data_19718
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19718
_Entry.PDB_ID 2MJE
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 19718
_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 GLU HA H 2 4.240 4.240 4.076 0.164 19718
2 1 1 . 1 1 2 2 GLU C C 2 173.400 173.400 176.425 -3.025 19718
3 1 1 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.606 -3.207 19718
4 1 1 . 1 1 2 2 GLU CB C 2 27.000 27.000 29.641 -2.641 19718
5 1 1 . 1 1 3 3 GLU N N 3 121.200 121.200 118.683 2.517 19718
6 1 1 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.013 0.367 19718
7 1 1 . 1 1 3 3 GLU C C 3 173.000 173.000 175.013 -2.013 19718
8 1 1 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.859 -2.459 19718
9 1 1 . 1 1 3 3 GLU CB C 3 27.400 27.400 29.687 -2.287 19718
10 1 1 . 1 1 3 3 GLU H H 3 8.510 8.510 8.124 0.386 19718
11 1 1 . 1 1 4 4 LEU N N 4 122.400 122.400 120.264 2.136 19718
12 1 1 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.973 -0.423 19718
13 1 1 . 1 1 4 4 LEU C C 4 172.900 172.900 175.308 -2.408 19718
14 1 1 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.353 -2.953 19718
15 1 1 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.487 -4.787 19718
16 1 1 . 1 1 4 4 LEU H H 4 8.460 8.460 8.333 0.127 19718
17 1 1 . 1 1 5 5 LYS N N 5 119.300 119.300 118.636 0.664 19718
18 1 1 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.222 0.198 19718
19 1 1 . 1 1 5 5 LYS C C 5 172.400 172.400 174.240 -1.840 19718
20 1 1 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.883 -2.583 19718
21 1 1 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.799 -3.799 19718
22 1 1 . 1 1 5 5 LYS H H 5 8.570 8.570 8.155 0.415 19718
23 1 1 . 1 1 6 6 ILE N N 6 116.900 116.900 121.299 -4.399 19718
24 1 1 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.491 -0.381 19718
25 1 1 . 1 1 6 6 ILE C C 6 169.800 169.800 173.253 -3.453 19718
26 1 1 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.507 -4.007 19718
27 1 1 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.058 -3.058 19718
28 1 1 . 1 1 6 6 ILE H H 6 8.160 8.160 8.806 -0.646 19718
29 1 1 . 1 1 7 7 THR N N 7 123.000 123.000 125.465 -2.465 19718
30 1 1 . 1 1 7 7 THR HA H 7 5.220 5.220 5.125 0.095 19718
31 1 1 . 1 1 7 7 THR C C 7 169.900 169.900 173.474 -3.574 19718
32 1 1 . 1 1 7 7 THR CA C 7 58.400 58.400 61.019 -2.619 19718
33 1 1 . 1 1 7 7 THR CB C 7 68.700 68.700 69.784 -1.084 19718
34 1 1 . 1 1 7 7 THR H H 7 8.520 8.520 8.353 0.167 19718
35 1 1 . 1 1 8 8 PHE N N 8 124.000 124.000 124.815 -0.815 19718
36 1 1 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.438 -0.288 19718
37 1 1 . 1 1 8 8 PHE C C 8 172.300 172.300 175.475 -3.175 19718
38 1 1 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.127 -1.527 19718
39 1 1 . 1 1 8 8 PHE CB C 8 40.100 40.100 40.986 -0.886 19718
40 1 1 . 1 1 8 8 PHE H H 8 9.290 9.290 9.342 -0.052 19718
41 1 1 . 1 1 9 9 ILE N N 9 122.700 122.700 122.826 -0.126 19718
42 1 1 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.650 -0.070 19718
43 1 1 . 1 1 9 9 ILE C C 9 173.600 173.600 176.517 -2.917 19718
44 1 1 . 1 1 9 9 ILE CA C 9 58.200 58.200 61.289 -3.089 19718
45 1 1 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.795 -3.295 19718
46 1 1 . 1 1 9 9 ILE H H 9 9.170 9.170 8.706 0.464 19718
47 1 1 . 1 1 10 10 LEU N N 10 126.700 126.700 127.671 -0.971 19718
48 1 1 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.310 0.010 19718
49 1 1 . 1 1 10 10 LEU C C 10 176.500 176.500 178.634 -2.134 19718
50 1 1 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.450 -3.250 19718
51 1 1 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.184 -4.684 19718
52 1 1 . 1 1 10 10 LEU H H 10 9.100 9.100 9.032 0.068 19718
53 1 1 . 1 1 11 11 LYS N N 11 118.900 118.900 120.217 -1.317 19718
54 1 1 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.109 -0.148 19718
55 1 1 . 1 1 11 11 LYS C C 11 174.100 174.100 177.110 -3.010 19718
56 1 1 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.342 -0.942 19718
57 1 1 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.063 -3.163 19718
58 1 1 . 1 1 11 11 LYS H H 11 8.520 8.520 8.764 -0.244 19718
59 1 1 . 1 1 12 12 ASP N N 12 114.400 114.400 118.009 -3.609 19718
60 1 1 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.690 -0.170 19718
61 1 1 . 1 1 12 12 ASP C C 12 174.500 174.500 177.041 -2.541 19718
62 1 1 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.009 -2.609 19718
63 1 1 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.490 -3.290 19718
64 1 1 . 1 1 12 12 ASP H H 12 7.690 7.690 7.948 -0.258 19718
65 1 1 . 1 1 13 13 GLY N N 13 109.200 109.200 107.900 1.300 19718
66 1 1 . 1 1 13 13 GLY C C 13 171.600 171.600 174.589 -2.989 19718
67 1 1 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.462 -3.062 19718
68 1 1 . 1 1 13 13 GLY H H 13 8.100 8.100 7.770 0.330 19718
69 1 1 . 1 1 14 14 SER N N 14 118.000 118.000 115.887 2.113 19718
70 1 1 . 1 1 14 14 SER HA H 14 4.280 4.280 4.388 -0.108 19718
71 1 1 . 1 1 14 14 SER C C 14 169.000 169.000 173.694 -4.694 19718
72 1 1 . 1 1 14 14 SER CA C 14 56.500 56.500 58.599 -2.099 19718
73 1 1 . 1 1 14 14 SER CB C 14 61.000 61.000 63.742 -2.742 19718
74 1 1 . 1 1 14 14 SER H H 14 8.110 8.110 7.851 0.259 19718
75 1 1 . 1 1 15 15 GLN N N 15 116.300 116.300 120.647 -4.347 19718
76 1 1 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.205 0.455 19718
77 1 1 . 1 1 15 15 GLN C C 15 173.500 173.500 175.940 -2.440 19718
78 1 1 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.987 -3.287 19718
79 1 1 . 1 1 15 15 GLN CB C 15 29.000 29.000 30.927 -1.927 19718
80 1 1 . 1 1 15 15 GLN H H 15 8.330 8.330 8.553 -0.223 19718
81 1 1 . 1 1 16 16 LYS N N 16 122.500 122.500 126.267 -3.767 19718
82 1 1 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.726 -0.396 19718
83 1 1 . 1 1 16 16 LYS C C 16 171.300 171.300 174.684 -3.384 19718
84 1 1 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.058 -3.158 19718
85 1 1 . 1 1 16 16 LYS CB C 16 34.000 34.000 36.070 -2.070 19718
86 1 1 . 1 1 16 16 LYS H H 16 8.780 8.780 8.903 -0.123 19718
87 1 1 . 1 1 17 17 THR N N 17 120.000 120.000 120.648 -0.648 19718
88 1 1 . 1 1 17 17 THR HA H 17 5.220 5.220 4.926 0.294 19718
89 1 1 . 1 1 17 17 THR C C 17 170.500 170.500 173.492 -2.992 19718
90 1 1 . 1 1 17 17 THR CA C 17 58.700 58.700 62.075 -3.375 19718
91 1 1 . 1 1 17 17 THR CB C 17 67.900 67.900 69.700 -1.800 19718
92 1 1 . 1 1 17 17 THR H H 17 8.160 8.160 8.647 -0.487 19718
93 1 1 . 1 1 18 18 TYR N N 18 125.600 125.600 126.238 -0.638 19718
94 1 1 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.747 0.093 19718
95 1 1 . 1 1 18 18 TYR CA C 18 53.000 53.000 55.018 -2.018 19718
96 1 1 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.569 -2.469 19718
97 1 1 . 1 1 18 18 TYR H H 18 9.020 9.020 9.197 -0.177 19718
98 1 1 . 1 1 19 19 GLU C C 19 174.200 174.200 175.912 -1.712 19718
99 1 1 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.559 -3.659 19718
100 1 1 . 1 1 19 19 GLU CB C 19 27.300 27.300 29.769 -2.469 19718
101 1 1 . 1 1 20 20 VAL N N 20 119.000 119.000 119.833 -0.833 19718
102 1 1 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.591 0.249 19718
103 1 1 . 1 1 20 20 VAL C C 20 171.200 171.200 174.659 -3.459 19718
104 1 1 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.679 -3.079 19718
105 1 1 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.702 -3.002 19718
106 1 1 . 1 1 20 20 VAL H H 20 9.160 9.160 7.948 1.212 19718
107 1 1 . 1 1 21 21 CYS N N 21 117.500 117.500 119.760 -2.260 19718
108 1 1 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.661 0.099 19718
109 1 1 . 1 1 21 21 CYS C C 21 171.400 171.400 174.886 -3.486 19718
110 1 1 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.400 -2.500 19718
111 1 1 . 1 1 21 21 CYS CB C 21 27.200 27.200 29.419 -2.219 19718
112 1 1 . 1 1 21 21 CYS H H 21 8.720 8.720 8.713 0.007 19718
113 1 1 . 1 1 22 22 GLU N N 22 120.900 120.900 122.818 -1.918 19718
114 1 1 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.995 -0.585 19718
115 1 1 . 1 1 22 22 GLU C C 22 174.300 174.300 177.115 -2.815 19718
116 1 1 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.180 -3.080 19718
117 1 1 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.722 -2.922 19718
118 1 1 . 1 1 22 22 GLU H H 22 8.540 8.540 8.703 -0.163 19718
119 1 1 . 1 1 23 23 GLY N N 23 112.400 112.400 114.746 -2.346 19718
120 1 1 . 1 1 23 23 GLY C C 23 171.000 171.000 174.446 -3.446 19718
121 1 1 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.087 -2.687 19718
122 1 1 . 1 1 23 23 GLY H H 23 8.720 8.720 8.947 -0.227 19718
123 1 1 . 1 1 24 24 GLU N N 24 119.600 119.600 121.597 -1.997 19718
124 1 1 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.438 -0.108 19718
125 1 1 . 1 1 24 24 GLU C C 24 174.400 174.400 176.180 -1.780 19718
126 1 1 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.660 -2.559 19718
127 1 1 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.302 -2.202 19718
128 1 1 . 1 1 24 24 GLU H H 24 7.060 7.060 7.723 -0.663 19718
129 1 1 . 1 1 25 25 THR N N 25 113.600 113.600 115.867 -2.267 19718
130 1 1 . 1 1 25 25 THR HA H 25 5.510 5.510 4.846 0.664 19718
131 1 1 . 1 1 25 25 THR C C 25 173.100 173.100 175.304 -2.204 19718
132 1 1 . 1 1 25 25 THR CA C 25 57.000 57.000 61.100 -4.100 19718
133 1 1 . 1 1 25 25 THR CB C 25 68.700 68.700 71.061 -2.361 19718
134 1 1 . 1 1 25 25 THR H H 25 9.080 9.080 8.458 0.622 19718
135 1 1 . 1 1 26 26 ILE N N 26 120.300 120.300 122.589 -2.289 19718
136 1 1 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.956 -0.326 19718
137 1 1 . 1 1 26 26 ILE C C 26 174.700 174.700 177.724 -3.024 19718
138 1 1 . 1 1 26 26 ILE CA C 26 63.700 63.700 65.520 -1.821 19718
139 1 1 . 1 1 26 26 ILE CB C 26 33.000 33.000 38.195 -5.195 19718
140 1 1 . 1 1 26 26 ILE H H 26 7.860 7.860 8.255 -0.395 19718
141 1 1 . 1 1 27 27 LEU N N 27 117.600 117.600 120.768 -3.168 19718
142 1 1 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.025 -0.275 19718
143 1 1 . 1 1 27 27 LEU C C 27 174.000 174.000 178.507 -4.507 19718
144 1 1 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.613 -2.713 19718
145 1 1 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.842 -1.542 19718
146 1 1 . 1 1 27 27 LEU H H 27 6.580 6.580 8.094 -1.514 19718
147 1 1 . 1 1 28 28 ASP N N 28 120.000 120.000 120.476 -0.476 19718
148 1 1 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.373 -0.123 19718
149 1 1 . 1 1 28 28 ASP C C 28 177.900 177.900 178.619 -0.719 19718
150 1 1 . 1 1 28 28 ASP CA C 28 55.000 55.000 58.586 -3.586 19718
151 1 1 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.653 -3.752 19718
152 1 1 . 1 1 28 28 ASP H H 28 7.880 7.880 8.044 -0.164 19718
153 1 1 . 1 1 29 29 ILE N N 29 122.100 122.100 119.622 2.478 19718
154 1 1 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.865 -0.125 19718
155 1 1 . 1 1 29 29 ILE C C 29 175.700 175.700 177.923 -2.223 19718
156 1 1 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.210 -3.110 19718
157 1 1 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.046 -1.546 19718
158 1 1 . 1 1 29 29 ILE H H 29 8.340 8.340 8.145 0.195 19718
159 1 1 . 1 1 30 30 ALA N N 30 124.100 124.100 123.148 0.952 19718
160 1 1 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.603 -0.263 19718
161 1 1 . 1 1 30 30 ALA C C 30 177.600 177.600 179.611 -2.011 19718
162 1 1 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.522 -2.722 19718
163 1 1 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.089 -1.289 19718
164 1 1 . 1 1 30 30 ALA H H 30 8.430 8.430 8.362 0.068 19718
165 1 1 . 1 1 31 31 GLN N N 31 116.000 116.000 115.795 0.205 19718
166 1 1 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.282 -0.122 19718
167 1 1 . 1 1 31 31 GLN C C 31 178.100 178.100 179.086 -0.986 19718
168 1 1 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.833 -1.133 19718
169 1 1 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.003 -3.803 19718
170 1 1 . 1 1 31 31 GLN H H 31 8.760 8.760 8.505 0.255 19718
171 1 1 . 1 1 32 32 GLY N N 32 108.700 108.700 108.363 0.337 19718
172 1 1 . 1 1 32 32 GLY C C 32 171.700 171.700 175.203 -3.503 19718
173 1 1 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.620 -3.420 19718
174 1 1 . 1 1 32 32 GLY H H 32 8.220 8.220 7.903 0.317 19718
175 1 1 . 1 1 33 33 HIS N N 33 115.000 115.000 119.320 -4.320 19718
176 1 1 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.674 -0.244 19718
177 1 1 . 1 1 33 33 HIS C C 33 169.800 169.800 174.520 -4.720 19718
178 1 1 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.684 -3.284 19718
179 1 1 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.862 -5.362 19718
180 1 1 . 1 1 33 33 HIS H H 33 6.980 6.980 7.971 -0.991 19718
181 1 1 . 1 1 34 34 ASN N N 34 113.700 113.700 117.729 -4.029 19718
182 1 1 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.388 -0.058 19718
183 1 1 . 1 1 34 34 ASN C C 34 172.000 172.000 175.333 -3.333 19718
184 1 1 . 1 1 34 34 ASN CA C 34 52.100 52.100 54.135 -2.035 19718
185 1 1 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.878 -2.878 19718
186 1 1 . 1 1 34 34 ASN H H 34 7.700 7.700 7.548 0.152 19718
187 1 1 . 1 1 35 35 LEU N N 35 115.600 115.600 119.095 -3.495 19718
188 1 1 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.161 0.089 19718
189 1 1 . 1 1 35 35 LEU C C 35 174.900 174.900 177.059 -2.159 19718
190 1 1 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.577 -4.277 19718
191 1 1 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.468 -3.268 19718
192 1 1 . 1 1 35 35 LEU H H 35 7.980 7.980 7.871 0.109 19718
193 1 1 . 1 1 36 36 ASP N N 36 120.100 120.100 121.883 -1.783 19718
194 1 1 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.578 -0.148 19718
195 1 1 . 1 1 36 36 ASP C C 36 171.100 171.100 174.858 -3.758 19718
196 1 1 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.836 -3.836 19718
197 1 1 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.847 -3.647 19718
198 1 1 . 1 1 36 36 ASP H H 36 8.610 8.610 8.512 0.098 19718
199 1 1 . 1 1 37 37 MET N N 37 123.900 123.900 120.374 3.526 19718
200 1 1 . 1 1 37 37 MET HA H 37 4.280 4.280 4.913 -0.633 19718
201 1 1 . 1 1 37 37 MET C C 37 171.200 171.200 173.977 -2.777 19718
202 1 1 . 1 1 37 37 MET CA C 37 52.800 52.800 54.869 -2.069 19718
203 1 1 . 1 1 37 37 MET CB C 37 33.000 33.000 35.733 -2.733 19718
204 1 1 . 1 1 37 37 MET H H 37 7.670 7.670 7.591 0.079 19718
205 1 1 . 1 1 38 38 GLU N N 38 128.600 128.600 119.231 9.369 19718
206 1 1 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.645 -0.355 19718
207 1 1 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.809 -2.608 19718
208 1 1 . 1 1 38 38 GLU CB C 38 29.400 29.400 31.329 -1.929 19718
209 1 1 . 1 1 38 38 GLU H H 38 9.060 9.060 8.665 0.395 19718
210 1 1 . 1 1 51 51 HIS C C 51 170.700 170.700 174.254 -3.554 19718
211 1 1 . 1 1 51 51 HIS CA C 51 52.800 52.800 54.129 -1.329 19718
212 1 1 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.531 -0.831 19718
213 1 1 . 1 1 53 53 ILE N N 53 122.200 122.200 120.661 1.539 19718
214 1 1 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.876 -0.866 19718
215 1 1 . 1 1 53 53 ILE C C 53 174.400 174.400 173.378 1.022 19718
216 1 1 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.799 -0.099 19718
217 1 1 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.308 -6.008 19718
218 1 1 . 1 1 53 53 ILE H H 53 8.800 8.800 8.186 0.614 19718
219 1 1 . 1 1 54 54 VAL N N 54 130.200 130.200 126.256 3.944 19718
220 1 1 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.715 -0.845 19718
221 1 1 . 1 1 54 54 VAL C C 54 172.500 172.500 174.718 -2.218 19718
222 1 1 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.648 1.252 19718
223 1 1 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.153 -5.553 19718
224 1 1 . 1 1 54 54 VAL H H 54 8.380 8.380 8.905 -0.525 19718
225 1 1 . 1 1 55 55 ASP N N 55 129.100 129.100 127.247 1.853 19718
226 1 1 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.699 -0.109 19718
227 1 1 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.489 -2.789 19718
228 1 1 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.955 -1.455 19718
229 1 1 . 1 1 55 55 ASP H H 55 8.160 8.160 8.173 -0.013 19718
230 1 1 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.280 -0.110 19718
231 1 1 . 1 1 56 56 PRO C C 56 174.900 174.900 177.554 -2.654 19718
232 1 1 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.917 -1.917 19718
233 1 1 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.786 -2.386 19718
234 1 1 . 1 1 57 57 ASP N N 57 117.100 117.100 118.022 -0.922 19718
235 1 1 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.373 -0.003 19718
236 1 1 . 1 1 57 57 ASP C C 57 174.100 174.100 178.039 -3.939 19718
237 1 1 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.994 -3.294 19718
238 1 1 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.951 -4.151 19718
239 1 1 . 1 1 57 57 ASP H H 57 9.110 9.110 8.864 0.246 19718
240 1 1 . 1 1 58 58 TYR N N 58 115.800 115.800 117.176 -1.376 19718
241 1 1 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.509 -0.149 19718
242 1 1 . 1 1 58 58 TYR C C 58 173.200 173.200 177.559 -4.359 19718
243 1 1 . 1 1 58 58 TYR CA C 58 56.700 56.700 58.971 -2.271 19718
244 1 1 . 1 1 58 58 TYR CB C 58 38.900 38.900 38.792 0.108 19718
245 1 1 . 1 1 58 58 TYR H H 58 8.190 8.190 7.819 0.371 19718
246 1 1 . 1 1 59 59 TYR N N 59 120.100 120.100 120.914 -0.814 19718
247 1 1 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.246 -0.466 19718
248 1 1 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.856 0.244 19718
249 1 1 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.668 -2.268 19718
250 1 1 . 1 1 59 59 TYR H H 59 7.420 7.420 8.308 -0.888 19718
251 1 1 . 1 1 60 60 ASP N N 60 115.200 115.200 119.018 -3.818 19718
252 1 1 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.467 -0.107 19718
253 1 1 . 1 1 60 60 ASP C C 60 173.100 173.100 176.271 -3.171 19718
254 1 1 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.894 -2.494 19718
255 1 1 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.419 -2.919 19718
256 1 1 . 1 1 60 60 ASP H H 60 8.440 8.440 8.160 0.280 19718
257 1 1 . 1 1 61 61 ALA N N 61 120.200 120.200 120.593 -0.393 19718
258 1 1 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.402 -0.222 19718
259 1 1 . 1 1 61 61 ALA C C 61 175.000 175.000 177.138 -2.138 19718
260 1 1 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.241 -2.941 19718
261 1 1 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.810 -3.610 19718
262 1 1 . 1 1 61 61 ALA H H 61 7.300 7.300 7.864 -0.564 19718
263 1 1 . 1 1 62 62 LEU N N 62 118.000 118.000 121.964 -3.964 19718
264 1 1 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.659 -0.369 19718
265 1 1 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.806 -2.706 19718
266 1 1 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.932 -3.232 19718
267 1 1 . 1 1 62 62 LEU H H 62 6.680 6.680 7.626 -0.946 19718
268 1 1 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.495 -0.175 19718
269 1 1 . 1 1 63 63 PRO C C 63 173.500 173.500 175.651 -2.151 19718
270 1 1 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.140 -2.440 19718
271 1 1 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.513 -4.013 19718
272 1 1 . 1 1 64 64 GLU N N 64 124.500 124.500 119.010 5.490 19718
273 1 1 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.596 -0.416 19718
274 1 1 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.108 -1.608 19718
275 1 1 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.465 -4.665 19718
276 1 1 . 1 1 64 64 GLU H H 64 8.590 8.590 8.365 0.225 19718
277 1 1 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.514 -0.344 19718
278 1 1 . 1 1 65 65 PRO C C 65 174.900 174.900 176.450 -1.550 19718
279 1 1 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.198 0.802 19718
280 1 1 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.897 -4.397 19718
281 1 1 . 1 1 66 66 GLU N N 66 123.300 123.300 119.516 3.784 19718
282 1 1 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.115 0.215 19718
283 1 1 . 1 1 66 66 GLU C C 66 174.200 174.200 177.396 -3.196 19718
284 1 1 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.657 -4.157 19718
285 1 1 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.565 -3.165 19718
286 1 1 . 1 1 66 66 GLU H H 66 9.080 9.080 8.586 0.494 19718
287 1 1 . 1 1 67 67 ASP N N 67 120.100 120.100 122.005 -1.905 19718
288 1 1 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.571 -0.331 19718
289 1 1 . 1 1 67 67 ASP C C 67 174.900 174.900 177.034 -2.134 19718
290 1 1 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.564 -1.164 19718
291 1 1 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.804 -3.004 19718
292 1 1 . 1 1 67 67 ASP H H 67 8.690 8.690 8.598 0.092 19718
293 1 1 . 1 1 68 68 ASP N N 68 116.800 116.800 115.924 0.876 19718
294 1 1 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.535 -0.295 19718
295 1 1 . 1 1 68 68 ASP C C 68 175.500 175.500 177.425 -1.925 19718
296 1 1 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.825 -1.525 19718
297 1 1 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.044 -4.944 19718
298 1 1 . 1 1 68 68 ASP H H 68 8.400 8.400 8.335 0.065 19718
299 1 1 . 1 1 69 69 GLU N N 69 123.600 123.600 119.692 3.908 19718
300 1 1 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.100 0.050 19718
301 1 1 . 1 1 69 69 GLU C C 69 175.200 175.200 178.538 -3.338 19718
302 1 1 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.952 -2.752 19718
303 1 1 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.112 -4.112 19718
304 1 1 . 1 1 69 69 GLU H H 69 7.530 7.530 7.862 -0.332 19718
305 1 1 . 1 1 70 70 ASN N N 70 119.100 119.100 118.044 1.056 19718
306 1 1 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.472 -0.112 19718
307 1 1 . 1 1 70 70 ASN C C 70 175.200 175.200 176.923 -1.723 19718
308 1 1 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.358 -1.658 19718
309 1 1 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.658 -2.858 19718
310 1 1 . 1 1 70 70 ASN H H 70 7.960 7.960 8.635 -0.675 19718
311 1 1 . 1 1 71 71 ASP N N 71 118.400 118.400 120.100 -1.700 19718
312 1 1 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.434 -0.184 19718
313 1 1 . 1 1 71 71 ASP C C 71 176.000 176.000 177.635 -1.635 19718
314 1 1 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.825 -2.224 19718
315 1 1 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.754 -3.254 19718
316 1 1 . 1 1 71 71 ASP H H 71 8.250 8.250 8.332 -0.082 19718
317 1 1 . 1 1 72 72 MET N N 72 117.300 117.300 115.825 1.475 19718
318 1 1 . 1 1 72 72 MET HA H 72 4.370 4.370 4.267 0.103 19718
319 1 1 . 1 1 72 72 MET C C 72 177.800 177.800 177.307 0.493 19718
320 1 1 . 1 1 72 72 MET CA C 72 53.700 53.700 56.723 -3.023 19718
321 1 1 . 1 1 72 72 MET CB C 72 32.400 32.400 31.921 0.479 19718
322 1 1 . 1 1 72 72 MET H H 72 7.240 7.240 7.721 -0.481 19718
323 1 1 . 1 1 73 73 LEU N N 73 123.000 123.000 118.377 4.623 19718
324 1 1 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.224 -0.464 19718
325 1 1 . 1 1 73 73 LEU C C 73 175.700 175.700 179.170 -3.470 19718
326 1 1 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.052 -2.152 19718
327 1 1 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.756 -3.656 19718
328 1 1 . 1 1 73 73 LEU H H 73 8.600 8.600 7.143 1.457 19718
329 1 1 . 1 1 74 74 ASP N N 74 118.500 118.500 119.273 -0.773 19718
330 1 1 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.321 0.019 19718
331 1 1 . 1 1 74 74 ASP C C 74 174.700 174.700 177.836 -3.136 19718
332 1 1 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.894 -2.594 19718
333 1 1 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.835 -2.635 19718
334 1 1 . 1 1 74 74 ASP H H 74 7.250 7.250 7.676 -0.426 19718
335 1 1 . 1 1 75 75 LEU N N 75 116.300 116.300 116.835 -0.535 19718
336 1 1 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.161 0.139 19718
337 1 1 . 1 1 75 75 LEU C C 75 174.500 174.500 176.699 -2.199 19718
338 1 1 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.946 -4.646 19718
339 1 1 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.522 -1.922 19718
340 1 1 . 1 1 75 75 LEU H H 75 7.000 7.000 7.362 -0.362 19718
341 1 1 . 1 1 76 76 ALA N N 76 124.600 124.600 119.521 5.079 19718
342 1 1 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.518 -0.418 19718
343 1 1 . 1 1 76 76 ALA C C 76 174.200 174.200 175.901 -1.701 19718
344 1 1 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.213 -0.713 19718
345 1 1 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.835 -5.635 19718
346 1 1 . 1 1 76 76 ALA H H 76 7.590 7.590 7.595 -0.005 19718
347 1 1 . 1 1 77 77 TYR N N 77 122.900 122.900 125.848 -2.948 19718
348 1 1 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.223 0.207 19718
349 1 1 . 1 1 77 77 TYR C C 77 174.100 174.100 176.824 -2.724 19718
350 1 1 . 1 1 77 77 TYR CA C 77 54.900 54.900 60.105 -5.205 19718
351 1 1 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.335 -3.435 19718
352 1 1 . 1 1 77 77 TYR H H 77 8.150 8.150 8.387 -0.237 19718
353 1 1 . 1 1 78 78 GLY N N 78 112.900 112.900 114.985 -2.085 19718
354 1 1 . 1 1 78 78 GLY C C 78 171.800 171.800 173.557 -1.757 19718
355 1 1 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.527 -0.827 19718
356 1 1 . 1 1 78 78 GLY H H 78 8.320 8.320 8.092 0.228 19718
357 1 1 . 1 1 79 79 LEU N N 79 119.300 119.300 118.354 0.946 19718
358 1 1 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.262 -0.472 19718
359 1 1 . 1 1 79 79 LEU C C 79 174.000 174.000 176.396 -2.396 19718
360 1 1 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.604 -1.604 19718
361 1 1 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.648 -2.748 19718
362 1 1 . 1 1 79 79 LEU H H 79 7.120 7.120 7.960 -0.840 19718
363 1 1 . 1 1 80 80 THR N N 80 118.500 118.500 119.861 -1.361 19718
364 1 1 . 1 1 80 80 THR HA H 80 4.860 4.860 4.437 0.423 19718
365 1 1 . 1 1 80 80 THR C C 80 173.300 173.300 174.523 -1.223 19718
366 1 1 . 1 1 80 80 THR CA C 80 57.600 57.600 60.617 -3.017 19718
367 1 1 . 1 1 80 80 THR CB C 80 71.000 71.000 70.868 0.132 19718
368 1 1 . 1 1 80 80 THR H H 80 9.240 9.240 7.712 1.528 19718
369 1 1 . 1 1 81 81 GLU N N 81 118.000 118.000 121.137 -3.137 19718
370 1 1 . 1 1 81 81 GLU HA H 81 4.110 4.110 3.924 0.186 19718
371 1 1 . 1 1 81 81 GLU C C 81 173.900 173.900 175.876 -1.976 19718
372 1 1 . 1 1 81 81 GLU CA C 81 55.400 55.400 59.166 -3.766 19718
373 1 1 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.594 -2.894 19718
374 1 1 . 1 1 81 81 GLU H H 81 9.020 9.020 8.802 0.218 19718
375 1 1 . 1 1 82 82 THR N N 82 106.400 106.400 105.872 0.528 19718
376 1 1 . 1 1 82 82 THR HA H 82 3.950 3.950 2.902 1.048 19718
377 1 1 . 1 1 82 82 THR C C 82 171.700 171.700 173.975 -2.275 19718
378 1 1 . 1 1 82 82 THR CA C 82 56.800 56.800 58.523 -1.724 19718
379 1 1 . 1 1 82 82 THR CB C 82 63.800 63.800 68.023 -4.223 19718
380 1 1 . 1 1 82 82 THR H H 82 7.630 7.630 7.266 0.364 19718
381 1 1 . 1 1 83 83 SER N N 83 121.500 121.500 119.110 2.390 19718
382 1 1 . 1 1 83 83 SER HA H 83 5.080 5.080 4.404 0.676 19718
383 1 1 . 1 1 83 83 SER C C 83 170.900 170.900 174.421 -3.521 19718
384 1 1 . 1 1 83 83 SER CA C 83 59.000 59.000 59.889 -0.889 19718
385 1 1 . 1 1 83 83 SER CB C 83 61.700 61.700 63.707 -2.007 19718
386 1 1 . 1 1 83 83 SER H H 83 6.930 6.930 7.843 -0.913 19718
387 1 1 . 1 1 84 84 ARG N N 84 119.300 119.300 122.477 -3.177 19718
388 1 1 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.811 0.059 19718
389 1 1 . 1 1 84 84 ARG C C 84 172.400 172.400 174.099 -1.699 19718
390 1 1 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.477 -4.177 19718
391 1 1 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.681 -2.281 19718
392 1 1 . 1 1 84 84 ARG H H 84 9.280 9.280 8.933 0.347 19718
393 1 1 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.493 -0.063 19718
394 1 1 . 1 1 88 88 GLN C C 88 172.500 172.500 175.437 -2.937 19718
395 1 1 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.605 -4.606 19718
396 1 1 . 1 1 88 88 GLN CB C 88 27.000 27.000 31.335 -4.335 19718
397 1 1 . 1 1 90 90 LYS N N 90 123.700 123.700 123.693 0.007 19718
398 1 1 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.926 -0.476 19718
399 1 1 . 1 1 90 90 LYS C C 90 173.500 173.500 175.729 -2.229 19718
400 1 1 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.865 -2.365 19718
401 1 1 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.785 -2.885 19718
402 1 1 . 1 1 90 90 LYS H H 90 8.330 8.330 8.233 0.097 19718
403 1 1 . 1 1 91 91 MET N N 91 118.200 118.200 120.200 -2.000 19718
404 1 1 . 1 1 91 91 MET HA H 91 4.330 4.330 4.589 -0.259 19718
405 1 1 . 1 1 91 91 MET C C 91 174.300 174.300 175.916 -1.616 19718
406 1 1 . 1 1 91 91 MET CA C 91 51.800 51.800 55.175 -3.376 19718
407 1 1 . 1 1 91 91 MET CB C 91 27.200 27.200 31.377 -4.177 19718
408 1 1 . 1 1 91 91 MET H H 91 8.620 8.620 8.549 0.071 19718
409 1 1 . 1 1 92 92 SER N N 92 117.000 117.000 117.996 -0.996 19718
410 1 1 . 1 1 92 92 SER HA H 92 4.610 4.610 4.918 -0.308 19718
411 1 1 . 1 1 92 92 SER C C 92 171.300 171.300 175.488 -4.188 19718
412 1 1 . 1 1 92 92 SER CA C 92 54.000 54.000 56.804 -2.804 19718
413 1 1 . 1 1 92 92 SER CB C 92 63.700 63.700 66.554 -2.854 19718
414 1 1 . 1 1 92 92 SER H H 92 6.970 6.970 8.141 -1.171 19718
415 1 1 . 1 1 93 93 LYS N N 93 121.700 121.700 120.446 1.254 19718
416 1 1 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.076 -0.106 19718
417 1 1 . 1 1 93 93 LYS C C 93 175.200 175.200 177.869 -2.669 19718
418 1 1 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.320 -2.620 19718
419 1 1 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.116 -3.016 19718
420 1 1 . 1 1 93 93 LYS H H 93 9.260 9.260 8.830 0.430 19718
421 1 1 . 1 1 94 94 ASP N N 94 116.700 116.700 118.762 -2.062 19718
422 1 1 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.633 -0.273 19718
423 1 1 . 1 1 94 94 ASP C C 94 174.300 174.300 177.568 -3.268 19718
424 1 1 . 1 1 94 94 ASP CA C 94 53.700 53.700 54.750 -1.050 19718
425 1 1 . 1 1 94 94 ASP CB C 94 37.900 37.900 40.903 -3.003 19718
426 1 1 . 1 1 94 94 ASP H H 94 8.020 8.020 7.787 0.233 19718
427 1 1 . 1 1 95 95 ILE N N 95 109.000 109.000 112.929 -3.929 19718
428 1 1 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.422 0.238 19718
429 1 1 . 1 1 95 95 ILE C C 95 170.600 170.600 175.524 -4.924 19718
430 1 1 . 1 1 95 95 ILE CA C 95 57.300 57.300 61.013 -3.713 19718
431 1 1 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.519 -3.319 19718
432 1 1 . 1 1 95 95 ILE H H 95 7.240 7.240 7.640 -0.400 19718
433 1 1 . 1 1 96 96 ASP N N 96 119.800 119.800 122.378 -2.578 19718
434 1 1 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.486 -0.306 19718
435 1 1 . 1 1 96 96 ASP C C 96 174.900 174.900 176.619 -1.719 19718
436 1 1 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.547 -0.848 19718
437 1 1 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.493 -0.493 19718
438 1 1 . 1 1 96 96 ASP H H 96 6.950 6.950 7.793 -0.843 19718
439 1 1 . 1 1 97 97 GLY N N 97 118.500 118.500 113.415 5.085 19718
440 1 1 . 1 1 97 97 GLY C C 97 170.500 170.500 174.100 -3.600 19718
441 1 1 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.309 -2.009 19718
442 1 1 . 1 1 97 97 GLY H H 97 9.210 9.210 8.349 0.861 19718
443 1 1 . 1 1 98 98 ILE N N 98 121.300 121.300 121.155 0.145 19718
444 1 1 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.349 2.251 19718
445 1 1 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.734 -3.134 19718
446 1 1 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.632 -3.932 19718
447 1 1 . 1 1 98 98 ILE H H 98 7.660 7.660 7.869 -0.209 19718
448 1 1 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.223 0.127 19718
449 1 1 . 1 1 99 99 ARG C C 99 172.200 172.200 175.150 -2.950 19718
450 1 1 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.361 -4.261 19718
451 1 1 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.410 -2.909 19718
452 1 1 . 1 1 100 100 VAL N N 100 114.900 114.900 116.566 -1.666 19718
453 1 1 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.047 -0.227 19718
454 1 1 . 1 1 100 100 VAL C C 100 169.600 169.600 173.553 -3.953 19718
455 1 1 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.491 -4.291 19718
456 1 1 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.062 -3.762 19718
457 1 1 . 1 1 100 100 VAL H H 100 8.440 8.440 8.899 -0.459 19718
458 1 1 . 1 1 101 101 ALA N N 101 123.400 123.400 122.374 1.026 19718
459 1 1 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.723 0.587 19718
460 1 1 . 1 1 101 101 ALA C C 101 174.400 174.400 175.429 -1.029 19718
461 1 1 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.200 -3.400 19718
462 1 1 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.214 -2.414 19718
463 1 1 . 1 1 101 101 ALA H H 101 9.040 9.040 8.913 0.127 19718
464 1 1 . 1 1 102 102 LEU N N 102 120.600 120.600 125.070 -4.470 19718
465 1 1 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.074 -0.504 19718
466 1 1 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.511 0.689 19718
467 1 1 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.416 -6.516 19718
468 1 1 . 1 1 102 102 LEU H H 102 8.260 8.260 8.371 -0.111 19718
469 1 1 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.842 -0.262 19718
470 1 1 . 1 1 112 112 ASN C C 112 171.900 171.900 174.169 -2.269 19718
471 1 1 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.693 -3.293 19718
472 1 1 . 1 1 112 112 ASN CB C 112 36.700 36.700 40.501 -3.801 19718
473 1 1 . 1 1 113 113 ASP N N 113 120.300 120.300 118.488 1.812 19718
474 1 1 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.727 -0.287 19718
475 1 1 . 1 1 113 113 ASP C C 113 173.000 173.000 175.195 -2.195 19718
476 1 1 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.694 -2.094 19718
477 1 1 . 1 1 113 113 ASP CB C 113 38.100 38.100 42.779 -4.679 19718
478 1 1 . 1 1 113 113 ASP H H 113 8.040 8.040 7.785 0.255 19718
479 1 1 . 1 1 114 114 PHE N N 114 120.100 120.100 115.106 4.994 19718
480 1 1 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.751 -0.141 19718
481 1 1 . 1 1 114 114 PHE C C 114 172.200 172.200 173.948 -1.748 19718
482 1 1 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.085 -3.185 19718
483 1 1 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.319 -2.819 19718
484 1 1 . 1 1 114 114 PHE H H 114 8.110 8.110 7.870 0.240 19718
485 1 2 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.584 -0.344 19718
486 1 2 . 1 1 2 2 GLU C C 2 173.400 173.400 174.864 -1.464 19718
487 1 2 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.145 -2.745 19718
488 1 2 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.730 -3.730 19718
489 1 2 . 1 1 3 3 GLU N N 3 121.200 121.200 124.732 -3.532 19718
490 1 2 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.730 -0.350 19718
491 1 2 . 1 1 3 3 GLU C C 3 173.000 173.000 175.589 -2.589 19718
492 1 2 . 1 1 3 3 GLU CA C 3 54.400 54.400 55.937 -1.537 19718
493 1 2 . 1 1 3 3 GLU CB C 3 27.400 27.400 31.345 -3.945 19718
494 1 2 . 1 1 3 3 GLU H H 3 8.510 8.510 8.481 0.029 19718
495 1 2 . 1 1 4 4 LEU N N 4 122.400 122.400 125.429 -3.029 19718
496 1 2 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.779 -0.229 19718
497 1 2 . 1 1 4 4 LEU C C 4 172.900 172.900 175.069 -2.169 19718
498 1 2 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.750 -3.350 19718
499 1 2 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.615 -3.916 19718
500 1 2 . 1 1 4 4 LEU H H 4 8.460 8.460 8.334 0.126 19718
501 1 2 . 1 1 5 5 LYS N N 5 119.300 119.300 121.038 -1.738 19718
502 1 2 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.376 0.044 19718
503 1 2 . 1 1 5 5 LYS C C 5 172.400 172.400 174.690 -2.290 19718
504 1 2 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.560 -2.260 19718
505 1 2 . 1 1 5 5 LYS CB C 5 33.000 33.000 35.662 -2.662 19718
506 1 2 . 1 1 5 5 LYS H H 5 8.570 8.570 8.335 0.235 19718
507 1 2 . 1 1 6 6 ILE N N 6 116.900 116.900 123.135 -6.235 19718
508 1 2 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.506 -0.396 19718
509 1 2 . 1 1 6 6 ILE C C 6 169.800 169.800 173.485 -3.685 19718
510 1 2 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.424 -3.924 19718
511 1 2 . 1 1 6 6 ILE CB C 6 38.000 38.000 40.793 -2.793 19718
512 1 2 . 1 1 6 6 ILE H H 6 8.160 8.160 8.923 -0.763 19718
513 1 2 . 1 1 7 7 THR N N 7 123.000 123.000 125.710 -2.710 19718
514 1 2 . 1 1 7 7 THR HA H 7 5.220 5.220 5.089 0.131 19718
515 1 2 . 1 1 7 7 THR C C 7 169.900 169.900 173.558 -3.658 19718
516 1 2 . 1 1 7 7 THR CA C 7 58.400 58.400 61.259 -2.859 19718
517 1 2 . 1 1 7 7 THR CB C 7 68.700 68.700 69.686 -0.986 19718
518 1 2 . 1 1 7 7 THR H H 7 8.520 8.520 8.588 -0.068 19718
519 1 2 . 1 1 8 8 PHE N N 8 124.000 124.000 124.634 -0.634 19718
520 1 2 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.596 -0.446 19718
521 1 2 . 1 1 8 8 PHE C C 8 172.300 172.300 174.720 -2.420 19718
522 1 2 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.054 -1.454 19718
523 1 2 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.986 -1.886 19718
524 1 2 . 1 1 8 8 PHE H H 8 9.290 9.290 9.314 -0.024 19718
525 1 2 . 1 1 9 9 ILE N N 9 122.700 122.700 122.135 0.565 19718
526 1 2 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.936 -0.356 19718
527 1 2 . 1 1 9 9 ILE C C 9 173.600 173.600 175.863 -2.263 19718
528 1 2 . 1 1 9 9 ILE CA C 9 58.200 58.200 59.096 -0.896 19718
529 1 2 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.587 -3.087 19718
530 1 2 . 1 1 9 9 ILE H H 9 9.170 9.170 8.804 0.366 19718
531 1 2 . 1 1 10 10 LEU N N 10 126.700 126.700 128.014 -1.314 19718
532 1 2 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.297 0.023 19718
533 1 2 . 1 1 10 10 LEU C C 10 176.500 176.500 178.869 -2.369 19718
534 1 2 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.546 -3.346 19718
535 1 2 . 1 1 10 10 LEU CB C 10 37.500 37.500 41.909 -4.409 19718
536 1 2 . 1 1 10 10 LEU H H 10 9.100 9.100 9.133 -0.033 19718
537 1 2 . 1 1 11 11 LYS N N 11 118.900 118.900 120.992 -2.092 19718
538 1 2 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.060 -0.100 19718
539 1 2 . 1 1 11 11 LYS C C 11 174.100 174.100 177.425 -3.325 19718
540 1 2 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.832 -1.432 19718
541 1 2 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.190 -3.290 19718
542 1 2 . 1 1 11 11 LYS H H 11 8.520 8.520 8.908 -0.388 19718
543 1 2 . 1 1 12 12 ASP N N 12 114.400 114.400 117.005 -2.605 19718
544 1 2 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.568 -0.048 19718
545 1 2 . 1 1 12 12 ASP C C 12 174.500 174.500 176.984 -2.484 19718
546 1 2 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.318 -2.918 19718
547 1 2 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.768 -3.568 19718
548 1 2 . 1 1 12 12 ASP H H 12 7.690 7.690 8.043 -0.353 19718
549 1 2 . 1 1 13 13 GLY N N 13 109.200 109.200 109.009 0.191 19718
550 1 2 . 1 1 13 13 GLY C C 13 171.600 171.600 174.524 -2.924 19718
551 1 2 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.373 -2.973 19718
552 1 2 . 1 1 13 13 GLY H H 13 8.100 8.100 8.050 0.050 19718
553 1 2 . 1 1 14 14 SER N N 14 118.000 118.000 116.110 1.890 19718
554 1 2 . 1 1 14 14 SER HA H 14 4.280 4.280 4.379 -0.099 19718
555 1 2 . 1 1 14 14 SER C C 14 169.000 169.000 173.795 -4.795 19718
556 1 2 . 1 1 14 14 SER CA C 14 56.500 56.500 58.968 -2.468 19718
557 1 2 . 1 1 14 14 SER CB C 14 61.000 61.000 63.785 -2.785 19718
558 1 2 . 1 1 14 14 SER H H 14 8.110 8.110 8.094 0.016 19718
559 1 2 . 1 1 15 15 GLN N N 15 116.300 116.300 120.862 -4.562 19718
560 1 2 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.259 0.401 19718
561 1 2 . 1 1 15 15 GLN C C 15 173.500 173.500 176.066 -2.566 19718
562 1 2 . 1 1 15 15 GLN CA C 15 51.700 51.700 55.118 -3.418 19718
563 1 2 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.713 -2.713 19718
564 1 2 . 1 1 15 15 GLN H H 15 8.330 8.330 8.513 -0.183 19718
565 1 2 . 1 1 16 16 LYS N N 16 122.500 122.500 124.712 -2.212 19718
566 1 2 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.619 -0.289 19718
567 1 2 . 1 1 16 16 LYS C C 16 171.300 171.300 174.364 -3.064 19718
568 1 2 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.242 -3.341 19718
569 1 2 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.466 -1.466 19718
570 1 2 . 1 1 16 16 LYS H H 16 8.780 8.780 8.782 -0.002 19718
571 1 2 . 1 1 17 17 THR N N 17 120.000 120.000 119.608 0.392 19718
572 1 2 . 1 1 17 17 THR HA H 17 5.220 5.220 4.961 0.259 19718
573 1 2 . 1 1 17 17 THR C C 17 170.500 170.500 173.575 -3.075 19718
574 1 2 . 1 1 17 17 THR CA C 17 58.700 58.700 60.766 -2.066 19718
575 1 2 . 1 1 17 17 THR CB C 17 67.900 67.900 69.788 -1.888 19718
576 1 2 . 1 1 17 17 THR H H 17 8.160 8.160 8.480 -0.320 19718
577 1 2 . 1 1 18 18 TYR N N 18 125.600 125.600 127.387 -1.787 19718
578 1 2 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.819 0.021 19718
579 1 2 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.893 -1.893 19718
580 1 2 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.883 -2.784 19718
581 1 2 . 1 1 18 18 TYR H H 18 9.020 9.020 9.203 -0.183 19718
582 1 2 . 1 1 19 19 GLU C C 19 174.200 174.200 175.699 -1.499 19718
583 1 2 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.642 -2.741 19718
584 1 2 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.556 -4.256 19718
585 1 2 . 1 1 20 20 VAL N N 20 119.000 119.000 119.637 -0.637 19718
586 1 2 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.695 0.145 19718
587 1 2 . 1 1 20 20 VAL C C 20 171.200 171.200 173.481 -2.281 19718
588 1 2 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.069 -2.469 19718
589 1 2 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.245 -1.545 19718
590 1 2 . 1 1 20 20 VAL H H 20 9.160 9.160 9.156 0.004 19718
591 1 2 . 1 1 21 21 CYS N N 21 117.500 117.500 118.968 -1.468 19718
592 1 2 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.839 -0.079 19718
593 1 2 . 1 1 21 21 CYS C C 21 171.400 171.400 174.193 -2.793 19718
594 1 2 . 1 1 21 21 CYS CA C 21 54.900 54.900 56.501 -1.601 19718
595 1 2 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.762 -3.562 19718
596 1 2 . 1 1 21 21 CYS H H 21 8.720 8.720 9.125 -0.405 19718
597 1 2 . 1 1 22 22 GLU N N 22 120.900 120.900 123.897 -2.997 19718
598 1 2 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.919 -0.509 19718
599 1 2 . 1 1 22 22 GLU C C 22 174.300 174.300 177.322 -3.022 19718
600 1 2 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.410 -3.309 19718
601 1 2 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.895 -3.095 19718
602 1 2 . 1 1 22 22 GLU H H 22 8.540 8.540 8.870 -0.330 19718
603 1 2 . 1 1 23 23 GLY N N 23 112.400 112.400 115.537 -3.137 19718
604 1 2 . 1 1 23 23 GLY C C 23 171.000 171.000 174.413 -3.413 19718
605 1 2 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.834 -2.434 19718
606 1 2 . 1 1 23 23 GLY H H 23 8.720 8.720 8.847 -0.127 19718
607 1 2 . 1 1 24 24 GLU N N 24 119.600 119.600 122.525 -2.925 19718
608 1 2 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.264 0.066 19718
609 1 2 . 1 1 24 24 GLU C C 24 174.400 174.400 175.800 -1.400 19718
610 1 2 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.489 -2.389 19718
611 1 2 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.390 -2.291 19718
612 1 2 . 1 1 24 24 GLU H H 24 7.060 7.060 7.719 -0.659 19718
613 1 2 . 1 1 25 25 THR N N 25 113.600 113.600 119.144 -5.544 19718
614 1 2 . 1 1 25 25 THR HA H 25 5.510 5.510 4.704 0.806 19718
615 1 2 . 1 1 25 25 THR C C 25 173.100 173.100 175.556 -2.456 19718
616 1 2 . 1 1 25 25 THR CA C 25 57.000 57.000 62.154 -5.154 19718
617 1 2 . 1 1 25 25 THR CB C 25 68.700 68.700 69.984 -1.284 19718
618 1 2 . 1 1 25 25 THR H H 25 9.080 9.080 8.592 0.488 19718
619 1 2 . 1 1 26 26 ILE N N 26 120.300 120.300 124.562 -4.262 19718
620 1 2 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.850 -0.220 19718
621 1 2 . 1 1 26 26 ILE C C 26 174.700 174.700 177.442 -2.742 19718
622 1 2 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.702 -1.002 19718
623 1 2 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.785 -4.785 19718
624 1 2 . 1 1 26 26 ILE H H 26 7.860 7.860 8.375 -0.515 19718
625 1 2 . 1 1 27 27 LEU N N 27 117.600 117.600 119.872 -2.272 19718
626 1 2 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.096 -0.346 19718
627 1 2 . 1 1 27 27 LEU C C 27 174.000 174.000 178.192 -4.192 19718
628 1 2 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.870 -2.970 19718
629 1 2 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.658 -2.358 19718
630 1 2 . 1 1 27 27 LEU H H 27 6.580 6.580 7.888 -1.308 19718
631 1 2 . 1 1 28 28 ASP N N 28 120.000 120.000 120.219 -0.219 19718
632 1 2 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.512 -0.262 19718
633 1 2 . 1 1 28 28 ASP C C 28 177.900 177.900 178.826 -0.926 19718
634 1 2 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.597 -2.598 19718
635 1 2 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.633 -3.733 19718
636 1 2 . 1 1 28 28 ASP H H 28 7.880 7.880 8.390 -0.510 19718
637 1 2 . 1 1 29 29 ILE N N 29 122.100 122.100 120.658 1.442 19718
638 1 2 . 1 1 29 29 ILE HA H 29 3.740 3.740 4.053 -0.313 19718
639 1 2 . 1 1 29 29 ILE C C 29 175.700 175.700 177.822 -2.122 19718
640 1 2 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.509 -2.409 19718
641 1 2 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.985 -1.485 19718
642 1 2 . 1 1 29 29 ILE H H 29 8.340 8.340 8.275 0.065 19718
643 1 2 . 1 1 30 30 ALA N N 30 124.100 124.100 123.806 0.294 19718
644 1 2 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.799 -0.459 19718
645 1 2 . 1 1 30 30 ALA C C 30 177.600 177.600 179.629 -2.029 19718
646 1 2 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.599 -2.799 19718
647 1 2 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.038 -1.238 19718
648 1 2 . 1 1 30 30 ALA H H 30 8.430 8.430 8.195 0.235 19718
649 1 2 . 1 1 31 31 GLN N N 31 116.000 116.000 118.146 -2.146 19718
650 1 2 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.153 0.007 19718
651 1 2 . 1 1 31 31 GLN C C 31 178.100 178.100 179.517 -1.417 19718
652 1 2 . 1 1 31 31 GLN CA C 31 56.700 56.700 58.598 -1.898 19718
653 1 2 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.323 -3.123 19718
654 1 2 . 1 1 31 31 GLN H H 31 8.760 8.760 8.278 0.482 19718
655 1 2 . 1 1 32 32 GLY N N 32 108.700 108.700 107.234 1.466 19718
656 1 2 . 1 1 32 32 GLY C C 32 171.700 171.700 175.584 -3.884 19718
657 1 2 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.684 -3.484 19718
658 1 2 . 1 1 32 32 GLY H H 32 8.220 8.220 8.067 0.153 19718
659 1 2 . 1 1 33 33 HIS N N 33 115.000 115.000 119.432 -4.432 19718
660 1 2 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.585 -0.155 19718
661 1 2 . 1 1 33 33 HIS C C 33 169.800 169.800 174.396 -4.596 19718
662 1 2 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.522 -3.122 19718
663 1 2 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.207 -4.707 19718
664 1 2 . 1 1 33 33 HIS H H 33 6.980 6.980 7.867 -0.887 19718
665 1 2 . 1 1 34 34 ASN N N 34 113.700 113.700 116.479 -2.779 19718
666 1 2 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.373 -0.043 19718
667 1 2 . 1 1 34 34 ASN C C 34 172.000 172.000 175.133 -3.133 19718
668 1 2 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.849 -1.749 19718
669 1 2 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.511 -2.511 19718
670 1 2 . 1 1 34 34 ASN H H 34 7.700 7.700 8.053 -0.353 19718
671 1 2 . 1 1 35 35 LEU N N 35 115.600 115.600 118.801 -3.201 19718
672 1 2 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.205 0.045 19718
673 1 2 . 1 1 35 35 LEU C C 35 174.900 174.900 177.214 -2.314 19718
674 1 2 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.858 -4.558 19718
675 1 2 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.532 -3.332 19718
676 1 2 . 1 1 35 35 LEU H H 35 7.980 7.980 7.916 0.064 19718
677 1 2 . 1 1 36 36 ASP N N 36 120.100 120.100 125.400 -5.300 19718
678 1 2 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.707 -0.277 19718
679 1 2 . 1 1 36 36 ASP C C 36 171.100 171.100 174.832 -3.732 19718
680 1 2 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.979 -3.979 19718
681 1 2 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.520 -3.320 19718
682 1 2 . 1 1 36 36 ASP H H 36 8.610 8.610 8.727 -0.117 19718
683 1 2 . 1 1 37 37 MET N N 37 123.900 123.900 119.326 4.574 19718
684 1 2 . 1 1 37 37 MET HA H 37 4.280 4.280 4.799 -0.519 19718
685 1 2 . 1 1 37 37 MET C C 37 171.200 171.200 174.022 -2.822 19718
686 1 2 . 1 1 37 37 MET CA C 37 52.800 52.800 54.720 -1.920 19718
687 1 2 . 1 1 37 37 MET CB C 37 33.000 33.000 36.870 -3.869 19718
688 1 2 . 1 1 37 37 MET H H 37 7.670 7.670 7.893 -0.223 19718
689 1 2 . 1 1 38 38 GLU N N 38 128.600 128.600 120.809 7.791 19718
690 1 2 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.696 -0.406 19718
691 1 2 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.380 -3.180 19718
692 1 2 . 1 1 38 38 GLU CB C 38 29.400 29.400 33.828 -4.428 19718
693 1 2 . 1 1 38 38 GLU H H 38 9.060 9.060 8.876 0.184 19718
694 1 2 . 1 1 51 51 HIS C C 51 170.700 170.700 174.275 -3.575 19718
695 1 2 . 1 1 51 51 HIS CA C 51 52.800 52.800 53.677 -0.877 19718
696 1 2 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.140 -0.440 19718
697 1 2 . 1 1 53 53 ILE N N 53 122.200 122.200 121.644 0.556 19718
698 1 2 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.811 -0.801 19718
699 1 2 . 1 1 53 53 ILE C C 53 174.400 174.400 173.695 0.705 19718
700 1 2 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.653 0.047 19718
701 1 2 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.761 -5.461 19718
702 1 2 . 1 1 53 53 ILE H H 53 8.800 8.800 8.085 0.715 19718
703 1 2 . 1 1 54 54 VAL N N 54 130.200 130.200 126.012 4.188 19718
704 1 2 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.841 -0.971 19718
705 1 2 . 1 1 54 54 VAL C C 54 172.500 172.500 175.097 -2.597 19718
706 1 2 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.635 1.265 19718
707 1 2 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.881 -5.281 19718
708 1 2 . 1 1 54 54 VAL H H 54 8.380 8.380 8.766 -0.386 19718
709 1 2 . 1 1 55 55 ASP N N 55 129.100 129.100 127.498 1.602 19718
710 1 2 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.679 -0.089 19718
711 1 2 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.361 -2.661 19718
712 1 2 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.826 -1.326 19718
713 1 2 . 1 1 55 55 ASP H H 55 8.160 8.160 8.145 0.015 19718
714 1 2 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.317 -0.147 19718
715 1 2 . 1 1 56 56 PRO C C 56 174.900 174.900 177.080 -2.180 19718
716 1 2 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.913 -1.913 19718
717 1 2 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.783 -2.383 19718
718 1 2 . 1 1 57 57 ASP N N 57 117.100 117.100 116.983 0.117 19718
719 1 2 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.451 -0.081 19718
720 1 2 . 1 1 57 57 ASP C C 57 174.100 174.100 177.195 -3.095 19718
721 1 2 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.526 -2.826 19718
722 1 2 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.960 -4.160 19718
723 1 2 . 1 1 57 57 ASP H H 57 9.110 9.110 8.546 0.564 19718
724 1 2 . 1 1 58 58 TYR N N 58 115.800 115.800 118.112 -2.312 19718
725 1 2 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.457 -0.097 19718
726 1 2 . 1 1 58 58 TYR C C 58 173.200 173.200 177.808 -4.608 19718
727 1 2 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.704 -3.004 19718
728 1 2 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.200 -0.300 19718
729 1 2 . 1 1 58 58 TYR H H 58 8.190 8.190 7.768 0.422 19718
730 1 2 . 1 1 59 59 TYR N N 59 120.100 120.100 121.826 -1.726 19718
731 1 2 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.150 -0.370 19718
732 1 2 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.849 0.251 19718
733 1 2 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.172 -1.772 19718
734 1 2 . 1 1 59 59 TYR H H 59 7.420 7.420 8.399 -0.979 19718
735 1 2 . 1 1 60 60 ASP N N 60 115.200 115.200 118.475 -3.275 19718
736 1 2 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.399 -0.039 19718
737 1 2 . 1 1 60 60 ASP C C 60 173.100 173.100 176.478 -3.378 19718
738 1 2 . 1 1 60 60 ASP CA C 60 53.400 53.400 56.130 -2.730 19718
739 1 2 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.489 -2.989 19718
740 1 2 . 1 1 60 60 ASP H H 60 8.440 8.440 8.688 -0.248 19718
741 1 2 . 1 1 61 61 ALA N N 61 120.200 120.200 120.679 -0.479 19718
742 1 2 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.295 -0.115 19718
743 1 2 . 1 1 61 61 ALA C C 61 175.000 175.000 176.878 -1.878 19718
744 1 2 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.281 -2.981 19718
745 1 2 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.654 -3.454 19718
746 1 2 . 1 1 61 61 ALA H H 61 7.300 7.300 7.639 -0.339 19718
747 1 2 . 1 1 62 62 LEU N N 62 118.000 118.000 121.116 -3.116 19718
748 1 2 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.717 -0.427 19718
749 1 2 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.083 -1.983 19718
750 1 2 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.598 -3.898 19718
751 1 2 . 1 1 62 62 LEU H H 62 6.680 6.680 7.459 -0.779 19718
752 1 2 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.485 -0.165 19718
753 1 2 . 1 1 63 63 PRO C C 63 173.500 173.500 175.638 -2.138 19718
754 1 2 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.060 -2.360 19718
755 1 2 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.535 -4.035 19718
756 1 2 . 1 1 64 64 GLU N N 64 124.500 124.500 118.301 6.199 19718
757 1 2 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.562 -0.382 19718
758 1 2 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.120 -1.619 19718
759 1 2 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.657 -4.856 19718
760 1 2 . 1 1 64 64 GLU H H 64 8.590 8.590 8.357 0.233 19718
761 1 2 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.646 -0.476 19718
762 1 2 . 1 1 65 65 PRO C C 65 174.900 174.900 176.126 -1.226 19718
763 1 2 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.381 0.619 19718
764 1 2 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.465 -3.965 19718
765 1 2 . 1 1 66 66 GLU N N 66 123.300 123.300 119.207 4.093 19718
766 1 2 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.094 0.236 19718
767 1 2 . 1 1 66 66 GLU C C 66 174.200 174.200 177.372 -3.172 19718
768 1 2 . 1 1 66 66 GLU CA C 66 52.500 52.500 57.617 -5.117 19718
769 1 2 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.306 -2.906 19718
770 1 2 . 1 1 66 66 GLU H H 66 9.080 9.080 8.415 0.665 19718
771 1 2 . 1 1 67 67 ASP N N 67 120.100 120.100 120.639 -0.539 19718
772 1 2 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.331 -0.091 19718
773 1 2 . 1 1 67 67 ASP C C 67 174.900 174.900 176.742 -1.842 19718
774 1 2 . 1 1 67 67 ASP CA C 67 55.400 55.400 57.190 -1.790 19718
775 1 2 . 1 1 67 67 ASP CB C 67 37.800 37.800 41.016 -3.216 19718
776 1 2 . 1 1 67 67 ASP H H 67 8.690 8.690 8.744 -0.054 19718
777 1 2 . 1 1 68 68 ASP N N 68 116.800 116.800 114.025 2.775 19718
778 1 2 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.497 -0.257 19718
779 1 2 . 1 1 68 68 ASP C C 68 175.500 175.500 176.971 -1.471 19718
780 1 2 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.497 -1.197 19718
781 1 2 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.248 -4.148 19718
782 1 2 . 1 1 68 68 ASP H H 68 8.400 8.400 8.326 0.074 19718
783 1 2 . 1 1 69 69 GLU N N 69 123.600 123.600 120.262 3.338 19718
784 1 2 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.234 -0.084 19718
785 1 2 . 1 1 69 69 GLU C C 69 175.200 175.200 178.451 -3.251 19718
786 1 2 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.278 -2.078 19718
787 1 2 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.389 -4.389 19718
788 1 2 . 1 1 69 69 GLU H H 69 7.530 7.530 7.692 -0.162 19718
789 1 2 . 1 1 70 70 ASN N N 70 119.100 119.100 118.689 0.411 19718
790 1 2 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.485 -0.125 19718
791 1 2 . 1 1 70 70 ASN C C 70 175.200 175.200 176.467 -1.267 19718
792 1 2 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.462 -1.762 19718
793 1 2 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.906 -3.106 19718
794 1 2 . 1 1 70 70 ASN H H 70 7.960 7.960 8.826 -0.866 19718
795 1 2 . 1 1 71 71 ASP N N 71 118.400 118.400 120.609 -2.209 19718
796 1 2 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.421 -0.171 19718
797 1 2 . 1 1 71 71 ASP C C 71 176.000 176.000 177.841 -1.841 19718
798 1 2 . 1 1 71 71 ASP CA C 71 54.600 54.600 57.023 -2.423 19718
799 1 2 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.792 -3.292 19718
800 1 2 . 1 1 71 71 ASP H H 71 8.250 8.250 7.971 0.279 19718
801 1 2 . 1 1 72 72 MET N N 72 117.300 117.300 115.828 1.472 19718
802 1 2 . 1 1 72 72 MET HA H 72 4.370 4.370 4.236 0.134 19718
803 1 2 . 1 1 72 72 MET C C 72 177.800 177.800 178.012 -0.212 19718
804 1 2 . 1 1 72 72 MET CA C 72 53.700 53.700 57.043 -3.343 19718
805 1 2 . 1 1 72 72 MET CB C 72 32.400 32.400 31.912 0.488 19718
806 1 2 . 1 1 72 72 MET H H 72 7.240 7.240 7.607 -0.367 19718
807 1 2 . 1 1 73 73 LEU N N 73 123.000 123.000 121.015 1.985 19718
808 1 2 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.273 -0.513 19718
809 1 2 . 1 1 73 73 LEU C C 73 175.700 175.700 179.137 -3.437 19718
810 1 2 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.483 -2.583 19718
811 1 2 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.506 -3.406 19718
812 1 2 . 1 1 73 73 LEU H H 73 8.600 8.600 7.507 1.093 19718
813 1 2 . 1 1 74 74 ASP N N 74 118.500 118.500 118.466 0.034 19718
814 1 2 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.389 -0.049 19718
815 1 2 . 1 1 74 74 ASP C C 74 174.700 174.700 177.598 -2.898 19718
816 1 2 . 1 1 74 74 ASP CA C 74 54.300 54.300 57.211 -2.911 19718
817 1 2 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.569 -2.369 19718
818 1 2 . 1 1 74 74 ASP H H 74 7.250 7.250 7.872 -0.622 19718
819 1 2 . 1 1 75 75 LEU N N 75 116.300 116.300 117.889 -1.589 19718
820 1 2 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.220 0.080 19718
821 1 2 . 1 1 75 75 LEU C C 75 174.500 174.500 176.621 -2.121 19718
822 1 2 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.559 -4.259 19718
823 1 2 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.317 -1.717 19718
824 1 2 . 1 1 75 75 LEU H H 75 7.000 7.000 7.460 -0.460 19718
825 1 2 . 1 1 76 76 ALA N N 76 124.600 124.600 120.585 4.015 19718
826 1 2 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.427 -0.327 19718
827 1 2 . 1 1 76 76 ALA C C 76 174.200 174.200 176.295 -2.095 19718
828 1 2 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.428 -0.928 19718
829 1 2 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.745 -5.545 19718
830 1 2 . 1 1 76 76 ALA H H 76 7.590 7.590 7.754 -0.164 19718
831 1 2 . 1 1 77 77 TYR N N 77 122.900 122.900 121.890 1.010 19718
832 1 2 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.295 0.135 19718
833 1 2 . 1 1 77 77 TYR C C 77 174.100 174.100 177.290 -3.190 19718
834 1 2 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.174 -4.274 19718
835 1 2 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.283 -3.383 19718
836 1 2 . 1 1 77 77 TYR H H 77 8.150 8.150 8.639 -0.489 19718
837 1 2 . 1 1 78 78 GLY N N 78 112.900 112.900 114.749 -1.849 19718
838 1 2 . 1 1 78 78 GLY C C 78 171.800 171.800 173.724 -1.924 19718
839 1 2 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.821 -1.121 19718
840 1 2 . 1 1 78 78 GLY H H 78 8.320 8.320 8.186 0.134 19718
841 1 2 . 1 1 79 79 LEU N N 79 119.300 119.300 119.167 0.133 19718
842 1 2 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.226 -0.436 19718
843 1 2 . 1 1 79 79 LEU C C 79 174.000 174.000 176.302 -2.302 19718
844 1 2 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.218 -1.218 19718
845 1 2 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.715 -2.815 19718
846 1 2 . 1 1 79 79 LEU H H 79 7.120 7.120 7.918 -0.798 19718
847 1 2 . 1 1 80 80 THR N N 80 118.500 118.500 117.740 0.760 19718
848 1 2 . 1 1 80 80 THR HA H 80 4.860 4.860 4.497 0.363 19718
849 1 2 . 1 1 80 80 THR C C 80 173.300 173.300 175.710 -2.410 19718
850 1 2 . 1 1 80 80 THR CA C 80 57.600 57.600 61.331 -3.731 19718
851 1 2 . 1 1 80 80 THR CB C 80 71.000 71.000 69.988 1.012 19718
852 1 2 . 1 1 80 80 THR H H 80 9.240 9.240 8.045 1.195 19718
853 1 2 . 1 1 81 81 GLU N N 81 118.000 118.000 121.530 -3.530 19718
854 1 2 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.019 0.091 19718
855 1 2 . 1 1 81 81 GLU C C 81 173.900 173.900 175.768 -1.868 19718
856 1 2 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.923 -3.523 19718
857 1 2 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.233 -2.534 19718
858 1 2 . 1 1 81 81 GLU H H 81 9.020 9.020 8.790 0.230 19718
859 1 2 . 1 1 82 82 THR N N 82 106.400 106.400 106.372 0.028 19718
860 1 2 . 1 1 82 82 THR HA H 82 3.950 3.950 3.083 0.867 19718
861 1 2 . 1 1 82 82 THR C C 82 171.700 171.700 173.586 -1.886 19718
862 1 2 . 1 1 82 82 THR CA C 82 56.800 56.800 59.593 -2.793 19718
863 1 2 . 1 1 82 82 THR CB C 82 63.800 63.800 68.342 -4.542 19718
864 1 2 . 1 1 82 82 THR H H 82 7.630 7.630 7.360 0.270 19718
865 1 2 . 1 1 83 83 SER N N 83 121.500 121.500 119.740 1.760 19718
866 1 2 . 1 1 83 83 SER HA H 83 5.080 5.080 4.342 0.738 19718
867 1 2 . 1 1 83 83 SER C C 83 170.900 170.900 174.350 -3.450 19718
868 1 2 . 1 1 83 83 SER CA C 83 59.000 59.000 60.058 -1.058 19718
869 1 2 . 1 1 83 83 SER CB C 83 61.700 61.700 63.609 -1.909 19718
870 1 2 . 1 1 83 83 SER H H 83 6.930 6.930 7.746 -0.816 19718
871 1 2 . 1 1 84 84 ARG N N 84 119.300 119.300 127.262 -7.962 19718
872 1 2 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.796 0.074 19718
873 1 2 . 1 1 84 84 ARG C C 84 172.400 172.400 174.288 -1.888 19718
874 1 2 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.353 -5.053 19718
875 1 2 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.293 -1.893 19718
876 1 2 . 1 1 84 84 ARG H H 84 9.280 9.280 8.683 0.597 19718
877 1 2 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.436 -0.006 19718
878 1 2 . 1 1 88 88 GLN C C 88 172.500 172.500 175.738 -3.238 19718
879 1 2 . 1 1 88 88 GLN CA C 88 51.000 51.000 56.702 -5.702 19718
880 1 2 . 1 1 88 88 GLN CB C 88 27.000 27.000 31.007 -4.007 19718
881 1 2 . 1 1 90 90 LYS N N 90 123.700 123.700 126.158 -2.458 19718
882 1 2 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.005 -0.555 19718
883 1 2 . 1 1 90 90 LYS C C 90 173.500 173.500 175.292 -1.792 19718
884 1 2 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.559 -2.059 19718
885 1 2 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.885 -2.985 19718
886 1 2 . 1 1 90 90 LYS H H 90 8.330 8.330 8.109 0.221 19718
887 1 2 . 1 1 91 91 MET N N 91 118.200 118.200 119.700 -1.500 19718
888 1 2 . 1 1 91 91 MET HA H 91 4.330 4.330 4.643 -0.313 19718
889 1 2 . 1 1 91 91 MET C C 91 174.300 174.300 176.063 -1.763 19718
890 1 2 . 1 1 91 91 MET CA C 91 51.800 51.800 55.283 -3.483 19718
891 1 2 . 1 1 91 91 MET CB C 91 27.200 27.200 31.750 -4.550 19718
892 1 2 . 1 1 91 91 MET H H 91 8.620 8.620 8.501 0.119 19718
893 1 2 . 1 1 92 92 SER N N 92 117.000 117.000 117.488 -0.488 19718
894 1 2 . 1 1 92 92 SER HA H 92 4.610 4.610 4.676 -0.066 19718
895 1 2 . 1 1 92 92 SER C C 92 171.300 171.300 175.436 -4.136 19718
896 1 2 . 1 1 92 92 SER CA C 92 54.000 54.000 56.673 -2.673 19718
897 1 2 . 1 1 92 92 SER CB C 92 63.700 63.700 65.795 -2.095 19718
898 1 2 . 1 1 92 92 SER H H 92 6.970 6.970 8.191 -1.221 19718
899 1 2 . 1 1 93 93 LYS N N 93 121.700 121.700 121.417 0.283 19718
900 1 2 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.062 -0.092 19718
901 1 2 . 1 1 93 93 LYS C C 93 175.200 175.200 178.409 -3.209 19718
902 1 2 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.304 -2.604 19718
903 1 2 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.965 -2.865 19718
904 1 2 . 1 1 93 93 LYS H H 93 9.260 9.260 8.888 0.372 19718
905 1 2 . 1 1 94 94 ASP N N 94 116.700 116.700 119.528 -2.828 19718
906 1 2 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.502 -0.142 19718
907 1 2 . 1 1 94 94 ASP C C 94 174.300 174.300 177.533 -3.233 19718
908 1 2 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.733 -3.033 19718
909 1 2 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.102 -3.202 19718
910 1 2 . 1 1 94 94 ASP H H 94 8.020 8.020 7.850 0.170 19718
911 1 2 . 1 1 95 95 ILE N N 95 109.000 109.000 112.071 -3.071 19718
912 1 2 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.487 0.173 19718
913 1 2 . 1 1 95 95 ILE C C 95 170.600 170.600 174.789 -4.189 19718
914 1 2 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.106 -2.806 19718
915 1 2 . 1 1 95 95 ILE CB C 95 35.200 35.200 39.197 -3.997 19718
916 1 2 . 1 1 95 95 ILE H H 95 7.240 7.240 7.486 -0.246 19718
917 1 2 . 1 1 96 96 ASP N N 96 119.800 119.800 121.937 -2.137 19718
918 1 2 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.437 -0.257 19718
919 1 2 . 1 1 96 96 ASP C C 96 174.900 174.900 176.636 -1.736 19718
920 1 2 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.244 -1.544 19718
921 1 2 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.793 -0.793 19718
922 1 2 . 1 1 96 96 ASP H H 96 6.950 6.950 7.890 -0.940 19718
923 1 2 . 1 1 97 97 GLY N N 97 118.500 118.500 113.485 5.015 19718
924 1 2 . 1 1 97 97 GLY C C 97 170.500 170.500 173.913 -3.413 19718
925 1 2 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.333 -2.033 19718
926 1 2 . 1 1 97 97 GLY H H 97 9.210 9.210 8.296 0.914 19718
927 1 2 . 1 1 98 98 ILE N N 98 121.300 121.300 121.433 -0.133 19718
928 1 2 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.276 2.324 19718
929 1 2 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.697 -3.097 19718
930 1 2 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.581 -3.881 19718
931 1 2 . 1 1 98 98 ILE H H 98 7.660 7.660 8.045 -0.385 19718
932 1 2 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.298 0.052 19718
933 1 2 . 1 1 99 99 ARG C C 99 172.200 172.200 174.928 -2.728 19718
934 1 2 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.408 -4.308 19718
935 1 2 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.535 -3.035 19718
936 1 2 . 1 1 100 100 VAL N N 100 114.900 114.900 116.936 -2.036 19718
937 1 2 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.165 -0.345 19718
938 1 2 . 1 1 100 100 VAL C C 100 169.600 169.600 173.223 -3.623 19718
939 1 2 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.144 -3.944 19718
940 1 2 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.048 -3.748 19718
941 1 2 . 1 1 100 100 VAL H H 100 8.440 8.440 8.851 -0.411 19718
942 1 2 . 1 1 101 101 ALA N N 101 123.400 123.400 122.377 1.023 19718
943 1 2 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.184 0.126 19718
944 1 2 . 1 1 101 101 ALA C C 101 174.400 174.400 175.971 -1.571 19718
945 1 2 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.887 -3.087 19718
946 1 2 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.193 -3.393 19718
947 1 2 . 1 1 101 101 ALA H H 101 9.040 9.040 8.757 0.283 19718
948 1 2 . 1 1 102 102 LEU N N 102 120.600 120.600 121.343 -0.743 19718
949 1 2 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.012 -0.442 19718
950 1 2 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.819 0.381 19718
951 1 2 . 1 1 102 102 LEU CB C 102 37.900 37.900 43.728 -5.828 19718
952 1 2 . 1 1 102 102 LEU H H 102 8.260 8.260 8.354 -0.094 19718
953 1 2 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.614 -0.034 19718
954 1 2 . 1 1 112 112 ASN C C 112 171.900 171.900 175.093 -3.193 19718
955 1 2 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.447 -3.047 19718
956 1 2 . 1 1 112 112 ASN CB C 112 36.700 36.700 38.843 -2.143 19718
957 1 2 . 1 1 113 113 ASP N N 113 120.300 120.300 120.902 -0.602 19718
958 1 2 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.481 -0.041 19718
959 1 2 . 1 1 113 113 ASP C C 113 173.000 173.000 174.905 -1.905 19718
960 1 2 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.890 -3.290 19718
961 1 2 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.970 -2.870 19718
962 1 2 . 1 1 113 113 ASP H H 113 8.040 8.040 8.494 -0.454 19718
963 1 2 . 1 1 114 114 PHE N N 114 120.100 120.100 120.175 -0.075 19718
964 1 2 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.688 -0.078 19718
965 1 2 . 1 1 114 114 PHE C C 114 172.200 172.200 175.725 -3.525 19718
966 1 2 . 1 1 114 114 PHE CA C 114 54.900 54.900 57.317 -2.417 19718
967 1 2 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.999 -3.499 19718
968 1 2 . 1 1 114 114 PHE H H 114 8.110 8.110 8.187 -0.077 19718
969 1 3 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.506 -0.266 19718
970 1 3 . 1 1 2 2 GLU C C 2 173.400 173.400 176.846 -3.446 19718
971 1 3 . 1 1 2 2 GLU CA C 2 53.400 53.400 57.134 -3.734 19718
972 1 3 . 1 1 2 2 GLU CB C 2 27.000 27.000 32.132 -5.132 19718
973 1 3 . 1 1 3 3 GLU N N 3 121.200 121.200 117.684 3.516 19718
974 1 3 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.465 -0.085 19718
975 1 3 . 1 1 3 3 GLU C C 3 173.000 173.000 175.987 -2.987 19718
976 1 3 . 1 1 3 3 GLU CA C 3 54.400 54.400 57.073 -2.673 19718
977 1 3 . 1 1 3 3 GLU CB C 3 27.400 27.400 32.156 -4.756 19718
978 1 3 . 1 1 3 3 GLU H H 3 8.510 8.510 7.986 0.524 19718
979 1 3 . 1 1 4 4 LEU N N 4 122.400 122.400 118.734 3.666 19718
980 1 3 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.745 -0.195 19718
981 1 3 . 1 1 4 4 LEU C C 4 172.900 172.900 174.924 -2.024 19718
982 1 3 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.343 -2.943 19718
983 1 3 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.678 -4.978 19718
984 1 3 . 1 1 4 4 LEU H H 4 8.460 8.460 7.965 0.495 19718
985 1 3 . 1 1 5 5 LYS N N 5 119.300 119.300 119.448 -0.148 19718
986 1 3 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.231 0.189 19718
987 1 3 . 1 1 5 5 LYS C C 5 172.400 172.400 174.380 -1.980 19718
988 1 3 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.959 -2.659 19718
989 1 3 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.337 -3.337 19718
990 1 3 . 1 1 5 5 LYS H H 5 8.570 8.570 8.232 0.338 19718
991 1 3 . 1 1 6 6 ILE N N 6 116.900 116.900 121.821 -4.921 19718
992 1 3 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.691 -0.581 19718
993 1 3 . 1 1 6 6 ILE C C 6 169.800 169.800 173.370 -3.570 19718
994 1 3 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.075 -3.575 19718
995 1 3 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.406 -3.406 19718
996 1 3 . 1 1 6 6 ILE H H 6 8.160 8.160 9.021 -0.861 19718
997 1 3 . 1 1 7 7 THR N N 7 123.000 123.000 124.806 -1.806 19718
998 1 3 . 1 1 7 7 THR HA H 7 5.220 5.220 5.166 0.054 19718
999 1 3 . 1 1 7 7 THR C C 7 169.900 169.900 173.469 -3.569 19718
1000 1 3 . 1 1 7 7 THR CA C 7 58.400 58.400 60.962 -2.562 19718
1001 1 3 . 1 1 7 7 THR CB C 7 68.700 68.700 70.043 -1.343 19718
1002 1 3 . 1 1 7 7 THR H H 7 8.520 8.520 8.605 -0.085 19718
1003 1 3 . 1 1 8 8 PHE N N 8 124.000 124.000 123.494 0.506 19718
1004 1 3 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.612 -0.462 19718
1005 1 3 . 1 1 8 8 PHE C C 8 172.300 172.300 175.015 -2.715 19718
1006 1 3 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.119 -1.519 19718
1007 1 3 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.005 -1.905 19718
1008 1 3 . 1 1 8 8 PHE H H 8 9.290 9.290 9.381 -0.091 19718
1009 1 3 . 1 1 9 9 ILE N N 9 122.700 122.700 122.079 0.621 19718
1010 1 3 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.874 -0.294 19718
1011 1 3 . 1 1 9 9 ILE C C 9 173.600 173.600 176.046 -2.446 19718
1012 1 3 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.587 -2.386 19718
1013 1 3 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.355 -3.855 19718
1014 1 3 . 1 1 9 9 ILE H H 9 9.170 9.170 9.067 0.103 19718
1015 1 3 . 1 1 10 10 LEU N N 10 126.700 126.700 128.206 -1.506 19718
1016 1 3 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.406 -0.086 19718
1017 1 3 . 1 1 10 10 LEU C C 10 176.500 176.500 178.616 -2.116 19718
1018 1 3 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.765 -2.565 19718
1019 1 3 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.222 -4.722 19718
1020 1 3 . 1 1 10 10 LEU H H 10 9.100 9.100 8.990 0.110 19718
1021 1 3 . 1 1 11 11 LYS N N 11 118.900 118.900 120.040 -1.140 19718
1022 1 3 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.060 -0.100 19718
1023 1 3 . 1 1 11 11 LYS C C 11 174.100 174.100 177.042 -2.942 19718
1024 1 3 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.984 -1.584 19718
1025 1 3 . 1 1 11 11 LYS CB C 11 28.900 28.900 31.932 -3.032 19718
1026 1 3 . 1 1 11 11 LYS H H 11 8.520 8.520 8.914 -0.394 19718
1027 1 3 . 1 1 12 12 ASP N N 12 114.400 114.400 116.881 -2.481 19718
1028 1 3 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.693 -0.173 19718
1029 1 3 . 1 1 12 12 ASP C C 12 174.500 174.500 176.725 -2.225 19718
1030 1 3 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.979 -3.579 19718
1031 1 3 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.829 -3.629 19718
1032 1 3 . 1 1 12 12 ASP H H 12 7.690 7.690 7.896 -0.206 19718
1033 1 3 . 1 1 13 13 GLY N N 13 109.200 109.200 109.010 0.190 19718
1034 1 3 . 1 1 13 13 GLY C C 13 171.600 171.600 174.460 -2.860 19718
1035 1 3 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.201 -2.801 19718
1036 1 3 . 1 1 13 13 GLY H H 13 8.100 8.100 7.930 0.170 19718
1037 1 3 . 1 1 14 14 SER N N 14 118.000 118.000 116.060 1.940 19718
1038 1 3 . 1 1 14 14 SER HA H 14 4.280 4.280 4.335 -0.055 19718
1039 1 3 . 1 1 14 14 SER C C 14 169.000 169.000 173.611 -4.611 19718
1040 1 3 . 1 1 14 14 SER CA C 14 56.500 56.500 58.714 -2.214 19718
1041 1 3 . 1 1 14 14 SER CB C 14 61.000 61.000 63.661 -2.661 19718
1042 1 3 . 1 1 14 14 SER H H 14 8.110 8.110 7.909 0.201 19718
1043 1 3 . 1 1 15 15 GLN N N 15 116.300 116.300 120.600 -4.300 19718
1044 1 3 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.301 0.359 19718
1045 1 3 . 1 1 15 15 GLN C C 15 173.500 173.500 176.064 -2.564 19718
1046 1 3 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.995 -3.295 19718
1047 1 3 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.205 -2.205 19718
1048 1 3 . 1 1 15 15 GLN H H 15 8.330 8.330 8.506 -0.176 19718
1049 1 3 . 1 1 16 16 LYS N N 16 122.500 122.500 124.261 -1.761 19718
1050 1 3 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.542 -0.212 19718
1051 1 3 . 1 1 16 16 LYS C C 16 171.300 171.300 174.355 -3.055 19718
1052 1 3 . 1 1 16 16 LYS CA C 16 51.900 51.900 54.978 -3.078 19718
1053 1 3 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.552 -1.552 19718
1054 1 3 . 1 1 16 16 LYS H H 16 8.780 8.780 8.723 0.057 19718
1055 1 3 . 1 1 17 17 THR N N 17 120.000 120.000 119.369 0.631 19718
1056 1 3 . 1 1 17 17 THR HA H 17 5.220 5.220 4.956 0.264 19718
1057 1 3 . 1 1 17 17 THR C C 17 170.500 170.500 173.311 -2.811 19718
1058 1 3 . 1 1 17 17 THR CA C 17 58.700 58.700 60.963 -2.263 19718
1059 1 3 . 1 1 17 17 THR CB C 17 67.900 67.900 69.666 -1.766 19718
1060 1 3 . 1 1 17 17 THR H H 17 8.160 8.160 8.312 -0.152 19718
1061 1 3 . 1 1 18 18 TYR N N 18 125.600 125.600 126.454 -0.854 19718
1062 1 3 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.816 0.024 19718
1063 1 3 . 1 1 18 18 TYR CA C 18 53.000 53.000 55.200 -2.200 19718
1064 1 3 . 1 1 18 18 TYR CB C 18 39.100 39.100 42.657 -3.557 19718
1065 1 3 . 1 1 18 18 TYR H H 18 9.020 9.020 9.246 -0.226 19718
1066 1 3 . 1 1 19 19 GLU C C 19 174.200 174.200 175.723 -1.523 19718
1067 1 3 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.417 -3.517 19718
1068 1 3 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.054 -3.754 19718
1069 1 3 . 1 1 20 20 VAL N N 20 119.000 119.000 119.799 -0.799 19718
1070 1 3 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.616 0.224 19718
1071 1 3 . 1 1 20 20 VAL C C 20 171.200 171.200 173.723 -2.523 19718
1072 1 3 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.719 -3.119 19718
1073 1 3 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.332 -2.632 19718
1074 1 3 . 1 1 20 20 VAL H H 20 9.160 9.160 8.932 0.228 19718
1075 1 3 . 1 1 21 21 CYS N N 21 117.500 117.500 117.991 -0.491 19718
1076 1 3 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.799 -0.039 19718
1077 1 3 . 1 1 21 21 CYS C C 21 171.400 171.400 173.576 -2.176 19718
1078 1 3 . 1 1 21 21 CYS CA C 21 54.900 54.900 55.940 -1.040 19718
1079 1 3 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.126 -2.926 19718
1080 1 3 . 1 1 21 21 CYS H H 21 8.720 8.720 8.754 -0.034 19718
1081 1 3 . 1 1 22 22 GLU N N 22 120.900 120.900 121.573 -0.673 19718
1082 1 3 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.936 -0.526 19718
1083 1 3 . 1 1 22 22 GLU C C 22 174.300 174.300 177.454 -3.154 19718
1084 1 3 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.513 -3.413 19718
1085 1 3 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.831 -3.031 19718
1086 1 3 . 1 1 22 22 GLU H H 22 8.540 8.540 8.801 -0.261 19718
1087 1 3 . 1 1 23 23 GLY N N 23 112.400 112.400 115.100 -2.700 19718
1088 1 3 . 1 1 23 23 GLY C C 23 171.000 171.000 174.286 -3.286 19718
1089 1 3 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.035 -2.635 19718
1090 1 3 . 1 1 23 23 GLY H H 23 8.720 8.720 8.934 -0.214 19718
1091 1 3 . 1 1 24 24 GLU N N 24 119.600 119.600 121.547 -1.947 19718
1092 1 3 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.376 -0.046 19718
1093 1 3 . 1 1 24 24 GLU C C 24 174.400 174.400 175.716 -1.316 19718
1094 1 3 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.129 -2.029 19718
1095 1 3 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.564 -2.463 19718
1096 1 3 . 1 1 24 24 GLU H H 24 7.060 7.060 7.693 -0.633 19718
1097 1 3 . 1 1 25 25 THR N N 25 113.600 113.600 118.746 -5.146 19718
1098 1 3 . 1 1 25 25 THR HA H 25 5.510 5.510 4.789 0.721 19718
1099 1 3 . 1 1 25 25 THR C C 25 173.100 173.100 175.432 -2.332 19718
1100 1 3 . 1 1 25 25 THR CA C 25 57.000 57.000 61.517 -4.516 19718
1101 1 3 . 1 1 25 25 THR CB C 25 68.700 68.700 70.875 -2.175 19718
1102 1 3 . 1 1 25 25 THR H H 25 9.080 9.080 8.440 0.640 19718
1103 1 3 . 1 1 26 26 ILE N N 26 120.300 120.300 125.267 -4.967 19718
1104 1 3 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.891 -0.261 19718
1105 1 3 . 1 1 26 26 ILE C C 26 174.700 174.700 177.602 -2.902 19718
1106 1 3 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.802 -1.102 19718
1107 1 3 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.654 -4.654 19718
1108 1 3 . 1 1 26 26 ILE H H 26 7.860 7.860 8.342 -0.482 19718
1109 1 3 . 1 1 27 27 LEU N N 27 117.600 117.600 121.900 -4.300 19718
1110 1 3 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.951 -0.201 19718
1111 1 3 . 1 1 27 27 LEU C C 27 174.000 174.000 178.321 -4.321 19718
1112 1 3 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.694 -3.794 19718
1113 1 3 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.476 -2.176 19718
1114 1 3 . 1 1 27 27 LEU H H 27 6.580 6.580 8.330 -1.750 19718
1115 1 3 . 1 1 28 28 ASP N N 28 120.000 120.000 118.949 1.051 19718
1116 1 3 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.433 -0.183 19718
1117 1 3 . 1 1 28 28 ASP C C 28 177.900 177.900 178.966 -1.066 19718
1118 1 3 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.925 -2.925 19718
1119 1 3 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.668 -3.768 19718
1120 1 3 . 1 1 28 28 ASP H H 28 7.880 7.880 8.334 -0.454 19718
1121 1 3 . 1 1 29 29 ILE N N 29 122.100 122.100 120.850 1.250 19718
1122 1 3 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.951 -0.211 19718
1123 1 3 . 1 1 29 29 ILE C C 29 175.700 175.700 178.140 -2.440 19718
1124 1 3 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.158 -3.058 19718
1125 1 3 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.025 -1.525 19718
1126 1 3 . 1 1 29 29 ILE H H 29 8.340 8.340 8.494 -0.154 19718
1127 1 3 . 1 1 30 30 ALA N N 30 124.100 124.100 122.772 1.328 19718
1128 1 3 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.708 -0.368 19718
1129 1 3 . 1 1 30 30 ALA C C 30 177.600 177.600 179.561 -1.961 19718
1130 1 3 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.489 -2.689 19718
1131 1 3 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.067 -1.267 19718
1132 1 3 . 1 1 30 30 ALA H H 30 8.430 8.430 8.575 -0.145 19718
1133 1 3 . 1 1 31 31 GLN N N 31 116.000 116.000 117.738 -1.738 19718
1134 1 3 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.056 0.104 19718
1135 1 3 . 1 1 31 31 GLN C C 31 178.100 178.100 179.383 -1.283 19718
1136 1 3 . 1 1 31 31 GLN CA C 31 56.700 56.700 58.485 -1.785 19718
1137 1 3 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.894 -3.694 19718
1138 1 3 . 1 1 31 31 GLN H H 31 8.760 8.760 8.067 0.693 19718
1139 1 3 . 1 1 32 32 GLY N N 32 108.700 108.700 107.553 1.147 19718
1140 1 3 . 1 1 32 32 GLY C C 32 171.700 171.700 175.453 -3.753 19718
1141 1 3 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.760 -3.560 19718
1142 1 3 . 1 1 32 32 GLY H H 32 8.220 8.220 8.333 -0.113 19718
1143 1 3 . 1 1 33 33 HIS N N 33 115.000 115.000 119.092 -4.092 19718
1144 1 3 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.586 -0.156 19718
1145 1 3 . 1 1 33 33 HIS C C 33 169.800 169.800 174.642 -4.842 19718
1146 1 3 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.558 -3.158 19718
1147 1 3 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.393 -4.893 19718
1148 1 3 . 1 1 33 33 HIS H H 33 6.980 6.980 7.918 -0.938 19718
1149 1 3 . 1 1 34 34 ASN N N 34 113.700 113.700 116.400 -2.700 19718
1150 1 3 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.321 0.009 19718
1151 1 3 . 1 1 34 34 ASN C C 34 172.000 172.000 175.004 -3.004 19718
1152 1 3 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.779 -1.679 19718
1153 1 3 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.556 -2.556 19718
1154 1 3 . 1 1 34 34 ASN H H 34 7.700 7.700 8.069 -0.369 19718
1155 1 3 . 1 1 35 35 LEU N N 35 115.600 115.600 118.300 -2.700 19718
1156 1 3 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.196 0.054 19718
1157 1 3 . 1 1 35 35 LEU C C 35 174.900 174.900 177.195 -2.295 19718
1158 1 3 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.378 -4.078 19718
1159 1 3 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.406 -3.206 19718
1160 1 3 . 1 1 35 35 LEU H H 35 7.980 7.980 7.568 0.412 19718
1161 1 3 . 1 1 36 36 ASP N N 36 120.100 120.100 124.066 -3.966 19718
1162 1 3 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.600 -0.170 19718
1163 1 3 . 1 1 36 36 ASP C C 36 171.100 171.100 174.669 -3.569 19718
1164 1 3 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.482 -3.482 19718
1165 1 3 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.648 -3.449 19718
1166 1 3 . 1 1 36 36 ASP H H 36 8.610 8.610 8.582 0.028 19718
1167 1 3 . 1 1 37 37 MET N N 37 123.900 123.900 118.101 5.799 19718
1168 1 3 . 1 1 37 37 MET HA H 37 4.280 4.280 4.846 -0.566 19718
1169 1 3 . 1 1 37 37 MET C C 37 171.200 171.200 174.484 -3.284 19718
1170 1 3 . 1 1 37 37 MET CA C 37 52.800 52.800 54.288 -1.488 19718
1171 1 3 . 1 1 37 37 MET CB C 37 33.000 33.000 36.001 -3.001 19718
1172 1 3 . 1 1 37 37 MET H H 37 7.670 7.670 7.836 -0.166 19718
1173 1 3 . 1 1 38 38 GLU N N 38 128.600 128.600 122.178 6.422 19718
