23 1 4 "Average Difference" CB 63 1.299 -0.312 1.271 25464
24 1 4 "Average Difference" HN 59 0.505 -0.034 0.508 25464
25 1 5 "Average Difference" N 58 2.690 0.957 2.537 25464
26 1 5 "Average Difference" HA 66 0.322 0.014 0.324 25464
27 1 5 "Average Difference" C 48 1.070 -0.084 1.078 25464
28 1 5 "Average Difference" CA 68 1.196 0.012 1.205 25464
29 1 5 "Average Difference" CB 63 1.448 -0.256 1.436 25464
30 1 5 "Average Difference" HN 59 0.495 -0.046 0.497 25464
31 1 6 "Average Difference" N 58 3.124 1.094 2.952 25464
32 1 6 "Average Difference" HA 66 0.315 0.038 0.315 25464
33 1 6 "Average Difference" C 48 1.044 -0.156 1.043 25464
34 1 6 "Average Difference" CA 68 1.346 0.158 1.347 25464
35 1 6 "Average Difference" CB 63 1.254 -0.288 1.230 25464
36 1 6 "Average Difference" HN 59 0.486 -0.063 0.486 25464
37 1 7 "Average Difference" N 58 2.901 0.787 2.817 25464
38 1 7 "Average Difference" HA 66 0.337 0.019 0.339 25464
39 1 7 "Average Difference" C 48 1.080 -0.211 1.070 25464
40 1 7 "Average Difference" CA 68 1.224 0.186 1.218 25464
41 1 7 "Average Difference" CB 63 1.473 -0.226 1.468 25464
42 1 7 "Average Difference" HN 59 0.461 -0.071 0.459 25464
43 1 8 "Average Difference" N 58 2.741 1.211 2.480 25464
44 1 8 "Average Difference" HA 66 0.309 0.018 0.310 25464
45 1 8 "Average Difference" C 48 1.067 -0.080 1.075 25464
46 1 8 "Average Difference" CA 68 1.144 0.128 1.146 25464
47 1 8 "Average Difference" CB 63 1.320 -0.405 1.267 25464
48 1 8 "Average Difference" HN 59 0.455 -0.028 0.458 25464
49 1 9 "Average Difference" N 58 2.847 0.557 2.817 25464
50 1 9 "Average Difference" HA 66 0.347 0.028 0.348 25464
51 1 9 "Average Difference" C 48 1.091 -0.170 1.089 25464
52 1 9 "Average Difference" CA 68 1.206 0.064 1.214 25464
53 1 9 "Average Difference" CB 63 1.433 -0.361 1.398 25464
54 1 9 "Average Difference" HN 59 0.525 -0.086 0.522 25464
55 1 10 "Average Difference" N 58 3.018 1.012 2.869 25464
56 1 10 "Average Difference" HA 66 0.331 0.007 0.333 25464
57 1 10 "Average Difference" C 48 1.008 -0.094 1.014 25464
58 1 10 "Average Difference" CA 68 1.047 0.013 1.055 25464
59 1 10 "Average Difference" CB 63 1.343 -0.287 1.322 25464
60 1 10 "Average Difference" HN 59 0.488 -0.067 0.488 25464
61 1 11 "Average Difference" N 58 2.976 0.705 2.917 25464
62 1 11 "Average Difference" HA 66 0.386 -0.009 0.389 25464
63 1 11 "Average Difference" C 48 1.060 -0.190 1.054 25464
64 1 11 "Average Difference" CA 68 1.112 0.128 1.113 25464
65 1 11 "Average Difference" CB 63 1.292 -0.238 1.280 25464
66 1 11 "Average Difference" HN 59 0.542 -0.040 0.546 25464
67 1 12 "Average Difference" N 58 3.229 1.144 3.046 25464
68 1 12 "Average Difference" HA 66 0.371 -0.010 0.374 25464
69 1 12 "Average Difference" C 48 0.918 -0.108 0.921 25464
70 1 12 "Average Difference" CA 68 1.106 0.085 1.111 25464
71 1 12 "Average Difference" CB 63 1.403 -0.320 1.377 25464
72 1 12 "Average Difference" HN 59 0.527 -0.076 0.526 25464
73 1 13 "Average Difference" N 58 3.038 1.049 2.875 25464
74 1 13 "Average Difference" HA 66 0.329 0.023 0.330 25464
75 1 13 "Average Difference" C 48 1.042 -0.163 1.040 25464
76 1 13 "Average Difference" CA 68 1.117 0.186 1.110 25464
77 1 13 "Average Difference" CB 63 1.316 -0.322 1.286 25464
78 1 13 "Average Difference" HN 59 0.519 -0.029 0.523 25464
79 1 14 "Average Difference" N 58 2.988 0.657 2.941 25464
80 1 14 "Average Difference" HA 66 0.329 0.003 0.332 25464
81 1 14 "Average Difference" C 48 1.068 -0.091 1.076 25464
82 1 14 "Average Difference" CA 68 1.145 0.076 1.151 25464