1174 1 3 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.636 -0.346 19718
1175 1 3 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.438 -3.238 19718
1176 1 3 . 1 1 38 38 GLU CB C 38 29.400 29.400 32.309 -2.909 19718
1177 1 3 . 1 1 38 38 GLU H H 38 9.060 9.060 8.553 0.507 19718
1178 1 3 . 1 1 51 51 HIS C C 51 170.700 170.700 174.308 -3.608 19718
1179 1 3 . 1 1 51 51 HIS CA C 51 52.800 52.800 53.919 -1.119 19718
1180 1 3 . 1 1 51 51 HIS CB C 51 27.700 27.700 27.651 0.049 19718
1181 1 3 . 1 1 53 53 ILE N N 53 122.200 122.200 120.101 2.099 19718
1182 1 3 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.848 -0.838 19718
1183 1 3 . 1 1 53 53 ILE C C 53 174.400 174.400 173.375 1.025 19718
1184 1 3 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.742 -0.042 19718
1185 1 3 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.536 -6.236 19718
1186 1 3 . 1 1 53 53 ILE H H 53 8.800 8.800 8.449 0.351 19718
1187 1 3 . 1 1 54 54 VAL N N 54 130.200 130.200 124.116 6.084 19718
1188 1 3 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.742 -0.872 19718
1189 1 3 . 1 1 54 54 VAL C C 54 172.500 172.500 174.538 -2.038 19718
1190 1 3 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.257 1.643 19718
1191 1 3 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.475 -5.875 19718
1192 1 3 . 1 1 54 54 VAL H H 54 8.380 8.380 8.747 -0.367 19718
1193 1 3 . 1 1 55 55 ASP N N 55 129.100 129.100 126.986 2.114 19718
1194 1 3 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.719 -0.129 19718
1195 1 3 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.577 -2.877 19718
1196 1 3 . 1 1 55 55 ASP CB C 55 40.500 40.500 42.043 -1.543 19718
1197 1 3 . 1 1 55 55 ASP H H 55 8.160 8.160 8.137 0.023 19718
1198 1 3 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.315 -0.145 19718
1199 1 3 . 1 1 56 56 PRO C C 56 174.900 174.900 176.946 -2.046 19718
1200 1 3 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.761 -1.761 19718
1201 1 3 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.786 -2.386 19718
1202 1 3 . 1 1 57 57 ASP N N 57 117.100 117.100 117.577 -0.477 19718
1203 1 3 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.396 -0.026 19718
1204 1 3 . 1 1 57 57 ASP C C 57 174.100 174.100 177.371 -3.271 19718
1205 1 3 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.552 -2.852 19718
1206 1 3 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.801 -4.001 19718
1207 1 3 . 1 1 57 57 ASP H H 57 9.110 9.110 8.820 0.290 19718
1208 1 3 . 1 1 58 58 TYR N N 58 115.800 115.800 117.008 -1.208 19718
1209 1 3 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.555 -0.195 19718
1210 1 3 . 1 1 58 58 TYR C C 58 173.200 173.200 177.650 -4.450 19718
1211 1 3 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.121 -2.421 19718
1212 1 3 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.139 -0.239 19718
1213 1 3 . 1 1 58 58 TYR H H 58 8.190 8.190 7.695 0.495 19718
1214 1 3 . 1 1 59 59 TYR N N 59 120.100 120.100 121.928 -1.828 19718
1215 1 3 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.175 -0.395 19718
1216 1 3 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.726 0.374 19718
1217 1 3 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.311 -1.911 19718
1218 1 3 . 1 1 59 59 TYR H H 59 7.420 7.420 8.340 -0.920 19718
1219 1 3 . 1 1 60 60 ASP N N 60 115.200 115.200 118.797 -3.597 19718
1220 1 3 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.466 -0.106 19718
1221 1 3 . 1 1 60 60 ASP C C 60 173.100 173.100 176.316 -3.216 19718
1222 1 3 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.979 -2.579 19718
1223 1 3 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.514 -3.014 19718
1224 1 3 . 1 1 60 60 ASP H H 60 8.440 8.440 8.259 0.181 19718
1225 1 3 . 1 1 61 61 ALA N N 61 120.200 120.200 120.562 -0.362 19718
1226 1 3 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.477 -0.297 19718
1227 1 3 . 1 1 61 61 ALA C C 61 175.000 175.000 177.356 -2.356 19718
1228 1 3 . 1 1 61 61 ALA CA C 61 49.300 49.300 51.828 -2.528 19718
1229 1 3 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.105 -3.905 19718
1230 1 3 . 1 1 61 61 ALA H H 61 7.300 7.300 7.545 -0.245 19718
1231 1 3 . 1 1 62 62 LEU N N 62 118.000 118.000 122.350 -4.350 19718
1232 1 3 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.678 -0.388 19718
1233 1 3 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.443 -2.343 19718
1234 1 3 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.216 -3.516 19718
1235 1 3 . 1 1 62 62 LEU H H 62 6.680 6.680 7.475 -0.795 19718
1236 1 3 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.484 -0.164 19718
1237 1 3 . 1 1 63 63 PRO C C 63 173.500 173.500 176.077 -2.577 19718
1238 1 3 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.039 -2.339 19718
1239 1 3 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.449 -3.949 19718
1240 1 3 . 1 1 64 64 GLU N N 64 124.500 124.500 118.725 5.775 19718
1241 1 3 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.560 -0.380 19718
1242 1 3 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.478 -1.978 19718
1243 1 3 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.157 -4.357 19718
1244 1 3 . 1 1 64 64 GLU H H 64 8.590 8.590 8.392 0.198 19718
1245 1 3 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.641 -0.471 19718
1246 1 3 . 1 1 65 65 PRO C C 65 174.900 174.900 176.041 -1.141 19718
1247 1 3 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.157 0.843 19718
1248 1 3 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.201 -4.701 19718
1249 1 3 . 1 1 66 66 GLU N N 66 123.300 123.300 119.984 3.316 19718
1250 1 3 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.125 0.205 19718
1251 1 3 . 1 1 66 66 GLU C C 66 174.200 174.200 177.706 -3.506 19718
1252 1 3 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.899 -4.399 19718
1253 1 3 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.508 -3.108 19718
1254 1 3 . 1 1 66 66 GLU H H 66 9.080 9.080 8.648 0.432 19718
1255 1 3 . 1 1 67 67 ASP N N 67 120.100 120.100 121.167 -1.067 19718
1256 1 3 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.413 -0.173 19718
1257 1 3 . 1 1 67 67 ASP C C 67 174.900 174.900 176.888 -1.988 19718
1258 1 3 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.743 -1.343 19718
1259 1 3 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.889 -3.089 19718
1260 1 3 . 1 1 67 67 ASP H H 67 8.690 8.690 8.708 -0.018 19718
1261 1 3 . 1 1 68 68 ASP N N 68 116.800 116.800 115.733 1.067 19718
1262 1 3 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.569 -0.329 19718
1263 1 3 . 1 1 68 68 ASP C C 68 175.500 175.500 177.495 -1.995 19718
1264 1 3 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.550 -1.250 19718
1265 1 3 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.895 -4.795 19718
1266 1 3 . 1 1 68 68 ASP H H 68 8.400 8.400 8.276 0.124 19718
1267 1 3 . 1 1 69 69 GLU N N 69 123.600 123.600 119.412 4.188 19718
1268 1 3 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.136 0.014 19718
1269 1 3 . 1 1 69 69 GLU C C 69 175.200 175.200 178.433 -3.233 19718
1270 1 3 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.747 -2.547 19718
1271 1 3 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.045 -4.045 19718
1272 1 3 . 1 1 69 69 GLU H H 69 7.530 7.530 7.851 -0.321 19718
1273 1 3 . 1 1 70 70 ASN N N 70 119.100 119.100 117.960 1.140 19718
1274 1 3 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.519 -0.159 19718
1275 1 3 . 1 1 70 70 ASN C C 70 175.200 175.200 176.640 -1.440 19718
1276 1 3 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.314 -1.614 19718
1277 1 3 . 1 1 70 70 ASN CB C 70 34.800 34.800 38.096 -3.296 19718
1278 1 3 . 1 1 70 70 ASN H H 70 7.960 7.960 8.610 -0.650 19718
1279 1 3 . 1 1 71 71 ASP N N 71 118.400 118.400 120.989 -2.589 19718
1280 1 3 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.337 -0.087 19718
1281 1 3 . 1 1 71 71 ASP C C 71 176.000 176.000 177.963 -1.963 19718
1282 1 3 . 1 1 71 71 ASP CA C 71 54.600 54.600 57.220 -2.620 19718
1283 1 3 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.896 -3.396 19718
1284 1 3 . 1 1 71 71 ASP H H 71 8.250 8.250 8.428 -0.178 19718
1285 1 3 . 1 1 72 72 MET N N 72 117.300 117.300 115.109 2.191 19718
1286 1 3 . 1 1 72 72 MET HA H 72 4.370 4.370 4.138 0.232 19718
1287 1 3 . 1 1 72 72 MET C C 72 177.800 177.800 177.257 0.543 19718
1288 1 3 . 1 1 72 72 MET CA C 72 53.700 53.700 58.012 -4.312 19718
1289 1 3 . 1 1 72 72 MET CB C 72 32.400 32.400 32.681 -0.281 19718
1290 1 3 . 1 1 72 72 MET H H 72 7.240 7.240 7.652 -0.412 19718
1291 1 3 . 1 1 73 73 LEU N N 73 123.000 123.000 117.055 5.945 19718
1292 1 3 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.242 -0.482 19718
1293 1 3 . 1 1 73 73 LEU C C 73 175.700 175.700 178.922 -3.222 19718
1294 1 3 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.208 -1.308 19718
1295 1 3 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.159 -4.059 19718
1296 1 3 . 1 1 73 73 LEU H H 73 8.600 8.600 7.246 1.354 19718
1297 1 3 . 1 1 74 74 ASP N N 74 118.500 118.500 118.693 -0.193 19718
1298 1 3 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.330 0.010 19718
1299 1 3 . 1 1 74 74 ASP C C 74 174.700 174.700 177.675 -2.975 19718
1300 1 3 . 1 1 74 74 ASP CA C 74 54.300 54.300 57.279 -2.979 19718
1301 1 3 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.598 -2.398 19718
1302 1 3 . 1 1 74 74 ASP H H 74 7.250 7.250 7.868 -0.618 19718
1303 1 3 . 1 1 75 75 LEU N N 75 116.300 116.300 117.566 -1.266 19718
1304 1 3 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.081 0.219 19718
1305 1 3 . 1 1 75 75 LEU C C 75 174.500 174.500 176.370 -1.870 19718
1306 1 3 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.886 -4.586 19718
1307 1 3 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.728 -2.128 19718
1308 1 3 . 1 1 75 75 LEU H H 75 7.000 7.000 7.317 -0.317 19718
1309 1 3 . 1 1 76 76 ALA N N 76 124.600 124.600 119.515 5.085 19718
1310 1 3 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.106 -0.006 19718
1311 1 3 . 1 1 76 76 ALA C C 76 174.200 174.200 175.581 -1.381 19718
1312 1 3 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.679 -1.179 19718
1313 1 3 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.115 -4.915 19718
1314 1 3 . 1 1 76 76 ALA H H 76 7.590 7.590 7.385 0.205 19718
1315 1 3 . 1 1 77 77 TYR N N 77 122.900 122.900 118.025 4.875 19718
1316 1 3 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.371 0.059 19718
1317 1 3 . 1 1 77 77 TYR C C 77 174.100 174.100 176.935 -2.835 19718
1318 1 3 . 1 1 77 77 TYR CA C 77 54.900 54.900 56.569 -1.669 19718
1319 1 3 . 1 1 77 77 TYR CB C 77 35.900 35.900 38.636 -2.736 19718
1320 1 3 . 1 1 77 77 TYR H H 77 8.150 8.150 6.279 1.871 19718
1321 1 3 . 1 1 78 78 GLY N N 78 112.900 112.900 110.291 2.609 19718
1322 1 3 . 1 1 78 78 GLY C C 78 171.800 171.800 174.366 -2.566 19718
1323 1 3 . 1 1 78 78 GLY CA C 78 43.700 43.700 45.411 -1.711 19718
1324 1 3 . 1 1 78 78 GLY H H 78 8.320 8.320 8.718 -0.398 19718
1325 1 3 . 1 1 79 79 LEU N N 79 119.300 119.300 119.445 -0.145 19718
1326 1 3 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.283 -0.493 19718
1327 1 3 . 1 1 79 79 LEU C C 79 174.000 174.000 176.790 -2.790 19718
1328 1 3 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.477 -1.477 19718
1329 1 3 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.754 -2.854 19718
1330 1 3 . 1 1 79 79 LEU H H 79 7.120 7.120 7.873 -0.753 19718
1331 1 3 . 1 1 80 80 THR N N 80 118.500 118.500 120.320 -1.820 19718
1332 1 3 . 1 1 80 80 THR HA H 80 4.860 4.860 4.466 0.394 19718
1333 1 3 . 1 1 80 80 THR C C 80 173.300 173.300 174.643 -1.343 19718
1334 1 3 . 1 1 80 80 THR CA C 80 57.600 57.600 60.420 -2.821 19718
1335 1 3 . 1 1 80 80 THR CB C 80 71.000 71.000 69.984 1.016 19718
1336 1 3 . 1 1 80 80 THR H H 80 9.240 9.240 7.732 1.508 19718
1337 1 3 . 1 1 81 81 GLU N N 81 118.000 118.000 120.407 -2.407 19718
1338 1 3 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.212 -0.102 19718
1339 1 3 . 1 1 81 81 GLU C C 81 173.900 173.900 176.007 -2.107 19718
1340 1 3 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.286 -2.886 19718
1341 1 3 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.452 -2.752 19718
1342 1 3 . 1 1 81 81 GLU H H 81 9.020 9.020 8.718 0.302 19718
1343 1 3 . 1 1 82 82 THR N N 82 106.400 106.400 107.762 -1.362 19718
1344 1 3 . 1 1 82 82 THR HA H 82 3.950 3.950 2.970 0.980 19718
1345 1 3 . 1 1 82 82 THR C C 82 171.700 171.700 173.447 -1.747 19718
1346 1 3 . 1 1 82 82 THR CA C 82 56.800 56.800 59.036 -2.236 19718
1347 1 3 . 1 1 82 82 THR CB C 82 63.800 63.800 67.991 -4.191 19718
1348 1 3 . 1 1 82 82 THR H H 82 7.630 7.630 7.459 0.171 19718
1349 1 3 . 1 1 83 83 SER N N 83 121.500 121.500 118.656 2.844 19718
1350 1 3 . 1 1 83 83 SER HA H 83 5.080 5.080 4.421 0.659 19718
1351 1 3 . 1 1 83 83 SER C C 83 170.900 170.900 174.097 -3.197 19718
1352 1 3 . 1 1 83 83 SER CA C 83 59.000 59.000 59.873 -0.873 19718
1353 1 3 . 1 1 83 83 SER CB C 83 61.700 61.700 63.830 -2.130 19718
1354 1 3 . 1 1 83 83 SER H H 83 6.930 6.930 8.017 -1.087 19718
1355 1 3 . 1 1 84 84 ARG N N 84 119.300 119.300 119.258 0.042 19718
1356 1 3 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.779 0.091 19718
1357 1 3 . 1 1 84 84 ARG C C 84 172.400 172.400 174.661 -2.261 19718
1358 1 3 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.236 -4.936 19718
1359 1 3 . 1 1 84 84 ARG CB C 84 32.400 32.400 35.151 -2.751 19718
1360 1 3 . 1 1 84 84 ARG H H 84 9.280 9.280 8.936 0.344 19718
1361 1 3 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.391 0.039 19718
1362 1 3 . 1 1 88 88 GLN C C 88 172.500 172.500 174.585 -2.085 19718
1363 1 3 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.447 -4.447 19718
1364 1 3 . 1 1 88 88 GLN CB C 88 27.000 27.000 28.146 -1.146 19718
1365 1 3 . 1 1 90 90 LYS N N 90 123.700 123.700 124.829 -1.129 19718
1366 1 3 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.010 -0.560 19718
1367 1 3 . 1 1 90 90 LYS C C 90 173.500 173.500 175.537 -2.037 19718
1368 1 3 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.855 -2.355 19718
1369 1 3 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.562 -2.662 19718
1370 1 3 . 1 1 90 90 LYS H H 90 8.330 8.330 8.082 0.248 19718
1371 1 3 . 1 1 91 91 MET N N 91 118.200 118.200 119.672 -1.472 19718
1372 1 3 . 1 1 91 91 MET HA H 91 4.330 4.330 4.570 -0.240 19718
1373 1 3 . 1 1 91 91 MET C C 91 174.300 174.300 176.371 -2.071 19718
1374 1 3 . 1 1 91 91 MET CA C 91 51.800 51.800 55.241 -3.441 19718
1375 1 3 . 1 1 91 91 MET CB C 91 27.200 27.200 31.734 -4.534 19718
1376 1 3 . 1 1 91 91 MET H H 91 8.620 8.620 8.587 0.033 19718
1377 1 3 . 1 1 92 92 SER N N 92 117.000 117.000 117.926 -0.926 19718
1378 1 3 . 1 1 92 92 SER HA H 92 4.610 4.610 4.784 -0.174 19718
1379 1 3 . 1 1 92 92 SER C C 92 171.300 171.300 175.176 -3.876 19718
1380 1 3 . 1 1 92 92 SER CA C 92 54.000 54.000 55.839 -1.839 19718
1381 1 3 . 1 1 92 92 SER CB C 92 63.700 63.700 66.368 -2.668 19718
1382 1 3 . 1 1 92 92 SER H H 92 6.970 6.970 8.186 -1.216 19718
1383 1 3 . 1 1 93 93 LYS N N 93 121.700 121.700 120.069 1.631 19718
1384 1 3 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.165 -0.195 19718
1385 1 3 . 1 1 93 93 LYS C C 93 175.200 175.200 177.035 -1.835 19718
1386 1 3 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.484 -1.784 19718
1387 1 3 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.649 -2.549 19718
1388 1 3 . 1 1 93 93 LYS H H 93 9.260 9.260 8.834 0.426 19718
1389 1 3 . 1 1 94 94 ASP N N 94 116.700 116.700 119.550 -2.850 19718
1390 1 3 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.644 -0.284 19718
1391 1 3 . 1 1 94 94 ASP C C 94 174.300 174.300 177.295 -2.995 19718
1392 1 3 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.076 -2.376 19718
1393 1 3 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.643 -3.743 19718
1394 1 3 . 1 1 94 94 ASP H H 94 8.020 8.020 7.708 0.312 19718
1395 1 3 . 1 1 95 95 ILE N N 95 109.000 109.000 113.001 -4.001 19718
1396 1 3 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.495 0.165 19718
1397 1 3 . 1 1 95 95 ILE C C 95 170.600 170.600 174.853 -4.253 19718
1398 1 3 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.341 -3.041 19718
1399 1 3 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.746 -3.546 19718
1400 1 3 . 1 1 95 95 ILE H H 95 7.240 7.240 7.571 -0.331 19718
1401 1 3 . 1 1 96 96 ASP N N 96 119.800 119.800 122.439 -2.639 19718
1402 1 3 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.417 -0.237 19718
1403 1 3 . 1 1 96 96 ASP C C 96 174.900 174.900 176.623 -1.723 19718
1404 1 3 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.961 -1.261 19718
1405 1 3 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.539 -0.539 19718
1406 1 3 . 1 1 96 96 ASP H H 96 6.950 6.950 8.246 -1.296 19718
1407 1 3 . 1 1 97 97 GLY N N 97 118.500 118.500 111.666 6.834 19718
1408 1 3 . 1 1 97 97 GLY C C 97 170.500 170.500 173.754 -3.254 19718
1409 1 3 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.465 -2.165 19718
1410 1 3 . 1 1 97 97 GLY H H 97 9.210 9.210 8.412 0.798 19718
1411 1 3 . 1 1 98 98 ILE N N 98 121.300 121.300 121.598 -0.298 19718
1412 1 3 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.088 2.512 19718
1413 1 3 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.911 -3.311 19718
1414 1 3 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.522 -3.822 19718
1415 1 3 . 1 1 98 98 ILE H H 98 7.660 7.660 8.191 -0.531 19718
1416 1 3 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.321 0.029 19718
1417 1 3 . 1 1 99 99 ARG C C 99 172.200 172.200 175.534 -3.334 19718
1418 1 3 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.218 -4.118 19718
1419 1 3 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.154 -2.654 19718
1420 1 3 . 1 1 100 100 VAL N N 100 114.900 114.900 115.833 -0.933 19718
1421 1 3 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.058 -0.238 19718
1422 1 3 . 1 1 100 100 VAL C C 100 169.600 169.600 173.430 -3.830 19718
1423 1 3 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.527 -4.327 19718
1424 1 3 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.496 -4.196 19718
1425 1 3 . 1 1 100 100 VAL H H 100 8.440 8.440 8.689 -0.249 19718
1426 1 3 . 1 1 101 101 ALA N N 101 123.400 123.400 123.501 -0.101 19718
1427 1 3 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.033 0.277 19718
1428 1 3 . 1 1 101 101 ALA C C 101 174.400 174.400 175.841 -1.441 19718
1429 1 3 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.105 -3.304 19718
1430 1 3 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.479 -2.679 19718
1431 1 3 . 1 1 101 101 ALA H H 101 9.040 9.040 8.972 0.068 19718
1432 1 3 . 1 1 102 102 LEU N N 102 120.600 120.600 119.147 1.453 19718
1433 1 3 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.258 -0.688 19718
1434 1 3 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.965 0.235 19718
1435 1 3 . 1 1 102 102 LEU CB C 102 37.900 37.900 41.418 -3.518 19718
1436 1 3 . 1 1 102 102 LEU H H 102 8.260 8.260 8.672 -0.412 19718
1437 1 3 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.714 -0.134 19718
1438 1 3 . 1 1 112 112 ASN C C 112 171.900 171.900 174.902 -3.002 19718
1439 1 3 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.862 -2.462 19718
1440 1 3 . 1 1 112 112 ASN CB C 112 36.700 36.700 38.925 -2.224 19718
1441 1 3 . 1 1 113 113 ASP N N 113 120.300 120.300 121.549 -1.249 19718
1442 1 3 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.301 0.139 19718
1443 1 3 . 1 1 113 113 ASP C C 113 173.000 173.000 175.630 -2.630 19718
1444 1 3 . 1 1 113 113 ASP CA C 113 51.600 51.600 55.254 -3.654 19718
1445 1 3 . 1 1 113 113 ASP CB C 113 38.100 38.100 39.775 -1.675 19718
1446 1 3 . 1 1 113 113 ASP H H 113 8.040 8.040 8.847 -0.807 19718
1447 1 3 . 1 1 114 114 PHE N N 114 120.100 120.100 118.125 1.975 19718
1448 1 3 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.665 -0.055 19718
1449 1 3 . 1 1 114 114 PHE C C 114 172.200 172.200 174.991 -2.791 19718
1450 1 3 . 1 1 114 114 PHE CA C 114 54.900 54.900 56.946 -2.046 19718
1451 1 3 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.083 -2.583 19718
1452 1 3 . 1 1 114 114 PHE H H 114 8.110 8.110 8.352 -0.242 19718
1453 1 4 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.391 -0.151 19718
1454 1 4 . 1 1 2 2 GLU C C 2 173.400 173.400 175.479 -2.079 19718
1455 1 4 . 1 1 2 2 GLU CA C 2 53.400 53.400 55.752 -2.352 19718
1456 1 4 . 1 1 2 2 GLU CB C 2 27.000 27.000 29.387 -2.387 19718
1457 1 4 . 1 1 3 3 GLU N N 3 121.200 121.200 124.186 -2.986 19718
1458 1 4 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.491 -0.111 19718
1459 1 4 . 1 1 3 3 GLU C C 3 173.000 173.000 175.867 -2.867 19718
1460 1 4 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.658 -2.258 19718
1461 1 4 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.566 -3.166 19718
1462 1 4 . 1 1 3 3 GLU H H 3 8.510 8.510 8.213 0.297 19718
1463 1 4 . 1 1 4 4 LEU N N 4 122.400 122.400 125.579 -3.179 19718
1464 1 4 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.765 -0.215 19718
1465 1 4 . 1 1 4 4 LEU C C 4 172.900 172.900 174.939 -2.039 19718
1466 1 4 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.322 -2.922 19718
1467 1 4 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.573 -4.873 19718
1468 1 4 . 1 1 4 4 LEU H H 4 8.460 8.460 8.942 -0.482 19718
1469 1 4 . 1 1 5 5 LYS N N 5 119.300 119.300 118.524 0.776 19718
1470 1 4 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.245 0.175 19718
1471 1 4 . 1 1 5 5 LYS C C 5 172.400 172.400 174.205 -1.805 19718
1472 1 4 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.847 -2.547 19718
1473 1 4 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.752 -3.752 19718
1474 1 4 . 1 1 5 5 LYS H H 5 8.570 8.570 8.157 0.413 19718
1475 1 4 . 1 1 6 6 ILE N N 6 116.900 116.900 121.465 -4.565 19718
1476 1 4 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.505 -0.395 19718
1477 1 4 . 1 1 6 6 ILE C C 6 169.800 169.800 173.371 -3.571 19718
1478 1 4 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.244 -3.744 19718
1479 1 4 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.008 -3.008 19718
1480 1 4 . 1 1 6 6 ILE H H 6 8.160 8.160 8.746 -0.586 19718
1481 1 4 . 1 1 7 7 THR N N 7 123.000 123.000 125.692 -2.692 19718
1482 1 4 . 1 1 7 7 THR HA H 7 5.220 5.220 4.967 0.253 19718
1483 1 4 . 1 1 7 7 THR C C 7 169.900 169.900 173.639 -3.739 19718
1484 1 4 . 1 1 7 7 THR CA C 7 58.400 58.400 62.074 -3.674 19718
1485 1 4 . 1 1 7 7 THR CB C 7 68.700 68.700 69.309 -0.609 19718
1486 1 4 . 1 1 7 7 THR H H 7 8.520 8.520 8.682 -0.162 19718
1487 1 4 . 1 1 8 8 PHE N N 8 124.000 124.000 124.697 -0.697 19718
1488 1 4 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.648 -0.498 19718
1489 1 4 . 1 1 8 8 PHE C C 8 172.300 172.300 175.209 -2.909 19718
1490 1 4 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.121 -1.521 19718
1491 1 4 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.040 -1.940 19718
1492 1 4 . 1 1 8 8 PHE H H 8 9.290 9.290 9.272 0.018 19718
1493 1 4 . 1 1 9 9 ILE N N 9 122.700 122.700 121.337 1.363 19718
1494 1 4 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.864 -0.284 19718
1495 1 4 . 1 1 9 9 ILE C C 9 173.600 173.600 176.033 -2.433 19718
1496 1 4 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.670 -2.470 19718
1497 1 4 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.506 -4.006 19718
1498 1 4 . 1 1 9 9 ILE H H 9 9.170 9.170 8.588 0.582 19718
1499 1 4 . 1 1 10 10 LEU N N 10 126.700 126.700 125.431 1.269 19718
1500 1 4 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.438 -0.118 19718
1501 1 4 . 1 1 10 10 LEU C C 10 176.500 176.500 178.898 -2.398 19718
1502 1 4 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.577 -2.377 19718
1503 1 4 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.366 -4.866 19718
1504 1 4 . 1 1 10 10 LEU H H 10 9.100 9.100 8.873 0.227 19718
1505 1 4 . 1 1 11 11 LYS N N 11 118.900 118.900 121.603 -2.703 19718
1506 1 4 . 1 1 11 11 LYS HA H 11 3.960 3.960 3.984 -0.024 19718
1507 1 4 . 1 1 11 11 LYS C C 11 174.100 174.100 177.596 -3.496 19718
1508 1 4 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.259 -1.859 19718
1509 1 4 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.433 -3.533 19718
1510 1 4 . 1 1 11 11 LYS H H 11 8.520 8.520 8.648 -0.128 19718
1511 1 4 . 1 1 12 12 ASP N N 12 114.400 114.400 113.949 0.451 19718
1512 1 4 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.565 -0.045 19718
1513 1 4 . 1 1 12 12 ASP C C 12 174.500 174.500 177.161 -2.661 19718
1514 1 4 . 1 1 12 12 ASP CA C 12 50.400 50.400 54.079 -3.679 19718
1515 1 4 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.565 -3.365 19718
1516 1 4 . 1 1 12 12 ASP H H 12 7.690 7.690 7.973 -0.283 19718
1517 1 4 . 1 1 13 13 GLY N N 13 109.200 109.200 107.661 1.539 19718
1518 1 4 . 1 1 13 13 GLY C C 13 171.600 171.600 175.114 -3.514 19718
1519 1 4 . 1 1 13 13 GLY CA C 13 42.400 42.400 44.883 -2.483 19718
1520 1 4 . 1 1 13 13 GLY H H 13 8.100 8.100 7.876 0.224 19718
1521 1 4 . 1 1 14 14 SER N N 14 118.000 118.000 117.794 0.206 19718
1522 1 4 . 1 1 14 14 SER HA H 14 4.280 4.280 4.356 -0.076 19718
1523 1 4 . 1 1 14 14 SER C C 14 169.000 169.000 173.451 -4.451 19718
1524 1 4 . 1 1 14 14 SER CA C 14 56.500 56.500 59.495 -2.995 19718
1525 1 4 . 1 1 14 14 SER CB C 14 61.000 61.000 63.781 -2.781 19718
1526 1 4 . 1 1 14 14 SER H H 14 8.110 8.110 8.513 -0.403 19718
1527 1 4 . 1 1 15 15 GLN N N 15 116.300 116.300 120.588 -4.288 19718
1528 1 4 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.221 0.439 19718
1529 1 4 . 1 1 15 15 GLN C C 15 173.500 173.500 176.252 -2.752 19718
1530 1 4 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.998 -3.298 19718
1531 1 4 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.078 -2.078 19718
1532 1 4 . 1 1 15 15 GLN H H 15 8.330 8.330 8.416 -0.086 19718
1533 1 4 . 1 1 16 16 LYS N N 16 122.500 122.500 125.004 -2.504 19718
1534 1 4 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.636 -0.306 19718
1535 1 4 . 1 1 16 16 LYS C C 16 171.300 171.300 174.511 -3.211 19718
1536 1 4 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.237 -3.337 19718
1537 1 4 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.714 -1.714 19718
1538 1 4 . 1 1 16 16 LYS H H 16 8.780 8.780 8.741 0.039 19718
1539 1 4 . 1 1 17 17 THR N N 17 120.000 120.000 119.253 0.747 19718
1540 1 4 . 1 1 17 17 THR HA H 17 5.220 5.220 4.982 0.238 19718
1541 1 4 . 1 1 17 17 THR C C 17 170.500 170.500 173.769 -3.269 19718
1542 1 4 . 1 1 17 17 THR CA C 17 58.700 58.700 60.926 -2.227 19718
1543 1 4 . 1 1 17 17 THR CB C 17 67.900 67.900 69.735 -1.835 19718
1544 1 4 . 1 1 17 17 THR H H 17 8.160 8.160 8.454 -0.294 19718
1545 1 4 . 1 1 18 18 TYR N N 18 125.600 125.600 127.600 -2.000 19718
1546 1 4 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.807 0.033 19718
1547 1 4 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.903 -1.903 19718
1548 1 4 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.746 -2.646 19718
1549 1 4 . 1 1 18 18 TYR H H 18 9.020 9.020 9.090 -0.070 19718
1550 1 4 . 1 1 19 19 GLU C C 19 174.200 174.200 175.827 -1.627 19718
1551 1 4 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.517 -3.617 19718
1552 1 4 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.547 -3.247 19718
1553 1 4 . 1 1 20 20 VAL N N 20 119.000 119.000 117.362 1.638 19718
1554 1 4 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.701 0.139 19718
1555 1 4 . 1 1 20 20 VAL C C 20 171.200 171.200 173.943 -2.743 19718
1556 1 4 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.947 -3.347 19718
1557 1 4 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.332 -1.632 19718
1558 1 4 . 1 1 20 20 VAL H H 20 9.160 9.160 8.585 0.575 19718
1559 1 4 . 1 1 21 21 CYS N N 21 117.500 117.500 118.458 -0.958 19718
1560 1 4 . 1 1 21 21 CYS HA H 21 4.760 4.760 5.428 -0.668 19718
1561 1 4 . 1 1 21 21 CYS C C 21 171.400 171.400 174.691 -3.291 19718
1562 1 4 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.160 -2.260 19718
1563 1 4 . 1 1 21 21 CYS CB C 21 27.200 27.200 31.800 -4.600 19718
1564 1 4 . 1 1 21 21 CYS H H 21 8.720 8.720 8.582 0.138 19718
1565 1 4 . 1 1 22 22 GLU N N 22 120.900 120.900 121.138 -0.238 19718
1566 1 4 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.966 -0.556 19718
1567 1 4 . 1 1 22 22 GLU C C 22 174.300 174.300 177.020 -2.720 19718
1568 1 4 . 1 1 22 22 GLU CA C 22 55.100 55.100 57.589 -2.489 19718
1569 1 4 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.602 -2.801 19718
1570 1 4 . 1 1 22 22 GLU H H 22 8.540 8.540 8.157 0.383 19718
1571 1 4 . 1 1 23 23 GLY N N 23 112.400 112.400 115.127 -2.727 19718
1572 1 4 . 1 1 23 23 GLY C C 23 171.000 171.000 174.286 -3.286 19718
1573 1 4 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.924 -2.524 19718
1574 1 4 . 1 1 23 23 GLY H H 23 8.720 8.720 8.902 -0.182 19718
1575 1 4 . 1 1 24 24 GLU N N 24 119.600 119.600 122.788 -3.188 19718
1576 1 4 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.408 -0.078 19718
1577 1 4 . 1 1 24 24 GLU C C 24 174.400 174.400 176.034 -1.634 19718
1578 1 4 . 1 1 24 24 GLU CA C 24 54.100 54.100 55.885 -1.785 19718
1579 1 4 . 1 1 24 24 GLU CB C 24 28.100 28.100 29.987 -1.887 19718
1580 1 4 . 1 1 24 24 GLU H H 24 7.060 7.060 7.742 -0.682 19718
1581 1 4 . 1 1 25 25 THR N N 25 113.600 113.600 119.123 -5.523 19718
1582 1 4 . 1 1 25 25 THR HA H 25 5.510 5.510 4.676 0.834 19718
1583 1 4 . 1 1 25 25 THR C C 25 173.100 173.100 175.590 -2.490 19718
1584 1 4 . 1 1 25 25 THR CA C 25 57.000 57.000 61.834 -4.834 19718
1585 1 4 . 1 1 25 25 THR CB C 25 68.700 68.700 70.405 -1.705 19718
1586 1 4 . 1 1 25 25 THR H H 25 9.080 9.080 8.383 0.697 19718
1587 1 4 . 1 1 26 26 ILE N N 26 120.300 120.300 125.258 -4.958 19718
1588 1 4 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.816 -0.186 19718
1589 1 4 . 1 1 26 26 ILE C C 26 174.700 174.700 177.517 -2.817 19718
1590 1 4 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.859 -1.159 19718
1591 1 4 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.737 -4.737 19718
1592 1 4 . 1 1 26 26 ILE H H 26 7.860 7.860 8.677 -0.817 19718
1593 1 4 . 1 1 27 27 LEU N N 27 117.600 117.600 121.216 -3.616 19718
1594 1 4 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.935 -0.185 19718
1595 1 4 . 1 1 27 27 LEU C C 27 174.000 174.000 177.956 -3.956 19718
1596 1 4 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.953 -4.053 19718
1597 1 4 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.472 -2.172 19718
1598 1 4 . 1 1 27 27 LEU H H 27 6.580 6.580 8.015 -1.435 19718
1599 1 4 . 1 1 28 28 ASP N N 28 120.000 120.000 119.543 0.457 19718
1600 1 4 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.398 -0.148 19718
1601 1 4 . 1 1 28 28 ASP C C 28 177.900 177.900 178.691 -0.791 19718
1602 1 4 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.792 -2.792 19718
1603 1 4 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.332 -3.432 19718
1604 1 4 . 1 1 28 28 ASP H H 28 7.880 7.880 8.486 -0.606 19718
1605 1 4 . 1 1 29 29 ILE N N 29 122.100 122.100 119.571 2.529 19718
1606 1 4 . 1 1 29 29 ILE HA H 29 3.740 3.740 4.096 -0.356 19718
1607 1 4 . 1 1 29 29 ILE C C 29 175.700 175.700 177.792 -2.092 19718
1608 1 4 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.109 -2.009 19718
1609 1 4 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.136 -1.636 19718
1610 1 4 . 1 1 29 29 ILE H H 29 8.340 8.340 8.049 0.291 19718
1611 1 4 . 1 1 30 30 ALA N N 30 124.100 124.100 124.083 0.017 19718
1612 1 4 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.731 -0.391 19718
1613 1 4 . 1 1 30 30 ALA C C 30 177.600 177.600 179.368 -1.768 19718
1614 1 4 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.694 -2.894 19718
1615 1 4 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.339 -1.539 19718
1616 1 4 . 1 1 30 30 ALA H H 30 8.430 8.430 8.667 -0.237 19718
1617 1 4 . 1 1 31 31 GLN N N 31 116.000 116.000 116.499 -0.499 19718
1618 1 4 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.221 -0.061 19718
1619 1 4 . 1 1 31 31 GLN C C 31 178.100 178.100 178.166 -0.066 19718
1620 1 4 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.454 -0.754 19718
1621 1 4 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.040 -3.840 19718
1622 1 4 . 1 1 31 31 GLN H H 31 8.760 8.760 8.476 0.284 19718
1623 1 4 . 1 1 32 32 GLY N N 32 108.700 108.700 106.982 1.718 19718
1624 1 4 . 1 1 32 32 GLY C C 32 171.700 171.700 175.015 -3.315 19718
1625 1 4 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.842 -2.642 19718
1626 1 4 . 1 1 32 32 GLY H H 32 8.220 8.220 8.090 0.130 19718
1627 1 4 . 1 1 33 33 HIS N N 33 115.000 115.000 119.531 -4.531 19718
1628 1 4 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.624 -0.194 19718
1629 1 4 . 1 1 33 33 HIS C C 33 169.800 169.800 174.611 -4.811 19718
1630 1 4 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.545 -3.145 19718
1631 1 4 . 1 1 33 33 HIS CB C 33 25.500 25.500 31.304 -5.804 19718
1632 1 4 . 1 1 33 33 HIS H H 33 6.980 6.980 7.938 -0.958 19718
1633 1 4 . 1 1 34 34 ASN N N 34 113.700 113.700 116.448 -2.748 19718
1634 1 4 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.314 0.016 19718
1635 1 4 . 1 1 34 34 ASN C C 34 172.000 172.000 175.011 -3.011 19718
1636 1 4 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.582 -1.482 19718
1637 1 4 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.389 -2.389 19718
1638 1 4 . 1 1 34 34 ASN H H 34 7.700 7.700 7.714 -0.014 19718
1639 1 4 . 1 1 35 35 LEU N N 35 115.600 115.600 118.818 -3.218 19718
1640 1 4 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.203 0.047 19718
1641 1 4 . 1 1 35 35 LEU C C 35 174.900 174.900 177.507 -2.607 19718
1642 1 4 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.421 -4.121 19718
1643 1 4 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.631 -3.431 19718
1644 1 4 . 1 1 35 35 LEU H H 35 7.980 7.980 7.892 0.088 19718
1645 1 4 . 1 1 36 36 ASP N N 36 120.100 120.100 124.403 -4.303 19718
1646 1 4 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.574 -0.144 19718
1647 1 4 . 1 1 36 36 ASP C C 36 171.100 171.100 174.501 -3.401 19718
1648 1 4 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.646 -3.646 19718
1649 1 4 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.739 -3.539 19718
1650 1 4 . 1 1 36 36 ASP H H 36 8.610 8.610 8.723 -0.113 19718
1651 1 4 . 1 1 37 37 MET N N 37 123.900 123.900 119.564 4.336 19718
1652 1 4 . 1 1 37 37 MET HA H 37 4.280 4.280 4.886 -0.606 19718
1653 1 4 . 1 1 37 37 MET C C 37 171.200 171.200 174.148 -2.948 19718
1654 1 4 . 1 1 37 37 MET CA C 37 52.800 52.800 54.840 -2.040 19718
1655 1 4 . 1 1 37 37 MET CB C 37 33.000 33.000 36.348 -3.348 19718
1656 1 4 . 1 1 37 37 MET H H 37 7.670 7.670 7.776 -0.106 19718
1657 1 4 . 1 1 38 38 GLU N N 38 128.600 128.600 120.875 7.725 19718
1658 1 4 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.639 -0.349 19718
1659 1 4 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.213 -2.013 19718
1660 1 4 . 1 1 38 38 GLU CB C 38 29.400 29.400 33.480 -4.080 19718
1661 1 4 . 1 1 38 38 GLU H H 38 9.060 9.060 8.640 0.420 19718
1662 1 4 . 1 1 51 51 HIS C C 51 170.700 170.700 175.017 -4.317 19718
1663 1 4 . 1 1 51 51 HIS CA C 51 52.800 52.800 54.309 -1.509 19718
1664 1 4 . 1 1 51 51 HIS CB C 51 27.700 27.700 31.255 -3.555 19718
1665 1 4 . 1 1 53 53 ILE N N 53 122.200 122.200 120.106 2.094 19718
1666 1 4 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.891 -0.881 19718
1667 1 4 . 1 1 53 53 ILE C C 53 174.400 174.400 173.654 0.746 19718
1668 1 4 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.434 0.266 19718
1669 1 4 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.966 -5.666 19718
1670 1 4 . 1 1 53 53 ILE H H 53 8.800 8.800 8.425 0.375 19718
1671 1 4 . 1 1 54 54 VAL N N 54 130.200 130.200 126.861 3.339 19718
1672 1 4 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.751 -0.881 19718
1673 1 4 . 1 1 54 54 VAL C C 54 172.500 172.500 174.834 -2.334 19718
1674 1 4 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.765 1.135 19718
1675 1 4 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.021 -5.421 19718
1676 1 4 . 1 1 54 54 VAL H H 54 8.380 8.380 8.727 -0.347 19718
1677 1 4 . 1 1 55 55 ASP N N 55 129.100 129.100 127.463 1.637 19718
1678 1 4 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.680 -0.090 19718
1679 1 4 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.566 -2.866 19718
1680 1 4 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.939 -1.439 19718
1681 1 4 . 1 1 55 55 ASP H H 55 8.160 8.160 8.146 0.014 19718
1682 1 4 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.300 -0.130 19718
1683 1 4 . 1 1 56 56 PRO C C 56 174.900 174.900 177.211 -2.311 19718
1684 1 4 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.654 -1.654 19718
1685 1 4 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.695 -2.295 19718
1686 1 4 . 1 1 57 57 ASP N N 57 117.100 117.100 117.436 -0.336 19718
1687 1 4 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.438 -0.068 19718
1688 1 4 . 1 1 57 57 ASP C C 57 174.100 174.100 178.057 -3.957 19718
1689 1 4 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.655 -2.955 19718
1690 1 4 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.894 -4.094 19718
1691 1 4 . 1 1 57 57 ASP H H 57 9.110 9.110 8.681 0.429 19718
1692 1 4 . 1 1 58 58 TYR N N 58 115.800 115.800 118.226 -2.426 19718
1693 1 4 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.487 -0.127 19718
1694 1 4 . 1 1 58 58 TYR C C 58 173.200 173.200 177.979 -4.779 19718
1695 1 4 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.320 -2.620 19718
1696 1 4 . 1 1 58 58 TYR CB C 58 38.900 38.900 38.999 -0.099 19718
1697 1 4 . 1 1 58 58 TYR H H 58 8.190 8.190 7.807 0.383 19718
1698 1 4 . 1 1 59 59 TYR N N 59 120.100 120.100 121.556 -1.456 19718
1699 1 4 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.187 -0.407 19718
1700 1 4 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.388 -0.288 19718
1701 1 4 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.307 -1.907 19718
1702 1 4 . 1 1 59 59 TYR H H 59 7.420 7.420 8.339 -0.919 19718
1703 1 4 . 1 1 60 60 ASP N N 60 115.200 115.200 118.511 -3.311 19718
1704 1 4 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.545 -0.185 19718
1705 1 4 . 1 1 60 60 ASP C C 60 173.100 173.100 176.087 -2.987 19718
1706 1 4 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.791 -2.391 19718
1707 1 4 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.508 -3.007 19718
1708 1 4 . 1 1 60 60 ASP H H 60 8.440 8.440 7.933 0.507 19718
1709 1 4 . 1 1 61 61 ALA N N 61 120.200 120.200 120.751 -0.551 19718
1710 1 4 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.446 -0.266 19718
1711 1 4 . 1 1 61 61 ALA C C 61 175.000 175.000 176.987 -1.987 19718
1712 1 4 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.150 -2.850 19718
1713 1 4 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.852 -3.652 19718
1714 1 4 . 1 1 61 61 ALA H H 61 7.300 7.300 7.635 -0.335 19718
1715 1 4 . 1 1 62 62 LEU N N 62 118.000 118.000 121.710 -3.710 19718
1716 1 4 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.648 -0.358 19718
1717 1 4 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.742 -2.642 19718
1718 1 4 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.046 -3.346 19718
1719 1 4 . 1 1 62 62 LEU H H 62 6.680 6.680 7.716 -1.036 19718
1720 1 4 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.527 -0.207 19718
1721 1 4 . 1 1 63 63 PRO C C 63 173.500 173.500 175.924 -2.424 19718
1722 1 4 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.076 -2.376 19718
1723 1 4 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.459 -3.958 19718
1724 1 4 . 1 1 64 64 GLU N N 64 124.500 124.500 120.252 4.248 19718
1725 1 4 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.472 -0.292 19718
1726 1 4 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.722 -2.222 19718
1727 1 4 . 1 1 64 64 GLU CB C 64 25.800 25.800 29.899 -4.099 19718
1728 1 4 . 1 1 64 64 GLU H H 64 8.590 8.590 8.416 0.174 19718
1729 1 4 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.482 -0.312 19718
1730 1 4 . 1 1 65 65 PRO C C 65 174.900 174.900 176.683 -1.783 19718
1731 1 4 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.583 0.417 19718
1732 1 4 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.485 -3.985 19718
1733 1 4 . 1 1 66 66 GLU N N 66 123.300 123.300 119.273 4.027 19718
1734 1 4 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.071 0.259 19718
1735 1 4 . 1 1 66 66 GLU C C 66 174.200 174.200 177.337 -3.137 19718
1736 1 4 . 1 1 66 66 GLU CA C 66 52.500 52.500 57.037 -4.537 19718
1737 1 4 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.297 -2.897 19718
1738 1 4 . 1 1 66 66 GLU H H 66 9.080 9.080 8.687 0.393 19718
1739 1 4 . 1 1 67 67 ASP N N 67 120.100 120.100 121.226 -1.126 19718
1740 1 4 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.570 -0.330 19718
1741 1 4 . 1 1 67 67 ASP C C 67 174.900 174.900 177.272 -2.372 19718
1742 1 4 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.617 -1.217 19718
1743 1 4 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.974 -3.174 19718
1744 1 4 . 1 1 67 67 ASP H H 67 8.690 8.690 8.832 -0.142 19718
1745 1 4 . 1 1 68 68 ASP N N 68 116.800 116.800 116.301 0.499 19718
1746 1 4 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.600 -0.360 19718
1747 1 4 . 1 1 68 68 ASP C C 68 175.500 175.500 177.228 -1.728 19718
1748 1 4 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.507 -1.206 19718
1749 1 4 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.970 -4.870 19718
1750 1 4 . 1 1 68 68 ASP H H 68 8.400 8.400 8.329 0.071 19718
1751 1 4 . 1 1 69 69 GLU N N 69 123.600 123.600 118.263 5.337 19718
1752 1 4 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.270 -0.120 19718
1753 1 4 . 1 1 69 69 GLU C C 69 175.200 175.200 178.362 -3.162 19718
1754 1 4 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.077 -1.877 19718
1755 1 4 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.728 -4.728 19718
1756 1 4 . 1 1 69 69 GLU H H 69 7.530 7.530 7.867 -0.337 19718
1757 1 4 . 1 1 70 70 ASN N N 70 119.100 119.100 119.072 0.028 19718
1758 1 4 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.451 -0.091 19718
1759 1 4 . 1 1 70 70 ASN C C 70 175.200 175.200 176.759 -1.559 19718
1760 1 4 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.862 -2.162 19718
1761 1 4 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.695 -2.895 19718
1762 1 4 . 1 1 70 70 ASN H H 70 7.960 7.960 8.775 -0.815 19718
1763 1 4 . 1 1 71 71 ASP N N 71 118.400 118.400 119.861 -1.461 19718
1764 1 4 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.429 -0.179 19718
1765 1 4 . 1 1 71 71 ASP C C 71 176.000 176.000 177.820 -1.820 19718
1766 1 4 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.953 -2.353 19718
1767 1 4 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.788 -3.288 19718
1768 1 4 . 1 1 71 71 ASP H H 71 8.250 8.250 8.153 0.097 19718
1769 1 4 . 1 1 72 72 MET N N 72 117.300 117.300 116.571 0.729 19718
1770 1 4 . 1 1 72 72 MET HA H 72 4.370 4.370 4.113 0.257 19718
1771 1 4 . 1 1 72 72 MET C C 72 177.800 177.800 177.357 0.443 19718
1772 1 4 . 1 1 72 72 MET CA C 72 53.700 53.700 58.469 -4.769 19718
1773 1 4 . 1 1 72 72 MET CB C 72 32.400 32.400 32.733 -0.333 19718
1774 1 4 . 1 1 72 72 MET H H 72 7.240 7.240 7.551 -0.311 19718
1775 1 4 . 1 1 73 73 LEU N N 73 123.000 123.000 119.622 3.378 19718
1776 1 4 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.087 -0.327 19718
1777 1 4 . 1 1 73 73 LEU C C 73 175.700 175.700 178.993 -3.293 19718
1778 1 4 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.132 -2.232 19718
1779 1 4 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.530 -3.430 19718
1780 1 4 . 1 1 73 73 LEU H H 73 8.600 8.600 7.188 1.412 19718
1781 1 4 . 1 1 74 74 ASP N N 74 118.500 118.500 119.144 -0.644 19718
1782 1 4 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.405 -0.065 19718
1783 1 4 . 1 1 74 74 ASP C C 74 174.700 174.700 177.916 -3.216 19718
1784 1 4 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.840 -2.540 19718
1785 1 4 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.384 -2.184 19718
1786 1 4 . 1 1 74 74 ASP H H 74 7.250 7.250 7.710 -0.460 19718
1787 1 4 . 1 1 75 75 LEU N N 75 116.300 116.300 118.125 -1.825 19718
1788 1 4 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.142 0.158 19718
1789 1 4 . 1 1 75 75 LEU C C 75 174.500 174.500 177.122 -2.622 19718
1790 1 4 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.718 -4.418 19718
1791 1 4 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.829 -2.229 19718
1792 1 4 . 1 1 75 75 LEU H H 75 7.000 7.000 7.310 -0.310 19718
1793 1 4 . 1 1 76 76 ALA N N 76 124.600 124.600 120.775 3.825 19718
1794 1 4 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.427 -0.327 19718
1795 1 4 . 1 1 76 76 ALA C C 76 174.200 174.200 176.094 -1.894 19718
1796 1 4 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.792 -1.292 19718
1797 1 4 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.488 -5.288 19718
1798 1 4 . 1 1 76 76 ALA H H 76 7.590 7.590 7.405 0.185 19718
1799 1 4 . 1 1 77 77 TYR N N 77 122.900 122.900 123.197 -0.297 19718
1800 1 4 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.285 0.145 19718
1801 1 4 . 1 1 77 77 TYR C C 77 174.100 174.100 177.238 -3.138 19718
1802 1 4 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.345 -4.445 19718
1803 1 4 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.236 -3.336 19718
1804 1 4 . 1 1 77 77 TYR H H 77 8.150 8.150 8.499 -0.349 19718
1805 1 4 . 1 1 78 78 GLY N N 78 112.900 112.900 113.335 -0.435 19718
1806 1 4 . 1 1 78 78 GLY C C 78 171.800 171.800 173.542 -1.742 19718
1807 1 4 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.396 -0.696 19718
1808 1 4 . 1 1 78 78 GLY H H 78 8.320 8.320 7.599 0.721 19718
1809 1 4 . 1 1 79 79 LEU N N 79 119.300 119.300 119.137 0.163 19718
1810 1 4 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.233 -0.443 19718
1811 1 4 . 1 1 79 79 LEU C C 79 174.000 174.000 176.520 -2.520 19718
1812 1 4 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.007 -1.007 19718
1813 1 4 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.576 -2.676 19718
1814 1 4 . 1 1 79 79 LEU H H 79 7.120 7.120 7.873 -0.753 19718
1815 1 4 . 1 1 80 80 THR N N 80 118.500 118.500 120.576 -2.076 19718
1816 1 4 . 1 1 80 80 THR HA H 80 4.860 4.860 4.416 0.444 19718
1817 1 4 . 1 1 80 80 THR C C 80 173.300 173.300 175.415 -2.115 19718
1818 1 4 . 1 1 80 80 THR CA C 80 57.600 57.600 60.949 -3.349 19718
1819 1 4 . 1 1 80 80 THR CB C 80 71.000 71.000 69.968 1.032 19718
1820 1 4 . 1 1 80 80 THR H H 80 9.240 9.240 7.947 1.293 19718
1821 1 4 . 1 1 81 81 GLU N N 81 118.000 118.000 120.341 -2.341 19718
1822 1 4 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.075 0.035 19718
1823 1 4 . 1 1 81 81 GLU C C 81 173.900 173.900 176.790 -2.890 19718
1824 1 4 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.703 -3.303 19718
1825 1 4 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.250 -2.550 19718
1826 1 4 . 1 1 81 81 GLU H H 81 9.020 9.020 8.793 0.227 19718
1827 1 4 . 1 1 82 82 THR N N 82 106.400 106.400 104.798 1.602 19718
1828 1 4 . 1 1 82 82 THR HA H 82 3.950 3.950 2.800 1.150 19718
1829 1 4 . 1 1 82 82 THR C C 82 171.700 171.700 173.822 -2.122 19718
1830 1 4 . 1 1 82 82 THR CA C 82 56.800 56.800 59.700 -2.900 19718
1831 1 4 . 1 1 82 82 THR CB C 82 63.800 63.800 68.733 -4.933 19718
1832 1 4 . 1 1 82 82 THR H H 82 7.630 7.630 7.415 0.215 19718
1833 1 4 . 1 1 83 83 SER N N 83 121.500 121.500 118.228 3.272 19718
1834 1 4 . 1 1 83 83 SER HA H 83 5.080 5.080 4.615 0.465 19718
1835 1 4 . 1 1 83 83 SER C C 83 170.900 170.900 174.325 -3.425 19718
1836 1 4 . 1 1 83 83 SER CA C 83 59.000 59.000 59.055 -0.055 19718
1837 1 4 . 1 1 83 83 SER CB C 83 61.700 61.700 63.919 -2.219 19718
1838 1 4 . 1 1 83 83 SER H H 83 6.930 6.930 7.521 -0.591 19718
1839 1 4 . 1 1 84 84 ARG N N 84 119.300 119.300 126.104 -6.804 19718
1840 1 4 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.884 -0.014 19718
1841 1 4 . 1 1 84 84 ARG C C 84 172.400 172.400 174.367 -1.967 19718
1842 1 4 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.265 -3.965 19718
1843 1 4 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.310 -1.910 19718
1844 1 4 . 1 1 84 84 ARG H H 84 9.280 9.280 9.233 0.047 19718
1845 1 4 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.253 0.177 19718
1846 1 4 . 1 1 88 88 GLN C C 88 172.500 172.500 176.015 -3.515 19718
1847 1 4 . 1 1 88 88 GLN CA C 88 51.000 51.000 57.043 -6.043 19718
1848 1 4 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.511 -2.511 19718
1849 1 4 . 1 1 90 90 LYS N N 90 123.700 123.700 126.372 -2.672 19718
1850 1 4 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.144 -0.694 19718
1851 1 4 . 1 1 90 90 LYS C C 90 173.500 173.500 175.435 -1.935 19718
1852 1 4 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.550 -2.050 19718
1853 1 4 . 1 1 90 90 LYS CB C 90 31.900 31.900 35.249 -3.349 19718
1854 1 4 . 1 1 90 90 LYS H H 90 8.330 8.330 8.007 0.323 19718
1855 1 4 . 1 1 91 91 MET N N 91 118.200 118.200 119.421 -1.221 19718
1856 1 4 . 1 1 91 91 MET HA H 91 4.330 4.330 4.688 -0.358 19718
1857 1 4 . 1 1 91 91 MET C C 91 174.300 174.300 175.603 -1.303 19718
1858 1 4 . 1 1 91 91 MET CA C 91 51.800 51.800 54.859 -3.059 19718
1859 1 4 . 1 1 91 91 MET CB C 91 27.200 27.200 32.493 -5.293 19718
1860 1 4 . 1 1 91 91 MET H H 91 8.620 8.620 8.522 0.098 19718
1861 1 4 . 1 1 92 92 SER N N 92 117.000 117.000 115.668 1.332 19718
1862 1 4 . 1 1 92 92 SER HA H 92 4.610 4.610 5.007 -0.397 19718
1863 1 4 . 1 1 92 92 SER C C 92 171.300 171.300 175.196 -3.896 19718
1864 1 4 . 1 1 92 92 SER CA C 92 54.000 54.000 57.009 -3.009 19718
1865 1 4 . 1 1 92 92 SER CB C 92 63.700 63.700 67.162 -3.462 19718
1866 1 4 . 1 1 92 92 SER H H 92 6.970 6.970 8.265 -1.295 19718
1867 1 4 . 1 1 93 93 LYS N N 93 121.700 121.700 122.761 -1.061 19718
1868 1 4 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.029 -0.059 19718
1869 1 4 . 1 1 93 93 LYS C C 93 175.200 175.200 177.804 -2.604 19718
1870 1 4 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.508 -2.808 19718
1871 1 4 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.225 -3.125 19718
1872 1 4 . 1 1 93 93 LYS H H 93 9.260 9.260 8.986 0.274 19718
1873 1 4 . 1 1 94 94 ASP N N 94 116.700 116.700 118.845 -2.145 19718
1874 1 4 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.603 -0.243 19718
1875 1 4 . 1 1 94 94 ASP C C 94 174.300 174.300 177.191 -2.891 19718
1876 1 4 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.692 -2.992 19718
1877 1 4 . 1 1 94 94 ASP CB C 94 37.900 37.900 40.583 -2.683 19718
1878 1 4 . 1 1 94 94 ASP H H 94 8.020 8.020 8.283 -0.263 19718
1879 1 4 . 1 1 95 95 ILE N N 95 109.000 109.000 113.281 -4.281 19718
1880 1 4 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.459 0.201 19718
1881 1 4 . 1 1 95 95 ILE C C 95 170.600 170.600 174.857 -4.257 19718
1882 1 4 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.412 -3.112 19718
1883 1 4 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.314 -3.114 19718
1884 1 4 . 1 1 95 95 ILE H H 95 7.240 7.240 7.618 -0.378 19718
1885 1 4 . 1 1 96 96 ASP N N 96 119.800 119.800 122.529 -2.729 19718
1886 1 4 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.426 -0.246 19718
1887 1 4 . 1 1 96 96 ASP C C 96 174.900 174.900 176.727 -1.827 19718
1888 1 4 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.101 -1.401 19718
1889 1 4 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.785 -0.785 19718
1890 1 4 . 1 1 96 96 ASP H H 96 6.950 6.950 7.707 -0.757 19718
1891 1 4 . 1 1 97 97 GLY N N 97 118.500 118.500 114.811 3.689 19718
1892 1 4 . 1 1 97 97 GLY C C 97 170.500 170.500 173.994 -3.494 19718
1893 1 4 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.388 -2.088 19718
1894 1 4 . 1 1 97 97 GLY H H 97 9.210 9.210 8.292 0.918 19718
1895 1 4 . 1 1 98 98 ILE N N 98 121.300 121.300 121.014 0.286 19718
1896 1 4 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.331 2.269 19718
1897 1 4 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.822 -3.222 19718
1898 1 4 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.661 -3.961 19718
1899 1 4 . 1 1 98 98 ILE H H 98 7.660 7.660 7.830 -0.170 19718
1900 1 4 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.292 0.058 19718
1901 1 4 . 1 1 99 99 ARG C C 99 172.200 172.200 175.078 -2.878 19718
1902 1 4 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.310 -4.210 19718
1903 1 4 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.336 -2.836 19718
1904 1 4 . 1 1 100 100 VAL N N 100 114.900 114.900 116.803 -1.903 19718
1905 1 4 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.091 -0.271 19718
1906 1 4 . 1 1 100 100 VAL C C 100 169.600 169.600 173.498 -3.898 19718
1907 1 4 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.850 -4.650 19718
1908 1 4 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.084 -3.784 19718
1909 1 4 . 1 1 100 100 VAL H H 100 8.440 8.440 8.809 -0.369 19718
1910 1 4 . 1 1 101 101 ALA N N 101 123.400 123.400 123.316 0.084 19718
1911 1 4 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.837 0.473 19718
1912 1 4 . 1 1 101 101 ALA C C 101 174.400 174.400 175.692 -1.292 19718
1913 1 4 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.871 -3.071 19718
1914 1 4 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.347 -2.547 19718
1915 1 4 . 1 1 101 101 ALA H H 101 9.040 9.040 8.770 0.270 19718
1916 1 4 . 1 1 102 102 LEU N N 102 120.600 120.600 120.946 -0.346 19718
1917 1 4 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.900 -0.330 19718
1918 1 4 . 1 1 102 102 LEU CA C 102 52.200 52.200 52.051 0.149 19718
1919 1 4 . 1 1 102 102 LEU CB C 102 37.900 37.900 45.929 -8.029 19718
1920 1 4 . 1 1 102 102 LEU H H 102 8.260 8.260 7.898 0.362 19718
1921 1 4 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.792 -0.212 19718
1922 1 4 . 1 1 112 112 ASN C C 112 171.900 171.900 174.352 -2.452 19718
1923 1 4 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.849 -2.449 19718
1924 1 4 . 1 1 112 112 ASN CB C 112 36.700 36.700 39.424 -2.724 19718
1925 1 4 . 1 1 113 113 ASP N N 113 120.300 120.300 118.049 2.251 19718
1926 1 4 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.954 -0.514 19718
1927 1 4 . 1 1 113 113 ASP C C 113 173.000 173.000 175.211 -2.211 19718
1928 1 4 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.118 -1.518 19718
1929 1 4 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.853 -2.753 19718
1930 1 4 . 1 1 113 113 ASP H H 113 8.040 8.040 8.665 -0.625 19718
1931 1 4 . 1 1 114 114 PHE N N 114 120.100 120.100 120.213 -0.113 19718
1932 1 4 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.452 0.158 19718
1933 1 4 . 1 1 114 114 PHE C C 114 172.200 172.200 175.885 -3.685 19718
1934 1 4 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.560 -3.660 19718
1935 1 4 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.978 -3.478 19718
1936 1 4 . 1 1 114 114 PHE H H 114 8.110 8.110 7.863 0.247 19718
1937 1 5 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.277 -0.037 19718
1938 1 5 . 1 1 2 2 GLU C C 2 173.400 173.400 176.229 -2.829 19718
1939 1 5 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.572 -3.172 19718
1940 1 5 . 1 1 2 2 GLU CB C 2 27.000 27.000 31.065 -4.065 19718
1941 1 5 . 1 1 3 3 GLU N N 3 121.200 121.200 121.584 -0.384 19718
1942 1 5 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.524 -0.144 19718
1943 1 5 . 1 1 3 3 GLU C C 3 173.000 173.000 176.039 -3.039 19718
1944 1 5 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.008 -1.608 19718
1945 1 5 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.747 -3.347 19718
1946 1 5 . 1 1 3 3 GLU H H 3 8.510 8.510 8.506 0.004 19718
1947 1 5 . 1 1 4 4 LEU N N 4 122.400 122.400 124.420 -2.020 19718
1948 1 5 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.988 -0.438 19718
1949 1 5 . 1 1 4 4 LEU C C 4 172.900 172.900 175.337 -2.437 19718
1950 1 5 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.534 -3.134 19718
1951 1 5 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.655 -3.955 19718
1952 1 5 . 1 1 4 4 LEU H H 4 8.460 8.460 8.897 -0.437 19718
1953 1 5 . 1 1 5 5 LYS N N 5 119.300 119.300 120.995 -1.695 19718
1954 1 5 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.508 -0.088 19718
1955 1 5 . 1 1 5 5 LYS C C 5 172.400 172.400 174.894 -2.494 19718
1956 1 5 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.391 -2.091 19718
1957 1 5 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.055 -3.055 19718
1958 1 5 . 1 1 5 5 LYS H H 5 8.570 8.570 8.461 0.109 19718
1959 1 5 . 1 1 6 6 ILE N N 6 116.900 116.900 121.992 -5.092 19718
1960 1 5 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.594 -0.484 19718
1961 1 5 . 1 1 6 6 ILE C C 6 169.800 169.800 173.421 -3.621 19718
1962 1 5 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.392 -3.893 19718
1963 1 5 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.205 -3.205 19718
1964 1 5 . 1 1 6 6 ILE H H 6 8.160 8.160 8.971 -0.811 19718
1965 1 5 . 1 1 7 7 THR N N 7 123.000 123.000 125.429 -2.429 19718
1966 1 5 . 1 1 7 7 THR HA H 7 5.220 5.220 4.995 0.225 19718
1967 1 5 . 1 1 7 7 THR C C 7 169.900 169.900 173.525 -3.625 19718
1968 1 5 . 1 1 7 7 THR CA C 7 58.400 58.400 61.305 -2.905 19718
1969 1 5 . 1 1 7 7 THR CB C 7 68.700 68.700 69.642 -0.942 19718
1970 1 5 . 1 1 7 7 THR H H 7 8.520 8.520 8.596 -0.076 19718
1971 1 5 . 1 1 8 8 PHE N N 8 124.000 124.000 124.328 -0.328 19718
1972 1 5 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.441 -0.291 19718
1973 1 5 . 1 1 8 8 PHE C C 8 172.300 172.300 175.129 -2.829 19718
1974 1 5 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.553 -1.953 19718
1975 1 5 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.268 -2.168 19718
1976 1 5 . 1 1 8 8 PHE H H 8 9.290 9.290 9.274 0.016 19718
1977 1 5 . 1 1 9 9 ILE N N 9 122.700 122.700 122.109 0.591 19718
1978 1 5 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.659 -0.079 19718
1979 1 5 . 1 1 9 9 ILE C C 9 173.600 173.600 176.060 -2.460 19718
1980 1 5 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.786 -2.586 19718
1981 1 5 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.993 -3.493 19718
1982 1 5 . 1 1 9 9 ILE H H 9 9.170 9.170 8.221 0.949 19718
1983 1 5 . 1 1 10 10 LEU N N 10 126.700 126.700 127.820 -1.120 19718
1984 1 5 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.206 0.114 19718
1985 1 5 . 1 1 10 10 LEU C C 10 176.500 176.500 178.916 -2.416 19718
1986 1 5 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.328 -3.128 19718
1987 1 5 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.178 -4.678 19718
1988 1 5 . 1 1 10 10 LEU H H 10 9.100 9.100 8.835 0.265 19718
1989 1 5 . 1 1 11 11 LYS N N 11 118.900 118.900 122.502 -3.602 19718
1990 1 5 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.102 -0.142 19718
1991 1 5 . 1 1 11 11 LYS C C 11 174.100 174.100 177.275 -3.175 19718
1992 1 5 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.775 -1.375 19718
1993 1 5 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.335 -3.435 19718
1994 1 5 . 1 1 11 11 LYS H H 11 8.520 8.520 8.896 -0.376 19718
1995 1 5 . 1 1 12 12 ASP N N 12 114.400 114.400 116.178 -1.778 19718
1996 1 5 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.672 -0.152 19718
1997 1 5 . 1 1 12 12 ASP C C 12 174.500 174.500 177.034 -2.534 19718
1998 1 5 . 1 1 12 12 ASP CA C 12 50.400 50.400 54.199 -3.799 19718
1999 1 5 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.430 -3.230 19718
2000 1 5 . 1 1 12 12 ASP H H 12 7.690 7.690 7.950 -0.260 19718
2001 1 5 . 1 1 13 13 GLY N N 13 109.200 109.200 108.602 0.598 19718
2002 1 5 . 1 1 13 13 GLY C C 13 171.600 171.600 174.665 -3.065 19718
2003 1 5 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.451 -3.051 19718
2004 1 5 . 1 1 13 13 GLY H H 13 8.100 8.100 7.873 0.227 19718
2005 1 5 . 1 1 14 14 SER N N 14 118.000 118.000 116.301 1.699 19718
2006 1 5 . 1 1 14 14 SER HA H 14 4.280 4.280 4.407 -0.127 19718
2007 1 5 . 1 1 14 14 SER C C 14 169.000 169.000 173.875 -4.875 19718
2008 1 5 . 1 1 14 14 SER CA C 14 56.500 56.500 58.854 -2.354 19718
2009 1 5 . 1 1 14 14 SER CB C 14 61.000 61.000 63.824 -2.824 19718
2010 1 5 . 1 1 14 14 SER H H 14 8.110 8.110 7.916 0.194 19718
2011 1 5 . 1 1 15 15 GLN N N 15 116.300 116.300 120.014 -3.714 19718
2012 1 5 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.284 0.376 19718
2013 1 5 . 1 1 15 15 GLN C C 15 173.500 173.500 175.959 -2.459 19718
2014 1 5 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.989 -3.289 19718
2015 1 5 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.282 -2.282 19718
2016 1 5 . 1 1 15 15 GLN H H 15 8.330 8.330 8.506 -0.176 19718
2017 1 5 . 1 1 16 16 LYS N N 16 122.500 122.500 124.881 -2.381 19718
2018 1 5 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.636 -0.306 19718
2019 1 5 . 1 1 16 16 LYS C C 16 171.300 171.300 174.556 -3.256 19718
2020 1 5 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.273 -3.373 19718
2021 1 5 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.557 -1.557 19718
2022 1 5 . 1 1 16 16 LYS H H 16 8.780 8.780 8.665 0.115 19718
2023 1 5 . 1 1 17 17 THR N N 17 120.000 120.000 120.112 -0.112 19718
2024 1 5 . 1 1 17 17 THR HA H 17 5.220 5.220 4.980 0.240 19718
2025 1 5 . 1 1 17 17 THR C C 17 170.500 170.500 173.761 -3.261 19718
2026 1 5 . 1 1 17 17 THR CA C 17 58.700 58.700 60.830 -2.130 19718
2027 1 5 . 1 1 17 17 THR CB C 17 67.900 67.900 69.445 -1.545 19718
2028 1 5 . 1 1 17 17 THR H H 17 8.160 8.160 8.477 -0.317 19718
2029 1 5 . 1 1 18 18 TYR N N 18 125.600 125.600 127.085 -1.485 19718
2030 1 5 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.862 -0.022 19718
2031 1 5 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.910 -1.910 19718
2032 1 5 . 1 1 18 18 TYR CB C 18 39.100 39.100 42.393 -3.293 19718
2033 1 5 . 1 1 18 18 TYR H H 18 9.020 9.020 9.131 -0.111 19718
2034 1 5 . 1 1 19 19 GLU C C 19 174.200 174.200 175.632 -1.432 19718
2035 1 5 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.227 -2.327 19718
2036 1 5 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.762 -4.462 19718
2037 1 5 . 1 1 20 20 VAL N N 20 119.000 119.000 118.026 0.974 19718
2038 1 5 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.631 0.209 19718
2039 1 5 . 1 1 20 20 VAL C C 20 171.200 171.200 174.209 -3.009 19718
2040 1 5 . 1 1 20 20 VAL CA C 20 56.600 56.600 60.021 -3.421 19718
2041 1 5 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.815 -2.115 19718
2042 1 5 . 1 1 20 20 VAL H H 20 9.160 9.160 9.282 -0.122 19718
2043 1 5 . 1 1 21 21 CYS N N 21 117.500 117.500 120.328 -2.828 19718
2044 1 5 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.693 0.067 19718
2045 1 5 . 1 1 21 21 CYS C C 21 171.400 171.400 175.313 -3.913 19718
2046 1 5 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.427 -2.527 19718
2047 1 5 . 1 1 21 21 CYS CB C 21 27.200 27.200 29.666 -2.466 19718
2048 1 5 . 1 1 21 21 CYS H H 21 8.720 8.720 8.637 0.083 19718
2049 1 5 . 1 1 22 22 GLU N N 22 120.900 120.900 123.759 -2.859 19718
2050 1 5 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.996 -0.586 19718
2051 1 5 . 1 1 22 22 GLU C C 22 174.300 174.300 176.943 -2.643 19718
2052 1 5 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.348 -3.248 19718
2053 1 5 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.889 -3.088 19718
2054 1 5 . 1 1 22 22 GLU H H 22 8.540 8.540 8.861 -0.321 19718
2055 1 5 . 1 1 23 23 GLY N N 23 112.400 112.400 115.063 -2.663 19718
2056 1 5 . 1 1 23 23 GLY C C 23 171.000 171.000 174.510 -3.510 19718
2057 1 5 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.916 -2.516 19718
2058 1 5 . 1 1 23 23 GLY H H 23 8.720 8.720 8.854 -0.134 19718
2059 1 5 . 1 1 24 24 GLU N N 24 119.600 119.600 122.072 -2.472 19718
2060 1 5 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.378 -0.048 19718
2061 1 5 . 1 1 24 24 GLU C C 24 174.400 174.400 176.345 -1.945 19718
2062 1 5 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.758 -2.658 19718
2063 1 5 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.000 -1.900 19718
2064 1 5 . 1 1 24 24 GLU H H 24 7.060 7.060 7.728 -0.668 19718
2065 1 5 . 1 1 25 25 THR N N 25 113.600 113.600 118.445 -4.845 19718
2066 1 5 . 1 1 25 25 THR HA H 25 5.510 5.510 4.734 0.776 19718
2067 1 5 . 1 1 25 25 THR C C 25 173.100 173.100 175.623 -2.523 19718
2068 1 5 . 1 1 25 25 THR CA C 25 57.000 57.000 61.431 -4.431 19718
2069 1 5 . 1 1 25 25 THR CB C 25 68.700 68.700 70.441 -1.740 19718
2070 1 5 . 1 1 25 25 THR H H 25 9.080 9.080 8.491 0.589 19718
2071 1 5 . 1 1 26 26 ILE N N 26 120.300 120.300 123.294 -2.994 19718
2072 1 5 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.914 -0.284 19718
2073 1 5 . 1 1 26 26 ILE C C 26 174.700 174.700 177.842 -3.142 19718
2074 1 5 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.115 0.585 19718
2075 1 5 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.753 -3.753 19718
2076 1 5 . 1 1 26 26 ILE H H 26 7.860 7.860 8.182 -0.322 19718
2077 1 5 . 1 1 27 27 LEU N N 27 117.600 117.600 120.778 -3.178 19718
2078 1 5 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.011 -0.261 19718
2079 1 5 . 1 1 27 27 LEU C C 27 174.000 174.000 177.901 -3.901 19718
2080 1 5 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.920 -3.020 19718
2081 1 5 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.681 -2.381 19718
2082 1 5 . 1 1 27 27 LEU H H 27 6.580 6.580 8.105 -1.525 19718
2083 1 5 . 1 1 28 28 ASP N N 28 120.000 120.000 120.008 -0.008 19718
2084 1 5 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.461 -0.211 19718
2085 1 5 . 1 1 28 28 ASP C C 28 177.900 177.900 178.802 -0.902 19718
2086 1 5 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.553 -2.553 19718
2087 1 5 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.637 -3.737 19718
2088 1 5 . 1 1 28 28 ASP H H 28 7.880 7.880 8.277 -0.397 19718
2089 1 5 . 1 1 29 29 ILE N N 29 122.100 122.100 121.120 0.980 19718
2090 1 5 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.996 -0.256 19718
2091 1 5 . 1 1 29 29 ILE C C 29 175.700 175.700 177.622 -1.922 19718
2092 1 5 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.351 -2.251 19718
2093 1 5 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.952 -1.452 19718
2094 1 5 . 1 1 29 29 ILE H H 29 8.340 8.340 8.241 0.099 19718
2095 1 5 . 1 1 30 30 ALA N N 30 124.100 124.100 124.156 -0.056 19718
2096 1 5 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.677 -0.337 19718
2097 1 5 . 1 1 30 30 ALA C C 30 177.600 177.600 179.418 -1.818 19718
2098 1 5 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.637 -2.837 19718
2099 1 5 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.080 -1.280 19718
2100 1 5 . 1 1 30 30 ALA H H 30 8.430 8.430 8.261 0.169 19718
2101 1 5 . 1 1 31 31 GLN N N 31 116.000 116.000 116.685 -0.685 19718
2102 1 5 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.252 -0.092 19718
2103 1 5 . 1 1 31 31 GLN C C 31 178.100 178.100 179.031 -0.931 19718
2104 1 5 . 1 1 31 31 GLN CA C 31 56.700 56.700 58.100 -1.401 19718
2105 1 5 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.696 -3.496 19718
2106 1 5 . 1 1 31 31 GLN H H 31 8.760 8.760 8.453 0.307 19718
2107 1 5 . 1 1 32 32 GLY N N 32 108.700 108.700 107.385 1.315 19718
2108 1 5 . 1 1 32 32 GLY C C 32 171.700 171.700 175.191 -3.491 19718
2109 1 5 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.421 -3.221 19718
2110 1 5 . 1 1 32 32 GLY H H 32 8.220 8.220 7.871 0.349 19718
2111 1 5 . 1 1 33 33 HIS N N 33 115.000 115.000 119.006 -4.006 19718
2112 1 5 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.698 -0.268 19718
2113 1 5 . 1 1 33 33 HIS C C 33 169.800 169.800 174.443 -4.643 19718
2114 1 5 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.507 -3.107 19718
2115 1 5 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.861 -5.361 19718
2116 1 5 . 1 1 33 33 HIS H H 33 6.980 6.980 7.982 -1.002 19718
2117 1 5 . 1 1 34 34 ASN N N 34 113.700 113.700 117.414 -3.714 19718
2118 1 5 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.527 -0.197 19718
2119 1 5 . 1 1 34 34 ASN C C 34 172.000 172.000 175.232 -3.232 19718
2120 1 5 . 1 1 34 34 ASN CA C 34 52.100 52.100 54.238 -2.138 19718
2121 1 5 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.693 -2.693 19718
2122 1 5 . 1 1 34 34 ASN H H 34 7.700 7.700 7.607 0.093 19718
2123 1 5 . 1 1 35 35 LEU N N 35 115.600 115.600 119.113 -3.513 19718
2124 1 5 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.216 0.034 19718
2125 1 5 . 1 1 35 35 LEU C C 35 174.900 174.900 176.362 -1.462 19718
2126 1 5 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.853 -4.553 19718
2127 1 5 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.205 -3.005 19718
2128 1 5 . 1 1 35 35 LEU H H 35 7.980 7.980 7.714 0.266 19718
2129 1 5 . 1 1 36 36 ASP N N 36 120.100 120.100 125.776 -5.676 19718
2130 1 5 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.788 -0.358 19718
2131 1 5 . 1 1 36 36 ASP C C 36 171.100 171.100 175.139 -4.039 19718
2132 1 5 . 1 1 36 36 ASP CA C 36 51.000 51.000 53.464 -2.463 19718
2133 1 5 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.819 -3.619 19718
2134 1 5 . 1 1 36 36 ASP H H 36 8.610 8.610 8.662 -0.053 19718
2135 1 5 . 1 1 37 37 MET N N 37 123.900 123.900 122.084 1.816 19718
2136 1 5 . 1 1 37 37 MET HA H 37 4.280 4.280 4.803 -0.523 19718
2137 1 5 . 1 1 37 37 MET C C 37 171.200 171.200 175.752 -4.552 19718
2138 1 5 . 1 1 37 37 MET CA C 37 52.800 52.800 55.083 -2.283 19718
2139 1 5 . 1 1 37 37 MET CB C 37 33.000 33.000 34.022 -1.022 19718
2140 1 5 . 1 1 37 37 MET H H 37 7.670 7.670 7.526 0.144 19718
2141 1 5 . 1 1 38 38 GLU N N 38 128.600 128.600 123.364 5.236 19718
2142 1 5 . 1 1 38 38 GLU HA H 38 4.290 4.290 3.852 0.438 19718
2143 1 5 . 1 1 38 38 GLU CA C 38 53.200 53.200 58.268 -5.068 19718
2144 1 5 . 1 1 38 38 GLU CB C 38 29.400 29.400 29.265 0.136 19718
2145 1 5 . 1 1 38 38 GLU H H 38 9.060 9.060 8.902 0.158 19718
2146 1 5 . 1 1 51 51 HIS C C 51 170.700 170.700 172.546 -1.846 19718
2147 1 5 . 1 1 51 51 HIS CA C 51 52.800 52.800 53.894 -1.094 19718
2148 1 5 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.881 -1.181 19718
2149 1 5 . 1 1 53 53 ILE N N 53 122.200 122.200 120.891 1.309 19718
2150 1 5 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.917 -0.907 19718
2151 1 5 . 1 1 53 53 ILE C C 53 174.400 174.400 173.167 1.233 19718
2152 1 5 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.684 0.016 19718
2153 1 5 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.486 -6.186 19718
2154 1 5 . 1 1 53 53 ILE H H 53 8.800 8.800 8.846 -0.046 19718
2155 1 5 . 1 1 54 54 VAL N N 54 130.200 130.200 125.221 4.979 19718
2156 1 5 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.778 -0.908 19718
2157 1 5 . 1 1 54 54 VAL C C 54 172.500 172.500 174.609 -2.109 19718
2158 1 5 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.319 1.581 19718
2159 1 5 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.386 -5.786 19718
2160 1 5 . 1 1 54 54 VAL H H 54 8.380 8.380 8.697 -0.317 19718
2161 1 5 . 1 1 55 55 ASP N N 55 129.100 129.100 126.934 2.166 19718
2162 1 5 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.687 -0.097 19718
2163 1 5 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.628 -2.928 19718
2164 1 5 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.894 -1.394 19718
2165 1 5 . 1 1 55 55 ASP H H 55 8.160 8.160 8.118 0.042 19718
2166 1 5 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.259 -0.089 19718
2167 1 5 . 1 1 56 56 PRO C C 56 174.900 174.900 177.627 -2.727 19718
2168 1 5 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.919 -1.919 19718
2169 1 5 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.733 -2.333 19718
2170 1 5 . 1 1 57 57 ASP N N 57 117.100 117.100 117.642 -0.542 19718
2171 1 5 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.375 -0.005 19718
2172 1 5 . 1 1 57 57 ASP C C 57 174.100 174.100 177.222 -3.122 19718
2173 1 5 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.757 -3.057 19718
2174 1 5 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.713 -3.913 19718
2175 1 5 . 1 1 57 57 ASP H H 57 9.110 9.110 8.651 0.459 19718
2176 1 5 . 1 1 58 58 TYR N N 58 115.800 115.800 116.982 -1.182 19718
2177 1 5 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.449 -0.089 19718
2178 1 5 . 1 1 58 58 TYR C C 58 173.200 173.200 177.858 -4.658 19718
2179 1 5 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.059 -2.359 19718
2180 1 5 . 1 1 58 58 TYR CB C 58 38.900 38.900 38.923 -0.023 19718
2181 1 5 . 1 1 58 58 TYR H H 58 8.190 8.190 7.723 0.467 19718
2182 1 5 . 1 1 59 59 TYR N N 59 120.100 120.100 121.751 -1.651 19718
2183 1 5 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.153 -0.373 19718
2184 1 5 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.414 -0.314 19718
2185 1 5 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.437 -2.037 19718
2186 1 5 . 1 1 59 59 TYR H H 59 7.420 7.420 8.398 -0.978 19718
2187 1 5 . 1 1 60 60 ASP N N 60 115.200 115.200 118.526 -3.326 19718
2188 1 5 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.540 -0.180 19718
2189 1 5 . 1 1 60 60 ASP C C 60 173.100 173.100 176.271 -3.171 19718
2190 1 5 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.595 -2.195 19718
2191 1 5 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.295 -2.795 19718
2192 1 5 . 1 1 60 60 ASP H H 60 8.440 8.440 8.469 -0.029 19718
2193 1 5 . 1 1 61 61 ALA N N 61 120.200 120.200 120.648 -0.448 19718
2194 1 5 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.390 -0.210 19718
2195 1 5 . 1 1 61 61 ALA C C 61 175.000 175.000 177.027 -2.027 19718
2196 1 5 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.101 -2.801 19718
2197 1 5 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.020 -3.820 19718
2198 1 5 . 1 1 61 61 ALA H H 61 7.300 7.300 7.577 -0.277 19718
2199 1 5 . 1 1 62 62 LEU N N 62 118.000 118.000 121.764 -3.764 19718
2200 1 5 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.674 -0.384 19718
2201 1 5 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.615 -2.515 19718
2202 1 5 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.140 -3.440 19718
2203 1 5 . 1 1 62 62 LEU H H 62 6.680 6.680 7.619 -0.939 19718
2204 1 5 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.562 -0.242 19718
2205 1 5 . 1 1 63 63 PRO C C 63 173.500 173.500 176.011 -2.511 19718
2206 1 5 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.054 -2.354 19718
2207 1 5 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.507 -4.007 19718
2208 1 5 . 1 1 64 64 GLU N N 64 124.500 124.500 119.308 5.192 19718
2209 1 5 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.608 -0.428 19718
2210 1 5 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.342 -1.842 19718
2211 1 5 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.482 -4.682 19718
2212 1 5 . 1 1 64 64 GLU H H 64 8.590 8.590 8.450 0.140 19718
2213 1 5 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.546 -0.376 19718
2214 1 5 . 1 1 65 65 PRO C C 65 174.900 174.900 176.396 -1.496 19718
2215 1 5 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.318 0.682 19718
2216 1 5 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.244 -4.744 19718
2217 1 5 . 1 1 66 66 GLU N N 66 123.300 123.300 119.222 4.078 19718
2218 1 5 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.083 0.247 19718
2219 1 5 . 1 1 66 66 GLU C C 66 174.200 174.200 177.451 -3.251 19718
2220 1 5 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.732 -4.232 19718
2221 1 5 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.404 -3.004 19718
2222 1 5 . 1 1 66 66 GLU H H 66 9.080 9.080 8.536 0.544 19718
2223 1 5 . 1 1 67 67 ASP N N 67 120.100 120.100 120.844 -0.744 19718
2224 1 5 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.509 -0.269 19718
2225 1 5 . 1 1 67 67 ASP C C 67 174.900 174.900 178.154 -3.254 19718
2226 1 5 . 1 1 67 67 ASP CA C 67 55.400 55.400 57.558 -2.158 19718
2227 1 5 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.845 -3.045 19718
2228 1 5 . 1 1 67 67 ASP H H 67 8.690 8.690 8.810 -0.120 19718
2229 1 5 . 1 1 68 68 ASP N N 68 116.800 116.800 116.312 0.488 19718
2230 1 5 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.488 -0.248 19718
2231 1 5 . 1 1 68 68 ASP C C 68 175.500 175.500 177.629 -2.129 19718
2232 1 5 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.951 -1.651 19718
2233 1 5 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.831 -4.731 19718
2234 1 5 . 1 1 68 68 ASP H H 68 8.400 8.400 8.483 -0.083 19718
2235 1 5 . 1 1 69 69 GLU N N 69 123.600 123.600 118.527 5.073 19718
2236 1 5 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.219 -0.069 19718
2237 1 5 . 1 1 69 69 GLU C C 69 175.200 175.200 178.655 -3.455 19718
2238 1 5 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.356 -2.156 19718
2239 1 5 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.314 -4.314 19718
2240 1 5 . 1 1 69 69 GLU H H 69 7.530 7.530 7.806 -0.276 19718
2241 1 5 . 1 1 70 70 ASN N N 70 119.100 119.100 117.970 1.130 19718
2242 1 5 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.474 -0.114 19718
2243 1 5 . 1 1 70 70 ASN C C 70 175.200 175.200 176.564 -1.364 19718
2244 1 5 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.562 -1.863 19718
2245 1 5 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.621 -2.821 19718
2246 1 5 . 1 1 70 70 ASN H H 70 7.960 7.960 8.815 -0.855 19718
2247 1 5 . 1 1 71 71 ASP N N 71 118.400 118.400 120.228 -1.828 19718
2248 1 5 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.426 -0.176 19718
2249 1 5 . 1 1 71 71 ASP C C 71 176.000 176.000 177.851 -1.851 19718
2250 1 5 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.774 -2.174 19718
2251 1 5 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.880 -3.380 19718
2252 1 5 . 1 1 71 71 ASP H H 71 8.250 8.250 7.692 0.558 19718
2253 1 5 . 1 1 72 72 MET N N 72 117.300 117.300 116.552 0.748 19718
2254 1 5 . 1 1 72 72 MET HA H 72 4.370 4.370 4.140 0.230 19718
2255 1 5 . 1 1 72 72 MET C C 72 177.800 177.800 177.303 0.497 19718
2256 1 5 . 1 1 72 72 MET CA C 72 53.700 53.700 58.339 -4.638 19718
2257 1 5 . 1 1 72 72 MET CB C 72 32.400 32.400 32.778 -0.378 19718
2258 1 5 . 1 1 72 72 MET H H 72 7.240 7.240 7.565 -0.325 19718
2259 1 5 . 1 1 73 73 LEU N N 73 123.000 123.000 117.163 5.837 19718
2260 1 5 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.575 -0.815 19718
2261 1 5 . 1 1 73 73 LEU C C 73 175.700 175.700 179.493 -3.793 19718
2262 1 5 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.163 -1.264 19718
2263 1 5 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.200 -4.100 19718
2264 1 5 . 1 1 73 73 LEU H H 73 8.600 8.600 7.160 1.440 19718
2265 1 5 . 1 1 74 74 ASP N N 74 118.500 118.500 119.362 -0.862 19718
2266 1 5 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.351 -0.011 19718
2267 1 5 . 1 1 74 74 ASP C C 74 174.700 174.700 177.899 -3.199 19718
2268 1 5 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.900 -2.600 19718
2269 1 5 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.862 -2.662 19718
2270 1 5 . 1 1 74 74 ASP H H 74 7.250 7.250 7.712 -0.462 19718
2271 1 5 . 1 1 75 75 LEU N N 75 116.300 116.300 117.466 -1.166 19718
2272 1 5 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.145 0.155 19718
2273 1 5 . 1 1 75 75 LEU C C 75 174.500 174.500 177.398 -2.898 19718
2274 1 5 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.537 -4.237 19718
2275 1 5 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.568 -1.968 19718
2276 1 5 . 1 1 75 75 LEU H H 75 7.000 7.000 7.399 -0.399 19718
2277 1 5 . 1 1 76 76 ALA N N 76 124.600 124.600 120.418 4.182 19718
2278 1 5 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.358 -0.258 19718
2279 1 5 . 1 1 76 76 ALA C C 76 174.200 174.200 176.716 -2.516 19718
2280 1 5 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.632 -2.132 19718
2281 1 5 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.227 -5.027 19718
2282 1 5 . 1 1 76 76 ALA H H 76 7.590 7.590 7.460 0.130 19718
2283 1 5 . 1 1 77 77 TYR N N 77 122.900 122.900 121.205 1.695 19718
2284 1 5 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.386 0.044 19718
2285 1 5 . 1 1 77 77 TYR C C 77 174.100 174.100 177.013 -2.913 19718
2286 1 5 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.375 -4.475 19718
2287 1 5 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.648 -3.748 19718
2288 1 5 . 1 1 77 77 TYR H H 77 8.150 8.150 7.856 0.294 19718
2289 1 5 . 1 1 78 78 GLY N N 78 112.900 112.900 114.453 -1.553 19718
2290 1 5 . 1 1 78 78 GLY C C 78 171.800 171.800 174.029 -2.229 19718
2291 1 5 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.606 -0.906 19718
2292 1 5 . 1 1 78 78 GLY H H 78 8.320 8.320 8.157 0.163 19718
2293 1 5 . 1 1 79 79 LEU N N 79 119.300 119.300 119.088 0.212 19718
2294 1 5 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.300 -0.510 19718
2295 1 5 . 1 1 79 79 LEU C C 79 174.000 174.000 176.650 -2.650 19718
2296 1 5 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.477 -1.476 19718
2297 1 5 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.819 -2.919 19718
2298 1 5 . 1 1 79 79 LEU H H 79 7.120 7.120 7.889 -0.769 19718
2299 1 5 . 1 1 80 80 THR N N 80 118.500 118.500 120.282 -1.782 19718
2300 1 5 . 1 1 80 80 THR HA H 80 4.860 4.860 4.409 0.451 19718
2301 1 5 . 1 1 80 80 THR C C 80 173.300 173.300 174.837 -1.537 19718
2302 1 5 . 1 1 80 80 THR CA C 80 57.600 57.600 60.659 -3.059 19718
2303 1 5 . 1 1 80 80 THR CB C 80 71.000 71.000 70.189 0.811 19718
2304 1 5 . 1 1 80 80 THR H H 80 9.240 9.240 7.689 1.551 19718
2305 1 5 . 1 1 81 81 GLU N N 81 118.000 118.000 120.492 -2.492 19718
2306 1 5 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.084 0.026 19718
2307 1 5 . 1 1 81 81 GLU C C 81 173.900 173.900 176.104 -2.204 19718
2308 1 5 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.412 -3.012 19718
2309 1 5 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.502 -2.802 19718
2310 1 5 . 1 1 81 81 GLU H H 81 9.020 9.020 8.827 0.193 19718
2311 1 5 . 1 1 82 82 THR N N 82 106.400 106.400 107.576 -1.176 19718
2312 1 5 . 1 1 82 82 THR HA H 82 3.950 3.950 2.808 1.142 19718
2313 1 5 . 1 1 82 82 THR C C 82 171.700 171.700 174.163 -2.463 19718
2314 1 5 . 1 1 82 82 THR CA C 82 56.800 56.800 59.546 -2.746 19718
2315 1 5 . 1 1 82 82 THR CB C 82 63.800 63.800 67.746 -3.946 19718
2316 1 5 . 1 1 82 82 THR H H 82 7.630 7.630 7.462 0.168 19718
2317 1 5 . 1 1 83 83 SER N N 83 121.500 121.500 118.648 2.852 19718
2318 1 5 . 1 1 83 83 SER HA H 83 5.080 5.080 4.243 0.837 19718
2319 1 5 . 1 1 83 83 SER C C 83 170.900 170.900 174.456 -3.556 19718
2320 1 5 . 1 1 83 83 SER CA C 83 59.000 59.000 60.020 -1.020 19718
2321 1 5 . 1 1 83 83 SER CB C 83 61.700 61.700 63.711 -2.011 19718
2322 1 5 . 1 1 83 83 SER H H 83 6.930 6.930 7.484 -0.554 19718
2323 1 5 . 1 1 84 84 ARG N N 84 119.300 119.300 124.357 -5.057 19718
2324 1 5 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.830 0.040 19718
2325 1 5 . 1 1 84 84 ARG C C 84 172.400 172.400 174.387 -1.987 19718
2326 1 5 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.924 -4.624 19718
2327 1 5 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.341 -1.941 19718
2328 1 5 . 1 1 84 84 ARG H H 84 9.280 9.280 8.751 0.529 19718
2329 1 5 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.398 0.032 19718
2330 1 5 . 1 1 88 88 GLN C C 88 172.500 172.500 175.567 -3.067 19718