83 1 14 "Average Difference" CB 63 1.402 -0.380 1.360 25464
84 1 14 "Average Difference" HN 59 0.543 -0.067 0.543 25464
85 1 15 "Average Difference" N 58 2.963 1.167 2.747 25464
86 1 15 "Average Difference" HA 66 0.335 -0.011 0.337 25464
87 1 15 "Average Difference" C 48 0.931 -0.143 0.930 25464
88 1 15 "Average Difference" CA 68 1.274 0.171 1.272 25464
89 1 15 "Average Difference" CB 63 1.239 -0.237 1.226 25464
90 1 15 "Average Difference" HN 59 0.475 -0.081 0.472 25464
91 1 16 "Average Difference" N 58 3.145 0.887 3.043 25464
92 1 16 "Average Difference" HA 66 0.323 0.018 0.325 25464
93 1 16 "Average Difference" C 48 1.118 -0.199 1.112 25464
94 1 16 "Average Difference" CA 68 1.261 0.096 1.267 25464
95 1 16 "Average Difference" CB 63 1.352 -0.290 1.331 25464
96 1 16 "Average Difference" HN 59 0.546 -0.060 0.548 25464
97 1 17 "Average Difference" N 58 2.747 0.553 2.714 25464
98 1 17 "Average Difference" HA 66 0.394 0.017 0.396 25464
99 1 17 "Average Difference" C 48 1.071 -0.038 1.082 25464
100 1 17 "Average Difference" CA 68 1.157 0.065 1.164 25464
101 1 17 "Average Difference" CB 63 1.360 -0.221 1.353 25464
102 1 17 "Average Difference" HN 59 0.492 -0.071 0.491 25464
103 1 18 "Average Difference" N 58 2.752 0.876 2.632 25464
104 1 18 "Average Difference" HA 66 0.333 0.022 0.335 25464
105 1 18 "Average Difference" C 48 0.941 -0.109 0.944 25464
106 1 18 "Average Difference" CA 68 1.152 0.069 1.158 25464
107 1 18 "Average Difference" CB 63 1.278 -0.233 1.267 25464
108 1 18 "Average Difference" HN 59 0.502 -0.095 0.497 25464
109 1 19 "Average Difference" N 58 2.863 1.051 2.687 25464
110 1 19 "Average Difference" HA 66 0.404 -0.033 0.406 25464
111 1 19 "Average Difference" C 48 1.014 -0.082 1.021 25464
112 1 19 "Average Difference" CA 68 1.413 0.183 1.412 25464
113 1 19 "Average Difference" CB 63 1.400 -0.375 1.360 25464
114 1 19 "Average Difference" HN 59 0.492 -0.093 0.487 25464
115 1 20 "Average Difference" N 58 2.771 1.093 2.568 25464
116 1 20 "Average Difference" HA 66 0.350 -0.010 0.353 25464
117 1 20 "Average Difference" C 48 1.043 -0.118 1.047 25464
118 1 20 "Average Difference" CA 68 1.140 -0.007 1.148 25464
119 1 20 "Average Difference" CB 63 1.421 -0.312 1.397 25464
120 1 20 "Average Difference" HN 59 0.517 -0.031 0.521 25464
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 25464
_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 PRO HA H 2 4.460 4.460 4.564 -0.104 25464
2 1 . 1 1 2 2 PRO CA C 2 63.400 63.400 62.734 0.666 25464
3 1 . 1 1 2 2 PRO CB C 2 32.100 32.100 31.814 0.286 25464
4 1 . 1 1 3 3 GLY CA C 3 45.100 45.100 45.195 -0.095 25464
5 1 . 1 1 10 10 ASP N N 10 121.500 121.500 122.493 -0.993 25464
6 1 . 1 1 10 10 ASP HA H 10 4.600 4.600 4.565 0.035 25464
7 1 . 1 1 10 10 ASP C C 10 175.300 175.300 175.134 0.166 25464
8 1 . 1 1 10 10 ASP CA C 10 54.500 54.500 54.452 0.048 25464
9 1 . 1 1 10 10 ASP CB C 10 40.900 40.900 41.137 -0.237 25464
10 1 . 1 1 10 10 ASP H H 10 8.420 8.420 8.308 0.112 25464
11 1 . 1 1 11 11 ASN N N 11 118.400 118.400 120.543 -2.143 25464
12 1 . 1 1 11 11 ASN HA H 11 4.950 4.950 4.847 0.103 25464
13 1 . 1 1 11 11 ASN CA C 11 50.800 50.800 51.105 -0.305 25464
14 1 . 1 1 11 11 ASN CB C 11 39.100 39.100 39.179 -0.079 25464
15 1 . 1 1 11 11 ASN H H 11 8.270 8.270 8.215 0.055 25464
16 1 . 1 1 12 12 PRO HA H 12 4.380 4.380 4.385 -0.005 25464
17 1 . 1 1 12 12 PRO C C 12 177.100 177.100 176.348 0.752 25464
18 1 . 1 1 12 12 PRO CA C 12 63.700 63.700 63.811 -0.111 25464
19 1 . 1 1 12 12 PRO CB C 12 31.900 31.900 31.621 0.279 25464
20 1 . 1 1 13 13 PHE N N 13 117.500 117.500 114.683 2.817 25464
21 1 . 1 1 13 13 PHE HA H 13 4.500 4.500 4.451 0.049 25464
22 1 . 1 1 13 13 PHE C C 13 175.700 175.700 175.070 0.630 25464
23 1 . 1 1 13 13 PHE CA C 13 58.300 58.300 56.676 1.624 25464
24 1 . 1 1 13 13 PHE CB C 13 38.700 38.700 38.361 0.339 25464
25 1 . 1 1 13 13 PHE H H 13 8.120 8.120 7.379 0.741 25464
26 1 . 1 1 14 14 ASP N N 14 120.000 120.000 119.518 0.482 25464
27 1 . 1 1 14 14 ASP HA H 14 4.620 4.620 4.494 0.126 25464
28 1 . 1 1 14 14 ASP C C 14 175.800 175.800 175.947 -0.147 25464
29 1 . 1 1 14 14 ASP CA C 14 54.400 54.400 54.302 0.098 25464
30 1 . 1 1 14 14 ASP CB C 14 41.400 41.400 41.081 0.319 25464
31 1 . 1 1 14 14 ASP H H 14 8.010 8.010 7.678 0.332 25464
32 1 . 1 1 15 15 ASP N N 15 119.900 119.900 120.212 -0.312 25464
33 1 . 1 1 15 15 ASP HA H 15 4.610 4.610 4.616 -0.006 25464
34 1 . 1 1 15 15 ASP C C 15 176.700 176.700 176.935 -0.235 25464
35 1 . 1 1 15 15 ASP CA C 15 54.500 54.500 54.668 -0.168 25464
36 1 . 1 1 15 15 ASP CB C 15 41.200 41.200 42.256 -1.056 25464
37 1 . 1 1 15 15 ASP H H 15 7.900 7.900 7.853 0.047 25464
38 1 . 1 1 16 16 GLU N N 16 122.700 122.700 121.268 1.432 25464
39 1 . 1 1 16 16 GLU HA H 16 4.230 4.230 4.200 0.030 25464
40 1 . 1 1 16 16 GLU C C 16 176.600 176.600 177.121 -0.521 25464
41 1 . 1 1 16 16 GLU CA C 16 57.400 57.400 58.235 -0.835 25464
42 1 . 1 1 16 16 GLU CB C 16 30.100 30.100 30.026 0.074 25464
43 1 . 1 1 16 16 GLU H H 16 8.610 8.610 8.705 -0.095 25464
44 1 . 1 1 17 17 ASP N N 17 119.500 119.500 119.870 -0.370 25464
45 1 . 1 1 17 17 ASP HA H 17 4.850 4.850 4.523 0.327 25464
46 1 . 1 1 17 17 ASP C C 17 176.300 176.300 176.905 -0.605 25464
47 1 . 1 1 17 17 ASP CA C 17 54.300 54.300 55.021 -0.721 25464
48 1 . 1 1 17 17 ASP CB C 17 41.600 41.600 40.984 0.616 25464
49 1 . 1 1 17 17 ASP H H 17 8.490 8.490 8.338 0.152 25464
50 1 . 1 1 18 18 GLY N N 18 107.700 107.700 107.641 0.059 25464
51 1 . 1 1 18 18 GLY C C 18 172.700 172.700 172.979 -0.279 25464
52 1 . 1 1 18 18 GLY CA C 18 44.900 44.900 44.317 0.583 25464
53 1 . 1 1 18 18 GLY H H 18 8.070 8.070 7.770 0.300 25464
54 1 . 1 1 19 19 MET N N 19 117.400 117.400 121.093 -3.693 25464
55 1 . 1 1 19 19 MET HA H 19 4.890 4.890 4.393 0.497 25464
56 1 . 1 1 19 19 MET C C 19 176.000 176.000 174.875 1.125 25464
57 1 . 1 1 19 19 MET CA C 19 53.700 53.700 54.654 -0.954 25464
58 1 . 1 1 19 19 MET CB C 19 35.100 35.100 32.882 2.218 25464
59 1 . 1 1 19 19 MET H H 19 7.820 7.820 8.178 -0.357 25464
60 1 . 1 1 20 20 PHE N N 20 120.100 120.100 119.969 0.131 25464
61 1 . 1 1 20 20 PHE HA H 20 5.010 5.010 4.645 0.365 25464
62 1 . 1 1 20 20 PHE C C 20 174.200 174.200 174.862 -0.662 25464
63 1 . 1 1 20 20 PHE CA C 20 57.400 57.400 55.191 2.209 25464
64 1 . 1 1 20 20 PHE CB C 20 45.800 45.800 41.995 3.805 25464
65 1 . 1 1 20 20 PHE H H 20 9.370 9.370 8.606 0.764 25464
66 1 . 1 1 21 21 PHE N N 21 115.200 115.200 116.267 -1.067 25464
67 1 . 1 1 21 21 PHE HA H 21 5.630 5.630 5.301 0.329 25464
68 1 . 1 1 21 21 PHE C C 21 177.500 177.500 174.819 2.681 25464
69 1 . 1 1 21 21 PHE CA C 21 55.500 55.500 55.331 0.169 25464
70 1 . 1 1 21 21 PHE CB C 21 44.100 44.100 40.580 3.520 25464
71 1 . 1 1 21 21 PHE H H 21 9.600 9.600 8.428 1.172 25464
72 1 . 1 1 22 22 VAL N N 22 116.600 116.600 120.927 -4.327 25464
73 1 . 1 1 22 22 VAL C C 22 175.000 175.000 175.487 -0.487 25464
74 1 . 1 1 22 22 VAL CA C 22 62.700 62.700 61.807 0.893 25464
75 1 . 1 1 22 22 VAL CB C 22 32.800 32.800 32.411 0.389 25464