2331 1 5 . 1 1 88 88 GLN CA C 88 51.000 51.000 56.049 -5.049 19718
2332 1 5 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.358 -2.358 19718
2333 1 5 . 1 1 90 90 LYS N N 90 123.700 123.700 126.225 -2.525 19718
2334 1 5 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.996 -0.546 19718
2335 1 5 . 1 1 90 90 LYS C C 90 173.500 173.500 175.452 -1.952 19718
2336 1 5 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.514 -2.014 19718
2337 1 5 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.651 -2.751 19718
2338 1 5 . 1 1 90 90 LYS H H 90 8.330 8.330 8.060 0.270 19718
2339 1 5 . 1 1 91 91 MET N N 91 118.200 118.200 120.458 -2.258 19718
2340 1 5 . 1 1 91 91 MET HA H 91 4.330 4.330 4.586 -0.256 19718
2341 1 5 . 1 1 91 91 MET C C 91 174.300 174.300 175.870 -1.570 19718
2342 1 5 . 1 1 91 91 MET CA C 91 51.800 51.800 55.096 -3.296 19718
2343 1 5 . 1 1 91 91 MET CB C 91 27.200 27.200 32.049 -4.849 19718
2344 1 5 . 1 1 91 91 MET H H 91 8.620 8.620 8.645 -0.025 19718
2345 1 5 . 1 1 92 92 SER N N 92 117.000 117.000 118.575 -1.575 19718
2346 1 5 . 1 1 92 92 SER HA H 92 4.610 4.610 4.678 -0.068 19718
2347 1 5 . 1 1 92 92 SER C C 92 171.300 171.300 174.891 -3.591 19718
2348 1 5 . 1 1 92 92 SER CA C 92 54.000 54.000 57.244 -3.244 19718
2349 1 5 . 1 1 92 92 SER CB C 92 63.700 63.700 66.152 -2.452 19718
2350 1 5 . 1 1 92 92 SER H H 92 6.970 6.970 8.207 -1.237 19718
2351 1 5 . 1 1 93 93 LYS N N 93 121.700 121.700 120.918 0.782 19718
2352 1 5 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.229 -0.259 19718
2353 1 5 . 1 1 93 93 LYS C C 93 175.200 175.200 178.190 -2.990 19718
2354 1 5 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.757 -2.057 19718
2355 1 5 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.305 -3.205 19718
2356 1 5 . 1 1 93 93 LYS H H 93 9.260 9.260 8.787 0.473 19718
2357 1 5 . 1 1 94 94 ASP N N 94 116.700 116.700 118.837 -2.137 19718
2358 1 5 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.529 -0.169 19718
2359 1 5 . 1 1 94 94 ASP C C 94 174.300 174.300 177.182 -2.882 19718
2360 1 5 . 1 1 94 94 ASP CA C 94 53.700 53.700 55.891 -2.191 19718
2361 1 5 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.141 -3.240 19718
2362 1 5 . 1 1 94 94 ASP H H 94 8.020 8.020 8.255 -0.235 19718
2363 1 5 . 1 1 95 95 ILE N N 95 109.000 109.000 111.304 -2.304 19718
2364 1 5 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.628 0.032 19718
2365 1 5 . 1 1 95 95 ILE C C 95 170.600 170.600 174.897 -4.297 19718
2366 1 5 . 1 1 95 95 ILE CA C 95 57.300 57.300 59.660 -2.360 19718
2367 1 5 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.812 -3.612 19718
2368 1 5 . 1 1 95 95 ILE H H 95 7.240 7.240 7.210 0.030 19718
2369 1 5 . 1 1 96 96 ASP N N 96 119.800 119.800 123.715 -3.915 19718
2370 1 5 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.452 -0.272 19718
2371 1 5 . 1 1 96 96 ASP C C 96 174.900 174.900 176.711 -1.811 19718
2372 1 5 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.866 -1.166 19718
2373 1 5 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.341 -0.341 19718
2374 1 5 . 1 1 96 96 ASP H H 96 6.950 6.950 7.714 -0.764 19718
2375 1 5 . 1 1 97 97 GLY N N 97 118.500 118.500 112.843 5.657 19718
2376 1 5 . 1 1 97 97 GLY C C 97 170.500 170.500 174.299 -3.799 19718
2377 1 5 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.276 -1.976 19718
2378 1 5 . 1 1 97 97 GLY H H 97 9.210 9.210 8.217 0.993 19718
2379 1 5 . 1 1 98 98 ILE N N 98 121.300 121.300 122.361 -1.061 19718
2380 1 5 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.560 2.040 19718
2381 1 5 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.927 -3.327 19718
2382 1 5 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.122 -3.422 19718
2383 1 5 . 1 1 98 98 ILE H H 98 7.660 7.660 8.007 -0.347 19718
2384 1 5 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.247 0.103 19718
2385 1 5 . 1 1 99 99 ARG C C 99 172.200 172.200 175.323 -3.123 19718
2386 1 5 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.147 -4.047 19718
2387 1 5 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.308 -2.808 19718
2388 1 5 . 1 1 100 100 VAL N N 100 114.900 114.900 116.354 -1.454 19718
2389 1 5 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.115 -0.295 19718
2390 1 5 . 1 1 100 100 VAL C C 100 169.600 169.600 173.299 -3.699 19718
2391 1 5 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.584 -4.384 19718
2392 1 5 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.259 -3.959 19718
2393 1 5 . 1 1 100 100 VAL H H 100 8.440 8.440 8.834 -0.394 19718
2394 1 5 . 1 1 101 101 ALA N N 101 123.400 123.400 123.308 0.092 19718
2395 1 5 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.897 0.413 19718
2396 1 5 . 1 1 101 101 ALA C C 101 174.400 174.400 175.258 -0.858 19718
2397 1 5 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.669 -2.869 19718
2398 1 5 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.432 -3.632 19718
2399 1 5 . 1 1 101 101 ALA H H 101 9.040 9.040 8.983 0.057 19718
2400 1 5 . 1 1 102 102 LEU N N 102 120.600 120.600 121.774 -1.174 19718
2401 1 5 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.144 -0.574 19718
2402 1 5 . 1 1 102 102 LEU CA C 102 52.200 52.200 52.964 -0.764 19718
2403 1 5 . 1 1 102 102 LEU CB C 102 37.900 37.900 43.902 -6.002 19718
2404 1 5 . 1 1 102 102 LEU H H 102 8.260 8.260 8.698 -0.438 19718
2405 1 5 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.333 0.247 19718
2406 1 5 . 1 1 112 112 ASN C C 112 171.900 171.900 174.845 -2.945 19718
2407 1 5 . 1 1 112 112 ASN CA C 112 50.400 50.400 55.100 -4.700 19718
2408 1 5 . 1 1 112 112 ASN CB C 112 36.700 36.700 37.885 -1.185 19718
2409 1 5 . 1 1 113 113 ASP N N 113 120.300 120.300 116.828 3.472 19718
2410 1 5 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.349 0.091 19718
2411 1 5 . 1 1 113 113 ASP C C 113 173.000 173.000 175.875 -2.875 19718
2412 1 5 . 1 1 113 113 ASP CA C 113 51.600 51.600 55.603 -4.003 19718
2413 1 5 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.419 -2.319 19718
2414 1 5 . 1 1 113 113 ASP H H 113 8.040 8.040 8.712 -0.672 19718
2415 1 5 . 1 1 114 114 PHE N N 114 120.100 120.100 117.673 2.427 19718
2416 1 5 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.540 0.070 19718
2417 1 5 . 1 1 114 114 PHE C C 114 172.200 172.200 174.511 -2.311 19718
2418 1 5 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.094 -3.194 19718
2419 1 5 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.493 -2.993 19718
2420 1 5 . 1 1 114 114 PHE H H 114 8.110 8.110 8.487 -0.377 19718
2421 1 6 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.485 -0.245 19718
2422 1 6 . 1 1 2 2 GLU C C 2 173.400 173.400 174.540 -1.140 19718
2423 1 6 . 1 1 2 2 GLU CA C 2 53.400 53.400 55.916 -2.516 19718
2424 1 6 . 1 1 2 2 GLU CB C 2 27.000 27.000 31.915 -4.915 19718
2425 1 6 . 1 1 3 3 GLU N N 3 121.200 121.200 124.045 -2.845 19718
2426 1 6 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.635 -0.255 19718
2427 1 6 . 1 1 3 3 GLU C C 3 173.000 173.000 176.376 -3.376 19718
2428 1 6 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.369 -1.969 19718
2429 1 6 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.026 -2.626 19718
2430 1 6 . 1 1 3 3 GLU H H 3 8.510 8.510 8.568 -0.058 19718
2431 1 6 . 1 1 4 4 LEU N N 4 122.400 122.400 125.433 -3.033 19718
2432 1 6 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.640 -0.090 19718
2433 1 6 . 1 1 4 4 LEU C C 4 172.900 172.900 176.242 -3.342 19718
2434 1 6 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.760 -3.360 19718
2435 1 6 . 1 1 4 4 LEU CB C 4 41.700 41.700 43.735 -2.035 19718
2436 1 6 . 1 1 4 4 LEU H H 4 8.460 8.460 8.803 -0.343 19718
2437 1 6 . 1 1 5 5 LYS N N 5 119.300 119.300 117.418 1.882 19718
2438 1 6 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.234 0.186 19718
2439 1 6 . 1 1 5 5 LYS C C 5 172.400 172.400 174.546 -2.146 19718
2440 1 6 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.855 -2.555 19718
2441 1 6 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.758 -3.758 19718
2442 1 6 . 1 1 5 5 LYS H H 5 8.570 8.570 7.997 0.573 19718
2443 1 6 . 1 1 6 6 ILE N N 6 116.900 116.900 121.752 -4.852 19718
2444 1 6 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.633 -0.523 19718
2445 1 6 . 1 1 6 6 ILE C C 6 169.800 169.800 173.206 -3.406 19718
2446 1 6 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.482 -3.982 19718
2447 1 6 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.199 -3.199 19718
2448 1 6 . 1 1 6 6 ILE H H 6 8.160 8.160 8.937 -0.777 19718
2449 1 6 . 1 1 7 7 THR N N 7 123.000 123.000 125.343 -2.343 19718
2450 1 6 . 1 1 7 7 THR HA H 7 5.220 5.220 5.124 0.096 19718
2451 1 6 . 1 1 7 7 THR C C 7 169.900 169.900 173.343 -3.443 19718
2452 1 6 . 1 1 7 7 THR CA C 7 58.400 58.400 60.900 -2.500 19718
2453 1 6 . 1 1 7 7 THR CB C 7 68.700 68.700 69.999 -1.299 19718
2454 1 6 . 1 1 7 7 THR H H 7 8.520 8.520 8.598 -0.078 19718
2455 1 6 . 1 1 8 8 PHE N N 8 124.000 124.000 124.525 -0.525 19718
2456 1 6 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.402 -0.252 19718
2457 1 6 . 1 1 8 8 PHE C C 8 172.300 172.300 175.277 -2.977 19718
2458 1 6 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.221 -1.621 19718
2459 1 6 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.230 -1.130 19718
2460 1 6 . 1 1 8 8 PHE H H 8 9.290 9.290 9.345 -0.055 19718
2461 1 6 . 1 1 9 9 ILE N N 9 122.700 122.700 122.184 0.516 19718
2462 1 6 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.741 -0.161 19718
2463 1 6 . 1 1 9 9 ILE C C 9 173.600 173.600 176.438 -2.838 19718
2464 1 6 . 1 1 9 9 ILE CA C 9 58.200 58.200 61.269 -3.069 19718
2465 1 6 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.296 -3.796 19718
2466 1 6 . 1 1 9 9 ILE H H 9 9.170 9.170 8.630 0.540 19718
2467 1 6 . 1 1 10 10 LEU N N 10 126.700 126.700 126.027 0.673 19718
2468 1 6 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.504 -0.184 19718
2469 1 6 . 1 1 10 10 LEU C C 10 176.500 176.500 178.564 -2.064 19718
2470 1 6 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.620 -2.420 19718
2471 1 6 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.635 -5.135 19718
2472 1 6 . 1 1 10 10 LEU H H 10 9.100 9.100 9.002 0.098 19718
2473 1 6 . 1 1 11 11 LYS N N 11 118.900 118.900 119.517 -0.617 19718
2474 1 6 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.152 -0.192 19718
2475 1 6 . 1 1 11 11 LYS C C 11 174.100 174.100 177.673 -3.573 19718
2476 1 6 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.493 -1.093 19718
2477 1 6 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.159 -3.259 19718
2478 1 6 . 1 1 11 11 LYS H H 11 8.520 8.520 9.047 -0.527 19718
2479 1 6 . 1 1 12 12 ASP N N 12 114.400 114.400 117.614 -3.214 19718
2480 1 6 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.747 -0.227 19718
2481 1 6 . 1 1 12 12 ASP C C 12 174.500 174.500 176.565 -2.065 19718
2482 1 6 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.894 -3.494 19718
2483 1 6 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.744 -3.544 19718
2484 1 6 . 1 1 12 12 ASP H H 12 7.690 7.690 8.237 -0.547 19718
2485 1 6 . 1 1 13 13 GLY N N 13 109.200 109.200 109.064 0.136 19718
2486 1 6 . 1 1 13 13 GLY C C 13 171.600 171.600 174.228 -2.628 19718
2487 1 6 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.709 -3.309 19718
2488 1 6 . 1 1 13 13 GLY H H 13 8.100 8.100 7.967 0.133 19718
2489 1 6 . 1 1 14 14 SER N N 14 118.000 118.000 116.269 1.731 19718
2490 1 6 . 1 1 14 14 SER HA H 14 4.280 4.280 4.404 -0.124 19718
2491 1 6 . 1 1 14 14 SER C C 14 169.000 169.000 173.855 -4.855 19718
2492 1 6 . 1 1 14 14 SER CA C 14 56.500 56.500 58.800 -2.300 19718
2493 1 6 . 1 1 14 14 SER CB C 14 61.000 61.000 63.967 -2.967 19718
2494 1 6 . 1 1 14 14 SER H H 14 8.110 8.110 8.020 0.090 19718
2495 1 6 . 1 1 15 15 GLN N N 15 116.300 116.300 120.392 -4.092 19718
2496 1 6 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.161 0.499 19718
2497 1 6 . 1 1 15 15 GLN C C 15 173.500 173.500 175.990 -2.490 19718
2498 1 6 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.983 -3.283 19718
2499 1 6 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.155 -2.155 19718
2500 1 6 . 1 1 15 15 GLN H H 15 8.330 8.330 8.517 -0.187 19718
2501 1 6 . 1 1 16 16 LYS N N 16 122.500 122.500 125.503 -3.003 19718
2502 1 6 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.626 -0.296 19718
2503 1 6 . 1 1 16 16 LYS C C 16 171.300 171.300 174.533 -3.233 19718
2504 1 6 . 1 1 16 16 LYS CA C 16 51.900 51.900 54.924 -3.024 19718
2505 1 6 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.922 -1.923 19718
2506 1 6 . 1 1 16 16 LYS H H 16 8.780 8.780 8.927 -0.147 19718
2507 1 6 . 1 1 17 17 THR N N 17 120.000 120.000 120.160 -0.160 19718
2508 1 6 . 1 1 17 17 THR HA H 17 5.220 5.220 4.858 0.362 19718
2509 1 6 . 1 1 17 17 THR C C 17 170.500 170.500 173.412 -2.912 19718
2510 1 6 . 1 1 17 17 THR CA C 17 58.700 58.700 62.044 -3.344 19718
2511 1 6 . 1 1 17 17 THR CB C 17 67.900 67.900 69.590 -1.690 19718
2512 1 6 . 1 1 17 17 THR H H 17 8.160 8.160 8.507 -0.347 19718
2513 1 6 . 1 1 18 18 TYR N N 18 125.600 125.600 125.111 0.489 19718
2514 1 6 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.885 -0.045 19718
2515 1 6 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.913 -1.913 19718
2516 1 6 . 1 1 18 18 TYR CB C 18 39.100 39.100 42.574 -3.474 19718
2517 1 6 . 1 1 18 18 TYR H H 18 9.020 9.020 9.295 -0.275 19718
2518 1 6 . 1 1 19 19 GLU C C 19 174.200 174.200 175.532 -1.332 19718
2519 1 6 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.642 -2.743 19718
2520 1 6 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.238 -3.938 19718
2521 1 6 . 1 1 20 20 VAL N N 20 119.000 119.000 119.342 -0.342 19718
2522 1 6 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.722 0.118 19718
2523 1 6 . 1 1 20 20 VAL C C 20 171.200 171.200 173.845 -2.645 19718
2524 1 6 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.846 -3.246 19718
2525 1 6 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.626 -1.926 19718
2526 1 6 . 1 1 20 20 VAL H H 20 9.160 9.160 8.223 0.937 19718
2527 1 6 . 1 1 21 21 CYS N N 21 117.500 117.500 119.739 -2.239 19718
2528 1 6 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.848 -0.088 19718
2529 1 6 . 1 1 21 21 CYS C C 21 171.400 171.400 175.152 -3.752 19718
2530 1 6 . 1 1 21 21 CYS CA C 21 54.900 54.900 56.539 -1.639 19718
2531 1 6 . 1 1 21 21 CYS CB C 21 27.200 27.200 29.849 -2.649 19718
2532 1 6 . 1 1 21 21 CYS H H 21 8.720 8.720 8.498 0.222 19718
2533 1 6 . 1 1 22 22 GLU N N 22 120.900 120.900 121.912 -1.012 19718
2534 1 6 . 1 1 22 22 GLU HA H 22 3.410 3.410 4.016 -0.606 19718
2535 1 6 . 1 1 22 22 GLU C C 22 174.300 174.300 177.195 -2.895 19718
2536 1 6 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.348 -3.248 19718
2537 1 6 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.968 -3.168 19718
2538 1 6 . 1 1 22 22 GLU H H 22 8.540 8.540 8.708 -0.168 19718
2539 1 6 . 1 1 23 23 GLY N N 23 112.400 112.400 113.621 -1.221 19718
2540 1 6 . 1 1 23 23 GLY C C 23 171.000 171.000 174.716 -3.716 19718
2541 1 6 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.194 -2.794 19718
2542 1 6 . 1 1 23 23 GLY H H 23 8.720 8.720 8.964 -0.244 19718
2543 1 6 . 1 1 24 24 GLU N N 24 119.600 119.600 122.442 -2.842 19718
2544 1 6 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.391 -0.061 19718
2545 1 6 . 1 1 24 24 GLU C C 24 174.400 174.400 175.945 -1.545 19718
2546 1 6 . 1 1 24 24 GLU CA C 24 54.100 54.100 57.028 -2.928 19718
2547 1 6 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.081 -1.981 19718
2548 1 6 . 1 1 24 24 GLU H H 24 7.060 7.060 7.933 -0.873 19718
2549 1 6 . 1 1 25 25 THR N N 25 113.600 113.600 119.502 -5.902 19718
2550 1 6 . 1 1 25 25 THR HA H 25 5.510 5.510 4.716 0.794 19718
2551 1 6 . 1 1 25 25 THR C C 25 173.100 173.100 175.892 -2.792 19718
2552 1 6 . 1 1 25 25 THR CA C 25 57.000 57.000 61.237 -4.237 19718
2553 1 6 . 1 1 25 25 THR CB C 25 68.700 68.700 70.458 -1.758 19718
2554 1 6 . 1 1 25 25 THR H H 25 9.080 9.080 8.459 0.621 19718
2555 1 6 . 1 1 26 26 ILE N N 26 120.300 120.300 123.783 -3.483 19718
2556 1 6 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.983 -0.353 19718
2557 1 6 . 1 1 26 26 ILE C C 26 174.700 174.700 177.540 -2.840 19718
2558 1 6 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.722 -0.022 19718
2559 1 6 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.985 -3.985 19718
2560 1 6 . 1 1 26 26 ILE H H 26 7.860 7.860 8.132 -0.272 19718
2561 1 6 . 1 1 27 27 LEU N N 27 117.600 117.600 118.418 -0.818 19718
2562 1 6 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.042 -0.292 19718
2563 1 6 . 1 1 27 27 LEU C C 27 174.000 174.000 179.115 -5.115 19718
2564 1 6 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.869 -2.969 19718
2565 1 6 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.915 -1.615 19718
2566 1 6 . 1 1 27 27 LEU H H 27 6.580 6.580 8.381 -1.801 19718
2567 1 6 . 1 1 28 28 ASP N N 28 120.000 120.000 120.085 -0.085 19718
2568 1 6 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.383 -0.133 19718
2569 1 6 . 1 1 28 28 ASP C C 28 177.900 177.900 178.831 -0.931 19718
2570 1 6 . 1 1 28 28 ASP CA C 28 55.000 55.000 58.677 -3.677 19718
2571 1 6 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.519 -3.619 19718
2572 1 6 . 1 1 28 28 ASP H H 28 7.880 7.880 8.370 -0.490 19718
2573 1 6 . 1 1 29 29 ILE N N 29 122.100 122.100 120.185 1.915 19718
2574 1 6 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.865 -0.125 19718
2575 1 6 . 1 1 29 29 ILE C C 29 175.700 175.700 177.772 -2.072 19718
2576 1 6 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.083 -2.983 19718
2577 1 6 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.027 -1.527 19718
2578 1 6 . 1 1 29 29 ILE H H 29 8.340 8.340 8.285 0.055 19718
2579 1 6 . 1 1 30 30 ALA N N 30 124.100 124.100 123.184 0.916 19718
2580 1 6 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.643 -0.303 19718
2581 1 6 . 1 1 30 30 ALA C C 30 177.600 177.600 179.608 -2.008 19718
2582 1 6 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.468 -2.668 19718
2583 1 6 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.091 -1.291 19718
2584 1 6 . 1 1 30 30 ALA H H 30 8.430 8.430 8.180 0.250 19718
2585 1 6 . 1 1 31 31 GLN N N 31 116.000 116.000 116.124 -0.124 19718
2586 1 6 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.224 -0.064 19718
2587 1 6 . 1 1 31 31 GLN C C 31 178.100 178.100 178.461 -0.361 19718
2588 1 6 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.381 -0.681 19718
2589 1 6 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.111 -3.911 19718
2590 1 6 . 1 1 31 31 GLN H H 31 8.760 8.760 8.462 0.298 19718
2591 1 6 . 1 1 32 32 GLY N N 32 108.700 108.700 108.196 0.504 19718
2592 1 6 . 1 1 32 32 GLY C C 32 171.700 171.700 175.324 -3.624 19718
2593 1 6 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.251 -3.051 19718
2594 1 6 . 1 1 32 32 GLY H H 32 8.220 8.220 7.967 0.253 19718
2595 1 6 . 1 1 33 33 HIS N N 33 115.000 115.000 119.240 -4.240 19718
2596 1 6 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.584 -0.154 19718
2597 1 6 . 1 1 33 33 HIS C C 33 169.800 169.800 174.613 -4.813 19718
2598 1 6 . 1 1 33 33 HIS CA C 33 53.400 53.400 55.956 -2.556 19718
2599 1 6 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.801 -5.301 19718
2600 1 6 . 1 1 33 33 HIS H H 33 6.980 6.980 8.028 -1.048 19718
2601 1 6 . 1 1 34 34 ASN N N 34 113.700 113.700 115.577 -1.877 19718
2602 1 6 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.329 0.001 19718
2603 1 6 . 1 1 34 34 ASN C C 34 172.000 172.000 174.990 -2.990 19718
2604 1 6 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.726 -1.626 19718
2605 1 6 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.677 -2.677 19718
2606 1 6 . 1 1 34 34 ASN H H 34 7.700 7.700 8.200 -0.500 19718
2607 1 6 . 1 1 35 35 LEU N N 35 115.600 115.600 118.879 -3.279 19718
2608 1 6 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.178 0.072 19718
2609 1 6 . 1 1 35 35 LEU C C 35 174.900 174.900 177.487 -2.587 19718
2610 1 6 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.713 -4.413 19718
2611 1 6 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.282 -3.082 19718
2612 1 6 . 1 1 35 35 LEU H H 35 7.980 7.980 7.818 0.162 19718
2613 1 6 . 1 1 36 36 ASP N N 36 120.100 120.100 125.304 -5.204 19718
2614 1 6 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.666 -0.236 19718
2615 1 6 . 1 1 36 36 ASP C C 36 171.100 171.100 174.805 -3.705 19718
2616 1 6 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.871 -3.871 19718
2617 1 6 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.188 -2.989 19718
2618 1 6 . 1 1 36 36 ASP H H 36 8.610 8.610 8.738 -0.128 19718
2619 1 6 . 1 1 37 37 MET N N 37 123.900 123.900 117.226 6.674 19718
2620 1 6 . 1 1 37 37 MET HA H 37 4.280 4.280 4.746 -0.466 19718
2621 1 6 . 1 1 37 37 MET C C 37 171.200 171.200 174.486 -3.286 19718
2622 1 6 . 1 1 37 37 MET CA C 37 52.800 52.800 54.126 -1.326 19718
2623 1 6 . 1 1 37 37 MET CB C 37 33.000 33.000 35.172 -2.172 19718
2624 1 6 . 1 1 37 37 MET H H 37 7.670 7.670 7.731 -0.061 19718
2625 1 6 . 1 1 38 38 GLU N N 38 128.600 128.600 120.843 7.757 19718
2626 1 6 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.293 -0.003 19718
2627 1 6 . 1 1 38 38 GLU CA C 38 53.200 53.200 57.025 -3.825 19718
2628 1 6 . 1 1 38 38 GLU CB C 38 29.400 29.400 30.331 -0.931 19718
2629 1 6 . 1 1 38 38 GLU H H 38 9.060 9.060 8.915 0.145 19718
2630 1 6 . 1 1 51 51 HIS C C 51 170.700 170.700 174.158 -3.458 19718
2631 1 6 . 1 1 51 51 HIS CA C 51 52.800 52.800 56.318 -3.518 19718
2632 1 6 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.035 -2.335 19718
2633 1 6 . 1 1 53 53 ILE N N 53 122.200 122.200 120.383 1.817 19718
2634 1 6 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.725 -0.715 19718
2635 1 6 . 1 1 53 53 ILE C C 53 174.400 174.400 173.499 0.901 19718
2636 1 6 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.731 -0.031 19718
2637 1 6 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.937 -5.637 19718
2638 1 6 . 1 1 53 53 ILE H H 53 8.800 8.800 8.119 0.681 19718
2639 1 6 . 1 1 54 54 VAL N N 54 130.200 130.200 125.324 4.876 19718
2640 1 6 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.577 -0.707 19718
2641 1 6 . 1 1 54 54 VAL C C 54 172.500 172.500 174.889 -2.389 19718
2642 1 6 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.410 1.490 19718
2643 1 6 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.150 -5.550 19718
2644 1 6 . 1 1 54 54 VAL H H 54 8.380 8.380 8.777 -0.397 19718
2645 1 6 . 1 1 55 55 ASP N N 55 129.100 129.100 127.619 1.481 19718
2646 1 6 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.662 -0.072 19718
2647 1 6 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.415 -2.715 19718
2648 1 6 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.735 -1.235 19718
2649 1 6 . 1 1 55 55 ASP H H 55 8.160 8.160 8.124 0.036 19718
2650 1 6 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.303 -0.133 19718
2651 1 6 . 1 1 56 56 PRO C C 56 174.900 174.900 177.337 -2.437 19718
2652 1 6 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.747 -1.747 19718
2653 1 6 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.731 -2.331 19718
2654 1 6 . 1 1 57 57 ASP N N 57 117.100 117.100 117.576 -0.476 19718
2655 1 6 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.422 -0.052 19718
2656 1 6 . 1 1 57 57 ASP C C 57 174.100 174.100 177.701 -3.601 19718
2657 1 6 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.891 -3.191 19718
2658 1 6 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.088 -4.288 19718
2659 1 6 . 1 1 57 57 ASP H H 57 9.110 9.110 9.018 0.092 19718
2660 1 6 . 1 1 58 58 TYR N N 58 115.800 115.800 117.319 -1.519 19718
2661 1 6 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.496 -0.136 19718
2662 1 6 . 1 1 58 58 TYR C C 58 173.200 173.200 177.819 -4.619 19718
2663 1 6 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.282 -2.582 19718
2664 1 6 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.049 -0.149 19718
2665 1 6 . 1 1 58 58 TYR H H 58 8.190 8.190 7.853 0.337 19718
2666 1 6 . 1 1 59 59 TYR N N 59 120.100 120.100 121.740 -1.640 19718
2667 1 6 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.176 -0.396 19718
2668 1 6 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.460 0.640 19718
2669 1 6 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.214 -1.813 19718
2670 1 6 . 1 1 59 59 TYR H H 59 7.420 7.420 8.294 -0.874 19718
2671 1 6 . 1 1 60 60 ASP N N 60 115.200 115.200 118.878 -3.678 19718
2672 1 6 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.404 -0.044 19718
2673 1 6 . 1 1 60 60 ASP C C 60 173.100 173.100 176.546 -3.446 19718
2674 1 6 . 1 1 60 60 ASP CA C 60 53.400 53.400 56.161 -2.761 19718
2675 1 6 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.464 -2.964 19718
2676 1 6 . 1 1 60 60 ASP H H 60 8.440 8.440 8.201 0.239 19718
2677 1 6 . 1 1 61 61 ALA N N 61 120.200 120.200 120.653 -0.453 19718
2678 1 6 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.380 -0.200 19718
2679 1 6 . 1 1 61 61 ALA C C 61 175.000 175.000 177.487 -2.487 19718
2680 1 6 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.394 -3.094 19718
2681 1 6 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.835 -3.635 19718
2682 1 6 . 1 1 61 61 ALA H H 61 7.300 7.300 7.586 -0.286 19718
2683 1 6 . 1 1 62 62 LEU N N 62 118.000 118.000 121.521 -3.521 19718
2684 1 6 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.718 -0.428 19718
2685 1 6 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.311 -2.211 19718
2686 1 6 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.324 -3.624 19718
2687 1 6 . 1 1 62 62 LEU H H 62 6.680 6.680 7.458 -0.778 19718
2688 1 6 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.549 -0.229 19718
2689 1 6 . 1 1 63 63 PRO C C 63 173.500 173.500 176.028 -2.528 19718
2690 1 6 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.003 -2.303 19718
2691 1 6 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.339 -3.839 19718
2692 1 6 . 1 1 64 64 GLU N N 64 124.500 124.500 119.527 4.973 19718
2693 1 6 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.545 -0.365 19718
2694 1 6 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.495 -1.995 19718
2695 1 6 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.101 -4.301 19718
2696 1 6 . 1 1 64 64 GLU H H 64 8.590 8.590 8.400 0.190 19718
2697 1 6 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.573 -0.403 19718
2698 1 6 . 1 1 65 65 PRO C C 65 174.900 174.900 176.585 -1.685 19718
2699 1 6 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.411 0.589 19718
2700 1 6 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.927 -4.427 19718
2701 1 6 . 1 1 66 66 GLU N N 66 123.300 123.300 119.229 4.071 19718
2702 1 6 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.069 0.261 19718
2703 1 6 . 1 1 66 66 GLU C C 66 174.200 174.200 177.243 -3.043 19718
2704 1 6 . 1 1 66 66 GLU CA C 66 52.500 52.500 57.207 -4.707 19718
2705 1 6 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.258 -2.858 19718
2706 1 6 . 1 1 66 66 GLU H H 66 9.080 9.080 8.680 0.400 19718
2707 1 6 . 1 1 67 67 ASP N N 67 120.100 120.100 122.162 -2.062 19718
2708 1 6 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.526 -0.286 19718
2709 1 6 . 1 1 67 67 ASP C C 67 174.900 174.900 176.722 -1.822 19718
2710 1 6 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.267 -0.867 19718
2711 1 6 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.894 -3.094 19718
2712 1 6 . 1 1 67 67 ASP H H 67 8.690 8.690 8.605 0.085 19718
2713 1 6 . 1 1 68 68 ASP N N 68 116.800 116.800 117.261 -0.461 19718
2714 1 6 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.523 -0.283 19718
2715 1 6 . 1 1 68 68 ASP C C 68 175.500 175.500 177.528 -2.028 19718
2716 1 6 . 1 1 68 68 ASP CA C 68 54.300 54.300 56.035 -1.735 19718
2717 1 6 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.057 -4.957 19718
2718 1 6 . 1 1 68 68 ASP H H 68 8.400 8.400 8.398 0.002 19718
2719 1 6 . 1 1 69 69 GLU N N 69 123.600 123.600 118.781 4.819 19718
2720 1 6 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.213 -0.063 19718
2721 1 6 . 1 1 69 69 GLU C C 69 175.200 175.200 178.339 -3.139 19718
2722 1 6 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.301 -2.101 19718
2723 1 6 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.361 -4.361 19718
2724 1 6 . 1 1 69 69 GLU H H 69 7.530 7.530 7.874 -0.344 19718
2725 1 6 . 1 1 70 70 ASN N N 70 119.100 119.100 118.001 1.099 19718
2726 1 6 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.436 -0.076 19718
2727 1 6 . 1 1 70 70 ASN C C 70 175.200 175.200 177.040 -1.840 19718
2728 1 6 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.705 -2.005 19718
2729 1 6 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.776 -2.976 19718
2730 1 6 . 1 1 70 70 ASN H H 70 7.960 7.960 8.609 -0.649 19718
2731 1 6 . 1 1 71 71 ASP N N 71 118.400 118.400 120.336 -1.936 19718
2732 1 6 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.577 -0.327 19718
2733 1 6 . 1 1 71 71 ASP C C 71 176.000 176.000 177.629 -1.629 19718
2734 1 6 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.511 -1.911 19718
2735 1 6 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.991 -3.491 19718
2736 1 6 . 1 1 71 71 ASP H H 71 8.250 8.250 8.314 -0.064 19718
2737 1 6 . 1 1 72 72 MET N N 72 117.300 117.300 116.935 0.365 19718
2738 1 6 . 1 1 72 72 MET HA H 72 4.370 4.370 4.197 0.173 19718
2739 1 6 . 1 1 72 72 MET C C 72 177.800 177.800 177.539 0.261 19718
2740 1 6 . 1 1 72 72 MET CA C 72 53.700 53.700 58.370 -4.670 19718
2741 1 6 . 1 1 72 72 MET CB C 72 32.400 32.400 32.736 -0.336 19718
2742 1 6 . 1 1 72 72 MET H H 72 7.240 7.240 7.484 -0.244 19718
2743 1 6 . 1 1 73 73 LEU N N 73 123.000 123.000 118.471 4.529 19718
2744 1 6 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.431 -0.671 19718
2745 1 6 . 1 1 73 73 LEU C C 73 175.700 175.700 179.320 -3.620 19718
2746 1 6 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.762 -1.862 19718
2747 1 6 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.141 -4.041 19718
2748 1 6 . 1 1 73 73 LEU H H 73 8.600 8.600 7.336 1.264 19718
2749 1 6 . 1 1 74 74 ASP N N 74 118.500 118.500 118.378 0.122 19718
2750 1 6 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.445 -0.105 19718
2751 1 6 . 1 1 74 74 ASP C C 74 174.700 174.700 177.658 -2.958 19718
2752 1 6 . 1 1 74 74 ASP CA C 74 54.300 54.300 57.047 -2.747 19718
2753 1 6 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.841 -2.641 19718
2754 1 6 . 1 1 74 74 ASP H H 74 7.250 7.250 7.758 -0.508 19718
2755 1 6 . 1 1 75 75 LEU N N 75 116.300 116.300 117.991 -1.691 19718
2756 1 6 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.162 0.138 19718
2757 1 6 . 1 1 75 75 LEU C C 75 174.500 174.500 176.616 -2.116 19718
2758 1 6 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.898 -4.598 19718
2759 1 6 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.687 -2.087 19718
2760 1 6 . 1 1 75 75 LEU H H 75 7.000 7.000 7.462 -0.462 19718
2761 1 6 . 1 1 76 76 ALA N N 76 124.600 124.600 119.948 4.652 19718
2762 1 6 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.364 -0.264 19718
2763 1 6 . 1 1 76 76 ALA C C 76 174.200 174.200 176.785 -2.585 19718
2764 1 6 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.730 -1.230 19718
2765 1 6 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.012 -4.812 19718
2766 1 6 . 1 1 76 76 ALA H H 76 7.590 7.590 7.429 0.161 19718
2767 1 6 . 1 1 77 77 TYR N N 77 122.900 122.900 124.535 -1.635 19718
2768 1 6 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.242 0.189 19718
2769 1 6 . 1 1 77 77 TYR C C 77 174.100 174.100 176.805 -2.705 19718
2770 1 6 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.743 -4.843 19718
2771 1 6 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.234 -3.334 19718
2772 1 6 . 1 1 77 77 TYR H H 77 8.150 8.150 8.618 -0.468 19718
2773 1 6 . 1 1 78 78 GLY N N 78 112.900 112.900 114.325 -1.425 19718
2774 1 6 . 1 1 78 78 GLY C C 78 171.800 171.800 173.967 -2.167 19718
2775 1 6 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.702 -1.002 19718
2776 1 6 . 1 1 78 78 GLY H H 78 8.320 8.320 8.178 0.142 19718
2777 1 6 . 1 1 79 79 LEU N N 79 119.300 119.300 119.022 0.278 19718
2778 1 6 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.338 -0.548 19718
2779 1 6 . 1 1 79 79 LEU C C 79 174.000 174.000 176.412 -2.412 19718
2780 1 6 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.272 -1.272 19718
2781 1 6 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.829 -2.929 19718
2782 1 6 . 1 1 79 79 LEU H H 79 7.120 7.120 7.851 -0.731 19718
2783 1 6 . 1 1 80 80 THR N N 80 118.500 118.500 117.837 0.663 19718
2784 1 6 . 1 1 80 80 THR HA H 80 4.860 4.860 4.590 0.270 19718
2785 1 6 . 1 1 80 80 THR C C 80 173.300 173.300 174.994 -1.694 19718
2786 1 6 . 1 1 80 80 THR CA C 80 57.600 57.600 60.462 -2.862 19718
2787 1 6 . 1 1 80 80 THR CB C 80 71.000 71.000 70.676 0.324 19718
2788 1 6 . 1 1 80 80 THR H H 80 9.240 9.240 7.966 1.274 19718
2789 1 6 . 1 1 81 81 GLU N N 81 118.000 118.000 121.075 -3.075 19718
2790 1 6 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.025 0.085 19718
2791 1 6 . 1 1 81 81 GLU C C 81 173.900 173.900 176.997 -3.097 19718
2792 1 6 . 1 1 81 81 GLU CA C 81 55.400 55.400 59.051 -3.651 19718
2793 1 6 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.510 -2.810 19718
2794 1 6 . 1 1 81 81 GLU H H 81 9.020 9.020 8.851 0.169 19718
2795 1 6 . 1 1 82 82 THR N N 82 106.400 106.400 106.954 -0.554 19718
2796 1 6 . 1 1 82 82 THR HA H 82 3.950 3.950 3.240 0.710 19718
2797 1 6 . 1 1 82 82 THR C C 82 171.700 171.700 173.939 -2.239 19718
2798 1 6 . 1 1 82 82 THR CA C 82 56.800 56.800 58.724 -1.925 19718
2799 1 6 . 1 1 82 82 THR CB C 82 63.800 63.800 67.997 -4.197 19718
2800 1 6 . 1 1 82 82 THR H H 82 7.630 7.630 7.569 0.061 19718
2801 1 6 . 1 1 83 83 SER N N 83 121.500 121.500 119.156 2.344 19718
2802 1 6 . 1 1 83 83 SER HA H 83 5.080 5.080 4.220 0.860 19718
2803 1 6 . 1 1 83 83 SER C C 83 170.900 170.900 173.475 -2.575 19718
2804 1 6 . 1 1 83 83 SER CA C 83 59.000 59.000 59.709 -0.709 19718
2805 1 6 . 1 1 83 83 SER CB C 83 61.700 61.700 63.856 -2.156 19718
2806 1 6 . 1 1 83 83 SER H H 83 6.930 6.930 7.532 -0.602 19718
2807 1 6 . 1 1 84 84 ARG N N 84 119.300 119.300 120.614 -1.314 19718
2808 1 6 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.744 0.126 19718
2809 1 6 . 1 1 84 84 ARG C C 84 172.400 172.400 174.539 -2.139 19718
2810 1 6 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.794 -5.494 19718
2811 1 6 . 1 1 84 84 ARG CB C 84 32.400 32.400 35.164 -2.764 19718
2812 1 6 . 1 1 84 84 ARG H H 84 9.280 9.280 8.690 0.590 19718
2813 1 6 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.377 0.053 19718
2814 1 6 . 1 1 88 88 GLN C C 88 172.500 172.500 174.900 -2.400 19718
2815 1 6 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.343 -4.343 19718
2816 1 6 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.631 -2.631 19718
2817 1 6 . 1 1 90 90 LYS N N 90 123.700 123.700 125.638 -1.938 19718
2818 1 6 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.935 -0.485 19718
2819 1 6 . 1 1 90 90 LYS C C 90 173.500 173.500 175.378 -1.878 19718
2820 1 6 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.434 -1.935 19718
2821 1 6 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.644 -2.744 19718
2822 1 6 . 1 1 90 90 LYS H H 90 8.330 8.330 8.080 0.250 19718
2823 1 6 . 1 1 91 91 MET N N 91 118.200 118.200 119.918 -1.718 19718
2824 1 6 . 1 1 91 91 MET HA H 91 4.330 4.330 4.633 -0.303 19718
2825 1 6 . 1 1 91 91 MET C C 91 174.300 174.300 176.061 -1.761 19718
2826 1 6 . 1 1 91 91 MET CA C 91 51.800 51.800 55.054 -3.254 19718
2827 1 6 . 1 1 91 91 MET CB C 91 27.200 27.200 31.649 -4.449 19718
2828 1 6 . 1 1 91 91 MET H H 91 8.620 8.620 8.489 0.131 19718
2829 1 6 . 1 1 92 92 SER N N 92 117.000 117.000 117.568 -0.568 19718
2830 1 6 . 1 1 92 92 SER HA H 92 4.610 4.610 4.800 -0.190 19718
2831 1 6 . 1 1 92 92 SER C C 92 171.300 171.300 174.908 -3.608 19718
2832 1 6 . 1 1 92 92 SER CA C 92 54.000 54.000 56.057 -2.057 19718
2833 1 6 . 1 1 92 92 SER CB C 92 63.700 63.700 66.454 -2.754 19718
2834 1 6 . 1 1 92 92 SER H H 92 6.970 6.970 8.296 -1.326 19718
2835 1 6 . 1 1 93 93 LYS N N 93 121.700 121.700 121.332 0.368 19718
2836 1 6 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.107 -0.137 19718
2837 1 6 . 1 1 93 93 LYS C C 93 175.200 175.200 177.788 -2.588 19718
2838 1 6 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.567 -1.867 19718
2839 1 6 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.165 -3.065 19718
2840 1 6 . 1 1 93 93 LYS H H 93 9.260 9.260 9.002 0.258 19718
2841 1 6 . 1 1 94 94 ASP N N 94 116.700 116.700 118.884 -2.184 19718
2842 1 6 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.540 -0.180 19718
2843 1 6 . 1 1 94 94 ASP C C 94 174.300 174.300 177.620 -3.320 19718
2844 1 6 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.190 -2.490 19718
2845 1 6 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.224 -3.324 19718
2846 1 6 . 1 1 94 94 ASP H H 94 8.020 8.020 7.710 0.310 19718
2847 1 6 . 1 1 95 95 ILE N N 95 109.000 109.000 112.658 -3.658 19718
2848 1 6 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.498 0.162 19718
2849 1 6 . 1 1 95 95 ILE C C 95 170.600 170.600 175.130 -4.530 19718
2850 1 6 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.580 -3.280 19718
2851 1 6 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.868 -3.668 19718
2852 1 6 . 1 1 95 95 ILE H H 95 7.240 7.240 7.542 -0.302 19718
2853 1 6 . 1 1 96 96 ASP N N 96 119.800 119.800 121.982 -2.182 19718
2854 1 6 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.420 -0.240 19718
2855 1 6 . 1 1 96 96 ASP C C 96 174.900 174.900 176.669 -1.769 19718
2856 1 6 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.197 -1.497 19718
2857 1 6 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.671 -0.671 19718
2858 1 6 . 1 1 96 96 ASP H H 96 6.950 6.950 7.927 -0.977 19718
2859 1 6 . 1 1 97 97 GLY N N 97 118.500 118.500 114.020 4.480 19718
2860 1 6 . 1 1 97 97 GLY C C 97 170.500 170.500 174.390 -3.890 19718
2861 1 6 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.351 -2.051 19718
2862 1 6 . 1 1 97 97 GLY H H 97 9.210 9.210 8.309 0.901 19718
2863 1 6 . 1 1 98 98 ILE N N 98 121.300 121.300 121.938 -0.638 19718
2864 1 6 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.198 2.402 19718
2865 1 6 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.601 -3.001 19718
2866 1 6 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.516 -3.816 19718
2867 1 6 . 1 1 98 98 ILE H H 98 7.660 7.660 8.039 -0.379 19718
2868 1 6 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.183 0.167 19718
2869 1 6 . 1 1 99 99 ARG C C 99 172.200 172.200 175.180 -2.980 19718
2870 1 6 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.507 -4.407 19718
2871 1 6 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.295 -2.795 19718
2872 1 6 . 1 1 100 100 VAL N N 100 114.900 114.900 116.294 -1.394 19718
2873 1 6 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.012 -0.192 19718
2874 1 6 . 1 1 100 100 VAL C C 100 169.600 169.600 173.310 -3.710 19718
2875 1 6 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.089 -3.889 19718
2876 1 6 . 1 1 100 100 VAL CB C 100 32.300 32.300 35.963 -3.663 19718
2877 1 6 . 1 1 100 100 VAL H H 100 8.440 8.440 8.816 -0.376 19718
2878 1 6 . 1 1 101 101 ALA N N 101 123.400 123.400 122.619 0.781 19718
2879 1 6 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.797 0.513 19718
2880 1 6 . 1 1 101 101 ALA C C 101 174.400 174.400 175.156 -0.756 19718
2881 1 6 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.507 -3.707 19718
2882 1 6 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.726 -2.926 19718
2883 1 6 . 1 1 101 101 ALA H H 101 9.040 9.040 8.886 0.154 19718
2884 1 6 . 1 1 102 102 LEU N N 102 120.600 120.600 123.440 -2.840 19718
2885 1 6 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.164 -0.594 19718
2886 1 6 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.999 0.201 19718
2887 1 6 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.451 -6.551 19718
2888 1 6 . 1 1 102 102 LEU H H 102 8.260 8.260 8.355 -0.095 19718
2889 1 6 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.632 -0.052 19718
2890 1 6 . 1 1 112 112 ASN C C 112 171.900 171.900 174.834 -2.934 19718
2891 1 6 . 1 1 112 112 ASN CA C 112 50.400 50.400 54.360 -3.960 19718
2892 1 6 . 1 1 112 112 ASN CB C 112 36.700 36.700 38.779 -2.079 19718
2893 1 6 . 1 1 113 113 ASP N N 113 120.300 120.300 125.455 -5.155 19718
2894 1 6 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.657 -0.217 19718
2895 1 6 . 1 1 113 113 ASP C C 113 173.000 173.000 174.969 -1.969 19718
2896 1 6 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.401 -2.801 19718
2897 1 6 . 1 1 113 113 ASP CB C 113 38.100 38.100 41.494 -3.394 19718
2898 1 6 . 1 1 113 113 ASP H H 113 8.040 8.040 8.731 -0.691 19718
2899 1 6 . 1 1 114 114 PHE N N 114 120.100 120.100 119.916 0.184 19718
2900 1 6 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.842 -0.232 19718
2901 1 6 . 1 1 114 114 PHE C C 114 172.200 172.200 174.450 -2.250 19718
2902 1 6 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.576 -3.676 19718
2903 1 6 . 1 1 114 114 PHE CB C 114 36.500 36.500 40.796 -4.296 19718
2904 1 6 . 1 1 114 114 PHE H H 114 8.110 8.110 8.237 -0.127 19718
2905 1 7 . 1 1 2 2 GLU HA H 2 4.240 4.240 3.984 0.256 19718
2906 1 7 . 1 1 2 2 GLU C C 2 173.400 173.400 175.936 -2.536 19718
2907 1 7 . 1 1 2 2 GLU CA C 2 53.400 53.400 57.080 -3.680 19718
2908 1 7 . 1 1 2 2 GLU CB C 2 27.000 27.000 29.507 -2.507 19718
2909 1 7 . 1 1 3 3 GLU N N 3 121.200 121.200 116.982 4.218 19718
2910 1 7 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.451 -0.071 19718
2911 1 7 . 1 1 3 3 GLU C C 3 173.000 173.000 176.295 -3.295 19718
2912 1 7 . 1 1 3 3 GLU CA C 3 54.400 54.400 55.119 -0.719 19718
2913 1 7 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.757 -3.357 19718
2914 1 7 . 1 1 3 3 GLU H H 3 8.510 8.510 7.848 0.662 19718
2915 1 7 . 1 1 4 4 LEU N N 4 122.400 122.400 121.499 0.901 19718
2916 1 7 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.686 -0.136 19718
2917 1 7 . 1 1 4 4 LEU C C 4 172.900 172.900 175.715 -2.815 19718
2918 1 7 . 1 1 4 4 LEU CA C 4 50.400 50.400 54.192 -3.792 19718
2919 1 7 . 1 1 4 4 LEU CB C 4 41.700 41.700 43.012 -1.312 19718
2920 1 7 . 1 1 4 4 LEU H H 4 8.460 8.460 8.347 0.113 19718
2921 1 7 . 1 1 5 5 LYS N N 5 119.300 119.300 119.443 -0.143 19718
2922 1 7 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.280 0.140 19718
2923 1 7 . 1 1 5 5 LYS C C 5 172.400 172.400 174.488 -2.088 19718
2924 1 7 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.850 -2.550 19718
2925 1 7 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.222 -3.222 19718
2926 1 7 . 1 1 5 5 LYS H H 5 8.570 8.570 8.126 0.444 19718
2927 1 7 . 1 1 6 6 ILE N N 6 116.900 116.900 121.924 -5.024 19718
2928 1 7 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.531 -0.421 19718
2929 1 7 . 1 1 6 6 ILE C C 6 169.800 169.800 173.510 -3.710 19718
2930 1 7 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.670 -4.170 19718
2931 1 7 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.013 -3.013 19718
2932 1 7 . 1 1 6 6 ILE H H 6 8.160 8.160 8.897 -0.737 19718
2933 1 7 . 1 1 7 7 THR N N 7 123.000 123.000 125.726 -2.726 19718
2934 1 7 . 1 1 7 7 THR HA H 7 5.220 5.220 5.037 0.183 19718
2935 1 7 . 1 1 7 7 THR C C 7 169.900 169.900 173.614 -3.714 19718
2936 1 7 . 1 1 7 7 THR CA C 7 58.400 58.400 61.785 -3.385 19718
2937 1 7 . 1 1 7 7 THR CB C 7 68.700 68.700 69.464 -0.764 19718
2938 1 7 . 1 1 7 7 THR H H 7 8.520 8.520 8.369 0.151 19718
2939 1 7 . 1 1 8 8 PHE N N 8 124.000 124.000 124.231 -0.231 19718
2940 1 7 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.540 -0.390 19718
2941 1 7 . 1 1 8 8 PHE C C 8 172.300 172.300 175.091 -2.791 19718
2942 1 7 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.160 -1.560 19718
2943 1 7 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.856 -1.756 19718
2944 1 7 . 1 1 8 8 PHE H H 8 9.290 9.290 9.445 -0.155 19718
2945 1 7 . 1 1 9 9 ILE N N 9 122.700 122.700 121.495 1.205 19718
2946 1 7 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.640 -0.060 19718
2947 1 7 . 1 1 9 9 ILE C C 9 173.600 173.600 176.204 -2.604 19718
2948 1 7 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.931 -2.732 19718
2949 1 7 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.589 -4.089 19718
2950 1 7 . 1 1 9 9 ILE H H 9 9.170 9.170 8.376 0.794 19718
2951 1 7 . 1 1 10 10 LEU N N 10 126.700 126.700 125.355 1.345 19718
2952 1 7 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.498 -0.178 19718
2953 1 7 . 1 1 10 10 LEU C C 10 176.500 176.500 178.502 -2.002 19718
2954 1 7 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.523 -2.323 19718
2955 1 7 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.175 -4.675 19718
2956 1 7 . 1 1 10 10 LEU H H 10 9.100 9.100 9.043 0.057 19718
2957 1 7 . 1 1 11 11 LYS N N 11 118.900 118.900 121.155 -2.255 19718
2958 1 7 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.007 -0.047 19718
2959 1 7 . 1 1 11 11 LYS C C 11 174.100 174.100 177.710 -3.610 19718
2960 1 7 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.486 -2.087 19718
2961 1 7 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.459 -3.559 19718
2962 1 7 . 1 1 11 11 LYS H H 11 8.520 8.520 8.710 -0.190 19718
2963 1 7 . 1 1 12 12 ASP N N 12 114.400 114.400 114.861 -0.461 19718
2964 1 7 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.549 -0.029 19718
2965 1 7 . 1 1 12 12 ASP C C 12 174.500 174.500 177.173 -2.673 19718
2966 1 7 . 1 1 12 12 ASP CA C 12 50.400 50.400 54.122 -3.722 19718
2967 1 7 . 1 1 12 12 ASP CB C 12 37.200 37.200 41.042 -3.842 19718
2968 1 7 . 1 1 12 12 ASP H H 12 7.690 7.690 8.228 -0.538 19718
2969 1 7 . 1 1 13 13 GLY N N 13 109.200 109.200 107.950 1.250 19718
2970 1 7 . 1 1 13 13 GLY C C 13 171.600 171.600 174.486 -2.886 19718
2971 1 7 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.776 -3.377 19718
2972 1 7 . 1 1 13 13 GLY H H 13 8.100 8.100 7.827 0.273 19718
2973 1 7 . 1 1 14 14 SER N N 14 118.000 118.000 115.433 2.567 19718
2974 1 7 . 1 1 14 14 SER HA H 14 4.280 4.280 4.444 -0.164 19718
2975 1 7 . 1 1 14 14 SER C C 14 169.000 169.000 173.939 -4.939 19718
2976 1 7 . 1 1 14 14 SER CA C 14 56.500 56.500 58.160 -1.660 19718
2977 1 7 . 1 1 14 14 SER CB C 14 61.000 61.000 64.035 -3.035 19718
2978 1 7 . 1 1 14 14 SER H H 14 8.110 8.110 8.027 0.083 19718
2979 1 7 . 1 1 15 15 GLN N N 15 116.300 116.300 120.473 -4.173 19718
2980 1 7 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.262 0.398 19718
2981 1 7 . 1 1 15 15 GLN C C 15 173.500 173.500 176.228 -2.728 19718
2982 1 7 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.755 -3.055 19718
2983 1 7 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.468 -2.468 19718
2984 1 7 . 1 1 15 15 GLN H H 15 8.330 8.330 8.462 -0.132 19718
2985 1 7 . 1 1 16 16 LYS N N 16 122.500 122.500 124.338 -1.838 19718
2986 1 7 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.620 -0.290 19718
2987 1 7 . 1 1 16 16 LYS C C 16 171.300 171.300 174.420 -3.120 19718
2988 1 7 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.091 -3.191 19718
2989 1 7 . 1 1 16 16 LYS CB C 16 34.000 34.000 36.011 -2.011 19718
2990 1 7 . 1 1 16 16 LYS H H 16 8.780 8.780 8.826 -0.046 19718
2991 1 7 . 1 1 17 17 THR N N 17 120.000 120.000 118.097 1.903 19718
2992 1 7 . 1 1 17 17 THR HA H 17 5.220 5.220 5.000 0.220 19718
2993 1 7 . 1 1 17 17 THR C C 17 170.500 170.500 173.437 -2.937 19718
2994 1 7 . 1 1 17 17 THR CA C 17 58.700 58.700 60.789 -2.089 19718
2995 1 7 . 1 1 17 17 THR CB C 17 67.900 67.900 70.118 -2.218 19718
2996 1 7 . 1 1 17 17 THR H H 17 8.160 8.160 8.322 -0.162 19718
2997 1 7 . 1 1 18 18 TYR N N 18 125.600 125.600 127.237 -1.637 19718
2998 1 7 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.781 0.059 19718
2999 1 7 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.827 -1.827 19718
3000 1 7 . 1 1 18 18 TYR CB C 18 39.100 39.100 42.629 -3.529 19718
3001 1 7 . 1 1 18 18 TYR H H 18 9.020 9.020 9.060 -0.040 19718
3002 1 7 . 1 1 19 19 GLU C C 19 174.200 174.200 175.631 -1.431 19718
3003 1 7 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.422 -2.522 19718
3004 1 7 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.037 -3.737 19718
3005 1 7 . 1 1 20 20 VAL N N 20 119.000 119.000 118.150 0.850 19718
3006 1 7 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.557 0.283 19718
3007 1 7 . 1 1 20 20 VAL C C 20 171.200 171.200 173.982 -2.782 19718
3008 1 7 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.944 -3.344 19718
3009 1 7 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.316 -2.616 19718
3010 1 7 . 1 1 20 20 VAL H H 20 9.160 9.160 8.867 0.293 19718
3011 1 7 . 1 1 21 21 CYS N N 21 117.500 117.500 119.580 -2.080 19718
3012 1 7 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.763 -0.003 19718
3013 1 7 . 1 1 21 21 CYS C C 21 171.400 171.400 174.431 -3.031 19718
3014 1 7 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.680 -2.780 19718
3015 1 7 . 1 1 21 21 CYS CB C 21 27.200 27.200 29.989 -2.789 19718
3016 1 7 . 1 1 21 21 CYS H H 21 8.720 8.720 8.804 -0.084 19718
3017 1 7 . 1 1 22 22 GLU N N 22 120.900 120.900 122.734 -1.834 19718
3018 1 7 . 1 1 22 22 GLU HA H 22 3.410 3.410 4.076 -0.666 19718
3019 1 7 . 1 1 22 22 GLU C C 22 174.300 174.300 176.895 -2.595 19718
3020 1 7 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.178 -3.079 19718
3021 1 7 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.538 -2.738 19718
3022 1 7 . 1 1 22 22 GLU H H 22 8.540 8.540 8.684 -0.144 19718
3023 1 7 . 1 1 23 23 GLY N N 23 112.400 112.400 115.593 -3.193 19718
3024 1 7 . 1 1 23 23 GLY C C 23 171.000 171.000 174.253 -3.253 19718
3025 1 7 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.832 -2.432 19718
3026 1 7 . 1 1 23 23 GLY H H 23 8.720 8.720 8.868 -0.148 19718
3027 1 7 . 1 1 24 24 GLU N N 24 119.600 119.600 121.673 -2.073 19718
3028 1 7 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.472 -0.142 19718
3029 1 7 . 1 1 24 24 GLU C C 24 174.400 174.400 176.023 -1.623 19718
3030 1 7 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.168 -2.068 19718
3031 1 7 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.634 -2.534 19718
3032 1 7 . 1 1 24 24 GLU H H 24 7.060 7.060 7.720 -0.660 19718
3033 1 7 . 1 1 25 25 THR N N 25 113.600 113.600 117.603 -4.003 19718
3034 1 7 . 1 1 25 25 THR HA H 25 5.510 5.510 4.776 0.734 19718
3035 1 7 . 1 1 25 25 THR C C 25 173.100 173.100 175.313 -2.213 19718
3036 1 7 . 1 1 25 25 THR CA C 25 57.000 57.000 61.018 -4.018 19718
3037 1 7 . 1 1 25 25 THR CB C 25 68.700 68.700 70.720 -2.020 19718
3038 1 7 . 1 1 25 25 THR H H 25 9.080 9.080 8.577 0.503 19718
3039 1 7 . 1 1 26 26 ILE N N 26 120.300 120.300 123.688 -3.388 19718
3040 1 7 . 1 1 26 26 ILE HA H 26 3.630 3.630 4.015 -0.385 19718
3041 1 7 . 1 1 26 26 ILE C C 26 174.700 174.700 177.754 -3.054 19718
3042 1 7 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.513 0.187 19718
3043 1 7 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.918 -3.918 19718
3044 1 7 . 1 1 26 26 ILE H H 26 7.860 7.860 8.359 -0.499 19718
3045 1 7 . 1 1 27 27 LEU N N 27 117.600 117.600 120.301 -2.701 19718
3046 1 7 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.179 -0.429 19718
3047 1 7 . 1 1 27 27 LEU C C 27 174.000 174.000 178.867 -4.867 19718
3048 1 7 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.181 -2.281 19718
3049 1 7 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.802 -1.502 19718
3050 1 7 . 1 1 27 27 LEU H H 27 6.580 6.580 8.576 -1.996 19718
3051 1 7 . 1 1 28 28 ASP N N 28 120.000 120.000 121.171 -1.171 19718
3052 1 7 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.421 -0.171 19718
3053 1 7 . 1 1 28 28 ASP C C 28 177.900 177.900 178.973 -1.073 19718
3054 1 7 . 1 1 28 28 ASP CA C 28 55.000 55.000 58.752 -3.752 19718
3055 1 7 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.775 -3.875 19718
3056 1 7 . 1 1 28 28 ASP H H 28 7.880 7.880 8.141 -0.261 19718
3057 1 7 . 1 1 29 29 ILE N N 29 122.100 122.100 120.542 1.558 19718
3058 1 7 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.890 -0.150 19718
3059 1 7 . 1 1 29 29 ILE C C 29 175.700 175.700 177.955 -2.255 19718
3060 1 7 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.441 -3.341 19718
3061 1 7 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.134 -1.634 19718
3062 1 7 . 1 1 29 29 ILE H H 29 8.340 8.340 8.571 -0.231 19718
3063 1 7 . 1 1 30 30 ALA N N 30 124.100 124.100 122.593 1.507 19718
3064 1 7 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.701 -0.361 19718
3065 1 7 . 1 1 30 30 ALA C C 30 177.600 177.600 179.334 -1.734 19718
3066 1 7 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.335 -2.535 19718
3067 1 7 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.350 -1.550 19718
3068 1 7 . 1 1 30 30 ALA H H 30 8.430 8.430 8.559 -0.129 19718
3069 1 7 . 1 1 31 31 GLN N N 31 116.000 116.000 116.026 -0.026 19718
3070 1 7 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.252 -0.092 19718
3071 1 7 . 1 1 31 31 GLN C C 31 178.100 178.100 178.120 -0.020 19718
3072 1 7 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.272 -0.572 19718
3073 1 7 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.286 -4.086 19718
3074 1 7 . 1 1 31 31 GLN H H 31 8.760 8.760 8.077 0.683 19718
3075 1 7 . 1 1 32 32 GLY N N 32 108.700 108.700 107.408 1.292 19718
3076 1 7 . 1 1 32 32 GLY C C 32 171.700 171.700 175.126 -3.426 19718
3077 1 7 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.954 -2.754 19718
3078 1 7 . 1 1 32 32 GLY H H 32 8.220 8.220 8.108 0.112 19718
3079 1 7 . 1 1 33 33 HIS N N 33 115.000 115.000 119.100 -4.100 19718
3080 1 7 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.617 -0.187 19718
3081 1 7 . 1 1 33 33 HIS C C 33 169.800 169.800 174.416 -4.616 19718
3082 1 7 . 1 1 33 33 HIS CA C 33 53.400 53.400 55.533 -2.133 19718
3083 1 7 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.896 -5.396 19718
3084 1 7 . 1 1 33 33 HIS H H 33 6.980 6.980 8.028 -1.048 19718
3085 1 7 . 1 1 34 34 ASN N N 34 113.700 113.700 114.970 -1.270 19718
3086 1 7 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.358 -0.028 19718
3087 1 7 . 1 1 34 34 ASN C C 34 172.000 172.000 175.089 -3.089 19718
3088 1 7 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.888 -1.788 19718
3089 1 7 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.622 -2.622 19718
3090 1 7 . 1 1 34 34 ASN H H 34 7.700 7.700 8.219 -0.519 19718
3091 1 7 . 1 1 35 35 LEU N N 35 115.600 115.600 118.219 -2.619 19718
3092 1 7 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.203 0.047 19718
3093 1 7 . 1 1 35 35 LEU C C 35 174.900 174.900 176.816 -1.916 19718
3094 1 7 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.457 -4.157 19718
3095 1 7 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.337 -3.137 19718
3096 1 7 . 1 1 35 35 LEU H H 35 7.980 7.980 7.394 0.586 19718
3097 1 7 . 1 1 36 36 ASP N N 36 120.100 120.100 125.574 -5.474 19718
3098 1 7 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.698 -0.268 19718
3099 1 7 . 1 1 36 36 ASP C C 36 171.100 171.100 174.951 -3.851 19718
3100 1 7 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.086 -3.086 19718
3101 1 7 . 1 1 36 36 ASP CB C 36 36.200 36.200 40.104 -3.904 19718
3102 1 7 . 1 1 36 36 ASP H H 36 8.610 8.610 8.642 -0.032 19718
3103 1 7 . 1 1 37 37 MET N N 37 123.900 123.900 118.015 5.885 19718
3104 1 7 . 1 1 37 37 MET HA H 37 4.280 4.280 4.867 -0.587 19718
3105 1 7 . 1 1 37 37 MET C C 37 171.200 171.200 174.306 -3.106 19718
3106 1 7 . 1 1 37 37 MET CA C 37 52.800 52.800 53.977 -1.177 19718
3107 1 7 . 1 1 37 37 MET CB C 37 33.000 33.000 35.764 -2.764 19718
3108 1 7 . 1 1 37 37 MET H H 37 7.670 7.670 7.542 0.128 19718
3109 1 7 . 1 1 38 38 GLU N N 38 128.600 128.600 122.804 5.796 19718
3110 1 7 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.396 -0.106 19718
3111 1 7 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.164 -2.964 19718
3112 1 7 . 1 1 38 38 GLU CB C 38 29.400 29.400 29.259 0.141 19718
3113 1 7 . 1 1 38 38 GLU H H 38 9.060 9.060 8.815 0.245 19718
3114 1 7 . 1 1 51 51 HIS C C 51 170.700 170.700 174.345 -3.645 19718
3115 1 7 . 1 1 51 51 HIS CA C 51 52.800 52.800 53.869 -1.069 19718
3116 1 7 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.569 -0.869 19718
3117 1 7 . 1 1 53 53 ILE N N 53 122.200 122.200 121.088 1.112 19718
3118 1 7 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.947 -0.937 19718
3119 1 7 . 1 1 53 53 ILE C C 53 174.400 174.400 173.443 0.957 19718
3120 1 7 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.653 0.047 19718
3121 1 7 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.953 -5.653 19718
3122 1 7 . 1 1 53 53 ILE H H 53 8.800 8.800 8.136 0.664 19718
3123 1 7 . 1 1 54 54 VAL N N 54 130.200 130.200 126.378 3.822 19718
3124 1 7 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.759 -0.889 19718
3125 1 7 . 1 1 54 54 VAL C C 54 172.500 172.500 174.705 -2.205 19718
3126 1 7 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.601 1.299 19718
3127 1 7 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.227 -5.627 19718
3128 1 7 . 1 1 54 54 VAL H H 54 8.380 8.380 8.833 -0.453 19718
3129 1 7 . 1 1 55 55 ASP N N 55 129.100 129.100 127.002 2.098 19718
3130 1 7 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.676 -0.086 19718
3131 1 7 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.577 -2.877 19718
3132 1 7 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.886 -1.386 19718
3133 1 7 . 1 1 55 55 ASP H H 55 8.160 8.160 8.099 0.061 19718
3134 1 7 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.235 -0.065 19718
3135 1 7 . 1 1 56 56 PRO C C 56 174.900 174.900 177.441 -2.541 19718
3136 1 7 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.860 -1.860 19718
3137 1 7 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.727 -2.326 19718
3138 1 7 . 1 1 57 57 ASP N N 57 117.100 117.100 117.690 -0.590 19718
3139 1 7 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.400 -0.030 19718
3140 1 7 . 1 1 57 57 ASP C C 57 174.100 174.100 177.595 -3.495 19718
3141 1 7 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.837 -3.136 19718
3142 1 7 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.936 -4.136 19718
3143 1 7 . 1 1 57 57 ASP H H 57 9.110 9.110 8.697 0.413 19718
3144 1 7 . 1 1 58 58 TYR N N 58 115.800 115.800 117.674 -1.874 19718
3145 1 7 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.474 -0.114 19718
3146 1 7 . 1 1 58 58 TYR C C 58 173.200 173.200 177.916 -4.716 19718
3147 1 7 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.609 -2.909 19718
3148 1 7 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.118 -0.218 19718
3149 1 7 . 1 1 58 58 TYR H H 58 8.190 8.190 7.831 0.359 19718
3150 1 7 . 1 1 59 59 TYR N N 59 120.100 120.100 121.495 -1.395 19718
3151 1 7 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.172 -0.392 19718
3152 1 7 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.392 -0.292 19718
3153 1 7 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.382 -1.982 19718
3154 1 7 . 1 1 59 59 TYR H H 59 7.420 7.420 8.037 -0.617 19718
3155 1 7 . 1 1 60 60 ASP N N 60 115.200 115.200 118.285 -3.085 19718
3156 1 7 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.567 -0.207 19718
3157 1 7 . 1 1 60 60 ASP C C 60 173.100 173.100 176.023 -2.923 19718
3158 1 7 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.316 -1.916 19718
3159 1 7 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.128 -2.628 19718
3160 1 7 . 1 1 60 60 ASP H H 60 8.440 8.440 8.184 0.256 19718
3161 1 7 . 1 1 61 61 ALA N N 61 120.200 120.200 120.656 -0.456 19718
3162 1 7 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.506 -0.326 19718
3163 1 7 . 1 1 61 61 ALA C C 61 175.000 175.000 177.378 -2.378 19718
3164 1 7 . 1 1 61 61 ALA CA C 61 49.300 49.300 51.645 -2.345 19718
3165 1 7 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.344 -4.144 19718
3166 1 7 . 1 1 61 61 ALA H H 61 7.300 7.300 7.432 -0.132 19718
3167 1 7 . 1 1 62 62 LEU N N 62 118.000 118.000 122.312 -4.312 19718
3168 1 7 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.649 -0.359 19718
3169 1 7 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.819 -2.719 19718
3170 1 7 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.774 -3.074 19718
3171 1 7 . 1 1 62 62 LEU H H 62 6.680 6.680 7.516 -0.836 19718
3172 1 7 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.587 -0.267 19718
3173 1 7 . 1 1 63 63 PRO C C 63 173.500 173.500 176.007 -2.507 19718
3174 1 7 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.045 -2.345 19718
3175 1 7 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.462 -3.962 19718
3176 1 7 . 1 1 64 64 GLU N N 64 124.500 124.500 119.156 5.344 19718
3177 1 7 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.557 -0.377 19718
3178 1 7 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.501 -2.001 19718
3179 1 7 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.415 -4.615 19718
3180 1 7 . 1 1 64 64 GLU H H 64 8.590 8.590 8.446 0.144 19718
3181 1 7 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.653 -0.483 19718
3182 1 7 . 1 1 65 65 PRO C C 65 174.900 174.900 176.088 -1.188 19718
3183 1 7 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.034 0.966 19718
3184 1 7 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.244 -4.744 19718
3185 1 7 . 1 1 66 66 GLU N N 66 123.300 123.300 119.901 3.399 19718
3186 1 7 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.104 0.226 19718
3187 1 7 . 1 1 66 66 GLU C C 66 174.200 174.200 177.391 -3.191 19718
3188 1 7 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.839 -4.339 19718
3189 1 7 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.404 -3.004 19718
3190 1 7 . 1 1 66 66 GLU H H 66 9.080 9.080 8.556 0.524 19718
3191 1 7 . 1 1 67 67 ASP N N 67 120.100 120.100 121.645 -1.545 19718
3192 1 7 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.578 -0.338 19718
3193 1 7 . 1 1 67 67 ASP C C 67 174.900 174.900 176.458 -1.558 19718
3194 1 7 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.516 -1.116 19718
3195 1 7 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.941 -3.141 19718
3196 1 7 . 1 1 67 67 ASP H H 67 8.690 8.690 8.677 0.013 19718
3197 1 7 . 1 1 68 68 ASP N N 68 116.800 116.800 117.009 -0.209 19718
3198 1 7 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.541 -0.301 19718
3199 1 7 . 1 1 68 68 ASP C C 68 175.500 175.500 177.487 -1.987 19718
3200 1 7 . 1 1 68 68 ASP CA C 68 54.300 54.300 56.116 -1.816 19718
3201 1 7 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.222 -5.122 19718
3202 1 7 . 1 1 68 68 ASP H H 68 8.400 8.400 8.568 -0.168 19718
3203 1 7 . 1 1 69 69 GLU N N 69 123.600 123.600 119.582 4.018 19718
3204 1 7 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.141 0.009 19718
3205 1 7 . 1 1 69 69 GLU C C 69 175.200 175.200 178.525 -3.325 19718
3206 1 7 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.908 -2.708 19718
3207 1 7 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.096 -4.096 19718
3208 1 7 . 1 1 69 69 GLU H H 69 7.530 7.530 8.001 -0.471 19718
3209 1 7 . 1 1 70 70 ASN N N 70 119.100 119.100 117.780 1.320 19718
3210 1 7 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.520 -0.160 19718
3211 1 7 . 1 1 70 70 ASN C C 70 175.200 175.200 176.776 -1.576 19718
3212 1 7 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.303 -1.603 19718
3213 1 7 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.819 -3.019 19718
3214 1 7 . 1 1 70 70 ASN H H 70 7.960 7.960 8.442 -0.482 19718
3215 1 7 . 1 1 71 71 ASP N N 71 118.400 118.400 119.878 -1.478 19718
3216 1 7 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.403 -0.153 19718
3217 1 7 . 1 1 71 71 ASP C C 71 176.000 176.000 177.654 -1.654 19718
3218 1 7 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.974 -2.373 19718
3219 1 7 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.879 -3.379 19718
3220 1 7 . 1 1 71 71 ASP H H 71 8.250 8.250 8.362 -0.112 19718
3221 1 7 . 1 1 72 72 MET N N 72 117.300 117.300 116.673 0.627 19718
3222 1 7 . 1 1 72 72 MET HA H 72 4.370 4.370 4.193 0.177 19718
3223 1 7 . 1 1 72 72 MET C C 72 177.800 177.800 177.781 0.019 19718
3224 1 7 . 1 1 72 72 MET CA C 72 53.700 53.700 57.881 -4.181 19718
3225 1 7 . 1 1 72 72 MET CB C 72 32.400 32.400 32.270 0.130 19718
3226 1 7 . 1 1 72 72 MET H H 72 7.240 7.240 7.605 -0.365 19718
3227 1 7 . 1 1 73 73 LEU N N 73 123.000 123.000 120.539 2.461 19718
3228 1 7 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.177 -0.417 19718
3229 1 7 . 1 1 73 73 LEU C C 73 175.700 175.700 179.411 -3.711 19718
3230 1 7 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.622 -2.722 19718
3231 1 7 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.714 -3.614 19718
3232 1 7 . 1 1 73 73 LEU H H 73 8.600 8.600 7.243 1.357 19718
3233 1 7 . 1 1 74 74 ASP N N 74 118.500 118.500 118.932 -0.432 19718
3234 1 7 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.398 -0.058 19718
3235 1 7 . 1 1 74 74 ASP C C 74 174.700 174.700 177.808 -3.108 19718
3236 1 7 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.880 -2.580 19718
3237 1 7 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.759 -2.559 19718
3238 1 7 . 1 1 74 74 ASP H H 74 7.250 7.250 7.706 -0.456 19718
3239 1 7 . 1 1 75 75 LEU N N 75 116.300 116.300 118.312 -2.012 19718
3240 1 7 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.149 0.151 19718
3241 1 7 . 1 1 75 75 LEU C C 75 174.500 174.500 177.248 -2.748 19718
3242 1 7 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.504 -4.204 19718
3243 1 7 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.684 -2.084 19718
3244 1 7 . 1 1 75 75 LEU H H 75 7.000 7.000 7.361 -0.361 19718
3245 1 7 . 1 1 76 76 ALA N N 76 124.600 124.600 120.988 3.612 19718
3246 1 7 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.407 -0.307 19718
3247 1 7 . 1 1 76 76 ALA C C 76 174.200 174.200 176.525 -2.325 19718
3248 1 7 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.321 -1.821 19718
3249 1 7 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.562 -5.362 19718
3250 1 7 . 1 1 76 76 ALA H H 76 7.590 7.590 7.531 0.059 19718
3251 1 7 . 1 1 77 77 TYR N N 77 122.900 122.900 124.851 -1.951 19718
3252 1 7 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.279 0.151 19718
3253 1 7 . 1 1 77 77 TYR C C 77 174.100 174.100 177.067 -2.967 19718
3254 1 7 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.131 -4.231 19718
3255 1 7 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.142 -3.242 19718
3256 1 7 . 1 1 77 77 TYR H H 77 8.150 8.150 8.678 -0.528 19718
3257 1 7 . 1 1 78 78 GLY N N 78 112.900 112.900 114.662 -1.762 19718
3258 1 7 . 1 1 78 78 GLY C C 78 171.800 171.800 173.786 -1.986 19718
3259 1 7 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.560 -0.860 19718
3260 1 7 . 1 1 78 78 GLY H H 78 8.320 8.320 8.290 0.030 19718
3261 1 7 . 1 1 79 79 LEU N N 79 119.300 119.300 119.335 -0.035 19718
3262 1 7 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.131 -0.341 19718
3263 1 7 . 1 1 79 79 LEU C C 79 174.000 174.000 176.412 -2.412 19718
3264 1 7 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.245 -1.245 19718
3265 1 7 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.800 -2.901 19718
3266 1 7 . 1 1 79 79 LEU H H 79 7.120 7.120 7.822 -0.702 19718
3267 1 7 . 1 1 80 80 THR N N 80 118.500 118.500 117.690 0.810 19718
3268 1 7 . 1 1 80 80 THR HA H 80 4.860 4.860 4.425 0.435 19718
3269 1 7 . 1 1 80 80 THR C C 80 173.300 173.300 175.682 -2.382 19718
3270 1 7 . 1 1 80 80 THR CA C 80 57.600 57.600 61.236 -3.636 19718
3271 1 7 . 1 1 80 80 THR CB C 80 71.000 71.000 69.829 1.171 19718
3272 1 7 . 1 1 80 80 THR H H 80 9.240 9.240 8.067 1.173 19718
3273 1 7 . 1 1 81 81 GLU N N 81 118.000 118.000 120.228 -2.228 19718
3274 1 7 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.083 0.027 19718
3275 1 7 . 1 1 81 81 GLU C C 81 173.900 173.900 176.002 -2.102 19718
3276 1 7 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.722 -3.322 19718
3277 1 7 . 1 1 81 81 GLU CB C 81 26.700 26.700 28.913 -2.213 19718
3278 1 7 . 1 1 81 81 GLU H H 81 9.020 9.020 8.853 0.167 19718
3279 1 7 . 1 1 82 82 THR N N 82 106.400 106.400 105.974 0.426 19718
3280 1 7 . 1 1 82 82 THR HA H 82 3.950 3.950 2.552 1.398 19718
3281 1 7 . 1 1 82 82 THR C C 82 171.700 171.700 173.340 -1.640 19718
3282 1 7 . 1 1 82 82 THR CA C 82 56.800 56.800 59.854 -3.054 19718
3283 1 7 . 1 1 82 82 THR CB C 82 63.800 63.800 68.135 -4.335 19718
3284 1 7 . 1 1 82 82 THR H H 82 7.630 7.630 7.461 0.169 19718
3285 1 7 . 1 1 83 83 SER N N 83 121.500 121.500 118.705 2.795 19718
3286 1 7 . 1 1 83 83 SER HA H 83 5.080 5.080 4.631 0.449 19718
3287 1 7 . 1 1 83 83 SER C C 83 170.900 170.900 174.301 -3.401 19718
3288 1 7 . 1 1 83 83 SER CA C 83 59.000 59.000 59.631 -0.631 19718
3289 1 7 . 1 1 83 83 SER CB C 83 61.700 61.700 63.748 -2.048 19718
3290 1 7 . 1 1 83 83 SER H H 83 6.930 6.930 7.777 -0.847 19718
3291 1 7 . 1 1 84 84 ARG N N 84 119.300 119.300 126.601 -7.301 19718
3292 1 7 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.713 0.157 19718
3293 1 7 . 1 1 84 84 ARG C C 84 172.400 172.400 173.934 -1.534 19718
3294 1 7 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.938 -5.638 19718
3295 1 7 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.551 -2.151 19718
3296 1 7 . 1 1 84 84 ARG H H 84 9.280 9.280 9.079 0.201 19718
3297 1 7 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.563 -0.133 19718
3298 1 7 . 1 1 88 88 GLN C C 88 172.500 172.500 175.619 -3.119 19718
3299 1 7 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.082 -4.082 19718
3300 1 7 . 1 1 88 88 GLN CB C 88 27.000 27.000 30.402 -3.402 19718
3301 1 7 . 1 1 90 90 LYS N N 90 123.700 123.700 125.001 -1.301 19718
3302 1 7 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.969 -0.519 19718
3303 1 7 . 1 1 90 90 LYS C C 90 173.500 173.500 175.513 -2.013 19718
3304 1 7 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.927 -2.427 19718
3305 1 7 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.366 -2.466 19718
3306 1 7 . 1 1 90 90 LYS H H 90 8.330 8.330 8.131 0.199 19718
3307 1 7 . 1 1 91 91 MET N N 91 118.200 118.200 119.322 -1.122 19718
3308 1 7 . 1 1 91 91 MET HA H 91 4.330 4.330 4.562 -0.232 19718
3309 1 7 . 1 1 91 91 MET C C 91 174.300 174.300 175.479 -1.179 19718
3310 1 7 . 1 1 91 91 MET CA C 91 51.800 51.800 55.629 -3.829 19718
3311 1 7 . 1 1 91 91 MET CB C 91 27.200 27.200 31.582 -4.382 19718
3312 1 7 . 1 1 91 91 MET H H 91 8.620 8.620 8.489 0.131 19718
3313 1 7 . 1 1 92 92 SER N N 92 117.000 117.000 117.572 -0.572 19718
3314 1 7 . 1 1 92 92 SER HA H 92 4.610 4.610 4.822 -0.212 19718
3315 1 7 . 1 1 92 92 SER C C 92 171.300 171.300 175.150 -3.850 19718
3316 1 7 . 1 1 92 92 SER CA C 92 54.000 54.000 56.581 -2.582 19718
3317 1 7 . 1 1 92 92 SER CB C 92 63.700 63.700 66.259 -2.559 19718
3318 1 7 . 1 1 92 92 SER H H 92 6.970 6.970 8.233 -1.263 19718
3319 1 7 . 1 1 93 93 LYS N N 93 121.700 121.700 121.157 0.543 19718
3320 1 7 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.086 -0.116 19718
3321 1 7 . 1 1 93 93 LYS C C 93 175.200 175.200 177.624 -2.424 19718
3322 1 7 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.892 -2.192 19718
3323 1 7 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.039 -2.939 19718
3324 1 7 . 1 1 93 93 LYS H H 93 9.260 9.260 8.949 0.311 19718
3325 1 7 . 1 1 94 94 ASP N N 94 116.700 116.700 119.104 -2.404 19718
3326 1 7 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.534 -0.174 19718
3327 1 7 . 1 1 94 94 ASP C C 94 174.300 174.300 177.664 -3.364 19718
3328 1 7 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.355 -2.655 19718
3329 1 7 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.328 -3.428 19718
3330 1 7 . 1 1 94 94 ASP H H 94 8.020 8.020 7.630 0.390 19718
3331 1 7 . 1 1 95 95 ILE N N 95 109.000 109.000 113.187 -4.187 19718
3332 1 7 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.527 0.133 19718
3333 1 7 . 1 1 95 95 ILE C C 95 170.600 170.600 175.117 -4.517 19718
3334 1 7 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.921 -3.621 19718
3335 1 7 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.146 -2.946 19718
3336 1 7 . 1 1 95 95 ILE H H 95 7.240 7.240 7.518 -0.278 19718
3337 1 7 . 1 1 96 96 ASP N N 96 119.800 119.800 122.123 -2.323 19718
3338 1 7 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.422 -0.242 19718
3339 1 7 . 1 1 96 96 ASP C C 96 174.900 174.900 176.786 -1.886 19718
3340 1 7 . 1 1 96 96 ASP CA C 96 53.700 53.700 53.974 -0.274 19718
3341 1 7 . 1 1 96 96 ASP CB C 96 39.000 39.000 38.888 0.112 19718
3342 1 7 . 1 1 96 96 ASP H H 96 6.950 6.950 8.128 -1.178 19718
3343 1 7 . 1 1 97 97 GLY N N 97 118.500 118.500 110.319 8.181 19718
3344 1 7 . 1 1 97 97 GLY C C 97 170.500 170.500 173.484 -2.984 19718
3345 1 7 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.544 -2.244 19718
3346 1 7 . 1 1 97 97 GLY H H 97 9.210 9.210 8.463 0.747 19718
3347 1 7 . 1 1 98 98 ILE N N 98 121.300 121.300 121.431 -0.131 19718
3348 1 7 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.171 2.429 19718
3349 1 7 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.995 -3.395 19718
3350 1 7 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.446 -3.746 19718
3351 1 7 . 1 1 98 98 ILE H H 98 7.660 7.660 8.086 -0.426 19718
3352 1 7 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.196 0.154 19718
3353 1 7 . 1 1 99 99 ARG C C 99 172.200 172.200 174.986 -2.786 19718
3354 1 7 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.402 -4.302 19718
3355 1 7 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.586 -3.086 19718
3356 1 7 . 1 1 100 100 VAL N N 100 114.900 114.900 116.524 -1.624 19718
3357 1 7 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.125 -0.305 19718
3358 1 7 . 1 1 100 100 VAL C C 100 169.600 169.600 173.337 -3.737 19718
3359 1 7 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.139 -3.939 19718
3360 1 7 . 1 1 100 100 VAL CB C 100 32.300 32.300 35.912 -3.612 19718
3361 1 7 . 1 1 100 100 VAL H H 100 8.440 8.440 8.901 -0.461 19718
3362 1 7 . 1 1 101 101 ALA N N 101 123.400 123.400 122.836 0.564 19718
3363 1 7 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.756 0.554 19718
3364 1 7 . 1 1 101 101 ALA C C 101 174.400 174.400 175.142 -0.742 19718
3365 1 7 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.385 -3.585 19718
3366 1 7 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.859 -3.059 19718
3367 1 7 . 1 1 101 101 ALA H H 101 9.040 9.040 8.942 0.098 19718
3368 1 7 . 1 1 102 102 LEU N N 102 120.600 120.600 124.127 -3.527 19718
3369 1 7 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.101 -0.531 19718
3370 1 7 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.894 0.306 19718
3371 1 7 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.989 -7.089 19718
3372 1 7 . 1 1 102 102 LEU H H 102 8.260 8.260 7.981 0.279 19718
3373 1 7 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.880 -0.300 19718
3374 1 7 . 1 1 112 112 ASN C C 112 171.900 171.900 174.306 -2.406 19718
3375 1 7 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.370 -2.970 19718
3376 1 7 . 1 1 112 112 ASN CB C 112 36.700 36.700 40.953 -4.253 19718
3377 1 7 . 1 1 113 113 ASP N N 113 120.300 120.300 122.922 -2.622 19718
3378 1 7 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.437 0.003 19718
3379 1 7 . 1 1 113 113 ASP C C 113 173.000 173.000 175.789 -2.789 19718
3380 1 7 . 1 1 113 113 ASP CA C 113 51.600 51.600 55.203 -3.603 19718
3381 1 7 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.590 -2.490 19718
3382 1 7 . 1 1 113 113 ASP H H 113 8.040 8.040 8.797 -0.757 19718
3383 1 7 . 1 1 114 114 PHE N N 114 120.100 120.100 120.396 -0.296 19718
3384 1 7 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.710 -0.100 19718
3385 1 7 . 1 1 114 114 PHE C C 114 172.200 172.200 175.782 -3.582 19718
3386 1 7 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.267 -3.367 19718
3387 1 7 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.529 -3.030 19718
3388 1 7 . 1 1 114 114 PHE H H 114 8.110 8.110 8.519 -0.409 19718
3389 1 8 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.624 -0.384 19718
3390 1 8 . 1 1 2 2 GLU C C 2 173.400 173.400 175.346 -1.946 19718
3391 1 8 . 1 1 2 2 GLU CA C 2 53.400 53.400 55.582 -2.182 19718
3392 1 8 . 1 1 2 2 GLU CB C 2 27.000 27.000 31.808 -4.808 19718
3393 1 8 . 1 1 3 3 GLU N N 3 121.200 121.200 120.524 0.676 19718
3394 1 8 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.579 -0.199 19718
3395 1 8 . 1 1 3 3 GLU C C 3 173.000 173.000 176.228 -3.228 19718
3396 1 8 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.732 -2.332 19718
3397 1 8 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.251 -2.851 19718
3398 1 8 . 1 1 3 3 GLU H H 3 8.510 8.510 8.520 -0.010 19718
3399 1 8 . 1 1 4 4 LEU N N 4 122.400 122.400 123.819 -1.419 19718
3400 1 8 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.845 -0.295 19718
3401 1 8 . 1 1 4 4 LEU C C 4 172.900 172.900 175.586 -2.686 19718
3402 1 8 . 1 1 4 4 LEU CA C 4 50.400 50.400 52.883 -2.483 19718
3403 1 8 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.432 -4.732 19718
3404 1 8 . 1 1 4 4 LEU H H 4 8.460 8.460 9.041 -0.581 19718
3405 1 8 . 1 1 5 5 LYS N N 5 119.300 119.300 118.888 0.412 19718
3406 1 8 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.318 0.102 19718
3407 1 8 . 1 1 5 5 LYS C C 5 172.400 172.400 174.400 -2.000 19718
3408 1 8 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.631 -2.331 19718
3409 1 8 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.554 -3.554 19718
3410 1 8 . 1 1 5 5 LYS H H 5 8.570 8.570 8.298 0.272 19718
3411 1 8 . 1 1 6 6 ILE N N 6 116.900 116.900 121.724 -4.824 19718
3412 1 8 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.532 -0.422 19718
3413 1 8 . 1 1 6 6 ILE C C 6 169.800 169.800 173.380 -3.580 19718
3414 1 8 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.253 -3.753 19718
3415 1 8 . 1 1 6 6 ILE CB C 6 38.000 38.000 40.864 -2.865 19718
3416 1 8 . 1 1 6 6 ILE H H 6 8.160 8.160 8.868 -0.708 19718
3417 1 8 . 1 1 7 7 THR N N 7 123.000 123.000 125.472 -2.472 19718
3418 1 8 . 1 1 7 7 THR HA H 7 5.220 5.220 5.170 0.050 19718
3419 1 8 . 1 1 7 7 THR C C 7 169.900 169.900 173.443 -3.543 19718
3420 1 8 . 1 1 7 7 THR CA C 7 58.400 58.400 61.124 -2.724 19718
3421 1 8 . 1 1 7 7 THR CB C 7 68.700 68.700 69.902 -1.202 19718
3422 1 8 . 1 1 7 7 THR H H 7 8.520 8.520 8.643 -0.123 19718
3423 1 8 . 1 1 8 8 PHE N N 8 124.000 124.000 123.996 0.004 19718
3424 1 8 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.549 -0.399 19718
3425 1 8 . 1 1 8 8 PHE C C 8 172.300 172.300 175.143 -2.843 19718
3426 1 8 . 1 1 8 8 PHE CA C 8 53.600 53.600 54.962 -1.362 19718
3427 1 8 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.898 -1.798 19718
3428 1 8 . 1 1 8 8 PHE H H 8 9.290 9.290 9.337 -0.047 19718
3429 1 8 . 1 1 9 9 ILE N N 9 122.700 122.700 122.479 0.221 19718
3430 1 8 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.630 -0.050 19718
3431 1 8 . 1 1 9 9 ILE C C 9 173.600 173.600 176.173 -2.573 19718
3432 1 8 . 1 1 9 9 ILE CA C 9 58.200 58.200 61.071 -2.871 19718
3433 1 8 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.929 -3.429 19718
3434 1 8 . 1 1 9 9 ILE H H 9 9.170 9.170 8.654 0.516 19718
3435 1 8 . 1 1 10 10 LEU N N 10 126.700 126.700 127.051 -0.351 19718
3436 1 8 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.330 -0.010 19718
3437 1 8 . 1 1 10 10 LEU C C 10 176.500 176.500 178.678 -2.178 19718
3438 1 8 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.236 -3.035 19718
3439 1 8 . 1 1 10 10 LEU CB C 10 37.500 37.500 41.978 -4.478 19718
3440 1 8 . 1 1 10 10 LEU H H 10 9.100 9.100 8.942 0.158 19718
3441 1 8 . 1 1 11 11 LYS N N 11 118.900 118.900 120.144 -1.244 19718
3442 1 8 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.212 -0.252 19718
3443 1 8 . 1 1 11 11 LYS C C 11 174.100 174.100 177.246 -3.146 19718
3444 1 8 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.466 -1.066 19718
3445 1 8 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.211 -3.311 19718
3446 1 8 . 1 1 11 11 LYS H H 11 8.520 8.520 8.984 -0.464 19718
3447 1 8 . 1 1 12 12 ASP N N 12 114.400 114.400 118.393 -3.993 19718
3448 1 8 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.640 -0.120 19718
3449 1 8 . 1 1 12 12 ASP C C 12 174.500 174.500 176.834 -2.334 19718
3450 1 8 . 1 1 12 12 ASP CA C 12 50.400 50.400 54.316 -3.916 19718
3451 1 8 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.189 -2.989 19718
3452 1 8 . 1 1 12 12 ASP H H 12 7.690 7.690 8.049 -0.359 19718
3453 1 8 . 1 1 13 13 GLY N N 13 109.200 109.200 108.757 0.443 19718
3454 1 8 . 1 1 13 13 GLY C C 13 171.600 171.600 174.427 -2.827 19718
3455 1 8 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.413 -3.013 19718
3456 1 8 . 1 1 13 13 GLY H H 13 8.100 8.100 7.612 0.488 19718
3457 1 8 . 1 1 14 14 SER N N 14 118.000 118.000 115.316 2.684 19718
3458 1 8 . 1 1 14 14 SER HA H 14 4.280 4.280 4.361 -0.081 19718
3459 1 8 . 1 1 14 14 SER C C 14 169.000 169.000 173.735 -4.735 19718
3460 1 8 . 1 1 14 14 SER CA C 14 56.500 56.500 58.520 -2.020 19718
3461 1 8 . 1 1 14 14 SER CB C 14 61.000 61.000 63.770 -2.770 19718
3462 1 8 . 1 1 14 14 SER H H 14 8.110 8.110 7.834 0.276 19718
3463 1 8 . 1 1 15 15 GLN N N 15 116.300 116.300 120.608 -4.308 19718
3464 1 8 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.222 0.438 19718
3465 1 8 . 1 1 15 15 GLN C C 15 173.500 173.500 176.072 -2.572 19718
3466 1 8 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.928 -3.228 19718
3467 1 8 . 1 1 15 15 GLN CB C 15 29.000 29.000 30.986 -1.986 19718
3468 1 8 . 1 1 15 15 GLN H H 15 8.330 8.330 8.522 -0.192 19718
3469 1 8 . 1 1 16 16 LYS N N 16 122.500 122.500 125.397 -2.897 19718
3470 1 8 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.541 -0.211 19718
3471 1 8 . 1 1 16 16 LYS C C 16 171.300 171.300 174.458 -3.158 19718
3472 1 8 . 1 1 16 16 LYS CA C 16 51.900 51.900 54.941 -3.042 19718
3473 1 8 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.968 -1.968 19718
3474 1 8 . 1 1 16 16 LYS H H 16 8.780 8.780 8.700 0.080 19718
3475 1 8 . 1 1 17 17 THR N N 17 120.000 120.000 120.100 -0.100 19718
3476 1 8 . 1 1 17 17 THR HA H 17 5.220 5.220 4.848 0.372 19718
3477 1 8 . 1 1 17 17 THR C C 17 170.500 170.500 173.256 -2.756 19718
3478 1 8 . 1 1 17 17 THR CA C 17 58.700 58.700 61.882 -3.182 19718
3479 1 8 . 1 1 17 17 THR CB C 17 67.900 67.900 69.770 -1.870 19718
3480 1 8 . 1 1 17 17 THR H H 17 8.160 8.160 8.311 -0.151 19718
3481 1 8 . 1 1 18 18 TYR N N 18 125.600 125.600 125.374 0.226 19718
3482 1 8 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.725 0.115 19718
3483 1 8 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.686 -1.686 19718
3484 1 8 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.884 -2.784 19718
3485 1 8 . 1 1 18 18 TYR H H 18 9.020 9.020 9.124 -0.104 19718
3486 1 8 . 1 1 19 19 GLU C C 19 174.200 174.200 176.342 -2.142 19718
3487 1 8 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.896 -2.996 19718
3488 1 8 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.918 -3.618 19718
3489 1 8 . 1 1 20 20 VAL N N 20 119.000 119.000 119.127 -0.127 19718
3490 1 8 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.689 0.151 19718
3491 1 8 . 1 1 20 20 VAL C C 20 171.200 171.200 173.648 -2.448 19718
3492 1 8 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.115 -2.515 19718
3493 1 8 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.655 -1.955 19718
3494 1 8 . 1 1 20 20 VAL H H 20 9.160 9.160 9.012 0.148 19718
3495 1 8 . 1 1 21 21 CYS N N 21 117.500 117.500 119.161 -1.661 19718
3496 1 8 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.795 -0.035 19718
3497 1 8 . 1 1 21 21 CYS C C 21 171.400 171.400 174.609 -3.209 19718
3498 1 8 . 1 1 21 21 CYS CA C 21 54.900 54.900 58.040 -3.140 19718
3499 1 8 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.711 -3.511 19718
3500 1 8 . 1 1 21 21 CYS H H 21 8.720 8.720 8.993 -0.273 19718
3501 1 8 . 1 1 22 22 GLU N N 22 120.900 120.900 122.923 -2.023 19718
3502 1 8 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.984 -0.574 19718
3503 1 8 . 1 1 22 22 GLU C C 22 174.300 174.300 177.193 -2.893 19718
3504 1 8 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.517 -3.417 19718
3505 1 8 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.896 -3.096 19718
3506 1 8 . 1 1 22 22 GLU H H 22 8.540 8.540 8.895 -0.355 19718
3507 1 8 . 1 1 23 23 GLY N N 23 112.400 112.400 115.559 -3.159 19718
3508 1 8 . 1 1 23 23 GLY C C 23 171.000 171.000 174.340 -3.340 19718
3509 1 8 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.038 -2.638 19718
3510 1 8 . 1 1 23 23 GLY H H 23 8.720 8.720 8.851 -0.131 19718
3511 1 8 . 1 1 24 24 GLU N N 24 119.600 119.600 120.978 -1.378 19718
3512 1 8 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.375 -0.045 19718
3513 1 8 . 1 1 24 24 GLU C C 24 174.400 174.400 175.976 -1.576 19718
3514 1 8 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.072 -1.972 19718
3515 1 8 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.563 -2.463 19718
3516 1 8 . 1 1 24 24 GLU H H 24 7.060 7.060 7.744 -0.684 19718
3517 1 8 . 1 1 25 25 THR N N 25 113.600 113.600 118.090 -4.490 19718
3518 1 8 . 1 1 25 25 THR HA H 25 5.510 5.510 4.830 0.680 19718
3519 1 8 . 1 1 25 25 THR C C 25 173.100 173.100 175.387 -2.287 19718
3520 1 8 . 1 1 25 25 THR CA C 25 57.000 57.000 61.197 -4.197 19718
3521 1 8 . 1 1 25 25 THR CB C 25 68.700 68.700 70.925 -2.225 19718
3522 1 8 . 1 1 25 25 THR H H 25 9.080 9.080 8.426 0.654 19718
3523 1 8 . 1 1 26 26 ILE N N 26 120.300 120.300 124.982 -4.682 19718
3524 1 8 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.881 -0.251 19718
3525 1 8 . 1 1 26 26 ILE C C 26 174.700 174.700 177.661 -2.961 19718
3526 1 8 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.827 -1.127 19718
3527 1 8 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.603 -4.603 19718
3528 1 8 . 1 1 26 26 ILE H H 26 7.860 7.860 8.453 -0.593 19718
3529 1 8 . 1 1 27 27 LEU N N 27 117.600 117.600 121.954 -4.354 19718
3530 1 8 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.949 -0.199 19718
3531 1 8 . 1 1 27 27 LEU C C 27 174.000 174.000 178.019 -4.019 19718
3532 1 8 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.921 -4.021 19718
3533 1 8 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.451 -2.151 19718
3534 1 8 . 1 1 27 27 LEU H H 27 6.580 6.580 8.513 -1.933 19718
3535 1 8 . 1 1 28 28 ASP N N 28 120.000 120.000 118.400 1.600 19718
3536 1 8 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.438 -0.188 19718
3537 1 8 . 1 1 28 28 ASP C C 28 177.900 177.900 178.488 -0.588 19718
3538 1 8 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.687 -2.687 19718
3539 1 8 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.782 -3.882 19718
3540 1 8 . 1 1 28 28 ASP H H 28 7.880 7.880 8.373 -0.493 19718
3541 1 8 . 1 1 29 29 ILE N N 29 122.100 122.100 119.775 2.325 19718
3542 1 8 . 1 1 29 29 ILE HA H 29 3.740 3.740 4.042 -0.302 19718
3543 1 8 . 1 1 29 29 ILE C C 29 175.700 175.700 177.818 -2.118 19718
3544 1 8 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.472 -2.372 19718
3545 1 8 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.132 -1.632 19718
3546 1 8 . 1 1 29 29 ILE H H 29 8.340 8.340 8.184 0.156 19718
3547 1 8 . 1 1 30 30 ALA N N 30 124.100 124.100 123.203 0.897 19718
3548 1 8 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.704 -0.364 19718
3549 1 8 . 1 1 30 30 ALA C C 30 177.600 177.600 179.542 -1.942 19718
3550 1 8 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.587 -2.788 19718
3551 1 8 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.230 -1.430 19718
3552 1 8 . 1 1 30 30 ALA H H 30 8.430 8.430 8.544 -0.114 19718
3553 1 8 . 1 1 31 31 GLN N N 31 116.000 116.000 115.533 0.467 19718
3554 1 8 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.224 -0.064 19718
3555 1 8 . 1 1 31 31 GLN C C 31 178.100 178.100 177.853 0.247 19718
3556 1 8 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.194 -0.494 19718
3557 1 8 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.077 -3.877 19718
3558 1 8 . 1 1 31 31 GLN H H 31 8.760 8.760 8.012 0.748 19718
3559 1 8 . 1 1 32 32 GLY N N 32 108.700 108.700 106.939 1.761 19718
3560 1 8 . 1 1 32 32 GLY C C 32 171.700 171.700 174.898 -3.198 19718
3561 1 8 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.805 -2.605 19718
3562 1 8 . 1 1 32 32 GLY H H 32 8.220 8.220 7.652 0.568 19718
3563 1 8 . 1 1 33 33 HIS N N 33 115.000 115.000 119.297 -4.297 19718
3564 1 8 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.589 -0.159 19718
3565 1 8 . 1 1 33 33 HIS C C 33 169.800 169.800 174.339 -4.539 19718
3566 1 8 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.391 -2.991 19718
3567 1 8 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.954 -5.454 19718
3568 1 8 . 1 1 33 33 HIS H H 33 6.980 6.980 8.017 -1.037 19718
3569 1 8 . 1 1 34 34 ASN N N 34 113.700 113.700 115.165 -1.465 19718
3570 1 8 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.337 -0.007 19718
3571 1 8 . 1 1 34 34 ASN C C 34 172.000 172.000 174.993 -2.993 19718
3572 1 8 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.657 -1.557 19718
3573 1 8 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.378 -2.378 19718
3574 1 8 . 1 1 34 34 ASN H H 34 7.700 7.700 7.671 0.029 19718
3575 1 8 . 1 1 35 35 LEU N N 35 115.600 115.600 118.472 -2.872 19718
3576 1 8 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.195 0.055 19718
3577 1 8 . 1 1 35 35 LEU C C 35 174.900 174.900 177.130 -2.230 19718
3578 1 8 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.289 -3.989 19718
3579 1 8 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.358 -3.158 19718
3580 1 8 . 1 1 35 35 LEU H H 35 7.980 7.980 7.489 0.491 19718
3581 1 8 . 1 1 36 36 ASP N N 36 120.100 120.100 124.510 -4.410 19718
3582 1 8 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.624 -0.194 19718
3583 1 8 . 1 1 36 36 ASP C C 36 171.100 171.100 174.780 -3.680 19718
3584 1 8 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.299 -3.299 19718
3585 1 8 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.811 -3.611 19718
3586 1 8 . 1 1 36 36 ASP H H 36 8.610 8.610 8.629 -0.019 19718
3587 1 8 . 1 1 37 37 MET N N 37 123.900 123.900 118.606 5.294 19718
3588 1 8 . 1 1 37 37 MET HA H 37 4.280 4.280 4.833 -0.553 19718
3589 1 8 . 1 1 37 37 MET C C 37 171.200 171.200 174.429 -3.229 19718
3590 1 8 . 1 1 37 37 MET CA C 37 52.800 52.800 55.017 -2.217 19718
3591 1 8 . 1 1 37 37 MET CB C 37 33.000 33.000 36.021 -3.021 19718
3592 1 8 . 1 1 37 37 MET H H 37 7.670 7.670 7.737 -0.067 19718
3593 1 8 . 1 1 38 38 GLU N N 38 128.600 128.600 118.977 9.623 19718
3594 1 8 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.534 -0.244 19718
3595 1 8 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.697 -3.497 19718
3596 1 8 . 1 1 38 38 GLU CB C 38 29.400 29.400 30.479 -1.079 19718
3597 1 8 . 1 1 38 38 GLU H H 38 9.060 9.060 8.646 0.414 19718
3598 1 8 . 1 1 51 51 HIS C C 51 170.700 170.700 174.828 -4.128 19718
3599 1 8 . 1 1 51 51 HIS CA C 51 52.800 52.800 56.017 -3.217 19718
3600 1 8 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.864 -3.164 19718
3601 1 8 . 1 1 53 53 ILE N N 53 122.200 122.200 119.582 2.618 19718
3602 1 8 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.713 -0.703 19718
3603 1 8 . 1 1 53 53 ILE C C 53 174.400 174.400 173.348 1.052 19718
3604 1 8 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.658 0.042 19718
3605 1 8 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.369 -6.069 19718
3606 1 8 . 1 1 53 53 ILE H H 53 8.800 8.800 7.777 1.023 19718
3607 1 8 . 1 1 54 54 VAL N N 54 130.200 130.200 124.809 5.391 19718
3608 1 8 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.603 -0.733 19718
3609 1 8 . 1 1 54 54 VAL C C 54 172.500 172.500 174.821 -2.321 19718
3610 1 8 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.677 1.223 19718
3611 1 8 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.720 -5.120 19718
3612 1 8 . 1 1 54 54 VAL H H 54 8.380 8.380 8.354 0.026 19718
3613 1 8 . 1 1 55 55 ASP N N 55 129.100 129.100 127.284 1.816 19718
3614 1 8 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.672 -0.082 19718
3615 1 8 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.385 -2.684 19718
3616 1 8 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.931 -1.431 19718
3617 1 8 . 1 1 55 55 ASP H H 55 8.160 8.160 8.060 0.100 19718
3618 1 8 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.297 -0.127 19718
3619 1 8 . 1 1 56 56 PRO C C 56 174.900 174.900 177.331 -2.431 19718
3620 1 8 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.834 -1.834 19718
3621 1 8 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.793 -2.393 19718
3622 1 8 . 1 1 57 57 ASP N N 57 117.100 117.100 117.926 -0.826 19718
3623 1 8 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.441 -0.071 19718
3624 1 8 . 1 1 57 57 ASP C C 57 174.100 174.100 178.048 -3.948 19718
3625 1 8 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.580 -2.880 19718
3626 1 8 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.694 -3.894 19718
3627 1 8 . 1 1 57 57 ASP H H 57 9.110 9.110 8.745 0.365 19718
3628 1 8 . 1 1 58 58 TYR N N 58 115.800 115.800 118.818 -3.018 19718
3629 1 8 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.413 -0.053 19718
3630 1 8 . 1 1 58 58 TYR C C 58 173.200 173.200 177.944 -4.744 19718
3631 1 8 . 1 1 58 58 TYR CA C 58 56.700 56.700 60.389 -3.689 19718
3632 1 8 . 1 1 58 58 TYR CB C 58 38.900 38.900 38.955 -0.055 19718
3633 1 8 . 1 1 58 58 TYR H H 58 8.190 8.190 7.778 0.412 19718
3634 1 8 . 1 1 59 59 TYR N N 59 120.100 120.100 120.896 -0.796 19718
3635 1 8 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.196 -0.416 19718
3636 1 8 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.298 0.802 19718
3637 1 8 . 1 1 59 59 TYR CB C 59 36.400 36.400 37.867 -1.467 19718
3638 1 8 . 1 1 59 59 TYR H H 59 7.420 7.420 8.177 -0.757 19718
3639 1 8 . 1 1 60 60 ASP N N 60 115.200 115.200 118.846 -3.646 19718
3640 1 8 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.451 -0.091 19718
3641 1 8 . 1 1 60 60 ASP C C 60 173.100 173.100 176.382 -3.282 19718
3642 1 8 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.939 -2.539 19718
3643 1 8 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.588 -3.088 19718
3644 1 8 . 1 1 60 60 ASP H H 60 8.440 8.440 7.905 0.535 19718
3645 1 8 . 1 1 61 61 ALA N N 61 120.200 120.200 119.844 0.356 19718
3646 1 8 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.433 -0.253 19718
3647 1 8 . 1 1 61 61 ALA C C 61 175.000 175.000 177.063 -2.063 19718
3648 1 8 . 1 1 61 61 ALA CA C 61 49.300 49.300 51.712 -2.412 19718
3649 1 8 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.752 -4.552 19718
3650 1 8 . 1 1 61 61 ALA H H 61 7.300 7.300 7.311 -0.011 19718
3651 1 8 . 1 1 62 62 LEU N N 62 118.000 118.000 121.377 -3.377 19718
3652 1 8 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.595 -0.305 19718
3653 1 8 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.378 -2.278 19718
3654 1 8 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.344 -3.644 19718
3655 1 8 . 1 1 62 62 LEU H H 62 6.680 6.680 7.434 -0.754 19718
3656 1 8 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.483 -0.163 19718
3657 1 8 . 1 1 63 63 PRO C C 63 173.500 173.500 176.241 -2.741 19718
3658 1 8 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.302 -2.602 19718
3659 1 8 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.046 -3.546 19718
3660 1 8 . 1 1 64 64 GLU N N 64 124.500 124.500 121.160 3.340 19718
3661 1 8 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.536 -0.356 19718
3662 1 8 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.497 -1.997 19718
3663 1 8 . 1 1 64 64 GLU CB C 64 25.800 25.800 29.901 -4.101 19718
3664 1 8 . 1 1 64 64 GLU H H 64 8.590 8.590 8.403 0.187 19718
3665 1 8 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.559 -0.389 19718
3666 1 8 . 1 1 65 65 PRO C C 65 174.900 174.900 176.481 -1.581 19718
3667 1 8 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.276 0.724 19718
3668 1 8 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.169 -4.669 19718
3669 1 8 . 1 1 66 66 GLU N N 66 123.300 123.300 118.925 4.375 19718
3670 1 8 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.072 0.258 19718
3671 1 8 . 1 1 66 66 GLU C C 66 174.200 174.200 177.226 -3.026 19718
3672 1 8 . 1 1 66 66 GLU CA C 66 52.500 52.500 57.103 -4.603 19718
3673 1 8 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.380 -2.980 19718
3674 1 8 . 1 1 66 66 GLU H H 66 9.080 9.080 8.548 0.532 19718
3675 1 8 . 1 1 67 67 ASP N N 67 120.100 120.100 120.514 -0.414 19718
3676 1 8 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.428 -0.188 19718
3677 1 8 . 1 1 67 67 ASP C C 67 174.900 174.900 177.872 -2.972 19718
3678 1 8 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.779 -1.379 19718
3679 1 8 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.865 -3.065 19718
3680 1 8 . 1 1 67 67 ASP H H 67 8.690 8.690 8.778 -0.088 19718
3681 1 8 . 1 1 68 68 ASP N N 68 116.800 116.800 118.098 -1.298 19718
3682 1 8 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.507 -0.267 19718
3683 1 8 . 1 1 68 68 ASP C C 68 175.500 175.500 177.979 -2.479 19718
3684 1 8 . 1 1 68 68 ASP CA C 68 54.300 54.300 56.017 -1.717 19718
3685 1 8 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.790 -4.690 19718
3686 1 8 . 1 1 68 68 ASP H H 68 8.400 8.400 8.516 -0.116 19718
3687 1 8 . 1 1 69 69 GLU N N 69 123.600 123.600 118.672 4.928 19718
3688 1 8 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.140 0.010 19718
3689 1 8 . 1 1 69 69 GLU C C 69 175.200 175.200 178.765 -3.565 19718
3690 1 8 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.609 -2.409 19718
3691 1 8 . 1 1 69 69 GLU CB C 69 26.000 26.000 29.858 -3.857 19718
3692 1 8 . 1 1 69 69 GLU H H 69 7.530 7.530 7.550 -0.020 19718
3693 1 8 . 1 1 70 70 ASN N N 70 119.100 119.100 118.819 0.281 19718
3694 1 8 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.515 -0.155 19718
3695 1 8 . 1 1 70 70 ASN C C 70 175.200 175.200 176.905 -1.705 19718
3696 1 8 . 1 1 70 70 ASN CA C 70 53.700 53.700 56.478 -2.778 19718
3697 1 8 . 1 1 70 70 ASN CB C 70 34.800 34.800 38.461 -3.661 19718
3698 1 8 . 1 1 70 70 ASN H H 70 7.960 7.960 8.625 -0.665 19718
3699 1 8 . 1 1 71 71 ASP N N 71 118.400 118.400 119.771 -1.371 19718
3700 1 8 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.464 -0.214 19718
3701 1 8 . 1 1 71 71 ASP C C 71 176.000 176.000 177.699 -1.699 19718
3702 1 8 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.453 -1.853 19718
3703 1 8 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.835 -3.335 19718
3704 1 8 . 1 1 71 71 ASP H H 71 8.250 8.250 7.723 0.527 19718
3705 1 8 . 1 1 72 72 MET N N 72 117.300 117.300 116.351 0.949 19718
3706 1 8 . 1 1 72 72 MET HA H 72 4.370 4.370 4.238 0.132 19718
3707 1 8 . 1 1 72 72 MET C C 72 177.800 177.800 177.326 0.474 19718
3708 1 8 . 1 1 72 72 MET CA C 72 53.700 53.700 57.753 -4.053 19718
3709 1 8 . 1 1 72 72 MET CB C 72 32.400 32.400 32.750 -0.350 19718
3710 1 8 . 1 1 72 72 MET H H 72 7.240 7.240 7.402 -0.162 19718
3711 1 8 . 1 1 73 73 LEU N N 73 123.000 123.000 118.728 4.272 19718
3712 1 8 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.135 -0.375 19718
3713 1 8 . 1 1 73 73 LEU C C 73 175.700 175.700 178.704 -3.004 19718
3714 1 8 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.101 -2.201 19718
3715 1 8 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.818 -3.718 19718
3716 1 8 . 1 1 73 73 LEU H H 73 8.600 8.600 7.221 1.379 19718
3717 1 8 . 1 1 74 74 ASP N N 74 118.500 118.500 118.590 -0.090 19718
3718 1 8 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.302 0.038 19718
3719 1 8 . 1 1 74 74 ASP C C 74 174.700 174.700 177.932 -3.232 19718
3720 1 8 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.952 -2.652 19718
3721 1 8 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.753 -2.553 19718
3722 1 8 . 1 1 74 74 ASP H H 74 7.250 7.250 7.690 -0.440 19718
3723 1 8 . 1 1 75 75 LEU N N 75 116.300 116.300 118.164 -1.864 19718
3724 1 8 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.134 0.166 19718
3725 1 8 . 1 1 75 75 LEU C C 75 174.500 174.500 176.660 -2.160 19718
3726 1 8 . 1 1 75 75 LEU CA C 75 51.300 51.300 56.097 -4.797 19718
3727 1 8 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.838 -2.238 19718
3728 1 8 . 1 1 75 75 LEU H H 75 7.000 7.000 7.398 -0.398 19718
3729 1 8 . 1 1 76 76 ALA N N 76 124.600 124.600 119.573 5.027 19718
3730 1 8 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.325 -0.225 19718
3731 1 8 . 1 1 76 76 ALA C C 76 174.200 174.200 176.100 -1.900 19718
3732 1 8 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.797 -1.297 19718
3733 1 8 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.254 -5.054 19718
3734 1 8 . 1 1 76 76 ALA H H 76 7.590 7.590 7.533 0.057 19718
3735 1 8 . 1 1 77 77 TYR N N 77 122.900 122.900 124.319 -1.419 19718
3736 1 8 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.213 0.217 19718
3737 1 8 . 1 1 77 77 TYR C C 77 174.100 174.100 177.056 -2.956 19718
3738 1 8 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.437 -4.537 19718
3739 1 8 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.108 -3.208 19718
3740 1 8 . 1 1 77 77 TYR H H 77 8.150 8.150 8.472 -0.322 19718
3741 1 8 . 1 1 78 78 GLY N N 78 112.900 112.900 113.306 -0.406 19718
3742 1 8 . 1 1 78 78 GLY C C 78 171.800 171.800 173.470 -1.670 19718
3743 1 8 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.253 -0.553 19718
3744 1 8 . 1 1 78 78 GLY H H 78 8.320 8.320 7.741 0.579 19718
3745 1 8 . 1 1 79 79 LEU N N 79 119.300 119.300 119.318 -0.018 19718
3746 1 8 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.148 -0.358 19718
3747 1 8 . 1 1 79 79 LEU C C 79 174.000 174.000 176.815 -2.815 19718
3748 1 8 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.886 -1.886 19718
3749 1 8 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.784 -2.884 19718
3750 1 8 . 1 1 79 79 LEU H H 79 7.120 7.120 7.799 -0.679 19718
3751 1 8 . 1 1 80 80 THR N N 80 118.500 118.500 117.210 1.290 19718
3752 1 8 . 1 1 80 80 THR HA H 80 4.860 4.860 4.564 0.296 19718
3753 1 8 . 1 1 80 80 THR C C 80 173.300 173.300 174.600 -1.300 19718
3754 1 8 . 1 1 80 80 THR CA C 80 57.600 57.600 60.797 -3.196 19718
3755 1 8 . 1 1 80 80 THR CB C 80 71.000 71.000 70.942 0.058 19718
3756 1 8 . 1 1 80 80 THR H H 80 9.240 9.240 8.113 1.127 19718
3757 1 8 . 1 1 81 81 GLU N N 81 118.000 118.000 120.113 -2.113 19718
3758 1 8 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.158 -0.048 19718
3759 1 8 . 1 1 81 81 GLU C C 81 173.900 173.900 176.384 -2.484 19718
3760 1 8 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.111 -2.711 19718
3761 1 8 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.869 -3.169 19718
3762 1 8 . 1 1 81 81 GLU H H 81 9.020 9.020 8.678 0.342 19718
3763 1 8 . 1 1 82 82 THR N N 82 106.400 106.400 107.949 -1.549 19718
3764 1 8 . 1 1 82 82 THR HA H 82 3.950 3.950 3.580 0.370 19718
3765 1 8 . 1 1 82 82 THR C C 82 171.700 171.700 173.338 -1.638 19718
3766 1 8 . 1 1 82 82 THR CA C 82 56.800 56.800 58.811 -2.011 19718
3767 1 8 . 1 1 82 82 THR CB C 82 63.800 63.800 68.382 -4.582 19718
3768 1 8 . 1 1 82 82 THR H H 82 7.630 7.630 7.887 -0.257 19718
3769 1 8 . 1 1 83 83 SER N N 83 121.500 121.500 118.762 2.738 19718
3770 1 8 . 1 1 83 83 SER HA H 83 5.080 5.080 4.525 0.555 19718
3771 1 8 . 1 1 83 83 SER C C 83 170.900 170.900 174.431 -3.531 19718
3772 1 8 . 1 1 83 83 SER CA C 83 59.000 59.000 58.643 0.357 19718
3773 1 8 . 1 1 83 83 SER CB C 83 61.700 61.700 64.091 -2.391 19718
3774 1 8 . 1 1 83 83 SER H H 83 6.930 6.930 7.609 -0.679 19718
3775 1 8 . 1 1 84 84 ARG N N 84 119.300 119.300 121.582 -2.282 19718
3776 1 8 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.771 0.099 19718
3777 1 8 . 1 1 84 84 ARG C C 84 172.400 172.400 174.614 -2.214 19718
3778 1 8 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.322 -5.022 19718
3779 1 8 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.454 -2.054 19718
3780 1 8 . 1 1 84 84 ARG H H 84 9.280 9.280 8.908 0.372 19718
3781 1 8 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.451 -0.021 19718
3782 1 8 . 1 1 88 88 GLN C C 88 172.500 172.500 174.779 -2.279 19718
3783 1 8 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.282 -4.282 19718
3784 1 8 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.033 -2.033 19718
3785 1 8 . 1 1 90 90 LYS N N 90 123.700 123.700 124.764 -1.064 19718
3786 1 8 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.021 -0.571 19718
3787 1 8 . 1 1 90 90 LYS C C 90 173.500 173.500 175.182 -1.682 19718
3788 1 8 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.672 -2.172 19718
3789 1 8 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.686 -2.786 19718
3790 1 8 . 1 1 90 90 LYS H H 90 8.330 8.330 8.092 0.238 19718
3791 1 8 . 1 1 91 91 MET N N 91 118.200 118.200 120.502 -2.302 19718
3792 1 8 . 1 1 91 91 MET HA H 91 4.330 4.330 4.577 -0.247 19718
3793 1 8 . 1 1 91 91 MET C C 91 174.300 174.300 176.458 -2.158 19718
3794 1 8 . 1 1 91 91 MET CA C 91 51.800 51.800 55.737 -3.937 19718
3795 1 8 . 1 1 91 91 MET CB C 91 27.200 27.200 32.357 -5.157 19718
3796 1 8 . 1 1 91 91 MET H H 91 8.620 8.620 8.611 0.009 19718
3797 1 8 . 1 1 92 92 SER N N 92 117.000 117.000 116.620 0.380 19718
3798 1 8 . 1 1 92 92 SER HA H 92 4.610 4.610 4.876 -0.266 19718
3799 1 8 . 1 1 92 92 SER C C 92 171.300 171.300 174.564 -3.264 19718
3800 1 8 . 1 1 92 92 SER CA C 92 54.000 54.000 56.718 -2.718 19718
3801 1 8 . 1 1 92 92 SER CB C 92 63.700 63.700 66.210 -2.510 19718
3802 1 8 . 1 1 92 92 SER H H 92 6.970 6.970 8.079 -1.109 19718
3803 1 8 . 1 1 93 93 LYS N N 93 121.700 121.700 117.094 4.606 19718
3804 1 8 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.192 -0.222 19718
3805 1 8 . 1 1 93 93 LYS C C 93 175.200 175.200 177.384 -2.184 19718
3806 1 8 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.466 -1.766 19718
3807 1 8 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.086 -2.986 19718
3808 1 8 . 1 1 93 93 LYS H H 93 9.260 9.260 8.707 0.553 19718
3809 1 8 . 1 1 94 94 ASP N N 94 116.700 116.700 119.141 -2.441 19718
3810 1 8 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.569 -0.209 19718
3811 1 8 . 1 1 94 94 ASP C C 94 174.300 174.300 176.984 -2.684 19718
3812 1 8 . 1 1 94 94 ASP CA C 94 53.700 53.700 55.592 -1.892 19718
3813 1 8 . 1 1 94 94 ASP CB C 94 37.900 37.900 40.930 -3.030 19718
3814 1 8 . 1 1 94 94 ASP H H 94 8.020 8.020 8.451 -0.431 19718
3815 1 8 . 1 1 95 95 ILE N N 95 109.000 109.000 112.527 -3.527 19718
3816 1 8 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.755 -0.095 19718
3817 1 8 . 1 1 95 95 ILE C C 95 170.600 170.600 175.083 -4.483 19718
3818 1 8 . 1 1 95 95 ILE CA C 95 57.300 57.300 59.686 -2.386 19718
3819 1 8 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.646 -3.446 19718
3820 1 8 . 1 1 95 95 ILE H H 95 7.240 7.240 7.203 0.037 19718
3821 1 8 . 1 1 96 96 ASP N N 96 119.800 119.800 123.683 -3.883 19718
3822 1 8 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.505 -0.325 19718
3823 1 8 . 1 1 96 96 ASP C C 96 174.900 174.900 176.658 -1.758 19718
3824 1 8 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.896 -1.196 19718
3825 1 8 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.479 -0.479 19718
3826 1 8 . 1 1 96 96 ASP H H 96 6.950 6.950 8.050 -1.100 19718
3827 1 8 . 1 1 97 97 GLY N N 97 118.500 118.500 112.222 6.278 19718
3828 1 8 . 1 1 97 97 GLY C C 97 170.500 170.500 174.097 -3.597 19718
3829 1 8 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.224 -1.924 19718
3830 1 8 . 1 1 97 97 GLY H H 97 9.210 9.210 8.305 0.905 19718
3831 1 8 . 1 1 98 98 ILE N N 98 121.300 121.300 121.804 -0.504 19718
3832 1 8 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.158 2.442 19718
3833 1 8 . 1 1 98 98 ILE CA C 98 58.600 58.600 62.365 -3.765 19718
3834 1 8 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.432 -3.732 19718
3835 1 8 . 1 1 98 98 ILE H H 98 7.660 7.660 7.768 -0.108 19718
3836 1 8 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.252 0.098 19718
3837 1 8 . 1 1 99 99 ARG C C 99 172.200 172.200 175.123 -2.923 19718
3838 1 8 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.251 -4.151 19718
3839 1 8 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.709 -3.209 19718
3840 1 8 . 1 1 100 100 VAL N N 100 114.900 114.900 116.440 -1.540 19718
3841 1 8 . 1 1 100 100 VAL HA H 100 4.820 4.820 4.963 -0.143 19718
3842 1 8 . 1 1 100 100 VAL C C 100 169.600 169.600 173.292 -3.692 19718
3843 1 8 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.225 -4.025 19718
3844 1 8 . 1 1 100 100 VAL CB C 100 32.300 32.300 35.887 -3.587 19718
3845 1 8 . 1 1 100 100 VAL H H 100 8.440 8.440 8.729 -0.289 19718
3846 1 8 . 1 1 101 101 ALA N N 101 123.400 123.400 123.394 0.006 19718
3847 1 8 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.605 0.705 19718
3848 1 8 . 1 1 101 101 ALA C C 101 174.400 174.400 175.263 -0.863 19718
3849 1 8 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.704 -3.904 19718
3850 1 8 . 1 1 101 101 ALA CB C 101 18.800 18.800 20.841 -2.041 19718
3851 1 8 . 1 1 101 101 ALA H H 101 9.040 9.040 8.767 0.273 19718
3852 1 8 . 1 1 102 102 LEU N N 102 120.600 120.600 122.534 -1.934 19718
3853 1 8 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.851 -0.281 19718
3854 1 8 . 1 1 102 102 LEU CA C 102 52.200 52.200 52.055 0.145 19718
3855 1 8 . 1 1 102 102 LEU CB C 102 37.900 37.900 46.049 -8.149 19718
3856 1 8 . 1 1 102 102 LEU H H 102 8.260 8.260 7.794 0.466 19718
3857 1 8 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.691 -0.111 19718
3858 1 8 . 1 1 112 112 ASN C C 112 171.900 171.900 175.283 -3.383 19718
3859 1 8 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.916 -3.516 19718
3860 1 8 . 1 1 112 112 ASN CB C 112 36.700 36.700 39.580 -2.880 19718
3861 1 8 . 1 1 113 113 ASP N N 113 120.300 120.300 122.859 -2.559 19718
3862 1 8 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.792 -0.352 19718
3863 1 8 . 1 1 113 113 ASP C C 113 173.000 173.000 174.305 -1.305 19718
3864 1 8 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.873 -2.273 19718
3865 1 8 . 1 1 113 113 ASP CB C 113 38.100 38.100 41.003 -2.903 19718
3866 1 8 . 1 1 113 113 ASP H H 113 8.040 8.040 8.804 -0.764 19718
3867 1 8 . 1 1 114 114 PHE N N 114 120.100 120.100 118.831 1.269 19718
3868 1 8 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.732 -0.122 19718
3869 1 8 . 1 1 114 114 PHE C C 114 172.200 172.200 174.917 -2.717 19718
3870 1 8 . 1 1 114 114 PHE CA C 114 54.900 54.900 56.953 -2.053 19718
3871 1 8 . 1 1 114 114 PHE CB C 114 36.500 36.500 41.429 -4.929 19718
3872 1 8 . 1 1 114 114 PHE H H 114 8.110 8.110 7.947 0.163 19718
3873 1 9 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.022 0.218 19718
3874 1 9 . 1 1 2 2 GLU C C 2 173.400 173.400 175.284 -1.884 19718
3875 1 9 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.656 -3.256 19718
3876 1 9 . 1 1 2 2 GLU CB C 2 27.000 27.000 29.013 -2.013 19718
3877 1 9 . 1 1 3 3 GLU N N 3 121.200 121.200 119.260 1.940 19718
3878 1 9 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.257 0.123 19718
3879 1 9 . 1 1 3 3 GLU C C 3 173.000 173.000 176.297 -3.297 19718
3880 1 9 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.444 -2.044 19718
3881 1 9 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.550 -3.150 19718
3882 1 9 . 1 1 3 3 GLU H H 3 8.510 8.510 8.066 0.444 19718
3883 1 9 . 1 1 4 4 LEU N N 4 122.400 122.400 126.543 -4.143 19718
3884 1 9 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.726 -0.176 19718
3885 1 9 . 1 1 4 4 LEU C C 4 172.900 172.900 175.668 -2.768 19718
3886 1 9 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.245 -2.845 19718
3887 1 9 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.249 -3.549 19718
3888 1 9 . 1 1 4 4 LEU H H 4 8.460 8.460 8.746 -0.286 19718
3889 1 9 . 1 1 5 5 LYS N N 5 119.300 119.300 118.544 0.756 19718
3890 1 9 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.361 0.059 19718
3891 1 9 . 1 1 5 5 LYS C C 5 172.400 172.400 174.504 -2.104 19718
3892 1 9 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.591 -2.291 19718
3893 1 9 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.710 -3.710 19718
3894 1 9 . 1 1 5 5 LYS H H 5 8.570 8.570 8.069 0.501 19718
3895 1 9 . 1 1 6 6 ILE N N 6 116.900 116.900 121.616 -4.716 19718
3896 1 9 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.471 -0.361 19718
3897 1 9 . 1 1 6 6 ILE C C 6 169.800 169.800 173.331 -3.531 19718
3898 1 9 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.493 -3.993 19718
3899 1 9 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.044 -3.044 19718
3900 1 9 . 1 1 6 6 ILE H H 6 8.160 8.160 8.691 -0.531 19718
3901 1 9 . 1 1 7 7 THR N N 7 123.000 123.000 125.615 -2.615 19718
3902 1 9 . 1 1 7 7 THR HA H 7 5.220 5.220 5.082 0.138 19718
3903 1 9 . 1 1 7 7 THR C C 7 169.900 169.900 173.615 -3.715 19718
3904 1 9 . 1 1 7 7 THR CA C 7 58.400 58.400 61.733 -3.333 19718
3905 1 9 . 1 1 7 7 THR CB C 7 68.700 68.700 69.484 -0.784 19718
3906 1 9 . 1 1 7 7 THR H H 7 8.520 8.520 8.323 0.197 19718
3907 1 9 . 1 1 8 8 PHE N N 8 124.000 124.000 124.319 -0.319 19718
3908 1 9 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.596 -0.446 19718
3909 1 9 . 1 1 8 8 PHE C C 8 172.300 172.300 174.983 -2.683 19718
3910 1 9 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.205 -1.605 19718
3911 1 9 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.168 -2.068 19718
3912 1 9 . 1 1 8 8 PHE H H 8 9.290 9.290 9.353 -0.063 19718
3913 1 9 . 1 1 9 9 ILE N N 9 122.700 122.700 121.297 1.403 19718
3914 1 9 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.858 -0.278 19718
3915 1 9 . 1 1 9 9 ILE C C 9 173.600 173.600 175.944 -2.344 19718
3916 1 9 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.602 -2.402 19718
3917 1 9 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.772 -4.272 19718
3918 1 9 . 1 1 9 9 ILE H H 9 9.170 9.170 8.405 0.765 19718
3919 1 9 . 1 1 10 10 LEU N N 10 126.700 126.700 125.331 1.369 19718
3920 1 9 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.569 -0.249 19718
3921 1 9 . 1 1 10 10 LEU C C 10 176.500 176.500 178.427 -1.927 19718
3922 1 9 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.340 -2.140 19718
3923 1 9 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.685 -5.185 19718
3924 1 9 . 1 1 10 10 LEU H H 10 9.100 9.100 8.925 0.175 19718
3925 1 9 . 1 1 11 11 LYS N N 11 118.900 118.900 120.197 -1.297 19718
3926 1 9 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.239 -0.279 19718
3927 1 9 . 1 1 11 11 LYS C C 11 174.100 174.100 177.350 -3.250 19718
3928 1 9 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.362 -0.962 19718
3929 1 9 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.235 -3.335 19718
3930 1 9 . 1 1 11 11 LYS H H 11 8.520 8.520 8.820 -0.300 19718
3931 1 9 . 1 1 12 12 ASP N N 12 114.400 114.400 118.303 -3.903 19718
3932 1 9 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.762 -0.242 19718
3933 1 9 . 1 1 12 12 ASP C C 12 174.500 174.500 176.715 -2.215 19718
3934 1 9 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.101 -2.701 19718
3935 1 9 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.558 -3.358 19718
3936 1 9 . 1 1 12 12 ASP H H 12 7.690 7.690 7.972 -0.282 19718
3937 1 9 . 1 1 13 13 GLY N N 13 109.200 109.200 107.056 2.144 19718
3938 1 9 . 1 1 13 13 GLY C C 13 171.600 171.600 174.368 -2.768 19718
3939 1 9 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.727 -3.327 19718
3940 1 9 . 1 1 13 13 GLY H H 13 8.100 8.100 7.880 0.220 19718
3941 1 9 . 1 1 14 14 SER N N 14 118.000 118.000 115.588 2.412 19718
3942 1 9 . 1 1 14 14 SER HA H 14 4.280 4.280 4.483 -0.203 19718
3943 1 9 . 1 1 14 14 SER C C 14 169.000 169.000 173.830 -4.830 19718
3944 1 9 . 1 1 14 14 SER CA C 14 56.500 56.500 58.468 -1.968 19718
3945 1 9 . 1 1 14 14 SER CB C 14 61.000 61.000 64.162 -3.162 19718
3946 1 9 . 1 1 14 14 SER H H 14 8.110 8.110 8.000 0.110 19718
3947 1 9 . 1 1 15 15 GLN N N 15 116.300 116.300 120.122 -3.822 19718
3948 1 9 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.280 0.380 19718
3949 1 9 . 1 1 15 15 GLN C C 15 173.500 173.500 175.952 -2.452 19718
3950 1 9 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.884 -3.184 19718
3951 1 9 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.350 -2.350 19718
3952 1 9 . 1 1 15 15 GLN H H 15 8.330 8.330 8.512 -0.182 19718
3953 1 9 . 1 1 16 16 LYS N N 16 122.500 122.500 124.728 -2.228 19718
3954 1 9 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.611 -0.281 19718
3955 1 9 . 1 1 16 16 LYS C C 16 171.300 171.300 174.556 -3.256 19718
3956 1 9 . 1 1 16 16 LYS CA C 16 51.900 51.900 54.831 -2.931 19718
3957 1 9 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.554 -1.554 19718
3958 1 9 . 1 1 16 16 LYS H H 16 8.780 8.780 8.797 -0.017 19718
3959 1 9 . 1 1 17 17 THR N N 17 120.000 120.000 119.289 0.711 19718
3960 1 9 . 1 1 17 17 THR HA H 17 5.220 5.220 5.118 0.102 19718
3961 1 9 . 1 1 17 17 THR C C 17 170.500 170.500 173.580 -3.080 19718
3962 1 9 . 1 1 17 17 THR CA C 17 58.700 58.700 60.625 -1.925 19718
3963 1 9 . 1 1 17 17 THR CB C 17 67.900 67.900 69.793 -1.893 19718
3964 1 9 . 1 1 17 17 THR H H 17 8.160 8.160 8.399 -0.239 19718
3965 1 9 . 1 1 18 18 TYR N N 18 125.600 125.600 126.801 -1.201 19718
3966 1 9 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.744 0.096 19718
3967 1 9 . 1 1 18 18 TYR CA C 18 53.000 53.000 55.048 -2.048 19718
3968 1 9 . 1 1 18 18 TYR CB C 18 39.100 39.100 42.798 -3.698 19718
3969 1 9 . 1 1 18 18 TYR H H 18 9.020 9.020 8.946 0.074 19718
3970 1 9 . 1 1 19 19 GLU C C 19 174.200 174.200 175.310 -1.110 19718
3971 1 9 . 1 1 19 19 GLU CA C 19 52.900 52.900 54.705 -1.805 19718
3972 1 9 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.540 -3.240 19718
3973 1 9 . 1 1 20 20 VAL N N 20 119.000 119.000 119.726 -0.726 19718
3974 1 9 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.623 0.217 19718
3975 1 9 . 1 1 20 20 VAL C C 20 171.200 171.200 174.429 -3.229 19718
3976 1 9 . 1 1 20 20 VAL CA C 20 56.600 56.600 60.269 -3.669 19718
3977 1 9 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.204 -2.504 19718
3978 1 9 . 1 1 20 20 VAL H H 20 9.160 9.160 8.492 0.668 19718
3979 1 9 . 1 1 21 21 CYS N N 21 117.500 117.500 118.889 -1.389 19718
3980 1 9 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.762 -0.002 19718
3981 1 9 . 1 1 21 21 CYS C C 21 171.400 171.400 174.491 -3.091 19718
3982 1 9 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.291 -2.391 19718
3983 1 9 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.547 -3.347 19718
3984 1 9 . 1 1 21 21 CYS H H 21 8.720 8.720 8.494 0.226 19718
3985 1 9 . 1 1 22 22 GLU N N 22 120.900 120.900 121.833 -0.933 19718
3986 1 9 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.980 -0.570 19718
3987 1 9 . 1 1 22 22 GLU C C 22 174.300 174.300 177.150 -2.850 19718
3988 1 9 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.604 -3.504 19718
3989 1 9 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.697 -2.897 19718
3990 1 9 . 1 1 22 22 GLU H H 22 8.540 8.540 8.813 -0.273 19718
3991 1 9 . 1 1 23 23 GLY N N 23 112.400 112.400 116.102 -3.702 19718
3992 1 9 . 1 1 23 23 GLY C C 23 171.000 171.000 174.608 -3.608 19718
3993 1 9 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.877 -2.477 19718
3994 1 9 . 1 1 23 23 GLY H H 23 8.720 8.720 8.731 -0.011 19718
3995 1 9 . 1 1 24 24 GLU N N 24 119.600 119.600 121.986 -2.386 19718
3996 1 9 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.429 -0.099 19718
3997 1 9 . 1 1 24 24 GLU C C 24 174.400 174.400 175.710 -1.310 19718
3998 1 9 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.430 -2.330 19718
3999 1 9 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.302 -2.203 19718
4000 1 9 . 1 1 24 24 GLU H H 24 7.060 7.060 7.798 -0.738 19718
4001 1 9 . 1 1 25 25 THR N N 25 113.600 113.600 116.667 -3.067 19718
4002 1 9 . 1 1 25 25 THR HA H 25 5.510 5.510 4.866 0.644 19718
4003 1 9 . 1 1 25 25 THR C C 25 173.100 173.100 175.719 -2.619 19718
4004 1 9 . 1 1 25 25 THR CA C 25 57.000 57.000 60.957 -3.957 19718
4005 1 9 . 1 1 25 25 THR CB C 25 68.700 68.700 70.341 -1.641 19718
4006 1 9 . 1 1 25 25 THR H H 25 9.080 9.080 8.524 0.556 19718
4007 1 9 . 1 1 26 26 ILE N N 26 120.300 120.300 123.305 -3.005 19718
4008 1 9 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.943 -0.313 19718
4009 1 9 . 1 1 26 26 ILE C C 26 174.700 174.700 177.455 -2.755 19718
4010 1 9 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.352 0.348 19718
4011 1 9 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.866 -3.866 19718
4012 1 9 . 1 1 26 26 ILE H H 26 7.860 7.860 8.248 -0.388 19718
4013 1 9 . 1 1 27 27 LEU N N 27 117.600 117.600 120.763 -3.163 19718
4014 1 9 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.095 -0.345 19718
4015 1 9 . 1 1 27 27 LEU C C 27 174.000 174.000 178.516 -4.516 19718
4016 1 9 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.959 -3.059 19718
4017 1 9 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.932 -1.632 19718
4018 1 9 . 1 1 27 27 LEU H H 27 6.580 6.580 8.414 -1.834 19718
4019 1 9 . 1 1 28 28 ASP N N 28 120.000 120.000 120.365 -0.365 19718
4020 1 9 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.464 -0.214 19718
4021 1 9 . 1 1 28 28 ASP C C 28 177.900 177.900 179.305 -1.405 19718
4022 1 9 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.851 -2.851 19718
4023 1 9 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.864 -3.964 19718
4024 1 9 . 1 1 28 28 ASP H H 28 7.880 7.880 8.307 -0.427 19718
4025 1 9 . 1 1 29 29 ILE N N 29 122.100 122.100 121.051 1.049 19718
4026 1 9 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.926 -0.186 19718
4027 1 9 . 1 1 29 29 ILE C C 29 175.700 175.700 177.834 -2.134 19718
4028 1 9 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.145 -3.046 19718
4029 1 9 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.989 -1.489 19718
4030 1 9 . 1 1 29 29 ILE H H 29 8.340 8.340 8.517 -0.177 19718
4031 1 9 . 1 1 30 30 ALA N N 30 124.100 124.100 122.907 1.193 19718
4032 1 9 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.752 -0.412 19718
4033 1 9 . 1 1 30 30 ALA C C 30 177.600 177.600 179.677 -2.077 19718
4034 1 9 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.516 -2.716 19718
4035 1 9 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.170 -1.370 19718
4036 1 9 . 1 1 30 30 ALA H H 30 8.430 8.430 8.226 0.204 19718
4037 1 9 . 1 1 31 31 GLN N N 31 116.000 116.000 115.974 0.026 19718
4038 1 9 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.251 -0.091 19718
4039 1 9 . 1 1 31 31 GLN C C 31 178.100 178.100 178.231 -0.131 19718
4040 1 9 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.430 -0.730 19718
4041 1 9 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.157 -3.958 19718
4042 1 9 . 1 1 31 31 GLN H H 31 8.760 8.760 8.423 0.337 19718
4043 1 9 . 1 1 32 32 GLY N N 32 108.700 108.700 107.547 1.153 19718
4044 1 9 . 1 1 32 32 GLY C C 32 171.700 171.700 175.266 -3.566 19718
4045 1 9 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.934 -2.734 19718
4046 1 9 . 1 1 32 32 GLY H H 32 8.220 8.220 7.842 0.378 19718
4047 1 9 . 1 1 33 33 HIS N N 33 115.000 115.000 119.091 -4.091 19718
4048 1 9 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.588 -0.158 19718
4049 1 9 . 1 1 33 33 HIS C C 33 169.800 169.800 174.093 -4.293 19718
4050 1 9 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.271 -2.871 19718
4051 1 9 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.625 -5.125 19718
4052 1 9 . 1 1 33 33 HIS H H 33 6.980 6.980 8.088 -1.108 19718
4053 1 9 . 1 1 34 34 ASN N N 34 113.700 113.700 114.490 -0.790 19718
4054 1 9 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.335 -0.005 19718
4055 1 9 . 1 1 34 34 ASN C C 34 172.000 172.000 174.969 -2.969 19718
4056 1 9 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.779 -1.679 19718
4057 1 9 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.215 -2.216 19718
4058 1 9 . 1 1 34 34 ASN H H 34 7.700 7.700 7.784 -0.084 19718
4059 1 9 . 1 1 35 35 LEU N N 35 115.600 115.600 118.908 -3.308 19718
4060 1 9 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.170 0.080 19718
4061 1 9 . 1 1 35 35 LEU C C 35 174.900 174.900 177.638 -2.738 19718
4062 1 9 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.567 -4.267 19718
4063 1 9 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.430 -3.230 19718
4064 1 9 . 1 1 35 35 LEU H H 35 7.980 7.980 7.656 0.324 19718
4065 1 9 . 1 1 36 36 ASP N N 36 120.100 120.100 125.490 -5.390 19718
4066 1 9 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.648 -0.218 19718
4067 1 9 . 1 1 36 36 ASP C C 36 171.100 171.100 174.787 -3.687 19718
4068 1 9 . 1 1 36 36 ASP CA C 36 51.000 51.000 55.017 -4.017 19718
4069 1 9 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.299 -3.099 19718
4070 1 9 . 1 1 36 36 ASP H H 36 8.610 8.610 8.745 -0.135 19718
4071 1 9 . 1 1 37 37 MET N N 37 123.900 123.900 118.422 5.478 19718
4072 1 9 . 1 1 37 37 MET HA H 37 4.280 4.280 4.739 -0.459 19718
4073 1 9 . 1 1 37 37 MET C C 37 171.200 171.200 174.689 -3.489 19718
4074 1 9 . 1 1 37 37 MET CA C 37 52.800 52.800 54.511 -1.711 19718
4075 1 9 . 1 1 37 37 MET CB C 37 33.000 33.000 36.651 -3.651 19718
4076 1 9 . 1 1 37 37 MET H H 37 7.670 7.670 7.837 -0.167 19718
4077 1 9 . 1 1 38 38 GLU N N 38 128.600 128.600 123.429 5.171 19718
4078 1 9 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.609 -0.319 19718
4079 1 9 . 1 1 38 38 GLU CA C 38 53.200 53.200 54.824 -1.624 19718
4080 1 9 . 1 1 38 38 GLU CB C 38 29.400 29.400 29.399 0.001 19718
4081 1 9 . 1 1 38 38 GLU H H 38 9.060 9.060 8.407 0.653 19718
4082 1 9 . 1 1 51 51 HIS C C 51 170.700 170.700 174.565 -3.865 19718
4083 1 9 . 1 1 51 51 HIS CA C 51 52.800 52.800 56.265 -3.465 19718
4084 1 9 . 1 1 51 51 HIS CB C 51 27.700 27.700 31.113 -3.413 19718
4085 1 9 . 1 1 53 53 ILE N N 53 122.200 122.200 120.194 2.006 19718
4086 1 9 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.773 -0.763 19718
4087 1 9 . 1 1 53 53 ILE C C 53 174.400 174.400 173.406 0.994 19718
4088 1 9 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.884 -0.184 19718
4089 1 9 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.087 -5.787 19718
4090 1 9 . 1 1 53 53 ILE H H 53 8.800 8.800 8.405 0.395 19718
4091 1 9 . 1 1 54 54 VAL N N 54 130.200 130.200 125.668 4.532 19718
4092 1 9 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.797 -0.927 19718
4093 1 9 . 1 1 54 54 VAL C C 54 172.500 172.500 175.068 -2.568 19718
4094 1 9 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.764 1.136 19718
4095 1 9 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.801 -5.201 19718
4096 1 9 . 1 1 54 54 VAL H H 54 8.380 8.380 8.780 -0.400 19718
4097 1 9 . 1 1 55 55 ASP N N 55 129.100 129.100 127.671 1.429 19718
4098 1 9 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.666 -0.076 19718
4099 1 9 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.592 -2.892 19718
4100 1 9 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.929 -1.429 19718
4101 1 9 . 1 1 55 55 ASP H H 55 8.160 8.160 8.177 -0.017 19718
4102 1 9 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.309 -0.139 19718
4103 1 9 . 1 1 56 56 PRO C C 56 174.900 174.900 177.121 -2.221 19718
4104 1 9 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.506 -1.506 19718
4105 1 9 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.642 -2.242 19718
4106 1 9 . 1 1 57 57 ASP N N 57 117.100 117.100 117.358 -0.258 19718
4107 1 9 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.379 -0.009 19718
4108 1 9 . 1 1 57 57 ASP C C 57 174.100 174.100 177.611 -3.511 19718
4109 1 9 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.924 -3.224 19718
4110 1 9 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.043 -4.243 19718
4111 1 9 . 1 1 57 57 ASP H H 57 9.110 9.110 8.857 0.253 19718
4112 1 9 . 1 1 58 58 TYR N N 58 115.800 115.800 117.299 -1.499 19718
4113 1 9 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.539 -0.179 19718
4114 1 9 . 1 1 58 58 TYR C C 58 173.200 173.200 177.758 -4.558 19718
4115 1 9 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.010 -2.310 19718
4116 1 9 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.033 -0.133 19718
4117 1 9 . 1 1 58 58 TYR H H 58 8.190 8.190 7.759 0.431 19718
4118 1 9 . 1 1 59 59 TYR N N 59 120.100 120.100 121.544 -1.444 19718
4119 1 9 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.163 -0.383 19718
4120 1 9 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.461 -0.361 19718
4121 1 9 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.445 -2.045 19718
4122 1 9 . 1 1 59 59 TYR H H 59 7.420 7.420 8.111 -0.691 19718
4123 1 9 . 1 1 60 60 ASP N N 60 115.200 115.200 118.376 -3.176 19718
4124 1 9 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.553 -0.193 19718
4125 1 9 . 1 1 60 60 ASP C C 60 173.100 173.100 176.085 -2.985 19718
4126 1 9 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.629 -2.229 19718
4127 1 9 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.382 -2.882 19718
4128 1 9 . 1 1 60 60 ASP H H 60 8.440 8.440 8.213 0.227 19718
4129 1 9 . 1 1 61 61 ALA N N 61 120.200 120.200 120.677 -0.477 19718
4130 1 9 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.432 -0.252 19718
4131 1 9 . 1 1 61 61 ALA C C 61 175.000 175.000 177.098 -2.098 19718
4132 1 9 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.087 -2.787 19718
4133 1 9 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.910 -3.710 19718
4134 1 9 . 1 1 61 61 ALA H H 61 7.300 7.300 7.660 -0.360 19718
4135 1 9 . 1 1 62 62 LEU N N 62 118.000 118.000 122.592 -4.592 19718
4136 1 9 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.614 -0.324 19718
4137 1 9 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.502 -2.402 19718
4138 1 9 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.228 -3.528 19718
4139 1 9 . 1 1 62 62 LEU H H 62 6.680 6.680 7.669 -0.989 19718
4140 1 9 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.499 -0.179 19718
4141 1 9 . 1 1 63 63 PRO C C 63 173.500 173.500 176.483 -2.983 19718
4142 1 9 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.282 -2.582 19718
4143 1 9 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.158 -3.658 19718
4144 1 9 . 1 1 64 64 GLU N N 64 124.500 124.500 123.596 0.904 19718
4145 1 9 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.352 -0.172 19718
4146 1 9 . 1 1 64 64 GLU CA C 64 52.500 52.500 55.322 -2.822 19718
4147 1 9 . 1 1 64 64 GLU CB C 64 25.800 25.800 29.521 -3.721 19718
4148 1 9 . 1 1 64 64 GLU H H 64 8.590 8.590 8.452 0.138 19718
4149 1 9 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.377 -0.207 19718
4150 1 9 . 1 1 65 65 PRO C C 65 174.900 174.900 176.542 -1.642 19718
4151 1 9 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.728 0.272 19718
4152 1 9 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.606 -4.106 19718
4153 1 9 . 1 1 66 66 GLU N N 66 123.300 123.300 119.210 4.090 19718
4154 1 9 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.063 0.267 19718
4155 1 9 . 1 1 66 66 GLU C C 66 174.200 174.200 177.308 -3.108 19718
4156 1 9 . 1 1 66 66 GLU CA C 66 52.500 52.500 57.120 -4.620 19718
4157 1 9 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.402 -3.002 19718
4158 1 9 . 1 1 66 66 GLU H H 66 9.080 9.080 8.606 0.474 19718
4159 1 9 . 1 1 67 67 ASP N N 67 120.100 120.100 121.342 -1.242 19718
4160 1 9 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.435 -0.195 19718
4161 1 9 . 1 1 67 67 ASP C C 67 174.900 174.900 177.054 -2.154 19718
4162 1 9 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.481 -1.081 19718
4163 1 9 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.922 -3.122 19718
4164 1 9 . 1 1 67 67 ASP H H 67 8.690 8.690 8.792 -0.102 19718
4165 1 9 . 1 1 68 68 ASP N N 68 116.800 116.800 116.489 0.311 19718
4166 1 9 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.619 -0.379 19718
4167 1 9 . 1 1 68 68 ASP C C 68 175.500 175.500 177.209 -1.709 19718
4168 1 9 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.276 -0.976 19718
4169 1 9 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.910 -4.810 19718
4170 1 9 . 1 1 68 68 ASP H H 68 8.400 8.400 8.411 -0.011 19718
4171 1 9 . 1 1 69 69 GLU N N 69 123.600 123.600 119.329 4.271 19718
4172 1 9 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.199 -0.049 19718
4173 1 9 . 1 1 69 69 GLU C C 69 175.200 175.200 178.802 -3.602 19718
4174 1 9 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.679 -2.479 19718
4175 1 9 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.175 -4.175 19718
4176 1 9 . 1 1 69 69 GLU H H 69 7.530 7.530 7.674 -0.144 19718
4177 1 9 . 1 1 70 70 ASN N N 70 119.100 119.100 119.148 -0.048 19718
4178 1 9 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.397 -0.037 19718
4179 1 9 . 1 1 70 70 ASN C C 70 175.200 175.200 177.190 -1.990 19718
4180 1 9 . 1 1 70 70 ASN CA C 70 53.700 53.700 56.597 -2.897 19718
4181 1 9 . 1 1 70 70 ASN CB C 70 34.800 34.800 38.215 -3.415 19718
4182 1 9 . 1 1 70 70 ASN H H 70 7.960 7.960 8.515 -0.555 19718
4183 1 9 . 1 1 71 71 ASP N N 71 118.400 118.400 119.329 -0.929 19718
4184 1 9 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.456 -0.206 19718
4185 1 9 . 1 1 71 71 ASP C C 71 176.000 176.000 178.036 -2.036 19718
4186 1 9 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.939 -2.339 19718
4187 1 9 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.661 -3.161 19718
4188 1 9 . 1 1 71 71 ASP H H 71 8.250 8.250 7.871 0.379 19718
4189 1 9 . 1 1 72 72 MET N N 72 117.300 117.300 116.029 1.271 19718
4190 1 9 . 1 1 72 72 MET HA H 72 4.370 4.370 4.125 0.245 19718
4191 1 9 . 1 1 72 72 MET C C 72 177.800 177.800 177.420 0.380 19718
4192 1 9 . 1 1 72 72 MET CA C 72 53.700 53.700 58.228 -4.528 19718
4193 1 9 . 1 1 72 72 MET CB C 72 32.400 32.400 32.725 -0.325 19718
4194 1 9 . 1 1 72 72 MET H H 72 7.240 7.240 7.613 -0.373 19718
4195 1 9 . 1 1 73 73 LEU N N 73 123.000 123.000 117.127 5.873 19718
4196 1 9 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.393 -0.633 19718
4197 1 9 . 1 1 73 73 LEU C C 73 175.700 175.700 179.375 -3.675 19718
4198 1 9 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.513 -1.613 19718
4199 1 9 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.259 -4.159 19718
4200 1 9 . 1 1 73 73 LEU H H 73 8.600 8.600 7.245 1.355 19718
4201 1 9 . 1 1 74 74 ASP N N 74 118.500 118.500 119.404 -0.904 19718
4202 1 9 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.492 -0.152 19718
4203 1 9 . 1 1 74 74 ASP C C 74 174.700 174.700 178.021 -3.321 19718
4204 1 9 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.878 -2.578 19718
4205 1 9 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.615 -2.416 19718
4206 1 9 . 1 1 74 74 ASP H H 74 7.250 7.250 7.916 -0.666 19718
4207 1 9 . 1 1 75 75 LEU N N 75 116.300 116.300 118.443 -2.143 19718
4208 1 9 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.184 0.116 19718
4209 1 9 . 1 1 75 75 LEU C C 75 174.500 174.500 177.338 -2.838 19718
4210 1 9 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.872 -4.572 19718
4211 1 9 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.854 -2.254 19718
4212 1 9 . 1 1 75 75 LEU H H 75 7.000 7.000 7.368 -0.368 19718
4213 1 9 . 1 1 76 76 ALA N N 76 124.600 124.600 120.960 3.640 19718
4214 1 9 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.362 -0.262 19718
4215 1 9 . 1 1 76 76 ALA C C 76 174.200 174.200 176.251 -2.051 19718
4216 1 9 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.982 -1.482 19718
4217 1 9 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.177 -4.977 19718
4218 1 9 . 1 1 76 76 ALA H H 76 7.590 7.590 7.509 0.081 19718
4219 1 9 . 1 1 77 77 TYR N N 77 122.900 122.900 124.590 -1.690 19718
4220 1 9 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.336 0.094 19718
4221 1 9 . 1 1 77 77 TYR C C 77 174.100 174.100 177.166 -3.066 19718
4222 1 9 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.327 -4.427 19718
4223 1 9 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.200 -3.300 19718
4224 1 9 . 1 1 77 77 TYR H H 77 8.150 8.150 8.477 -0.327 19718
4225 1 9 . 1 1 78 78 GLY N N 78 112.900 112.900 114.660 -1.760 19718
4226 1 9 . 1 1 78 78 GLY C C 78 171.800 171.800 173.462 -1.662 19718
4227 1 9 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.725 -1.025 19718
4228 1 9 . 1 1 78 78 GLY H H 78 8.320 8.320 7.983 0.337 19718
4229 1 9 . 1 1 79 79 LEU N N 79 119.300 119.300 119.384 -0.084 19718
4230 1 9 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.438 -0.648 19718
4231 1 9 . 1 1 79 79 LEU C C 79 174.000 174.000 176.318 -2.318 19718
4232 1 9 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.129 -1.129 19718
4233 1 9 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.949 -3.049 19718
4234 1 9 . 1 1 79 79 LEU H H 79 7.120 7.120 7.946 -0.826 19718
4235 1 9 . 1 1 80 80 THR N N 80 118.500 118.500 119.713 -1.213 19718
4236 1 9 . 1 1 80 80 THR HA H 80 4.860 4.860 4.443 0.417 19718
4237 1 9 . 1 1 80 80 THR C C 80 173.300 173.300 175.307 -2.007 19718
4238 1 9 . 1 1 80 80 THR CA C 80 57.600 57.600 61.001 -3.401 19718
4239 1 9 . 1 1 80 80 THR CB C 80 71.000 71.000 69.878 1.122 19718
4240 1 9 . 1 1 80 80 THR H H 80 9.240 9.240 7.983 1.257 19718
4241 1 9 . 1 1 81 81 GLU N N 81 118.000 118.000 119.660 -1.660 19718
4242 1 9 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.099 0.011 19718
4243 1 9 . 1 1 81 81 GLU C C 81 173.900 173.900 175.938 -2.038 19718
4244 1 9 . 1 1 81 81 GLU CA C 81 55.400 55.400 57.795 -2.395 19718
4245 1 9 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.403 -2.703 19718
4246 1 9 . 1 1 81 81 GLU H H 81 9.020 9.020 8.666 0.354 19718
4247 1 9 . 1 1 82 82 THR N N 82 106.400 106.400 105.971 0.429 19718
4248 1 9 . 1 1 82 82 THR HA H 82 3.950 3.950 2.709 1.241 19718
4249 1 9 . 1 1 82 82 THR C C 82 171.700 171.700 173.554 -1.854 19718
4250 1 9 . 1 1 82 82 THR CA C 82 56.800 56.800 59.590 -2.790 19718
4251 1 9 . 1 1 82 82 THR CB C 82 63.800 63.800 68.230 -4.430 19718
4252 1 9 . 1 1 82 82 THR H H 82 7.630 7.630 7.361 0.269 19718
4253 1 9 . 1 1 83 83 SER N N 83 121.500 121.500 119.222 2.278 19718
4254 1 9 . 1 1 83 83 SER HA H 83 5.080 5.080 4.312 0.768 19718
4255 1 9 . 1 1 83 83 SER C C 83 170.900 170.900 174.487 -3.587 19718
4256 1 9 . 1 1 83 83 SER CA C 83 59.000 59.000 59.829 -0.829 19718
4257 1 9 . 1 1 83 83 SER CB C 83 61.700 61.700 63.627 -1.927 19718
4258 1 9 . 1 1 83 83 SER H H 83 6.930 6.930 7.620 -0.690 19718
4259 1 9 . 1 1 84 84 ARG N N 84 119.300 119.300 124.900 -5.600 19718
4260 1 9 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.825 0.045 19718
4261 1 9 . 1 1 84 84 ARG C C 84 172.400 172.400 174.281 -1.881 19718
4262 1 9 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.418 -4.118 19718
4263 1 9 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.695 -2.295 19718
4264 1 9 . 1 1 84 84 ARG H H 84 9.280 9.280 8.888 0.392 19718
4265 1 9 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.572 -0.142 19718
4266 1 9 . 1 1 88 88 GLN C C 88 172.500 172.500 174.819 -2.319 19718
4267 1 9 . 1 1 88 88 GLN CA C 88 51.000 51.000 54.758 -3.758 19718
4268 1 9 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.269 -2.269 19718
4269 1 9 . 1 1 90 90 LYS N N 90 123.700 123.700 125.667 -1.967 19718
4270 1 9 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.075 -0.625 19718
4271 1 9 . 1 1 90 90 LYS C C 90 173.500 173.500 175.499 -1.999 19718
4272 1 9 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.880 -2.380 19718
4273 1 9 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.410 -2.510 19718
4274 1 9 . 1 1 90 90 LYS H H 90 8.330 8.330 8.143 0.187 19718
4275 1 9 . 1 1 91 91 MET N N 91 118.200 118.200 120.072 -1.872 19718
4276 1 9 . 1 1 91 91 MET HA H 91 4.330 4.330 4.591 -0.261 19718
4277 1 9 . 1 1 91 91 MET C C 91 174.300 174.300 175.759 -1.459 19718
4278 1 9 . 1 1 91 91 MET CA C 91 51.800 51.800 55.132 -3.332 19718
4279 1 9 . 1 1 91 91 MET CB C 91 27.200 27.200 31.800 -4.600 19718
4280 1 9 . 1 1 91 91 MET H H 91 8.620 8.620 8.543 0.077 19718
4281 1 9 . 1 1 92 92 SER N N 92 117.000 117.000 117.950 -0.950 19718
4282 1 9 . 1 1 92 92 SER HA H 92 4.610 4.610 4.840 -0.230 19718
4283 1 9 . 1 1 92 92 SER C C 92 171.300 171.300 173.988 -2.688 19718
4284 1 9 . 1 1 92 92 SER CA C 92 54.000 54.000 56.531 -2.531 19718
4285 1 9 . 1 1 92 92 SER CB C 92 63.700 63.700 66.029 -2.329 19718
4286 1 9 . 1 1 92 92 SER H H 92 6.970 6.970 8.269 -1.299 19718
4287 1 9 . 1 1 93 93 LYS N N 93 121.700 121.700 118.731 2.969 19718
4288 1 9 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.259 -0.289 19718
4289 1 9 . 1 1 93 93 LYS C C 93 175.200 175.200 178.651 -3.451 19718
4290 1 9 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.468 -1.768 19718
4291 1 9 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.597 -3.498 19718
4292 1 9 . 1 1 93 93 LYS H H 93 9.260 9.260 8.688 0.572 19718
4293 1 9 . 1 1 94 94 ASP N N 94 116.700 116.700 119.813 -3.113 19718
4294 1 9 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.501 -0.141 19718
4295 1 9 . 1 1 94 94 ASP C C 94 174.300 174.300 177.332 -3.032 19718
4296 1 9 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.384 -2.684 19718
4297 1 9 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.296 -3.396 19718
4298 1 9 . 1 1 94 94 ASP H H 94 8.020 8.020 7.884 0.136 19718
4299 1 9 . 1 1 95 95 ILE N N 95 109.000 109.000 112.336 -3.336 19718
4300 1 9 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.618 0.042 19718
4301 1 9 . 1 1 95 95 ILE C C 95 170.600 170.600 174.825 -4.225 19718
4302 1 9 . 1 1 95 95 ILE CA C 95 57.300 57.300 59.783 -2.483 19718
4303 1 9 . 1 1 95 95 ILE CB C 95 35.200 35.200 37.789 -2.589 19718
4304 1 9 . 1 1 95 95 ILE H H 95 7.240 7.240 7.386 -0.146 19718
4305 1 9 . 1 1 96 96 ASP N N 96 119.800 119.800 122.888 -3.088 19718
4306 1 9 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.421 -0.241 19718
4307 1 9 . 1 1 96 96 ASP C C 96 174.900 174.900 176.669 -1.769 19718
4308 1 9 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.948 -1.248 19718
4309 1 9 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.798 -0.798 19718
4310 1 9 . 1 1 96 96 ASP H H 96 6.950 6.950 7.875 -0.925 19718
4311 1 9 . 1 1 97 97 GLY N N 97 118.500 118.500 114.388 4.112 19718
4312 1 9 . 1 1 97 97 GLY C C 97 170.500 170.500 174.225 -3.725 19718
4313 1 9 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.261 -1.960 19718
4314 1 9 . 1 1 97 97 GLY H H 97 9.210 9.210 8.191 1.019 19718
4315 1 9 . 1 1 98 98 ILE N N 98 121.300 121.300 121.614 -0.314 19718
4316 1 9 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.597 2.003 19718
4317 1 9 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.595 -2.995 19718
4318 1 9 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.197 -3.497 19718
4319 1 9 . 1 1 98 98 ILE H H 98 7.660 7.660 7.714 -0.054 19718
4320 1 9 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.228 0.122 19718
4321 1 9 . 1 1 99 99 ARG C C 99 172.200 172.200 175.183 -2.983 19718
4322 1 9 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.363 -4.263 19718
4323 1 9 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.461 -2.961 19718
4324 1 9 . 1 1 100 100 VAL N N 100 114.900 114.900 115.942 -1.042 19718
4325 1 9 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.136 -0.316 19718
4326 1 9 . 1 1 100 100 VAL C C 100 169.600 169.600 173.496 -3.896 19718
4327 1 9 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.643 -4.443 19718
4328 1 9 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.213 -3.913 19718
4329 1 9 . 1 1 100 100 VAL H H 100 8.440 8.440 8.876 -0.436 19718
4330 1 9 . 1 1 101 101 ALA N N 101 123.400 123.400 121.046 2.354 19718
4331 1 9 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.036 0.274 19718
4332 1 9 . 1 1 101 101 ALA C C 101 174.400 174.400 175.513 -1.113 19718
4333 1 9 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.939 -3.139 19718
4334 1 9 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.093 -3.293 19718
4335 1 9 . 1 1 101 101 ALA H H 101 9.040 9.040 8.716 0.324 19718
4336 1 9 . 1 1 102 102 LEU N N 102 120.600 120.600 121.535 -0.935 19718
4337 1 9 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.113 -0.543 19718
4338 1 9 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.709 0.491 19718
4339 1 9 . 1 1 102 102 LEU CB C 102 37.900 37.900 45.444 -7.545 19718
4340 1 9 . 1 1 102 102 LEU H H 102 8.260 8.260 7.880 0.380 19718
4341 1 9 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.595 -0.015 19718
4342 1 9 . 1 1 112 112 ASN C C 112 171.900 171.900 172.578 -0.678 19718
4343 1 9 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.617 -2.217 19718
4344 1 9 . 1 1 112 112 ASN CB C 112 36.700 36.700 40.372 -3.672 19718
4345 1 9 . 1 1 113 113 ASP N N 113 120.300 120.300 121.425 -1.125 19718
4346 1 9 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.690 -0.250 19718
4347 1 9 . 1 1 113 113 ASP C C 113 173.000 173.000 175.210 -2.210 19718
4348 1 9 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.206 -1.606 19718
4349 1 9 . 1 1 113 113 ASP CB C 113 38.100 38.100 41.690 -3.590 19718
4350 1 9 . 1 1 113 113 ASP H H 113 8.040 8.040 8.163 -0.123 19718
4351 1 9 . 1 1 114 114 PHE N N 114 120.100 120.100 123.850 -3.750 19718
4352 1 9 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.753 -0.143 19718
4353 1 9 . 1 1 114 114 PHE C C 114 172.200 172.200 175.945 -3.745 19718
4354 1 9 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.292 -3.392 19718
4355 1 9 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.585 -3.085 19718
4356 1 9 . 1 1 114 114 PHE H H 114 8.110 8.110 8.715 -0.605 19718
4357 1 10 . 1 1 2 2 GLU HA H 2 4.240 4.240 3.951 0.289 19718
4358 1 10 . 1 1 2 2 GLU C C 2 173.400 173.400 175.504 -2.104 19718
4359 1 10 . 1 1 2 2 GLU CA C 2 53.400 53.400 57.378 -3.978 19718
4360 1 10 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.375 -3.375 19718
4361 1 10 . 1 1 3 3 GLU N N 3 121.200 121.200 122.359 -1.159 19718
4362 1 10 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.518 -0.138 19718
4363 1 10 . 1 1 3 3 GLU C C 3 173.000 173.000 175.743 -2.743 19718
4364 1 10 . 1 1 3 3 GLU CA C 3 54.400 54.400 55.923 -1.523 19718
4365 1 10 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.090 -2.691 19718
4366 1 10 . 1 1 3 3 GLU H H 3 8.510 8.510 8.556 -0.046 19718
4367 1 10 . 1 1 4 4 LEU N N 4 122.400 122.400 126.342 -3.942 19718
4368 1 10 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.983 -0.433 19718
4369 1 10 . 1 1 4 4 LEU C C 4 172.900 172.900 175.392 -2.492 19718
4370 1 10 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.174 -2.774 19718
4371 1 10 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.237 -4.537 19718
4372 1 10 . 1 1 4 4 LEU H H 4 8.460 8.460 8.341 0.119 19718
4373 1 10 . 1 1 5 5 LYS N N 5 119.300 119.300 118.965 0.335 19718
4374 1 10 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.258 0.162 19718
4375 1 10 . 1 1 5 5 LYS C C 5 172.400 172.400 174.303 -1.903 19718
4376 1 10 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.872 -2.572 19718
4377 1 10 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.815 -3.815 19718
4378 1 10 . 1 1 5 5 LYS H H 5 8.570 8.570 8.238 0.332 19718
4379 1 10 . 1 1 6 6 ILE N N 6 116.900 116.900 121.996 -5.096 19718
4380 1 10 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.710 -0.600 19718
4381 1 10 . 1 1 6 6 ILE C C 6 169.800 169.800 173.276 -3.476 19718
4382 1 10 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.283 -3.783 19718
4383 1 10 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.224 -3.224 19718
4384 1 10 . 1 1 6 6 ILE H H 6 8.160 8.160 8.997 -0.837 19718
4385 1 10 . 1 1 7 7 THR N N 7 123.000 123.000 125.174 -2.174 19718
4386 1 10 . 1 1 7 7 THR HA H 7 5.220 5.220 5.058 0.162 19718
4387 1 10 . 1 1 7 7 THR C C 7 169.900 169.900 173.399 -3.499 19718
4388 1 10 . 1 1 7 7 THR CA C 7 58.400 58.400 61.038 -2.638 19718
4389 1 10 . 1 1 7 7 THR CB C 7 68.700 68.700 69.930 -1.230 19718
4390 1 10 . 1 1 7 7 THR H H 7 8.520 8.520 8.661 -0.141 19718
4391 1 10 . 1 1 8 8 PHE N N 8 124.000 124.000 123.784 0.216 19718
4392 1 10 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.539 -0.389 19718
4393 1 10 . 1 1 8 8 PHE C C 8 172.300 172.300 174.656 -2.356 19718
4394 1 10 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.129 -1.529 19718
4395 1 10 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.309 -2.209 19718
4396 1 10 . 1 1 8 8 PHE H H 8 9.290 9.290 9.506 -0.216 19718
4397 1 10 . 1 1 9 9 ILE N N 9 122.700 122.700 121.580 1.120 19718
4398 1 10 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.777 -0.197 19718
4399 1 10 . 1 1 9 9 ILE C C 9 173.600 173.600 175.859 -2.259 19718
4400 1 10 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.514 -2.314 19718
4401 1 10 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.623 -4.123 19718
4402 1 10 . 1 1 9 9 ILE H H 9 9.170 9.170 8.393 0.777 19718
4403 1 10 . 1 1 10 10 LEU N N 10 126.700 126.700 126.822 -0.122 19718
4404 1 10 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.363 -0.043 19718
4405 1 10 . 1 1 10 10 LEU C C 10 176.500 176.500 178.121 -1.621 19718
4406 1 10 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.162 -2.962 19718
4407 1 10 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.607 -5.107 19718
4408 1 10 . 1 1 10 10 LEU H H 10 9.100 9.100 8.931 0.169 19718
4409 1 10 . 1 1 11 11 LYS N N 11 118.900 118.900 120.547 -1.647 19718
4410 1 10 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.170 -0.210 19718
4411 1 10 . 1 1 11 11 LYS C C 11 174.100 174.100 177.800 -3.700 19718
4412 1 10 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.463 -1.063 19718
4413 1 10 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.286 -3.386 19718
4414 1 10 . 1 1 11 11 LYS H H 11 8.520 8.520 8.293 0.227 19718
4415 1 10 . 1 1 12 12 ASP N N 12 114.400 114.400 117.914 -3.514 19718
4416 1 10 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.658 -0.138 19718
4417 1 10 . 1 1 12 12 ASP C C 12 174.500 174.500 176.957 -2.457 19718
4418 1 10 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.920 -3.521 19718
4419 1 10 . 1 1 12 12 ASP CB C 12 37.200 37.200 41.030 -3.830 19718
4420 1 10 . 1 1 12 12 ASP H H 12 7.690 7.690 8.217 -0.527 19718
4421 1 10 . 1 1 13 13 GLY N N 13 109.200 109.200 105.718 3.482 19718
4422 1 10 . 1 1 13 13 GLY C C 13 171.600 171.600 174.191 -2.591 19718
4423 1 10 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.198 -2.798 19718
4424 1 10 . 1 1 13 13 GLY H H 13 8.100 8.100 7.883 0.217 19718
4425 1 10 . 1 1 14 14 SER N N 14 118.000 118.000 116.364 1.636 19718
4426 1 10 . 1 1 14 14 SER HA H 14 4.280 4.280 4.356 -0.076 19718
4427 1 10 . 1 1 14 14 SER C C 14 169.000 169.000 173.819 -4.819 19718
4428 1 10 . 1 1 14 14 SER CA C 14 56.500 56.500 58.497 -1.997 19718
4429 1 10 . 1 1 14 14 SER CB C 14 61.000 61.000 63.960 -2.960 19718
4430 1 10 . 1 1 14 14 SER H H 14 8.110 8.110 8.032 0.078 19718
4431 1 10 . 1 1 15 15 GLN N N 15 116.300 116.300 120.392 -4.092 19718
4432 1 10 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.200 0.460 19718
4433 1 10 . 1 1 15 15 GLN C C 15 173.500 173.500 176.053 -2.553 19718
4434 1 10 . 1 1 15 15 GLN CA C 15 51.700 51.700 55.174 -3.474 19718
4435 1 10 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.053 -2.053 19718
4436 1 10 . 1 1 15 15 GLN H H 15 8.330 8.330 8.501 -0.171 19718
4437 1 10 . 1 1 16 16 LYS N N 16 122.500 122.500 123.884 -1.384 19718
4438 1 10 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.591 -0.261 19718
4439 1 10 . 1 1 16 16 LYS C C 16 171.300 171.300 174.316 -3.016 19718
4440 1 10 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.035 -3.135 19718
4441 1 10 . 1 1 16 16 LYS CB C 16 34.000 34.000 36.001 -2.001 19718
4442 1 10 . 1 1 16 16 LYS H H 16 8.780 8.780 8.867 -0.087 19718
4443 1 10 . 1 1 17 17 THR N N 17 120.000 120.000 118.090 1.910 19718
4444 1 10 . 1 1 17 17 THR HA H 17 5.220 5.220 4.961 0.259 19718
4445 1 10 . 1 1 17 17 THR C C 17 170.500 170.500 173.372 -2.872 19718
4446 1 10 . 1 1 17 17 THR CA C 17 58.700 58.700 60.479 -1.779 19718
4447 1 10 . 1 1 17 17 THR CB C 17 67.900 67.900 70.124 -2.224 19718
4448 1 10 . 1 1 17 17 THR H H 17 8.160 8.160 8.355 -0.195 19718
4449 1 10 . 1 1 18 18 TYR N N 18 125.600 125.600 126.377 -0.777 19718
4450 1 10 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.819 0.021 19718
4451 1 10 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.875 -1.875 19718
4452 1 10 . 1 1 18 18 TYR CB C 18 39.100 39.100 42.070 -2.970 19718
4453 1 10 . 1 1 18 18 TYR H H 18 9.020 9.020 9.223 -0.203 19718
4454 1 10 . 1 1 19 19 GLU C C 19 174.200 174.200 175.663 -1.463 19718
4455 1 10 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.339 -2.439 19718
4456 1 10 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.723 -3.423 19718
4457 1 10 . 1 1 20 20 VAL N N 20 119.000 119.000 117.605 1.395 19718
4458 1 10 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.670 0.170 19718
4459 1 10 . 1 1 20 20 VAL C C 20 171.200 171.200 174.358 -3.158 19718
4460 1 10 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.242 -2.642 19718
4461 1 10 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.401 -2.701 19718
4462 1 10 . 1 1 20 20 VAL H H 20 9.160 9.160 8.606 0.554 19718
4463 1 10 . 1 1 21 21 CYS N N 21 117.500 117.500 118.898 -1.398 19718
4464 1 10 . 1 1 21 21 CYS HA H 21 4.760 4.760 5.298 -0.538 19718
4465 1 10 . 1 1 21 21 CYS C C 21 171.400 171.400 175.432 -4.032 19718
4466 1 10 . 1 1 21 21 CYS CA C 21 54.900 54.900 58.221 -3.321 19718
4467 1 10 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.277 -3.077 19718
4468 1 10 . 1 1 21 21 CYS H H 21 8.720 8.720 8.769 -0.049 19718
4469 1 10 . 1 1 22 22 GLU N N 22 120.900 120.900 121.731 -0.831 19718
4470 1 10 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.996 -0.586 19718
4471 1 10 . 1 1 22 22 GLU C C 22 174.300 174.300 177.556 -3.256 19718
4472 1 10 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.030 -2.930 19718
4473 1 10 . 1 1 22 22 GLU CB C 22 26.800 26.800 30.240 -3.440 19718
4474 1 10 . 1 1 22 22 GLU H H 22 8.540 8.540 8.500 0.040 19718
4475 1 10 . 1 1 23 23 GLY N N 23 112.400 112.400 115.842 -3.442 19718
4476 1 10 . 1 1 23 23 GLY C C 23 171.000 171.000 174.471 -3.471 19718
4477 1 10 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.118 -2.718 19718
4478 1 10 . 1 1 23 23 GLY H H 23 8.720 8.720 8.923 -0.203 19718
4479 1 10 . 1 1 24 24 GLU N N 24 119.600 119.600 122.249 -2.649 19718
4480 1 10 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.314 0.016 19718
4481 1 10 . 1 1 24 24 GLU C C 24 174.400 174.400 175.751 -1.351 19718
4482 1 10 . 1 1 24 24 GLU CA C 24 54.100 54.100 57.365 -3.265 19718
4483 1 10 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.212 -2.112 19718
4484 1 10 . 1 1 24 24 GLU H H 24 7.060 7.060 7.895 -0.835 19718
4485 1 10 . 1 1 25 25 THR N N 25 113.600 113.600 116.546 -2.946 19718
4486 1 10 . 1 1 25 25 THR HA H 25 5.510 5.510 4.741 0.769 19718
4487 1 10 . 1 1 25 25 THR C C 25 173.100 173.100 175.443 -2.343 19718
4488 1 10 . 1 1 25 25 THR CA C 25 57.000 57.000 60.387 -3.387 19718
4489 1 10 . 1 1 25 25 THR CB C 25 68.700 68.700 71.185 -2.485 19718
4490 1 10 . 1 1 25 25 THR H H 25 9.080 9.080 8.297 0.783 19718
4491 1 10 . 1 1 26 26 ILE N N 26 120.300 120.300 123.981 -3.681 19718
4492 1 10 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.940 -0.310 19718
4493 1 10 . 1 1 26 26 ILE C C 26 174.700 174.700 177.523 -2.823 19718
4494 1 10 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.908 -1.208 19718
4495 1 10 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.722 -4.723 19718
4496 1 10 . 1 1 26 26 ILE H H 26 7.860 7.860 8.813 -0.953 19718
4497 1 10 . 1 1 27 27 LEU N N 27 117.600 117.600 121.172 -3.572 19718
4498 1 10 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.996 -0.246 19718
4499 1 10 . 1 1 27 27 LEU C C 27 174.000 174.000 178.320 -4.320 19718
4500 1 10 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.296 -3.396 19718
4501 1 10 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.960 -1.660 19718
4502 1 10 . 1 1 27 27 LEU H H 27 6.580 6.580 8.345 -1.765 19718
4503 1 10 . 1 1 28 28 ASP N N 28 120.000 120.000 119.754 0.246 19718
4504 1 10 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.356 -0.106 19718
4505 1 10 . 1 1 28 28 ASP C C 28 177.900 177.900 178.991 -1.091 19718
4506 1 10 . 1 1 28 28 ASP CA C 28 55.000 55.000 58.548 -3.548 19718
4507 1 10 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.554 -3.654 19718
4508 1 10 . 1 1 28 28 ASP H H 28 7.880 7.880 8.481 -0.601 19718
4509 1 10 . 1 1 29 29 ILE N N 29 122.100 122.100 120.365 1.735 19718
4510 1 10 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.915 -0.175 19718
4511 1 10 . 1 1 29 29 ILE C C 29 175.700 175.700 177.815 -2.115 19718
4512 1 10 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.891 -2.791 19718
4513 1 10 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.985 -1.485 19718
4514 1 10 . 1 1 29 29 ILE H H 29 8.340 8.340 8.455 -0.115 19718
4515 1 10 . 1 1 30 30 ALA N N 30 124.100 124.100 123.047 1.053 19718
4516 1 10 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.775 -0.435 19718
4517 1 10 . 1 1 30 30 ALA C C 30 177.600 177.600 179.756 -2.156 19718
4518 1 10 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.447 -2.647 19718
4519 1 10 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.119 -1.319 19718
4520 1 10 . 1 1 30 30 ALA H H 30 8.430 8.430 8.459 -0.029 19718
4521 1 10 . 1 1 31 31 GLN N N 31 116.000 116.000 117.226 -1.226 19718
4522 1 10 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.227 -0.067 19718
4523 1 10 . 1 1 31 31 GLN C C 31 178.100 178.100 179.549 -1.449 19718
4524 1 10 . 1 1 31 31 GLN CA C 31 56.700 56.700 58.346 -1.645 19718
4525 1 10 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.794 -3.595 19718
4526 1 10 . 1 1 31 31 GLN H H 31 8.760 8.760 8.526 0.234 19718
4527 1 10 . 1 1 32 32 GLY N N 32 108.700 108.700 107.791 0.909 19718
4528 1 10 . 1 1 32 32 GLY C C 32 171.700 171.700 175.475 -3.775 19718
4529 1 10 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.841 -3.641 19718
4530 1 10 . 1 1 32 32 GLY H H 32 8.220 8.220 8.265 -0.045 19718
4531 1 10 . 1 1 33 33 HIS N N 33 115.000 115.000 118.684 -3.684 19718
4532 1 10 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.693 -0.263 19718
4533 1 10 . 1 1 33 33 HIS C C 33 169.800 169.800 174.477 -4.677 19718
4534 1 10 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.046 -2.646 19718
4535 1 10 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.636 -5.136 19718
4536 1 10 . 1 1 33 33 HIS H H 33 6.980 6.980 7.893 -0.913 19718
4537 1 10 . 1 1 34 34 ASN N N 34 113.700 113.700 117.062 -3.362 19718
4538 1 10 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.348 -0.018 19718
4539 1 10 . 1 1 34 34 ASN C C 34 172.000 172.000 174.983 -2.983 19718
4540 1 10 . 1 1 34 34 ASN CA C 34 52.100 52.100 54.363 -2.263 19718
4541 1 10 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.624 -2.624 19718
4542 1 10 . 1 1 34 34 ASN H H 34 7.700 7.700 8.029 -0.329 19718
4543 1 10 . 1 1 35 35 LEU N N 35 115.600 115.600 118.754 -3.154 19718
4544 1 10 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.170 0.080 19718
4545 1 10 . 1 1 35 35 LEU C C 35 174.900 174.900 176.661 -1.761 19718
4546 1 10 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.407 -4.106 19718
4547 1 10 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.313 -3.114 19718
4548 1 10 . 1 1 35 35 LEU H H 35 7.980 7.980 7.704 0.276 19718
4549 1 10 . 1 1 36 36 ASP N N 36 120.100 120.100 124.669 -4.569 19718
4550 1 10 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.596 -0.166 19718
4551 1 10 . 1 1 36 36 ASP C C 36 171.100 171.100 174.833 -3.733 19718
4552 1 10 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.863 -3.863 19718
4553 1 10 . 1 1 36 36 ASP CB C 36 36.200 36.200 40.490 -4.290 19718
4554 1 10 . 1 1 36 36 ASP H H 36 8.610 8.610 8.566 0.044 19718
4555 1 10 . 1 1 37 37 MET N N 37 123.900 123.900 122.018 1.882 19718
4556 1 10 . 1 1 37 37 MET HA H 37 4.280 4.280 4.845 -0.565 19718
4557 1 10 . 1 1 37 37 MET C C 37 171.200 171.200 173.770 -2.570 19718
4558 1 10 . 1 1 37 37 MET CA C 37 52.800 52.800 54.817 -2.017 19718
4559 1 10 . 1 1 37 37 MET CB C 37 33.000 33.000 36.699 -3.699 19718
4560 1 10 . 1 1 37 37 MET H H 37 7.670 7.670 7.674 -0.004 19718
4561 1 10 . 1 1 38 38 GLU N N 38 128.600 128.600 122.045 6.555 19718
4562 1 10 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.694 -0.404 19718
4563 1 10 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.902 -2.702 19718
4564 1 10 . 1 1 38 38 GLU CB C 38 29.400 29.400 33.231 -3.831 19718
4565 1 10 . 1 1 38 38 GLU H H 38 9.060 9.060 8.536 0.524 19718
4566 1 10 . 1 1 51 51 HIS C C 51 170.700 170.700 174.089 -3.389 19718
4567 1 10 . 1 1 51 51 HIS CA C 51 52.800 52.800 56.620 -3.820 19718
4568 1 10 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.161 -2.461 19718
4569 1 10 . 1 1 53 53 ILE N N 53 122.200 122.200 120.391 1.809 19718
4570 1 10 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.719 -0.709 19718
4571 1 10 . 1 1 53 53 ILE C C 53 174.400 174.400 173.346 1.054 19718
4572 1 10 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.557 0.143 19718
4573 1 10 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.986 -5.686 19718
4574 1 10 . 1 1 53 53 ILE H H 53 8.800 8.800 8.409 0.391 19718
4575 1 10 . 1 1 54 54 VAL N N 54 130.200 130.200 126.326 3.874 19718
4576 1 10 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.809 -0.939 19718
4577 1 10 . 1 1 54 54 VAL C C 54 172.500 172.500 174.806 -2.306 19718
4578 1 10 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.632 1.268 19718
4579 1 10 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.991 -5.391 19718
4580 1 10 . 1 1 54 54 VAL H H 54 8.380 8.380 8.779 -0.399 19718
4581 1 10 . 1 1 55 55 ASP N N 55 129.100 129.100 127.470 1.630 19718
4582 1 10 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.666 -0.076 19718
4583 1 10 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.726 -3.026 19718
4584 1 10 . 1 1 55 55 ASP CB C 55 40.500 40.500 42.026 -1.526 19718
4585 1 10 . 1 1 55 55 ASP H H 55 8.160 8.160 8.335 -0.175 19718
4586 1 10 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.324 -0.154 19718
4587 1 10 . 1 1 56 56 PRO C C 56 174.900 174.900 177.121 -2.221 19718
4588 1 10 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.517 -1.518 19718
4589 1 10 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.725 -2.325 19718
4590 1 10 . 1 1 57 57 ASP N N 57 117.100 117.100 117.337 -0.237 19718
4591 1 10 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.433 -0.063 19718
4592 1 10 . 1 1 57 57 ASP C C 57 174.100 174.100 177.252 -3.152 19718
4593 1 10 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.592 -2.892 19718
4594 1 10 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.852 -4.053 19718
4595 1 10 . 1 1 57 57 ASP H H 57 9.110 9.110 8.807 0.303 19718
4596 1 10 . 1 1 58 58 TYR N N 58 115.800 115.800 117.715 -1.915 19718
4597 1 10 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.427 -0.067 19718
4598 1 10 . 1 1 58 58 TYR C C 58 173.200 173.200 177.857 -4.657 19718
4599 1 10 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.833 -3.133 19718
4600 1 10 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.175 -0.274 19718
4601 1 10 . 1 1 58 58 TYR H H 58 8.190 8.190 7.787 0.403 19718
4602 1 10 . 1 1 59 59 TYR N N 59 120.100 120.100 121.579 -1.479 19718
4603 1 10 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.121 -0.341 19718
4604 1 10 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.754 -0.654 19718
4605 1 10 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.295 -1.895 19718
4606 1 10 . 1 1 59 59 TYR H H 59 7.420 7.420 8.054 -0.634 19718
4607 1 10 . 1 1 60 60 ASP N N 60 115.200 115.200 118.048 -2.848 19718
4608 1 10 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.512 -0.152 19718
4609 1 10 . 1 1 60 60 ASP C C 60 173.100 173.100 176.053 -2.953 19718
4610 1 10 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.653 -2.252 19718
4611 1 10 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.298 -2.798 19718
4612 1 10 . 1 1 60 60 ASP H H 60 8.440 8.440 8.722 -0.282 19718
4613 1 10 . 1 1 61 61 ALA N N 61 120.200 120.200 120.475 -0.275 19718
4614 1 10 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.432 -0.252 19718
4615 1 10 . 1 1 61 61 ALA C C 61 175.000 175.000 177.109 -2.109 19718
4616 1 10 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.068 -2.768 19718
4617 1 10 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.036 -3.836 19718
4618 1 10 . 1 1 61 61 ALA H H 61 7.300 7.300 7.480 -0.180 19718
4619 1 10 . 1 1 62 62 LEU N N 62 118.000 118.000 122.275 -4.275 19718
4620 1 10 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.619 -0.329 19718
4621 1 10 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.636 -2.536 19718
4622 1 10 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.916 -3.216 19718
4623 1 10 . 1 1 62 62 LEU H H 62 6.680 6.680 7.803 -1.123 19718
4624 1 10 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.521 -0.201 19718
4625 1 10 . 1 1 63 63 PRO C C 63 173.500 173.500 175.878 -2.378 19718
4626 1 10 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.201 -2.501 19718
4627 1 10 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.309 -3.809 19718
4628 1 10 . 1 1 64 64 GLU N N 64 124.500 124.500 121.565 2.935 19718
4629 1 10 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.463 -0.283 19718
4630 1 10 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.712 -2.212 19718
4631 1 10 . 1 1 64 64 GLU CB C 64 25.800 25.800 29.625 -3.825 19718
4632 1 10 . 1 1 64 64 GLU H H 64 8.590 8.590 8.469 0.121 19718
4633 1 10 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.509 -0.339 19718
4634 1 10 . 1 1 65 65 PRO C C 65 174.900 174.900 176.444 -1.544 19718
4635 1 10 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.459 0.541 19718
4636 1 10 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.708 -4.208 19718
4637 1 10 . 1 1 66 66 GLU N N 66 123.300 123.300 119.646 3.654 19718
4638 1 10 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.097 0.233 19718
4639 1 10 . 1 1 66 66 GLU C C 66 174.200 174.200 177.389 -3.189 19718
4640 1 10 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.851 -4.351 19718
4641 1 10 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.547 -3.147 19718
4642 1 10 . 1 1 66 66 GLU H H 66 9.080 9.080 8.873 0.207 19718
4643 1 10 . 1 1 67 67 ASP N N 67 120.100 120.100 121.108 -1.008 19718
4644 1 10 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.568 -0.328 19718
4645 1 10 . 1 1 67 67 ASP C C 67 174.900 174.900 177.024 -2.124 19718