76 1 . 1 1 22 22 VAL H H 22 8.750 8.750 8.615 0.135 25464
77 1 . 1 1 23 23 LEU N N 23 126.500 126.500 127.570 -1.070 25464
78 1 . 1 1 23 23 LEU HA H 23 5.640 5.640 5.581 0.059 25464
79 1 . 1 1 23 23 LEU C C 23 176.200 176.200 175.916 0.284 25464
80 1 . 1 1 23 23 LEU CA C 23 51.800 51.800 53.116 -1.316 25464
81 1 . 1 1 23 23 LEU CB C 23 46.700 46.700 45.522 1.178 25464
82 1 . 1 1 23 23 LEU H H 23 9.530 9.530 8.890 0.640 25464
83 1 . 1 1 24 24 ILE N N 24 117.700 117.700 118.367 -0.667 25464
84 1 . 1 1 24 24 ILE HA H 24 5.690 5.690 5.395 0.295 25464
85 1 . 1 1 24 24 ILE C C 24 174.300 174.300 173.533 0.767 25464
86 1 . 1 1 24 24 ILE CA C 24 58.900 58.900 59.099 -0.199 25464
87 1 . 1 1 24 24 ILE CB C 24 43.600 43.600 42.639 0.961 25464
88 1 . 1 1 24 24 ILE H H 24 9.300 9.300 8.929 0.371 25464
89 1 . 1 1 25 25 ASN N N 25 122.500 122.500 124.084 -1.584 25464
90 1 . 1 1 25 25 ASN HA H 25 4.700 4.700 4.863 -0.163 25464
91 1 . 1 1 25 25 ASN C C 25 177.700 177.700 175.774 1.926 25464
92 1 . 1 1 25 25 ASN CA C 25 49.700 49.700 51.139 -1.439 25464
93 1 . 1 1 25 25 ASN CB C 25 37.600 37.600 40.283 -2.683 25464
94 1 . 1 1 25 25 ASN H H 25 7.300 7.300 8.466 -1.166 25464
95 1 . 1 1 26 26 ASP N N 26 118.100 118.100 122.874 -4.774 25464
96 1 . 1 1 26 26 ASP HA H 26 4.360 4.360 4.298 0.062 25464
97 1 . 1 1 26 26 ASP C C 26 176.700 176.700 176.542 0.158 25464
98 1 . 1 1 26 26 ASP CA C 26 56.500 56.500 57.027 -0.527 25464
99 1 . 1 1 26 26 ASP CB C 26 39.900 39.900 40.750 -0.850 25464
100 1 . 1 1 26 26 ASP H H 26 8.340 8.340 8.720 -0.380 25464
101 1 . 1 1 27 27 GLU N N 27 117.600 117.600 117.736 -0.136 25464
102 1 . 1 1 27 27 GLU HA H 27 4.540 4.540 4.243 0.297 25464
103 1 . 1 1 27 27 GLU C C 27 175.100 175.100 175.804 -0.704 25464
104 1 . 1 1 27 27 GLU CA C 27 55.700 55.700 56.002 -0.302 25464
105 1 . 1 1 27 27 GLU CB C 27 29.500 29.500 28.335 1.165 25464
106 1 . 1 1 27 27 GLU H H 27 7.190 7.190 8.059 -0.869 25464
107 1 . 1 1 28 28 GLU N N 28 112.800 112.800 114.331 -1.531 25464
108 1 . 1 1 28 28 GLU HA H 28 3.590 3.590 3.891 -0.301 25464
109 1 . 1 1 28 28 GLU C C 28 175.200 175.200 175.373 -0.173 25464
110 1 . 1 1 28 28 GLU CA C 28 57.800 57.800 57.505 0.296 25464
111 1 . 1 1 28 28 GLU CB C 28 26.500 26.500 27.146 -0.646 25464
112 1 . 1 1 28 28 GLU H H 28 8.050 8.050 7.999 0.051 25464
113 1 . 1 1 29 29 GLN N N 29 117.200 117.200 117.931 -0.731 25464
114 1 . 1 1 29 29 GLN HA H 29 4.280 4.280 4.253 0.027 25464
115 1 . 1 1 29 29 GLN C C 29 174.600 174.600 175.263 -0.663 25464
116 1 . 1 1 29 29 GLN CA C 29 54.900 54.900 55.395 -0.495 25464
117 1 . 1 1 29 29 GLN CB C 29 29.300 29.300 29.438 -0.138 25464
118 1 . 1 1 29 29 GLN H H 29 7.840 7.840 7.594 0.246 25464
119 1 . 1 1 30 30 HIS HA H 30 6.060 6.060 5.657 0.403 25464
120 1 . 1 1 30 30 HIS C C 30 175.900 175.900 174.845 1.055 25464
121 1 . 1 1 30 30 HIS CA C 30 54.700 54.700 54.292 0.409 25464
122 1 . 1 1 30 30 HIS CB C 30 32.900 32.900 31.662 1.238 25464
123 1 . 1 1 31 31 SER N N 31 113.100 113.100 116.288 -3.188 25464
124 1 . 1 1 31 31 SER HA H 31 4.740 4.740 4.777 -0.037 25464
125 1 . 1 1 31 31 SER C C 31 173.200 173.200 172.206 0.994 25464
126 1 . 1 1 31 31 SER CA C 31 57.400 57.400 57.622 -0.222 25464
127 1 . 1 1 31 31 SER CB C 31 66.600 66.600 64.758 1.842 25464
128 1 . 1 1 31 31 SER H H 31 8.850 8.850 8.875 -0.025 25464
129 1 . 1 1 32 32 LEU HA H 32 5.360 5.360 5.016 0.344 25464
130 1 . 1 1 32 32 LEU C C 32 178.200 178.200 174.930 3.270 25464
131 1 . 1 1 32 32 LEU CA C 32 56.000 56.000 54.466 1.534 25464
132 1 . 1 1 32 32 LEU CB C 32 43.700 43.700 44.865 -1.165 25464
133 1 . 1 1 33 33 TRP N N 33 123.400 123.400 128.553 -5.153 25464
134 1 . 1 1 33 33 TRP HA H 33 5.300 5.300 4.933 0.367 25464
135 1 . 1 1 33 33 TRP CA C 33 54.100 54.100 54.226 -0.126 25464
136 1 . 1 1 33 33 TRP CB C 33 35.500 35.500 33.798 1.702 25464
137 1 . 1 1 33 33 TRP H H 33 9.170 9.170 9.263 -0.093 25464
138 1 . 1 1 34 34 PRO HA H 34 3.810 3.810 4.578 -0.768 25464
139 1 . 1 1 34 34 PRO C C 34 177.400 177.400 177.426 -0.026 25464
140 1 . 1 1 34 34 PRO CA C 34 61.800 61.800 62.245 -0.445 25464
141 1 . 1 1 34 34 PRO CB C 34 32.000 32.000 33.313 -1.313 25464
142 1 . 1 1 35 35 THR N N 35 107.700 107.700 114.760 -7.060 25464
143 1 . 1 1 35 35 THR HA H 35 3.730 3.730 4.321 -0.591 25464
144 1 . 1 1 35 35 THR C C 35 176.100 176.100 175.268 0.831 25464
145 1 . 1 1 35 35 THR CA C 35 63.600 63.600 64.933 -1.333 25464
146 1 . 1 1 35 35 THR CB C 35 68.200 68.200 68.373 -0.173 25464
147 1 . 1 1 35 35 THR H H 35 7.260 7.260 7.994 -0.734 25464
148 1 . 1 1 36 36 PHE N N 36 114.500 114.500 118.353 -3.853 25464
149 1 . 1 1 36 36 PHE HA H 36 4.510 4.510 4.558 -0.048 25464
150 1 . 1 1 36 36 PHE C C 36 174.500 174.500 175.136 -0.636 25464
151 1 . 1 1 36 36 PHE CA C 36 56.900 56.900 57.791 -0.891 25464
152 1 . 1 1 36 36 PHE CB C 36 37.600 37.600 38.495 -0.895 25464
153 1 . 1 1 36 36 PHE H H 36 6.770 6.770 7.409 -0.639 25464
154 1 . 1 1 37 37 ALA N N 37 125.300 125.300 121.568 3.732 25464
155 1 . 1 1 37 37 ALA HA H 37 4.710 4.710 4.598 0.112 25464
156 1 . 1 1 37 37 ALA C C 37 177.300 177.300 175.494 1.806 25464
157 1 . 1 1 37 37 ALA CA C 37 50.200 50.200 51.073 -0.873 25464
158 1 . 1 1 37 37 ALA CB C 37 20.400 20.400 21.270 -0.870 25464
159 1 . 1 1 37 37 ALA H H 37 6.950 6.950 7.406 -0.456 25464
160 1 . 1 1 38 38 ASP N N 38 124.500 124.500 120.285 4.215 25464
161 1 . 1 1 38 38 ASP HA H 38 4.480 4.480 4.881 -0.401 25464
162 1 . 1 1 38 38 ASP C C 38 176.700 176.700 176.140 0.560 25464
163 1 . 1 1 38 38 ASP CA C 38 55.000 55.000 53.732 1.268 25464
164 1 . 1 1 38 38 ASP CB C 38 40.400 40.400 42.698 -2.298 25464
165 1 . 1 1 38 38 ASP H H 38 8.870 8.870 8.611 0.259 25464
166 1 . 1 1 39 39 VAL N N 39 126.000 126.000 123.012 2.988 25464
167 1 . 1 1 39 39 VAL HA H 39 3.360 3.360 3.683 -0.323 25464
168 1 . 1 1 39 39 VAL CA C 39 61.100 61.100 60.697 0.403 25464
169 1 . 1 1 39 39 VAL CB C 39 32.200 32.200 31.591 0.609 25464
170 1 . 1 1 39 39 VAL H H 39 8.650 8.650 8.405 0.245 25464
171 1 . 1 1 40 40 PRO HA H 40 4.250 4.250 4.358 -0.108 25464
172 1 . 1 1 40 40 PRO C C 40 175.800 175.800 176.318 -0.518 25464
173 1 . 1 1 40 40 PRO CA C 40 62.200 62.200 62.500 -0.300 25464
174 1 . 1 1 40 40 PRO CB C 40 31.700 31.700 31.784 -0.084 25464
175 1 . 1 1 41 41 ALA N N 41 122.700 122.700 126.054 -3.354 25464
176 1 . 1 1 41 41 ALA HA H 41 4.180 4.180 4.058 0.122 25464
177 1 . 1 1 41 41 ALA C C 41 179.000 179.000 178.685 0.315 25464
178 1 . 1 1 41 41 ALA CA C 41 53.300 53.300 53.568 -0.268 25464
179 1 . 1 1 41 41 ALA CB C 41 18.300 18.300 18.996 -0.696 25464
180 1 . 1 1 41 41 ALA H H 41 8.280 8.280 8.445 -0.165 25464
181 1 . 1 1 42 42 GLY N N 42 109.800 109.800 111.550 -1.750 25464
182 1 . 1 1 42 42 GLY C C 42 173.800 173.800 173.838 -0.038 25464
183 1 . 1 1 42 42 GLY CA C 42 44.700 44.700 44.837 -0.137 25464
184 1 . 1 1 42 42 GLY H H 42 8.770 8.770 8.319 0.451 25464
185 1 . 1 1 43 43 TRP N N 43 120.300 120.300 122.346 -2.046 25464
186 1 . 1 1 43 43 TRP HA H 43 4.950 4.950 5.140 -0.190 25464
187 1 . 1 1 43 43 TRP C C 43 174.900 174.900 176.009 -1.109 25464