4646 1 10 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.497 -1.097 19718
4647 1 10 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.850 -3.050 19718
4648 1 10 . 1 1 67 67 ASP H H 67 8.690 8.690 8.616 0.074 19718
4649 1 10 . 1 1 68 68 ASP N N 68 116.800 116.800 117.164 -0.364 19718
4650 1 10 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.460 -0.220 19718
4651 1 10 . 1 1 68 68 ASP C C 68 175.500 175.500 177.663 -2.163 19718
4652 1 10 . 1 1 68 68 ASP CA C 68 54.300 54.300 56.303 -2.003 19718
4653 1 10 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.969 -4.869 19718
4654 1 10 . 1 1 68 68 ASP H H 68 8.400 8.400 8.333 0.067 19718
4655 1 10 . 1 1 69 69 GLU N N 69 123.600 123.600 119.578 4.022 19718
4656 1 10 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.045 0.105 19718
4657 1 10 . 1 1 69 69 GLU C C 69 175.200 175.200 178.899 -3.699 19718
4658 1 10 . 1 1 69 69 GLU CA C 69 56.200 56.200 59.108 -2.908 19718
4659 1 10 . 1 1 69 69 GLU CB C 69 26.000 26.000 29.899 -3.900 19718
4660 1 10 . 1 1 69 69 GLU H H 69 7.530 7.530 7.846 -0.316 19718
4661 1 10 . 1 1 70 70 ASN N N 70 119.100 119.100 117.571 1.529 19718
4662 1 10 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.495 -0.135 19718
4663 1 10 . 1 1 70 70 ASN C C 70 175.200 175.200 176.601 -1.401 19718
4664 1 10 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.671 -1.971 19718
4665 1 10 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.645 -2.845 19718
4666 1 10 . 1 1 70 70 ASN H H 70 7.960 7.960 8.446 -0.486 19718
4667 1 10 . 1 1 71 71 ASP N N 71 118.400 118.400 120.374 -1.974 19718
4668 1 10 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.571 -0.321 19718
4669 1 10 . 1 1 71 71 ASP C C 71 176.000 176.000 177.609 -1.609 19718
4670 1 10 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.387 -1.787 19718
4671 1 10 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.980 -3.480 19718
4672 1 10 . 1 1 71 71 ASP H H 71 8.250 8.250 8.378 -0.128 19718
4673 1 10 . 1 1 72 72 MET N N 72 117.300 117.300 117.272 0.028 19718
4674 1 10 . 1 1 72 72 MET HA H 72 4.370 4.370 4.230 0.140 19718
4675 1 10 . 1 1 72 72 MET C C 72 177.800 177.800 177.589 0.211 19718
4676 1 10 . 1 1 72 72 MET CA C 72 53.700 53.700 58.351 -4.651 19718
4677 1 10 . 1 1 72 72 MET CB C 72 32.400 32.400 32.792 -0.392 19718
4678 1 10 . 1 1 72 72 MET H H 72 7.240 7.240 7.668 -0.428 19718
4679 1 10 . 1 1 73 73 LEU N N 73 123.000 123.000 119.835 3.165 19718
4680 1 10 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.256 -0.496 19718
4681 1 10 . 1 1 73 73 LEU C C 73 175.700 175.700 179.031 -3.331 19718
4682 1 10 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.398 -2.498 19718
4683 1 10 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.662 -3.562 19718
4684 1 10 . 1 1 73 73 LEU H H 73 8.600 8.600 7.218 1.382 19718
4685 1 10 . 1 1 74 74 ASP N N 74 118.500 118.500 119.258 -0.758 19718
4686 1 10 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.310 0.030 19718
4687 1 10 . 1 1 74 74 ASP C C 74 174.700 174.700 177.826 -3.126 19718
4688 1 10 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.973 -2.673 19718
4689 1 10 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.822 -2.622 19718
4690 1 10 . 1 1 74 74 ASP H H 74 7.250 7.250 7.752 -0.502 19718
4691 1 10 . 1 1 75 75 LEU N N 75 116.300 116.300 117.310 -1.010 19718
4692 1 10 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.183 0.117 19718
4693 1 10 . 1 1 75 75 LEU C C 75 174.500 174.500 177.071 -2.571 19718
4694 1 10 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.403 -4.103 19718
4695 1 10 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.655 -2.055 19718
4696 1 10 . 1 1 75 75 LEU H H 75 7.000 7.000 7.384 -0.384 19718
4697 1 10 . 1 1 76 76 ALA N N 76 124.600 124.600 121.277 3.323 19718
4698 1 10 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.382 -0.282 19718
4699 1 10 . 1 1 76 76 ALA C C 76 174.200 174.200 176.222 -2.022 19718
4700 1 10 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.157 -1.657 19718
4701 1 10 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.008 -4.808 19718
4702 1 10 . 1 1 76 76 ALA H H 76 7.590 7.590 7.568 0.022 19718
4703 1 10 . 1 1 77 77 TYR N N 77 122.900 122.900 125.303 -2.403 19718
4704 1 10 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.261 0.169 19718
4705 1 10 . 1 1 77 77 TYR C C 77 174.100 174.100 177.060 -2.960 19718
4706 1 10 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.172 -4.272 19718
4707 1 10 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.090 -3.190 19718
4708 1 10 . 1 1 77 77 TYR H H 77 8.150 8.150 8.478 -0.328 19718
4709 1 10 . 1 1 78 78 GLY N N 78 112.900 112.900 114.274 -1.374 19718
4710 1 10 . 1 1 78 78 GLY C C 78 171.800 171.800 173.960 -2.160 19718
4711 1 10 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.602 -0.902 19718
4712 1 10 . 1 1 78 78 GLY H H 78 8.320 8.320 7.936 0.384 19718
4713 1 10 . 1 1 79 79 LEU N N 79 119.300 119.300 120.316 -1.016 19718
4714 1 10 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.135 -0.345 19718
4715 1 10 . 1 1 79 79 LEU C C 79 174.000 174.000 177.059 -3.059 19718
4716 1 10 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.356 -1.356 19718
4717 1 10 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.736 -2.836 19718
4718 1 10 . 1 1 79 79 LEU H H 79 7.120 7.120 7.848 -0.728 19718
4719 1 10 . 1 1 80 80 THR N N 80 118.500 118.500 116.986 1.514 19718
4720 1 10 . 1 1 80 80 THR HA H 80 4.860 4.860 4.511 0.349 19718
4721 1 10 . 1 1 80 80 THR C C 80 173.300 173.300 175.582 -2.282 19718
4722 1 10 . 1 1 80 80 THR CA C 80 57.600 57.600 60.625 -3.025 19718
4723 1 10 . 1 1 80 80 THR CB C 80 71.000 71.000 70.345 0.655 19718
4724 1 10 . 1 1 80 80 THR H H 80 9.240 9.240 8.481 0.759 19718
4725 1 10 . 1 1 81 81 GLU N N 81 118.000 118.000 121.145 -3.145 19718
4726 1 10 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.160 -0.050 19718
4727 1 10 . 1 1 81 81 GLU C C 81 173.900 173.900 176.182 -2.282 19718
4728 1 10 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.609 -3.209 19718
4729 1 10 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.106 -2.406 19718
4730 1 10 . 1 1 81 81 GLU H H 81 9.020 9.020 8.889 0.131 19718
4731 1 10 . 1 1 82 82 THR N N 82 106.400 106.400 106.664 -0.264 19718
4732 1 10 . 1 1 82 82 THR HA H 82 3.950 3.950 2.784 1.166 19718
4733 1 10 . 1 1 82 82 THR C C 82 171.700 171.700 173.386 -1.686 19718
4734 1 10 . 1 1 82 82 THR CA C 82 56.800 56.800 59.595 -2.795 19718
4735 1 10 . 1 1 82 82 THR CB C 82 63.800 63.800 68.272 -4.473 19718
4736 1 10 . 1 1 82 82 THR H H 82 7.630 7.630 7.460 0.170 19718
4737 1 10 . 1 1 83 83 SER N N 83 121.500 121.500 118.433 3.067 19718
4738 1 10 . 1 1 83 83 SER HA H 83 5.080 5.080 4.289 0.791 19718
4739 1 10 . 1 1 83 83 SER C C 83 170.900 170.900 173.776 -2.876 19718
4740 1 10 . 1 1 83 83 SER CA C 83 59.000 59.000 60.160 -1.161 19718
4741 1 10 . 1 1 83 83 SER CB C 83 61.700 61.700 63.905 -2.205 19718
4742 1 10 . 1 1 83 83 SER H H 83 6.930 6.930 7.903 -0.973 19718
4743 1 10 . 1 1 84 84 ARG N N 84 119.300 119.300 123.386 -4.086 19718
4744 1 10 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.721 0.149 19718
4745 1 10 . 1 1 84 84 ARG C C 84 172.400 172.400 173.991 -1.591 19718
4746 1 10 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.784 -4.484 19718
4747 1 10 . 1 1 84 84 ARG CB C 84 32.400 32.400 35.008 -2.607 19718
4748 1 10 . 1 1 84 84 ARG H H 84 9.280 9.280 8.842 0.438 19718
4749 1 10 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.228 0.202 19718
4750 1 10 . 1 1 88 88 GLN C C 88 172.500 172.500 175.532 -3.032 19718
4751 1 10 . 1 1 88 88 GLN CA C 88 51.000 51.000 57.465 -6.465 19718
4752 1 10 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.270 -2.270 19718
4753 1 10 . 1 1 90 90 LYS N N 90 123.700 123.700 124.314 -0.614 19718
4754 1 10 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.852 -0.402 19718
4755 1 10 . 1 1 90 90 LYS C C 90 173.500 173.500 175.275 -1.775 19718
4756 1 10 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.855 -2.355 19718
4757 1 10 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.759 -2.859 19718
4758 1 10 . 1 1 90 90 LYS H H 90 8.330 8.330 8.024 0.306 19718
4759 1 10 . 1 1 91 91 MET N N 91 118.200 118.200 119.550 -1.350 19718
4760 1 10 . 1 1 91 91 MET HA H 91 4.330 4.330 4.664 -0.334 19718
4761 1 10 . 1 1 91 91 MET C C 91 174.300 174.300 176.181 -1.881 19718
4762 1 10 . 1 1 91 91 MET CA C 91 51.800 51.800 54.835 -3.035 19718
4763 1 10 . 1 1 91 91 MET CB C 91 27.200 27.200 31.897 -4.697 19718
4764 1 10 . 1 1 91 91 MET H H 91 8.620 8.620 8.557 0.063 19718
4765 1 10 . 1 1 92 92 SER N N 92 117.000 117.000 117.247 -0.247 19718
4766 1 10 . 1 1 92 92 SER HA H 92 4.610 4.610 4.760 -0.150 19718
4767 1 10 . 1 1 92 92 SER C C 92 171.300 171.300 175.057 -3.757 19718
4768 1 10 . 1 1 92 92 SER CA C 92 54.000 54.000 56.083 -2.083 19718
4769 1 10 . 1 1 92 92 SER CB C 92 63.700 63.700 66.072 -2.372 19718
4770 1 10 . 1 1 92 92 SER H H 92 6.970 6.970 8.291 -1.321 19718
4771 1 10 . 1 1 93 93 LYS N N 93 121.700 121.700 121.185 0.515 19718
4772 1 10 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.093 -0.123 19718
4773 1 10 . 1 1 93 93 LYS C C 93 175.200 175.200 177.581 -2.381 19718
4774 1 10 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.608 -1.908 19718
4775 1 10 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.726 -2.626 19718
4776 1 10 . 1 1 93 93 LYS H H 93 9.260 9.260 8.754 0.506 19718
4777 1 10 . 1 1 94 94 ASP N N 94 116.700 116.700 119.742 -3.042 19718
4778 1 10 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.606 -0.246 19718
4779 1 10 . 1 1 94 94 ASP C C 94 174.300 174.300 177.139 -2.839 19718
4780 1 10 . 1 1 94 94 ASP CA C 94 53.700 53.700 55.665 -1.965 19718
4781 1 10 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.459 -3.559 19718
4782 1 10 . 1 1 94 94 ASP H H 94 8.020 8.020 7.745 0.275 19718
4783 1 10 . 1 1 95 95 ILE N N 95 109.000 109.000 112.045 -3.045 19718
4784 1 10 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.544 0.116 19718
4785 1 10 . 1 1 95 95 ILE C C 95 170.600 170.600 174.995 -4.395 19718
4786 1 10 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.544 -3.244 19718
4787 1 10 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.756 -3.556 19718
4788 1 10 . 1 1 95 95 ILE H H 95 7.240 7.240 7.522 -0.282 19718
4789 1 10 . 1 1 96 96 ASP N N 96 119.800 119.800 122.301 -2.501 19718
4790 1 10 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.422 -0.242 19718
4791 1 10 . 1 1 96 96 ASP C C 96 174.900 174.900 176.684 -1.784 19718
4792 1 10 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.221 -1.521 19718
4793 1 10 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.292 -0.292 19718
4794 1 10 . 1 1 96 96 ASP H H 96 6.950 6.950 8.083 -1.133 19718
4795 1 10 . 1 1 97 97 GLY N N 97 118.500 118.500 112.024 6.476 19718
4796 1 10 . 1 1 97 97 GLY C C 97 170.500 170.500 174.171 -3.671 19718
4797 1 10 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.311 -2.011 19718
4798 1 10 . 1 1 97 97 GLY H H 97 9.210 9.210 8.269 0.941 19718
4799 1 10 . 1 1 98 98 ILE N N 98 121.300 121.300 121.865 -0.565 19718
4800 1 10 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.376 2.224 19718
4801 1 10 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.748 -3.148 19718
4802 1 10 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.413 -3.712 19718
4803 1 10 . 1 1 98 98 ILE H H 98 7.660 7.660 8.164 -0.504 19718
4804 1 10 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.230 0.120 19718
4805 1 10 . 1 1 99 99 ARG C C 99 172.200 172.200 175.234 -3.034 19718
4806 1 10 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.562 -4.462 19718
4807 1 10 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.094 -2.595 19718
4808 1 10 . 1 1 100 100 VAL N N 100 114.900 114.900 117.254 -2.354 19718
4809 1 10 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.240 -0.420 19718
4810 1 10 . 1 1 100 100 VAL C C 100 169.600 169.600 173.371 -3.771 19718
4811 1 10 . 1 1 100 100 VAL CA C 100 55.200 55.200 58.883 -3.683 19718
4812 1 10 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.075 -3.775 19718
4813 1 10 . 1 1 100 100 VAL H H 100 8.440 8.440 8.807 -0.367 19718
4814 1 10 . 1 1 101 101 ALA N N 101 123.400 123.400 121.848 1.552 19718
4815 1 10 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.893 0.417 19718
4816 1 10 . 1 1 101 101 ALA C C 101 174.400 174.400 175.866 -1.466 19718
4817 1 10 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.933 -3.133 19718
4818 1 10 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.175 -3.375 19718
4819 1 10 . 1 1 101 101 ALA H H 101 9.040 9.040 8.716 0.324 19718
4820 1 10 . 1 1 102 102 LEU N N 102 120.600 120.600 122.136 -1.536 19718
4821 1 10 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.795 -0.225 19718
4822 1 10 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.986 0.214 19718
4823 1 10 . 1 1 102 102 LEU CB C 102 37.900 37.900 42.313 -4.413 19718
4824 1 10 . 1 1 102 102 LEU H H 102 8.260 8.260 7.809 0.451 19718
4825 1 10 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.955 -0.375 19718
4826 1 10 . 1 1 112 112 ASN C C 112 171.900 171.900 174.239 -2.339 19718
4827 1 10 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.184 -2.784 19718
4828 1 10 . 1 1 112 112 ASN CB C 112 36.700 36.700 40.796 -4.096 19718
4829 1 10 . 1 1 113 113 ASP N N 113 120.300 120.300 121.943 -1.643 19718
4830 1 10 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.735 -0.295 19718
4831 1 10 . 1 1 113 113 ASP C C 113 173.000 173.000 175.716 -2.716 19718
4832 1 10 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.644 -3.044 19718
4833 1 10 . 1 1 113 113 ASP CB C 113 38.100 38.100 42.244 -4.144 19718
4834 1 10 . 1 1 113 113 ASP H H 113 8.040 8.040 8.964 -0.924 19718
4835 1 10 . 1 1 114 114 PHE N N 114 120.100 120.100 119.973 0.127 19718
4836 1 10 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.803 -0.193 19718
4837 1 10 . 1 1 114 114 PHE C C 114 172.200 172.200 175.335 -3.135 19718
4838 1 10 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.700 -3.800 19718
4839 1 10 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.972 -3.472 19718
4840 1 10 . 1 1 114 114 PHE H H 114 8.110 8.110 8.431 -0.321 19718
4841 1 11 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.033 0.207 19718
4842 1 11 . 1 1 2 2 GLU C C 2 173.400 173.400 175.610 -2.210 19718
4843 1 11 . 1 1 2 2 GLU CA C 2 53.400 53.400 57.269 -3.869 19718
4844 1 11 . 1 1 2 2 GLU CB C 2 27.000 27.000 29.423 -2.423 19718
4845 1 11 . 1 1 3 3 GLU N N 3 121.200 121.200 118.800 2.400 19718
4846 1 11 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.616 -0.236 19718
4847 1 11 . 1 1 3 3 GLU C C 3 173.000 173.000 176.785 -3.785 19718
4848 1 11 . 1 1 3 3 GLU CA C 3 54.400 54.400 57.183 -2.783 19718
4849 1 11 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.305 -2.905 19718
4850 1 11 . 1 1 3 3 GLU H H 3 8.510 8.510 8.199 0.311 19718
4851 1 11 . 1 1 4 4 LEU N N 4 122.400 122.400 122.955 -0.555 19718
4852 1 11 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.763 -0.213 19718
4853 1 11 . 1 1 4 4 LEU C C 4 172.900 172.900 175.439 -2.539 19718
4854 1 11 . 1 1 4 4 LEU CA C 4 50.400 50.400 52.832 -2.432 19718
4855 1 11 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.544 -4.843 19718
4856 1 11 . 1 1 4 4 LEU H H 4 8.460 8.460 8.810 -0.350 19718
4857 1 11 . 1 1 5 5 LYS N N 5 119.300 119.300 119.220 0.080 19718
4858 1 11 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.334 0.086 19718
4859 1 11 . 1 1 5 5 LYS C C 5 172.400 172.400 174.515 -2.115 19718
4860 1 11 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.540 -2.240 19718
4861 1 11 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.367 -3.367 19718
4862 1 11 . 1 1 5 5 LYS H H 5 8.570 8.570 8.189 0.381 19718
4863 1 11 . 1 1 6 6 ILE N N 6 116.900 116.900 121.773 -4.873 19718
4864 1 11 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.625 -0.515 19718
4865 1 11 . 1 1 6 6 ILE C C 6 169.800 169.800 173.410 -3.610 19718
4866 1 11 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.059 -3.559 19718
4867 1 11 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.050 -3.050 19718
4868 1 11 . 1 1 6 6 ILE H H 6 8.160 8.160 8.614 -0.454 19718
4869 1 11 . 1 1 7 7 THR N N 7 123.000 123.000 124.846 -1.846 19718
4870 1 11 . 1 1 7 7 THR HA H 7 5.220 5.220 5.174 0.046 19718
4871 1 11 . 1 1 7 7 THR C C 7 169.900 169.900 173.363 -3.463 19718
4872 1 11 . 1 1 7 7 THR CA C 7 58.400 58.400 60.660 -2.260 19718
4873 1 11 . 1 1 7 7 THR CB C 7 68.700 68.700 70.145 -1.445 19718
4874 1 11 . 1 1 7 7 THR H H 7 8.520 8.520 8.280 0.240 19718
4875 1 11 . 1 1 8 8 PHE N N 8 124.000 124.000 123.876 0.124 19718
4876 1 11 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.541 -0.391 19718
4877 1 11 . 1 1 8 8 PHE C C 8 172.300 172.300 175.227 -2.927 19718
4878 1 11 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.169 -1.569 19718
4879 1 11 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.763 -1.663 19718
4880 1 11 . 1 1 8 8 PHE H H 8 9.290 9.290 9.327 -0.037 19718
4881 1 11 . 1 1 9 9 ILE N N 9 122.700 122.700 122.456 0.244 19718
4882 1 11 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.684 -0.104 19718
4883 1 11 . 1 1 9 9 ILE C C 9 173.600 173.600 176.285 -2.685 19718
4884 1 11 . 1 1 9 9 ILE CA C 9 58.200 58.200 61.052 -2.852 19718
4885 1 11 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.116 -3.616 19718
4886 1 11 . 1 1 9 9 ILE H H 9 9.170 9.170 8.671 0.499 19718
4887 1 11 . 1 1 10 10 LEU N N 10 126.700 126.700 127.236 -0.536 19718
4888 1 11 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.333 -0.013 19718
4889 1 11 . 1 1 10 10 LEU C C 10 176.500 176.500 178.492 -1.992 19718
4890 1 11 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.092 -2.892 19718
4891 1 11 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.081 -4.581 19718
4892 1 11 . 1 1 10 10 LEU H H 10 9.100 9.100 9.011 0.089 19718
4893 1 11 . 1 1 11 11 LYS N N 11 118.900 118.900 120.906 -2.006 19718
4894 1 11 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.079 -0.119 19718
4895 1 11 . 1 1 11 11 LYS C C 11 174.100 174.100 177.753 -3.653 19718
4896 1 11 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.278 -1.878 19718
4897 1 11 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.344 -3.444 19718
4898 1 11 . 1 1 11 11 LYS H H 11 8.520 8.520 8.171 0.349 19718
4899 1 11 . 1 1 12 12 ASP N N 12 114.400 114.400 116.841 -2.441 19718
4900 1 11 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.665 -0.145 19718
4901 1 11 . 1 1 12 12 ASP C C 12 174.500 174.500 176.737 -2.237 19718
4902 1 11 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.094 -2.694 19718
4903 1 11 . 1 1 12 12 ASP CB C 12 37.200 37.200 41.295 -4.096 19718
4904 1 11 . 1 1 12 12 ASP H H 12 7.690 7.690 7.960 -0.270 19718
4905 1 11 . 1 1 13 13 GLY N N 13 109.200 109.200 108.180 1.020 19718
4906 1 11 . 1 1 13 13 GLY C C 13 171.600 171.600 174.548 -2.948 19718
4907 1 11 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.874 -3.474 19718
4908 1 11 . 1 1 13 13 GLY H H 13 8.100 8.100 8.040 0.060 19718
4909 1 11 . 1 1 14 14 SER N N 14 118.000 118.000 115.764 2.236 19718
4910 1 11 . 1 1 14 14 SER HA H 14 4.280 4.280 4.429 -0.149 19718
4911 1 11 . 1 1 14 14 SER C C 14 169.000 169.000 173.701 -4.701 19718
4912 1 11 . 1 1 14 14 SER CA C 14 56.500 56.500 58.537 -2.037 19718
4913 1 11 . 1 1 14 14 SER CB C 14 61.000 61.000 64.064 -3.064 19718
4914 1 11 . 1 1 14 14 SER H H 14 8.110 8.110 7.970 0.140 19718
4915 1 11 . 1 1 15 15 GLN N N 15 116.300 116.300 120.698 -4.398 19718
4916 1 11 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.247 0.413 19718
4917 1 11 . 1 1 15 15 GLN C C 15 173.500 173.500 176.003 -2.503 19718
4918 1 11 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.769 -3.068 19718
4919 1 11 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.359 -2.359 19718
4920 1 11 . 1 1 15 15 GLN H H 15 8.330 8.330 8.523 -0.193 19718
4921 1 11 . 1 1 16 16 LYS N N 16 122.500 122.500 124.898 -2.398 19718
4922 1 11 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.558 -0.228 19718
4923 1 11 . 1 1 16 16 LYS C C 16 171.300 171.300 174.430 -3.130 19718
4924 1 11 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.212 -3.312 19718
4925 1 11 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.707 -1.707 19718
4926 1 11 . 1 1 16 16 LYS H H 16 8.780 8.780 8.496 0.284 19718
4927 1 11 . 1 1 17 17 THR N N 17 120.000 120.000 119.712 0.288 19718
4928 1 11 . 1 1 17 17 THR HA H 17 5.220 5.220 4.946 0.274 19718
4929 1 11 . 1 1 17 17 THR C C 17 170.500 170.500 173.476 -2.976 19718
4930 1 11 . 1 1 17 17 THR CA C 17 58.700 58.700 60.907 -2.207 19718
4931 1 11 . 1 1 17 17 THR CB C 17 67.900 67.900 69.711 -1.811 19718
4932 1 11 . 1 1 17 17 THR H H 17 8.160 8.160 8.457 -0.297 19718
4933 1 11 . 1 1 18 18 TYR N N 18 125.600 125.600 126.999 -1.399 19718
4934 1 11 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.716 0.124 19718
4935 1 11 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.771 -1.771 19718
4936 1 11 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.437 -2.337 19718
4937 1 11 . 1 1 18 18 TYR H H 18 9.020 9.020 9.282 -0.262 19718
4938 1 11 . 1 1 19 19 GLU C C 19 174.200 174.200 175.686 -1.486 19718
4939 1 11 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.180 -3.280 19718
4940 1 11 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.512 -3.212 19718
4941 1 11 . 1 1 20 20 VAL N N 20 119.000 119.000 122.205 -3.205 19718
4942 1 11 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.637 0.203 19718
4943 1 11 . 1 1 20 20 VAL C C 20 171.200 171.200 173.690 -2.490 19718
4944 1 11 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.639 -3.039 19718
4945 1 11 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.928 -2.228 19718
4946 1 11 . 1 1 20 20 VAL H H 20 9.160 9.160 8.950 0.210 19718
4947 1 11 . 1 1 21 21 CYS N N 21 117.500 117.500 118.476 -0.976 19718
4948 1 11 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.878 -0.118 19718
4949 1 11 . 1 1 21 21 CYS C C 21 171.400 171.400 174.006 -2.606 19718
4950 1 11 . 1 1 21 21 CYS CA C 21 54.900 54.900 56.395 -1.494 19718
4951 1 11 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.834 -3.634 19718
4952 1 11 . 1 1 21 21 CYS H H 21 8.720 8.720 8.466 0.254 19718
4953 1 11 . 1 1 22 22 GLU N N 22 120.900 120.900 122.185 -1.285 19718
4954 1 11 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.890 -0.480 19718
4955 1 11 . 1 1 22 22 GLU C C 22 174.300 174.300 177.087 -2.787 19718
4956 1 11 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.569 -3.469 19718
4957 1 11 . 1 1 22 22 GLU CB C 22 26.800 26.800 30.007 -3.207 19718
4958 1 11 . 1 1 22 22 GLU H H 22 8.540 8.540 8.899 -0.359 19718
4959 1 11 . 1 1 23 23 GLY N N 23 112.400 112.400 115.022 -2.622 19718
4960 1 11 . 1 1 23 23 GLY C C 23 171.000 171.000 174.596 -3.596 19718
4961 1 11 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.980 -2.580 19718
4962 1 11 . 1 1 23 23 GLY H H 23 8.720 8.720 8.903 -0.183 19718
4963 1 11 . 1 1 24 24 GLU N N 24 119.600 119.600 122.313 -2.713 19718
4964 1 11 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.374 -0.044 19718
4965 1 11 . 1 1 24 24 GLU C C 24 174.400 174.400 176.274 -1.874 19718
4966 1 11 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.814 -2.714 19718
4967 1 11 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.169 -2.069 19718
4968 1 11 . 1 1 24 24 GLU H H 24 7.060 7.060 7.707 -0.647 19718
4969 1 11 . 1 1 25 25 THR N N 25 113.600 113.600 117.469 -3.869 19718
4970 1 11 . 1 1 25 25 THR HA H 25 5.510 5.510 4.767 0.743 19718
4971 1 11 . 1 1 25 25 THR C C 25 173.100 173.100 175.762 -2.662 19718
4972 1 11 . 1 1 25 25 THR CA C 25 57.000 57.000 62.080 -5.080 19718
4973 1 11 . 1 1 25 25 THR CB C 25 68.700 68.700 70.023 -1.323 19718
4974 1 11 . 1 1 25 25 THR H H 25 9.080 9.080 8.374 0.706 19718
4975 1 11 . 1 1 26 26 ILE N N 26 120.300 120.300 124.069 -3.769 19718
4976 1 11 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.937 -0.307 19718
4977 1 11 . 1 1 26 26 ILE C C 26 174.700 174.700 177.462 -2.762 19718
4978 1 11 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.483 -0.782 19718
4979 1 11 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.727 -4.727 19718
4980 1 11 . 1 1 26 26 ILE H H 26 7.860 7.860 8.349 -0.489 19718
4981 1 11 . 1 1 27 27 LEU N N 27 117.600 117.600 122.120 -4.520 19718
4982 1 11 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.962 -0.212 19718
4983 1 11 . 1 1 27 27 LEU C C 27 174.000 174.000 178.178 -4.178 19718
4984 1 11 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.645 -3.745 19718
4985 1 11 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.964 -1.664 19718
4986 1 11 . 1 1 27 27 LEU H H 27 6.580 6.580 8.379 -1.799 19718
4987 1 11 . 1 1 28 28 ASP N N 28 120.000 120.000 120.183 -0.183 19718
4988 1 11 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.371 -0.121 19718
4989 1 11 . 1 1 28 28 ASP C C 28 177.900 177.900 179.186 -1.286 19718
4990 1 11 . 1 1 28 28 ASP CA C 28 55.000 55.000 58.169 -3.169 19718
4991 1 11 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.921 -4.021 19718
4992 1 11 . 1 1 28 28 ASP H H 28 7.880 7.880 8.368 -0.488 19718
4993 1 11 . 1 1 29 29 ILE N N 29 122.100 122.100 120.486 1.614 19718
4994 1 11 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.891 -0.151 19718
4995 1 11 . 1 1 29 29 ILE C C 29 175.700 175.700 177.961 -2.261 19718
4996 1 11 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.237 -3.137 19718
4997 1 11 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.965 -1.465 19718
4998 1 11 . 1 1 29 29 ILE H H 29 8.340 8.340 8.408 -0.068 19718
4999 1 11 . 1 1 30 30 ALA N N 30 124.100 124.100 123.312 0.788 19718
5000 1 11 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.603 -0.263 19718
5001 1 11 . 1 1 30 30 ALA C C 30 177.600 177.600 179.394 -1.794 19718
5002 1 11 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.513 -2.713 19718
5003 1 11 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.203 -1.403 19718
5004 1 11 . 1 1 30 30 ALA H H 30 8.430 8.430 8.489 -0.059 19718
5005 1 11 . 1 1 31 31 GLN N N 31 116.000 116.000 116.479 -0.479 19718
5006 1 11 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.190 -0.030 19718
5007 1 11 . 1 1 31 31 GLN C C 31 178.100 178.100 178.606 -0.506 19718
5008 1 11 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.652 -0.952 19718
5009 1 11 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.127 -3.927 19718
5010 1 11 . 1 1 31 31 GLN H H 31 8.760 8.760 8.461 0.299 19718
5011 1 11 . 1 1 32 32 GLY N N 32 108.700 108.700 108.226 0.474 19718
5012 1 11 . 1 1 32 32 GLY C C 32 171.700 171.700 175.400 -3.700 19718
5013 1 11 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.344 -3.144 19718
5014 1 11 . 1 1 32 32 GLY H H 32 8.220 8.220 8.147 0.073 19718
5015 1 11 . 1 1 33 33 HIS N N 33 115.000 115.000 119.268 -4.268 19718
5016 1 11 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.532 -0.102 19718
5017 1 11 . 1 1 33 33 HIS C C 33 169.800 169.800 174.573 -4.773 19718
5018 1 11 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.517 -3.117 19718
5019 1 11 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.670 -5.170 19718
5020 1 11 . 1 1 33 33 HIS H H 33 6.980 6.980 8.087 -1.107 19718
5021 1 11 . 1 1 34 34 ASN N N 34 113.700 113.700 115.781 -2.081 19718
5022 1 11 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.367 -0.037 19718
5023 1 11 . 1 1 34 34 ASN C C 34 172.000 172.000 175.102 -3.102 19718
5024 1 11 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.631 -1.531 19718
5025 1 11 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.675 -2.675 19718
5026 1 11 . 1 1 34 34 ASN H H 34 7.700 7.700 7.898 -0.198 19718
5027 1 11 . 1 1 35 35 LEU N N 35 115.600 115.600 118.481 -2.881 19718
5028 1 11 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.212 0.038 19718
5029 1 11 . 1 1 35 35 LEU C C 35 174.900 174.900 176.690 -1.790 19718
5030 1 11 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.512 -4.212 19718
5031 1 11 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.445 -3.245 19718
5032 1 11 . 1 1 35 35 LEU H H 35 7.980 7.980 7.524 0.456 19718
5033 1 11 . 1 1 36 36 ASP N N 36 120.100 120.100 123.947 -3.847 19718
5034 1 11 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.680 -0.250 19718
5035 1 11 . 1 1 36 36 ASP C C 36 171.100 171.100 174.919 -3.819 19718
5036 1 11 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.166 -3.166 19718
5037 1 11 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.939 -3.739 19718
5038 1 11 . 1 1 36 36 ASP H H 36 8.610 8.610 8.591 0.019 19718
5039 1 11 . 1 1 37 37 MET N N 37 123.900 123.900 119.440 4.460 19718
5040 1 11 . 1 1 37 37 MET HA H 37 4.280 4.280 4.891 -0.611 19718
5041 1 11 . 1 1 37 37 MET C C 37 171.200 171.200 174.383 -3.183 19718
5042 1 11 . 1 1 37 37 MET CA C 37 52.800 52.800 54.617 -1.817 19718
5043 1 11 . 1 1 37 37 MET CB C 37 33.000 33.000 36.002 -3.002 19718
5044 1 11 . 1 1 37 37 MET H H 37 7.670 7.670 7.786 -0.116 19718
5045 1 11 . 1 1 38 38 GLU N N 38 128.600 128.600 121.087 7.513 19718
5046 1 11 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.423 -0.133 19718
5047 1 11 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.381 -3.181 19718
5048 1 11 . 1 1 38 38 GLU CB C 38 29.400 29.400 31.450 -2.050 19718
5049 1 11 . 1 1 38 38 GLU H H 38 9.060 9.060 8.455 0.605 19718
5050 1 11 . 1 1 51 51 HIS C C 51 170.700 170.700 173.496 -2.796 19718
5051 1 11 . 1 1 51 51 HIS CA C 51 52.800 52.800 55.294 -2.494 19718
5052 1 11 . 1 1 51 51 HIS CB C 51 27.700 27.700 33.479 -5.779 19718
5053 1 11 . 1 1 53 53 ILE N N 53 122.200 122.200 120.142 2.058 19718
5054 1 11 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.736 -0.726 19718
5055 1 11 . 1 1 53 53 ILE C C 53 174.400 174.400 173.314 1.086 19718
5056 1 11 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.633 0.067 19718
5057 1 11 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.961 -5.661 19718
5058 1 11 . 1 1 53 53 ILE H H 53 8.800 8.800 7.913 0.887 19718
5059 1 11 . 1 1 54 54 VAL N N 54 130.200 130.200 126.320 3.880 19718
5060 1 11 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.931 -1.061 19718
5061 1 11 . 1 1 54 54 VAL C C 54 172.500 172.500 175.381 -2.881 19718
5062 1 11 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.259 1.641 19718
5063 1 11 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.226 -5.626 19718
5064 1 11 . 1 1 54 54 VAL H H 54 8.380 8.380 8.667 -0.287 19718
5065 1 11 . 1 1 55 55 ASP N N 55 129.100 129.100 126.483 2.617 19718
5066 1 11 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.584 0.006 19718
5067 1 11 . 1 1 55 55 ASP CA C 55 50.700 50.700 54.815 -4.115 19718
5068 1 11 . 1 1 55 55 ASP CB C 55 40.500 40.500 39.506 0.994 19718
5069 1 11 . 1 1 55 55 ASP H H 55 8.160 8.160 8.041 0.119 19718
5070 1 11 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.356 -0.186 19718
5071 1 11 . 1 1 56 56 PRO C C 56 174.900 174.900 176.252 -1.352 19718
5072 1 11 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.541 -1.541 19718
5073 1 11 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.834 -2.434 19718
5074 1 11 . 1 1 57 57 ASP N N 57 117.100 117.100 117.634 -0.534 19718
5075 1 11 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.455 -0.085 19718
5076 1 11 . 1 1 57 57 ASP C C 57 174.100 174.100 177.351 -3.251 19718
5077 1 11 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.194 -2.494 19718
5078 1 11 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.466 -4.666 19718
5079 1 11 . 1 1 57 57 ASP H H 57 9.110 9.110 8.189 0.921 19718
5080 1 11 . 1 1 58 58 TYR N N 58 115.800 115.800 117.174 -1.374 19718
5081 1 11 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.502 -0.142 19718
5082 1 11 . 1 1 58 58 TYR C C 58 173.200 173.200 177.729 -4.529 19718
5083 1 11 . 1 1 58 58 TYR CA C 58 56.700 56.700 58.959 -2.259 19718
5084 1 11 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.150 -0.250 19718
5085 1 11 . 1 1 58 58 TYR H H 58 8.190 8.190 9.204 -1.014 19718
5086 1 11 . 1 1 59 59 TYR N N 59 120.100 120.100 121.985 -1.885 19718
5087 1 11 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.095 -0.315 19718
5088 1 11 . 1 1 59 59 TYR CA C 59 60.100 60.100 61.172 -1.072 19718
5089 1 11 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.065 -1.665 19718
5090 1 11 . 1 1 59 59 TYR H H 59 7.420 7.420 7.851 -0.431 19718
5091 1 11 . 1 1 60 60 ASP N N 60 115.200 115.200 118.263 -3.063 19718
5092 1 11 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.426 -0.066 19718
5093 1 11 . 1 1 60 60 ASP C C 60 173.100 173.100 176.287 -3.187 19718
5094 1 11 . 1 1 60 60 ASP CA C 60 53.400 53.400 56.100 -2.700 19718
5095 1 11 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.515 -3.015 19718
5096 1 11 . 1 1 60 60 ASP H H 60 8.440 8.440 8.694 -0.254 19718
5097 1 11 . 1 1 61 61 ALA N N 61 120.200 120.200 120.547 -0.347 19718
5098 1 11 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.453 -0.273 19718
5099 1 11 . 1 1 61 61 ALA C C 61 175.000 175.000 176.796 -1.796 19718
5100 1 11 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.214 -2.914 19718
5101 1 11 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.830 -3.630 19718
5102 1 11 . 1 1 61 61 ALA H H 61 7.300 7.300 7.398 -0.098 19718
5103 1 11 . 1 1 62 62 LEU N N 62 118.000 118.000 121.201 -3.201 19718
5104 1 11 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.720 -0.430 19718
5105 1 11 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.044 -1.944 19718
5106 1 11 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.694 -3.994 19718
5107 1 11 . 1 1 62 62 LEU H H 62 6.680 6.680 7.486 -0.806 19718
5108 1 11 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.475 -0.155 19718
5109 1 11 . 1 1 63 63 PRO C C 63 173.500 173.500 176.014 -2.514 19718
5110 1 11 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.107 -2.407 19718
5111 1 11 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.365 -3.865 19718
5112 1 11 . 1 1 64 64 GLU N N 64 124.500 124.500 119.347 5.153 19718
5113 1 11 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.544 -0.364 19718
5114 1 11 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.041 -1.542 19718
5115 1 11 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.196 -4.396 19718
5116 1 11 . 1 1 64 64 GLU H H 64 8.590 8.590 8.327 0.263 19718
5117 1 11 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.518 -0.348 19718
5118 1 11 . 1 1 65 65 PRO C C 65 174.900 174.900 176.537 -1.637 19718
5119 1 11 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.705 0.295 19718
5120 1 11 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.473 -3.973 19718
5121 1 11 . 1 1 66 66 GLU N N 66 123.300 123.300 119.230 4.070 19718
5122 1 11 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.070 0.260 19718
5123 1 11 . 1 1 66 66 GLU C C 66 174.200 174.200 177.425 -3.225 19718
5124 1 11 . 1 1 66 66 GLU CA C 66 52.500 52.500 57.824 -5.324 19718
5125 1 11 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.168 -2.768 19718
5126 1 11 . 1 1 66 66 GLU H H 66 9.080 9.080 8.637 0.443 19718
5127 1 11 . 1 1 67 67 ASP N N 67 120.100 120.100 120.653 -0.553 19718
5128 1 11 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.362 -0.122 19718
5129 1 11 . 1 1 67 67 ASP C C 67 174.900 174.900 178.088 -3.188 19718
5130 1 11 . 1 1 67 67 ASP CA C 67 55.400 55.400 57.178 -1.778 19718
5131 1 11 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.924 -3.124 19718
5132 1 11 . 1 1 67 67 ASP H H 67 8.690 8.690 8.771 -0.081 19718
5133 1 11 . 1 1 68 68 ASP N N 68 116.800 116.800 117.367 -0.567 19718
5134 1 11 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.544 -0.304 19718
5135 1 11 . 1 1 68 68 ASP C C 68 175.500 175.500 177.197 -1.697 19718
5136 1 11 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.982 -1.682 19718
5137 1 11 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.016 -4.916 19718
5138 1 11 . 1 1 68 68 ASP H H 68 8.400 8.400 8.506 -0.106 19718
5139 1 11 . 1 1 69 69 GLU N N 69 123.600 123.600 117.881 5.719 19718
5140 1 11 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.171 -0.021 19718
5141 1 11 . 1 1 69 69 GLU C C 69 175.200 175.200 178.643 -3.443 19718
5142 1 11 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.507 -2.307 19718
5143 1 11 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.435 -4.435 19718
5144 1 11 . 1 1 69 69 GLU H H 69 7.530 7.530 7.757 -0.227 19718
5145 1 11 . 1 1 70 70 ASN N N 70 119.100 119.100 118.142 0.958 19718
5146 1 11 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.508 -0.148 19718
5147 1 11 . 1 1 70 70 ASN C C 70 175.200 175.200 176.193 -0.993 19718
5148 1 11 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.871 -2.171 19718
5149 1 11 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.976 -3.176 19718
5150 1 11 . 1 1 70 70 ASN H H 70 7.960 7.960 8.926 -0.966 19718
5151 1 11 . 1 1 71 71 ASP N N 71 118.400 118.400 119.467 -1.067 19718
5152 1 11 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.628 -0.378 19718
5153 1 11 . 1 1 71 71 ASP C C 71 176.000 176.000 177.171 -1.171 19718
5154 1 11 . 1 1 71 71 ASP CA C 71 54.600 54.600 55.395 -0.795 19718
5155 1 11 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.853 -3.353 19718
5156 1 11 . 1 1 71 71 ASP H H 71 8.250 8.250 7.915 0.335 19718
5157 1 11 . 1 1 72 72 MET N N 72 117.300 117.300 116.789 0.511 19718
5158 1 11 . 1 1 72 72 MET HA H 72 4.370 4.370 4.197 0.173 19718
5159 1 11 . 1 1 72 72 MET C C 72 177.800 177.800 177.596 0.204 19718
5160 1 11 . 1 1 72 72 MET CA C 72 53.700 53.700 58.355 -4.655 19718
5161 1 11 . 1 1 72 72 MET CB C 72 32.400 32.400 33.063 -0.663 19718
5162 1 11 . 1 1 72 72 MET H H 72 7.240 7.240 7.512 -0.272 19718
5163 1 11 . 1 1 73 73 LEU N N 73 123.000 123.000 120.467 2.533 19718
5164 1 11 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.764 -1.004 19718
5165 1 11 . 1 1 73 73 LEU C C 73 175.700 175.700 179.253 -3.553 19718
5166 1 11 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.429 -1.529 19718
5167 1 11 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.237 -4.137 19718
5168 1 11 . 1 1 73 73 LEU H H 73 8.600 8.600 7.413 1.187 19718
5169 1 11 . 1 1 74 74 ASP N N 74 118.500 118.500 119.445 -0.945 19718
5170 1 11 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.266 0.074 19718
5171 1 11 . 1 1 74 74 ASP C C 74 174.700 174.700 177.434 -2.734 19718
5172 1 11 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.537 -2.237 19718
5173 1 11 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.779 -2.579 19718
5174 1 11 . 1 1 74 74 ASP H H 74 7.250 7.250 7.751 -0.501 19718
5175 1 11 . 1 1 75 75 LEU N N 75 116.300 116.300 116.604 -0.304 19718
5176 1 11 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.208 0.092 19718
5177 1 11 . 1 1 75 75 LEU C C 75 174.500 174.500 176.892 -2.392 19718
5178 1 11 . 1 1 75 75 LEU CA C 75 51.300 51.300 54.923 -3.623 19718
5179 1 11 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.586 -1.986 19718
5180 1 11 . 1 1 75 75 LEU H H 75 7.000 7.000 7.509 -0.509 19718
5181 1 11 . 1 1 76 76 ALA N N 76 124.600 124.600 120.807 3.793 19718
5182 1 11 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.233 -0.133 19718
5183 1 11 . 1 1 76 76 ALA C C 76 174.200 174.200 176.715 -2.515 19718
5184 1 11 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.440 -1.940 19718
5185 1 11 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.420 -5.220 19718
5186 1 11 . 1 1 76 76 ALA H H 76 7.590 7.590 7.425 0.165 19718
5187 1 11 . 1 1 77 77 TYR N N 77 122.900 122.900 121.956 0.944 19718
5188 1 11 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.317 0.113 19718
5189 1 11 . 1 1 77 77 TYR C C 77 174.100 174.100 177.107 -3.007 19718
5190 1 11 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.601 -4.701 19718
5191 1 11 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.573 -3.673 19718
5192 1 11 . 1 1 77 77 TYR H H 77 8.150 8.150 8.396 -0.246 19718
5193 1 11 . 1 1 78 78 GLY N N 78 112.900 112.900 114.066 -1.166 19718
5194 1 11 . 1 1 78 78 GLY C C 78 171.800 171.800 173.936 -2.136 19718
5195 1 11 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.658 -0.958 19718
5196 1 11 . 1 1 78 78 GLY H H 78 8.320 8.320 7.938 0.382 19718
5197 1 11 . 1 1 79 79 LEU N N 79 119.300 119.300 120.021 -0.721 19718
5198 1 11 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.163 -0.373 19718
5199 1 11 . 1 1 79 79 LEU C C 79 174.000 174.000 176.877 -2.877 19718
5200 1 11 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.101 -1.101 19718
5201 1 11 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.545 -2.646 19718
5202 1 11 . 1 1 79 79 LEU H H 79 7.120 7.120 7.690 -0.570 19718
5203 1 11 . 1 1 80 80 THR N N 80 118.500 118.500 118.949 -0.449 19718
5204 1 11 . 1 1 80 80 THR HA H 80 4.860 4.860 4.522 0.338 19718
5205 1 11 . 1 1 80 80 THR C C 80 173.300 173.300 175.423 -2.123 19718
5206 1 11 . 1 1 80 80 THR CA C 80 57.600 57.600 60.511 -2.911 19718
5207 1 11 . 1 1 80 80 THR CB C 80 71.000 71.000 70.081 0.919 19718
5208 1 11 . 1 1 80 80 THR H H 80 9.240 9.240 7.974 1.266 19718
5209 1 11 . 1 1 81 81 GLU N N 81 118.000 118.000 120.634 -2.634 19718
5210 1 11 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.077 0.033 19718
5211 1 11 . 1 1 81 81 GLU C C 81 173.900 173.900 176.371 -2.471 19718
5212 1 11 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.869 -3.469 19718
5213 1 11 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.533 -2.833 19718
5214 1 11 . 1 1 81 81 GLU H H 81 9.020 9.020 8.857 0.163 19718
5215 1 11 . 1 1 82 82 THR N N 82 106.400 106.400 107.437 -1.037 19718
5216 1 11 . 1 1 82 82 THR HA H 82 3.950 3.950 2.911 1.039 19718
5217 1 11 . 1 1 82 82 THR C C 82 171.700 171.700 173.474 -1.774 19718
5218 1 11 . 1 1 82 82 THR CA C 82 56.800 56.800 58.991 -2.191 19718
5219 1 11 . 1 1 82 82 THR CB C 82 63.800 63.800 67.895 -4.095 19718
5220 1 11 . 1 1 82 82 THR H H 82 7.630 7.630 7.469 0.161 19718
5221 1 11 . 1 1 83 83 SER N N 83 121.500 121.500 118.477 3.023 19718
5222 1 11 . 1 1 83 83 SER HA H 83 5.080 5.080 4.435 0.645 19718
5223 1 11 . 1 1 83 83 SER C C 83 170.900 170.900 173.814 -2.914 19718
5224 1 11 . 1 1 83 83 SER CA C 83 59.000 59.000 59.994 -0.994 19718
5225 1 11 . 1 1 83 83 SER CB C 83 61.700 61.700 64.067 -2.367 19718
5226 1 11 . 1 1 83 83 SER H H 83 6.930 6.930 8.038 -1.108 19718
5227 1 11 . 1 1 84 84 ARG N N 84 119.300 119.300 121.660 -2.360 19718
5228 1 11 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.763 0.107 19718
5229 1 11 . 1 1 84 84 ARG C C 84 172.400 172.400 174.537 -2.137 19718
5230 1 11 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.310 -5.011 19718
5231 1 11 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.998 -2.599 19718
5232 1 11 . 1 1 84 84 ARG H H 84 9.280 9.280 9.058 0.222 19718
5233 1 11 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.452 -0.022 19718
5234 1 11 . 1 1 88 88 GLN C C 88 172.500 172.500 174.217 -1.717 19718
5235 1 11 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.846 -4.846 19718
5236 1 11 . 1 1 88 88 GLN CB C 88 27.000 27.000 28.721 -1.721 19718
5237 1 11 . 1 1 90 90 LYS N N 90 123.700 123.700 124.053 -0.353 19718
5238 1 11 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.983 -0.533 19718
5239 1 11 . 1 1 90 90 LYS C C 90 173.500 173.500 175.707 -2.207 19718
5240 1 11 . 1 1 90 90 LYS CA C 90 51.500 51.500 54.000 -2.500 19718
5241 1 11 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.398 -2.498 19718
5242 1 11 . 1 1 90 90 LYS H H 90 8.330 8.330 8.098 0.232 19718
5243 1 11 . 1 1 91 91 MET N N 91 118.200 118.200 119.423 -1.223 19718
5244 1 11 . 1 1 91 91 MET HA H 91 4.330 4.330 4.523 -0.193 19718
5245 1 11 . 1 1 91 91 MET C C 91 174.300 174.300 175.770 -1.470 19718
5246 1 11 . 1 1 91 91 MET CA C 91 51.800 51.800 55.415 -3.615 19718
5247 1 11 . 1 1 91 91 MET CB C 91 27.200 27.200 31.442 -4.242 19718
5248 1 11 . 1 1 91 91 MET H H 91 8.620 8.620 8.470 0.150 19718
5249 1 11 . 1 1 92 92 SER N N 92 117.000 117.000 117.699 -0.699 19718
5250 1 11 . 1 1 92 92 SER HA H 92 4.610 4.610 4.743 -0.133 19718
5251 1 11 . 1 1 92 92 SER C C 92 171.300 171.300 175.288 -3.988 19718
5252 1 11 . 1 1 92 92 SER CA C 92 54.000 54.000 57.033 -3.033 19718
5253 1 11 . 1 1 92 92 SER CB C 92 63.700 63.700 66.285 -2.586 19718
5254 1 11 . 1 1 92 92 SER H H 92 6.970 6.970 8.250 -1.280 19718
5255 1 11 . 1 1 93 93 LYS N N 93 121.700 121.700 120.405 1.295 19718
5256 1 11 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.215 -0.245 19718
5257 1 11 . 1 1 93 93 LYS C C 93 175.200 175.200 177.497 -2.297 19718
5258 1 11 . 1 1 93 93 LYS CA C 93 56.700 56.700 57.921 -1.221 19718
5259 1 11 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.731 -2.631 19718
5260 1 11 . 1 1 93 93 LYS H H 93 9.260 9.260 8.834 0.426 19718
5261 1 11 . 1 1 94 94 ASP N N 94 116.700 116.700 118.985 -2.285 19718
5262 1 11 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.615 -0.255 19718
5263 1 11 . 1 1 94 94 ASP C C 94 174.300 174.300 177.106 -2.806 19718
5264 1 11 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.179 -2.479 19718
5265 1 11 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.540 -3.640 19718
5266 1 11 . 1 1 94 94 ASP H H 94 8.020 8.020 7.694 0.326 19718
5267 1 11 . 1 1 95 95 ILE N N 95 109.000 109.000 112.306 -3.306 19718
5268 1 11 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.285 0.375 19718
5269 1 11 . 1 1 95 95 ILE C C 95 170.600 170.600 174.542 -3.942 19718
5270 1 11 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.004 -2.704 19718
5271 1 11 . 1 1 95 95 ILE CB C 95 35.200 35.200 39.039 -3.839 19718
5272 1 11 . 1 1 95 95 ILE H H 95 7.240 7.240 7.310 -0.070 19718
5273 1 11 . 1 1 96 96 ASP N N 96 119.800 119.800 121.902 -2.102 19718
5274 1 11 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.387 -0.207 19718
5275 1 11 . 1 1 96 96 ASP C C 96 174.900 174.900 176.457 -1.557 19718
5276 1 11 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.098 -1.398 19718
5277 1 11 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.700 -0.700 19718
5278 1 11 . 1 1 96 96 ASP H H 96 6.950 6.950 8.326 -1.376 19718
5279 1 11 . 1 1 97 97 GLY N N 97 118.500 118.500 113.488 5.012 19718
5280 1 11 . 1 1 97 97 GLY C C 97 170.500 170.500 174.295 -3.795 19718
5281 1 11 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.288 -1.988 19718
5282 1 11 . 1 1 97 97 GLY H H 97 9.210 9.210 8.261 0.949 19718
5283 1 11 . 1 1 98 98 ILE N N 98 121.300 121.300 121.725 -0.425 19718
5284 1 11 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.982 1.618 19718
5285 1 11 . 1 1 98 98 ILE CA C 98 58.600 58.600 62.123 -3.523 19718
5286 1 11 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.262 -3.562 19718
5287 1 11 . 1 1 98 98 ILE H H 98 7.660 7.660 7.654 0.006 19718
5288 1 11 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.203 0.147 19718
5289 1 11 . 1 1 99 99 ARG C C 99 172.200 172.200 174.743 -2.543 19718
5290 1 11 . 1 1 99 99 ARG CA C 99 50.100 50.100 53.839 -3.739 19718
5291 1 11 . 1 1 99 99 ARG CB C 99 30.500 30.500 34.286 -3.786 19718
5292 1 11 . 1 1 100 100 VAL N N 100 114.900 114.900 115.578 -0.678 19718
5293 1 11 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.076 -0.256 19718
5294 1 11 . 1 1 100 100 VAL C C 100 169.600 169.600 173.394 -3.794 19718
5295 1 11 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.379 -4.179 19718
5296 1 11 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.328 -4.028 19718
5297 1 11 . 1 1 100 100 VAL H H 100 8.440 8.440 8.945 -0.505 19718
5298 1 11 . 1 1 101 101 ALA N N 101 123.400 123.400 123.228 0.172 19718
5299 1 11 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.695 0.615 19718
5300 1 11 . 1 1 101 101 ALA C C 101 174.400 174.400 175.215 -0.815 19718
5301 1 11 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.555 -3.755 19718
5302 1 11 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.247 -2.447 19718
5303 1 11 . 1 1 101 101 ALA H H 101 9.040 9.040 8.889 0.151 19718
5304 1 11 . 1 1 102 102 LEU N N 102 120.600 120.600 124.117 -3.517 19718
5305 1 11 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.981 -0.411 19718
5306 1 11 . 1 1 102 102 LEU CA C 102 52.200 52.200 52.039 0.161 19718
5307 1 11 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.080 -6.180 19718
5308 1 11 . 1 1 102 102 LEU H H 102 8.260 8.260 8.216 0.045 19718
5309 1 11 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.839 -0.259 19718
5310 1 11 . 1 1 112 112 ASN C C 112 171.900 171.900 174.577 -2.677 19718
5311 1 11 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.170 -2.770 19718
5312 1 11 . 1 1 112 112 ASN CB C 112 36.700 36.700 39.340 -2.640 19718
5313 1 11 . 1 1 113 113 ASP N N 113 120.300 120.300 118.156 2.144 19718
5314 1 11 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.370 0.070 19718
5315 1 11 . 1 1 113 113 ASP C C 113 173.000 173.000 174.944 -1.944 19718
5316 1 11 . 1 1 113 113 ASP CA C 113 51.600 51.600 55.731 -4.131 19718
5317 1 11 . 1 1 113 113 ASP CB C 113 38.100 38.100 39.651 -1.551 19718
5318 1 11 . 1 1 113 113 ASP H H 113 8.040 8.040 8.830 -0.790 19718
5319 1 11 . 1 1 114 114 PHE N N 114 120.100 120.100 117.662 2.438 19718
5320 1 11 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.588 0.022 19718
5321 1 11 . 1 1 114 114 PHE C C 114 172.200 172.200 174.503 -2.303 19718
5322 1 11 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.448 -3.548 19718
5323 1 11 . 1 1 114 114 PHE CB C 114 36.500 36.500 40.646 -4.146 19718
5324 1 11 . 1 1 114 114 PHE H H 114 8.110 8.110 8.606 -0.496 19718
5325 1 12 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.454 -0.214 19718
5326 1 12 . 1 1 2 2 GLU C C 2 173.400 173.400 176.350 -2.950 19718
5327 1 12 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.214 -2.814 19718
5328 1 12 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.264 -3.264 19718
5329 1 12 . 1 1 3 3 GLU N N 3 121.200 121.200 122.174 -0.974 19718
5330 1 12 . 1 1 3 3 GLU HA H 3 4.380 4.380 3.950 0.430 19718
5331 1 12 . 1 1 3 3 GLU C C 3 173.000 173.000 175.041 -2.041 19718
5332 1 12 . 1 1 3 3 GLU CA C 3 54.400 54.400 57.331 -2.931 19718
5333 1 12 . 1 1 3 3 GLU CB C 3 27.400 27.400 29.761 -2.361 19718
5334 1 12 . 1 1 3 3 GLU H H 3 8.510 8.510 8.663 -0.153 19718
5335 1 12 . 1 1 4 4 LEU N N 4 122.400 122.400 124.674 -2.274 19718
5336 1 12 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.760 -0.210 19718
5337 1 12 . 1 1 4 4 LEU C C 4 172.900 172.900 175.511 -2.611 19718
5338 1 12 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.157 -2.757 19718
5339 1 12 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.885 -4.185 19718
5340 1 12 . 1 1 4 4 LEU H H 4 8.460 8.460 8.720 -0.260 19718
5341 1 12 . 1 1 5 5 LYS N N 5 119.300 119.300 117.927 1.373 19718
5342 1 12 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.186 0.234 19718
5343 1 12 . 1 1 5 5 LYS C C 5 172.400 172.400 174.397 -1.997 19718
5344 1 12 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.907 -2.607 19718
5345 1 12 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.684 -3.684 19718
5346 1 12 . 1 1 5 5 LYS H H 5 8.570 8.570 8.125 0.445 19718
5347 1 12 . 1 1 6 6 ILE N N 6 116.900 116.900 120.805 -3.905 19718
5348 1 12 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.619 -0.509 19718
5349 1 12 . 1 1 6 6 ILE C C 6 169.800 169.800 173.272 -3.472 19718
5350 1 12 . 1 1 6 6 ILE CA C 6 55.500 55.500 58.902 -3.402 19718
5351 1 12 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.533 -3.533 19718
5352 1 12 . 1 1 6 6 ILE H H 6 8.160 8.160 8.887 -0.727 19718
5353 1 12 . 1 1 7 7 THR N N 7 123.000 123.000 124.122 -1.122 19718
5354 1 12 . 1 1 7 7 THR HA H 7 5.220 5.220 5.205 0.015 19718
5355 1 12 . 1 1 7 7 THR C C 7 169.900 169.900 173.379 -3.479 19718
5356 1 12 . 1 1 7 7 THR CA C 7 58.400 58.400 60.794 -2.394 19718
5357 1 12 . 1 1 7 7 THR CB C 7 68.700 68.700 70.435 -1.735 19718
5358 1 12 . 1 1 7 7 THR H H 7 8.520 8.520 8.331 0.189 19718
5359 1 12 . 1 1 8 8 PHE N N 8 124.000 124.000 123.636 0.364 19718
5360 1 12 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.526 -0.376 19718
5361 1 12 . 1 1 8 8 PHE C C 8 172.300 172.300 174.936 -2.636 19718
5362 1 12 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.273 -1.673 19718
5363 1 12 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.304 -2.204 19718
5364 1 12 . 1 1 8 8 PHE H H 8 9.290 9.290 9.355 -0.065 19718
5365 1 12 . 1 1 9 9 ILE N N 9 122.700 122.700 121.433 1.267 19718
5366 1 12 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.846 -0.266 19718
5367 1 12 . 1 1 9 9 ILE C C 9 173.600 173.600 175.995 -2.395 19718
5368 1 12 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.632 -2.432 19718
5369 1 12 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.778 -4.278 19718
5370 1 12 . 1 1 9 9 ILE H H 9 9.170 9.170 8.103 1.067 19718
5371 1 12 . 1 1 10 10 LEU N N 10 126.700 126.700 125.967 0.733 19718
5372 1 12 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.508 -0.188 19718
5373 1 12 . 1 1 10 10 LEU C C 10 176.500 176.500 178.621 -2.121 19718
5374 1 12 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.045 -1.845 19718
5375 1 12 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.351 -4.851 19718
5376 1 12 . 1 1 10 10 LEU H H 10 9.100 9.100 8.927 0.173 19718
5377 1 12 . 1 1 11 11 LYS N N 11 118.900 118.900 121.796 -2.896 19718
5378 1 12 . 1 1 11 11 LYS HA H 11 3.960 3.960 3.985 -0.025 19718
5379 1 12 . 1 1 11 11 LYS C C 11 174.100 174.100 177.433 -3.333 19718
5380 1 12 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.429 -2.030 19718
5381 1 12 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.400 -3.500 19718
5382 1 12 . 1 1 11 11 LYS H H 11 8.520 8.520 8.995 -0.475 19718
5383 1 12 . 1 1 12 12 ASP N N 12 114.400 114.400 114.340 0.060 19718
5384 1 12 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.587 -0.067 19718
5385 1 12 . 1 1 12 12 ASP C C 12 174.500 174.500 176.992 -2.492 19718
5386 1 12 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.563 -3.163 19718
5387 1 12 . 1 1 12 12 ASP CB C 12 37.200 37.200 39.535 -2.335 19718
5388 1 12 . 1 1 12 12 ASP H H 12 7.690 7.690 7.752 -0.062 19718
5389 1 12 . 1 1 13 13 GLY N N 13 109.200 109.200 107.249 1.951 19718
5390 1 12 . 1 1 13 13 GLY C C 13 171.600 171.600 174.968 -3.368 19718
5391 1 12 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.210 -2.810 19718
5392 1 12 . 1 1 13 13 GLY H H 13 8.100 8.100 7.834 0.266 19718
5393 1 12 . 1 1 14 14 SER N N 14 118.000 118.000 116.967 1.033 19718
5394 1 12 . 1 1 14 14 SER HA H 14 4.280 4.280 4.483 -0.203 19718
5395 1 12 . 1 1 14 14 SER C C 14 169.000 169.000 173.707 -4.707 19718
5396 1 12 . 1 1 14 14 SER CA C 14 56.500 56.500 59.147 -2.647 19718
5397 1 12 . 1 1 14 14 SER CB C 14 61.000 61.000 63.927 -2.927 19718
5398 1 12 . 1 1 14 14 SER H H 14 8.110 8.110 8.407 -0.297 19718
5399 1 12 . 1 1 15 15 GLN N N 15 116.300 116.300 120.177 -3.877 19718
5400 1 12 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.202 0.458 19718
5401 1 12 . 1 1 15 15 GLN C C 15 173.500 173.500 176.221 -2.721 19718
5402 1 12 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.942 -3.242 19718
5403 1 12 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.033 -2.033 19718
5404 1 12 . 1 1 15 15 GLN H H 15 8.330 8.330 8.447 -0.117 19718
5405 1 12 . 1 1 16 16 LYS N N 16 122.500 122.500 125.619 -3.119 19718
5406 1 12 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.671 -0.341 19718
5407 1 12 . 1 1 16 16 LYS C C 16 171.300 171.300 174.564 -3.264 19718
5408 1 12 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.135 -3.235 19718
5409 1 12 . 1 1 16 16 LYS CB C 16 34.000 34.000 36.063 -2.063 19718
5410 1 12 . 1 1 16 16 LYS H H 16 8.780 8.780 8.937 -0.157 19718
5411 1 12 . 1 1 17 17 THR N N 17 120.000 120.000 120.507 -0.507 19718
5412 1 12 . 1 1 17 17 THR HA H 17 5.220 5.220 4.886 0.334 19718
5413 1 12 . 1 1 17 17 THR C C 17 170.500 170.500 173.386 -2.886 19718
5414 1 12 . 1 1 17 17 THR CA C 17 58.700 58.700 62.014 -3.314 19718
5415 1 12 . 1 1 17 17 THR CB C 17 67.900 67.900 69.794 -1.894 19718
5416 1 12 . 1 1 17 17 THR H H 17 8.160 8.160 8.540 -0.380 19718
5417 1 12 . 1 1 18 18 TYR N N 18 125.600 125.600 125.632 -0.032 19718
5418 1 12 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.743 0.097 19718
5419 1 12 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.868 -1.869 19718
5420 1 12 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.678 -2.578 19718
5421 1 12 . 1 1 18 18 TYR H H 18 9.020 9.020 9.260 -0.240 19718
5422 1 12 . 1 1 19 19 GLU C C 19 174.200 174.200 175.533 -1.333 19718
5423 1 12 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.899 -2.999 19718
5424 1 12 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.212 -2.912 19718
5425 1 12 . 1 1 20 20 VAL N N 20 119.000 119.000 116.176 2.824 19718
5426 1 12 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.621 0.219 19718
5427 1 12 . 1 1 20 20 VAL C C 20 171.200 171.200 174.288 -3.088 19718
5428 1 12 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.632 -3.032 19718
5429 1 12 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.097 -2.397 19718
5430 1 12 . 1 1 20 20 VAL H H 20 9.160 9.160 8.265 0.895 19718
5431 1 12 . 1 1 21 21 CYS N N 21 117.500 117.500 119.960 -2.460 19718
5432 1 12 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.754 0.006 19718
5433 1 12 . 1 1 21 21 CYS C C 21 171.400 171.400 174.880 -3.480 19718
5434 1 12 . 1 1 21 21 CYS CA C 21 54.900 54.900 56.947 -2.047 19718
5435 1 12 . 1 1 21 21 CYS CB C 21 27.200 27.200 29.646 -2.446 19718
5436 1 12 . 1 1 21 21 CYS H H 21 8.720 8.720 8.963 -0.243 19718
5437 1 12 . 1 1 22 22 GLU N N 22 120.900 120.900 123.426 -2.526 19718
5438 1 12 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.920 -0.510 19718
5439 1 12 . 1 1 22 22 GLU C C 22 174.300 174.300 177.434 -3.134 19718
5440 1 12 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.294 -3.194 19718
5441 1 12 . 1 1 22 22 GLU CB C 22 26.800 26.800 30.003 -3.203 19718
5442 1 12 . 1 1 22 22 GLU H H 22 8.540 8.540 8.843 -0.303 19718
5443 1 12 . 1 1 23 23 GLY N N 23 112.400 112.400 115.191 -2.791 19718
5444 1 12 . 1 1 23 23 GLY C C 23 171.000 171.000 174.472 -3.472 19718
5445 1 12 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.089 -2.689 19718
5446 1 12 . 1 1 23 23 GLY H H 23 8.720 8.720 8.968 -0.248 19718
5447 1 12 . 1 1 24 24 GLU N N 24 119.600 119.600 121.855 -2.255 19718
5448 1 12 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.376 -0.046 19718
5449 1 12 . 1 1 24 24 GLU C C 24 174.400 174.400 176.253 -1.853 19718
5450 1 12 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.825 -2.724 19718
5451 1 12 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.096 -1.996 19718
5452 1 12 . 1 1 24 24 GLU H H 24 7.060 7.060 7.694 -0.634 19718
5453 1 12 . 1 1 25 25 THR N N 25 113.600 113.600 118.046 -4.446 19718
5454 1 12 . 1 1 25 25 THR HA H 25 5.510 5.510 4.770 0.740 19718
5455 1 12 . 1 1 25 25 THR C C 25 173.100 173.100 175.539 -2.439 19718
5456 1 12 . 1 1 25 25 THR CA C 25 57.000 57.000 61.553 -4.553 19718
5457 1 12 . 1 1 25 25 THR CB C 25 68.700 68.700 70.428 -1.728 19718
5458 1 12 . 1 1 25 25 THR H H 25 9.080 9.080 8.480 0.600 19718
5459 1 12 . 1 1 26 26 ILE N N 26 120.300 120.300 124.585 -4.285 19718
5460 1 12 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.854 -0.224 19718
5461 1 12 . 1 1 26 26 ILE C C 26 174.700 174.700 177.736 -3.036 19718
5462 1 12 . 1 1 26 26 ILE CA C 26 63.700 63.700 65.210 -1.510 19718
5463 1 12 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.844 -4.844 19718
5464 1 12 . 1 1 26 26 ILE H H 26 7.860 7.860 8.281 -0.421 19718
5465 1 12 . 1 1 27 27 LEU N N 27 117.600 117.600 119.181 -1.581 19718
5466 1 12 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.119 -0.369 19718
5467 1 12 . 1 1 27 27 LEU C C 27 174.000 174.000 178.676 -4.676 19718
5468 1 12 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.818 -2.917 19718
5469 1 12 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.728 -1.428 19718
5470 1 12 . 1 1 27 27 LEU H H 27 6.580 6.580 8.140 -1.560 19718
5471 1 12 . 1 1 28 28 ASP N N 28 120.000 120.000 120.218 -0.218 19718
5472 1 12 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.512 -0.262 19718
5473 1 12 . 1 1 28 28 ASP C C 28 177.900 177.900 179.024 -1.124 19718
5474 1 12 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.754 -2.753 19718
5475 1 12 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.844 -3.944 19718
5476 1 12 . 1 1 28 28 ASP H H 28 7.880 7.880 8.441 -0.561 19718
5477 1 12 . 1 1 29 29 ILE N N 29 122.100 122.100 120.892 1.208 19718
5478 1 12 . 1 1 29 29 ILE HA H 29 3.740 3.740 4.000 -0.260 19718
5479 1 12 . 1 1 29 29 ILE C C 29 175.700 175.700 177.760 -2.060 19718
5480 1 12 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.591 -2.491 19718
5481 1 12 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.973 -1.473 19718
5482 1 12 . 1 1 29 29 ILE H H 29 8.340 8.340 8.377 -0.037 19718
5483 1 12 . 1 1 30 30 ALA N N 30 124.100 124.100 123.617 0.483 19718
5484 1 12 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.748 -0.408 19718
5485 1 12 . 1 1 30 30 ALA C C 30 177.600 177.600 179.661 -2.061 19718
5486 1 12 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.562 -2.762 19718
5487 1 12 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.028 -1.228 19718
5488 1 12 . 1 1 30 30 ALA H H 30 8.430 8.430 8.277 0.153 19718
5489 1 12 . 1 1 31 31 GLN N N 31 116.000 116.000 118.051 -2.051 19718
5490 1 12 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.133 0.027 19718
5491 1 12 . 1 1 31 31 GLN C C 31 178.100 178.100 179.520 -1.420 19718
5492 1 12 . 1 1 31 31 GLN CA C 31 56.700 56.700 58.531 -1.831 19718
5493 1 12 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.394 -3.194 19718
5494 1 12 . 1 1 31 31 GLN H H 31 8.760 8.760 8.518 0.242 19718
5495 1 12 . 1 1 32 32 GLY N N 32 108.700 108.700 106.809 1.891 19718
5496 1 12 . 1 1 32 32 GLY C C 32 171.700 171.700 175.452 -3.752 19718
5497 1 12 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.575 -3.375 19718
5498 1 12 . 1 1 32 32 GLY H H 32 8.220 8.220 8.122 0.098 19718
5499 1 12 . 1 1 33 33 HIS N N 33 115.000 115.000 118.932 -3.932 19718
5500 1 12 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.657 -0.227 19718
5501 1 12 . 1 1 33 33 HIS C C 33 169.800 169.800 174.054 -4.254 19718
5502 1 12 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.083 -2.683 19718
5503 1 12 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.322 -4.822 19718
5504 1 12 . 1 1 33 33 HIS H H 33 6.980 6.980 7.883 -0.903 19718
5505 1 12 . 1 1 34 34 ASN N N 34 113.700 113.700 116.990 -3.290 19718
5506 1 12 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.409 -0.079 19718
5507 1 12 . 1 1 34 34 ASN C C 34 172.000 172.000 175.292 -3.292 19718
5508 1 12 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.941 -1.841 19718
5509 1 12 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.576 -2.576 19718
5510 1 12 . 1 1 34 34 ASN H H 34 7.700 7.700 7.997 -0.297 19718
5511 1 12 . 1 1 35 35 LEU N N 35 115.600 115.600 118.775 -3.175 19718
5512 1 12 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.173 0.077 19718
5513 1 12 . 1 1 35 35 LEU C C 35 174.900 174.900 176.693 -1.793 19718
5514 1 12 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.900 -4.600 19718
5515 1 12 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.062 -2.862 19718
5516 1 12 . 1 1 35 35 LEU H H 35 7.980 7.980 7.964 0.016 19718
5517 1 12 . 1 1 36 36 ASP N N 36 120.100 120.100 126.870 -6.770 19718
5518 1 12 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.693 -0.263 19718
5519 1 12 . 1 1 36 36 ASP C C 36 171.100 171.100 175.184 -4.084 19718
5520 1 12 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.659 -3.659 19718
5521 1 12 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.682 -3.482 19718
5522 1 12 . 1 1 36 36 ASP H H 36 8.610 8.610 8.662 -0.052 19718
5523 1 12 . 1 1 37 37 MET N N 37 123.900 123.900 118.243 5.657 19718
5524 1 12 . 1 1 37 37 MET HA H 37 4.280 4.280 4.771 -0.491 19718
5525 1 12 . 1 1 37 37 MET C C 37 171.200 171.200 174.934 -3.734 19718
5526 1 12 . 1 1 37 37 MET CA C 37 52.800 52.800 54.688 -1.888 19718
5527 1 12 . 1 1 37 37 MET CB C 37 33.000 33.000 35.844 -2.844 19718
5528 1 12 . 1 1 37 37 MET H H 37 7.670 7.670 7.788 -0.118 19718
5529 1 12 . 1 1 38 38 GLU N N 38 128.600 128.600 120.766 7.834 19718
5530 1 12 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.329 -0.039 19718
5531 1 12 . 1 1 38 38 GLU CA C 38 53.200 53.200 58.150 -4.950 19718
5532 1 12 . 1 1 38 38 GLU CB C 38 29.400 29.400 30.188 -0.788 19718
5533 1 12 . 1 1 38 38 GLU H H 38 9.060 9.060 8.947 0.113 19718
5534 1 12 . 1 1 51 51 HIS C C 51 170.700 170.700 174.485 -3.785 19718
5535 1 12 . 1 1 51 51 HIS CA C 51 52.800 52.800 56.103 -3.303 19718
5536 1 12 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.045 -2.345 19718
5537 1 12 . 1 1 53 53 ILE N N 53 122.200 122.200 120.663 1.537 19718
5538 1 12 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.782 -0.772 19718
5539 1 12 . 1 1 53 53 ILE C C 53 174.400 174.400 173.634 0.766 19718
5540 1 12 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.899 -0.199 19718
5541 1 12 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.619 -5.319 19718
5542 1 12 . 1 1 53 53 ILE H H 53 8.800 8.800 7.846 0.954 19718
5543 1 12 . 1 1 54 54 VAL N N 54 130.200 130.200 125.959 4.241 19718
5544 1 12 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.724 -0.854 19718
5545 1 12 . 1 1 54 54 VAL C C 54 172.500 172.500 174.901 -2.401 19718
5546 1 12 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.224 1.677 19718
5547 1 12 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.282 -5.682 19718
5548 1 12 . 1 1 54 54 VAL H H 54 8.380 8.380 8.646 -0.266 19718
5549 1 12 . 1 1 55 55 ASP N N 55 129.100 129.100 127.316 1.784 19718
5550 1 12 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.665 -0.075 19718
5551 1 12 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.345 -2.645 19718
5552 1 12 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.718 -1.218 19718
5553 1 12 . 1 1 55 55 ASP H H 55 8.160 8.160 8.148 0.012 19718
5554 1 12 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.317 -0.147 19718
5555 1 12 . 1 1 56 56 PRO C C 56 174.900 174.900 177.246 -2.346 19718
5556 1 12 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.559 -1.559 19718
5557 1 12 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.671 -2.271 19718
5558 1 12 . 1 1 57 57 ASP N N 57 117.100 117.100 117.286 -0.186 19718
5559 1 12 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.376 -0.006 19718
5560 1 12 . 1 1 57 57 ASP C C 57 174.100 174.100 177.178 -3.078 19718
5561 1 12 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.666 -2.966 19718
5562 1 12 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.083 -4.283 19718
5563 1 12 . 1 1 57 57 ASP H H 57 9.110 9.110 8.608 0.502 19718
5564 1 12 . 1 1 58 58 TYR N N 58 115.800 115.800 117.255 -1.455 19718
5565 1 12 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.445 -0.085 19718
5566 1 12 . 1 1 58 58 TYR C C 58 173.200 173.200 177.959 -4.759 19718
5567 1 12 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.253 -2.553 19718
5568 1 12 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.119 -0.219 19718
5569 1 12 . 1 1 58 58 TYR H H 58 8.190 8.190 7.806 0.384 19718
5570 1 12 . 1 1 59 59 TYR N N 59 120.100 120.100 121.869 -1.769 19718
5571 1 12 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.133 -0.353 19718
5572 1 12 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.506 -0.406 19718
5573 1 12 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.284 -1.884 19718
5574 1 12 . 1 1 59 59 TYR H H 59 7.420 7.420 8.262 -0.842 19718
5575 1 12 . 1 1 60 60 ASP N N 60 115.200 115.200 118.070 -2.870 19718
5576 1 12 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.488 -0.128 19718
5577 1 12 . 1 1 60 60 ASP C C 60 173.100 173.100 176.277 -3.177 19718
5578 1 12 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.856 -2.457 19718
5579 1 12 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.349 -2.849 19718
5580 1 12 . 1 1 60 60 ASP H H 60 8.440 8.440 8.710 -0.270 19718
5581 1 12 . 1 1 61 61 ALA N N 61 120.200 120.200 120.875 -0.675 19718
5582 1 12 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.307 -0.127 19718
5583 1 12 . 1 1 61 61 ALA C C 61 175.000 175.000 177.206 -2.206 19718
5584 1 12 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.298 -2.998 19718
5585 1 12 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.054 -3.854 19718
5586 1 12 . 1 1 61 61 ALA H H 61 7.300 7.300 7.649 -0.349 19718
5587 1 12 . 1 1 62 62 LEU N N 62 118.000 118.000 122.011 -4.011 19718
5588 1 12 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.636 -0.346 19718
5589 1 12 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.901 -2.801 19718
5590 1 12 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.822 -3.122 19718
5591 1 12 . 1 1 62 62 LEU H H 62 6.680 6.680 7.646 -0.966 19718
5592 1 12 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.518 -0.198 19718
5593 1 12 . 1 1 63 63 PRO C C 63 173.500 173.500 175.777 -2.277 19718
5594 1 12 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.039 -2.339 19718
5595 1 12 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.473 -3.973 19718
5596 1 12 . 1 1 64 64 GLU N N 64 124.500 124.500 118.774 5.726 19718
5597 1 12 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.594 -0.414 19718
5598 1 12 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.195 -1.695 19718
5599 1 12 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.611 -4.811 19718
5600 1 12 . 1 1 64 64 GLU H H 64 8.590 8.590 8.389 0.201 19718
5601 1 12 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.574 -0.404 19718
5602 1 12 . 1 1 65 65 PRO C C 65 174.900 174.900 176.384 -1.484 19718
5603 1 12 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.320 0.680 19718
5604 1 12 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.265 -4.765 19718
5605 1 12 . 1 1 66 66 GLU N N 66 123.300 123.300 119.174 4.126 19718
5606 1 12 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.147 0.183 19718
5607 1 12 . 1 1 66 66 GLU C C 66 174.200 174.200 177.142 -2.942 19718
5608 1 12 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.626 -4.125 19718
5609 1 12 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.692 -3.292 19718
5610 1 12 . 1 1 66 66 GLU H H 66 9.080 9.080 8.468 0.612 19718
5611 1 12 . 1 1 67 67 ASP N N 67 120.100 120.100 121.165 -1.065 19718
5612 1 12 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.604 -0.364 19718
5613 1 12 . 1 1 67 67 ASP C C 67 174.900 174.900 176.877 -1.977 19718
5614 1 12 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.217 -0.817 19718
5615 1 12 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.929 -3.129 19718
5616 1 12 . 1 1 67 67 ASP H H 67 8.690 8.690 8.589 0.101 19718
5617 1 12 . 1 1 68 68 ASP N N 68 116.800 116.800 116.611 0.189 19718
5618 1 12 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.557 -0.317 19718
5619 1 12 . 1 1 68 68 ASP C C 68 175.500 175.500 177.327 -1.827 19718
5620 1 12 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.638 -1.338 19718
5621 1 12 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.004 -4.904 19718
5622 1 12 . 1 1 68 68 ASP H H 68 8.400 8.400 8.436 -0.036 19718
5623 1 12 . 1 1 69 69 GLU N N 69 123.600 123.600 119.665 3.935 19718
5624 1 12 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.135 0.015 19718
5625 1 12 . 1 1 69 69 GLU C C 69 175.200 175.200 178.592 -3.392 19718
5626 1 12 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.672 -2.472 19718
5627 1 12 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.156 -4.156 19718
5628 1 12 . 1 1 69 69 GLU H H 69 7.530 7.530 7.897 -0.367 19718
5629 1 12 . 1 1 70 70 ASN N N 70 119.100 119.100 118.289 0.811 19718
5630 1 12 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.471 -0.111 19718
5631 1 12 . 1 1 70 70 ASN C C 70 175.200 175.200 176.533 -1.333 19718
5632 1 12 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.463 -1.763 19718
5633 1 12 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.449 -2.649 19718
5634 1 12 . 1 1 70 70 ASN H H 70 7.960 7.960 8.725 -0.765 19718
5635 1 12 . 1 1 71 71 ASP N N 71 118.400 118.400 120.903 -2.503 19718
5636 1 12 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.468 -0.218 19718
5637 1 12 . 1 1 71 71 ASP C C 71 176.000 176.000 177.768 -1.768 19718
5638 1 12 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.820 -2.220 19718
5639 1 12 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.910 -3.410 19718
5640 1 12 . 1 1 71 71 ASP H H 71 8.250 8.250 8.325 -0.075 19718
5641 1 12 . 1 1 72 72 MET N N 72 117.300 117.300 116.703 0.597 19718
5642 1 12 . 1 1 72 72 MET HA H 72 4.370 4.370 4.149 0.221 19718
5643 1 12 . 1 1 72 72 MET C C 72 177.800 177.800 177.687 0.113 19718
5644 1 12 . 1 1 72 72 MET CA C 72 53.700 53.700 58.403 -4.703 19718
5645 1 12 . 1 1 72 72 MET CB C 72 32.400 32.400 32.535 -0.135 19718
5646 1 12 . 1 1 72 72 MET H H 72 7.240 7.240 7.530 -0.290 19718
5647 1 12 . 1 1 73 73 LEU N N 73 123.000 123.000 120.297 2.703 19718
5648 1 12 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.354 -0.595 19718
5649 1 12 . 1 1 73 73 LEU C C 73 175.700 175.700 179.764 -4.064 19718
5650 1 12 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.181 -2.281 19718
5651 1 12 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.925 -3.825 19718
5652 1 12 . 1 1 73 73 LEU H H 73 8.600 8.600 7.305 1.295 19718
5653 1 12 . 1 1 74 74 ASP N N 74 118.500 118.500 118.958 -0.458 19718
5654 1 12 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.442 -0.102 19718
5655 1 12 . 1 1 74 74 ASP C C 74 174.700 174.700 177.722 -3.022 19718
5656 1 12 . 1 1 74 74 ASP CA C 74 54.300 54.300 57.232 -2.932 19718
5657 1 12 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.705 -2.505 19718
5658 1 12 . 1 1 74 74 ASP H H 74 7.250 7.250 7.846 -0.596 19718
5659 1 12 . 1 1 75 75 LEU N N 75 116.300 116.300 117.361 -1.061 19718
5660 1 12 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.105 0.195 19718
5661 1 12 . 1 1 75 75 LEU C C 75 174.500 174.500 176.738 -2.238 19718
5662 1 12 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.688 -4.388 19718
5663 1 12 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.394 -1.794 19718
5664 1 12 . 1 1 75 75 LEU H H 75 7.000 7.000 7.555 -0.555 19718
5665 1 12 . 1 1 76 76 ALA N N 76 124.600 124.600 119.157 5.443 19718
5666 1 12 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.460 -0.360 19718
5667 1 12 . 1 1 76 76 ALA C C 76 174.200 174.200 176.197 -1.997 19718
5668 1 12 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.536 -1.036 19718
5669 1 12 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.792 -5.592 19718
5670 1 12 . 1 1 76 76 ALA H H 76 7.590 7.590 7.407 0.183 19718
5671 1 12 . 1 1 77 77 TYR N N 77 122.900 122.900 121.828 1.072 19718
5672 1 12 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.139 0.291 19718
5673 1 12 . 1 1 77 77 TYR C C 77 174.100 174.100 177.136 -3.036 19718
5674 1 12 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.713 -4.813 19718
5675 1 12 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.126 -3.226 19718
5676 1 12 . 1 1 77 77 TYR H H 77 8.150 8.150 8.623 -0.473 19718
5677 1 12 . 1 1 78 78 GLY N N 78 112.900 112.900 113.593 -0.693 19718
5678 1 12 . 1 1 78 78 GLY C C 78 171.800 171.800 173.271 -1.471 19718
5679 1 12 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.844 -1.144 19718
5680 1 12 . 1 1 78 78 GLY H H 78 8.320 8.320 7.858 0.462 19718
5681 1 12 . 1 1 79 79 LEU N N 79 119.300 119.300 118.850 0.450 19718
5682 1 12 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.609 -0.819 19718
5683 1 12 . 1 1 79 79 LEU C C 79 174.000 174.000 176.297 -2.297 19718
5684 1 12 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.286 -1.286 19718
5685 1 12 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.947 -3.047 19718
5686 1 12 . 1 1 79 79 LEU H H 79 7.120 7.120 8.025 -0.905 19718
5687 1 12 . 1 1 80 80 THR N N 80 118.500 118.500 120.164 -1.664 19718
5688 1 12 . 1 1 80 80 THR HA H 80 4.860 4.860 4.521 0.339 19718
5689 1 12 . 1 1 80 80 THR C C 80 173.300 173.300 174.827 -1.527 19718
5690 1 12 . 1 1 80 80 THR CA C 80 57.600 57.600 60.182 -2.582 19718
5691 1 12 . 1 1 80 80 THR CB C 80 71.000 71.000 70.591 0.409 19718
5692 1 12 . 1 1 80 80 THR H H 80 9.240 9.240 7.930 1.310 19718
5693 1 12 . 1 1 81 81 GLU N N 81 118.000 118.000 121.039 -3.039 19718
5694 1 12 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.149 -0.039 19718
5695 1 12 . 1 1 81 81 GLU C C 81 173.900 173.900 176.681 -2.781 19718
5696 1 12 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.457 -3.057 19718
5697 1 12 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.122 -2.422 19718
5698 1 12 . 1 1 81 81 GLU H H 81 9.020 9.020 8.765 0.255 19718
5699 1 12 . 1 1 82 82 THR N N 82 106.400 106.400 106.097 0.303 19718
5700 1 12 . 1 1 82 82 THR HA H 82 3.950 3.950 2.713 1.237 19718
5701 1 12 . 1 1 82 82 THR C C 82 171.700 171.700 173.361 -1.661 19718
5702 1 12 . 1 1 82 82 THR CA C 82 56.800 56.800 59.320 -2.520 19718
5703 1 12 . 1 1 82 82 THR CB C 82 63.800 63.800 68.296 -4.496 19718
5704 1 12 . 1 1 82 82 THR H H 82 7.630 7.630 7.419 0.211 19718
5705 1 12 . 1 1 83 83 SER N N 83 121.500 121.500 118.781 2.719 19718
5706 1 12 . 1 1 83 83 SER HA H 83 5.080 5.080 4.301 0.779 19718
5707 1 12 . 1 1 83 83 SER C C 83 170.900 170.900 173.639 -2.739 19718
5708 1 12 . 1 1 83 83 SER CA C 83 59.000 59.000 59.812 -0.812 19718
5709 1 12 . 1 1 83 83 SER CB C 83 61.700 61.700 63.815 -2.115 19718
5710 1 12 . 1 1 83 83 SER H H 83 6.930 6.930 7.598 -0.668 19718
5711 1 12 . 1 1 84 84 ARG N N 84 119.300 119.300 124.458 -5.158 19718
5712 1 12 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.826 0.044 19718
5713 1 12 . 1 1 84 84 ARG C C 84 172.400 172.400 174.248 -1.848 19718
5714 1 12 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.308 -4.008 19718
5715 1 12 . 1 1 84 84 ARG CB C 84 32.400 32.400 35.079 -2.679 19718
5716 1 12 . 1 1 84 84 ARG H H 84 9.280 9.280 8.754 0.526 19718
5717 1 12 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.493 -0.063 19718
5718 1 12 . 1 1 88 88 GLN C C 88 172.500 172.500 174.386 -1.886 19718
5719 1 12 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.717 -4.717 19718
5720 1 12 . 1 1 88 88 GLN CB C 88 27.000 27.000 30.174 -3.174 19718
5721 1 12 . 1 1 90 90 LYS N N 90 123.700 123.700 124.817 -1.117 19718
5722 1 12 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.048 -0.598 19718
5723 1 12 . 1 1 90 90 LYS C C 90 173.500 173.500 175.399 -1.899 19718
5724 1 12 . 1 1 90 90 LYS CA C 90 51.500 51.500 54.033 -2.534 19718
5725 1 12 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.716 -2.816 19718
5726 1 12 . 1 1 90 90 LYS H H 90 8.330 8.330 8.069 0.261 19718
5727 1 12 . 1 1 91 91 MET N N 91 118.200 118.200 119.581 -1.381 19718
5728 1 12 . 1 1 91 91 MET HA H 91 4.330 4.330 4.676 -0.346 19718
5729 1 12 . 1 1 91 91 MET C C 91 174.300 174.300 176.124 -1.824 19718
5730 1 12 . 1 1 91 91 MET CA C 91 51.800 51.800 54.978 -3.178 19718
5731 1 12 . 1 1 91 91 MET CB C 91 27.200 27.200 32.040 -4.840 19718
5732 1 12 . 1 1 91 91 MET H H 91 8.620 8.620 8.417 0.203 19718
5733 1 12 . 1 1 92 92 SER N N 92 117.000 117.000 117.114 -0.114 19718
5734 1 12 . 1 1 92 92 SER HA H 92 4.610 4.610 4.748 -0.138 19718
5735 1 12 . 1 1 92 92 SER C C 92 171.300 171.300 175.408 -4.108 19718
5736 1 12 . 1 1 92 92 SER CA C 92 54.000 54.000 56.499 -2.499 19718
5737 1 12 . 1 1 92 92 SER CB C 92 63.700 63.700 66.119 -2.419 19718
5738 1 12 . 1 1 92 92 SER H H 92 6.970 6.970 8.213 -1.243 19718
5739 1 12 . 1 1 93 93 LYS N N 93 121.700 121.700 120.807 0.893 19718
5740 1 12 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.109 -0.139 19718
5741 1 12 . 1 1 93 93 LYS C C 93 175.200 175.200 177.725 -2.525 19718
5742 1 12 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.107 -2.407 19718
5743 1 12 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.118 -3.018 19718
5744 1 12 . 1 1 93 93 LYS H H 93 9.260 9.260 8.876 0.384 19718
5745 1 12 . 1 1 94 94 ASP N N 94 116.700 116.700 119.164 -2.464 19718
5746 1 12 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.540 -0.180 19718
5747 1 12 . 1 1 94 94 ASP C C 94 174.300 174.300 177.328 -3.028 19718
5748 1 12 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.353 -2.653 19718
5749 1 12 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.164 -3.264 19718
5750 1 12 . 1 1 94 94 ASP H H 94 8.020 8.020 7.711 0.309 19718
5751 1 12 . 1 1 95 95 ILE N N 95 109.000 109.000 111.591 -2.591 19718
5752 1 12 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.540 0.120 19718
5753 1 12 . 1 1 95 95 ILE C C 95 170.600 170.600 174.776 -4.176 19718
5754 1 12 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.117 -2.817 19718
5755 1 12 . 1 1 95 95 ILE CB C 95 35.200 35.200 39.520 -4.320 19718
5756 1 12 . 1 1 95 95 ILE H H 95 7.240 7.240 7.545 -0.305 19718
5757 1 12 . 1 1 96 96 ASP N N 96 119.800 119.800 122.346 -2.546 19718
5758 1 12 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.445 -0.265 19718
5759 1 12 . 1 1 96 96 ASP C C 96 174.900 174.900 176.695 -1.795 19718
5760 1 12 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.408 -1.708 19718
5761 1 12 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.236 -0.236 19718
5762 1 12 . 1 1 96 96 ASP H H 96 6.950 6.950 7.880 -0.930 19718
5763 1 12 . 1 1 97 97 GLY N N 97 118.500 118.500 111.942 6.558 19718
5764 1 12 . 1 1 97 97 GLY C C 97 170.500 170.500 174.030 -3.530 19718
5765 1 12 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.316 -2.016 19718
5766 1 12 . 1 1 97 97 GLY H H 97 9.210 9.210 8.279 0.931 19718
5767 1 12 . 1 1 98 98 ILE N N 98 121.300 121.300 121.857 -0.557 19718
5768 1 12 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.384 2.216 19718
5769 1 12 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.764 -3.163 19718
5770 1 12 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.337 -3.637 19718
5771 1 12 . 1 1 98 98 ILE H H 98 7.660 7.660 8.123 -0.463 19718
5772 1 12 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.194 0.156 19718
5773 1 12 . 1 1 99 99 ARG C C 99 172.200 172.200 175.119 -2.919 19718
5774 1 12 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.098 -3.998 19718
5775 1 12 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.520 -3.020 19718
5776 1 12 . 1 1 100 100 VAL N N 100 114.900 114.900 115.992 -1.092 19718
5777 1 12 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.071 -0.251 19718
5778 1 12 . 1 1 100 100 VAL C C 100 169.600 169.600 173.457 -3.857 19718
5779 1 12 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.529 -4.329 19718
5780 1 12 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.318 -4.018 19718
5781 1 12 . 1 1 100 100 VAL H H 100 8.440 8.440 8.919 -0.479 19718
5782 1 12 . 1 1 101 101 ALA N N 101 123.400 123.400 122.910 0.490 19718
5783 1 12 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.736 0.574 19718
5784 1 12 . 1 1 101 101 ALA C C 101 174.400 174.400 175.394 -0.994 19718
5785 1 12 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.675 -3.875 19718
5786 1 12 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.030 -2.230 19718
5787 1 12 . 1 1 101 101 ALA H H 101 9.040 9.040 8.784 0.256 19718
5788 1 12 . 1 1 102 102 LEU N N 102 120.600 120.600 123.125 -2.525 19718
5789 1 12 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.965 -0.395 19718
5790 1 12 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.940 0.260 19718
5791 1 12 . 1 1 102 102 LEU CB C 102 37.900 37.900 45.915 -8.015 19718
5792 1 12 . 1 1 102 102 LEU H H 102 8.260 8.260 7.972 0.288 19718
5793 1 12 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.372 0.208 19718
5794 1 12 . 1 1 112 112 ASN C C 112 171.900 171.900 173.983 -2.083 19718
5795 1 12 . 1 1 112 112 ASN CA C 112 50.400 50.400 54.275 -3.875 19718
5796 1 12 . 1 1 112 112 ASN CB C 112 36.700 36.700 38.556 -1.856 19718
5797 1 12 . 1 1 113 113 ASP N N 113 120.300 120.300 117.613 2.687 19718
5798 1 12 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.540 -0.100 19718
5799 1 12 . 1 1 113 113 ASP C C 113 173.000 173.000 175.176 -2.176 19718
5800 1 12 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.927 -3.327 19718
5801 1 12 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.974 -2.873 19718
5802 1 12 . 1 1 113 113 ASP H H 113 8.040 8.040 8.012 0.028 19718
5803 1 12 . 1 1 114 114 PHE N N 114 120.100 120.100 123.129 -3.029 19718
5804 1 12 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.845 -0.235 19718
5805 1 12 . 1 1 114 114 PHE C C 114 172.200 172.200 174.363 -2.163 19718
5806 1 12 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.136 -3.236 19718
5807 1 12 . 1 1 114 114 PHE CB C 114 36.500 36.500 41.723 -5.223 19718
5808 1 12 . 1 1 114 114 PHE H H 114 8.110 8.110 8.576 -0.466 19718
5809 1 13 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.588 -0.348 19718
5810 1 13 . 1 1 2 2 GLU C C 2 173.400 173.400 175.205 -1.805 19718
5811 1 13 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.151 -2.751 19718
5812 1 13 . 1 1 2 2 GLU CB C 2 27.000 27.000 31.757 -4.757 19718
5813 1 13 . 1 1 3 3 GLU N N 3 121.200 121.200 121.409 -0.209 19718
5814 1 13 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.829 -0.449 19718
5815 1 13 . 1 1 3 3 GLU C C 3 173.000 173.000 174.227 -1.227 19718
5816 1 13 . 1 1 3 3 GLU CA C 3 54.400 54.400 55.601 -1.201 19718
5817 1 13 . 1 1 3 3 GLU CB C 3 27.400 27.400 31.447 -4.047 19718
5818 1 13 . 1 1 3 3 GLU H H 3 8.510 8.510 8.515 -0.005 19718
5819 1 13 . 1 1 4 4 LEU N N 4 122.400 122.400 121.216 1.184 19718
5820 1 13 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.841 -0.291 19718
5821 1 13 . 1 1 4 4 LEU C C 4 172.900 172.900 174.633 -1.733 19718
5822 1 13 . 1 1 4 4 LEU CA C 4 50.400 50.400 54.562 -4.162 19718
5823 1 13 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.980 -4.280 19718
5824 1 13 . 1 1 4 4 LEU H H 4 8.460 8.460 8.626 -0.166 19718
5825 1 13 . 1 1 5 5 LYS N N 5 119.300 119.300 119.681 -0.381 19718
5826 1 13 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.328 0.092 19718
5827 1 13 . 1 1 5 5 LYS C C 5 172.400 172.400 174.351 -1.951 19718
5828 1 13 . 1 1 5 5 LYS CA C 5 52.300 52.300 55.026 -2.726 19718
5829 1 13 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.328 -3.328 19718
5830 1 13 . 1 1 5 5 LYS H H 5 8.570 8.570 8.232 0.338 19718
5831 1 13 . 1 1 6 6 ILE N N 6 116.900 116.900 122.196 -5.296 19718
5832 1 13 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.624 -0.514 19718
5833 1 13 . 1 1 6 6 ILE C C 6 169.800 169.800 173.320 -3.520 19718
5834 1 13 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.245 -3.745 19718
5835 1 13 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.461 -3.461 19718
5836 1 13 . 1 1 6 6 ILE H H 6 8.160 8.160 8.964 -0.804 19718
5837 1 13 . 1 1 7 7 THR N N 7 123.000 123.000 124.738 -1.738 19718
5838 1 13 . 1 1 7 7 THR HA H 7 5.220 5.220 5.147 0.073 19718
5839 1 13 . 1 1 7 7 THR C C 7 169.900 169.900 173.459 -3.559 19718
5840 1 13 . 1 1 7 7 THR CA C 7 58.400 58.400 60.959 -2.559 19718
5841 1 13 . 1 1 7 7 THR CB C 7 68.700 68.700 70.082 -1.382 19718
5842 1 13 . 1 1 7 7 THR H H 7 8.520 8.520 8.231 0.289 19718
5843 1 13 . 1 1 8 8 PHE N N 8 124.000 124.000 122.915 1.085 19718
5844 1 13 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.566 -0.416 19718
5845 1 13 . 1 1 8 8 PHE C C 8 172.300 172.300 174.878 -2.578 19718
5846 1 13 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.383 -1.784 19718
5847 1 13 . 1 1 8 8 PHE CB C 8 40.100 40.100 42.508 -2.408 19718
5848 1 13 . 1 1 8 8 PHE H H 8 9.290 9.290 9.319 -0.029 19718
5849 1 13 . 1 1 9 9 ILE N N 9 122.700 122.700 121.722 0.978 19718
5850 1 13 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.916 -0.336 19718
5851 1 13 . 1 1 9 9 ILE C C 9 173.600 173.600 176.130 -2.530 19718
5852 1 13 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.540 -2.340 19718
5853 1 13 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.611 -4.111 19718
5854 1 13 . 1 1 9 9 ILE H H 9 9.170 9.170 8.235 0.935 19718
5855 1 13 . 1 1 10 10 LEU N N 10 126.700 126.700 126.228 0.472 19718
5856 1 13 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.431 -0.111 19718
5857 1 13 . 1 1 10 10 LEU C C 10 176.500 176.500 178.766 -2.266 19718
5858 1 13 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.787 -2.587 19718
5859 1 13 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.254 -4.754 19718
5860 1 13 . 1 1 10 10 LEU H H 10 9.100 9.100 8.939 0.161 19718
5861 1 13 . 1 1 11 11 LYS N N 11 118.900 118.900 122.059 -3.159 19718
5862 1 13 . 1 1 11 11 LYS HA H 11 3.960 3.960 3.994 -0.034 19718
5863 1 13 . 1 1 11 11 LYS C C 11 174.100 174.100 178.057 -3.957 19718
5864 1 13 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.499 -2.099 19718
5865 1 13 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.316 -3.416 19718
5866 1 13 . 1 1 11 11 LYS H H 11 8.520 8.520 8.572 -0.052 19718
5867 1 13 . 1 1 12 12 ASP N N 12 114.400 114.400 116.003 -1.603 19718
5868 1 13 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.580 -0.060 19718
5869 1 13 . 1 1 12 12 ASP C C 12 174.500 174.500 176.840 -2.340 19718
5870 1 13 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.790 -3.390 19718
5871 1 13 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.767 -3.567 19718
5872 1 13 . 1 1 12 12 ASP H H 12 7.690 7.690 8.178 -0.488 19718
5873 1 13 . 1 1 13 13 GLY N N 13 109.200 109.200 107.816 1.384 19718
5874 1 13 . 1 1 13 13 GLY C C 13 171.600 171.600 174.326 -2.726 19718
5875 1 13 . 1 1 13 13 GLY CA C 13 42.400 42.400 46.092 -3.692 19718
5876 1 13 . 1 1 13 13 GLY H H 13 8.100 8.100 8.010 0.090 19718
5877 1 13 . 1 1 14 14 SER N N 14 118.000 118.000 115.983 2.017 19718
5878 1 13 . 1 1 14 14 SER HA H 14 4.280 4.280 4.459 -0.179 19718
5879 1 13 . 1 1 14 14 SER C C 14 169.000 169.000 173.930 -4.930 19718
5880 1 13 . 1 1 14 14 SER CA C 14 56.500 56.500 58.110 -1.610 19718
5881 1 13 . 1 1 14 14 SER CB C 14 61.000 61.000 64.036 -3.036 19718
5882 1 13 . 1 1 14 14 SER H H 14 8.110 8.110 7.992 0.118 19718
5883 1 13 . 1 1 15 15 GLN N N 15 116.300 116.300 120.546 -4.246 19718
5884 1 13 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.246 0.414 19718
5885 1 13 . 1 1 15 15 GLN C C 15 173.500 173.500 176.163 -2.663 19718
5886 1 13 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.996 -3.296 19718
5887 1 13 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.138 -2.138 19718
5888 1 13 . 1 1 15 15 GLN H H 15 8.330 8.330 8.503 -0.173 19718
5889 1 13 . 1 1 16 16 LYS N N 16 122.500 122.500 125.202 -2.702 19718
5890 1 13 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.588 -0.258 19718
5891 1 13 . 1 1 16 16 LYS C C 16 171.300 171.300 174.445 -3.145 19718
5892 1 13 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.038 -3.138 19718
5893 1 13 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.691 -1.691 19718
5894 1 13 . 1 1 16 16 LYS H H 16 8.780 8.780 8.659 0.121 19718
5895 1 13 . 1 1 17 17 THR N N 17 120.000 120.000 118.756 1.244 19718
5896 1 13 . 1 1 17 17 THR HA H 17 5.220 5.220 4.967 0.253 19718
5897 1 13 . 1 1 17 17 THR C C 17 170.500 170.500 173.413 -2.913 19718
5898 1 13 . 1 1 17 17 THR CA C 17 58.700 58.700 60.626 -1.926 19718
5899 1 13 . 1 1 17 17 THR CB C 17 67.900 67.900 70.076 -2.176 19718
5900 1 13 . 1 1 17 17 THR H H 17 8.160 8.160 8.411 -0.251 19718
5901 1 13 . 1 1 18 18 TYR N N 18 125.600 125.600 126.961 -1.361 19718
5902 1 13 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.787 0.053 19718
5903 1 13 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.981 -1.981 19718
5904 1 13 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.860 -2.760 19718
5905 1 13 . 1 1 18 18 TYR H H 18 9.020 9.020 9.301 -0.281 19718
5906 1 13 . 1 1 19 19 GLU C C 19 174.200 174.200 175.853 -1.653 19718
5907 1 13 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.531 -3.631 19718
5908 1 13 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.668 -3.368 19718
5909 1 13 . 1 1 20 20 VAL N N 20 119.000 119.000 118.298 0.702 19718
5910 1 13 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.736 0.104 19718
5911 1 13 . 1 1 20 20 VAL C C 20 171.200 171.200 174.034 -2.834 19718
5912 1 13 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.931 -3.331 19718
5913 1 13 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.557 -1.857 19718
5914 1 13 . 1 1 20 20 VAL H H 20 9.160 9.160 8.693 0.467 19718
5915 1 13 . 1 1 21 21 CYS N N 21 117.500 117.500 117.686 -0.186 19718
5916 1 13 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.866 -0.106 19718
5917 1 13 . 1 1 21 21 CYS C C 21 171.400 171.400 174.289 -2.889 19718
5918 1 13 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.123 -2.223 19718
5919 1 13 . 1 1 21 21 CYS CB C 21 27.200 27.200 31.328 -4.128 19718
5920 1 13 . 1 1 21 21 CYS H H 21 8.720 8.720 8.373 0.347 19718
5921 1 13 . 1 1 22 22 GLU N N 22 120.900 120.900 120.731 0.169 19718
5922 1 13 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.991 -0.581 19718
5923 1 13 . 1 1 22 22 GLU C C 22 174.300 174.300 177.430 -3.130 19718
5924 1 13 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.047 -2.947 19718
5925 1 13 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.887 -3.087 19718
5926 1 13 . 1 1 22 22 GLU H H 22 8.540 8.540 8.689 -0.149 19718
5927 1 13 . 1 1 23 23 GLY N N 23 112.400 112.400 115.180 -2.780 19718
5928 1 13 . 1 1 23 23 GLY C C 23 171.000 171.000 174.505 -3.505 19718
5929 1 13 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.071 -2.671 19718
5930 1 13 . 1 1 23 23 GLY H H 23 8.720 8.720 9.010 -0.290 19718
5931 1 13 . 1 1 24 24 GLU N N 24 119.600 119.600 121.400 -1.800 19718
5932 1 13 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.358 -0.028 19718
5933 1 13 . 1 1 24 24 GLU C C 24 174.400 174.400 176.177 -1.777 19718
5934 1 13 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.240 -2.140 19718
5935 1 13 . 1 1 24 24 GLU CB C 24 28.100 28.100 29.907 -1.807 19718
5936 1 13 . 1 1 24 24 GLU H H 24 7.060 7.060 7.694 -0.634 19718
5937 1 13 . 1 1 25 25 THR N N 25 113.600 113.600 118.688 -5.088 19718
5938 1 13 . 1 1 25 25 THR HA H 25 5.510 5.510 4.760 0.750 19718
5939 1 13 . 1 1 25 25 THR C C 25 173.100 173.100 175.714 -2.614 19718
5940 1 13 . 1 1 25 25 THR CA C 25 57.000 57.000 61.394 -4.394 19718
5941 1 13 . 1 1 25 25 THR CB C 25 68.700 68.700 70.896 -2.196 19718
5942 1 13 . 1 1 25 25 THR H H 25 9.080 9.080 8.548 0.532 19718
5943 1 13 . 1 1 26 26 ILE N N 26 120.300 120.300 124.183 -3.883 19718
5944 1 13 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.938 -0.308 19718
5945 1 13 . 1 1 26 26 ILE C C 26 174.700 174.700 177.920 -3.220 19718
5946 1 13 . 1 1 26 26 ILE CA C 26 63.700 63.700 62.999 0.701 19718
5947 1 13 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.573 -3.573 19718
5948 1 13 . 1 1 26 26 ILE H H 26 7.860 7.860 8.144 -0.284 19718
5949 1 13 . 1 1 27 27 LEU N N 27 117.600 117.600 121.939 -4.339 19718
5950 1 13 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.951 -0.201 19718
5951 1 13 . 1 1 27 27 LEU C C 27 174.000 174.000 178.342 -4.342 19718
5952 1 13 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.920 -4.020 19718
5953 1 13 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.572 -2.272 19718
5954 1 13 . 1 1 27 27 LEU H H 27 6.580 6.580 8.291 -1.711 19718
5955 1 13 . 1 1 28 28 ASP N N 28 120.000 120.000 118.388 1.612 19718
5956 1 13 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.484 -0.234 19718
5957 1 13 . 1 1 28 28 ASP C C 28 177.900 177.900 178.956 -1.056 19718
5958 1 13 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.599 -2.599 19718
5959 1 13 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.596 -3.696 19718
5960 1 13 . 1 1 28 28 ASP H H 28 7.880 7.880 8.472 -0.592 19718
5961 1 13 . 1 1 29 29 ILE N N 29 122.100 122.100 121.189 0.911 19718
5962 1 13 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.952 -0.212 19718
5963 1 13 . 1 1 29 29 ILE C C 29 175.700 175.700 177.756 -2.056 19718
5964 1 13 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.644 -2.544 19718
5965 1 13 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.970 -1.470 19718
5966 1 13 . 1 1 29 29 ILE H H 29 8.340 8.340 8.479 -0.139 19718
5967 1 13 . 1 1 30 30 ALA N N 30 124.100 124.100 123.327 0.773 19718
5968 1 13 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.700 -0.360 19718
5969 1 13 . 1 1 30 30 ALA C C 30 177.600 177.600 179.605 -2.005 19718
5970 1 13 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.536 -2.736 19718
5971 1 13 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.092 -1.292 19718
5972 1 13 . 1 1 30 30 ALA H H 30 8.430 8.430 8.539 -0.109 19718
5973 1 13 . 1 1 31 31 GLN N N 31 116.000 116.000 115.599 0.401 19718
5974 1 13 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.188 -0.028 19718
5975 1 13 . 1 1 31 31 GLN C C 31 178.100 178.100 178.062 0.038 19718
5976 1 13 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.634 -0.934 19718
5977 1 13 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.040 -3.840 19718
5978 1 13 . 1 1 31 31 GLN H H 31 8.760 8.760 8.538 0.222 19718
5979 1 13 . 1 1 32 32 GLY N N 32 108.700 108.700 106.610 2.090 19718
5980 1 13 . 1 1 32 32 GLY C C 32 171.700 171.700 175.210 -3.510 19718
5981 1 13 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.987 -2.787 19718
5982 1 13 . 1 1 32 32 GLY H H 32 8.220 8.220 7.725 0.495 19718
5983 1 13 . 1 1 33 33 HIS N N 33 115.000 115.000 119.058 -4.058 19718
5984 1 13 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.539 -0.109 19718
5985 1 13 . 1 1 33 33 HIS C C 33 169.800 169.800 174.689 -4.889 19718
5986 1 13 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.455 -3.055 19718
5987 1 13 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.680 -5.180 19718
5988 1 13 . 1 1 33 33 HIS H H 33 6.980 6.980 7.993 -1.013 19718
5989 1 13 . 1 1 34 34 ASN N N 34 113.700 113.700 115.004 -1.304 19718
5990 1 13 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.310 0.020 19718
5991 1 13 . 1 1 34 34 ASN C C 34 172.000 172.000 174.828 -2.828 19718
5992 1 13 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.737 -1.637 19718
5993 1 13 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.525 -2.525 19718
5994 1 13 . 1 1 34 34 ASN H H 34 7.700 7.700 8.174 -0.474 19718
5995 1 13 . 1 1 35 35 LEU N N 35 115.600 115.600 118.366 -2.766 19718
5996 1 13 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.183 0.067 19718
5997 1 13 . 1 1 35 35 LEU C C 35 174.900 174.900 177.244 -2.344 19718
5998 1 13 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.403 -4.103 19718
5999 1 13 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.549 -3.349 19718
6000 1 13 . 1 1 35 35 LEU H H 35 7.980 7.980 7.709 0.271 19718
6001 1 13 . 1 1 36 36 ASP N N 36 120.100 120.100 123.563 -3.463 19718
6002 1 13 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.562 -0.132 19718
6003 1 13 . 1 1 36 36 ASP C C 36 171.100 171.100 174.912 -3.812 19718
6004 1 13 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.910 -3.910 19718
6005 1 13 . 1 1 36 36 ASP CB C 36 36.200 36.200 40.251 -4.051 19718
6006 1 13 . 1 1 36 36 ASP H H 36 8.610 8.610 8.663 -0.053 19718
6007 1 13 . 1 1 37 37 MET N N 37 123.900 123.900 119.570 4.330 19718
6008 1 13 . 1 1 37 37 MET HA H 37 4.280 4.280 4.856 -0.576 19718
6009 1 13 . 1 1 37 37 MET C C 37 171.200 171.200 174.100 -2.900 19718
6010 1 13 . 1 1 37 37 MET CA C 37 52.800 52.800 55.151 -2.351 19718
6011 1 13 . 1 1 37 37 MET CB C 37 33.000 33.000 36.053 -3.053 19718
6012 1 13 . 1 1 37 37 MET H H 37 7.670 7.670 7.713 -0.043 19718
6013 1 13 . 1 1 38 38 GLU N N 38 128.600 128.600 120.802 7.798 19718
6014 1 13 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.800 -0.510 19718
6015 1 13 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.302 -2.102 19718
6016 1 13 . 1 1 38 38 GLU CB C 38 29.400 29.400 33.527 -4.127 19718
6017 1 13 . 1 1 38 38 GLU H H 38 9.060 9.060 8.619 0.441 19718
6018 1 13 . 1 1 51 51 HIS C C 51 170.700 170.700 173.871 -3.171 19718
6019 1 13 . 1 1 51 51 HIS CA C 51 52.800 52.800 54.294 -1.494 19718
6020 1 13 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.251 -0.551 19718
6021 1 13 . 1 1 53 53 ILE N N 53 122.200 122.200 121.221 0.979 19718
6022 1 13 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.909 -0.899 19718
6023 1 13 . 1 1 53 53 ILE C C 53 174.400 174.400 173.776 0.624 19718
6024 1 13 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.353 0.347 19718
6025 1 13 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.637 -5.337 19718
6026 1 13 . 1 1 53 53 ILE H H 53 8.800 8.800 8.571 0.229 19718
6027 1 13 . 1 1 54 54 VAL N N 54 130.200 130.200 126.317 3.883 19718
6028 1 13 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.709 -0.839 19718
6029 1 13 . 1 1 54 54 VAL C C 54 172.500 172.500 174.880 -2.380 19718
6030 1 13 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.395 1.505 19718
6031 1 13 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.257 -5.657 19718
6032 1 13 . 1 1 54 54 VAL H H 54 8.380 8.380 8.759 -0.379 19718
6033 1 13 . 1 1 55 55 ASP N N 55 129.100 129.100 127.677 1.423 19718
6034 1 13 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.666 -0.076 19718
6035 1 13 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.385 -2.685 19718
6036 1 13 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.718 -1.218 19718
6037 1 13 . 1 1 55 55 ASP H H 55 8.160 8.160 8.127 0.033 19718
6038 1 13 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.327 -0.157 19718
6039 1 13 . 1 1 56 56 PRO C C 56 174.900 174.900 177.232 -2.332 19718
6040 1 13 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.622 -1.622 19718
6041 1 13 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.694 -2.294 19718
6042 1 13 . 1 1 57 57 ASP N N 57 117.100 117.100 117.018 0.082 19718
6043 1 13 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.347 0.023 19718
6044 1 13 . 1 1 57 57 ASP C C 57 174.100 174.100 177.108 -3.008 19718
6045 1 13 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.572 -2.872 19718
6046 1 13 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.018 -4.218 19718
6047 1 13 . 1 1 57 57 ASP H H 57 9.110 9.110 8.566 0.544 19718
6048 1 13 . 1 1 58 58 TYR N N 58 115.800 115.800 117.245 -1.445 19718
6049 1 13 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.471 -0.111 19718
6050 1 13 . 1 1 58 58 TYR C C 58 173.200 173.200 177.960 -4.760 19718
6051 1 13 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.133 -2.433 19718
6052 1 13 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.218 -0.318 19718
6053 1 13 . 1 1 58 58 TYR H H 58 8.190 8.190 7.762 0.428 19718
6054 1 13 . 1 1 59 59 TYR N N 59 120.100 120.100 121.915 -1.815 19718
6055 1 13 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.155 -0.375 19718
6056 1 13 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.038 0.062 19718
6057 1 13 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.234 -1.834 19718
6058 1 13 . 1 1 59 59 TYR H H 59 7.420 7.420 8.276 -0.856 19718
6059 1 13 . 1 1 60 60 ASP N N 60 115.200 115.200 118.848 -3.648 19718
6060 1 13 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.431 -0.071 19718
6061 1 13 . 1 1 60 60 ASP C C 60 173.100 173.100 176.433 -3.333 19718
6062 1 13 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.929 -2.529 19718
6063 1 13 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.386 -2.886 19718
6064 1 13 . 1 1 60 60 ASP H H 60 8.440 8.440 8.653 -0.213 19718
6065 1 13 . 1 1 61 61 ALA N N 61 120.200 120.200 120.707 -0.507 19718
6066 1 13 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.445 -0.265 19718
6067 1 13 . 1 1 61 61 ALA C C 61 175.000 175.000 177.437 -2.437 19718
6068 1 13 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.024 -2.724 19718
6069 1 13 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.009 -3.809 19718
6070 1 13 . 1 1 61 61 ALA H H 61 7.300 7.300 7.425 -0.125 19718
6071 1 13 . 1 1 62 62 LEU N N 62 118.000 118.000 121.059 -3.059 19718
6072 1 13 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.614 -0.324 19718
6073 1 13 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.227 -2.127 19718
6074 1 13 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.989 -3.289 19718
6075 1 13 . 1 1 62 62 LEU H H 62 6.680 6.680 7.505 -0.825 19718
6076 1 13 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.477 -0.157 19718
6077 1 13 . 1 1 63 63 PRO C C 63 173.500 173.500 175.684 -2.184 19718
6078 1 13 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.043 -2.343 19718
6079 1 13 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.504 -4.004 19718
6080 1 13 . 1 1 64 64 GLU N N 64 124.500 124.500 118.318 6.182 19718
6081 1 13 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.574 -0.394 19718
6082 1 13 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.351 -1.851 19718
6083 1 13 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.672 -4.872 19718
6084 1 13 . 1 1 64 64 GLU H H 64 8.590 8.590 8.385 0.205 19718
6085 1 13 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.590 -0.420 19718
6086 1 13 . 1 1 65 65 PRO C C 65 174.900 174.900 176.429 -1.529 19718
6087 1 13 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.349 0.651 19718
6088 1 13 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.238 -4.738 19718
6089 1 13 . 1 1 66 66 GLU N N 66 123.300 123.300 119.479 3.821 19718
6090 1 13 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.117 0.213 19718
6091 1 13 . 1 1 66 66 GLU C C 66 174.200 174.200 177.234 -3.034 19718
6092 1 13 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.922 -4.422 19718
6093 1 13 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.480 -3.080 19718
6094 1 13 . 1 1 66 66 GLU H H 66 9.080 9.080 8.490 0.590 19718
6095 1 13 . 1 1 67 67 ASP N N 67 120.100 120.100 122.136 -2.036 19718
6096 1 13 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.600 -0.360 19718
6097 1 13 . 1 1 67 67 ASP C C 67 174.900 174.900 176.939 -2.039 19718
6098 1 13 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.277 -0.877 19718
6099 1 13 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.873 -3.072 19718
6100 1 13 . 1 1 67 67 ASP H H 67 8.690 8.690 8.621 0.069 19718
6101 1 13 . 1 1 68 68 ASP N N 68 116.800 116.800 116.509 0.291 19718
6102 1 13 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.519 -0.279 19718
6103 1 13 . 1 1 68 68 ASP C C 68 175.500 175.500 177.463 -1.963 19718
6104 1 13 . 1 1 68 68 ASP CA C 68 54.300 54.300 56.064 -1.764 19718
6105 1 13 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.081 -4.981 19718
6106 1 13 . 1 1 68 68 ASP H H 68 8.400 8.400 8.295 0.105 19718
6107 1 13 . 1 1 69 69 GLU N N 69 123.600 123.600 119.087 4.513 19718
6108 1 13 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.199 -0.049 19718
6109 1 13 . 1 1 69 69 GLU C C 69 175.200 175.200 178.720 -3.520 19718
6110 1 13 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.372 -2.172 19718
6111 1 13 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.248 -4.248 19718
6112 1 13 . 1 1 69 69 GLU H H 69 7.530 7.530 7.827 -0.297 19718
6113 1 13 . 1 1 70 70 ASN N N 70 119.100 119.100 118.329 0.771 19718
6114 1 13 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.473 -0.113 19718
6115 1 13 . 1 1 70 70 ASN C C 70 175.200 175.200 176.648 -1.448 19718
6116 1 13 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.778 -2.078 19718
6117 1 13 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.616 -2.816 19718
6118 1 13 . 1 1 70 70 ASN H H 70 7.960 7.960 8.629 -0.669 19718
6119 1 13 . 1 1 71 71 ASP N N 71 118.400 118.400 120.295 -1.895 19718
6120 1 13 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.506 -0.256 19718
6121 1 13 . 1 1 71 71 ASP C C 71 176.000 176.000 177.584 -1.584 19718
6122 1 13 . 1 1 71 71 ASP CA C 71 54.600 54.600 57.167 -2.567 19718
6123 1 13 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.915 -3.415 19718
6124 1 13 . 1 1 71 71 ASP H H 71 8.250 8.250 8.448 -0.199 19718
6125 1 13 . 1 1 72 72 MET N N 72 117.300 117.300 116.047 1.253 19718
6126 1 13 . 1 1 72 72 MET HA H 72 4.370 4.370 4.213 0.157 19718
6127 1 13 . 1 1 72 72 MET C C 72 177.800 177.800 177.152 0.648 19718
6128 1 13 . 1 1 72 72 MET CA C 72 53.700 53.700 57.944 -4.244 19718
6129 1 13 . 1 1 72 72 MET CB C 72 32.400 32.400 32.773 -0.373 19718
6130 1 13 . 1 1 72 72 MET H H 72 7.240 7.240 7.508 -0.268 19718
6131 1 13 . 1 1 73 73 LEU N N 73 123.000 123.000 117.346 5.654 19718
6132 1 13 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.291 -0.531 19718
6133 1 13 . 1 1 73 73 LEU C C 73 175.700 175.700 178.920 -3.220 19718
6134 1 13 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.501 -1.601 19718
6135 1 13 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.961 -3.861 19718
6136 1 13 . 1 1 73 73 LEU H H 73 8.600 8.600 7.134 1.466 19718
6137 1 13 . 1 1 74 74 ASP N N 74 118.500 118.500 119.580 -1.080 19718
6138 1 13 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.335 0.005 19718
6139 1 13 . 1 1 74 74 ASP C C 74 174.700 174.700 177.799 -3.099 19718
6140 1 13 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.816 -2.516 19718
6141 1 13 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.522 -2.322 19718
6142 1 13 . 1 1 74 74 ASP H H 74 7.250 7.250 7.860 -0.610 19718
6143 1 13 . 1 1 75 75 LEU N N 75 116.300 116.300 117.324 -1.024 19718
6144 1 13 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.175 0.125 19718
6145 1 13 . 1 1 75 75 LEU C C 75 174.500 174.500 177.062 -2.562 19718
6146 1 13 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.544 -4.244 19718
6147 1 13 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.740 -2.140 19718
6148 1 13 . 1 1 75 75 LEU H H 75 7.000 7.000 7.343 -0.343 19718
6149 1 13 . 1 1 76 76 ALA N N 76 124.600 124.600 120.107 4.493 19718
6150 1 13 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.267 -0.167 19718
6151 1 13 . 1 1 76 76 ALA C C 76 174.200 174.200 175.713 -1.513 19718
6152 1 13 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.737 -1.237 19718
6153 1 13 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.308 -5.108 19718
6154 1 13 . 1 1 76 76 ALA H H 76 7.590 7.590 7.544 0.046 19718
6155 1 13 . 1 1 77 77 TYR N N 77 122.900 122.900 125.244 -2.344 19718
6156 1 13 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.312 0.118 19718
6157 1 13 . 1 1 77 77 TYR C C 77 174.100 174.100 177.205 -3.105 19718
6158 1 13 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.794 -4.894 19718
6159 1 13 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.595 -3.695 19718
6160 1 13 . 1 1 77 77 TYR H H 77 8.150 8.150 8.008 0.142 19718
6161 1 13 . 1 1 78 78 GLY N N 78 112.900 112.900 112.859 0.041 19718
6162 1 13 . 1 1 78 78 GLY C C 78 171.800 171.800 173.593 -1.793 19718
6163 1 13 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.902 -1.202 19718
6164 1 13 . 1 1 78 78 GLY H H 78 8.320 8.320 7.709 0.611 19718
6165 1 13 . 1 1 79 79 LEU N N 79 119.300 119.300 119.206 0.094 19718
6166 1 13 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.355 -0.565 19718
6167 1 13 . 1 1 79 79 LEU C C 79 174.000 174.000 176.497 -2.497 19718
6168 1 13 . 1 1 79 79 LEU CA C 79 54.000 54.000 54.798 -0.798 19718
6169 1 13 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.796 -2.896 19718
6170 1 13 . 1 1 79 79 LEU H H 79 7.120 7.120 7.783 -0.663 19718
6171 1 13 . 1 1 80 80 THR N N 80 118.500 118.500 118.801 -0.301 19718
6172 1 13 . 1 1 80 80 THR HA H 80 4.860 4.860 4.499 0.361 19718
6173 1 13 . 1 1 80 80 THR C C 80 173.300 173.300 175.291 -1.991 19718
6174 1 13 . 1 1 80 80 THR CA C 80 57.600 57.600 60.574 -2.974 19718
6175 1 13 . 1 1 80 80 THR CB C 80 71.000 71.000 69.975 1.024 19718
6176 1 13 . 1 1 80 80 THR H H 80 9.240 9.240 7.953 1.287 19718
6177 1 13 . 1 1 81 81 GLU N N 81 118.000 118.000 120.541 -2.541 19718
6178 1 13 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.087 0.023 19718
6179 1 13 . 1 1 81 81 GLU C C 81 173.900 173.900 176.970 -3.070 19718
6180 1 13 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.595 -3.195 19718
6181 1 13 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.444 -2.744 19718
6182 1 13 . 1 1 81 81 GLU H H 81 9.020 9.020 8.839 0.181 19718
6183 1 13 . 1 1 82 82 THR N N 82 106.400 106.400 105.752 0.648 19718
6184 1 13 . 1 1 82 82 THR HA H 82 3.950 3.950 3.050 0.900 19718
6185 1 13 . 1 1 82 82 THR C C 82 171.700 171.700 173.836 -2.136 19718
6186 1 13 . 1 1 82 82 THR CA C 82 56.800 56.800 59.410 -2.610 19718
6187 1 13 . 1 1 82 82 THR CB C 82 63.800 63.800 68.437 -4.637 19718
6188 1 13 . 1 1 82 82 THR H H 82 7.630 7.630 7.359 0.271 19718
6189 1 13 . 1 1 83 83 SER N N 83 121.500 121.500 119.494 2.006 19718
6190 1 13 . 1 1 83 83 SER HA H 83 5.080 5.080 4.374 0.706 19718
6191 1 13 . 1 1 83 83 SER C C 83 170.900 170.900 174.224 -3.324 19718
6192 1 13 . 1 1 83 83 SER CA C 83 59.000 59.000 59.873 -0.873 19718
6193 1 13 . 1 1 83 83 SER CB C 83 61.700 61.700 63.688 -1.988 19718
6194 1 13 . 1 1 83 83 SER H H 83 6.930 6.930 7.668 -0.738 19718
6195 1 13 . 1 1 84 84 ARG N N 84 119.300 119.300 128.103 -8.803 19718
6196 1 13 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.806 0.064 19718
6197 1 13 . 1 1 84 84 ARG C C 84 172.400 172.400 174.632 -2.232 19718
6198 1 13 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.971 -4.671 19718
6199 1 13 . 1 1 84 84 ARG CB C 84 32.400 32.400 33.749 -1.349 19718
6200 1 13 . 1 1 84 84 ARG H H 84 9.280 9.280 8.624 0.656 19718
6201 1 13 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.573 -0.143 19718
6202 1 13 . 1 1 88 88 GLN C C 88 172.500 172.500 174.347 -1.847 19718
6203 1 13 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.070 -4.070 19718
6204 1 13 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.435 -2.435 19718
6205 1 13 . 1 1 90 90 LYS N N 90 123.700 123.700 125.578 -1.878 19718
6206 1 13 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.109 -0.659 19718
6207 1 13 . 1 1 90 90 LYS C C 90 173.500 173.500 175.600 -2.100 19718
6208 1 13 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.746 -2.246 19718
6209 1 13 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.650 -2.750 19718
6210 1 13 . 1 1 90 90 LYS H H 90 8.330 8.330 8.086 0.244 19718
6211 1 13 . 1 1 91 91 MET N N 91 118.200 118.200 119.737 -1.537 19718
6212 1 13 . 1 1 91 91 MET HA H 91 4.330 4.330 4.645 -0.315 19718
6213 1 13 . 1 1 91 91 MET C C 91 174.300 174.300 176.051 -1.751 19718
6214 1 13 . 1 1 91 91 MET CA C 91 51.800 51.800 55.003 -3.203 19718
6215 1 13 . 1 1 91 91 MET CB C 91 27.200 27.200 31.600 -4.400 19718
6216 1 13 . 1 1 91 91 MET H H 91 8.620 8.620 8.448 0.172 19718
6217 1 13 . 1 1 92 92 SER N N 92 117.000 117.000 117.723 -0.723 19718
6218 1 13 . 1 1 92 92 SER HA H 92 4.610 4.610 4.795 -0.185 19718
6219 1 13 . 1 1 92 92 SER C C 92 171.300 171.300 175.414 -4.114 19718
6220 1 13 . 1 1 92 92 SER CA C 92 54.000 54.000 56.637 -2.637 19718
6221 1 13 . 1 1 92 92 SER CB C 92 63.700 63.700 66.254 -2.554 19718
6222 1 13 . 1 1 92 92 SER H H 92 6.970 6.970 8.320 -1.350 19718
6223 1 13 . 1 1 93 93 LYS N N 93 121.700 121.700 120.577 1.123 19718
6224 1 13 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.180 -0.210 19718
6225 1 13 . 1 1 93 93 LYS C C 93 175.200 175.200 178.030 -2.830 19718
6226 1 13 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.208 -1.508 19718
6227 1 13 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.731 -2.631 19718
6228 1 13 . 1 1 93 93 LYS H H 93 9.260 9.260 8.952 0.308 19718
6229 1 13 . 1 1 94 94 ASP N N 94 116.700 116.700 119.787 -3.087 19718
6230 1 13 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.491 -0.131 19718
6231 1 13 . 1 1 94 94 ASP C C 94 174.300 174.300 177.509 -3.209 19718
6232 1 13 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.709 -3.009 19718
6233 1 13 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.016 -3.116 19718
6234 1 13 . 1 1 94 94 ASP H H 94 8.020 8.020 7.724 0.296 19718
6235 1 13 . 1 1 95 95 ILE N N 95 109.000 109.000 112.012 -3.012 19718
6236 1 13 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.453 0.207 19718
6237 1 13 . 1 1 95 95 ILE C C 95 170.600 170.600 174.896 -4.296 19718
6238 1 13 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.447 -3.147 19718
6239 1 13 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.853 -3.653 19718
6240 1 13 . 1 1 95 95 ILE H H 95 7.240 7.240 7.517 -0.277 19718
6241 1 13 . 1 1 96 96 ASP N N 96 119.800 119.800 122.570 -2.770 19718
6242 1 13 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.472 -0.292 19718
6243 1 13 . 1 1 96 96 ASP C C 96 174.900 174.900 176.512 -1.612 19718
6244 1 13 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.983 -1.283 19718
6245 1 13 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.623 -0.623 19718
6246 1 13 . 1 1 96 96 ASP H H 96 6.950 6.950 7.715 -0.765 19718
6247 1 13 . 1 1 97 97 GLY N N 97 118.500 118.500 111.883 6.617 19718
6248 1 13 . 1 1 97 97 GLY C C 97 170.500 170.500 174.033 -3.533 19718
6249 1 13 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.334 -2.034 19718
6250 1 13 . 1 1 97 97 GLY H H 97 9.210 9.210 8.355 0.855 19718
6251 1 13 . 1 1 98 98 ILE N N 98 121.300 121.300 121.568 -0.268 19718
6252 1 13 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.526 2.074 19718
6253 1 13 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.817 -3.217 19718
6254 1 13 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.548 -3.848 19718
6255 1 13 . 1 1 98 98 ILE H H 98 7.660 7.660 8.128 -0.468 19718
6256 1 13 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.128 0.222 19718
6257 1 13 . 1 1 99 99 ARG C C 99 172.200 172.200 175.048 -2.848 19718
6258 1 13 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.211 -4.111 19718
6259 1 13 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.531 -3.031 19718
6260 1 13 . 1 1 100 100 VAL N N 100 114.900 114.900 116.260 -1.360 19718
6261 1 13 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.166 -0.346 19718
6262 1 13 . 1 1 100 100 VAL C C 100 169.600 169.600 173.382 -3.782 19718
6263 1 13 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.398 -4.198 19718
6264 1 13 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.351 -4.051 19718
6265 1 13 . 1 1 100 100 VAL H H 100 8.440 8.440 8.812 -0.372 19718
6266 1 13 . 1 1 101 101 ALA N N 101 123.400 123.400 122.528 0.872 19718
6267 1 13 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.833 0.477 19718
6268 1 13 . 1 1 101 101 ALA C C 101 174.400 174.400 175.179 -0.779 19718
6269 1 13 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.214 -3.414 19718
6270 1 13 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.358 -3.558 19718
6271 1 13 . 1 1 101 101 ALA H H 101 9.040 9.040 8.953 0.087 19718
6272 1 13 . 1 1 102 102 LEU N N 102 120.600 120.600 123.288 -2.688 19718
6273 1 13 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.146 -0.576 19718
6274 1 13 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.981 0.219 19718
6275 1 13 . 1 1 102 102 LEU CB C 102 37.900 37.900 43.777 -5.877 19718
6276 1 13 . 1 1 102 102 LEU H H 102 8.260 8.260 7.994 0.266 19718
6277 1 13 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.679 -0.099 19718
6278 1 13 . 1 1 112 112 ASN C C 112 171.900 171.900 174.996 -3.096 19718
6279 1 13 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.857 -2.457 19718
6280 1 13 . 1 1 112 112 ASN CB C 112 36.700 36.700 39.600 -2.900 19718
6281 1 13 . 1 1 113 113 ASP N N 113 120.300 120.300 121.838 -1.538 19718
6282 1 13 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.594 -0.154 19718
6283 1 13 . 1 1 113 113 ASP C C 113 173.000 173.000 176.509 -3.509 19718
6284 1 13 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.388 -2.788 19718
6285 1 13 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.337 -2.237 19718
6286 1 13 . 1 1 113 113 ASP H H 113 8.040 8.040 8.495 -0.455 19718
6287 1 13 . 1 1 114 114 PHE N N 114 120.100 120.100 125.465 -5.365 19718
6288 1 13 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.008 0.602 19718
6289 1 13 . 1 1 114 114 PHE C C 114 172.200 172.200 174.353 -2.153 19718
6290 1 13 . 1 1 114 114 PHE CA C 114 54.900 54.900 60.470 -5.570 19718
6291 1 13 . 1 1 114 114 PHE CB C 114 36.500 36.500 38.577 -2.077 19718
6292 1 13 . 1 1 114 114 PHE H H 114 8.110 8.110 8.207 -0.097 19718
6293 1 14 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.546 -0.306 19718
6294 1 14 . 1 1 2 2 GLU C C 2 173.400 173.400 175.287 -1.887 19718
6295 1 14 . 1 1 2 2 GLU CA C 2 53.400 53.400 55.511 -2.111 19718
6296 1 14 . 1 1 2 2 GLU CB C 2 27.000 27.000 29.696 -2.696 19718
6297 1 14 . 1 1 3 3 GLU N N 3 121.200 121.200 123.994 -2.794 19718
6298 1 14 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.555 -0.175 19718
6299 1 14 . 1 1 3 3 GLU C C 3 173.000 173.000 175.757 -2.757 19718
6300 1 14 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.188 -1.788 19718
6301 1 14 . 1 1 3 3 GLU CB C 3 27.400 27.400 29.946 -2.546 19718
6302 1 14 . 1 1 3 3 GLU H H 3 8.510 8.510 8.666 -0.156 19718
6303 1 14 . 1 1 4 4 LEU N N 4 122.400 122.400 125.301 -2.901 19718
6304 1 14 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.976 -0.426 19718
6305 1 14 . 1 1 4 4 LEU C C 4 172.900 172.900 175.686 -2.786 19718
6306 1 14 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.251 -2.851 19718
6307 1 14 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.625 -3.925 19718
6308 1 14 . 1 1 4 4 LEU H H 4 8.460 8.460 8.381 0.079 19718
6309 1 14 . 1 1 5 5 LYS N N 5 119.300 119.300 118.588 0.712 19718
6310 1 14 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.261 0.159 19718
6311 1 14 . 1 1 5 5 LYS C C 5 172.400 172.400 174.382 -1.982 19718
6312 1 14 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.745 -2.445 19718
6313 1 14 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.794 -3.794 19718
6314 1 14 . 1 1 5 5 LYS H H 5 8.570 8.570 8.263 0.307 19718
6315 1 14 . 1 1 6 6 ILE N N 6 116.900 116.900 121.201 -4.301 19718
6316 1 14 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.707 -0.597 19718
6317 1 14 . 1 1 6 6 ILE C C 6 169.800 169.800 173.318 -3.518 19718
6318 1 14 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.193 -3.693 19718
6319 1 14 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.494 -3.494 19718
6320 1 14 . 1 1 6 6 ILE H H 6 8.160 8.160 8.661 -0.501 19718
6321 1 14 . 1 1 7 7 THR N N 7 123.000 123.000 125.116 -2.116 19718
6322 1 14 . 1 1 7 7 THR HA H 7 5.220 5.220 5.126 0.094 19718
6323 1 14 . 1 1 7 7 THR C C 7 169.900 169.900 173.577 -3.677 19718
6324 1 14 . 1 1 7 7 THR CA C 7 58.400 58.400 61.006 -2.606 19718
6325 1 14 . 1 1 7 7 THR CB C 7 68.700 68.700 69.618 -0.918 19718
6326 1 14 . 1 1 7 7 THR H H 7 8.520 8.520 8.657 -0.137 19718
6327 1 14 . 1 1 8 8 PHE N N 8 124.000 124.000 124.144 -0.144 19718
6328 1 14 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.547 -0.397 19718
6329 1 14 . 1 1 8 8 PHE C C 8 172.300 172.300 174.783 -2.483 19718
6330 1 14 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.325 -1.725 19718
6331 1 14 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.984 -1.884 19718
6332 1 14 . 1 1 8 8 PHE H H 8 9.290 9.290 9.210 0.080 19718
6333 1 14 . 1 1 9 9 ILE N N 9 122.700 122.700 122.425 0.275 19718
6334 1 14 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.969 -0.389 19718
6335 1 14 . 1 1 9 9 ILE C C 9 173.600 173.600 175.963 -2.363 19718
6336 1 14 . 1 1 9 9 ILE CA C 9 58.200 58.200 59.342 -1.142 19718
6337 1 14 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.531 -3.031 19718
6338 1 14 . 1 1 9 9 ILE H H 9 9.170 9.170 8.806 0.364 19718
6339 1 14 . 1 1 10 10 LEU N N 10 126.700 126.700 127.434 -0.734 19718
6340 1 14 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.342 -0.022 19718
6341 1 14 . 1 1 10 10 LEU C C 10 176.500 176.500 177.506 -1.006 19718
6342 1 14 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.267 -3.067 19718
6343 1 14 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.298 -4.798 19718
6344 1 14 . 1 1 10 10 LEU H H 10 9.100 9.100 9.026 0.074 19718
6345 1 14 . 1 1 11 11 LYS N N 11 118.900 118.900 118.512 0.388 19718
6346 1 14 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.211 -0.251 19718
6347 1 14 . 1 1 11 11 LYS C C 11 174.100 174.100 177.525 -3.425 19718
6348 1 14 . 1 1 11 11 LYS CA C 11 57.400 57.400 57.989 -0.589 19718
6349 1 14 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.398 -3.498 19718
6350 1 14 . 1 1 11 11 LYS H H 11 8.520 8.520 8.725 -0.205 19718
6351 1 14 . 1 1 12 12 ASP N N 12 114.400 114.400 117.834 -3.434 19718
6352 1 14 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.728 -0.208 19718
6353 1 14 . 1 1 12 12 ASP C C 12 174.500 174.500 176.631 -2.131 19718
6354 1 14 . 1 1 12 12 ASP CA C 12 50.400 50.400 54.175 -3.775 19718
6355 1 14 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.909 -3.709 19718
6356 1 14 . 1 1 12 12 ASP H H 12 7.690 7.690 8.121 -0.431 19718
6357 1 14 . 1 1 13 13 GLY N N 13 109.200 109.200 108.369 0.831 19718
6358 1 14 . 1 1 13 13 GLY C C 13 171.600 171.600 174.439 -2.839 19718
6359 1 14 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.040 -2.640 19718
6360 1 14 . 1 1 13 13 GLY H H 13 8.100 8.100 7.565 0.535 19718
6361 1 14 . 1 1 14 14 SER N N 14 118.000 118.000 115.885 2.115 19718
6362 1 14 . 1 1 14 14 SER HA H 14 4.280 4.280 4.341 -0.061 19718
6363 1 14 . 1 1 14 14 SER C C 14 169.000 169.000 173.588 -4.588 19718
6364 1 14 . 1 1 14 14 SER CA C 14 56.500 56.500 58.876 -2.376 19718
6365 1 14 . 1 1 14 14 SER CB C 14 61.000 61.000 63.706 -2.706 19718
6366 1 14 . 1 1 14 14 SER H H 14 8.110 8.110 7.941 0.169 19718
6367 1 14 . 1 1 15 15 GLN N N 15 116.300 116.300 120.352 -4.052 19718
6368 1 14 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.189 0.471 19718
6369 1 14 . 1 1 15 15 GLN C C 15 173.500 173.500 175.876 -2.376 19718
6370 1 14 . 1 1 15 15 GLN CA C 15 51.700 51.700 55.086 -3.386 19718
6371 1 14 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.468 -2.468 19718
6372 1 14 . 1 1 15 15 GLN H H 15 8.330 8.330 8.527 -0.197 19718
6373 1 14 . 1 1 16 16 LYS N N 16 122.500 122.500 125.099 -2.599 19718
6374 1 14 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.607 -0.277 19718
6375 1 14 . 1 1 16 16 LYS C C 16 171.300 171.300 174.440 -3.140 19718
6376 1 14 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.138 -3.238 19718
6377 1 14 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.183 -1.183 19718
6378 1 14 . 1 1 16 16 LYS H H 16 8.780 8.780 8.762 0.018 19718
6379 1 14 . 1 1 17 17 THR N N 17 120.000 120.000 119.688 0.312 19718
6380 1 14 . 1 1 17 17 THR HA H 17 5.220 5.220 4.976 0.244 19718
6381 1 14 . 1 1 17 17 THR C C 17 170.500 170.500 173.520 -3.020 19718
6382 1 14 . 1 1 17 17 THR CA C 17 58.700 58.700 60.704 -2.004 19718
6383 1 14 . 1 1 17 17 THR CB C 17 67.900 67.900 69.799 -1.899 19718
6384 1 14 . 1 1 17 17 THR H H 17 8.160 8.160 8.522 -0.362 19718
6385 1 14 . 1 1 18 18 TYR N N 18 125.600 125.600 127.558 -1.958 19718
6386 1 14 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.735 0.105 19718
6387 1 14 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.980 -1.980 19718
6388 1 14 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.567 -2.467 19718
6389 1 14 . 1 1 18 18 TYR H H 18 9.020 9.020 9.113 -0.093 19718
6390 1 14 . 1 1 19 19 GLU C C 19 174.200 174.200 175.919 -1.719 19718
6391 1 14 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.964 -4.064 19718
6392 1 14 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.146 -2.846 19718
6393 1 14 . 1 1 20 20 VAL N N 20 119.000 119.000 120.113 -1.113 19718
6394 1 14 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.634 0.206 19718
6395 1 14 . 1 1 20 20 VAL C C 20 171.200 171.200 174.629 -3.429 19718
6396 1 14 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.627 -3.027 19718
6397 1 14 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.463 -2.763 19718
6398 1 14 . 1 1 20 20 VAL H H 20 9.160 9.160 8.519 0.641 19718
6399 1 14 . 1 1 21 21 CYS N N 21 117.500 117.500 119.019 -1.519 19718
6400 1 14 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.878 -0.118 19718
6401 1 14 . 1 1 21 21 CYS C C 21 171.400 171.400 175.259 -3.859 19718
6402 1 14 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.427 -2.527 19718
6403 1 14 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.511 -3.311 19718
6404 1 14 . 1 1 21 21 CYS H H 21 8.720 8.720 8.528 0.192 19718
6405 1 14 . 1 1 22 22 GLU N N 22 120.900 120.900 121.717 -0.817 19718
6406 1 14 . 1 1 22 22 GLU HA H 22 3.410 3.410 4.030 -0.620 19718
6407 1 14 . 1 1 22 22 GLU C C 22 174.300 174.300 177.153 -2.853 19718
6408 1 14 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.121 -3.021 19718
6409 1 14 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.941 -3.141 19718
6410 1 14 . 1 1 22 22 GLU H H 22 8.540 8.540 8.786 -0.246 19718
6411 1 14 . 1 1 23 23 GLY N N 23 112.400 112.400 115.147 -2.747 19718
6412 1 14 . 1 1 23 23 GLY C C 23 171.000 171.000 174.466 -3.466 19718
6413 1 14 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.974 -2.574 19718
6414 1 14 . 1 1 23 23 GLY H H 23 8.720 8.720 8.970 -0.250 19718
6415 1 14 . 1 1 24 24 GLU N N 24 119.600 119.600 122.082 -2.482 19718
6416 1 14 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.409 -0.079 19718
6417 1 14 . 1 1 24 24 GLU C C 24 174.400 174.400 176.118 -1.718 19718
6418 1 14 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.496 -2.396 19718
6419 1 14 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.206 -2.106 19718
6420 1 14 . 1 1 24 24 GLU H H 24 7.060 7.060 7.760 -0.700 19718
6421 1 14 . 1 1 25 25 THR N N 25 113.600 113.600 117.242 -3.642 19718
6422 1 14 . 1 1 25 25 THR HA H 25 5.510 5.510 4.869 0.641 19718
6423 1 14 . 1 1 25 25 THR C C 25 173.100 173.100 175.693 -2.593 19718
6424 1 14 . 1 1 25 25 THR CA C 25 57.000 57.000 61.205 -4.205 19718
6425 1 14 . 1 1 25 25 THR CB C 25 68.700 68.700 70.425 -1.725 19718
6426 1 14 . 1 1 25 25 THR H H 25 9.080 9.080 8.491 0.589 19718
6427 1 14 . 1 1 26 26 ILE N N 26 120.300 120.300 123.380 -3.080 19718
6428 1 14 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.965 -0.335 19718
6429 1 14 . 1 1 26 26 ILE C C 26 174.700 174.700 177.505 -2.805 19718
6430 1 14 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.198 0.502 19718
6431 1 14 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.667 -3.667 19718
6432 1 14 . 1 1 26 26 ILE H H 26 7.860 7.860 8.279 -0.419 19718
6433 1 14 . 1 1 27 27 LEU N N 27 117.600 117.600 122.077 -4.477 19718
6434 1 14 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.970 -0.220 19718
6435 1 14 . 1 1 27 27 LEU C C 27 174.000 174.000 178.052 -4.052 19718
6436 1 14 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.936 -4.036 19718
6437 1 14 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.222 -1.922 19718
6438 1 14 . 1 1 27 27 LEU H H 27 6.580 6.580 8.373 -1.793 19718
6439 1 14 . 1 1 28 28 ASP N N 28 120.000 120.000 118.727 1.273 19718
6440 1 14 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.460 -0.210 19718
6441 1 14 . 1 1 28 28 ASP C C 28 177.900 177.900 178.549 -0.649 19718
6442 1 14 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.860 -2.860 19718
6443 1 14 . 1 1 28 28 ASP CB C 28 36.900 36.900 41.029 -4.128 19718
6444 1 14 . 1 1 28 28 ASP H H 28 7.880 7.880 8.325 -0.445 19718
6445 1 14 . 1 1 29 29 ILE N N 29 122.100 122.100 119.945 2.155 19718
6446 1 14 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.971 -0.231 19718
6447 1 14 . 1 1 29 29 ILE C C 29 175.700 175.700 177.973 -2.273 19718
6448 1 14 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.835 -2.735 19718
6449 1 14 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.092 -1.592 19718
6450 1 14 . 1 1 29 29 ILE H H 29 8.340 8.340 8.463 -0.123 19718
6451 1 14 . 1 1 30 30 ALA N N 30 124.100 124.100 123.122 0.978 19718
6452 1 14 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.670 -0.330 19718
6453 1 14 . 1 1 30 30 ALA C C 30 177.600 177.600 179.624 -2.024 19718
6454 1 14 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.513 -2.713 19718
6455 1 14 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.126 -1.326 19718
6456 1 14 . 1 1 30 30 ALA H H 30 8.430 8.430 8.113 0.317 19718
6457 1 14 . 1 1 31 31 GLN N N 31 116.000 116.000 115.893 0.107 19718
6458 1 14 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.241 -0.081 19718
6459 1 14 . 1 1 31 31 GLN C C 31 178.100 178.100 178.169 -0.069 19718
6460 1 14 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.381 -0.681 19718
6461 1 14 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.131 -3.931 19718
6462 1 14 . 1 1 31 31 GLN H H 31 8.760 8.760 8.418 0.342 19718
6463 1 14 . 1 1 32 32 GLY N N 32 108.700 108.700 107.568 1.132 19718
6464 1 14 . 1 1 32 32 GLY C C 32 171.700 171.700 175.319 -3.619 19718
6465 1 14 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.906 -2.706 19718
6466 1 14 . 1 1 32 32 GLY H H 32 8.220 8.220 7.882 0.338 19718
6467 1 14 . 1 1 33 33 HIS N N 33 115.000 115.000 119.135 -4.135 19718
6468 1 14 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.562 -0.132 19718
6469 1 14 . 1 1 33 33 HIS C C 33 169.800 169.800 174.230 -4.430 19718
6470 1 14 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.761 -3.361 19718
6471 1 14 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.625 -5.125 19718
6472 1 14 . 1 1 33 33 HIS H H 33 6.980 6.980 8.030 -1.050 19718
6473 1 14 . 1 1 34 34 ASN N N 34 113.700 113.700 115.281 -1.581 19718
6474 1 14 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.377 -0.047 19718
6475 1 14 . 1 1 34 34 ASN C C 34 172.000 172.000 174.840 -2.840 19718
6476 1 14 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.743 -1.643 19718
6477 1 14 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.219 -2.219 19718
6478 1 14 . 1 1 34 34 ASN H H 34 7.700 7.700 7.796 -0.096 19718
6479 1 14 . 1 1 35 35 LEU N N 35 115.600 115.600 119.579 -3.979 19718
6480 1 14 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.209 0.041 19718
6481 1 14 . 1 1 35 35 LEU C C 35 174.900 174.900 177.580 -2.680 19718
6482 1 14 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.344 -4.044 19718
6483 1 14 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.459 -3.259 19718
6484 1 14 . 1 1 35 35 LEU H H 35 7.980 7.980 7.915 0.065 19718
6485 1 14 . 1 1 36 36 ASP N N 36 120.100 120.100 125.160 -5.060 19718
6486 1 14 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.705 -0.275 19718
6487 1 14 . 1 1 36 36 ASP C C 36 171.100 171.100 175.191 -4.091 19718
6488 1 14 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.671 -3.671 19718
6489 1 14 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.737 -3.537 19718
6490 1 14 . 1 1 36 36 ASP H H 36 8.610 8.610 8.575 0.035 19718
6491 1 14 . 1 1 37 37 MET N N 37 123.900 123.900 119.327 4.573 19718
6492 1 14 . 1 1 37 37 MET HA H 37 4.280 4.280 4.731 -0.451 19718
6493 1 14 . 1 1 37 37 MET C C 37 171.200 171.200 174.589 -3.389 19718
6494 1 14 . 1 1 37 37 MET CA C 37 52.800 52.800 54.418 -1.618 19718
6495 1 14 . 1 1 37 37 MET CB C 37 33.000 33.000 36.016 -3.016 19718
6496 1 14 . 1 1 37 37 MET H H 37 7.670 7.670 7.647 0.023 19718
6497 1 14 . 1 1 38 38 GLU N N 38 128.600 128.600 123.067 5.533 19718
6498 1 14 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.256 0.034 19718
6499 1 14 . 1 1 38 38 GLU CA C 38 53.200 53.200 57.523 -4.322 19718
6500 1 14 . 1 1 38 38 GLU CB C 38 29.400 29.400 30.480 -1.080 19718
6501 1 14 . 1 1 38 38 GLU H H 38 9.060 9.060 8.678 0.382 19718
6502 1 14 . 1 1 51 51 HIS C C 51 170.700 170.700 173.779 -3.079 19718
6503 1 14 . 1 1 51 51 HIS CA C 51 52.800 52.800 55.792 -2.992 19718
6504 1 14 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.526 -2.826 19718
6505 1 14 . 1 1 53 53 ILE N N 53 122.200 122.200 121.705 0.495 19718
6506 1 14 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.732 -0.722 19718
6507 1 14 . 1 1 53 53 ILE C C 53 174.400 174.400 173.429 0.971 19718
6508 1 14 . 1 1 53 53 ILE CA C 53 58.700 58.700 59.193 -0.493 19718
6509 1 14 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.765 -5.465 19718
6510 1 14 . 1 1 53 53 ILE H H 53 8.800 8.800 8.050 0.750 19718
6511 1 14 . 1 1 54 54 VAL N N 54 130.200 130.200 126.006 4.194 19718
6512 1 14 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.859 -0.989 19718
6513 1 14 . 1 1 54 54 VAL C C 54 172.500 172.500 175.033 -2.533 19718
6514 1 14 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.813 1.087 19718
6515 1 14 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.757 -5.157 19718
6516 1 14 . 1 1 54 54 VAL H H 54 8.380 8.380 8.870 -0.490 19718
6517 1 14 . 1 1 55 55 ASP N N 55 129.100 129.100 127.852 1.248 19718
6518 1 14 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.655 -0.065 19718
6519 1 14 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.502 -2.802 19718
6520 1 14 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.886 -1.386 19718
6521 1 14 . 1 1 55 55 ASP H H 55 8.160 8.160 8.135 0.025 19718
6522 1 14 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.329 -0.159 19718
6523 1 14 . 1 1 56 56 PRO C C 56 174.900 174.900 177.203 -2.303 19718
6524 1 14 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.558 -1.558 19718
6525 1 14 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.675 -2.275 19718
6526 1 14 . 1 1 57 57 ASP N N 57 117.100 117.100 117.656 -0.556 19718
6527 1 14 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.428 -0.058 19718
6528 1 14 . 1 1 57 57 ASP C C 57 174.100 174.100 176.927 -2.827 19718
6529 1 14 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.574 -2.874 19718
6530 1 14 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.084 -4.284 19718
6531 1 14 . 1 1 57 57 ASP H H 57 9.110 9.110 8.696 0.414 19718
6532 1 14 . 1 1 58 58 TYR N N 58 115.800 115.800 117.370 -1.570 19718
6533 1 14 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.364 -0.004 19718
6534 1 14 . 1 1 58 58 TYR C C 58 173.200 173.200 177.737 -4.537 19718
6535 1 14 . 1 1 58 58 TYR CA C 58 56.700 56.700 60.598 -3.898 19718
6536 1 14 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.296 -0.396 19718
6537 1 14 . 1 1 58 58 TYR H H 58 8.190 8.190 7.731 0.459 19718
6538 1 14 . 1 1 59 59 TYR N N 59 120.100 120.100 120.642 -0.542 19718
6539 1 14 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.053 -0.273 19718
6540 1 14 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.822 -0.722 19718
6541 1 14 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.155 -1.755 19718
6542 1 14 . 1 1 59 59 TYR H H 59 7.420 7.420 8.245 -0.825 19718
6543 1 14 . 1 1 60 60 ASP N N 60 115.200 115.200 118.736 -3.536 19718
6544 1 14 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.455 -0.095 19718
6545 1 14 . 1 1 60 60 ASP C C 60 173.100 173.100 176.480 -3.380 19718
6546 1 14 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.831 -2.431 19718
6547 1 14 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.520 -3.020 19718
6548 1 14 . 1 1 60 60 ASP H H 60 8.440 8.440 8.639 -0.199 19718
6549 1 14 . 1 1 61 61 ALA N N 61 120.200 120.200 120.580 -0.380 19718
6550 1 14 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.428 -0.248 19718
6551 1 14 . 1 1 61 61 ALA C C 61 175.000 175.000 177.100 -2.100 19718
6552 1 14 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.012 -2.712 19718
6553 1 14 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.083 -3.883 19718
6554 1 14 . 1 1 61 61 ALA H H 61 7.300 7.300 7.436 -0.136 19718
6555 1 14 . 1 1 62 62 LEU N N 62 118.000 118.000 122.337 -4.337 19718
6556 1 14 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.660 -0.370 19718
6557 1 14 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.217 -2.117 19718
6558 1 14 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.319 -3.619 19718
6559 1 14 . 1 1 62 62 LEU H H 62 6.680 6.680 7.478 -0.798 19718
6560 1 14 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.507 -0.187 19718
6561 1 14 . 1 1 63 63 PRO C C 63 173.500 173.500 176.167 -2.667 19718
6562 1 14 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.314 -2.614 19718
6563 1 14 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.198 -3.698 19718
6564 1 14 . 1 1 64 64 GLU N N 64 124.500 124.500 123.344 1.156 19718
6565 1 14 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.353 -0.173 19718
6566 1 14 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.991 -2.491 19718
6567 1 14 . 1 1 64 64 GLU CB C 64 25.800 25.800 29.702 -3.902 19718
6568 1 14 . 1 1 64 64 GLU H H 64 8.590 8.590 8.452 0.138 19718
6569 1 14 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.481 -0.311 19718
6570 1 14 . 1 1 65 65 PRO C C 65 174.900 174.900 176.246 -1.346 19718
6571 1 14 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.396 0.604 19718
6572 1 14 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.178 -4.678 19718
6573 1 14 . 1 1 66 66 GLU N N 66 123.300 123.300 119.306 3.994 19718
6574 1 14 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.117 0.213 19718
6575 1 14 . 1 1 66 66 GLU C C 66 174.200 174.200 177.725 -3.525 19718
6576 1 14 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.608 -4.107 19718
6577 1 14 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.512 -3.112 19718
6578 1 14 . 1 1 66 66 GLU H H 66 9.080 9.080 8.985 0.095 19718
6579 1 14 . 1 1 67 67 ASP N N 67 120.100 120.100 121.064 -0.964 19718
6580 1 14 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.381 -0.141 19718
6581 1 14 . 1 1 67 67 ASP C C 67 174.900 174.900 177.063 -2.163 19718
6582 1 14 . 1 1 67 67 ASP CA C 67 55.400 55.400 57.159 -1.759 19718
6583 1 14 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.937 -3.137 19718
6584 1 14 . 1 1 67 67 ASP H H 67 8.690 8.690 8.872 -0.182 19718
6585 1 14 . 1 1 68 68 ASP N N 68 116.800 116.800 116.597 0.203 19718
6586 1 14 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.586 -0.346 19718
6587 1 14 . 1 1 68 68 ASP C C 68 175.500 175.500 177.494 -1.994 19718
6588 1 14 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.754 -1.454 19718
6589 1 14 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.003 -4.903 19718
6590 1 14 . 1 1 68 68 ASP H H 68 8.400 8.400 8.423 -0.023 19718
6591 1 14 . 1 1 69 69 GLU N N 69 123.600 123.600 119.441 4.159 19718
6592 1 14 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.192 -0.042 19718
6593 1 14 . 1 1 69 69 GLU C C 69 175.200 175.200 178.691 -3.491 19718
6594 1 14 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.422 -2.222 19718
6595 1 14 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.259 -4.259 19718
6596 1 14 . 1 1 69 69 GLU H H 69 7.530 7.530 7.803 -0.273 19718
6597 1 14 . 1 1 70 70 ASN N N 70 119.100 119.100 118.772 0.328 19718
6598 1 14 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.404 -0.044 19718
6599 1 14 . 1 1 70 70 ASN C C 70 175.200 175.200 176.482 -1.282 19718
6600 1 14 . 1 1 70 70 ASN CA C 70 53.700 53.700 56.011 -2.311 19718
6601 1 14 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.687 -2.887 19718
6602 1 14 . 1 1 70 70 ASN H H 70 7.960 7.960 8.642 -0.682 19718
6603 1 14 . 1 1 71 71 ASP N N 71 118.400 118.400 119.337 -0.937 19718
6604 1 14 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.451 -0.201 19718
6605 1 14 . 1 1 71 71 ASP C C 71 176.000 176.000 177.872 -1.872 19718
6606 1 14 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.958 -2.358 19718
6607 1 14 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.828 -3.328 19718
6608 1 14 . 1 1 71 71 ASP H H 71 8.250 8.250 8.297 -0.047 19718
6609 1 14 . 1 1 72 72 MET N N 72 117.300 117.300 117.382 -0.082 19718
6610 1 14 . 1 1 72 72 MET HA H 72 4.370 4.370 4.110 0.260 19718
6611 1 14 . 1 1 72 72 MET C C 72 177.800 177.800 177.856 -0.056 19718
6612 1 14 . 1 1 72 72 MET CA C 72 53.700 53.700 59.065 -5.365 19718
6613 1 14 . 1 1 72 72 MET CB C 72 32.400 32.400 32.774 -0.374 19718
6614 1 14 . 1 1 72 72 MET H H 72 7.240 7.240 7.599 -0.359 19718
6615 1 14 . 1 1 73 73 LEU N N 73 123.000 123.000 119.762 3.238 19718
6616 1 14 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.595 -0.835 19718
6617 1 14 . 1 1 73 73 LEU C C 73 175.700 175.700 179.747 -4.047 19718
6618 1 14 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.839 -1.939 19718
6619 1 14 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.944 -3.844 19718
6620 1 14 . 1 1 73 73 LEU H H 73 8.600 8.600 7.400 1.200 19718
6621 1 14 . 1 1 74 74 ASP N N 74 118.500 118.500 118.889 -0.389 19718
6622 1 14 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.518 -0.178 19718
6623 1 14 . 1 1 74 74 ASP C C 74 174.700 174.700 177.647 -2.947 19718
6624 1 14 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.447 -2.147 19718
6625 1 14 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.450 -2.250 19718
6626 1 14 . 1 1 74 74 ASP H H 74 7.250 7.250 7.777 -0.527 19718
6627 1 14 . 1 1 75 75 LEU N N 75 116.300 116.300 118.247 -1.947 19718
6628 1 14 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.292 0.008 19718
6629 1 14 . 1 1 75 75 LEU C C 75 174.500 174.500 175.937 -1.437 19718
6630 1 14 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.021 -3.721 19718
6631 1 14 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.203 -1.603 19718
6632 1 14 . 1 1 75 75 LEU H H 75 7.000 7.000 7.297 -0.297 19718
6633 1 14 . 1 1 76 76 ALA N N 76 124.600 124.600 120.101 4.499 19718
6634 1 14 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.552 -0.452 19718
6635 1 14 . 1 1 76 76 ALA C C 76 174.200 174.200 175.329 -1.129 19718
6636 1 14 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.678 -1.179 19718
6637 1 14 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.838 -5.638 19718
6638 1 14 . 1 1 76 76 ALA H H 76 7.590 7.590 7.380 0.210 19718
6639 1 14 . 1 1 77 77 TYR N N 77 122.900 122.900 121.641 1.259 19718
6640 1 14 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.339 0.091 19718
6641 1 14 . 1 1 77 77 TYR C C 77 174.100 174.100 176.874 -2.774 19718
6642 1 14 . 1 1 77 77 TYR CA C 77 54.900 54.900 60.029 -5.129 19718
6643 1 14 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.544 -3.644 19718
6644 1 14 . 1 1 77 77 TYR H H 77 8.150 8.150 8.325 -0.175 19718
6645 1 14 . 1 1 78 78 GLY N N 78 112.900 112.900 112.960 -0.060 19718
6646 1 14 . 1 1 78 78 GLY C C 78 171.800 171.800 173.999 -2.199 19718
6647 1 14 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.629 -0.929 19718
6648 1 14 . 1 1 78 78 GLY H H 78 8.320 8.320 7.601 0.719 19718
6649 1 14 . 1 1 79 79 LEU N N 79 119.300 119.300 119.438 -0.138 19718
6650 1 14 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.464 -0.674 19718
6651 1 14 . 1 1 79 79 LEU C C 79 174.000 174.000 176.991 -2.991 19718
6652 1 14 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.547 -1.547 19718
6653 1 14 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.816 -2.916 19718
6654 1 14 . 1 1 79 79 LEU H H 79 7.120 7.120 7.986 -0.866 19718
6655 1 14 . 1 1 80 80 THR N N 80 118.500 118.500 118.734 -0.234 19718
6656 1 14 . 1 1 80 80 THR HA H 80 4.860 4.860 4.463 0.397 19718
6657 1 14 . 1 1 80 80 THR C C 80 173.300 173.300 174.819 -1.519 19718
6658 1 14 . 1 1 80 80 THR CA C 80 57.600 57.600 60.058 -2.458 19718
6659 1 14 . 1 1 80 80 THR CB C 80 71.000 71.000 70.546 0.454 19718
6660 1 14 . 1 1 80 80 THR H H 80 9.240 9.240 7.678 1.562 19718
6661 1 14 . 1 1 81 81 GLU N N 81 118.000 118.000 119.976 -1.976 19718
6662 1 14 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.014 0.096 19718
6663 1 14 . 1 1 81 81 GLU C C 81 173.900 173.900 176.547 -2.647 19718
6664 1 14 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.660 -3.260 19718
6665 1 14 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.520 -2.820 19718
6666 1 14 . 1 1 81 81 GLU H H 81 9.020 9.020 8.737 0.283 19718
6667 1 14 . 1 1 82 82 THR N N 82 106.400 106.400 107.382 -0.982 19718
6668 1 14 . 1 1 82 82 THR HA H 82 3.950 3.950 2.919 1.031 19718
6669 1 14 . 1 1 82 82 THR C C 82 171.700 171.700 173.529 -1.829 19718
6670 1 14 . 1 1 82 82 THR CA C 82 56.800 56.800 59.201 -2.401 19718
6671 1 14 . 1 1 82 82 THR CB C 82 63.800 63.800 67.643 -3.843 19718
6672 1 14 . 1 1 82 82 THR H H 82 7.630 7.630 7.490 0.140 19718
6673 1 14 . 1 1 83 83 SER N N 83 121.500 121.500 119.907 1.593 19718
6674 1 14 . 1 1 83 83 SER HA H 83 5.080 5.080 4.276 0.804 19718
6675 1 14 . 1 1 83 83 SER C C 83 170.900 170.900 174.609 -3.709 19718
6676 1 14 . 1 1 83 83 SER CA C 83 59.000 59.000 59.209 -0.209 19718
6677 1 14 . 1 1 83 83 SER CB C 83 61.700 61.700 63.291 -1.591 19718
6678 1 14 . 1 1 83 83 SER H H 83 6.930 6.930 7.617 -0.687 19718
6679 1 14 . 1 1 84 84 ARG N N 84 119.300 119.300 124.328 -5.028 19718
6680 1 14 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.815 0.055 19718
6681 1 14 . 1 1 84 84 ARG C C 84 172.400 172.400 174.824 -2.424 19718
6682 1 14 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.871 -4.571 19718
6683 1 14 . 1 1 84 84 ARG CB C 84 32.400 32.400 33.996 -1.596 19718
6684 1 14 . 1 1 84 84 ARG H H 84 9.280 9.280 8.677 0.603 19718
6685 1 14 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.241 0.189 19718
6686 1 14 . 1 1 88 88 GLN C C 88 172.500 172.500 175.270 -2.770 19718
6687 1 14 . 1 1 88 88 GLN CA C 88 51.000 51.000 57.077 -6.077 19718
6688 1 14 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.175 -2.175 19718
6689 1 14 . 1 1 90 90 LYS N N 90 123.700 123.700 126.050 -2.350 19718
6690 1 14 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.051 -0.601 19718
6691 1 14 . 1 1 90 90 LYS C C 90 173.500 173.500 175.350 -1.850 19718
6692 1 14 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.578 -2.078 19718
6693 1 14 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.956 -3.056 19718
6694 1 14 . 1 1 90 90 LYS H H 90 8.330 8.330 8.092 0.238 19718
6695 1 14 . 1 1 91 91 MET N N 91 118.200 118.200 120.368 -2.168 19718
6696 1 14 . 1 1 91 91 MET HA H 91 4.330 4.330 4.566 -0.236 19718
6697 1 14 . 1 1 91 91 MET C C 91 174.300 174.300 176.059 -1.759 19718
6698 1 14 . 1 1 91 91 MET CA C 91 51.800 51.800 55.528 -3.728 19718
6699 1 14 . 1 1 91 91 MET CB C 91 27.200 27.200 32.046 -4.846 19718
6700 1 14 . 1 1 91 91 MET H H 91 8.620 8.620 8.534 0.086 19718
6701 1 14 . 1 1 92 92 SER N N 92 117.000 117.000 118.170 -1.170 19718
6702 1 14 . 1 1 92 92 SER HA H 92 4.610 4.610 4.821 -0.211 19718
6703 1 14 . 1 1 92 92 SER C C 92 171.300 171.300 175.187 -3.887 19718
6704 1 14 . 1 1 92 92 SER CA C 92 54.000 54.000 56.966 -2.966 19718
6705 1 14 . 1 1 92 92 SER CB C 92 63.700 63.700 66.480 -2.780 19718
6706 1 14 . 1 1 92 92 SER H H 92 6.970 6.970 8.128 -1.158 19718
6707 1 14 . 1 1 93 93 LYS N N 93 121.700 121.700 121.371 0.329 19718
6708 1 14 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.084 -0.114 19718
6709 1 14 . 1 1 93 93 LYS C C 93 175.200 175.200 178.367 -3.167 19718
6710 1 14 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.205 -2.505 19718
6711 1 14 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.227 -3.127 19718
6712 1 14 . 1 1 93 93 LYS H H 93 9.260 9.260 8.927 0.333 19718
6713 1 14 . 1 1 94 94 ASP N N 94 116.700 116.700 119.402 -2.702 19718
6714 1 14 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.541 -0.181 19718
6715 1 14 . 1 1 94 94 ASP C C 94 174.300 174.300 177.485 -3.185 19718
6716 1 14 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.151 -2.451 19718
6717 1 14 . 1 1 94 94 ASP CB C 94 37.900 37.900 40.969 -3.069 19718
6718 1 14 . 1 1 94 94 ASP H H 94 8.020 8.020 7.736 0.284 19718
6719 1 14 . 1 1 95 95 ILE N N 95 109.000 109.000 112.084 -3.084 19718
6720 1 14 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.547 0.113 19718
6721 1 14 . 1 1 95 95 ILE C C 95 170.600 170.600 174.999 -4.399 19718
6722 1 14 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.489 -3.188 19718
6723 1 14 . 1 1 95 95 ILE CB C 95 35.200 35.200 39.231 -4.031 19718
6724 1 14 . 1 1 95 95 ILE H H 95 7.240 7.240 7.473 -0.233 19718
6725 1 14 . 1 1 96 96 ASP N N 96 119.800 119.800 122.087 -2.287 19718
6726 1 14 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.423 -0.243 19718
6727 1 14 . 1 1 96 96 ASP C C 96 174.900 174.900 176.817 -1.917 19718
6728 1 14 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.609 -1.909 19718
6729 1 14 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.427 -0.427 19718
6730 1 14 . 1 1 96 96 ASP H H 96 6.950 6.950 7.846 -0.896 19718
6731 1 14 . 1 1 97 97 GLY N N 97 118.500 118.500 113.055 5.445 19718
6732 1 14 . 1 1 97 97 GLY C C 97 170.500 170.500 174.064 -3.564 19718
6733 1 14 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.304 -2.005 19718
6734 1 14 . 1 1 97 97 GLY H H 97 9.210 9.210 8.285 0.925 19718
6735 1 14 . 1 1 98 98 ILE N N 98 121.300 121.300 121.723 -0.423 19718
6736 1 14 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.142 2.458 19718
6737 1 14 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.738 -3.138 19718
6738 1 14 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.447 -3.747 19718
6739 1 14 . 1 1 98 98 ILE H H 98 7.660 7.660 8.127 -0.467 19718
6740 1 14 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.203 0.147 19718
6741 1 14 . 1 1 99 99 ARG C C 99 172.200 172.200 175.174 -2.974 19718
6742 1 14 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.484 -4.385 19718
6743 1 14 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.173 -2.673 19718
6744 1 14 . 1 1 100 100 VAL N N 100 114.900 114.900 116.783 -1.883 19718
6745 1 14 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.197 -0.377 19718
6746 1 14 . 1 1 100 100 VAL C C 100 169.600 169.600 173.347 -3.747 19718
6747 1 14 . 1 1 100 100 VAL CA C 100 55.200 55.200 58.900 -3.700 19718
6748 1 14 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.103 -3.803 19718
6749 1 14 . 1 1 100 100 VAL H H 100 8.440 8.440 8.876 -0.436 19718
6750 1 14 . 1 1 101 101 ALA N N 101 123.400 123.400 123.307 0.093 19718
6751 1 14 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.036 0.274 19718
6752 1 14 . 1 1 101 101 ALA C C 101 174.400 174.400 175.907 -1.507 19718
6753 1 14 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.293 -3.493 19718
6754 1 14 . 1 1 101 101 ALA CB C 101 18.800 18.800 20.766 -1.966 19718
6755 1 14 . 1 1 101 101 ALA H H 101 9.040 9.040 8.742 0.298 19718
6756 1 14 . 1 1 102 102 LEU N N 102 120.600 120.600 122.198 -1.598 19718
6757 1 14 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.333 -0.763 19718
6758 1 14 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.221 0.979 19718
6759 1 14 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.101 -6.201 19718
6760 1 14 . 1 1 102 102 LEU H H 102 8.260 8.260 8.324 -0.064 19718
6761 1 14 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.531 0.049 19718
6762 1 14 . 1 1 112 112 ASN C C 112 171.900 171.900 173.031 -1.131 19718
6763 1 14 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.595 -2.195 19718
6764 1 14 . 1 1 112 112 ASN CB C 112 36.700 36.700 41.005 -4.305 19718
6765 1 14 . 1 1 113 113 ASP N N 113 120.300 120.300 119.642 0.658 19718
6766 1 14 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.852 -0.412 19718
6767 1 14 . 1 1 113 113 ASP C C 113 173.000 173.000 175.041 -2.041 19718
6768 1 14 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.492 -1.892 19718
6769 1 14 . 1 1 113 113 ASP CB C 113 38.100 38.100 40.219 -2.119 19718
6770 1 14 . 1 1 113 113 ASP H H 113 8.040 8.040 8.145 -0.105 19718
6771 1 14 . 1 1 114 114 PHE N N 114 120.100 120.100 121.149 -1.049 19718
6772 1 14 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.604 0.006 19718
6773 1 14 . 1 1 114 114 PHE C C 114 172.200 172.200 176.858 -4.658 19718
6774 1 14 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.447 -3.547 19718
6775 1 14 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.414 -2.914 19718
6776 1 14 . 1 1 114 114 PHE H H 114 8.110 8.110 8.357 -0.247 19718
6777 1 15 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.362 -0.122 19718
6778 1 15 . 1 1 2 2 GLU C C 2 173.400 173.400 176.147 -2.747 19718
6779 1 15 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.132 -2.732 19718
6780 1 15 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.278 -3.278 19718
6781 1 15 . 1 1 3 3 GLU N N 3 121.200 121.200 124.470 -3.270 19718
6782 1 15 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.549 -0.169 19718
6783 1 15 . 1 1 3 3 GLU C C 3 173.000 173.000 175.501 -2.501 19718
6784 1 15 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.146 -1.746 19718
6785 1 15 . 1 1 3 3 GLU CB C 3 27.400 27.400 29.898 -2.498 19718
6786 1 15 . 1 1 3 3 GLU H H 3 8.510 8.510 8.741 -0.231 19718
6787 1 15 . 1 1 4 4 LEU N N 4 122.400 122.400 123.604 -1.204 19718
6788 1 15 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.807 -0.257 19718
6789 1 15 . 1 1 4 4 LEU C C 4 172.900 172.900 175.508 -2.608 19718
6790 1 15 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.087 -2.687 19718
6791 1 15 . 1 1 4 4 LEU CB C 4 41.700 41.700 44.937 -3.237 19718
6792 1 15 . 1 1 4 4 LEU H H 4 8.460 8.460 8.144 0.316 19718
6793 1 15 . 1 1 5 5 LYS N N 5 119.300 119.300 118.273 1.027 19718
6794 1 15 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.242 0.178 19718
6795 1 15 . 1 1 5 5 LYS C C 5 172.400 172.400 174.471 -2.071 19718
6796 1 15 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.890 -2.590 19718
6797 1 15 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.807 -3.807 19718
6798 1 15 . 1 1 5 5 LYS H H 5 8.570 8.570 8.175 0.395 19718
6799 1 15 . 1 1 6 6 ILE N N 6 116.900 116.900 120.894 -3.994 19718
6800 1 15 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.534 -0.424 19718
6801 1 15 . 1 1 6 6 ILE C C 6 169.800 169.800 173.212 -3.412 19718
6802 1 15 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.513 -4.013 19718
6803 1 15 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.397 -3.397 19718
6804 1 15 . 1 1 6 6 ILE H H 6 8.160 8.160 8.856 -0.696 19718
6805 1 15 . 1 1 7 7 THR N N 7 123.000 123.000 125.357 -2.357 19718
6806 1 15 . 1 1 7 7 THR HA H 7 5.220 5.220 5.129 0.091 19718
6807 1 15 . 1 1 7 7 THR C C 7 169.900 169.900 173.515 -3.615 19718
6808 1 15 . 1 1 7 7 THR CA C 7 58.400 58.400 61.288 -2.888 19718
6809 1 15 . 1 1 7 7 THR CB C 7 68.700 68.700 69.638 -0.938 19718
6810 1 15 . 1 1 7 7 THR H H 7 8.520 8.520 8.602 -0.082 19718
6811 1 15 . 1 1 8 8 PHE N N 8 124.000 124.000 124.586 -0.586 19718
6812 1 15 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.560 -0.410 19718
6813 1 15 . 1 1 8 8 PHE C C 8 172.300 172.300 175.266 -2.966 19718
6814 1 15 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.166 -1.566 19718
6815 1 15 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.584 -1.484 19718
6816 1 15 . 1 1 8 8 PHE H H 8 9.290 9.290 9.369 -0.079 19718
6817 1 15 . 1 1 9 9 ILE N N 9 122.700 122.700 121.949 0.751 19718
6818 1 15 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.703 -0.123 19718
6819 1 15 . 1 1 9 9 ILE C C 9 173.600 173.600 176.329 -2.729 19718
6820 1 15 . 1 1 9 9 ILE CA C 9 58.200 58.200 61.234 -3.034 19718
6821 1 15 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.188 -3.688 19718
6822 1 15 . 1 1 9 9 ILE H H 9 9.170 9.170 8.696 0.474 19718
6823 1 15 . 1 1 10 10 LEU N N 10 126.700 126.700 125.863 0.837 19718
6824 1 15 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.443 -0.123 19718
6825 1 15 . 1 1 10 10 LEU C C 10 176.500 176.500 178.334 -1.834 19718
6826 1 15 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.506 -2.306 19718
6827 1 15 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.090 -4.590 19718
6828 1 15 . 1 1 10 10 LEU H H 10 9.100 9.100 8.903 0.197 19718
6829 1 15 . 1 1 11 11 LYS N N 11 118.900 118.900 122.282 -3.382 19718
6830 1 15 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.056 -0.096 19718
6831 1 15 . 1 1 11 11 LYS C C 11 174.100 174.100 177.485 -3.385 19718
6832 1 15 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.174 -1.774 19718
6833 1 15 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.429 -3.529 19718
6834 1 15 . 1 1 11 11 LYS H H 11 8.520 8.520 8.950 -0.430 19718
6835 1 15 . 1 1 12 12 ASP N N 12 114.400 114.400 116.571 -2.171 19718
6836 1 15 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.629 -0.109 19718
6837 1 15 . 1 1 12 12 ASP C C 12 174.500 174.500 176.853 -2.353 19718
6838 1 15 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.691 -3.291 19718
6839 1 15 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.640 -3.440 19718
6840 1 15 . 1 1 12 12 ASP H H 12 7.690 7.690 8.016 -0.326 19718
6841 1 15 . 1 1 13 13 GLY N N 13 109.200 109.200 107.811 1.389 19718
6842 1 15 . 1 1 13 13 GLY C C 13 171.600 171.600 174.386 -2.786 19718
6843 1 15 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.574 -3.174 19718
6844 1 15 . 1 1 13 13 GLY H H 13 8.100 8.100 7.841 0.259 19718
6845 1 15 . 1 1 14 14 SER N N 14 118.000 118.000 116.090 1.910 19718
6846 1 15 . 1 1 14 14 SER HA H 14 4.280 4.280 4.430 -0.150 19718
6847 1 15 . 1 1 14 14 SER C C 14 169.000 169.000 173.706 -4.706 19718
6848 1 15 . 1 1 14 14 SER CA C 14 56.500 56.500 58.355 -1.855 19718
6849 1 15 . 1 1 14 14 SER CB C 14 61.000 61.000 64.040 -3.040 19718
6850 1 15 . 1 1 14 14 SER H H 14 8.110 8.110 8.024 0.086 19718
6851 1 15 . 1 1 15 15 GLN N N 15 116.300 116.300 120.761 -4.461 19718
6852 1 15 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.210 0.450 19718
6853 1 15 . 1 1 15 15 GLN C C 15 173.500 173.500 176.047 -2.547 19718
6854 1 15 . 1 1 15 15 GLN CA C 15 51.700 51.700 55.016 -3.316 19718
6855 1 15 . 1 1 15 15 GLN CB C 15 29.000 29.000 30.952 -1.952 19718
6856 1 15 . 1 1 15 15 GLN H H 15 8.330 8.330 8.520 -0.190 19718
6857 1 15 . 1 1 16 16 LYS N N 16 122.500 122.500 124.693 -2.193 19718
6858 1 15 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.529 -0.199 19718
6859 1 15 . 1 1 16 16 LYS C C 16 171.300 171.300 174.439 -3.139 19718
6860 1 15 . 1 1 16 16 LYS CA C 16 51.900 51.900 54.765 -2.865 19718
6861 1 15 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.509 -1.509 19718
6862 1 15 . 1 1 16 16 LYS H H 16 8.780 8.780 8.672 0.108 19718
6863 1 15 . 1 1 17 17 THR N N 17 120.000 120.000 118.996 1.004 19718
6864 1 15 . 1 1 17 17 THR HA H 17 5.220 5.220 4.950 0.270 19718
6865 1 15 . 1 1 17 17 THR C C 17 170.500 170.500 173.414 -2.914 19718
6866 1 15 . 1 1 17 17 THR CA C 17 58.700 58.700 60.767 -2.067 19718
6867 1 15 . 1 1 17 17 THR CB C 17 67.900 67.900 69.629 -1.729 19718
6868 1 15 . 1 1 17 17 THR H H 17 8.160 8.160 8.312 -0.152 19718
6869 1 15 . 1 1 18 18 TYR N N 18 125.600 125.600 127.167 -1.567 19718
6870 1 15 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.714 0.126 19718
6871 1 15 . 1 1 18 18 TYR CA C 18 53.000 53.000 55.269 -2.268 19718
6872 1 15 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.935 -2.836 19718
6873 1 15 . 1 1 18 18 TYR H H 18 9.020 9.020 9.116 -0.096 19718
6874 1 15 . 1 1 19 19 GLU C C 19 174.200 174.200 175.868 -1.668 19718
6875 1 15 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.180 -3.280 19718
6876 1 15 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.209 -2.909 19718
6877 1 15 . 1 1 20 20 VAL N N 20 119.000 119.000 117.408 1.592 19718
6878 1 15 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.834 0.006 19718
6879 1 15 . 1 1 20 20 VAL C C 20 171.200 171.200 174.152 -2.952 19718
6880 1 15 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.102 -2.502 19718
6881 1 15 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.393 -2.693 19718
6882 1 15 . 1 1 20 20 VAL H H 20 9.160 9.160 8.571 0.589 19718
6883 1 15 . 1 1 21 21 CYS N N 21 117.500 117.500 119.558 -2.058 19718
6884 1 15 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.695 0.065 19718
6885 1 15 . 1 1 21 21 CYS C C 21 171.400 171.400 175.015 -3.615 19718
6886 1 15 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.720 -2.820 19718
6887 1 15 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.057 -2.857 19718
6888 1 15 . 1 1 21 21 CYS H H 21 8.720 8.720 9.305 -0.585 19718
6889 1 15 . 1 1 22 22 GLU N N 22 120.900 120.900 121.332 -0.432 19718
6890 1 15 . 1 1 22 22 GLU HA H 22 3.410 3.410 4.082 -0.672 19718
6891 1 15 . 1 1 22 22 GLU C C 22 174.300 174.300 177.225 -2.925 19718
6892 1 15 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.550 -3.450 19718
6893 1 15 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.738 -2.938 19718
6894 1 15 . 1 1 22 22 GLU H H 22 8.540 8.540 8.487 0.053 19718
6895 1 15 . 1 1 23 23 GLY N N 23 112.400 112.400 115.278 -2.878 19718
6896 1 15 . 1 1 23 23 GLY C C 23 171.000 171.000 174.674 -3.674 19718
6897 1 15 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.024 -2.624 19718
6898 1 15 . 1 1 23 23 GLY H H 23 8.720 8.720 8.883 -0.163 19718
6899 1 15 . 1 1 24 24 GLU N N 24 119.600 119.600 122.629 -3.029 19718
6900 1 15 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.356 -0.026 19718
6901 1 15 . 1 1 24 24 GLU C C 24 174.400 174.400 175.810 -1.410 19718
6902 1 15 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.993 -2.893 19718
6903 1 15 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.134 -2.034 19718
6904 1 15 . 1 1 24 24 GLU H H 24 7.060 7.060 7.826 -0.766 19718
6905 1 15 . 1 1 25 25 THR N N 25 113.600 113.600 119.255 -5.655 19718
6906 1 15 . 1 1 25 25 THR HA H 25 5.510 5.510 4.526 0.984 19718
6907 1 15 . 1 1 25 25 THR C C 25 173.100 173.100 175.817 -2.717 19718
6908 1 15 . 1 1 25 25 THR CA C 25 57.000 57.000 61.684 -4.684 19718
6909 1 15 . 1 1 25 25 THR CB C 25 68.700 68.700 70.306 -1.606 19718
6910 1 15 . 1 1 25 25 THR H H 25 9.080 9.080 8.503 0.577 19718
6911 1 15 . 1 1 26 26 ILE N N 26 120.300 120.300 123.636 -3.336 19718
6912 1 15 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.931 -0.301 19718
6913 1 15 . 1 1 26 26 ILE C C 26 174.700 174.700 177.721 -3.021 19718
6914 1 15 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.231 0.469 19718
6915 1 15 . 1 1 26 26 ILE CB C 26 33.000 33.000 36.788 -3.788 19718
6916 1 15 . 1 1 26 26 ILE H H 26 7.860 7.860 8.077 -0.217 19718
6917 1 15 . 1 1 27 27 LEU N N 27 117.600 117.600 120.822 -3.222 19718
6918 1 15 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.912 -0.162 19718
6919 1 15 . 1 1 27 27 LEU C C 27 174.000 174.000 177.993 -3.993 19718
6920 1 15 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.557 -3.657 19718
6921 1 15 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.391 -2.091 19718
6922 1 15 . 1 1 27 27 LEU H H 27 6.580 6.580 8.336 -1.756 19718
6923 1 15 . 1 1 28 28 ASP N N 28 120.000 120.000 119.690 0.310 19718
6924 1 15 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.383 -0.133 19718
6925 1 15 . 1 1 28 28 ASP C C 28 177.900 177.900 178.729 -0.829 19718
6926 1 15 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.699 -2.699 19718
6927 1 15 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.308 -3.408 19718
6928 1 15 . 1 1 28 28 ASP H H 28 7.880 7.880 8.369 -0.489 19718
6929 1 15 . 1 1 29 29 ILE N N 29 122.100 122.100 120.617 1.483 19718
6930 1 15 . 1 1 29 29 ILE HA H 29 3.740 3.740 4.044 -0.304 19718
6931 1 15 . 1 1 29 29 ILE C C 29 175.700 175.700 177.874 -2.174 19718
6932 1 15 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.622 -2.522 19718
6933 1 15 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.123 -1.623 19718
6934 1 15 . 1 1 29 29 ILE H H 29 8.340 8.340 8.475 -0.135 19718