188 1 . 1 1 43 43 TRP CA C 43 55.700 55.700 56.557 -0.857 25464
189 1 . 1 1 43 43 TRP CB C 43 32.000 32.000 30.223 1.777 25464
190 1 . 1 1 43 43 TRP H H 43 7.740 7.740 7.931 -0.191 25464
191 1 . 1 1 44 44 ARG N N 44 117.700 117.700 122.197 -4.497 25464
192 1 . 1 1 44 44 ARG HA H 44 4.720 4.720 4.731 -0.011 25464
193 1 . 1 1 44 44 ARG C C 44 174.900 174.900 175.115 -0.215 25464
194 1 . 1 1 44 44 ARG CA C 44 53.900 53.900 54.698 -0.797 25464
195 1 . 1 1 44 44 ARG CB C 44 33.200 33.200 32.589 0.611 25464
196 1 . 1 1 44 44 ARG H H 44 8.990 8.990 8.968 0.022 25464
197 1 . 1 1 45 45 VAL N N 45 122.800 122.800 124.839 -2.039 25464
198 1 . 1 1 45 45 VAL HA H 45 3.980 3.980 4.133 -0.153 25464
199 1 . 1 1 45 45 VAL C C 45 177.600 177.600 176.656 0.944 25464
200 1 . 1 1 45 45 VAL CA C 45 63.700 63.700 63.497 0.203 25464
201 1 . 1 1 45 45 VAL CB C 45 32.100 32.100 31.408 0.692 25464
202 1 . 1 1 45 45 VAL H H 45 8.720 8.720 8.614 0.106 25464
203 1 . 1 1 46 46 VAL N N 46 120.400 120.400 124.855 -4.455 25464
204 1 . 1 1 46 46 VAL HA H 46 4.680 4.680 4.264 0.416 25464
205 1 . 1 1 46 46 VAL C C 46 174.200 174.200 175.156 -0.956 25464
206 1 . 1 1 46 46 VAL CA C 46 60.500 60.500 63.204 -2.704 25464
207 1 . 1 1 46 46 VAL CB C 46 34.000 34.000 33.156 0.844 25464
208 1 . 1 1 46 46 VAL H H 46 9.060 9.060 8.797 0.263 25464
209 1 . 1 1 47 47 PHE N N 47 121.100 121.100 121.829 -0.729 25464
210 1 . 1 1 47 47 PHE HA H 47 4.450 4.450 4.662 -0.212 25464
211 1 . 1 1 47 47 PHE CA C 47 58.700 58.700 56.232 2.468 25464
212 1 . 1 1 47 47 PHE CB C 47 41.700 41.700 41.465 0.235 25464
213 1 . 1 1 47 47 PHE H H 47 7.680 7.680 8.229 -0.549 25464
214 1 . 1 1 48 48 GLY N N 48 112.600 112.600 112.632 -0.032 25464
215 1 . 1 1 48 48 GLY C C 48 174.700 174.700 173.820 0.880 25464
216 1 . 1 1 48 48 GLY CA C 48 42.000 42.000 44.446 -2.446 25464
217 1 . 1 1 48 48 GLY H H 48 7.380 7.380 8.414 -1.034 25464
218 1 . 1 1 49 49 GLU N N 49 120.600 120.600 118.922 1.678 25464
219 1 . 1 1 49 49 GLU HA H 49 4.230 4.230 4.297 -0.067 25464
220 1 . 1 1 49 49 GLU C C 49 174.900 174.900 175.436 -0.536 25464
221 1 . 1 1 49 49 GLU CA C 49 56.300 56.300 57.491 -1.191 25464
222 1 . 1 1 49 49 GLU CB C 49 31.200 31.200 28.412 2.788 25464
223 1 . 1 1 49 49 GLU H H 49 8.510 8.510 8.555 -0.045 25464
224 1 . 1 1 50 50 ALA N N 50 126.600 126.600 128.063 -1.463 25464
225 1 . 1 1 50 50 ALA HA H 50 4.640 4.640 4.668 -0.028 25464
226 1 . 1 1 50 50 ALA C C 50 175.100 175.100 175.678 -0.578 25464
227 1 . 1 1 50 50 ALA CA C 50 51.400 51.400 50.288 1.112 25464
228 1 . 1 1 50 50 ALA CB C 50 23.200 23.200 22.693 0.507 25464
229 1 . 1 1 50 50 ALA H H 50 9.440 9.440 8.694 0.746 25464
230 1 . 1 1 51 51 SER N N 51 115.100 115.100 114.859 0.241 25464
231 1 . 1 1 51 51 SER HA H 51 4.740 4.740 4.149 0.591 25464
232 1 . 1 1 51 51 SER C C 51 175.000 175.000 176.035 -1.035 25464
233 1 . 1 1 51 51 SER CA C 51 58.100 58.100 58.442 -0.342 25464
234 1 . 1 1 51 51 SER CB C 51 64.700 64.700 63.814 0.886 25464
235 1 . 1 1 51 51 SER H H 51 8.950 8.950 8.629 0.321 25464
236 1 . 1 1 52 52 ARG N N 52 123.500 123.500 127.192 -3.692 25464
237 1 . 1 1 52 52 ARG HA H 52 3.410 3.410 3.969 -0.559 25464
238 1 . 1 1 52 52 ARG C C 52 178.200 178.200 177.682 0.518 25464
239 1 . 1 1 52 52 ARG CA C 52 61.000 61.000 59.534 1.466 25464
240 1 . 1 1 52 52 ARG CB C 52 29.900 29.900 29.928 -0.028 25464
241 1 . 1 1 52 52 ARG H H 52 9.540 9.540 8.385 1.155 25464
242 1 . 1 1 53 53 ALA N N 53 118.000 118.000 120.164 -2.164 25464