6935 1 15 . 1 1 30 30 ALA N N 30 124.100 124.100 123.213 0.887 19718
6936 1 15 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.735 -0.395 19718
6937 1 15 . 1 1 30 30 ALA C C 30 177.600 177.600 179.659 -2.059 19718
6938 1 15 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.429 -2.629 19718
6939 1 15 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.162 -1.362 19718
6940 1 15 . 1 1 30 30 ALA H H 30 8.430 8.430 8.492 -0.062 19718
6941 1 15 . 1 1 31 31 GLN N N 31 116.000 116.000 116.584 -0.584 19718
6942 1 15 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.218 -0.058 19718
6943 1 15 . 1 1 31 31 GLN C C 31 178.100 178.100 179.430 -1.330 19718
6944 1 15 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.855 -1.155 19718
6945 1 15 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.054 -3.854 19718
6946 1 15 . 1 1 31 31 GLN H H 31 8.760 8.760 8.709 0.051 19718
6947 1 15 . 1 1 32 32 GLY N N 32 108.700 108.700 108.988 -0.288 19718
6948 1 15 . 1 1 32 32 GLY C C 32 171.700 171.700 175.280 -3.580 19718
6949 1 15 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.968 -3.768 19718
6950 1 15 . 1 1 32 32 GLY H H 32 8.220 8.220 7.957 0.263 19718
6951 1 15 . 1 1 33 33 HIS N N 33 115.000 115.000 118.656 -3.656 19718
6952 1 15 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.609 -0.179 19718
6953 1 15 . 1 1 33 33 HIS C C 33 169.800 169.800 174.221 -4.421 19718
6954 1 15 . 1 1 33 33 HIS CA C 33 53.400 53.400 55.983 -2.583 19718
6955 1 15 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.356 -4.856 19718
6956 1 15 . 1 1 33 33 HIS H H 33 6.980 6.980 7.915 -0.935 19718
6957 1 15 . 1 1 34 34 ASN N N 34 113.700 113.700 116.810 -3.110 19718
6958 1 15 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.329 0.001 19718
6959 1 15 . 1 1 34 34 ASN C C 34 172.000 172.000 175.150 -3.150 19718
6960 1 15 . 1 1 34 34 ASN CA C 34 52.100 52.100 54.244 -2.144 19718
6961 1 15 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.415 -2.415 19718
6962 1 15 . 1 1 34 34 ASN H H 34 7.700 7.700 7.715 -0.015 19718
6963 1 15 . 1 1 35 35 LEU N N 35 115.600 115.600 119.075 -3.475 19718
6964 1 15 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.192 0.058 19718
6965 1 15 . 1 1 35 35 LEU C C 35 174.900 174.900 177.028 -2.128 19718
6966 1 15 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.528 -4.228 19718
6967 1 15 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.248 -3.048 19718
6968 1 15 . 1 1 35 35 LEU H H 35 7.980 7.980 7.681 0.299 19718
6969 1 15 . 1 1 36 36 ASP N N 36 120.100 120.100 124.836 -4.736 19718
6970 1 15 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.597 -0.167 19718
6971 1 15 . 1 1 36 36 ASP C C 36 171.100 171.100 174.753 -3.653 19718
6972 1 15 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.669 -3.670 19718
6973 1 15 . 1 1 36 36 ASP CB C 36 36.200 36.200 40.031 -3.831 19718
6974 1 15 . 1 1 36 36 ASP H H 36 8.610 8.610 8.689 -0.079 19718
6975 1 15 . 1 1 37 37 MET N N 37 123.900 123.900 120.626 3.274 19718
6976 1 15 . 1 1 37 37 MET HA H 37 4.280 4.280 4.822 -0.542 19718
6977 1 15 . 1 1 37 37 MET C C 37 171.200 171.200 174.179 -2.979 19718
6978 1 15 . 1 1 37 37 MET CA C 37 52.800 52.800 55.174 -2.374 19718
6979 1 15 . 1 1 37 37 MET CB C 37 33.000 33.000 35.549 -2.549 19718
6980 1 15 . 1 1 37 37 MET H H 37 7.670 7.670 7.751 -0.081 19718
6981 1 15 . 1 1 38 38 GLU N N 38 128.600 128.600 122.021 6.579 19718
6982 1 15 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.695 -0.405 19718
6983 1 15 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.321 -2.121 19718
6984 1 15 . 1 1 38 38 GLU CB C 38 29.400 29.400 33.179 -3.779 19718
6985 1 15 . 1 1 38 38 GLU H H 38 9.060 9.060 8.572 0.488 19718
6986 1 15 . 1 1 51 51 HIS C C 51 170.700 170.700 174.739 -4.039 19718
6987 1 15 . 1 1 51 51 HIS CA C 51 52.800 52.800 53.111 -0.311 19718
6988 1 15 . 1 1 51 51 HIS CB C 51 27.700 27.700 29.522 -1.822 19718
6989 1 15 . 1 1 53 53 ILE N N 53 122.200 122.200 119.867 2.333 19718
6990 1 15 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.879 -0.869 19718
6991 1 15 . 1 1 53 53 ILE C C 53 174.400 174.400 173.432 0.968 19718
6992 1 15 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.713 -0.013 19718
6993 1 15 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.279 -5.979 19718
6994 1 15 . 1 1 53 53 ILE H H 53 8.800 8.800 8.200 0.600 19718
6995 1 15 . 1 1 54 54 VAL N N 54 130.200 130.200 125.850 4.350 19718
6996 1 15 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.783 -0.913 19718
6997 1 15 . 1 1 54 54 VAL C C 54 172.500 172.500 174.770 -2.270 19718
6998 1 15 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.646 1.254 19718
6999 1 15 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.144 -5.544 19718
7000 1 15 . 1 1 54 54 VAL H H 54 8.380 8.380 8.743 -0.363 19718
7001 1 15 . 1 1 55 55 ASP N N 55 129.100 129.100 127.040 2.060 19718
7002 1 15 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.686 -0.096 19718
7003 1 15 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.648 -2.948 19718
7004 1 15 . 1 1 55 55 ASP CB C 55 40.500 40.500 42.011 -1.511 19718
7005 1 15 . 1 1 55 55 ASP H H 55 8.160 8.160 8.125 0.035 19718
7006 1 15 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.317 -0.147 19718
7007 1 15 . 1 1 56 56 PRO C C 56 174.900 174.900 176.722 -1.822 19718
7008 1 15 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.531 -1.531 19718
7009 1 15 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.718 -2.318 19718
7010 1 15 . 1 1 57 57 ASP N N 57 117.100 117.100 117.339 -0.239 19718
7011 1 15 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.405 -0.035 19718
7012 1 15 . 1 1 57 57 ASP C C 57 174.100 174.100 177.437 -3.337 19718
7013 1 15 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.794 -3.094 19718
7014 1 15 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.163 -4.363 19718
7015 1 15 . 1 1 57 57 ASP H H 57 9.110 9.110 8.752 0.358 19718
7016 1 15 . 1 1 58 58 TYR N N 58 115.800 115.800 116.621 -0.821 19718
7017 1 15 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.548 -0.188 19718
7018 1 15 . 1 1 58 58 TYR C C 58 173.200 173.200 176.665 -3.465 19718
7019 1 15 . 1 1 58 58 TYR CA C 58 56.700 56.700 58.252 -1.552 19718
7020 1 15 . 1 1 58 58 TYR CB C 58 38.900 38.900 38.962 -0.062 19718
7021 1 15 . 1 1 58 58 TYR H H 58 8.190 8.190 7.811 0.379 19718
7022 1 15 . 1 1 59 59 TYR N N 59 120.100 120.100 120.844 -0.744 19718
7023 1 15 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.189 -0.409 19718
7024 1 15 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.010 0.090 19718
7025 1 15 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.816 -2.416 19718
7026 1 15 . 1 1 59 59 TYR H H 59 7.420 7.420 8.009 -0.589 19718
7027 1 15 . 1 1 60 60 ASP N N 60 115.200 115.200 119.340 -4.140 19718
7028 1 15 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.480 -0.120 19718
7029 1 15 . 1 1 60 60 ASP C C 60 173.100 173.100 176.152 -3.052 19718
7030 1 15 . 1 1 60 60 ASP CA C 60 53.400 53.400 56.108 -2.708 19718
7031 1 15 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.385 -2.885 19718
7032 1 15 . 1 1 60 60 ASP H H 60 8.440 8.440 7.719 0.721 19718
7033 1 15 . 1 1 61 61 ALA N N 61 120.200 120.200 120.653 -0.453 19718
7034 1 15 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.492 -0.312 19718
7035 1 15 . 1 1 61 61 ALA C C 61 175.000 175.000 177.234 -2.234 19718
7036 1 15 . 1 1 61 61 ALA CA C 61 49.300 49.300 51.665 -2.365 19718
7037 1 15 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.734 -3.534 19718
7038 1 15 . 1 1 61 61 ALA H H 61 7.300 7.300 7.964 -0.664 19718
7039 1 15 . 1 1 62 62 LEU N N 62 118.000 118.000 122.465 -4.465 19718
7040 1 15 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.690 -0.400 19718
7041 1 15 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.616 -2.516 19718
7042 1 15 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.904 -3.204 19718
7043 1 15 . 1 1 62 62 LEU H H 62 6.680 6.680 7.482 -0.802 19718
7044 1 15 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.509 -0.189 19718
7045 1 15 . 1 1 63 63 PRO C C 63 173.500 173.500 176.232 -2.732 19718
7046 1 15 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.186 -2.486 19718
7047 1 15 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.345 -3.845 19718
7048 1 15 . 1 1 64 64 GLU N N 64 124.500 124.500 120.035 4.465 19718
7049 1 15 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.523 -0.343 19718
7050 1 15 . 1 1 64 64 GLU CA C 64 52.500 52.500 53.938 -1.438 19718
7051 1 15 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.114 -4.314 19718
7052 1 15 . 1 1 64 64 GLU H H 64 8.590 8.590 8.399 0.191 19718
7053 1 15 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.246 -0.076 19718
7054 1 15 . 1 1 65 65 PRO C C 65 174.900 174.900 176.881 -1.981 19718
7055 1 15 . 1 1 65 65 PRO CA C 65 63.000 63.000 63.002 -0.002 19718
7056 1 15 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.436 -3.936 19718
7057 1 15 . 1 1 66 66 GLU N N 66 123.300 123.300 119.645 3.655 19718
7058 1 15 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.085 0.245 19718
7059 1 15 . 1 1 66 66 GLU C C 66 174.200 174.200 177.398 -3.198 19718
7060 1 15 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.698 -4.198 19718
7061 1 15 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.462 -3.062 19718
7062 1 15 . 1 1 66 66 GLU H H 66 9.080 9.080 8.750 0.330 19718
7063 1 15 . 1 1 67 67 ASP N N 67 120.100 120.100 120.450 -0.350 19718
7064 1 15 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.610 -0.370 19718
7065 1 15 . 1 1 67 67 ASP C C 67 174.900 174.900 177.428 -2.528 19718
7066 1 15 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.662 -1.262 19718
7067 1 15 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.911 -3.111 19718
7068 1 15 . 1 1 67 67 ASP H H 67 8.690 8.690 8.771 -0.081 19718
7069 1 15 . 1 1 68 68 ASP N N 68 116.800 116.800 116.981 -0.181 19718
7070 1 15 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.572 -0.332 19718
7071 1 15 . 1 1 68 68 ASP C C 68 175.500 175.500 177.054 -1.554 19718
7072 1 15 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.487 -1.187 19718
7073 1 15 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.872 -4.772 19718
7074 1 15 . 1 1 68 68 ASP H H 68 8.400 8.400 8.597 -0.197 19718
7075 1 15 . 1 1 69 69 GLU N N 69 123.600 123.600 119.216 4.384 19718
7076 1 15 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.179 -0.029 19718
7077 1 15 . 1 1 69 69 GLU C C 69 175.200 175.200 178.484 -3.284 19718
7078 1 15 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.581 -2.381 19718
7079 1 15 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.455 -4.455 19718
7080 1 15 . 1 1 69 69 GLU H H 69 7.530 7.530 7.776 -0.246 19718
7081 1 15 . 1 1 70 70 ASN N N 70 119.100 119.100 118.342 0.758 19718
7082 1 15 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.466 -0.106 19718
7083 1 15 . 1 1 70 70 ASN C C 70 175.200 175.200 176.144 -0.944 19718
7084 1 15 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.655 -1.955 19718
7085 1 15 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.631 -2.831 19718
7086 1 15 . 1 1 70 70 ASN H H 70 7.960 7.960 8.871 -0.911 19718
7087 1 15 . 1 1 71 71 ASP N N 71 118.400 118.400 118.164 0.236 19718
7088 1 15 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.566 -0.316 19718
7089 1 15 . 1 1 71 71 ASP C C 71 176.000 176.000 177.467 -1.467 19718
7090 1 15 . 1 1 71 71 ASP CA C 71 54.600 54.600 55.685 -1.085 19718
7091 1 15 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.661 -3.161 19718
7092 1 15 . 1 1 71 71 ASP H H 71 8.250 8.250 7.969 0.281 19718
7093 1 15 . 1 1 72 72 MET N N 72 117.300 117.300 117.028 0.272 19718
7094 1 15 . 1 1 72 72 MET HA H 72 4.370 4.370 4.397 -0.028 19718
7095 1 15 . 1 1 72 72 MET C C 72 177.800 177.800 177.424 0.376 19718
7096 1 15 . 1 1 72 72 MET CA C 72 53.700 53.700 58.045 -4.345 19718
7097 1 15 . 1 1 72 72 MET CB C 72 32.400 32.400 32.999 -0.599 19718
7098 1 15 . 1 1 72 72 MET H H 72 7.240 7.240 7.787 -0.547 19718
7099 1 15 . 1 1 73 73 LEU N N 73 123.000 123.000 120.249 2.751 19718
7100 1 15 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.323 -0.563 19718
7101 1 15 . 1 1 73 73 LEU C C 73 175.700 175.700 178.786 -3.086 19718
7102 1 15 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.152 -2.252 19718
7103 1 15 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.599 -3.499 19718
7104 1 15 . 1 1 73 73 LEU H H 73 8.600 8.600 7.340 1.260 19718
7105 1 15 . 1 1 74 74 ASP N N 74 118.500 118.500 119.291 -0.791 19718
7106 1 15 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.293 0.047 19718
7107 1 15 . 1 1 74 74 ASP C C 74 174.700 174.700 177.607 -2.907 19718
7108 1 15 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.945 -2.645 19718
7109 1 15 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.895 -2.695 19718
7110 1 15 . 1 1 74 74 ASP H H 74 7.250 7.250 7.757 -0.507 19718
7111 1 15 . 1 1 75 75 LEU N N 75 116.300 116.300 117.114 -0.814 19718
7112 1 15 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.189 0.111 19718
7113 1 15 . 1 1 75 75 LEU C C 75 174.500 174.500 177.147 -2.647 19718
7114 1 15 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.435 -4.135 19718
7115 1 15 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.870 -2.271 19718
7116 1 15 . 1 1 75 75 LEU H H 75 7.000 7.000 7.715 -0.715 19718
7117 1 15 . 1 1 76 76 ALA N N 76 124.600 124.600 121.180 3.420 19718
7118 1 15 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.288 -0.188 19718
7119 1 15 . 1 1 76 76 ALA C C 76 174.200 174.200 176.583 -2.383 19718
7120 1 15 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.264 -1.764 19718
7121 1 15 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.045 -4.845 19718
7122 1 15 . 1 1 76 76 ALA H H 76 7.590 7.590 7.493 0.097 19718
7123 1 15 . 1 1 77 77 TYR N N 77 122.900 122.900 122.602 0.298 19718
7124 1 15 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.101 0.329 19718
7125 1 15 . 1 1 77 77 TYR C C 77 174.100 174.100 177.120 -3.020 19718
7126 1 15 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.187 -4.287 19718
7127 1 15 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.113 -3.213 19718
7128 1 15 . 1 1 77 77 TYR H H 77 8.150 8.150 8.448 -0.298 19718
7129 1 15 . 1 1 78 78 GLY N N 78 112.900 112.900 114.377 -1.477 19718
7130 1 15 . 1 1 78 78 GLY C C 78 171.800 171.800 173.547 -1.747 19718
7131 1 15 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.739 -1.040 19718
7132 1 15 . 1 1 78 78 GLY H H 78 8.320 8.320 7.950 0.370 19718
7133 1 15 . 1 1 79 79 LEU N N 79 119.300 119.300 119.328 -0.028 19718
7134 1 15 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.224 -0.434 19718
7135 1 15 . 1 1 79 79 LEU C C 79 174.000 174.000 176.992 -2.992 19718
7136 1 15 . 1 1 79 79 LEU CA C 79 54.000 54.000 54.961 -0.961 19718
7137 1 15 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.545 -2.645 19718
7138 1 15 . 1 1 79 79 LEU H H 79 7.120 7.120 7.871 -0.751 19718
7139 1 15 . 1 1 80 80 THR N N 80 118.500 118.500 120.389 -1.889 19718
7140 1 15 . 1 1 80 80 THR HA H 80 4.860 4.860 4.432 0.428 19718
7141 1 15 . 1 1 80 80 THR C C 80 173.300 173.300 175.176 -1.876 19718
7142 1 15 . 1 1 80 80 THR CA C 80 57.600 57.600 60.553 -2.953 19718
7143 1 15 . 1 1 80 80 THR CB C 80 71.000 71.000 70.118 0.882 19718
7144 1 15 . 1 1 80 80 THR H H 80 9.240 9.240 7.869 1.371 19718
7145 1 15 . 1 1 81 81 GLU N N 81 118.000 118.000 121.030 -3.030 19718
7146 1 15 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.176 -0.066 19718
7147 1 15 . 1 1 81 81 GLU C C 81 173.900 173.900 176.186 -2.286 19718
7148 1 15 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.153 -2.753 19718
7149 1 15 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.197 -2.497 19718
7150 1 15 . 1 1 81 81 GLU H H 81 9.020 9.020 8.739 0.281 19718
7151 1 15 . 1 1 82 82 THR N N 82 106.400 106.400 107.821 -1.421 19718
7152 1 15 . 1 1 82 82 THR HA H 82 3.950 3.950 2.761 1.189 19718
7153 1 15 . 1 1 82 82 THR C C 82 171.700 171.700 173.422 -1.722 19718
7154 1 15 . 1 1 82 82 THR CA C 82 56.800 56.800 59.698 -2.898 19718
7155 1 15 . 1 1 82 82 THR CB C 82 63.800 63.800 68.128 -4.328 19718
7156 1 15 . 1 1 82 82 THR H H 82 7.630 7.630 7.484 0.146 19718
7157 1 15 . 1 1 83 83 SER N N 83 121.500 121.500 118.483 3.017 19718
7158 1 15 . 1 1 83 83 SER HA H 83 5.080 5.080 4.370 0.710 19718
7159 1 15 . 1 1 83 83 SER C C 83 170.900 170.900 173.540 -2.640 19718
7160 1 15 . 1 1 83 83 SER CA C 83 59.000 59.000 60.257 -1.257 19718
7161 1 15 . 1 1 83 83 SER CB C 83 61.700 61.700 63.868 -2.168 19718
7162 1 15 . 1 1 83 83 SER H H 83 6.930 6.930 7.777 -0.847 19718
7163 1 15 . 1 1 84 84 ARG N N 84 119.300 119.300 121.873 -2.573 19718
7164 1 15 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.820 0.050 19718
7165 1 15 . 1 1 84 84 ARG C C 84 172.400 172.400 174.784 -2.384 19718
7166 1 15 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.627 -5.327 19718
7167 1 15 . 1 1 84 84 ARG CB C 84 32.400 32.400 35.095 -2.695 19718
7168 1 15 . 1 1 84 84 ARG H H 84 9.280 9.280 8.991 0.289 19718
7169 1 15 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.569 -0.139 19718
7170 1 15 . 1 1 88 88 GLN C C 88 172.500 172.500 174.845 -2.345 19718
7171 1 15 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.235 -4.235 19718
7172 1 15 . 1 1 88 88 GLN CB C 88 27.000 27.000 30.045 -3.045 19718
7173 1 15 . 1 1 90 90 LYS N N 90 123.700 123.700 125.461 -1.761 19718
7174 1 15 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.935 -0.485 19718
7175 1 15 . 1 1 90 90 LYS C C 90 173.500 173.500 175.441 -1.941 19718
7176 1 15 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.318 -1.818 19718
7177 1 15 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.609 -2.709 19718
7178 1 15 . 1 1 90 90 LYS H H 90 8.330 8.330 8.064 0.266 19718
7179 1 15 . 1 1 91 91 MET N N 91 118.200 118.200 120.082 -1.882 19718
7180 1 15 . 1 1 91 91 MET HA H 91 4.330 4.330 4.622 -0.292 19718
7181 1 15 . 1 1 91 91 MET C C 91 174.300 174.300 176.025 -1.725 19718
7182 1 15 . 1 1 91 91 MET CA C 91 51.800 51.800 54.809 -3.009 19718
7183 1 15 . 1 1 91 91 MET CB C 91 27.200 27.200 31.252 -4.052 19718
7184 1 15 . 1 1 91 91 MET H H 91 8.620 8.620 8.338 0.282 19718
7185 1 15 . 1 1 92 92 SER N N 92 117.000 117.000 118.355 -1.355 19718
7186 1 15 . 1 1 92 92 SER HA H 92 4.610 4.610 4.961 -0.351 19718
7187 1 15 . 1 1 92 92 SER C C 92 171.300 171.300 174.980 -3.680 19718
7188 1 15 . 1 1 92 92 SER CA C 92 54.000 54.000 56.383 -2.383 19718
7189 1 15 . 1 1 92 92 SER CB C 92 63.700 63.700 66.099 -2.399 19718
7190 1 15 . 1 1 92 92 SER H H 92 6.970 6.970 8.322 -1.352 19718
7191 1 15 . 1 1 93 93 LYS N N 93 121.700 121.700 118.763 2.937 19718
7192 1 15 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.113 -0.143 19718
7193 1 15 . 1 1 93 93 LYS C C 93 175.200 175.200 177.343 -2.143 19718
7194 1 15 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.855 -2.155 19718
7195 1 15 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.902 -2.802 19718
7196 1 15 . 1 1 93 93 LYS H H 93 9.260 9.260 8.792 0.468 19718
7197 1 15 . 1 1 94 94 ASP N N 94 116.700 116.700 119.381 -2.681 19718
7198 1 15 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.686 -0.326 19718
7199 1 15 . 1 1 94 94 ASP C C 94 174.300 174.300 177.357 -3.057 19718
7200 1 15 . 1 1 94 94 ASP CA C 94 53.700 53.700 54.929 -1.229 19718
7201 1 15 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.659 -3.759 19718
7202 1 15 . 1 1 94 94 ASP H H 94 8.020 8.020 7.679 0.341 19718
7203 1 15 . 1 1 95 95 ILE N N 95 109.000 109.000 113.878 -4.878 19718
7204 1 15 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.381 0.279 19718
7205 1 15 . 1 1 95 95 ILE C C 95 170.600 170.600 175.189 -4.589 19718
7206 1 15 . 1 1 95 95 ILE CA C 95 57.300 57.300 61.218 -3.918 19718
7207 1 15 . 1 1 95 95 ILE CB C 95 35.200 35.200 37.860 -2.660 19718
7208 1 15 . 1 1 95 95 ILE H H 95 7.240 7.240 7.477 -0.237 19718
7209 1 15 . 1 1 96 96 ASP N N 96 119.800 119.800 122.253 -2.453 19718
7210 1 15 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.401 -0.221 19718
7211 1 15 . 1 1 96 96 ASP C C 96 174.900 174.900 176.735 -1.835 19718
7212 1 15 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.610 -0.910 19718
7213 1 15 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.471 -0.471 19718
7214 1 15 . 1 1 96 96 ASP H H 96 6.950 6.950 8.080 -1.130 19718
7215 1 15 . 1 1 97 97 GLY N N 97 118.500 118.500 113.926 4.574 19718
7216 1 15 . 1 1 97 97 GLY C C 97 170.500 170.500 173.464 -2.964 19718
7217 1 15 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.475 -2.175 19718
7218 1 15 . 1 1 97 97 GLY H H 97 9.210 9.210 8.368 0.842 19718
7219 1 15 . 1 1 98 98 ILE N N 98 121.300 121.300 121.096 0.204 19718
7220 1 15 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.403 2.197 19718
7221 1 15 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.542 -2.942 19718
7222 1 15 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.635 -3.935 19718
7223 1 15 . 1 1 98 98 ILE H H 98 7.660 7.660 7.818 -0.158 19718
7224 1 15 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.280 0.070 19718
7225 1 15 . 1 1 99 99 ARG C C 99 172.200 172.200 174.987 -2.787 19718
7226 1 15 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.427 -4.327 19718
7227 1 15 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.649 -3.149 19718
7228 1 15 . 1 1 100 100 VAL N N 100 114.900 114.900 116.728 -1.828 19718
7229 1 15 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.138 -0.318 19718
7230 1 15 . 1 1 100 100 VAL C C 100 169.600 169.600 173.303 -3.703 19718
7231 1 15 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.140 -3.940 19718
7232 1 15 . 1 1 100 100 VAL CB C 100 32.300 32.300 35.984 -3.684 19718
7233 1 15 . 1 1 100 100 VAL H H 100 8.440 8.440 8.922 -0.482 19718
7234 1 15 . 1 1 101 101 ALA N N 101 123.400 123.400 123.299 0.101 19718
7235 1 15 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.819 0.491 19718
7236 1 15 . 1 1 101 101 ALA C C 101 174.400 174.400 175.399 -0.999 19718
7237 1 15 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.013 -3.213 19718
7238 1 15 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.792 -2.992 19718
7239 1 15 . 1 1 101 101 ALA H H 101 9.040 9.040 8.942 0.098 19718
7240 1 15 . 1 1 102 102 LEU N N 102 120.600 120.600 121.634 -1.034 19718
7241 1 15 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.124 -0.554 19718
7242 1 15 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.897 0.303 19718
7243 1 15 . 1 1 102 102 LEU CB C 102 37.900 37.900 43.217 -5.317 19718
7244 1 15 . 1 1 102 102 LEU H H 102 8.260 8.260 8.210 0.050 19718
7245 1 15 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.776 -0.196 19718
7246 1 15 . 1 1 112 112 ASN C C 112 171.900 171.900 173.295 -1.395 19718
7247 1 15 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.656 -2.256 19718
7248 1 15 . 1 1 112 112 ASN CB C 112 36.700 36.700 40.705 -4.005 19718
7249 1 15 . 1 1 113 113 ASP N N 113 120.300 120.300 120.493 -0.193 19718
7250 1 15 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.827 -0.387 19718
7251 1 15 . 1 1 113 113 ASP C C 113 173.000 173.000 175.038 -2.038 19718
7252 1 15 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.072 -2.472 19718
7253 1 15 . 1 1 113 113 ASP CB C 113 38.100 38.100 42.658 -4.558 19718
7254 1 15 . 1 1 113 113 ASP H H 113 8.040 8.040 8.230 -0.190 19718
7255 1 15 . 1 1 114 114 PHE N N 114 120.100 120.100 121.623 -1.523 19718
7256 1 15 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.696 -0.086 19718
7257 1 15 . 1 1 114 114 PHE C C 114 172.200 172.200 176.739 -4.539 19718
7258 1 15 . 1 1 114 114 PHE CA C 114 54.900 54.900 57.660 -2.760 19718
7259 1 15 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.792 -3.292 19718
7260 1 15 . 1 1 114 114 PHE H H 114 8.110 8.110 8.674 -0.564 19718
7261 1 16 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.185 0.055 19718
7262 1 16 . 1 1 2 2 GLU C C 2 173.400 173.400 176.017 -2.617 19718
7263 1 16 . 1 1 2 2 GLU CA C 2 53.400 53.400 55.584 -2.184 19718
7264 1 16 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.794 -3.794 19718
7265 1 16 . 1 1 3 3 GLU N N 3 121.200 121.200 123.122 -1.922 19718
7266 1 16 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.414 -0.034 19718
7267 1 16 . 1 1 3 3 GLU C C 3 173.000 173.000 176.004 -3.004 19718
7268 1 16 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.620 -2.220 19718
7269 1 16 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.107 -2.707 19718
7270 1 16 . 1 1 3 3 GLU H H 3 8.510 8.510 8.647 -0.137 19718
7271 1 16 . 1 1 4 4 LEU N N 4 122.400 122.400 125.624 -3.224 19718
7272 1 16 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.789 -0.239 19718
7273 1 16 . 1 1 4 4 LEU C C 4 172.900 172.900 175.064 -2.164 19718
7274 1 16 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.347 -2.947 19718
7275 1 16 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.616 -4.916 19718
7276 1 16 . 1 1 4 4 LEU H H 4 8.460 8.460 8.574 -0.114 19718
7277 1 16 . 1 1 5 5 LYS N N 5 119.300 119.300 119.453 -0.153 19718
7278 1 16 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.341 0.079 19718
7279 1 16 . 1 1 5 5 LYS C C 5 172.400 172.400 174.578 -2.178 19718
7280 1 16 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.648 -2.348 19718
7281 1 16 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.722 -3.722 19718
7282 1 16 . 1 1 5 5 LYS H H 5 8.570 8.570 8.261 0.309 19718
7283 1 16 . 1 1 6 6 ILE N N 6 116.900 116.900 120.720 -3.820 19718
7284 1 16 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.520 -0.410 19718
7285 1 16 . 1 1 6 6 ILE C C 6 169.800 169.800 173.437 -3.637 19718
7286 1 16 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.747 -4.247 19718
7287 1 16 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.109 -3.109 19718
7288 1 16 . 1 1 6 6 ILE H H 6 8.160 8.160 8.832 -0.672 19718
7289 1 16 . 1 1 7 7 THR N N 7 123.000 123.000 125.698 -2.698 19718
7290 1 16 . 1 1 7 7 THR HA H 7 5.220 5.220 4.993 0.227 19718
7291 1 16 . 1 1 7 7 THR C C 7 169.900 169.900 173.767 -3.867 19718
7292 1 16 . 1 1 7 7 THR CA C 7 58.400 58.400 61.944 -3.544 19718
7293 1 16 . 1 1 7 7 THR CB C 7 68.700 68.700 69.340 -0.640 19718
7294 1 16 . 1 1 7 7 THR H H 7 8.520 8.520 8.710 -0.190 19718
7295 1 16 . 1 1 8 8 PHE N N 8 124.000 124.000 124.764 -0.764 19718
7296 1 16 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.470 -0.320 19718
7297 1 16 . 1 1 8 8 PHE C C 8 172.300 172.300 174.881 -2.581 19718
7298 1 16 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.352 -1.752 19718
7299 1 16 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.836 -1.736 19718
7300 1 16 . 1 1 8 8 PHE H H 8 9.290 9.290 9.197 0.093 19718
7301 1 16 . 1 1 9 9 ILE N N 9 122.700 122.700 122.380 0.320 19718
7302 1 16 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.873 -0.293 19718
7303 1 16 . 1 1 9 9 ILE C C 9 173.600 173.600 175.868 -2.268 19718
7304 1 16 . 1 1 9 9 ILE CA C 9 58.200 58.200 59.208 -1.008 19718
7305 1 16 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.541 -3.041 19718
7306 1 16 . 1 1 9 9 ILE H H 9 9.170 9.170 8.751 0.419 19718
7307 1 16 . 1 1 10 10 LEU N N 10 126.700 126.700 127.405 -0.705 19718
7308 1 16 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.214 0.106 19718
7309 1 16 . 1 1 10 10 LEU C C 10 176.500 176.500 178.469 -1.969 19718
7310 1 16 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.559 -3.359 19718
7311 1 16 . 1 1 10 10 LEU CB C 10 37.500 37.500 41.746 -4.246 19718
7312 1 16 . 1 1 10 10 LEU H H 10 9.100 9.100 9.107 -0.007 19718
7313 1 16 . 1 1 11 11 LYS N N 11 118.900 118.900 122.748 -3.848 19718
7314 1 16 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.054 -0.094 19718
7315 1 16 . 1 1 11 11 LYS C C 11 174.100 174.100 177.640 -3.540 19718
7316 1 16 . 1 1 11 11 LYS CA C 11 57.400 57.400 59.303 -1.903 19718
7317 1 16 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.227 -3.327 19718
7318 1 16 . 1 1 11 11 LYS H H 11 8.520 8.520 8.976 -0.456 19718
7319 1 16 . 1 1 12 12 ASP N N 12 114.400 114.400 116.018 -1.618 19718
7320 1 16 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.600 -0.080 19718
7321 1 16 . 1 1 12 12 ASP C C 12 174.500 174.500 177.022 -2.522 19718
7322 1 16 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.894 -3.494 19718
7323 1 16 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.782 -3.583 19718
7324 1 16 . 1 1 12 12 ASP H H 12 7.690 7.690 7.891 -0.201 19718
7325 1 16 . 1 1 13 13 GLY N N 13 109.200 109.200 107.354 1.846 19718
7326 1 16 . 1 1 13 13 GLY C C 13 171.600 171.600 174.314 -2.714 19718
7327 1 16 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.193 -2.793 19718
7328 1 16 . 1 1 13 13 GLY H H 13 8.100 8.100 7.924 0.176 19718
7329 1 16 . 1 1 14 14 SER N N 14 118.000 118.000 115.931 2.069 19718
7330 1 16 . 1 1 14 14 SER HA H 14 4.280 4.280 4.352 -0.072 19718
7331 1 16 . 1 1 14 14 SER C C 14 169.000 169.000 173.823 -4.823 19718
7332 1 16 . 1 1 14 14 SER CA C 14 56.500 56.500 58.781 -2.281 19718
7333 1 16 . 1 1 14 14 SER CB C 14 61.000 61.000 63.816 -2.816 19718
7334 1 16 . 1 1 14 14 SER H H 14 8.110 8.110 7.954 0.156 19718
7335 1 16 . 1 1 15 15 GLN N N 15 116.300 116.300 120.740 -4.440 19718
7336 1 16 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.288 0.372 19718
7337 1 16 . 1 1 15 15 GLN C C 15 173.500 173.500 175.944 -2.444 19718
7338 1 16 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.988 -3.288 19718
7339 1 16 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.752 -2.752 19718
7340 1 16 . 1 1 15 15 GLN H H 15 8.330 8.330 8.511 -0.181 19718
7341 1 16 . 1 1 16 16 LYS N N 16 122.500 122.500 124.716 -2.216 19718
7342 1 16 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.647 -0.317 19718
7343 1 16 . 1 1 16 16 LYS C C 16 171.300 171.300 174.510 -3.210 19718
7344 1 16 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.404 -3.504 19718
7345 1 16 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.342 -1.342 19718
7346 1 16 . 1 1 16 16 LYS H H 16 8.780 8.780 8.809 -0.029 19718
7347 1 16 . 1 1 17 17 THR N N 17 120.000 120.000 120.007 -0.007 19718
7348 1 16 . 1 1 17 17 THR HA H 17 5.220 5.220 4.941 0.279 19718
7349 1 16 . 1 1 17 17 THR C C 17 170.500 170.500 173.731 -3.231 19718
7350 1 16 . 1 1 17 17 THR CA C 17 58.700 58.700 61.153 -2.453 19718
7351 1 16 . 1 1 17 17 THR CB C 17 67.900 67.900 69.449 -1.549 19718
7352 1 16 . 1 1 17 17 THR H H 17 8.160 8.160 8.489 -0.329 19718
7353 1 16 . 1 1 18 18 TYR N N 18 125.600 125.600 128.099 -2.499 19718
7354 1 16 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.722 0.118 19718
7355 1 16 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.969 -1.969 19718
7356 1 16 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.700 -2.600 19718
7357 1 16 . 1 1 18 18 TYR H H 18 9.020 9.020 9.007 0.013 19718
7358 1 16 . 1 1 19 19 GLU C C 19 174.200 174.200 176.029 -1.829 19718
7359 1 16 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.285 -3.385 19718
7360 1 16 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.068 -2.768 19718
7361 1 16 . 1 1 20 20 VAL N N 20 119.000 119.000 118.317 0.683 19718
7362 1 16 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.798 0.042 19718
7363 1 16 . 1 1 20 20 VAL C C 20 171.200 171.200 174.034 -2.834 19718
7364 1 16 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.513 -2.913 19718
7365 1 16 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.736 -2.036 19718
7366 1 16 . 1 1 20 20 VAL H H 20 9.160 9.160 8.549 0.611 19718
7367 1 16 . 1 1 21 21 CYS N N 21 117.500 117.500 118.981 -1.481 19718
7368 1 16 . 1 1 21 21 CYS HA H 21 4.760 4.760 5.342 -0.582 19718
7369 1 16 . 1 1 21 21 CYS C C 21 171.400 171.400 174.343 -2.943 19718
7370 1 16 . 1 1 21 21 CYS CA C 21 54.900 54.900 56.130 -1.230 19718
7371 1 16 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.668 -3.468 19718
7372 1 16 . 1 1 21 21 CYS H H 21 8.720 8.720 8.449 0.271 19718
7373 1 16 . 1 1 22 22 GLU N N 22 120.900 120.900 124.276 -3.376 19718
7374 1 16 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.912 -0.502 19718
7375 1 16 . 1 1 22 22 GLU C C 22 174.300 174.300 176.775 -2.475 19718
7376 1 16 . 1 1 22 22 GLU CA C 22 55.100 55.100 59.037 -3.937 19718
7377 1 16 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.898 -3.098 19718
7378 1 16 . 1 1 22 22 GLU H H 22 8.540 8.540 8.114 0.426 19718
7379 1 16 . 1 1 23 23 GLY N N 23 112.400 112.400 114.727 -2.327 19718
7380 1 16 . 1 1 23 23 GLY C C 23 171.000 171.000 175.045 -4.045 19718
7381 1 16 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.972 -2.572 19718
7382 1 16 . 1 1 23 23 GLY H H 23 8.720 8.720 8.695 0.025 19718
7383 1 16 . 1 1 24 24 GLU N N 24 119.600 119.600 122.293 -2.693 19718
7384 1 16 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.558 -0.228 19718
7385 1 16 . 1 1 24 24 GLU C C 24 174.400 174.400 175.691 -1.291 19718
7386 1 16 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.209 -2.108 19718
7387 1 16 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.193 -2.093 19718
7388 1 16 . 1 1 24 24 GLU H H 24 7.060 7.060 7.791 -0.731 19718
7389 1 16 . 1 1 25 25 THR N N 25 113.600 113.600 115.666 -2.066 19718
7390 1 16 . 1 1 25 25 THR HA H 25 5.510 5.510 4.641 0.869 19718
7391 1 16 . 1 1 25 25 THR C C 25 173.100 173.100 175.280 -2.180 19718
7392 1 16 . 1 1 25 25 THR CA C 25 57.000 57.000 60.791 -3.791 19718
7393 1 16 . 1 1 25 25 THR CB C 25 68.700 68.700 70.970 -2.270 19718
7394 1 16 . 1 1 25 25 THR H H 25 9.080 9.080 8.421 0.659 19718
7395 1 16 . 1 1 26 26 ILE N N 26 120.300 120.300 124.674 -4.374 19718
7396 1 16 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.959 -0.329 19718
7397 1 16 . 1 1 26 26 ILE C C 26 174.700 174.700 177.800 -3.100 19718
7398 1 16 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.529 0.171 19718
7399 1 16 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.050 -4.050 19718
7400 1 16 . 1 1 26 26 ILE H H 26 7.860 7.860 9.217 -1.357 19718
7401 1 16 . 1 1 27 27 LEU N N 27 117.600 117.600 122.187 -4.587 19718
7402 1 16 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.895 -0.145 19718
7403 1 16 . 1 1 27 27 LEU C C 27 174.000 174.000 178.376 -4.376 19718
7404 1 16 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.724 -3.824 19718
7405 1 16 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.610 -2.310 19718
7406 1 16 . 1 1 27 27 LEU H H 27 6.580 6.580 8.240 -1.660 19718
7407 1 16 . 1 1 28 28 ASP N N 28 120.000 120.000 117.871 2.129 19718
7408 1 16 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.396 -0.146 19718
7409 1 16 . 1 1 28 28 ASP C C 28 177.900 177.900 178.481 -0.581 19718
7410 1 16 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.694 -2.694 19718
7411 1 16 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.877 -3.977 19718
7412 1 16 . 1 1 28 28 ASP H H 28 7.880 7.880 8.522 -0.642 19718
7413 1 16 . 1 1 29 29 ILE N N 29 122.100 122.100 119.867 2.233 19718
7414 1 16 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.986 -0.246 19718
7415 1 16 . 1 1 29 29 ILE C C 29 175.700 175.700 177.933 -2.233 19718
7416 1 16 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.676 -2.576 19718
7417 1 16 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.066 -1.566 19718
7418 1 16 . 1 1 29 29 ILE H H 29 8.340 8.340 8.301 0.039 19718
7419 1 16 . 1 1 30 30 ALA N N 30 124.100 124.100 123.623 0.477 19718
7420 1 16 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.713 -0.373 19718
7421 1 16 . 1 1 30 30 ALA C C 30 177.600 177.600 179.622 -2.022 19718
7422 1 16 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.561 -2.761 19718
7423 1 16 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.155 -1.355 19718
7424 1 16 . 1 1 30 30 ALA H H 30 8.430 8.430 8.416 0.014 19718
7425 1 16 . 1 1 31 31 GLN N N 31 116.000 116.000 116.774 -0.774 19718
7426 1 16 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.266 -0.106 19718
7427 1 16 . 1 1 31 31 GLN C C 31 178.100 178.100 178.582 -0.482 19718
7428 1 16 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.634 -0.934 19718
7429 1 16 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.484 -3.284 19718
7430 1 16 . 1 1 31 31 GLN H H 31 8.760 8.760 8.298 0.462 19718
7431 1 16 . 1 1 32 32 GLY N N 32 108.700 108.700 107.405 1.295 19718
7432 1 16 . 1 1 32 32 GLY C C 32 171.700 171.700 175.149 -3.449 19718
7433 1 16 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.004 -2.804 19718
7434 1 16 . 1 1 32 32 GLY H H 32 8.220 8.220 7.684 0.536 19718
7435 1 16 . 1 1 33 33 HIS N N 33 115.000 115.000 119.259 -4.259 19718
7436 1 16 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.703 -0.273 19718
7437 1 16 . 1 1 33 33 HIS C C 33 169.800 169.800 174.291 -4.491 19718
7438 1 16 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.020 -2.620 19718
7439 1 16 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.817 -5.317 19718
7440 1 16 . 1 1 33 33 HIS H H 33 6.980 6.980 8.025 -1.045 19718
7441 1 16 . 1 1 34 34 ASN N N 34 113.700 113.700 114.906 -1.206 19718
7442 1 16 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.365 -0.035 19718
7443 1 16 . 1 1 34 34 ASN C C 34 172.000 172.000 174.969 -2.969 19718
7444 1 16 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.695 -1.595 19718
7445 1 16 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.309 -2.309 19718
7446 1 16 . 1 1 34 34 ASN H H 34 7.700 7.700 7.653 0.047 19718
7447 1 16 . 1 1 35 35 LEU N N 35 115.600 115.600 118.682 -3.082 19718
7448 1 16 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.181 0.069 19718
7449 1 16 . 1 1 35 35 LEU C C 35 174.900 174.900 177.352 -2.452 19718
7450 1 16 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.328 -4.028 19718
7451 1 16 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.273 -3.073 19718
7452 1 16 . 1 1 35 35 LEU H H 35 7.980 7.980 7.735 0.245 19718
7453 1 16 . 1 1 36 36 ASP N N 36 120.100 120.100 124.662 -4.562 19718
7454 1 16 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.621 -0.191 19718
7455 1 16 . 1 1 36 36 ASP C C 36 171.100 171.100 174.781 -3.681 19718
7456 1 16 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.285 -3.285 19718
7457 1 16 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.407 -3.207 19718
7458 1 16 . 1 1 36 36 ASP H H 36 8.610 8.610 8.707 -0.097 19718
7459 1 16 . 1 1 37 37 MET N N 37 123.900 123.900 116.781 7.119 19718
7460 1 16 . 1 1 37 37 MET HA H 37 4.280 4.280 4.860 -0.580 19718
7461 1 16 . 1 1 37 37 MET C C 37 171.200 171.200 174.952 -3.752 19718
7462 1 16 . 1 1 37 37 MET CA C 37 52.800 52.800 54.273 -1.473 19718
7463 1 16 . 1 1 37 37 MET CB C 37 33.000 33.000 35.574 -2.574 19718
7464 1 16 . 1 1 37 37 MET H H 37 7.670 7.670 7.805 -0.135 19718
7465 1 16 . 1 1 38 38 GLU N N 38 128.600 128.600 122.805 5.795 19718
7466 1 16 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.552 -0.262 19718
7467 1 16 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.009 -2.809 19718
7468 1 16 . 1 1 38 38 GLU CB C 38 29.400 29.400 29.065 0.335 19718
7469 1 16 . 1 1 38 38 GLU H H 38 9.060 9.060 9.017 0.043 19718
7470 1 16 . 1 1 51 51 HIS C C 51 170.700 170.700 173.529 -2.829 19718
7471 1 16 . 1 1 51 51 HIS CA C 51 52.800 52.800 55.491 -2.691 19718
7472 1 16 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.976 -1.276 19718
7473 1 16 . 1 1 53 53 ILE N N 53 122.200 122.200 121.357 0.843 19718
7474 1 16 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.809 -0.799 19718
7475 1 16 . 1 1 53 53 ILE C C 53 174.400 174.400 173.753 0.647 19718
7476 1 16 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.230 0.470 19718
7477 1 16 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.673 -5.373 19718
7478 1 16 . 1 1 53 53 ILE H H 53 8.800 8.800 8.421 0.379 19718
7479 1 16 . 1 1 54 54 VAL N N 54 130.200 130.200 125.697 4.503 19718
7480 1 16 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.595 -0.725 19718
7481 1 16 . 1 1 54 54 VAL C C 54 172.500 172.500 174.904 -2.404 19718
7482 1 16 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.479 1.421 19718
7483 1 16 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.963 -5.363 19718
7484 1 16 . 1 1 54 54 VAL H H 54 8.380 8.380 8.639 -0.259 19718
7485 1 16 . 1 1 55 55 ASP N N 55 129.100 129.100 127.777 1.323 19718
7486 1 16 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.670 -0.080 19718
7487 1 16 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.476 -2.776 19718
7488 1 16 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.766 -1.266 19718
7489 1 16 . 1 1 55 55 ASP H H 55 8.160 8.160 8.086 0.074 19718
7490 1 16 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.336 -0.166 19718
7491 1 16 . 1 1 56 56 PRO C C 56 174.900 174.900 177.514 -2.614 19718
7492 1 16 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.736 -1.736 19718
7493 1 16 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.770 -2.370 19718
7494 1 16 . 1 1 57 57 ASP N N 57 117.100 117.100 118.269 -1.169 19718
7495 1 16 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.391 -0.021 19718
7496 1 16 . 1 1 57 57 ASP C C 57 174.100 174.100 177.215 -3.115 19718
7497 1 16 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.622 -2.922 19718
7498 1 16 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.598 -3.798 19718
7499 1 16 . 1 1 57 57 ASP H H 57 9.110 9.110 8.852 0.258 19718
7500 1 16 . 1 1 58 58 TYR N N 58 115.800 115.800 116.643 -0.843 19718
7501 1 16 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.490 -0.130 19718
7502 1 16 . 1 1 58 58 TYR C C 58 173.200 173.200 177.874 -4.674 19718
7503 1 16 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.665 -2.965 19718
7504 1 16 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.239 -0.339 19718
7505 1 16 . 1 1 58 58 TYR H H 58 8.190 8.190 7.738 0.452 19718
7506 1 16 . 1 1 59 59 TYR N N 59 120.100 120.100 121.034 -0.934 19718
7507 1 16 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.220 -0.440 19718
7508 1 16 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.358 0.742 19718
7509 1 16 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.227 -1.827 19718
7510 1 16 . 1 1 59 59 TYR H H 59 7.420 7.420 8.077 -0.657 19718
7511 1 16 . 1 1 60 60 ASP N N 60 115.200 115.200 117.234 -2.034 19718
7512 1 16 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.400 -0.040 19718
7513 1 16 . 1 1 60 60 ASP C C 60 173.100 173.100 176.347 -3.247 19718
7514 1 16 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.663 -2.263 19718
7515 1 16 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.738 -3.238 19718
7516 1 16 . 1 1 60 60 ASP H H 60 8.440 8.440 8.089 0.351 19718
7517 1 16 . 1 1 61 61 ALA N N 61 120.200 120.200 121.337 -1.137 19718
7518 1 16 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.489 -0.309 19718
7519 1 16 . 1 1 61 61 ALA C C 61 175.000 175.000 177.079 -2.079 19718
7520 1 16 . 1 1 61 61 ALA CA C 61 49.300 49.300 51.715 -2.415 19718
7521 1 16 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.418 -3.218 19718
7522 1 16 . 1 1 61 61 ALA H H 61 7.300 7.300 7.414 -0.114 19718
7523 1 16 . 1 1 62 62 LEU N N 62 118.000 118.000 120.050 -2.050 19718
7524 1 16 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.733 -0.443 19718
7525 1 16 . 1 1 62 62 LEU CA C 62 50.100 50.100 51.804 -1.704 19718
7526 1 16 . 1 1 62 62 LEU CB C 62 38.700 38.700 43.728 -5.028 19718
7527 1 16 . 1 1 62 62 LEU H H 62 6.680 6.680 7.415 -0.735 19718
7528 1 16 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.517 -0.197 19718
7529 1 16 . 1 1 63 63 PRO C C 63 173.500 173.500 175.712 -2.212 19718
7530 1 16 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.317 -2.617 19718
7531 1 16 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.502 -4.002 19718
7532 1 16 . 1 1 64 64 GLU N N 64 124.500 124.500 119.346 5.154 19718
7533 1 16 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.525 -0.345 19718
7534 1 16 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.024 -1.524 19718
7535 1 16 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.215 -4.415 19718
7536 1 16 . 1 1 64 64 GLU H H 64 8.590 8.590 8.271 0.319 19718
7537 1 16 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.526 -0.356 19718
7538 1 16 . 1 1 65 65 PRO C C 65 174.900 174.900 176.386 -1.486 19718
7539 1 16 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.384 0.616 19718
7540 1 16 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.802 -4.302 19718
7541 1 16 . 1 1 66 66 GLU N N 66 123.300 123.300 119.513 3.787 19718
7542 1 16 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.069 0.261 19718
7543 1 16 . 1 1 66 66 GLU C C 66 174.200 174.200 177.436 -3.236 19718
7544 1 16 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.918 -4.418 19718
7545 1 16 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.317 -2.917 19718
7546 1 16 . 1 1 66 66 GLU H H 66 9.080 9.080 8.431 0.649 19718
7547 1 16 . 1 1 67 67 ASP N N 67 120.100 120.100 121.145 -1.045 19718
7548 1 16 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.532 -0.292 19718
7549 1 16 . 1 1 67 67 ASP C C 67 174.900 174.900 176.371 -1.471 19718
7550 1 16 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.608 -1.208 19718
7551 1 16 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.804 -3.004 19718
7552 1 16 . 1 1 67 67 ASP H H 67 8.690 8.690 8.655 0.035 19718
7553 1 16 . 1 1 68 68 ASP N N 68 116.800 116.800 116.529 0.271 19718
7554 1 16 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.529 -0.289 19718
7555 1 16 . 1 1 68 68 ASP C C 68 175.500 175.500 177.093 -1.593 19718
7556 1 16 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.604 -1.304 19718
7557 1 16 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.261 -5.160 19718
7558 1 16 . 1 1 68 68 ASP H H 68 8.400 8.400 8.505 -0.105 19718
7559 1 16 . 1 1 69 69 GLU N N 69 123.600 123.600 118.781 4.819 19718
7560 1 16 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.150 -0.000 19718
7561 1 16 . 1 1 69 69 GLU C C 69 175.200 175.200 178.475 -3.275 19718
7562 1 16 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.622 -2.422 19718
7563 1 16 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.327 -4.327 19718
7564 1 16 . 1 1 69 69 GLU H H 69 7.530 7.530 7.856 -0.326 19718
7565 1 16 . 1 1 70 70 ASN N N 70 119.100 119.100 118.675 0.425 19718
7566 1 16 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.527 -0.167 19718
7567 1 16 . 1 1 70 70 ASN C C 70 175.200 175.200 176.288 -1.088 19718
7568 1 16 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.396 -1.696 19718
7569 1 16 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.598 -2.798 19718
7570 1 16 . 1 1 70 70 ASN H H 70 7.960 7.960 8.796 -0.836 19718
7571 1 16 . 1 1 71 71 ASP N N 71 118.400 118.400 119.543 -1.143 19718
7572 1 16 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.430 -0.180 19718
7573 1 16 . 1 1 71 71 ASP C C 71 176.000 176.000 177.549 -1.549 19718
7574 1 16 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.242 -1.642 19718
7575 1 16 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.585 -3.085 19718
7576 1 16 . 1 1 71 71 ASP H H 71 8.250 8.250 8.288 -0.038 19718
7577 1 16 . 1 1 72 72 MET N N 72 117.300 117.300 116.381 0.919 19718
7578 1 16 . 1 1 72 72 MET HA H 72 4.370 4.370 4.232 0.138 19718
7579 1 16 . 1 1 72 72 MET C C 72 177.800 177.800 177.006 0.794 19718
7580 1 16 . 1 1 72 72 MET CA C 72 53.700 53.700 57.806 -4.106 19718
7581 1 16 . 1 1 72 72 MET CB C 72 32.400 32.400 32.888 -0.488 19718
7582 1 16 . 1 1 72 72 MET H H 72 7.240 7.240 7.499 -0.259 19718
7583 1 16 . 1 1 73 73 LEU N N 73 123.000 123.000 116.104 6.896 19718
7584 1 16 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.429 -0.669 19718
7585 1 16 . 1 1 73 73 LEU C C 73 175.700 175.700 178.909 -3.209 19718
7586 1 16 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.110 -1.210 19718
7587 1 16 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.452 -4.352 19718
7588 1 16 . 1 1 73 73 LEU H H 73 8.600 8.600 7.129 1.471 19718
7589 1 16 . 1 1 74 74 ASP N N 74 118.500 118.500 119.384 -0.884 19718
7590 1 16 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.425 -0.085 19718
7591 1 16 . 1 1 74 74 ASP C C 74 174.700 174.700 178.033 -3.333 19718
7592 1 16 . 1 1 74 74 ASP CA C 74 54.300 54.300 57.020 -2.720 19718
7593 1 16 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.751 -2.551 19718
7594 1 16 . 1 1 74 74 ASP H H 74 7.250 7.250 7.798 -0.548 19718
7595 1 16 . 1 1 75 75 LEU N N 75 116.300 116.300 118.304 -2.004 19718
7596 1 16 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.248 0.052 19718
7597 1 16 . 1 1 75 75 LEU C C 75 174.500 174.500 177.141 -2.641 19718
7598 1 16 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.513 -4.213 19718
7599 1 16 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.839 -2.239 19718
7600 1 16 . 1 1 75 75 LEU H H 75 7.000 7.000 7.378 -0.378 19718
7601 1 16 . 1 1 76 76 ALA N N 76 124.600 124.600 121.282 3.318 19718
7602 1 16 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.257 -0.157 19718
7603 1 16 . 1 1 76 76 ALA C C 76 174.200 174.200 176.065 -1.865 19718
7604 1 16 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.334 -1.834 19718
7605 1 16 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.072 -4.872 19718
7606 1 16 . 1 1 76 76 ALA H H 76 7.590 7.590 7.654 -0.064 19718
7607 1 16 . 1 1 77 77 TYR N N 77 122.900 122.900 124.487 -1.587 19718
7608 1 16 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.352 0.078 19718
7609 1 16 . 1 1 77 77 TYR C C 77 174.100 174.100 176.965 -2.865 19718
7610 1 16 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.188 -4.288 19718
7611 1 16 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.328 -3.428 19718
7612 1 16 . 1 1 77 77 TYR H H 77 8.150 8.150 8.384 -0.234 19718
7613 1 16 . 1 1 78 78 GLY N N 78 112.900 112.900 112.788 0.112 19718
7614 1 16 . 1 1 78 78 GLY C C 78 171.800 171.800 174.039 -2.239 19718
7615 1 16 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.970 -1.270 19718
7616 1 16 . 1 1 78 78 GLY H H 78 8.320 8.320 8.125 0.195 19718
7617 1 16 . 1 1 79 79 LEU N N 79 119.300 119.300 118.419 0.881 19718
7618 1 16 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.250 -0.460 19718
7619 1 16 . 1 1 79 79 LEU C C 79 174.000 174.000 176.070 -2.070 19718
7620 1 16 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.326 -1.326 19718
7621 1 16 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.969 -3.069 19718
7622 1 16 . 1 1 79 79 LEU H H 79 7.120 7.120 7.849 -0.729 19718
7623 1 16 . 1 1 80 80 THR N N 80 118.500 118.500 117.970 0.530 19718
7624 1 16 . 1 1 80 80 THR HA H 80 4.860 4.860 4.441 0.419 19718
7625 1 16 . 1 1 80 80 THR C C 80 173.300 173.300 175.576 -2.276 19718
7626 1 16 . 1 1 80 80 THR CA C 80 57.600 57.600 60.810 -3.210 19718
7627 1 16 . 1 1 80 80 THR CB C 80 71.000 71.000 69.808 1.192 19718
7628 1 16 . 1 1 80 80 THR H H 80 9.240 9.240 7.895 1.345 19718
7629 1 16 . 1 1 81 81 GLU N N 81 118.000 118.000 120.058 -2.058 19718
7630 1 16 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.150 -0.040 19718
7631 1 16 . 1 1 81 81 GLU C C 81 173.900 173.900 176.727 -2.827 19718
7632 1 16 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.628 -3.228 19718
7633 1 16 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.479 -2.779 19718
7634 1 16 . 1 1 81 81 GLU H H 81 9.020 9.020 8.869 0.151 19718
7635 1 16 . 1 1 82 82 THR N N 82 106.400 106.400 105.087 1.313 19718
7636 1 16 . 1 1 82 82 THR HA H 82 3.950 3.950 4.108 -0.158 19718
7637 1 16 . 1 1 82 82 THR C C 82 171.700 171.700 173.194 -1.494 19718
7638 1 16 . 1 1 82 82 THR CA C 82 56.800 56.800 60.431 -3.631 19718
7639 1 16 . 1 1 82 82 THR CB C 82 63.800 63.800 68.515 -4.715 19718
7640 1 16 . 1 1 82 82 THR H H 82 7.630 7.630 7.544 0.086 19718
7641 1 16 . 1 1 83 83 SER N N 83 121.500 121.500 118.997 2.503 19718
7642 1 16 . 1 1 83 83 SER HA H 83 5.080 5.080 4.482 0.598 19718
7643 1 16 . 1 1 83 83 SER C C 83 170.900 170.900 173.389 -2.489 19718
7644 1 16 . 1 1 83 83 SER CA C 83 59.000 59.000 59.155 -0.155 19718
7645 1 16 . 1 1 83 83 SER CB C 83 61.700 61.700 63.937 -2.237 19718
7646 1 16 . 1 1 83 83 SER H H 83 6.930 6.930 7.580 -0.650 19718
7647 1 16 . 1 1 84 84 ARG N N 84 119.300 119.300 126.043 -6.743 19718
7648 1 16 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.714 0.156 19718
7649 1 16 . 1 1 84 84 ARG C C 84 172.400 172.400 174.258 -1.858 19718
7650 1 16 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.826 -5.526 19718
7651 1 16 . 1 1 84 84 ARG CB C 84 32.400 32.400 33.004 -0.604 19718
7652 1 16 . 1 1 84 84 ARG H H 84 9.280 9.280 8.697 0.583 19718
7653 1 16 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.245 0.185 19718
7654 1 16 . 1 1 88 88 GLN C C 88 172.500 172.500 174.692 -2.192 19718
7655 1 16 . 1 1 88 88 GLN CA C 88 51.000 51.000 56.859 -5.859 19718
7656 1 16 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.243 -2.243 19718
7657 1 16 . 1 1 90 90 LYS N N 90 123.700 123.700 126.861 -3.161 19718
7658 1 16 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.916 -0.466 19718
7659 1 16 . 1 1 90 90 LYS C C 90 173.500 173.500 175.535 -2.035 19718
7660 1 16 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.840 -2.340 19718
7661 1 16 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.292 -2.393 19718
7662 1 16 . 1 1 90 90 LYS H H 90 8.330 8.330 8.229 0.101 19718
7663 1 16 . 1 1 91 91 MET N N 91 118.200 118.200 120.322 -2.122 19718
7664 1 16 . 1 1 91 91 MET HA H 91 4.330 4.330 4.654 -0.324 19718
7665 1 16 . 1 1 91 91 MET C C 91 174.300 174.300 176.241 -1.941 19718
7666 1 16 . 1 1 91 91 MET CA C 91 51.800 51.800 55.065 -3.265 19718
7667 1 16 . 1 1 91 91 MET CB C 91 27.200 27.200 31.606 -4.406 19718
7668 1 16 . 1 1 91 91 MET H H 91 8.620 8.620 8.659 -0.039 19718
7669 1 16 . 1 1 92 92 SER N N 92 117.000 117.000 117.353 -0.353 19718
7670 1 16 . 1 1 92 92 SER HA H 92 4.610 4.610 4.849 -0.239 19718
7671 1 16 . 1 1 92 92 SER C C 92 171.300 171.300 174.705 -3.405 19718
7672 1 16 . 1 1 92 92 SER CA C 92 54.000 54.000 57.148 -3.148 19718
7673 1 16 . 1 1 92 92 SER CB C 92 63.700 63.700 66.171 -2.471 19718
7674 1 16 . 1 1 92 92 SER H H 92 6.970 6.970 8.003 -1.033 19718
7675 1 16 . 1 1 93 93 LYS N N 93 121.700 121.700 118.561 3.139 19718
7676 1 16 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.050 -0.080 19718
7677 1 16 . 1 1 93 93 LYS C C 93 175.200 175.200 177.268 -2.068 19718
7678 1 16 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.972 -2.272 19718
7679 1 16 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.826 -2.726 19718
7680 1 16 . 1 1 93 93 LYS H H 93 9.260 9.260 8.693 0.567 19718
7681 1 16 . 1 1 94 94 ASP N N 94 116.700 116.700 119.951 -3.251 19718
7682 1 16 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.569 -0.209 19718
7683 1 16 . 1 1 94 94 ASP C C 94 174.300 174.300 177.426 -3.126 19718
7684 1 16 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.267 -2.567 19718
7685 1 16 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.243 -3.344 19718
7686 1 16 . 1 1 94 94 ASP H H 94 8.020 8.020 7.727 0.293 19718
7687 1 16 . 1 1 95 95 ILE N N 95 109.000 109.000 112.970 -3.970 19718
7688 1 16 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.482 0.178 19718
7689 1 16 . 1 1 95 95 ILE C C 95 170.600 170.600 175.188 -4.588 19718
7690 1 16 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.571 -3.271 19718
7691 1 16 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.366 -3.166 19718
7692 1 16 . 1 1 95 95 ILE H H 95 7.240 7.240 7.553 -0.313 19718
7693 1 16 . 1 1 96 96 ASP N N 96 119.800 119.800 123.190 -3.390 19718
7694 1 16 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.427 -0.247 19718
7695 1 16 . 1 1 96 96 ASP C C 96 174.900 174.900 176.670 -1.770 19718
7696 1 16 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.675 -0.975 19718
7697 1 16 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.316 -0.316 19718
7698 1 16 . 1 1 96 96 ASP H H 96 6.950 6.950 7.858 -0.908 19718
7699 1 16 . 1 1 97 97 GLY N N 97 118.500 118.500 112.839 5.661 19718
7700 1 16 . 1 1 97 97 GLY C C 97 170.500 170.500 173.770 -3.270 19718
7701 1 16 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.432 -2.132 19718
7702 1 16 . 1 1 97 97 GLY H H 97 9.210 9.210 8.310 0.900 19718
7703 1 16 . 1 1 98 98 ILE N N 98 121.300 121.300 121.223 0.077 19718
7704 1 16 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.266 2.334 19718
7705 1 16 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.795 -3.195 19718
7706 1 16 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.738 -4.038 19718
7707 1 16 . 1 1 98 98 ILE H H 98 7.660 7.660 7.978 -0.318 19718
7708 1 16 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.275 0.075 19718
7709 1 16 . 1 1 99 99 ARG C C 99 172.200 172.200 175.228 -3.028 19718
7710 1 16 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.417 -4.317 19718
7711 1 16 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.203 -2.703 19718
7712 1 16 . 1 1 100 100 VAL N N 100 114.900 114.900 116.995 -2.095 19718
7713 1 16 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.136 -0.316 19718
7714 1 16 . 1 1 100 100 VAL C C 100 169.600 169.600 173.309 -3.709 19718
7715 1 16 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.054 -3.854 19718
7716 1 16 . 1 1 100 100 VAL CB C 100 32.300 32.300 35.929 -3.629 19718
7717 1 16 . 1 1 100 100 VAL H H 100 8.440 8.440 8.730 -0.290 19718
7718 1 16 . 1 1 101 101 ALA N N 101 123.400 123.400 123.074 0.326 19718
7719 1 16 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.077 0.233 19718
7720 1 16 . 1 1 101 101 ALA C C 101 174.400 174.400 176.625 -2.225 19718
7721 1 16 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.063 -3.264 19718
7722 1 16 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.274 -3.474 19718
7723 1 16 . 1 1 101 101 ALA H H 101 9.040 9.040 8.803 0.237 19718
7724 1 16 . 1 1 102 102 LEU N N 102 120.600 120.600 119.362 1.238 19718
7725 1 16 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.960 -0.390 19718
7726 1 16 . 1 1 102 102 LEU CA C 102 52.200 52.200 54.704 -2.504 19718
7727 1 16 . 1 1 102 102 LEU CB C 102 37.900 37.900 41.796 -3.896 19718
7728 1 16 . 1 1 102 102 LEU H H 102 8.260 8.260 8.616 -0.356 19718
7729 1 16 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.409 0.171 19718
7730 1 16 . 1 1 112 112 ASN C C 112 171.900 171.900 174.164 -2.264 19718
7731 1 16 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.528 -3.128 19718
7732 1 16 . 1 1 112 112 ASN CB C 112 36.700 36.700 37.557 -0.857 19718
7733 1 16 . 1 1 113 113 ASP N N 113 120.300 120.300 120.411 -0.111 19718
7734 1 16 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.395 0.045 19718
7735 1 16 . 1 1 113 113 ASP C C 113 173.000 173.000 175.612 -2.612 19718
7736 1 16 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.400 -2.800 19718
7737 1 16 . 1 1 113 113 ASP CB C 113 38.100 38.100 41.591 -3.491 19718
7738 1 16 . 1 1 113 113 ASP H H 113 8.040 8.040 8.235 -0.195 19718
7739 1 16 . 1 1 114 114 PHE N N 114 120.100 120.100 119.743 0.357 19718
7740 1 16 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.681 -0.071 19718
7741 1 16 . 1 1 114 114 PHE C C 114 172.200 172.200 176.207 -4.007 19718
7742 1 16 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.491 -3.591 19718
7743 1 16 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.636 -3.136 19718
7744 1 16 . 1 1 114 114 PHE H H 114 8.110 8.110 8.569 -0.459 19718
7745 1 17 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.673 -0.433 19718
7746 1 17 . 1 1 2 2 GLU C C 2 173.400 173.400 176.418 -3.018 19718
7747 1 17 . 1 1 2 2 GLU CA C 2 53.400 53.400 55.634 -2.234 19718
7748 1 17 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.547 -3.547 19718
7749 1 17 . 1 1 3 3 GLU N N 3 121.200 121.200 118.666 2.534 19718
7750 1 17 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.169 0.211 19718
7751 1 17 . 1 1 3 3 GLU C C 3 173.000 173.000 177.104 -4.104 19718
7752 1 17 . 1 1 3 3 GLU CA C 3 54.400 54.400 58.146 -3.746 19718
7753 1 17 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.419 -3.019 19718
7754 1 17 . 1 1 3 3 GLU H H 3 8.510 8.510 8.439 0.071 19718
7755 1 17 . 1 1 4 4 LEU N N 4 122.400 122.400 115.933 6.467 19718
7756 1 17 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.722 -0.172 19718
7757 1 17 . 1 1 4 4 LEU C C 4 172.900 172.900 174.378 -1.478 19718
7758 1 17 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.400 -3.000 19718
7759 1 17 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.451 -4.751 19718
7760 1 17 . 1 1 4 4 LEU H H 4 8.460 8.460 7.936 0.524 19718
7761 1 17 . 1 1 5 5 LYS N N 5 119.300 119.300 119.602 -0.302 19718
7762 1 17 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.379 0.041 19718
7763 1 17 . 1 1 5 5 LYS C C 5 172.400 172.400 174.303 -1.903 19718
7764 1 17 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.657 -2.357 19718
7765 1 17 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.520 -3.521 19718
7766 1 17 . 1 1 5 5 LYS H H 5 8.570 8.570 8.311 0.259 19718
7767 1 17 . 1 1 6 6 ILE N N 6 116.900 116.900 122.244 -5.344 19718
7768 1 17 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.490 -0.380 19718
7769 1 17 . 1 1 6 6 ILE C C 6 169.800 169.800 173.308 -3.508 19718
7770 1 17 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.518 -4.018 19718
7771 1 17 . 1 1 6 6 ILE CB C 6 38.000 38.000 40.878 -2.878 19718
7772 1 17 . 1 1 6 6 ILE H H 6 8.160 8.160 8.835 -0.675 19718
7773 1 17 . 1 1 7 7 THR N N 7 123.000 123.000 125.640 -2.640 19718
7774 1 17 . 1 1 7 7 THR HA H 7 5.220 5.220 4.908 0.312 19718
7775 1 17 . 1 1 7 7 THR C C 7 169.900 169.900 173.550 -3.650 19718
7776 1 17 . 1 1 7 7 THR CA C 7 58.400 58.400 61.437 -3.037 19718
7777 1 17 . 1 1 7 7 THR CB C 7 68.700 68.700 69.535 -0.835 19718
7778 1 17 . 1 1 7 7 THR H H 7 8.520 8.520 8.617 -0.097 19718
7779 1 17 . 1 1 8 8 PHE N N 8 124.000 124.000 124.826 -0.826 19718
7780 1 17 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.603 -0.453 19718
7781 1 17 . 1 1 8 8 PHE C C 8 172.300 172.300 174.805 -2.505 19718
7782 1 17 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.205 -1.605 19718
7783 1 17 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.943 -1.843 19718
7784 1 17 . 1 1 8 8 PHE H H 8 9.290 9.290 9.256 0.034 19718
7785 1 17 . 1 1 9 9 ILE N N 9 122.700 122.700 121.791 0.909 19718
7786 1 17 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.950 -0.370 19718
7787 1 17 . 1 1 9 9 ILE C C 9 173.600 173.600 175.687 -2.087 19718
7788 1 17 . 1 1 9 9 ILE CA C 9 58.200 58.200 59.113 -0.913 19718
7789 1 17 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.687 -3.187 19718
7790 1 17 . 1 1 9 9 ILE H H 9 9.170 9.170 8.750 0.420 19718
7791 1 17 . 1 1 10 10 LEU N N 10 126.700 126.700 127.097 -0.397 19718
7792 1 17 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.324 -0.004 19718
7793 1 17 . 1 1 10 10 LEU C C 10 176.500 176.500 178.724 -2.224 19718
7794 1 17 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.325 -3.125 19718
7795 1 17 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.331 -4.831 19718
7796 1 17 . 1 1 10 10 LEU H H 10 9.100 9.100 9.090 0.010 19718
7797 1 17 . 1 1 11 11 LYS N N 11 118.900 118.900 120.167 -1.267 19718
7798 1 17 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.184 -0.224 19718
7799 1 17 . 1 1 11 11 LYS C C 11 174.100 174.100 177.072 -2.972 19718
7800 1 17 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.388 -0.988 19718
7801 1 17 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.071 -3.171 19718
7802 1 17 . 1 1 11 11 LYS H H 11 8.520 8.520 8.787 -0.267 19718
7803 1 17 . 1 1 12 12 ASP N N 12 114.400 114.400 117.197 -2.797 19718
7804 1 17 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.723 -0.203 19718
7805 1 17 . 1 1 12 12 ASP C C 12 174.500 174.500 176.974 -2.474 19718
7806 1 17 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.441 -3.041 19718
7807 1 17 . 1 1 12 12 ASP CB C 12 37.200 37.200 41.118 -3.918 19718
7808 1 17 . 1 1 12 12 ASP H H 12 7.690 7.690 7.957 -0.267 19718
7809 1 17 . 1 1 13 13 GLY N N 13 109.200 109.200 107.763 1.437 19718
7810 1 17 . 1 1 13 13 GLY C C 13 171.600 171.600 174.365 -2.765 19718
7811 1 17 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.056 -2.655 19718
7812 1 17 . 1 1 13 13 GLY H H 13 8.100 8.100 7.833 0.267 19718
7813 1 17 . 1 1 14 14 SER N N 14 118.000 118.000 115.927 2.073 19718
7814 1 17 . 1 1 14 14 SER HA H 14 4.280 4.280 4.355 -0.075 19718
7815 1 17 . 1 1 14 14 SER C C 14 169.000 169.000 173.438 -4.438 19718
7816 1 17 . 1 1 14 14 SER CA C 14 56.500 56.500 58.722 -2.222 19718
7817 1 17 . 1 1 14 14 SER CB C 14 61.000 61.000 63.708 -2.708 19718
7818 1 17 . 1 1 14 14 SER H H 14 8.110 8.110 7.911 0.199 19718
7819 1 17 . 1 1 15 15 GLN N N 15 116.300 116.300 120.652 -4.352 19718
7820 1 17 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.331 0.329 19718
7821 1 17 . 1 1 15 15 GLN C C 15 173.500 173.500 175.975 -2.475 19718
7822 1 17 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.986 -3.286 19718
7823 1 17 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.729 -2.729 19718
7824 1 17 . 1 1 15 15 GLN H H 15 8.330 8.330 8.502 -0.172 19718
7825 1 17 . 1 1 16 16 LYS N N 16 122.500 122.500 124.505 -2.005 19718
7826 1 17 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.607 -0.277 19718
7827 1 17 . 1 1 16 16 LYS C C 16 171.300 171.300 174.434 -3.134 19718
7828 1 17 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.204 -3.304 19718
7829 1 17 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.408 -1.408 19718
7830 1 17 . 1 1 16 16 LYS H H 16 8.780 8.780 8.792 -0.012 19718
7831 1 17 . 1 1 17 17 THR N N 17 120.000 120.000 119.880 0.120 19718
7832 1 17 . 1 1 17 17 THR HA H 17 5.220 5.220 4.921 0.299 19718
7833 1 17 . 1 1 17 17 THR C C 17 170.500 170.500 173.699 -3.199 19718
7834 1 17 . 1 1 17 17 THR CA C 17 58.700 58.700 60.832 -2.132 19718
7835 1 17 . 1 1 17 17 THR CB C 17 67.900 67.900 69.332 -1.432 19718
7836 1 17 . 1 1 17 17 THR H H 17 8.160 8.160 8.454 -0.294 19718
7837 1 17 . 1 1 18 18 TYR N N 18 125.600 125.600 127.133 -1.533 19718
7838 1 17 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.775 0.065 19718
7839 1 17 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.810 -1.810 19718
7840 1 17 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.700 -2.600 19718
7841 1 17 . 1 1 18 18 TYR H H 18 9.020 9.020 9.032 -0.012 19718
7842 1 17 . 1 1 19 19 GLU C C 19 174.200 174.200 175.756 -1.556 19718
7843 1 17 . 1 1 19 19 GLU CA C 19 52.900 52.900 56.217 -3.317 19718
7844 1 17 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.247 -3.947 19718
7845 1 17 . 1 1 20 20 VAL N N 20 119.000 119.000 118.275 0.725 19718
7846 1 17 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.745 0.095 19718
7847 1 17 . 1 1 20 20 VAL C C 20 171.200 171.200 174.505 -3.305 19718
7848 1 17 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.607 -3.007 19718
7849 1 17 . 1 1 20 20 VAL CB C 20 32.700 32.700 35.728 -3.028 19718
7850 1 17 . 1 1 20 20 VAL H H 20 9.160 9.160 8.996 0.164 19718
7851 1 17 . 1 1 21 21 CYS N N 21 117.500 117.500 119.175 -1.675 19718
7852 1 17 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.747 0.013 19718
7853 1 17 . 1 1 21 21 CYS C C 21 171.400 171.400 174.633 -3.233 19718
7854 1 17 . 1 1 21 21 CYS CA C 21 54.900 54.900 59.036 -4.136 19718
7855 1 17 . 1 1 21 21 CYS CB C 21 27.200 27.200 29.457 -2.257 19718
7856 1 17 . 1 1 21 21 CYS H H 21 8.720 8.720 8.842 -0.122 19718
7857 1 17 . 1 1 22 22 GLU N N 22 120.900 120.900 120.899 0.001 19718
7858 1 17 . 1 1 22 22 GLU HA H 22 3.410 3.410 4.133 -0.723 19718
7859 1 17 . 1 1 22 22 GLU C C 22 174.300 174.300 176.962 -2.662 19718
7860 1 17 . 1 1 22 22 GLU CA C 22 55.100 55.100 56.938 -1.838 19718
7861 1 17 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.508 -2.708 19718
7862 1 17 . 1 1 22 22 GLU H H 22 8.540 8.540 8.458 0.082 19718
7863 1 17 . 1 1 23 23 GLY N N 23 112.400 112.400 112.830 -0.430 19718
7864 1 17 . 1 1 23 23 GLY C C 23 171.000 171.000 174.444 -3.444 19718
7865 1 17 . 1 1 23 23 GLY CA C 23 42.400 42.400 45.157 -2.757 19718
7866 1 17 . 1 1 23 23 GLY H H 23 8.720 8.720 8.983 -0.263 19718
7867 1 17 . 1 1 24 24 GLU N N 24 119.600 119.600 122.543 -2.943 19718
7868 1 17 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.297 0.033 19718
7869 1 17 . 1 1 24 24 GLU C C 24 174.400 174.400 176.148 -1.748 19718
7870 1 17 . 1 1 24 24 GLU CA C 24 54.100 54.100 57.411 -3.311 19718
7871 1 17 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.142 -2.042 19718
7872 1 17 . 1 1 24 24 GLU H H 24 7.060 7.060 8.041 -0.981 19718
7873 1 17 . 1 1 25 25 THR N N 25 113.600 113.600 116.710 -3.110 19718
7874 1 17 . 1 1 25 25 THR HA H 25 5.510 5.510 4.788 0.722 19718
7875 1 17 . 1 1 25 25 THR C C 25 173.100 173.100 175.789 -2.689 19718
7876 1 17 . 1 1 25 25 THR CA C 25 57.000 57.000 60.637 -3.637 19718
7877 1 17 . 1 1 25 25 THR CB C 25 68.700 68.700 70.660 -1.960 19718
7878 1 17 . 1 1 25 25 THR H H 25 9.080 9.080 8.405 0.675 19718
7879 1 17 . 1 1 26 26 ILE N N 26 120.300 120.300 121.957 -1.657 19718
7880 1 17 . 1 1 26 26 ILE HA H 26 3.630 3.630 4.004 -0.374 19718
7881 1 17 . 1 1 26 26 ILE C C 26 174.700 174.700 177.670 -2.970 19718
7882 1 17 . 1 1 26 26 ILE CA C 26 63.700 63.700 63.185 0.515 19718
7883 1 17 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.106 -4.106 19718
7884 1 17 . 1 1 26 26 ILE H H 26 7.860 7.860 8.359 -0.499 19718
7885 1 17 . 1 1 27 27 LEU N N 27 117.600 117.600 119.191 -1.591 19718
7886 1 17 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.016 -0.266 19718
7887 1 17 . 1 1 27 27 LEU C C 27 174.000 174.000 178.748 -4.748 19718
7888 1 17 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.360 -2.460 19718
7889 1 17 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.158 -1.859 19718
7890 1 17 . 1 1 27 27 LEU H H 27 6.580 6.580 8.224 -1.644 19718
7891 1 17 . 1 1 28 28 ASP N N 28 120.000 120.000 121.363 -1.363 19718
7892 1 17 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.426 -0.176 19718
7893 1 17 . 1 1 28 28 ASP C C 28 177.900 177.900 178.864 -0.964 19718
7894 1 17 . 1 1 28 28 ASP CA C 28 55.000 55.000 58.201 -3.201 19718
7895 1 17 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.903 -4.003 19718
7896 1 17 . 1 1 28 28 ASP H H 28 7.880 7.880 8.054 -0.174 19718
7897 1 17 . 1 1 29 29 ILE N N 29 122.100 122.100 120.057 2.043 19718
7898 1 17 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.914 -0.174 19718
7899 1 17 . 1 1 29 29 ILE C C 29 175.700 175.700 177.740 -2.040 19718
7900 1 17 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.817 -2.717 19718
7901 1 17 . 1 1 29 29 ILE CB C 29 36.500 36.500 37.952 -1.452 19718
7902 1 17 . 1 1 29 29 ILE H H 29 8.340 8.340 8.258 0.082 19718
7903 1 17 . 1 1 30 30 ALA N N 30 124.100 124.100 122.848 1.252 19718
7904 1 17 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.638 -0.298 19718
7905 1 17 . 1 1 30 30 ALA C C 30 177.600 177.600 179.597 -1.997 19718
7906 1 17 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.465 -2.665 19718
7907 1 17 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.023 -1.223 19718
7908 1 17 . 1 1 30 30 ALA H H 30 8.430 8.430 8.194 0.236 19718
7909 1 17 . 1 1 31 31 GLN N N 31 116.000 116.000 116.673 -0.673 19718
7910 1 17 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.197 -0.037 19718
7911 1 17 . 1 1 31 31 GLN C C 31 178.100 178.100 178.530 -0.430 19718
7912 1 17 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.610 -0.910 19718
7913 1 17 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.186 -3.986 19718
7914 1 17 . 1 1 31 31 GLN H H 31 8.760 8.760 8.152 0.608 19718
7915 1 17 . 1 1 32 32 GLY N N 32 108.700 108.700 107.297 1.403 19718
7916 1 17 . 1 1 32 32 GLY C C 32 171.700 171.700 175.180 -3.480 19718
7917 1 17 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.092 -2.892 19718
7918 1 17 . 1 1 32 32 GLY H H 32 8.220 8.220 8.300 -0.080 19718
7919 1 17 . 1 1 33 33 HIS N N 33 115.000 115.000 119.585 -4.585 19718
7920 1 17 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.602 -0.172 19718
7921 1 17 . 1 1 33 33 HIS C C 33 169.800 169.800 174.411 -4.611 19718
7922 1 17 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.250 -2.850 19718
7923 1 17 . 1 1 33 33 HIS CB C 33 25.500 25.500 31.086 -5.586 19718
7924 1 17 . 1 1 33 33 HIS H H 33 6.980 6.980 8.085 -1.105 19718
7925 1 17 . 1 1 34 34 ASN N N 34 113.700 113.700 115.649 -1.949 19718
7926 1 17 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.398 -0.068 19718
7927 1 17 . 1 1 34 34 ASN C C 34 172.000 172.000 174.905 -2.905 19718
7928 1 17 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.709 -1.609 19718
7929 1 17 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.634 -2.634 19718
7930 1 17 . 1 1 34 34 ASN H H 34 7.700 7.700 7.839 -0.139 19718
7931 1 17 . 1 1 35 35 LEU N N 35 115.600 115.600 119.424 -3.824 19718
7932 1 17 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.182 0.068 19718
7933 1 17 . 1 1 35 35 LEU C C 35 174.900 174.900 177.757 -2.857 19718
7934 1 17 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.208 -3.908 19718
7935 1 17 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.427 -3.227 19718
7936 1 17 . 1 1 35 35 LEU H H 35 7.980 7.980 7.852 0.128 19718
7937 1 17 . 1 1 36 36 ASP N N 36 120.100 120.100 124.590 -4.490 19718
7938 1 17 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.637 -0.207 19718
7939 1 17 . 1 1 36 36 ASP C C 36 171.100 171.100 174.881 -3.781 19718
7940 1 17 . 1 1 36 36 ASP CA C 36 51.000 51.000 53.962 -2.962 19718
7941 1 17 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.815 -3.615 19718
7942 1 17 . 1 1 36 36 ASP H H 36 8.610 8.610 8.584 0.026 19718
7943 1 17 . 1 1 37 37 MET N N 37 123.900 123.900 120.090 3.810 19718
7944 1 17 . 1 1 37 37 MET HA H 37 4.280 4.280 4.821 -0.541 19718
7945 1 17 . 1 1 37 37 MET C C 37 171.200 171.200 174.112 -2.912 19718
7946 1 17 . 1 1 37 37 MET CA C 37 52.800 52.800 54.570 -1.770 19718
7947 1 17 . 1 1 37 37 MET CB C 37 33.000 33.000 36.215 -3.215 19718
7948 1 17 . 1 1 37 37 MET H H 37 7.670 7.670 7.765 -0.095 19718
7949 1 17 . 1 1 38 38 GLU N N 38 128.600 128.600 120.079 8.521 19718
7950 1 17 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.622 -0.332 19718
7951 1 17 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.042 -1.842 19718
7952 1 17 . 1 1 38 38 GLU CB C 38 29.400 29.400 30.008 -0.608 19718
7953 1 17 . 1 1 38 38 GLU H H 38 9.060 9.060 8.335 0.725 19718
7954 1 17 . 1 1 51 51 HIS C C 51 170.700 170.700 174.487 -3.787 19718
7955 1 17 . 1 1 51 51 HIS CA C 51 52.800 52.800 55.699 -2.899 19718
7956 1 17 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.714 -3.014 19718
7957 1 17 . 1 1 53 53 ILE N N 53 122.200 122.200 120.188 2.012 19718
7958 1 17 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.769 -0.759 19718
7959 1 17 . 1 1 53 53 ILE C C 53 174.400 174.400 173.376 1.024 19718
7960 1 17 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.837 -0.137 19718
7961 1 17 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.858 -5.558 19718
7962 1 17 . 1 1 53 53 ILE H H 53 8.800 8.800 8.381 0.419 19718
7963 1 17 . 1 1 54 54 VAL N N 54 130.200 130.200 126.026 4.174 19718
7964 1 17 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.808 -0.938 19718
7965 1 17 . 1 1 54 54 VAL C C 54 172.500 172.500 175.282 -2.782 19718
7966 1 17 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.902 0.998 19718
7967 1 17 . 1 1 54 54 VAL CB C 54 29.600 29.600 34.613 -5.013 19718
7968 1 17 . 1 1 54 54 VAL H H 54 8.380 8.380 8.569 -0.189 19718
7969 1 17 . 1 1 55 55 ASP N N 55 129.100 129.100 127.420 1.680 19718
7970 1 17 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.670 -0.080 19718
7971 1 17 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.678 -2.978 19718
7972 1 17 . 1 1 55 55 ASP CB C 55 40.500 40.500 42.184 -1.683 19718
7973 1 17 . 1 1 55 55 ASP H H 55 8.160 8.160 8.136 0.024 19718
7974 1 17 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.370 -0.200 19718
7975 1 17 . 1 1 56 56 PRO C C 56 174.900 174.900 176.973 -2.073 19718
7976 1 17 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.699 -1.699 19718
7977 1 17 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.772 -2.372 19718
7978 1 17 . 1 1 57 57 ASP N N 57 117.100 117.100 118.640 -1.540 19718
7979 1 17 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.394 -0.024 19718
7980 1 17 . 1 1 57 57 ASP C C 57 174.100 174.100 177.529 -3.429 19718
7981 1 17 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.979 -3.279 19718
7982 1 17 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.831 -4.030 19718
7983 1 17 . 1 1 57 57 ASP H H 57 9.110 9.110 8.895 0.215 19718
7984 1 17 . 1 1 58 58 TYR N N 58 115.800 115.800 117.466 -1.666 19718
7985 1 17 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.556 -0.196 19718
7986 1 17 . 1 1 58 58 TYR C C 58 173.200 173.200 176.707 -3.507 19718
7987 1 17 . 1 1 58 58 TYR CA C 58 56.700 56.700 58.528 -1.828 19718
7988 1 17 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.016 -0.116 19718
7989 1 17 . 1 1 58 58 TYR H H 58 8.190 8.190 7.687 0.503 19718
7990 1 17 . 1 1 59 59 TYR N N 59 120.100 120.100 120.519 -0.419 19718
7991 1 17 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.191 -0.411 19718
7992 1 17 . 1 1 59 59 TYR CA C 59 60.100 60.100 59.482 0.618 19718
7993 1 17 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.525 -2.125 19718
7994 1 17 . 1 1 59 59 TYR H H 59 7.420 7.420 8.063 -0.643 19718
7995 1 17 . 1 1 60 60 ASP N N 60 115.200 115.200 118.528 -3.328 19718
7996 1 17 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.517 -0.157 19718
7997 1 17 . 1 1 60 60 ASP C C 60 173.100 173.100 175.947 -2.847 19718
7998 1 17 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.581 -2.181 19718
7999 1 17 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.249 -2.749 19718
8000 1 17 . 1 1 60 60 ASP H H 60 8.440 8.440 7.884 0.556 19718
8001 1 17 . 1 1 61 61 ALA N N 61 120.200 120.200 120.062 0.138 19718
8002 1 17 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.341 -0.161 19718
8003 1 17 . 1 1 61 61 ALA C C 61 175.000 175.000 176.928 -1.928 19718
8004 1 17 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.188 -2.888 19718
8005 1 17 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.941 -3.740 19718
8006 1 17 . 1 1 61 61 ALA H H 61 7.300 7.300 7.714 -0.414 19718
8007 1 17 . 1 1 62 62 LEU N N 62 118.000 118.000 121.887 -3.887 19718
8008 1 17 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.595 -0.305 19718
8009 1 17 . 1 1 62 62 LEU CA C 62 50.100 50.100 53.474 -3.374 19718
8010 1 17 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.078 -3.377 19718
8011 1 17 . 1 1 62 62 LEU H H 62 6.680 6.680 7.607 -0.927 19718
8012 1 17 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.596 -0.276 19718
8013 1 17 . 1 1 63 63 PRO C C 63 173.500 173.500 176.127 -2.627 19718
8014 1 17 . 1 1 63 63 PRO CA C 63 59.700 59.700 61.987 -2.287 19718
8015 1 17 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.539 -4.039 19718
8016 1 17 . 1 1 64 64 GLU N N 64 124.500 124.500 119.793 4.707 19718
8017 1 17 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.513 -0.333 19718
8018 1 17 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.687 -2.187 19718
8019 1 17 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.157 -4.357 19718
8020 1 17 . 1 1 64 64 GLU H H 64 8.590 8.590 8.389 0.201 19718
8021 1 17 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.566 -0.396 19718
8022 1 17 . 1 1 65 65 PRO C C 65 174.900 174.900 176.705 -1.805 19718
8023 1 17 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.449 0.551 19718
8024 1 17 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.788 -4.288 19718
8025 1 17 . 1 1 66 66 GLU N N 66 123.300 123.300 118.944 4.356 19718
8026 1 17 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.133 0.197 19718
8027 1 17 . 1 1 66 66 GLU C C 66 174.200 174.200 177.180 -2.980 19718
8028 1 17 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.792 -4.292 19718
8029 1 17 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.387 -2.987 19718
8030 1 17 . 1 1 66 66 GLU H H 66 9.080 9.080 8.598 0.482 19718
8031 1 17 . 1 1 67 67 ASP N N 67 120.100 120.100 120.660 -0.560 19718
8032 1 17 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.549 -0.309 19718
8033 1 17 . 1 1 67 67 ASP C C 67 174.900 174.900 177.327 -2.427 19718
8034 1 17 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.744 -1.344 19718
8035 1 17 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.927 -3.127 19718
8036 1 17 . 1 1 67 67 ASP H H 67 8.690 8.690 8.837 -0.147 19718
8037 1 17 . 1 1 68 68 ASP N N 68 116.800 116.800 116.514 0.286 19718
8038 1 17 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.556 -0.316 19718
8039 1 17 . 1 1 68 68 ASP C C 68 175.500 175.500 177.438 -1.938 19718
8040 1 17 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.617 -1.317 19718
8041 1 17 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.811 -4.711 19718
8042 1 17 . 1 1 68 68 ASP H H 68 8.400 8.400 8.380 0.020 19718
8043 1 17 . 1 1 69 69 GLU N N 69 123.600 123.600 118.931 4.669 19718
8044 1 17 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.225 -0.075 19718
8045 1 17 . 1 1 69 69 GLU C C 69 175.200 175.200 178.619 -3.419 19718
8046 1 17 . 1 1 69 69 GLU CA C 69 56.200 56.200 57.924 -1.724 19718
8047 1 17 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.183 -4.183 19718
8048 1 17 . 1 1 69 69 GLU H H 69 7.530 7.530 7.843 -0.313 19718
8049 1 17 . 1 1 70 70 ASN N N 70 119.100 119.100 118.902 0.198 19718
8050 1 17 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.454 -0.094 19718
8051 1 17 . 1 1 70 70 ASN C C 70 175.200 175.200 176.765 -1.565 19718
8052 1 17 . 1 1 70 70 ASN CA C 70 53.700 53.700 56.019 -2.319 19718
8053 1 17 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.747 -2.947 19718
8054 1 17 . 1 1 70 70 ASN H H 70 7.960 7.960 8.653 -0.693 19718
8055 1 17 . 1 1 71 71 ASP N N 71 118.400 118.400 119.588 -1.188 19718
8056 1 17 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.425 -0.175 19718
8057 1 17 . 1 1 71 71 ASP C C 71 176.000 176.000 177.330 -1.330 19718
8058 1 17 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.928 -2.328 19718
8059 1 17 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.822 -3.322 19718
8060 1 17 . 1 1 71 71 ASP H H 71 8.250 8.250 8.042 0.208 19718
8061 1 17 . 1 1 72 72 MET N N 72 117.300 117.300 116.154 1.146 19718
8062 1 17 . 1 1 72 72 MET HA H 72 4.370 4.370 4.327 0.043 19718
8063 1 17 . 1 1 72 72 MET C C 72 177.800 177.800 177.729 0.071 19718
8064 1 17 . 1 1 72 72 MET CA C 72 53.700 53.700 56.494 -2.794 19718
8065 1 17 . 1 1 72 72 MET CB C 72 32.400 32.400 32.066 0.334 19718
8066 1 17 . 1 1 72 72 MET H H 72 7.240 7.240 7.695 -0.455 19718
8067 1 17 . 1 1 73 73 LEU N N 73 123.000 123.000 120.963 2.037 19718
8068 1 17 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.218 -0.458 19718
8069 1 17 . 1 1 73 73 LEU C C 73 175.700 175.700 179.125 -3.425 19718
8070 1 17 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.605 -2.705 19718
8071 1 17 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.685 -3.585 19718
8072 1 17 . 1 1 73 73 LEU H H 73 8.600 8.600 7.389 1.211 19718
8073 1 17 . 1 1 74 74 ASP N N 74 118.500 118.500 119.018 -0.518 19718
8074 1 17 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.347 -0.007 19718
8075 1 17 . 1 1 74 74 ASP C C 74 174.700 174.700 177.670 -2.970 19718
8076 1 17 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.737 -2.437 19718
8077 1 17 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.654 -2.454 19718