243 1 . 1 1 53 53 ALA HA H 53 4.030 4.030 4.098 -0.068 25464
244 1 . 1 1 53 53 ALA C C 53 181.000 181.000 179.822 1.178 25464
245 1 . 1 1 53 53 ALA CA C 53 55.300 55.300 55.187 0.113 25464
246 1 . 1 1 53 53 ALA CB C 53 18.100 18.100 17.771 0.329 25464
247 1 . 1 1 53 53 ALA H H 53 8.770 8.770 8.378 0.392 25464
248 1 . 1 1 54 54 SER N N 54 115.300 115.300 115.191 0.109 25464
249 1 . 1 1 54 54 SER HA H 54 4.350 4.350 4.195 0.155 25464
250 1 . 1 1 54 54 SER C C 54 177.500 177.500 176.690 0.810 25464
251 1 . 1 1 54 54 SER CA C 54 61.900 61.900 61.883 0.017 25464
252 1 . 1 1 54 54 SER CB C 54 63.100 63.100 62.609 0.491 25464
253 1 . 1 1 54 54 SER H H 54 8.140 8.140 7.834 0.306 25464
254 1 . 1 1 55 55 CYS N N 55 121.900 121.900 120.680 1.220 25464
255 1 . 1 1 55 55 CYS HA H 55 4.160 4.160 3.850 0.310 25464
256 1 . 1 1 55 55 CYS C C 55 176.300 176.300 176.786 -0.486 25464
257 1 . 1 1 55 55 CYS CA C 55 64.300 64.300 64.279 0.021 25464
258 1 . 1 1 55 55 CYS CB C 55 27.000 27.000 26.981 0.019 25464
259 1 . 1 1 55 55 CYS H H 55 8.430 8.430 7.942 0.488 25464
260 1 . 1 1 56 56 VAL N N 56 121.100 121.100 120.283 0.817 25464
261 1 . 1 1 56 56 VAL HA H 56 3.490 3.490 3.604 -0.114 25464
262 1 . 1 1 56 56 VAL C C 56 177.800 177.800 178.082 -0.282 25464
263 1 . 1 1 56 56 VAL CA C 56 67.000 67.000 67.092 -0.092 25464
264 1 . 1 1 56 56 VAL CB C 56 31.600 31.600 31.279 0.321 25464
265 1 . 1 1 56 56 VAL H H 56 8.750 8.750 8.611 0.139 25464
266 1 . 1 1 57 57 GLU N N 57 119.200 119.200 120.583 -1.383 25464
267 1 . 1 1 57 57 GLU HA H 57 4.070 4.070 3.981 0.089 25464
268 1 . 1 1 57 57 GLU C C 57 177.900 177.900 178.671 -0.771 25464
269 1 . 1 1 57 57 GLU CA C 57 59.300 59.300 59.692 -0.392 25464
270 1 . 1 1 57 57 GLU CB C 57 29.500 29.500 29.566 -0.066 25464
271 1 . 1 1 57 57 GLU H H 57 7.780 7.780 8.212 -0.432 25464
272 1 . 1 1 58 58 TYR N N 58 119.400 119.400 120.489 -1.089 25464
273 1 . 1 1 58 58 TYR HA H 58 3.890 3.890 4.270 -0.380 25464
274 1 . 1 1 58 58 TYR CA C 58 62.200 62.200 61.797 0.403 25464
275 1 . 1 1 58 58 TYR CB C 58 37.200 37.200 38.797 -1.597 25464
276 1 . 1 1 58 58 TYR H H 58 7.700 7.700 8.143 -0.443 25464
277 1 . 1 1 59 59 VAL N N 59 121.500 121.500 118.826 2.674 25464
278 1 . 1 1 59 59 VAL HA H 59 3.360 3.360 3.577 -0.217 25464
279 1 . 1 1 59 59 VAL C C 59 176.300 176.300 177.636 -1.336 25464
280 1 . 1 1 59 59 VAL CA C 59 67.400 67.400 66.701 0.699 25464
281 1 . 1 1 59 59 VAL CB C 59 31.400 31.400 31.384 0.016 25464
282 1 . 1 1 59 59 VAL H H 59 8.380 8.380 8.360 0.020 25464
283 1 . 1 1 60 60 ASP N N 60 120.000 120.000 118.385 1.615 25464
284 1 . 1 1 60 60 ASP HA H 60 4.410 4.410 4.351 0.059 25464
285 1 . 1 1 60 60 ASP C C 60 178.300 178.300 178.856 -0.556 25464
286 1 . 1 1 60 60 ASP CA C 60 57.100 57.100 57.179 -0.079 25464
287 1 . 1 1 60 60 ASP CB C 60 40.600 40.600 41.049 -0.449 25464
288 1 . 1 1 60 60 ASP H H 60 8.580 8.580 8.141 0.439 25464
289 1 . 1 1 61 61 GLN N N 61 114.500 114.500 117.479 -2.979 25464
290 1 . 1 1 61 61 GLN HA H 61 4.010 4.010 4.090 -0.080 25464
291 1 . 1 1 61 61 GLN C C 61 176.700 176.700 177.934 -1.234 25464
292 1 . 1 1 61 61 GLN CA C 61 56.700 56.700 57.930 -1.230 25464
293 1 . 1 1 61 61 GLN CB C 61 28.800 28.800 28.641 0.159 25464
294 1 . 1 1 61 61 GLN H H 61 7.810 7.810 7.823 -0.013 25464
295 1 . 1 1 62 62 HIS N N 62 115.100 115.100 117.670 -2.570 25464
296 1 . 1 1 62 62 HIS HA H 62 4.380 4.380 4.511 -0.131 25464
297 1 . 1 1 62 62 HIS CA C 62 57.300 57.300 55.975 1.325 25464
298 1 . 1 1 62 62 HIS CB C 62 29.000 29.000 29.213 -0.213 25464
299 1 . 1 1 62 62 HIS H H 62 7.730 7.730 7.686 0.044 25464
300 1 . 1 1 63 63 TRP N N 63 121.500 121.500 121.014 0.486 25464
301 1 . 1 1 63 63 TRP CA C 63 58.800 58.800 59.175 -0.375 25464
302 1 . 1 1 63 63 TRP CB C 63 29.700 29.700 29.403 0.297 25464
303 1 . 1 1 63 63 TRP H H 63 8.180 8.180 7.548 0.632 25464
304 1 . 1 1 64 64 THR N N 64 114.900 114.900 112.317 2.583 25464
305 1 . 1 1 64 64 THR HA H 64 4.180 4.180 4.033 0.147 25464
306 1 . 1 1 64 64 THR CA C 64 62.100 62.100 63.407 -1.307 25464
307 1 . 1 1 64 64 THR CB C 64 69.500 69.500 68.760 0.740 25464
308 1 . 1 1 64 64 THR H H 64 7.940 7.940 7.734 0.206 25464
309 1 . 1 1 65 65 ASP N N 65 122.900 122.900 122.017 0.883 25464
310 1 . 1 1 65 65 ASP CA C 65 54.400 54.400 54.225 0.175 25464
311 1 . 1 1 65 65 ASP CB C 65 41.100 41.100 41.504 -0.404 25464
312 1 . 1 1 65 65 ASP H H 65 8.340 8.340 7.999 0.341 25464
313 1 . 1 1 66 66 ILE N N 66 122.200 122.200 121.758 0.442 25464
314 1 . 1 1 66 66 ILE HA H 66 4.160 4.160 4.231 -0.071 25464
315 1 . 1 1 66 66 ILE CA C 66 61.100 61.100 60.558 0.542 25464
316 1 . 1 1 66 66 ILE CB C 66 38.500 38.500 39.292 -0.792 25464
317 1 . 1 1 66 66 ILE H H 66 8.250 8.250 8.181 0.069 25464
318 1 . 1 1 67 67 ARG N N 67 124.000 124.000 125.792 -1.791 25464
319 1 . 1 1 67 67 ARG CA C 67 53.900 53.900 57.600 -3.700 25464
320 1 . 1 1 67 67 ARG CB C 67 30.000 30.000 28.891 1.109 25464
321 1 . 1 1 67 67 ARG H H 67 8.490 8.490 8.454 0.036 25464
322 1 . 1 1 68 68 PRO HA H 68 4.440 4.440 4.427 0.013 25464
323 1 . 1 1 68 68 PRO CA C 68 63.100 63.100 63.109 -0.009 25464
324 1 . 1 1 68 68 PRO CB C 68 32.100 32.100 31.889 0.211 25464
325 1 . 1 1 69 69 LYS HA H 69 4.330 4.330 4.266 0.064 25464
326 1 . 1 1 69 69 LYS C C 69 175.900 175.900 176.143 -0.243 25464
327 1 . 1 1 69 69 LYS CA C 69 56.300 56.300 56.466 -0.166 25464
328 1 . 1 1 69 69 LYS CB C 69 33.000 33.000 32.092 0.908 25464
329 1 . 1 1 69 69 LYS H H 69 8.270 8.270 8.261 0.009 25464
330 1 . 1 1 70 70 SER N N 70 122.300 122.300 117.154 5.146 25464
331 1 . 1 1 70 70 SER HA H 70 4.580 4.580 4.467 0.113 25464
332 1 . 1 1 70 70 SER CA C 70 59.900 59.900 58.291 1.609 25464
333 1 . 1 1 70 70 SER CB C 70 65.100 65.100 63.464 1.636 25464
334 1 . 1 1 70 70 SER H H 70 8.140 8.140 8.204 -0.064 25464
335 1 . 1 1 75 75 LEU HA H 75 4.320 4.320 4.428 -0.108 25464
336 1 . 1 1 75 75 LEU CA C 75 55.400 55.400 55.102 0.298 25464
337 1 . 1 1 75 75 LEU CB C 75 42.100 42.100 43.011 -0.911 25464
338 1 . 1 1 76 76 ALA N N 76 124.000 124.000 125.483 -1.483 25464
339 1 . 1 1 76 76 ALA HA H 76 4.330 4.330 4.380 -0.050 25464
340 1 . 1 1 76 76 ALA CA C 76 52.700 52.700 51.937 0.763 25464
341 1 . 1 1 76 76 ALA CB C 76 19.000 19.000 19.179 -0.179 25464
342 1 . 1 1 76 76 ALA H H 76 8.200 8.200 8.246 -0.046 25464
343 1 . 1 1 77 77 SER N N 77 114.100 114.100 117.186 -3.086 25464
344 1 . 1 1 77 77 SER HA H 77 4.450 4.450 4.434 0.016 25464
345 1 . 1 1 77 77 SER CA C 77 58.200 58.200 58.377 -0.177 25464
346 1 . 1 1 77 77 SER CB C 77 63.900 63.900 63.433 0.467 25464
347 1 . 1 1 77 77 SER H H 77 8.210 8.210 8.465 -0.255 25464
348 1 . 1 1 78 78 GLY N N 78 110.500 110.500 111.281 -0.781 25464
349 1 . 1 1 78 78 GLY CA C 78 45.400 45.400 45.252 0.148 25464
350 1 . 1 1 78 78 GLY H H 78 8.390 8.390 8.278 0.112 25464
351 1 . 1 1 79 79 GLN N N 79 119.600 119.600 120.693 -1.093 25464
352 1 . 1 1 79 79 GLN CA C 79 55.600 55.600 55.725 -0.125 25464
353 1 . 1 1 79 79 GLN CB C 79 29.600 29.600 29.374 0.226 25464
354 1 . 1 1 79 79 GLN H H 79 8.250 8.250 8.393 -0.143 25464
stop_
save_