8078 1 17 . 1 1 74 74 ASP H H 74 7.250 7.250 7.753 -0.503 19718
8079 1 17 . 1 1 75 75 LEU N N 75 116.300 116.300 118.125 -1.825 19718
8080 1 17 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.200 0.100 19718
8081 1 17 . 1 1 75 75 LEU C C 75 174.500 174.500 177.294 -2.794 19718
8082 1 17 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.612 -4.312 19718
8083 1 17 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.754 -2.154 19718
8084 1 17 . 1 1 75 75 LEU H H 75 7.000 7.000 7.415 -0.415 19718
8085 1 17 . 1 1 76 76 ALA N N 76 124.600 124.600 120.935 3.665 19718
8086 1 17 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.482 -0.382 19718
8087 1 17 . 1 1 76 76 ALA C C 76 174.200 174.200 175.942 -1.742 19718
8088 1 17 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.194 -1.694 19718
8089 1 17 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.677 -5.477 19718
8090 1 17 . 1 1 76 76 ALA H H 76 7.590 7.590 7.478 0.112 19718
8091 1 17 . 1 1 77 77 TYR N N 77 122.900 122.900 121.255 1.645 19718
8092 1 17 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.291 0.139 19718
8093 1 17 . 1 1 77 77 TYR C C 77 174.100 174.100 177.027 -2.927 19718
8094 1 17 . 1 1 77 77 TYR CA C 77 54.900 54.900 58.840 -3.940 19718
8095 1 17 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.289 -3.389 19718
8096 1 17 . 1 1 77 77 TYR H H 77 8.150 8.150 8.388 -0.238 19718
8097 1 17 . 1 1 78 78 GLY N N 78 112.900 112.900 113.361 -0.461 19718
8098 1 17 . 1 1 78 78 GLY C C 78 171.800 171.800 173.559 -1.759 19718
8099 1 17 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.638 -0.938 19718
8100 1 17 . 1 1 78 78 GLY H H 78 8.320 8.320 7.753 0.567 19718
8101 1 17 . 1 1 79 79 LEU N N 79 119.300 119.300 118.828 0.472 19718
8102 1 17 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.178 -0.388 19718
8103 1 17 . 1 1 79 79 LEU C C 79 174.000 174.000 176.949 -2.949 19718
8104 1 17 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.296 -1.296 19718
8105 1 17 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.598 -2.698 19718
8106 1 17 . 1 1 79 79 LEU H H 79 7.120 7.120 7.916 -0.796 19718
8107 1 17 . 1 1 80 80 THR N N 80 118.500 118.500 121.119 -2.619 19718
8108 1 17 . 1 1 80 80 THR HA H 80 4.860 4.860 4.475 0.385 19718
8109 1 17 . 1 1 80 80 THR C C 80 173.300 173.300 175.276 -1.976 19718
8110 1 17 . 1 1 80 80 THR CA C 80 57.600 57.600 60.891 -3.291 19718
8111 1 17 . 1 1 80 80 THR CB C 80 71.000 71.000 69.975 1.025 19718
8112 1 17 . 1 1 80 80 THR H H 80 9.240 9.240 7.908 1.332 19718
8113 1 17 . 1 1 81 81 GLU N N 81 118.000 118.000 119.807 -1.807 19718
8114 1 17 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.083 0.027 19718
8115 1 17 . 1 1 81 81 GLU C C 81 173.900 173.900 176.558 -2.658 19718
8116 1 17 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.077 -2.677 19718
8117 1 17 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.409 -2.709 19718
8118 1 17 . 1 1 81 81 GLU H H 81 9.020 9.020 8.760 0.260 19718
8119 1 17 . 1 1 82 82 THR N N 82 106.400 106.400 106.184 0.216 19718
8120 1 17 . 1 1 82 82 THR HA H 82 3.950 3.950 2.873 1.077 19718
8121 1 17 . 1 1 82 82 THR C C 82 171.700 171.700 173.752 -2.052 19718
8122 1 17 . 1 1 82 82 THR CA C 82 56.800 56.800 59.869 -3.069 19718
8123 1 17 . 1 1 82 82 THR CB C 82 63.800 63.800 68.213 -4.413 19718
8124 1 17 . 1 1 82 82 THR H H 82 7.630 7.630 7.459 0.171 19718
8125 1 17 . 1 1 83 83 SER N N 83 121.500 121.500 118.235 3.265 19718
8126 1 17 . 1 1 83 83 SER HA H 83 5.080 5.080 4.514 0.566 19718
8127 1 17 . 1 1 83 83 SER C C 83 170.900 170.900 173.892 -2.992 19718
8128 1 17 . 1 1 83 83 SER CA C 83 59.000 59.000 60.154 -1.154 19718
8129 1 17 . 1 1 83 83 SER CB C 83 61.700 61.700 63.928 -2.228 19718
8130 1 17 . 1 1 83 83 SER H H 83 6.930 6.930 7.564 -0.634 19718
8131 1 17 . 1 1 84 84 ARG N N 84 119.300 119.300 122.987 -3.687 19718
8132 1 17 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.830 0.040 19718
8133 1 17 . 1 1 84 84 ARG C C 84 172.400 172.400 174.514 -2.114 19718
8134 1 17 . 1 1 84 84 ARG CA C 84 49.300 49.300 54.092 -4.792 19718
8135 1 17 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.918 -2.518 19718
8136 1 17 . 1 1 84 84 ARG H H 84 9.280 9.280 9.015 0.265 19718
8137 1 17 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.463 -0.033 19718
8138 1 17 . 1 1 88 88 GLN C C 88 172.500 172.500 175.384 -2.884 19718
8139 1 17 . 1 1 88 88 GLN CA C 88 51.000 51.000 56.363 -5.363 19718
8140 1 17 . 1 1 88 88 GLN CB C 88 27.000 27.000 31.319 -4.319 19718
8141 1 17 . 1 1 90 90 LYS N N 90 123.700 123.700 125.441 -1.741 19718
8142 1 17 . 1 1 90 90 LYS HA H 90 4.450 4.450 4.975 -0.525 19718
8143 1 17 . 1 1 90 90 LYS C C 90 173.500 173.500 175.496 -1.996 19718
8144 1 17 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.546 -2.046 19718
8145 1 17 . 1 1 90 90 LYS CB C 90 31.900 31.900 35.080 -3.179 19718
8146 1 17 . 1 1 90 90 LYS H H 90 8.330 8.330 7.849 0.481 19718
8147 1 17 . 1 1 91 91 MET N N 91 118.200 118.200 120.436 -2.236 19718
8148 1 17 . 1 1 91 91 MET HA H 91 4.330 4.330 4.684 -0.354 19718
8149 1 17 . 1 1 91 91 MET C C 91 174.300 174.300 175.607 -1.307 19718
8150 1 17 . 1 1 91 91 MET CA C 91 51.800 51.800 54.705 -2.905 19718
8151 1 17 . 1 1 91 91 MET CB C 91 27.200 27.200 31.688 -4.488 19718
8152 1 17 . 1 1 91 91 MET H H 91 8.620 8.620 8.494 0.126 19718
8153 1 17 . 1 1 92 92 SER N N 92 117.000 117.000 118.339 -1.339 19718
8154 1 17 . 1 1 92 92 SER HA H 92 4.610 4.610 4.794 -0.184 19718
8155 1 17 . 1 1 92 92 SER C C 92 171.300 171.300 174.958 -3.658 19718
8156 1 17 . 1 1 92 92 SER CA C 92 54.000 54.000 56.784 -2.784 19718
8157 1 17 . 1 1 92 92 SER CB C 92 63.700 63.700 65.758 -2.058 19718
8158 1 17 . 1 1 92 92 SER H H 92 6.970 6.970 8.444 -1.474 19718
8159 1 17 . 1 1 93 93 LYS N N 93 121.700 121.700 120.479 1.221 19718
8160 1 17 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.048 -0.078 19718
8161 1 17 . 1 1 93 93 LYS C C 93 175.200 175.200 177.879 -2.679 19718
8162 1 17 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.397 -2.696 19718
8163 1 17 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.076 -2.976 19718
8164 1 17 . 1 1 93 93 LYS H H 93 9.260 9.260 8.722 0.538 19718
8165 1 17 . 1 1 94 94 ASP N N 94 116.700 116.700 119.213 -2.513 19718
8166 1 17 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.549 -0.189 19718
8167 1 17 . 1 1 94 94 ASP C C 94 174.300 174.300 177.652 -3.352 19718
8168 1 17 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.471 -2.771 19718
8169 1 17 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.048 -3.148 19718
8170 1 17 . 1 1 94 94 ASP H H 94 8.020 8.020 8.164 -0.144 19718
8171 1 17 . 1 1 95 95 ILE N N 95 109.000 109.000 113.103 -4.103 19718
8172 1 17 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.350 0.310 19718
8173 1 17 . 1 1 95 95 ILE C C 95 170.600 170.600 174.860 -4.260 19718
8174 1 17 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.547 -3.247 19718
8175 1 17 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.330 -3.130 19718
8176 1 17 . 1 1 95 95 ILE H H 95 7.240 7.240 7.648 -0.408 19718
8177 1 17 . 1 1 96 96 ASP N N 96 119.800 119.800 122.073 -2.273 19718
8178 1 17 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.447 -0.267 19718
8179 1 17 . 1 1 96 96 ASP C C 96 174.900 174.900 176.623 -1.723 19718
8180 1 17 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.868 -1.168 19718
8181 1 17 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.721 -0.721 19718
8182 1 17 . 1 1 96 96 ASP H H 96 6.950 6.950 7.727 -0.777 19718
8183 1 17 . 1 1 97 97 GLY N N 97 118.500 118.500 113.624 4.876 19718
8184 1 17 . 1 1 97 97 GLY C C 97 170.500 170.500 173.951 -3.451 19718
8185 1 17 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.316 -2.015 19718
8186 1 17 . 1 1 97 97 GLY H H 97 9.210 9.210 8.288 0.922 19718
8187 1 17 . 1 1 98 98 ILE N N 98 121.300 121.300 121.359 -0.059 19718
8188 1 17 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.403 2.197 19718
8189 1 17 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.840 -3.240 19718
8190 1 17 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.517 -3.817 19718
8191 1 17 . 1 1 98 98 ILE H H 98 7.660 7.660 8.022 -0.362 19718
8192 1 17 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.307 0.043 19718
8193 1 17 . 1 1 99 99 ARG C C 99 172.200 172.200 175.160 -2.960 19718
8194 1 17 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.227 -4.127 19718
8195 1 17 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.290 -2.790 19718
8196 1 17 . 1 1 100 100 VAL N N 100 114.900 114.900 116.292 -1.392 19718
8197 1 17 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.187 -0.367 19718
8198 1 17 . 1 1 100 100 VAL C C 100 169.600 169.600 173.219 -3.619 19718
8199 1 17 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.455 -4.255 19718
8200 1 17 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.537 -4.237 19718
8201 1 17 . 1 1 100 100 VAL H H 100 8.440 8.440 8.926 -0.486 19718
8202 1 17 . 1 1 101 101 ALA N N 101 123.400 123.400 121.729 1.671 19718
8203 1 17 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.226 0.084 19718
8204 1 17 . 1 1 101 101 ALA C C 101 174.400 174.400 175.788 -1.388 19718
8205 1 17 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.613 -2.813 19718
8206 1 17 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.256 -3.456 19718
8207 1 17 . 1 1 101 101 ALA H H 101 9.040 9.040 8.718 0.322 19718
8208 1 17 . 1 1 102 102 LEU N N 102 120.600 120.600 121.280 -0.680 19718
8209 1 17 . 1 1 102 102 LEU HA H 102 4.570 4.570 4.762 -0.192 19718
8210 1 17 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.737 0.463 19718
8211 1 17 . 1 1 102 102 LEU CB C 102 37.900 37.900 43.325 -5.425 19718
8212 1 17 . 1 1 102 102 LEU H H 102 8.260 8.260 7.814 0.446 19718
8213 1 17 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.886 -0.306 19718
8214 1 17 . 1 1 112 112 ASN C C 112 171.900 171.900 173.019 -1.119 19718
8215 1 17 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.082 -2.682 19718
8216 1 17 . 1 1 112 112 ASN CB C 112 36.700 36.700 41.561 -4.861 19718
8217 1 17 . 1 1 113 113 ASP N N 113 120.300 120.300 120.910 -0.610 19718
8218 1 17 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.849 -0.409 19718
8219 1 17 . 1 1 113 113 ASP C C 113 173.000 173.000 175.108 -2.108 19718
8220 1 17 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.472 -2.872 19718
8221 1 17 . 1 1 113 113 ASP CB C 113 38.100 38.100 42.926 -4.826 19718
8222 1 17 . 1 1 113 113 ASP H H 113 8.040 8.040 8.426 -0.386 19718
8223 1 17 . 1 1 114 114 PHE N N 114 120.100 120.100 124.178 -4.078 19718
8224 1 17 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.692 -0.082 19718
8225 1 17 . 1 1 114 114 PHE C C 114 172.200 172.200 174.795 -2.595 19718
8226 1 17 . 1 1 114 114 PHE CA C 114 54.900 54.900 57.935 -3.035 19718
8227 1 17 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.171 -2.671 19718
8228 1 17 . 1 1 114 114 PHE H H 114 8.110 8.110 8.534 -0.424 19718
8229 1 18 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.259 -0.019 19718
8230 1 18 . 1 1 2 2 GLU C C 2 173.400 173.400 174.877 -1.477 19718
8231 1 18 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.170 -2.770 19718
8232 1 18 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.119 -3.119 19718
8233 1 18 . 1 1 3 3 GLU N N 3 121.200 121.200 121.961 -0.761 19718
8234 1 18 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.851 -0.471 19718
8235 1 18 . 1 1 3 3 GLU C C 3 173.000 173.000 175.897 -2.897 19718
8236 1 18 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.348 -1.948 19718
8237 1 18 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.740 -3.340 19718
8238 1 18 . 1 1 3 3 GLU H H 3 8.510 8.510 8.056 0.454 19718
8239 1 18 . 1 1 4 4 LEU N N 4 122.400 122.400 124.775 -2.375 19718
8240 1 18 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.699 -0.149 19718
8241 1 18 . 1 1 4 4 LEU C C 4 172.900 172.900 175.053 -2.153 19718
8242 1 18 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.376 -2.976 19718
8243 1 18 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.569 -4.869 19718
8244 1 18 . 1 1 4 4 LEU H H 4 8.460 8.460 8.923 -0.463 19718
8245 1 18 . 1 1 5 5 LYS N N 5 119.300 119.300 119.153 0.147 19718
8246 1 18 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.378 0.042 19718
8247 1 18 . 1 1 5 5 LYS C C 5 172.400 172.400 175.663 -3.263 19718
8248 1 18 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.681 -2.381 19718
8249 1 18 . 1 1 5 5 LYS CB C 5 33.000 33.000 34.847 -1.847 19718
8250 1 18 . 1 1 5 5 LYS H H 5 8.570 8.570 8.377 0.193 19718
8251 1 18 . 1 1 6 6 ILE N N 6 116.900 116.900 120.984 -4.084 19718
8252 1 18 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.172 -0.062 19718
8253 1 18 . 1 1 6 6 ILE C C 6 169.800 169.800 173.150 -3.350 19718
8254 1 18 . 1 1 6 6 ILE CA C 6 55.500 55.500 60.096 -4.596 19718
8255 1 18 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.551 -3.551 19718
8256 1 18 . 1 1 6 6 ILE H H 6 8.160 8.160 8.800 -0.640 19718
8257 1 18 . 1 1 7 7 THR N N 7 123.000 123.000 125.278 -2.278 19718
8258 1 18 . 1 1 7 7 THR HA H 7 5.220 5.220 5.157 0.063 19718
8259 1 18 . 1 1 7 7 THR C C 7 169.900 169.900 173.475 -3.575 19718
8260 1 18 . 1 1 7 7 THR CA C 7 58.400 58.400 61.207 -2.807 19718
8261 1 18 . 1 1 7 7 THR CB C 7 68.700 68.700 69.776 -1.076 19718
8262 1 18 . 1 1 7 7 THR H H 7 8.520 8.520 8.262 0.258 19718
8263 1 18 . 1 1 8 8 PHE N N 8 124.000 124.000 124.428 -0.428 19718
8264 1 18 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.524 -0.374 19718
8265 1 18 . 1 1 8 8 PHE C C 8 172.300 172.300 175.236 -2.936 19718
8266 1 18 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.151 -1.551 19718
8267 1 18 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.502 -1.402 19718
8268 1 18 . 1 1 8 8 PHE H H 8 9.290 9.290 9.341 -0.051 19718
8269 1 18 . 1 1 9 9 ILE N N 9 122.700 122.700 122.600 0.100 19718
8270 1 18 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.624 -0.044 19718
8271 1 18 . 1 1 9 9 ILE C C 9 173.600 173.600 176.155 -2.555 19718
8272 1 18 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.969 -2.769 19718
8273 1 18 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.917 -3.417 19718
8274 1 18 . 1 1 9 9 ILE H H 9 9.170 9.170 8.829 0.341 19718
8275 1 18 . 1 1 10 10 LEU N N 10 126.700 126.700 127.562 -0.862 19718
8276 1 18 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.354 -0.034 19718
8277 1 18 . 1 1 10 10 LEU C C 10 176.500 176.500 178.790 -2.290 19718
8278 1 18 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.045 -2.845 19718
8279 1 18 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.161 -4.661 19718
8280 1 18 . 1 1 10 10 LEU H H 10 9.100 9.100 9.066 0.034 19718
8281 1 18 . 1 1 11 11 LYS N N 11 118.900 118.900 120.245 -1.345 19718
8282 1 18 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.125 -0.165 19718
8283 1 18 . 1 1 11 11 LYS C C 11 174.100 174.100 177.697 -3.597 19718
8284 1 18 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.845 -1.445 19718
8285 1 18 . 1 1 11 11 LYS CB C 11 28.900 28.900 31.853 -2.953 19718
8286 1 18 . 1 1 11 11 LYS H H 11 8.520 8.520 8.898 -0.378 19718
8287 1 18 . 1 1 12 12 ASP N N 12 114.400 114.400 118.524 -4.124 19718
8288 1 18 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.569 -0.049 19718
8289 1 18 . 1 1 12 12 ASP C C 12 174.500 174.500 177.008 -2.508 19718
8290 1 18 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.803 -3.403 19718
8291 1 18 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.987 -3.787 19718
8292 1 18 . 1 1 12 12 ASP H H 12 7.690 7.690 7.994 -0.304 19718
8293 1 18 . 1 1 13 13 GLY N N 13 109.200 109.200 106.505 2.695 19718
8294 1 18 . 1 1 13 13 GLY C C 13 171.600 171.600 174.332 -2.732 19718
8295 1 18 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.529 -3.130 19718
8296 1 18 . 1 1 13 13 GLY H H 13 8.100 8.100 8.145 -0.045 19718
8297 1 18 . 1 1 14 14 SER N N 14 118.000 118.000 115.533 2.467 19718
8298 1 18 . 1 1 14 14 SER HA H 14 4.280 4.280 4.412 -0.132 19718
8299 1 18 . 1 1 14 14 SER C C 14 169.000 169.000 173.777 -4.777 19718
8300 1 18 . 1 1 14 14 SER CA C 14 56.500 56.500 58.211 -1.711 19718
8301 1 18 . 1 1 14 14 SER CB C 14 61.000 61.000 64.042 -3.042 19718
8302 1 18 . 1 1 14 14 SER H H 14 8.110 8.110 7.979 0.131 19718
8303 1 18 . 1 1 15 15 GLN N N 15 116.300 116.300 120.887 -4.587 19718
8304 1 18 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.311 0.349 19718
8305 1 18 . 1 1 15 15 GLN C C 15 173.500 173.500 176.104 -2.604 19718
8306 1 18 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.870 -3.170 19718
8307 1 18 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.300 -2.300 19718
8308 1 18 . 1 1 15 15 GLN H H 15 8.330 8.330 8.520 -0.190 19718
8309 1 18 . 1 1 16 16 LYS N N 16 122.500 122.500 124.309 -1.809 19718
8310 1 18 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.615 -0.285 19718
8311 1 18 . 1 1 16 16 LYS C C 16 171.300 171.300 174.567 -3.267 19718
8312 1 18 . 1 1 16 16 LYS CA C 16 51.900 51.900 54.975 -3.075 19718
8313 1 18 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.640 -1.640 19718
8314 1 18 . 1 1 16 16 LYS H H 16 8.780 8.780 8.713 0.067 19718
8315 1 18 . 1 1 17 17 THR N N 17 120.000 120.000 119.930 0.070 19718
8316 1 18 . 1 1 17 17 THR HA H 17 5.220 5.220 4.902 0.318 19718
8317 1 18 . 1 1 17 17 THR C C 17 170.500 170.500 174.086 -3.586 19718
8318 1 18 . 1 1 17 17 THR CA C 17 58.700 58.700 61.128 -2.428 19718
8319 1 18 . 1 1 17 17 THR CB C 17 67.900 67.900 69.544 -1.644 19718
8320 1 18 . 1 1 17 17 THR H H 17 8.160 8.160 8.553 -0.393 19718
8321 1 18 . 1 1 18 18 TYR N N 18 125.600 125.600 127.635 -2.035 19718
8322 1 18 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.857 -0.017 19718
8323 1 18 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.896 -1.896 19718
8324 1 18 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.801 -2.701 19718
8325 1 18 . 1 1 18 18 TYR H H 18 9.020 9.020 8.982 0.038 19718
8326 1 18 . 1 1 19 19 GLU C C 19 174.200 174.200 175.547 -1.347 19718
8327 1 18 . 1 1 19 19 GLU CA C 19 52.900 52.900 54.892 -1.992 19718
8328 1 18 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.891 -4.591 19718
8329 1 18 . 1 1 20 20 VAL N N 20 119.000 119.000 120.611 -1.611 19718
8330 1 18 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.792 0.048 19718
8331 1 18 . 1 1 20 20 VAL C C 20 171.200 171.200 173.499 -2.299 19718
8332 1 18 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.108 -2.508 19718
8333 1 18 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.484 -1.784 19718
8334 1 18 . 1 1 20 20 VAL H H 20 9.160 9.160 9.118 0.042 19718
8335 1 18 . 1 1 21 21 CYS N N 21 117.500 117.500 118.260 -0.760 19718
8336 1 18 . 1 1 21 21 CYS HA H 21 4.760 4.760 5.278 -0.518 19718
8337 1 18 . 1 1 21 21 CYS C C 21 171.400 171.400 174.109 -2.709 19718
8338 1 18 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.574 -2.674 19718
8339 1 18 . 1 1 21 21 CYS CB C 21 27.200 27.200 32.255 -5.055 19718
8340 1 18 . 1 1 21 21 CYS H H 21 8.720 8.720 9.010 -0.290 19718
8341 1 18 . 1 1 22 22 GLU N N 22 120.900 120.900 122.565 -1.665 19718
8342 1 18 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.938 -0.528 19718
8343 1 18 . 1 1 22 22 GLU C C 22 174.300 174.300 177.404 -3.104 19718
8344 1 18 . 1 1 22 22 GLU CA C 22 55.100 55.100 57.649 -2.549 19718
8345 1 18 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.585 -2.785 19718
8346 1 18 . 1 1 22 22 GLU H H 22 8.540 8.540 8.407 0.133 19718
8347 1 18 . 1 1 23 23 GLY N N 23 112.400 112.400 114.836 -2.436 19718
8348 1 18 . 1 1 23 23 GLY C C 23 171.000 171.000 174.684 -3.684 19718
8349 1 18 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.840 -2.441 19718
8350 1 18 . 1 1 23 23 GLY H H 23 8.720 8.720 8.913 -0.193 19718
8351 1 18 . 1 1 24 24 GLU N N 24 119.600 119.600 122.146 -2.546 19718
8352 1 18 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.374 -0.044 19718
8353 1 18 . 1 1 24 24 GLU C C 24 174.400 174.400 175.433 -1.033 19718
8354 1 18 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.249 -2.149 19718
8355 1 18 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.460 -2.360 19718
8356 1 18 . 1 1 24 24 GLU H H 24 7.060 7.060 7.857 -0.797 19718
8357 1 18 . 1 1 25 25 THR N N 25 113.600 113.600 114.925 -1.325 19718
8358 1 18 . 1 1 25 25 THR HA H 25 5.510 5.510 4.942 0.568 19718
8359 1 18 . 1 1 25 25 THR C C 25 173.100 173.100 175.152 -2.052 19718
8360 1 18 . 1 1 25 25 THR CA C 25 57.000 57.000 60.791 -3.791 19718
8361 1 18 . 1 1 25 25 THR CB C 25 68.700 68.700 70.579 -1.879 19718
8362 1 18 . 1 1 25 25 THR H H 25 9.080 9.080 8.526 0.554 19718
8363 1 18 . 1 1 26 26 ILE N N 26 120.300 120.300 123.205 -2.905 19718
8364 1 18 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.915 -0.285 19718
8365 1 18 . 1 1 26 26 ILE C C 26 174.700 174.700 177.298 -2.598 19718
8366 1 18 . 1 1 26 26 ILE CA C 26 63.700 63.700 65.598 -1.898 19718
8367 1 18 . 1 1 26 26 ILE CB C 26 33.000 33.000 38.122 -5.122 19718
8368 1 18 . 1 1 26 26 ILE H H 26 7.860 7.860 8.430 -0.570 19718
8369 1 18 . 1 1 27 27 LEU N N 27 117.600 117.600 120.474 -2.874 19718
8370 1 18 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.069 -0.319 19718
8371 1 18 . 1 1 27 27 LEU C C 27 174.000 174.000 178.536 -4.536 19718
8372 1 18 . 1 1 27 27 LEU CA C 27 54.900 54.900 57.749 -2.849 19718
8373 1 18 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.904 -1.604 19718
8374 1 18 . 1 1 27 27 LEU H H 27 6.580 6.580 7.847 -1.267 19718
8375 1 18 . 1 1 28 28 ASP N N 28 120.000 120.000 119.645 0.355 19718
8376 1 18 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.491 -0.241 19718
8377 1 18 . 1 1 28 28 ASP C C 28 177.900 177.900 178.531 -0.631 19718
8378 1 18 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.544 -2.543 19718
8379 1 18 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.812 -3.912 19718
8380 1 18 . 1 1 28 28 ASP H H 28 7.880 7.880 7.851 0.029 19718
8381 1 18 . 1 1 29 29 ILE N N 29 122.100 122.100 119.930 2.170 19718
8382 1 18 . 1 1 29 29 ILE HA H 29 3.740 3.740 4.016 -0.276 19718
8383 1 18 . 1 1 29 29 ILE C C 29 175.700 175.700 178.053 -2.353 19718
8384 1 18 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.670 -2.570 19718
8385 1 18 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.077 -1.577 19718
8386 1 18 . 1 1 29 29 ILE H H 29 8.340 8.340 8.321 0.019 19718
8387 1 18 . 1 1 30 30 ALA N N 30 124.100 124.100 124.191 -0.091 19718
8388 1 18 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.680 -0.340 19718
8389 1 18 . 1 1 30 30 ALA C C 30 177.600 177.600 179.338 -1.738 19718
8390 1 18 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.658 -2.858 19718
8391 1 18 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.229 -1.429 19718
8392 1 18 . 1 1 30 30 ALA H H 30 8.430 8.430 8.373 0.057 19718
8393 1 18 . 1 1 31 31 GLN N N 31 116.000 116.000 116.162 -0.162 19718
8394 1 18 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.235 -0.075 19718
8395 1 18 . 1 1 31 31 GLN C C 31 178.100 178.100 178.317 -0.217 19718
8396 1 18 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.288 -0.588 19718
8397 1 18 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.007 -3.807 19718
8398 1 18 . 1 1 31 31 GLN H H 31 8.760 8.760 8.581 0.179 19718
8399 1 18 . 1 1 32 32 GLY N N 32 108.700 108.700 108.334 0.366 19718
8400 1 18 . 1 1 32 32 GLY C C 32 171.700 171.700 175.277 -3.577 19718
8401 1 18 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.204 -3.004 19718
8402 1 18 . 1 1 32 32 GLY H H 32 8.220 8.220 7.825 0.395 19718
8403 1 18 . 1 1 33 33 HIS N N 33 115.000 115.000 119.360 -4.360 19718
8404 1 18 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.599 -0.169 19718
8405 1 18 . 1 1 33 33 HIS C C 33 169.800 169.800 174.413 -4.613 19718
8406 1 18 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.514 -3.114 19718
8407 1 18 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.703 -5.203 19718
8408 1 18 . 1 1 33 33 HIS H H 33 6.980 6.980 8.012 -1.032 19718
8409 1 18 . 1 1 34 34 ASN N N 34 113.700 113.700 115.528 -1.828 19718
8410 1 18 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.344 -0.014 19718
8411 1 18 . 1 1 34 34 ASN C C 34 172.000 172.000 175.045 -3.045 19718
8412 1 18 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.703 -1.603 19718
8413 1 18 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.046 -2.046 19718
8414 1 18 . 1 1 34 34 ASN H H 34 7.700 7.700 7.791 -0.091 19718
8415 1 18 . 1 1 35 35 LEU N N 35 115.600 115.600 118.610 -3.010 19718
8416 1 18 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.150 0.100 19718
8417 1 18 . 1 1 35 35 LEU C C 35 174.900 174.900 177.708 -2.808 19718
8418 1 18 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.553 -4.253 19718
8419 1 18 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.564 -3.364 19718
8420 1 18 . 1 1 35 35 LEU H H 35 7.980 7.980 7.843 0.137 19718
8421 1 18 . 1 1 36 36 ASP N N 36 120.100 120.100 124.197 -4.097 19718
8422 1 18 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.577 -0.147 19718
8423 1 18 . 1 1 36 36 ASP C C 36 171.100 171.100 174.621 -3.521 19718
8424 1 18 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.474 -3.474 19718
8425 1 18 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.545 -3.345 19718
8426 1 18 . 1 1 36 36 ASP H H 36 8.610 8.610 8.737 -0.127 19718
8427 1 18 . 1 1 37 37 MET N N 37 123.900 123.900 119.057 4.843 19718
8428 1 18 . 1 1 37 37 MET HA H 37 4.280 4.280 4.601 -0.321 19718
8429 1 18 . 1 1 37 37 MET C C 37 171.200 171.200 176.109 -4.909 19718
8430 1 18 . 1 1 37 37 MET CA C 37 52.800 52.800 54.691 -1.891 19718
8431 1 18 . 1 1 37 37 MET CB C 37 33.000 33.000 36.366 -3.366 19718
8432 1 18 . 1 1 37 37 MET H H 37 7.670 7.670 7.730 -0.060 19718
8433 1 18 . 1 1 38 38 GLU N N 38 128.600 128.600 123.096 5.504 19718
8434 1 18 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.293 -0.003 19718
8435 1 18 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.208 -3.008 19718
8436 1 18 . 1 1 38 38 GLU CB C 38 29.400 29.400 28.715 0.685 19718
8437 1 18 . 1 1 38 38 GLU H H 38 9.060 9.060 9.087 -0.027 19718
8438 1 18 . 1 1 51 51 HIS C C 51 170.700 170.700 174.453 -3.753 19718
8439 1 18 . 1 1 51 51 HIS CA C 51 52.800 52.800 56.657 -3.857 19718
8440 1 18 . 1 1 51 51 HIS CB C 51 27.700 27.700 30.928 -3.228 19718
8441 1 18 . 1 1 53 53 ILE N N 53 122.200 122.200 120.127 2.073 19718
8442 1 18 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.839 -0.829 19718
8443 1 18 . 1 1 53 53 ILE C C 53 174.400 174.400 173.357 1.043 19718
8444 1 18 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.776 -0.076 19718
8445 1 18 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.407 -6.106 19718
8446 1 18 . 1 1 53 53 ILE H H 53 8.800 8.800 8.265 0.535 19718
8447 1 18 . 1 1 54 54 VAL N N 54 130.200 130.200 125.809 4.391 19718
8448 1 18 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.693 -0.823 19718
8449 1 18 . 1 1 54 54 VAL C C 54 172.500 172.500 174.699 -2.199 19718
8450 1 18 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.737 1.163 19718
8451 1 18 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.124 -5.524 19718
8452 1 18 . 1 1 54 54 VAL H H 54 8.380 8.380 8.858 -0.478 19718
8453 1 18 . 1 1 55 55 ASP N N 55 129.100 129.100 127.554 1.546 19718
8454 1 18 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.675 -0.085 19718
8455 1 18 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.507 -2.807 19718
8456 1 18 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.888 -1.388 19718
8457 1 18 . 1 1 55 55 ASP H H 55 8.160 8.160 8.112 0.048 19718
8458 1 18 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.285 -0.115 19718
8459 1 18 . 1 1 56 56 PRO C C 56 174.900 174.900 177.179 -2.279 19718
8460 1 18 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.792 -1.792 19718
8461 1 18 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.730 -2.330 19718
8462 1 18 . 1 1 57 57 ASP N N 57 117.100 117.100 117.459 -0.359 19718
8463 1 18 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.483 -0.113 19718
8464 1 18 . 1 1 57 57 ASP C C 57 174.100 174.100 177.877 -3.777 19718
8465 1 18 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.757 -3.057 19718
8466 1 18 . 1 1 57 57 ASP CB C 57 36.800 36.800 41.059 -4.259 19718
8467 1 18 . 1 1 57 57 ASP H H 57 9.110 9.110 8.293 0.817 19718
8468 1 18 . 1 1 58 58 TYR N N 58 115.800 115.800 118.704 -2.904 19718
8469 1 18 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.443 -0.083 19718
8470 1 18 . 1 1 58 58 TYR C C 58 173.200 173.200 177.824 -4.624 19718
8471 1 18 . 1 1 58 58 TYR CA C 58 56.700 56.700 60.062 -3.362 19718
8472 1 18 . 1 1 58 58 TYR CB C 58 38.900 38.900 38.935 -0.035 19718
8473 1 18 . 1 1 58 58 TYR H H 58 8.190 8.190 7.782 0.408 19718
8474 1 18 . 1 1 59 59 TYR N N 59 120.100 120.100 121.593 -1.493 19718
8475 1 18 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.123 -0.343 19718
8476 1 18 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.500 -0.400 19718
8477 1 18 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.155 -1.755 19718
8478 1 18 . 1 1 59 59 TYR H H 59 7.420 7.420 8.329 -0.909 19718
8479 1 18 . 1 1 60 60 ASP N N 60 115.200 115.200 118.751 -3.551 19718
8480 1 18 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.506 -0.146 19718
8481 1 18 . 1 1 60 60 ASP C C 60 173.100 173.100 176.371 -3.271 19718
8482 1 18 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.920 -2.520 19718
8483 1 18 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.598 -3.098 19718
8484 1 18 . 1 1 60 60 ASP H H 60 8.440 8.440 8.109 0.331 19718
8485 1 18 . 1 1 61 61 ALA N N 61 120.200 120.200 120.460 -0.260 19718
8486 1 18 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.438 -0.258 19718
8487 1 18 . 1 1 61 61 ALA C C 61 175.000 175.000 177.010 -2.010 19718
8488 1 18 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.019 -2.719 19718
8489 1 18 . 1 1 61 61 ALA CB C 61 16.200 16.200 20.019 -3.819 19718
8490 1 18 . 1 1 61 61 ALA H H 61 7.300 7.300 7.391 -0.091 19718
8491 1 18 . 1 1 62 62 LEU N N 62 118.000 118.000 122.242 -4.242 19718
8492 1 18 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.642 -0.352 19718
8493 1 18 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.705 -2.605 19718
8494 1 18 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.257 -3.557 19718
8495 1 18 . 1 1 62 62 LEU H H 62 6.680 6.680 7.479 -0.799 19718
8496 1 18 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.540 -0.220 19718
8497 1 18 . 1 1 63 63 PRO C C 63 173.500 173.500 175.994 -2.494 19718
8498 1 18 . 1 1 63 63 PRO CA C 63 59.700 59.700 61.992 -2.292 19718
8499 1 18 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.501 -4.001 19718
8500 1 18 . 1 1 64 64 GLU N N 64 124.500 124.500 119.057 5.443 19718
8501 1 18 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.546 -0.366 19718
8502 1 18 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.586 -2.086 19718
8503 1 18 . 1 1 64 64 GLU CB C 64 25.800 25.800 29.812 -4.012 19718
8504 1 18 . 1 1 64 64 GLU H H 64 8.590 8.590 8.328 0.262 19718
8505 1 18 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.665 -0.495 19718
8506 1 18 . 1 1 65 65 PRO C C 65 174.900 174.900 176.384 -1.484 19718
8507 1 18 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.341 0.659 19718
8508 1 18 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.425 -4.925 19718
8509 1 18 . 1 1 66 66 GLU N N 66 123.300 123.300 119.344 3.956 19718
8510 1 18 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.187 0.143 19718
8511 1 18 . 1 1 66 66 GLU C C 66 174.200 174.200 177.418 -3.218 19718
8512 1 18 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.895 -4.395 19718
8513 1 18 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.401 -3.001 19718
8514 1 18 . 1 1 66 66 GLU H H 66 9.080 9.080 8.579 0.501 19718
8515 1 18 . 1 1 67 67 ASP N N 67 120.100 120.100 121.619 -1.519 19718
8516 1 18 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.552 -0.312 19718
8517 1 18 . 1 1 67 67 ASP C C 67 174.900 174.900 176.791 -1.891 19718
8518 1 18 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.193 -0.792 19718
8519 1 18 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.904 -3.104 19718
8520 1 18 . 1 1 67 67 ASP H H 67 8.690 8.690 8.616 0.074 19718
8521 1 18 . 1 1 68 68 ASP N N 68 116.800 116.800 116.271 0.529 19718
8522 1 18 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.547 -0.307 19718
8523 1 18 . 1 1 68 68 ASP C C 68 175.500 175.500 177.589 -2.089 19718
8524 1 18 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.798 -1.498 19718
8525 1 18 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.053 -4.953 19718
8526 1 18 . 1 1 68 68 ASP H H 68 8.400 8.400 8.257 0.143 19718
8527 1 18 . 1 1 69 69 GLU N N 69 123.600 123.600 119.783 3.817 19718
8528 1 18 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.158 -0.008 19718
8529 1 18 . 1 1 69 69 GLU C C 69 175.200 175.200 178.765 -3.565 19718
8530 1 18 . 1 1 69 69 GLU CA C 69 56.200 56.200 59.174 -2.974 19718
8531 1 18 . 1 1 69 69 GLU CB C 69 26.000 26.000 29.899 -3.899 19718
8532 1 18 . 1 1 69 69 GLU H H 69 7.530 7.530 7.808 -0.278 19718
8533 1 18 . 1 1 70 70 ASN N N 70 119.100 119.100 118.315 0.785 19718
8534 1 18 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.435 -0.075 19718
8535 1 18 . 1 1 70 70 ASN C C 70 175.200 175.200 177.150 -1.950 19718
8536 1 18 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.744 -2.044 19718
8537 1 18 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.561 -2.761 19718
8538 1 18 . 1 1 70 70 ASN H H 70 7.960 7.960 8.425 -0.465 19718
8539 1 18 . 1 1 71 71 ASP N N 71 118.400 118.400 120.766 -2.366 19718
8540 1 18 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.495 -0.245 19718
8541 1 18 . 1 1 71 71 ASP C C 71 176.000 176.000 177.688 -1.688 19718
8542 1 18 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.823 -2.223 19718
8543 1 18 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.944 -3.444 19718
8544 1 18 . 1 1 71 71 ASP H H 71 8.250 8.250 8.375 -0.125 19718
8545 1 18 . 1 1 72 72 MET N N 72 117.300 117.300 116.897 0.403 19718
8546 1 18 . 1 1 72 72 MET HA H 72 4.370 4.370 4.139 0.231 19718
8547 1 18 . 1 1 72 72 MET C C 72 177.800 177.800 177.710 0.090 19718
8548 1 18 . 1 1 72 72 MET CA C 72 53.700 53.700 58.572 -4.872 19718
8549 1 18 . 1 1 72 72 MET CB C 72 32.400 32.400 32.556 -0.156 19718
8550 1 18 . 1 1 72 72 MET H H 72 7.240 7.240 7.652 -0.412 19718
8551 1 18 . 1 1 73 73 LEU N N 73 123.000 123.000 119.922 3.078 19718
8552 1 18 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.371 -0.611 19718
8553 1 18 . 1 1 73 73 LEU C C 73 175.700 175.700 179.421 -3.721 19718
8554 1 18 . 1 1 73 73 LEU CA C 73 54.900 54.900 57.004 -2.104 19718
8555 1 18 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.916 -3.816 19718
8556 1 18 . 1 1 73 73 LEU H H 73 8.600 8.600 7.354 1.246 19718
8557 1 18 . 1 1 74 74 ASP N N 74 118.500 118.500 119.628 -1.128 19718
8558 1 18 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.417 -0.077 19718
8559 1 18 . 1 1 74 74 ASP C C 74 174.700 174.700 178.046 -3.346 19718
8560 1 18 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.996 -2.696 19718
8561 1 18 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.871 -2.671 19718
8562 1 18 . 1 1 74 74 ASP H H 74 7.250 7.250 7.774 -0.524 19718
8563 1 18 . 1 1 75 75 LEU N N 75 116.300 116.300 118.112 -1.812 19718
8564 1 18 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.181 0.119 19718
8565 1 18 . 1 1 75 75 LEU C C 75 174.500 174.500 177.587 -3.087 19718
8566 1 18 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.788 -4.488 19718
8567 1 18 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.753 -2.153 19718
8568 1 18 . 1 1 75 75 LEU H H 75 7.000 7.000 7.480 -0.480 19718
8569 1 18 . 1 1 76 76 ALA N N 76 124.600 124.600 120.237 4.363 19718
8570 1 18 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.201 -0.101 19718
8571 1 18 . 1 1 76 76 ALA C C 76 174.200 174.200 175.964 -1.764 19718
8572 1 18 . 1 1 76 76 ALA CA C 76 49.500 49.500 51.422 -1.922 19718
8573 1 18 . 1 1 76 76 ALA CB C 76 15.200 15.200 19.826 -4.626 19718
8574 1 18 . 1 1 76 76 ALA H H 76 7.590 7.590 7.632 -0.042 19718
8575 1 18 . 1 1 77 77 TYR N N 77 122.900 122.900 121.512 1.388 19718
8576 1 18 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.300 0.130 19718
8577 1 18 . 1 1 77 77 TYR C C 77 174.100 174.100 177.031 -2.931 19718
8578 1 18 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.609 -4.709 19718
8579 1 18 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.491 -3.591 19718
8580 1 18 . 1 1 77 77 TYR H H 77 8.150 8.150 8.544 -0.394 19718
8581 1 18 . 1 1 78 78 GLY N N 78 112.900 112.900 114.544 -1.644 19718
8582 1 18 . 1 1 78 78 GLY C C 78 171.800 171.800 173.876 -2.076 19718
8583 1 18 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.656 -0.956 19718
8584 1 18 . 1 1 78 78 GLY H H 78 8.320 8.320 7.948 0.372 19718
8585 1 18 . 1 1 79 79 LEU N N 79 119.300 119.300 119.583 -0.283 19718
8586 1 18 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.349 -0.559 19718
8587 1 18 . 1 1 79 79 LEU C C 79 174.000 174.000 176.439 -2.439 19718
8588 1 18 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.395 -1.395 19718
8589 1 18 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.856 -2.956 19718
8590 1 18 . 1 1 79 79 LEU H H 79 7.120 7.120 7.896 -0.776 19718
8591 1 18 . 1 1 80 80 THR N N 80 118.500 118.500 118.649 -0.149 19718
8592 1 18 . 1 1 80 80 THR HA H 80 4.860 4.860 4.509 0.351 19718
8593 1 18 . 1 1 80 80 THR C C 80 173.300 173.300 175.292 -1.992 19718
8594 1 18 . 1 1 80 80 THR CA C 80 57.600 57.600 60.634 -3.034 19718
8595 1 18 . 1 1 80 80 THR CB C 80 71.000 71.000 69.929 1.071 19718
8596 1 18 . 1 1 80 80 THR H H 80 9.240 9.240 8.005 1.235 19718
8597 1 18 . 1 1 81 81 GLU N N 81 118.000 118.000 119.967 -1.967 19718
8598 1 18 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.101 0.009 19718
8599 1 18 . 1 1 81 81 GLU C C 81 173.900 173.900 176.387 -2.487 19718
8600 1 18 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.783 -3.383 19718
8601 1 18 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.512 -2.812 19718
8602 1 18 . 1 1 81 81 GLU H H 81 9.020 9.020 8.830 0.190 19718
8603 1 18 . 1 1 82 82 THR N N 82 106.400 106.400 105.917 0.483 19718
8604 1 18 . 1 1 82 82 THR HA H 82 3.950 3.950 2.814 1.136 19718
8605 1 18 . 1 1 82 82 THR C C 82 171.700 171.700 173.716 -2.016 19718
8606 1 18 . 1 1 82 82 THR CA C 82 56.800 56.800 59.740 -2.940 19718
8607 1 18 . 1 1 82 82 THR CB C 82 63.800 63.800 68.138 -4.338 19718
8608 1 18 . 1 1 82 82 THR H H 82 7.630 7.630 7.451 0.179 19718
8609 1 18 . 1 1 83 83 SER N N 83 121.500 121.500 119.294 2.206 19718
8610 1 18 . 1 1 83 83 SER HA H 83 5.080 5.080 4.280 0.800 19718
8611 1 18 . 1 1 83 83 SER C C 83 170.900 170.900 174.099 -3.199 19718
8612 1 18 . 1 1 83 83 SER CA C 83 59.000 59.000 59.852 -0.852 19718
8613 1 18 . 1 1 83 83 SER CB C 83 61.700 61.700 63.565 -1.865 19718
8614 1 18 . 1 1 83 83 SER H H 83 6.930 6.930 7.677 -0.747 19718
8615 1 18 . 1 1 84 84 ARG N N 84 119.300 119.300 124.737 -5.437 19718
8616 1 18 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.694 0.176 19718
8617 1 18 . 1 1 84 84 ARG C C 84 172.400 172.400 174.468 -2.068 19718
8618 1 18 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.415 -4.115 19718
8619 1 18 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.432 -2.032 19718
8620 1 18 . 1 1 84 84 ARG H H 84 9.280 9.280 8.752 0.528 19718
8621 1 18 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.436 -0.006 19718
8622 1 18 . 1 1 88 88 GLN C C 88 172.500 172.500 173.854 -1.354 19718
8623 1 18 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.580 -4.580 19718
8624 1 18 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.745 -2.745 19718
8625 1 18 . 1 1 90 90 LYS N N 90 123.700 123.700 124.940 -1.240 19718
8626 1 18 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.060 -0.610 19718
8627 1 18 . 1 1 90 90 LYS C C 90 173.500 173.500 175.808 -2.308 19718
8628 1 18 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.938 -2.438 19718
8629 1 18 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.718 -2.818 19718
8630 1 18 . 1 1 90 90 LYS H H 90 8.330 8.330 8.106 0.224 19718
8631 1 18 . 1 1 91 91 MET N N 91 118.200 118.200 120.394 -2.194 19718
8632 1 18 . 1 1 91 91 MET HA H 91 4.330 4.330 4.624 -0.294 19718
8633 1 18 . 1 1 91 91 MET C C 91 174.300 174.300 175.872 -1.572 19718
8634 1 18 . 1 1 91 91 MET CA C 91 51.800 51.800 55.227 -3.427 19718
8635 1 18 . 1 1 91 91 MET CB C 91 27.200 27.200 31.437 -4.237 19718
8636 1 18 . 1 1 91 91 MET H H 91 8.620 8.620 8.661 -0.041 19718
8637 1 18 . 1 1 92 92 SER N N 92 117.000 117.000 117.907 -0.907 19718
8638 1 18 . 1 1 92 92 SER HA H 92 4.610 4.610 5.068 -0.458 19718
8639 1 18 . 1 1 92 92 SER C C 92 171.300 171.300 175.623 -4.323 19718
8640 1 18 . 1 1 92 92 SER CA C 92 54.000 54.000 56.746 -2.746 19718
8641 1 18 . 1 1 92 92 SER CB C 92 63.700 63.700 66.324 -2.624 19718
8642 1 18 . 1 1 92 92 SER H H 92 6.970 6.970 8.157 -1.187 19718
8643 1 18 . 1 1 93 93 LYS N N 93 121.700 121.700 119.588 2.112 19718
8644 1 18 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.109 -0.139 19718
8645 1 18 . 1 1 93 93 LYS C C 93 175.200 175.200 177.946 -2.746 19718
8646 1 18 . 1 1 93 93 LYS CA C 93 56.700 56.700 59.022 -2.322 19718
8647 1 18 . 1 1 93 93 LYS CB C 93 29.100 29.100 31.873 -2.773 19718
8648 1 18 . 1 1 93 93 LYS H H 93 9.260 9.260 8.962 0.298 19718
8649 1 18 . 1 1 94 94 ASP N N 94 116.700 116.700 120.197 -3.497 19718
8650 1 18 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.558 -0.198 19718
8651 1 18 . 1 1 94 94 ASP C C 94 174.300 174.300 177.480 -3.180 19718
8652 1 18 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.160 -2.460 19718
8653 1 18 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.212 -3.312 19718
8654 1 18 . 1 1 94 94 ASP H H 94 8.020 8.020 7.682 0.338 19718
8655 1 18 . 1 1 95 95 ILE N N 95 109.000 109.000 112.935 -3.935 19718
8656 1 18 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.512 0.148 19718
8657 1 18 . 1 1 95 95 ILE C C 95 170.600 170.600 175.063 -4.463 19718
8658 1 18 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.336 -3.036 19718
8659 1 18 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.405 -3.205 19718
8660 1 18 . 1 1 95 95 ILE H H 95 7.240 7.240 7.677 -0.437 19718
8661 1 18 . 1 1 96 96 ASP N N 96 119.800 119.800 123.488 -3.688 19718
8662 1 18 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.459 -0.279 19718
8663 1 18 . 1 1 96 96 ASP C C 96 174.900 174.900 176.796 -1.896 19718
8664 1 18 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.714 -1.014 19718
8665 1 18 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.314 -0.314 19718
8666 1 18 . 1 1 96 96 ASP H H 96 6.950 6.950 8.032 -1.082 19718
8667 1 18 . 1 1 97 97 GLY N N 97 118.500 118.500 114.320 4.180 19718
8668 1 18 . 1 1 97 97 GLY C C 97 170.500 170.500 173.875 -3.375 19718
8669 1 18 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.438 -2.138 19718
8670 1 18 . 1 1 97 97 GLY H H 97 9.210 9.210 8.335 0.875 19718
8671 1 18 . 1 1 98 98 ILE N N 98 121.300 121.300 120.776 0.524 19718
8672 1 18 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.095 2.505 19718
8673 1 18 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.932 -3.332 19718
8674 1 18 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.683 -3.983 19718
8675 1 18 . 1 1 98 98 ILE H H 98 7.660 7.660 7.868 -0.208 19718
8676 1 18 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.245 0.105 19718
8677 1 18 . 1 1 99 99 ARG C C 99 172.200 172.200 175.165 -2.965 19718
8678 1 18 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.163 -4.063 19718
8679 1 18 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.461 -2.961 19718
8680 1 18 . 1 1 100 100 VAL N N 100 114.900 114.900 115.829 -0.929 19718
8681 1 18 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.121 -0.301 19718
8682 1 18 . 1 1 100 100 VAL C C 100 169.600 169.600 173.342 -3.742 19718
8683 1 18 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.423 -4.223 19718
8684 1 18 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.376 -4.075 19718
8685 1 18 . 1 1 100 100 VAL H H 100 8.440 8.440 8.915 -0.475 19718
8686 1 18 . 1 1 101 101 ALA N N 101 123.400 123.400 122.425 0.975 19718
8687 1 18 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.071 0.239 19718
8688 1 18 . 1 1 101 101 ALA C C 101 174.400 174.400 175.317 -0.917 19718
8689 1 18 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.802 -3.002 19718
8690 1 18 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.438 -3.638 19718
8691 1 18 . 1 1 101 101 ALA H H 101 9.040 9.040 8.947 0.093 19718
8692 1 18 . 1 1 102 102 LEU N N 102 120.600 120.600 121.442 -0.842 19718
8693 1 18 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.016 -0.446 19718
8694 1 18 . 1 1 102 102 LEU CA C 102 52.200 52.200 53.163 -0.963 19718
8695 1 18 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.254 -6.354 19718
8696 1 18 . 1 1 102 102 LEU H H 102 8.260 8.260 8.340 -0.080 19718
8697 1 18 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.839 -0.259 19718
8698 1 18 . 1 1 112 112 ASN C C 112 171.900 171.900 172.963 -1.063 19718
8699 1 18 . 1 1 112 112 ASN CA C 112 50.400 50.400 52.928 -2.528 19718
8700 1 18 . 1 1 112 112 ASN CB C 112 36.700 36.700 40.640 -3.940 19718
8701 1 18 . 1 1 113 113 ASP N N 113 120.300 120.300 121.125 -0.825 19718
8702 1 18 . 1 1 113 113 ASP HA H 113 4.440 4.440 5.034 -0.594 19718
8703 1 18 . 1 1 113 113 ASP C C 113 173.000 173.000 175.679 -2.679 19718
8704 1 18 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.108 -1.508 19718
8705 1 18 . 1 1 113 113 ASP CB C 113 38.100 38.100 43.409 -5.309 19718
8706 1 18 . 1 1 113 113 ASP H H 113 8.040 8.040 8.365 -0.325 19718
8707 1 18 . 1 1 114 114 PHE N N 114 120.100 120.100 121.573 -1.473 19718
8708 1 18 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.279 0.331 19718
8709 1 18 . 1 1 114 114 PHE C C 114 172.200 172.200 175.090 -2.890 19718
8710 1 18 . 1 1 114 114 PHE CA C 114 54.900 54.900 60.160 -5.260 19718
8711 1 18 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.472 -2.972 19718
8712 1 18 . 1 1 114 114 PHE H H 114 8.110 8.110 8.778 -0.668 19718
8713 1 19 . 1 1 2 2 GLU HA H 2 4.240 4.240 4.037 0.203 19718
8714 1 19 . 1 1 2 2 GLU C C 2 173.400 173.400 175.280 -1.880 19718
8715 1 19 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.894 -3.494 19718
8716 1 19 . 1 1 2 2 GLU CB C 2 27.000 27.000 28.579 -1.579 19718
8717 1 19 . 1 1 3 3 GLU N N 3 121.200 121.200 117.950 3.250 19718
8718 1 19 . 1 1 3 3 GLU HA H 3 4.380 4.380 5.022 -0.642 19718
8719 1 19 . 1 1 3 3 GLU C C 3 173.000 173.000 176.051 -3.051 19718
8720 1 19 . 1 1 3 3 GLU CA C 3 54.400 54.400 55.311 -0.911 19718
8721 1 19 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.995 -3.595 19718
8722 1 19 . 1 1 3 3 GLU H H 3 8.510 8.510 8.175 0.335 19718
8723 1 19 . 1 1 4 4 LEU N N 4 122.400 122.400 123.074 -0.674 19718
8724 1 19 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.970 -0.420 19718
8725 1 19 . 1 1 4 4 LEU C C 4 172.900 172.900 175.260 -2.360 19718
8726 1 19 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.600 -3.200 19718
8727 1 19 . 1 1 4 4 LEU CB C 4 41.700 41.700 46.590 -4.889 19718
8728 1 19 . 1 1 4 4 LEU H H 4 8.460 8.460 8.854 -0.394 19718
8729 1 19 . 1 1 5 5 LYS N N 5 119.300 119.300 119.190 0.110 19718
8730 1 19 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.400 0.020 19718
8731 1 19 . 1 1 5 5 LYS C C 5 172.400 172.400 174.500 -2.100 19718
8732 1 19 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.581 -2.281 19718
8733 1 19 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.589 -3.589 19718
8734 1 19 . 1 1 5 5 LYS H H 5 8.570 8.570 8.287 0.283 19718
8735 1 19 . 1 1 6 6 ILE N N 6 116.900 116.900 121.964 -5.064 19718
8736 1 19 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.558 -0.448 19718
8737 1 19 . 1 1 6 6 ILE C C 6 169.800 169.800 173.262 -3.462 19718
8738 1 19 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.694 -4.194 19718
8739 1 19 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.042 -3.042 19718
8740 1 19 . 1 1 6 6 ILE H H 6 8.160 8.160 8.840 -0.680 19718
8741 1 19 . 1 1 7 7 THR N N 7 123.000 123.000 125.591 -2.591 19718
8742 1 19 . 1 1 7 7 THR HA H 7 5.220 5.220 5.041 0.179 19718
8743 1 19 . 1 1 7 7 THR C C 7 169.900 169.900 173.514 -3.614 19718
8744 1 19 . 1 1 7 7 THR CA C 7 58.400 58.400 61.172 -2.772 19718
8745 1 19 . 1 1 7 7 THR CB C 7 68.700 68.700 69.690 -0.990 19718
8746 1 19 . 1 1 7 7 THR H H 7 8.520 8.520 8.629 -0.109 19718
8747 1 19 . 1 1 8 8 PHE N N 8 124.000 124.000 124.642 -0.642 19718
8748 1 19 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.602 -0.452 19718
8749 1 19 . 1 1 8 8 PHE C C 8 172.300 172.300 174.873 -2.573 19718
8750 1 19 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.160 -1.560 19718
8751 1 19 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.754 -1.654 19718
8752 1 19 . 1 1 8 8 PHE H H 8 9.290 9.290 9.230 0.060 19718
8753 1 19 . 1 1 9 9 ILE N N 9 122.700 122.700 122.057 0.643 19718
8754 1 19 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.963 -0.383 19718
8755 1 19 . 1 1 9 9 ILE C C 9 173.600 173.600 175.885 -2.285 19718
8756 1 19 . 1 1 9 9 ILE CA C 9 58.200 58.200 59.248 -1.048 19718
8757 1 19 . 1 1 9 9 ILE CB C 9 34.500 34.500 37.721 -3.221 19718
8758 1 19 . 1 1 9 9 ILE H H 9 9.170 9.170 8.894 0.276 19718
8759 1 19 . 1 1 10 10 LEU N N 10 126.700 126.700 127.308 -0.608 19718
8760 1 19 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.443 -0.123 19718
8761 1 19 . 1 1 10 10 LEU C C 10 176.500 176.500 178.554 -2.054 19718
8762 1 19 . 1 1 10 10 LEU CA C 10 52.200 52.200 55.057 -2.857 19718
8763 1 19 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.339 -4.839 19718
8764 1 19 . 1 1 10 10 LEU H H 10 9.100 9.100 9.051 0.049 19718
8765 1 19 . 1 1 11 11 LYS N N 11 118.900 118.900 119.290 -0.390 19718
8766 1 19 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.221 -0.261 19718
8767 1 19 . 1 1 11 11 LYS C C 11 174.100 174.100 177.738 -3.638 19718
8768 1 19 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.079 -0.679 19718
8769 1 19 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.128 -3.228 19718
8770 1 19 . 1 1 11 11 LYS H H 11 8.520 8.520 9.111 -0.591 19718
8771 1 19 . 1 1 12 12 ASP N N 12 114.400 114.400 118.349 -3.949 19718
8772 1 19 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.687 -0.167 19718
8773 1 19 . 1 1 12 12 ASP C C 12 174.500 174.500 176.732 -2.232 19718
8774 1 19 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.750 -3.350 19718
8775 1 19 . 1 1 12 12 ASP CB C 12 37.200 37.200 41.220 -4.020 19718
8776 1 19 . 1 1 12 12 ASP H H 12 7.690 7.690 8.190 -0.500 19718
8777 1 19 . 1 1 13 13 GLY N N 13 109.200 109.200 108.902 0.298 19718
8778 1 19 . 1 1 13 13 GLY C C 13 171.600 171.600 174.471 -2.871 19718
8779 1 19 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.789 -3.389 19718
8780 1 19 . 1 1 13 13 GLY H H 13 8.100 8.100 7.899 0.201 19718
8781 1 19 . 1 1 14 14 SER N N 14 118.000 118.000 115.827 2.173 19718
8782 1 19 . 1 1 14 14 SER HA H 14 4.280 4.280 4.375 -0.095 19718
8783 1 19 . 1 1 14 14 SER C C 14 169.000 169.000 173.812 -4.812 19718
8784 1 19 . 1 1 14 14 SER CA C 14 56.500 56.500 58.981 -2.481 19718
8785 1 19 . 1 1 14 14 SER CB C 14 61.000 61.000 63.828 -2.828 19718
8786 1 19 . 1 1 14 14 SER H H 14 8.110 8.110 8.083 0.027 19718
8787 1 19 . 1 1 15 15 GLN N N 15 116.300 116.300 120.181 -3.881 19718
8788 1 19 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.259 0.401 19718
8789 1 19 . 1 1 15 15 GLN C C 15 173.500 173.500 176.070 -2.570 19718
8790 1 19 . 1 1 15 15 GLN CA C 15 51.700 51.700 55.024 -3.324 19718
8791 1 19 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.658 -2.658 19718
8792 1 19 . 1 1 15 15 GLN H H 15 8.330 8.330 8.480 -0.150 19718
8793 1 19 . 1 1 16 16 LYS N N 16 122.500 122.500 124.587 -2.087 19718
8794 1 19 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.575 -0.245 19718
8795 1 19 . 1 1 16 16 LYS C C 16 171.300 171.300 174.493 -3.193 19718
8796 1 19 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.027 -3.127 19718
8797 1 19 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.187 -1.187 19718
8798 1 19 . 1 1 16 16 LYS H H 16 8.780 8.780 8.736 0.044 19718
8799 1 19 . 1 1 17 17 THR N N 17 120.000 120.000 119.869 0.131 19718
8800 1 19 . 1 1 17 17 THR HA H 17 5.220 5.220 4.925 0.295 19718
8801 1 19 . 1 1 17 17 THR C C 17 170.500 170.500 173.697 -3.197 19718
8802 1 19 . 1 1 17 17 THR CA C 17 58.700 58.700 60.874 -2.175 19718
8803 1 19 . 1 1 17 17 THR CB C 17 67.900 67.900 69.415 -1.515 19718
8804 1 19 . 1 1 17 17 THR H H 17 8.160 8.160 8.428 -0.268 19718
8805 1 19 . 1 1 18 18 TYR N N 18 125.600 125.600 127.126 -1.526 19718
8806 1 19 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.731 0.109 19718
8807 1 19 . 1 1 18 18 TYR CA C 18 53.000 53.000 55.043 -2.043 19718
8808 1 19 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.830 -2.730 19718
8809 1 19 . 1 1 18 18 TYR H H 18 9.020 9.020 9.164 -0.144 19718
8810 1 19 . 1 1 19 19 GLU C C 19 174.200 174.200 175.629 -1.429 19718
8811 1 19 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.657 -2.757 19718
8812 1 19 . 1 1 19 19 GLU CB C 19 27.300 27.300 31.544 -4.244 19718
8813 1 19 . 1 1 20 20 VAL N N 20 119.000 119.000 118.615 0.385 19718
8814 1 19 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.769 0.071 19718
8815 1 19 . 1 1 20 20 VAL C C 20 171.200 171.200 174.028 -2.828 19718
8816 1 19 . 1 1 20 20 VAL CA C 20 56.600 56.600 60.008 -3.408 19718
8817 1 19 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.752 -2.052 19718
8818 1 19 . 1 1 20 20 VAL H H 20 9.160 9.160 8.826 0.334 19718
8819 1 19 . 1 1 21 21 CYS N N 21 117.500 117.500 119.232 -1.732 19718
8820 1 19 . 1 1 21 21 CYS HA H 21 4.760 4.760 5.415 -0.655 19718
8821 1 19 . 1 1 21 21 CYS C C 21 171.400 171.400 174.655 -3.255 19718
8822 1 19 . 1 1 21 21 CYS CA C 21 54.900 54.900 56.087 -1.187 19718
8823 1 19 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.383 -3.183 19718
8824 1 19 . 1 1 21 21 CYS H H 21 8.720 8.720 8.545 0.175 19718
8825 1 19 . 1 1 22 22 GLU N N 22 120.900 120.900 122.565 -1.665 19718
8826 1 19 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.807 -0.397 19718
8827 1 19 . 1 1 22 22 GLU C C 22 174.300 174.300 177.384 -3.084 19718
8828 1 19 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.412 -3.312 19718
8829 1 19 . 1 1 22 22 GLU CB C 22 26.800 26.800 30.100 -3.300 19718
8830 1 19 . 1 1 22 22 GLU H H 22 8.540 8.540 8.091 0.449 19718
8831 1 19 . 1 1 23 23 GLY N N 23 112.400 112.400 115.032 -2.632 19718
8832 1 19 . 1 1 23 23 GLY C C 23 171.000 171.000 174.547 -3.547 19718
8833 1 19 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.981 -2.581 19718
8834 1 19 . 1 1 23 23 GLY H H 23 8.720 8.720 8.942 -0.222 19718
8835 1 19 . 1 1 24 24 GLU N N 24 119.600 119.600 123.043 -3.443 19718
8836 1 19 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.270 0.060 19718
8837 1 19 . 1 1 24 24 GLU C C 24 174.400 174.400 176.402 -2.002 19718
8838 1 19 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.566 -2.466 19718
8839 1 19 . 1 1 24 24 GLU CB C 24 28.100 28.100 29.541 -1.441 19718
8840 1 19 . 1 1 24 24 GLU H H 24 7.060 7.060 7.751 -0.691 19718
8841 1 19 . 1 1 25 25 THR N N 25 113.600 113.600 120.181 -6.581 19718
8842 1 19 . 1 1 25 25 THR HA H 25 5.510 5.510 4.561 0.949 19718
8843 1 19 . 1 1 25 25 THR C C 25 173.100 173.100 175.623 -2.523 19718
8844 1 19 . 1 1 25 25 THR CA C 25 57.000 57.000 62.607 -5.607 19718
8845 1 19 . 1 1 25 25 THR CB C 25 68.700 68.700 69.996 -1.296 19718
8846 1 19 . 1 1 25 25 THR H H 25 9.080 9.080 8.352 0.728 19718
8847 1 19 . 1 1 26 26 ILE N N 26 120.300 120.300 125.695 -5.395 19718
8848 1 19 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.872 -0.242 19718
8849 1 19 . 1 1 26 26 ILE C C 26 174.700 174.700 177.661 -2.961 19718
8850 1 19 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.454 -0.754 19718
8851 1 19 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.686 -4.686 19718
8852 1 19 . 1 1 26 26 ILE H H 26 7.860 7.860 8.721 -0.861 19718
8853 1 19 . 1 1 27 27 LEU N N 27 117.600 117.600 121.283 -3.683 19718
8854 1 19 . 1 1 27 27 LEU HA H 27 3.750 3.750 3.982 -0.232 19718
8855 1 19 . 1 1 27 27 LEU C C 27 174.000 174.000 178.271 -4.271 19718
8856 1 19 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.849 -3.949 19718
8857 1 19 . 1 1 27 27 LEU CB C 27 39.300 39.300 40.854 -1.554 19718
8858 1 19 . 1 1 27 27 LEU H H 27 6.580 6.580 7.878 -1.298 19718
8859 1 19 . 1 1 28 28 ASP N N 28 120.000 120.000 119.780 0.220 19718
8860 1 19 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.366 -0.116 19718
8861 1 19 . 1 1 28 28 ASP C C 28 177.900 177.900 179.263 -1.363 19718
8862 1 19 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.748 -2.748 19718
8863 1 19 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.390 -3.490 19718
8864 1 19 . 1 1 28 28 ASP H H 28 7.880 7.880 8.477 -0.597 19718
8865 1 19 . 1 1 29 29 ILE N N 29 122.100 122.100 120.693 1.407 19718
8866 1 19 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.915 -0.175 19718
8867 1 19 . 1 1 29 29 ILE C C 29 175.700 175.700 177.876 -2.176 19718
8868 1 19 . 1 1 29 29 ILE CA C 29 62.100 62.100 65.161 -3.061 19718
8869 1 19 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.014 -1.514 19718
8870 1 19 . 1 1 29 29 ILE H H 29 8.340 8.340 8.435 -0.095 19718
8871 1 19 . 1 1 30 30 ALA N N 30 124.100 124.100 122.910 1.190 19718
8872 1 19 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.613 -0.273 19718
8873 1 19 . 1 1 30 30 ALA C C 30 177.600 177.600 179.682 -2.082 19718
8874 1 19 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.424 -2.624 19718
8875 1 19 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.047 -1.247 19718
8876 1 19 . 1 1 30 30 ALA H H 30 8.430 8.430 8.060 0.370 19718
8877 1 19 . 1 1 31 31 GLN N N 31 116.000 116.000 115.694 0.306 19718
8878 1 19 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.194 -0.034 19718
8879 1 19 . 1 1 31 31 GLN C C 31 178.100 178.100 178.189 -0.089 19718
8880 1 19 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.545 -0.845 19718
8881 1 19 . 1 1 31 31 GLN CB C 31 25.200 25.200 29.099 -3.899 19718
8882 1 19 . 1 1 31 31 GLN H H 31 8.760 8.760 8.412 0.348 19718
8883 1 19 . 1 1 32 32 GLY N N 32 108.700 108.700 107.487 1.213 19718
8884 1 19 . 1 1 32 32 GLY C C 32 171.700 171.700 175.354 -3.654 19718
8885 1 19 . 1 1 32 32 GLY CA C 32 43.200 43.200 45.805 -2.605 19718
8886 1 19 . 1 1 32 32 GLY H H 32 8.220 8.220 7.861 0.359 19718
8887 1 19 . 1 1 33 33 HIS N N 33 115.000 115.000 119.480 -4.480 19718
8888 1 19 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.536 -0.106 19718
8889 1 19 . 1 1 33 33 HIS C C 33 169.800 169.800 174.302 -4.502 19718
8890 1 19 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.907 -3.507 19718
8891 1 19 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.438 -4.938 19718
8892 1 19 . 1 1 33 33 HIS H H 33 6.980 6.980 8.141 -1.161 19718
8893 1 19 . 1 1 34 34 ASN N N 34 113.700 113.700 114.433 -0.733 19718
8894 1 19 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.300 0.030 19718
8895 1 19 . 1 1 34 34 ASN C C 34 172.000 172.000 174.771 -2.771 19718
8896 1 19 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.646 -1.546 19718
8897 1 19 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.270 -2.270 19718
8898 1 19 . 1 1 34 34 ASN H H 34 7.700 7.700 7.819 -0.119 19718
8899 1 19 . 1 1 35 35 LEU N N 35 115.600 115.600 118.481 -2.881 19718
8900 1 19 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.173 0.077 19718
8901 1 19 . 1 1 35 35 LEU C C 35 174.900 174.900 177.286 -2.386 19718
8902 1 19 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.496 -4.196 19718
8903 1 19 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.639 -3.438 19718
8904 1 19 . 1 1 35 35 LEU H H 35 7.980 7.980 7.654 0.326 19718
8905 1 19 . 1 1 36 36 ASP N N 36 120.100 120.100 123.141 -3.041 19718
8906 1 19 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.556 -0.126 19718
8907 1 19 . 1 1 36 36 ASP C C 36 171.100 171.100 174.979 -3.879 19718
8908 1 19 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.848 -3.848 19718
8909 1 19 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.940 -3.740 19718
8910 1 19 . 1 1 36 36 ASP H H 36 8.610 8.610 8.614 -0.004 19718
8911 1 19 . 1 1 37 37 MET N N 37 123.900 123.900 119.128 4.772 19718
8912 1 19 . 1 1 37 37 MET HA H 37 4.280 4.280 4.885 -0.605 19718
8913 1 19 . 1 1 37 37 MET C C 37 171.200 171.200 173.996 -2.796 19718
8914 1 19 . 1 1 37 37 MET CA C 37 52.800 52.800 55.042 -2.242 19718
8915 1 19 . 1 1 37 37 MET CB C 37 33.000 33.000 35.522 -2.522 19718
8916 1 19 . 1 1 37 37 MET H H 37 7.670 7.670 7.552 0.118 19718
8917 1 19 . 1 1 38 38 GLU N N 38 128.600 128.600 121.106 7.494 19718
8918 1 19 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.631 -0.341 19718
8919 1 19 . 1 1 38 38 GLU CA C 38 53.200 53.200 55.871 -2.671 19718
8920 1 19 . 1 1 38 38 GLU CB C 38 29.400 29.400 31.182 -1.782 19718
8921 1 19 . 1 1 38 38 GLU H H 38 9.060 9.060 8.677 0.383 19718
8922 1 19 . 1 1 51 51 HIS C C 51 170.700 170.700 174.220 -3.520 19718
8923 1 19 . 1 1 51 51 HIS CA C 51 52.800 52.800 53.543 -0.743 19718
8924 1 19 . 1 1 51 51 HIS CB C 51 27.700 27.700 28.168 -0.468 19718
8925 1 19 . 1 1 53 53 ILE N N 53 122.200 122.200 121.279 0.921 19718
8926 1 19 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.904 -0.894 19718
8927 1 19 . 1 1 53 53 ILE C C 53 174.400 174.400 173.634 0.766 19718
8928 1 19 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.931 -0.231 19718
8929 1 19 . 1 1 53 53 ILE CB C 53 36.300 36.300 41.838 -5.538 19718
8930 1 19 . 1 1 53 53 ILE H H 53 8.800 8.800 8.178 0.622 19718
8931 1 19 . 1 1 54 54 VAL N N 54 130.200 130.200 126.392 3.808 19718
8932 1 19 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.714 -0.844 19718
8933 1 19 . 1 1 54 54 VAL C C 54 172.500 172.500 174.853 -2.353 19718
8934 1 19 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.345 1.555 19718
8935 1 19 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.260 -5.660 19718
8936 1 19 . 1 1 54 54 VAL H H 54 8.380 8.380 8.871 -0.491 19718
8937 1 19 . 1 1 55 55 ASP N N 55 129.100 129.100 127.644 1.456 19718
8938 1 19 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.659 -0.069 19718
8939 1 19 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.507 -2.807 19718
8940 1 19 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.645 -1.145 19718
8941 1 19 . 1 1 55 55 ASP H H 55 8.160 8.160 8.113 0.047 19718
8942 1 19 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.208 -0.038 19718
8943 1 19 . 1 1 56 56 PRO C C 56 174.900 174.900 177.930 -3.030 19718
8944 1 19 . 1 1 56 56 PRO CA C 56 63.000 63.000 65.075 -2.075 19718
8945 1 19 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.747 -2.346 19718
8946 1 19 . 1 1 57 57 ASP N N 57 117.100 117.100 118.083 -0.983 19718
8947 1 19 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.327 0.043 19718
8948 1 19 . 1 1 57 57 ASP C C 57 174.100 174.100 177.502 -3.402 19718
8949 1 19 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.984 -3.284 19718
8950 1 19 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.900 -4.100 19718
8951 1 19 . 1 1 57 57 ASP H H 57 9.110 9.110 8.560 0.550 19718
8952 1 19 . 1 1 58 58 TYR N N 58 115.800 115.800 117.995 -2.195 19718
8953 1 19 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.386 -0.026 19718
8954 1 19 . 1 1 58 58 TYR C C 58 173.200 173.200 178.091 -4.891 19718
8955 1 19 . 1 1 58 58 TYR CA C 58 56.700 56.700 60.155 -3.455 19718
8956 1 19 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.000 -0.100 19718
8957 1 19 . 1 1 58 58 TYR H H 58 8.190 8.190 7.823 0.367 19718
8958 1 19 . 1 1 59 59 TYR N N 59 120.100 120.100 121.213 -1.113 19718
8959 1 19 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.136 -0.356 19718
8960 1 19 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.620 -0.520 19718
8961 1 19 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.317 -1.917 19718
8962 1 19 . 1 1 59 59 TYR H H 59 7.420 7.420 8.435 -1.015 19718
8963 1 19 . 1 1 60 60 ASP N N 60 115.200 115.200 118.927 -3.727 19718
8964 1 19 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.532 -0.172 19718
8965 1 19 . 1 1 60 60 ASP C C 60 173.100 173.100 176.577 -3.477 19718
8966 1 19 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.796 -2.396 19718
8967 1 19 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.533 -3.033 19718
8968 1 19 . 1 1 60 60 ASP H H 60 8.440 8.440 8.317 0.123 19718
8969 1 19 . 1 1 61 61 ALA N N 61 120.200 120.200 120.758 -0.558 19718
8970 1 19 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.414 -0.234 19718
8971 1 19 . 1 1 61 61 ALA C C 61 175.000 175.000 177.218 -2.218 19718
8972 1 19 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.064 -2.764 19718
8973 1 19 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.887 -3.687 19718
8974 1 19 . 1 1 61 61 ALA H H 61 7.300 7.300 7.434 -0.134 19718
8975 1 19 . 1 1 62 62 LEU N N 62 118.000 118.000 122.080 -4.080 19718
8976 1 19 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.644 -0.354 19718
8977 1 19 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.986 -2.886 19718
8978 1 19 . 1 1 62 62 LEU CB C 62 38.700 38.700 41.859 -3.159 19718
8979 1 19 . 1 1 62 62 LEU H H 62 6.680 6.680 7.648 -0.968 19718
8980 1 19 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.548 -0.228 19718
8981 1 19 . 1 1 63 63 PRO C C 63 173.500 173.500 175.767 -2.267 19718
8982 1 19 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.076 -2.376 19718
8983 1 19 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.523 -4.023 19718
8984 1 19 . 1 1 64 64 GLU N N 64 124.500 124.500 118.808 5.692 19718
8985 1 19 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.558 -0.378 19718
8986 1 19 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.364 -1.864 19718
8987 1 19 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.600 -4.800 19718
8988 1 19 . 1 1 64 64 GLU H H 64 8.590 8.590 8.375 0.215 19718
8989 1 19 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.618 -0.448 19718
8990 1 19 . 1 1 65 65 PRO C C 65 174.900 174.900 176.078 -1.178 19718
8991 1 19 . 1 1 65 65 PRO CA C 65 63.000 63.000 61.986 1.014 19718
8992 1 19 . 1 1 65 65 PRO CB C 65 28.500 28.500 33.224 -4.724 19718
8993 1 19 . 1 1 66 66 GLU N N 66 123.300 123.300 119.522 3.778 19718
8994 1 19 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.115 0.215 19718
8995 1 19 . 1 1 66 66 GLU C C 66 174.200 174.200 177.301 -3.101 19718
8996 1 19 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.771 -4.271 19718
8997 1 19 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.554 -3.154 19718
8998 1 19 . 1 1 66 66 GLU H H 66 9.080 9.080 8.938 0.142 19718
8999 1 19 . 1 1 67 67 ASP N N 67 120.100 120.100 121.028 -0.928 19718
9000 1 19 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.589 -0.349 19718
9001 1 19 . 1 1 67 67 ASP C C 67 174.900 174.900 176.500 -1.600 19718
9002 1 19 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.636 -1.236 19718
9003 1 19 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.871 -3.071 19718
9004 1 19 . 1 1 67 67 ASP H H 67 8.690 8.690 8.661 0.029 19718
9005 1 19 . 1 1 68 68 ASP N N 68 116.800 116.800 116.752 0.048 19718
9006 1 19 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.566 -0.326 19718
9007 1 19 . 1 1 68 68 ASP C C 68 175.500 175.500 177.162 -1.662 19718
9008 1 19 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.737 -1.437 19718
9009 1 19 . 1 1 68 68 ASP CB C 68 36.100 36.100 41.116 -5.016 19718
9010 1 19 . 1 1 68 68 ASP H H 68 8.400 8.400 8.581 -0.181 19718
9011 1 19 . 1 1 69 69 GLU N N 69 123.600 123.600 118.576 5.024 19718
9012 1 19 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.231 -0.081 19718
9013 1 19 . 1 1 69 69 GLU C C 69 175.200 175.200 178.343 -3.143 19718
9014 1 19 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.522 -2.322 19718
9015 1 19 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.588 -4.588 19718
9016 1 19 . 1 1 69 69 GLU H H 69 7.530 7.530 7.778 -0.248 19718
9017 1 19 . 1 1 70 70 ASN N N 70 119.100 119.100 118.311 0.789 19718
9018 1 19 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.465 -0.105 19718
9019 1 19 . 1 1 70 70 ASN C C 70 175.200 175.200 176.966 -1.766 19718
9020 1 19 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.472 -1.772 19718
9021 1 19 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.776 -2.976 19718
9022 1 19 . 1 1 70 70 ASN H H 70 7.960 7.960 8.667 -0.707 19718
9023 1 19 . 1 1 71 71 ASP N N 71 118.400 118.400 120.083 -1.683 19718
9024 1 19 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.413 -0.163 19718
9025 1 19 . 1 1 71 71 ASP C C 71 176.000 176.000 177.832 -1.832 19718
9026 1 19 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.879 -2.279 19718
9027 1 19 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.803 -3.303 19718
9028 1 19 . 1 1 71 71 ASP H H 71 8.250 8.250 8.167 0.083 19718
9029 1 19 . 1 1 72 72 MET N N 72 117.300 117.300 116.111 1.189 19718
9030 1 19 . 1 1 72 72 MET HA H 72 4.370 4.370 4.195 0.175 19718
9031 1 19 . 1 1 72 72 MET C C 72 177.800 177.800 177.145 0.655 19718
9032 1 19 . 1 1 72 72 MET CA C 72 53.700 53.700 57.947 -4.247 19718
9033 1 19 . 1 1 72 72 MET CB C 72 32.400 32.400 32.733 -0.333 19718
9034 1 19 . 1 1 72 72 MET H H 72 7.240 7.240 7.623 -0.383 19718
9035 1 19 . 1 1 73 73 LEU N N 73 123.000 123.000 117.098 5.902 19718
9036 1 19 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.248 -0.488 19718
9037 1 19 . 1 1 73 73 LEU C C 73 175.700 175.700 178.929 -3.229 19718
9038 1 19 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.416 -1.516 19718
9039 1 19 . 1 1 73 73 LEU CB C 73 38.100 38.100 42.013 -3.913 19718
9040 1 19 . 1 1 73 73 LEU H H 73 8.600 8.600 7.156 1.444 19718
9041 1 19 . 1 1 74 74 ASP N N 74 118.500 118.500 118.646 -0.146 19718
9042 1 19 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.399 -0.059 19718
9043 1 19 . 1 1 74 74 ASP C C 74 174.700 174.700 177.894 -3.194 19718
9044 1 19 . 1 1 74 74 ASP CA C 74 54.300 54.300 57.247 -2.947 19718
9045 1 19 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.641 -2.441 19718
9046 1 19 . 1 1 74 74 ASP H H 74 7.250 7.250 7.782 -0.532 19718
9047 1 19 . 1 1 75 75 LEU N N 75 116.300 116.300 118.185 -1.885 19718
9048 1 19 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.188 0.112 19718
9049 1 19 . 1 1 75 75 LEU C C 75 174.500 174.500 176.836 -2.336 19718
9050 1 19 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.835 -4.535 19718
9051 1 19 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.554 -1.954 19718
9052 1 19 . 1 1 75 75 LEU H H 75 7.000 7.000 7.448 -0.448 19718
9053 1 19 . 1 1 76 76 ALA N N 76 124.600 124.600 120.521 4.079 19718
9054 1 19 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.424 -0.324 19718
9055 1 19 . 1 1 76 76 ALA C C 76 174.200 174.200 175.833 -1.633 19718
9056 1 19 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.576 -1.076 19718
9057 1 19 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.372 -5.172 19718
9058 1 19 . 1 1 76 76 ALA H H 76 7.590 7.590 7.792 -0.202 19718
9059 1 19 . 1 1 77 77 TYR N N 77 122.900 122.900 121.560 1.340 19718
9060 1 19 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.285 0.145 19718
9061 1 19 . 1 1 77 77 TYR C C 77 174.100 174.100 176.982 -2.882 19718
9062 1 19 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.618 -4.718 19718
9063 1 19 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.263 -3.363 19718
9064 1 19 . 1 1 77 77 TYR H H 77 8.150 8.150 7.778 0.372 19718
9065 1 19 . 1 1 78 78 GLY N N 78 112.900 112.900 115.119 -2.219 19718
9066 1 19 . 1 1 78 78 GLY C C 78 171.800 171.800 173.822 -2.022 19718
9067 1 19 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.793 -1.093 19718
9068 1 19 . 1 1 78 78 GLY H H 78 8.320 8.320 8.391 -0.071 19718
9069 1 19 . 1 1 79 79 LEU N N 79 119.300 119.300 118.937 0.363 19718
9070 1 19 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.385 -0.595 19718
9071 1 19 . 1 1 79 79 LEU C C 79 174.000 174.000 176.553 -2.553 19718
9072 1 19 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.281 -1.281 19718
9073 1 19 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.674 -2.774 19718
9074 1 19 . 1 1 79 79 LEU H H 79 7.120 7.120 7.954 -0.834 19718
9075 1 19 . 1 1 80 80 THR N N 80 118.500 118.500 118.512 -0.012 19718
9076 1 19 . 1 1 80 80 THR HA H 80 4.860 4.860 4.449 0.411 19718
9077 1 19 . 1 1 80 80 THR C C 80 173.300 173.300 175.821 -2.521 19718
9078 1 19 . 1 1 80 80 THR CA C 80 57.600 57.600 61.334 -3.735 19718
9079 1 19 . 1 1 80 80 THR CB C 80 71.000 71.000 69.879 1.121 19718
9080 1 19 . 1 1 80 80 THR H H 80 9.240 9.240 8.131 1.109 19718
9081 1 19 . 1 1 81 81 GLU N N 81 118.000 118.000 120.269 -2.269 19718
9082 1 19 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.168 -0.058 19718
9083 1 19 . 1 1 81 81 GLU C C 81 173.900 173.900 176.083 -2.183 19718
9084 1 19 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.328 -2.928 19718
9085 1 19 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.610 -2.910 19718
9086 1 19 . 1 1 81 81 GLU H H 81 9.020 9.020 8.760 0.260 19718
9087 1 19 . 1 1 82 82 THR N N 82 106.400 106.400 106.279 0.121 19718
9088 1 19 . 1 1 82 82 THR HA H 82 3.950 3.950 2.793 1.157 19718
9089 1 19 . 1 1 82 82 THR C C 82 171.700 171.700 173.304 -1.604 19718
9090 1 19 . 1 1 82 82 THR CA C 82 56.800 56.800 59.633 -2.833 19718
9091 1 19 . 1 1 82 82 THR CB C 82 63.800 63.800 68.786 -4.986 19718
9092 1 19 . 1 1 82 82 THR H H 82 7.630 7.630 7.540 0.090 19718
9093 1 19 . 1 1 83 83 SER N N 83 121.500 121.500 119.099 2.401 19718
9094 1 19 . 1 1 83 83 SER HA H 83 5.080 5.080 4.383 0.697 19718
9095 1 19 . 1 1 83 83 SER C C 83 170.900 170.900 173.598 -2.698 19718
9096 1 19 . 1 1 83 83 SER CA C 83 59.000 59.000 60.151 -1.151 19718
9097 1 19 . 1 1 83 83 SER CB C 83 61.700 61.700 63.866 -2.166 19718
9098 1 19 . 1 1 83 83 SER H H 83 6.930 6.930 7.878 -0.948 19718
9099 1 19 . 1 1 84 84 ARG N N 84 119.300 119.300 125.606 -6.306 19718
9100 1 19 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.931 -0.061 19718
9101 1 19 . 1 1 84 84 ARG C C 84 172.400 172.400 174.491 -2.091 19718
9102 1 19 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.030 -3.730 19718
9103 1 19 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.447 -2.047 19718
9104 1 19 . 1 1 84 84 ARG H H 84 9.280 9.280 9.023 0.257 19718
9105 1 19 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.505 -0.075 19718
9106 1 19 . 1 1 88 88 GLN C C 88 172.500 172.500 174.105 -1.605 19718
9107 1 19 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.659 -4.659 19718
9108 1 19 . 1 1 88 88 GLN CB C 88 27.000 27.000 30.774 -3.774 19718
9109 1 19 . 1 1 90 90 LYS N N 90 123.700 123.700 126.289 -2.589 19718
9110 1 19 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.096 -0.646 19718
9111 1 19 . 1 1 90 90 LYS C C 90 173.500 173.500 175.086 -1.586 19718
9112 1 19 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.493 -1.993 19718
9113 1 19 . 1 1 90 90 LYS CB C 90 31.900 31.900 35.254 -3.354 19718
9114 1 19 . 1 1 90 90 LYS H H 90 8.330 8.330 8.066 0.264 19718
9115 1 19 . 1 1 91 91 MET N N 91 118.200 118.200 119.635 -1.435 19718
9116 1 19 . 1 1 91 91 MET HA H 91 4.330 4.330 4.654 -0.324 19718
9117 1 19 . 1 1 91 91 MET C C 91 174.300 174.300 176.125 -1.825 19718
9118 1 19 . 1 1 91 91 MET CA C 91 51.800 51.800 54.905 -3.105 19718
9119 1 19 . 1 1 91 91 MET CB C 91 27.200 27.200 31.493 -4.293 19718
9120 1 19 . 1 1 91 91 MET H H 91 8.620 8.620 8.388 0.232 19718
9121 1 19 . 1 1 92 92 SER N N 92 117.000 117.000 117.765 -0.765 19718
9122 1 19 . 1 1 92 92 SER HA H 92 4.610 4.610 4.739 -0.129 19718
9123 1 19 . 1 1 92 92 SER C C 92 171.300 171.300 175.073 -3.773 19718
9124 1 19 . 1 1 92 92 SER CA C 92 54.000 54.000 56.882 -2.882 19718
9125 1 19 . 1 1 92 92 SER CB C 92 63.700 63.700 65.933 -2.233 19718
9126 1 19 . 1 1 92 92 SER H H 92 6.970 6.970 8.350 -1.380 19718
9127 1 19 . 1 1 93 93 LYS N N 93 121.700 121.700 121.087 0.613 19718
9128 1 19 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.247 -0.277 19718
9129 1 19 . 1 1 93 93 LYS C C 93 175.200 175.200 178.352 -3.152 19718
9130 1 19 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.505 -1.805 19718
9131 1 19 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.252 -3.152 19718
9132 1 19 . 1 1 93 93 LYS H H 93 9.260 9.260 8.872 0.388 19718
9133 1 19 . 1 1 94 94 ASP N N 94 116.700 116.700 118.666 -1.966 19718
9134 1 19 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.476 -0.116 19718
9135 1 19 . 1 1 94 94 ASP C C 94 174.300 174.300 177.015 -2.715 19718
9136 1 19 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.824 -3.124 19718
9137 1 19 . 1 1 94 94 ASP CB C 94 37.900 37.900 40.962 -3.062 19718
9138 1 19 . 1 1 94 94 ASP H H 94 8.020 8.020 8.438 -0.418 19718
9139 1 19 . 1 1 95 95 ILE N N 95 109.000 109.000 110.176 -1.176 19718
9140 1 19 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.776 -0.116 19718
9141 1 19 . 1 1 95 95 ILE C C 95 170.600 170.600 174.565 -3.965 19718
9142 1 19 . 1 1 95 95 ILE CA C 95 57.300 57.300 59.625 -2.325 19718
9143 1 19 . 1 1 95 95 ILE CB C 95 35.200 35.200 39.512 -4.312 19718
9144 1 19 . 1 1 95 95 ILE H H 95 7.240 7.240 7.231 0.009 19718
9145 1 19 . 1 1 96 96 ASP N N 96 119.800 119.800 123.613 -3.813 19718
9146 1 19 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.464 -0.284 19718
9147 1 19 . 1 1 96 96 ASP C C 96 174.900 174.900 176.654 -1.754 19718
9148 1 19 . 1 1 96 96 ASP CA C 96 53.700 53.700 55.429 -1.730 19718
9149 1 19 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.330 -0.330 19718
9150 1 19 . 1 1 96 96 ASP H H 96 6.950 6.950 7.858 -0.908 19718
9151 1 19 . 1 1 97 97 GLY N N 97 118.500 118.500 112.176 6.324 19718
9152 1 19 . 1 1 97 97 GLY C C 97 170.500 170.500 174.267 -3.767 19718
9153 1 19 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.282 -1.982 19718
9154 1 19 . 1 1 97 97 GLY H H 97 9.210 9.210 8.271 0.939 19718
9155 1 19 . 1 1 98 98 ILE N N 98 121.300 121.300 121.607 -0.307 19718
9156 1 19 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.265 2.335 19718
9157 1 19 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.959 -3.360 19718
9158 1 19 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.591 -3.891 19718
9159 1 19 . 1 1 98 98 ILE H H 98 7.660 7.660 7.955 -0.295 19718
9160 1 19 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.268 0.082 19718
9161 1 19 . 1 1 99 99 ARG C C 99 172.200 172.200 175.167 -2.967 19718
9162 1 19 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.167 -4.067 19718
9163 1 19 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.495 -2.995 19718
9164 1 19 . 1 1 100 100 VAL N N 100 114.900 114.900 116.362 -1.462 19718
9165 1 19 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.198 -0.378 19718
9166 1 19 . 1 1 100 100 VAL C C 100 169.600 169.600 173.332 -3.732 19718
9167 1 19 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.360 -4.160 19718
9168 1 19 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.550 -4.250 19718
9169 1 19 . 1 1 100 100 VAL H H 100 8.440 8.440 8.871 -0.431 19718
9170 1 19 . 1 1 101 101 ALA N N 101 123.400 123.400 122.790 0.610 19718
9171 1 19 . 1 1 101 101 ALA HA H 101 5.310 5.310 5.042 0.268 19718
9172 1 19 . 1 1 101 101 ALA C C 101 174.400 174.400 175.153 -0.753 19718
9173 1 19 . 1 1 101 101 ALA CA C 101 46.800 46.800 49.842 -3.042 19718
9174 1 19 . 1 1 101 101 ALA CB C 101 18.800 18.800 22.207 -3.407 19718
9175 1 19 . 1 1 101 101 ALA H H 101 9.040 9.040 8.985 0.055 19718
9176 1 19 . 1 1 102 102 LEU N N 102 120.600 120.600 124.106 -3.506 19718
9177 1 19 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.131 -0.561 19718
9178 1 19 . 1 1 102 102 LEU CA C 102 52.200 52.200 51.622 0.578 19718
9179 1 19 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.802 -6.902 19718
9180 1 19 . 1 1 102 102 LEU H H 102 8.260 8.260 8.569 -0.309 19718
9181 1 19 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.452 0.128 19718
9182 1 19 . 1 1 112 112 ASN C C 112 171.900 171.900 173.895 -1.995 19718
9183 1 19 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.955 -3.555 19718
9184 1 19 . 1 1 112 112 ASN CB C 112 36.700 36.700 38.797 -2.098 19718
9185 1 19 . 1 1 113 113 ASP N N 113 120.300 120.300 119.176 1.124 19718
9186 1 19 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.781 -0.341 19718
9187 1 19 . 1 1 113 113 ASP C C 113 173.000 173.000 175.335 -2.335 19718
9188 1 19 . 1 1 113 113 ASP CA C 113 51.600 51.600 53.936 -2.336 19718
9189 1 19 . 1 1 113 113 ASP CB C 113 38.100 38.100 41.781 -3.680 19718
9190 1 19 . 1 1 113 113 ASP H H 113 8.040 8.040 8.426 -0.386 19718
9191 1 19 . 1 1 114 114 PHE N N 114 120.100 120.100 119.197 0.903 19718
9192 1 19 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.914 -0.304 19718
9193 1 19 . 1 1 114 114 PHE C C 114 172.200 172.200 174.556 -2.356 19718
9194 1 19 . 1 1 114 114 PHE CA C 114 54.900 54.900 57.711 -2.811 19718
9195 1 19 . 1 1 114 114 PHE CB C 114 36.500 36.500 41.352 -4.851 19718
9196 1 19 . 1 1 114 114 PHE H H 114 8.110 8.110 8.507 -0.397 19718
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 78 2.812 0.301 2.814 19718
2 1 1 "Average Difference" HA 88 0.426 0.051 0.425 19718
3 1 1 "Average Difference" C 79 2.822 2.617 1.063 19718
4 1 1 "Average Difference" CA 87 2.814 2.532 1.235 19718
5 1 1 "Average Difference" CB 82 3.317 3.031 1.355 19718
6 1 1 "Average Difference" HN 78 0.535 0.029 0.537 19718
7 1 2 "Average Difference" N 78 2.902 0.757 2.820 19718
8 1 2 "Average Difference" HA 88 0.415 0.074 0.411 19718
9 1 2 "Average Difference" C 79 2.781 2.603 0.984 19718
10 1 2 "Average Difference" CA 87 2.817 2.521 1.265 19718
11 1 2 "Average Difference" CB 82 3.293 3.021 1.319 19718
12 1 2 "Average Difference" HN 78 0.501 0.103 0.493 19718
13 1 3 "Average Difference" N 78 2.928 0.052 2.946 19718
14 1 3 "Average Difference" HA 88 0.424 0.070 0.421 19718
15 1 3 "Average Difference" C 79 2.765 2.578 1.006 19718
16 1 3 "Average Difference" CA 87 2.744 2.464 1.215 19718
17 1 3 "Average Difference" CB 82 3.299 3.026 1.322 19718
18 1 3 "Average Difference" HN 78 0.590 0.075 0.589 19718
19 1 4 "Average Difference" N 78 2.791 0.523 2.759 19718
20 1 4 "Average Difference" HA 88 0.439 0.067 0.436 19718
21 1 4 "Average Difference" C 79 2.839 2.647 1.034 19718
22 1 4 "Average Difference" CA 87 2.815 2.521 1.260 19718
23 1 4 "Average Difference" CB 82 3.406 3.113 1.391 19718
24 1 4 "Average Difference" HN 78 0.526 0.056 0.526 19718
25 1 5 "Average Difference" N 78 2.767 0.590 2.720 19718
26 1 5 "Average Difference" HA 88 0.423 0.056 0.422 19718
27 1 5 "Average Difference" C 79 2.886 2.688 1.056 19718
28 1 5 "Average Difference" CA 87 2.854 2.567 1.254 19718
29 1 5 "Average Difference" CB 82 3.252 2.951 1.375 19718
30 1 5 "Average Difference" HN 78 0.531 0.069 0.529 19718
31 1 6 "Average Difference" N 78 2.802 0.512 2.773 19718
32 1 6 "Average Difference" HA 88 0.420 0.061 0.418 19718
33 1 6 "Average Difference" C 79 2.850 2.647 1.063 19718
34 1 6 "Average Difference" CA 87 2.866 2.550 1.314 19718
35 1 6 "Average Difference" CB 82 3.286 3.023 1.295 19718
36 1 6 "Average Difference" HN 78 0.538 0.096 0.532 19718
37 1 7 "Average Difference" N 78 2.820 0.407 2.808 19718
38 1 7 "Average Difference" HA 88 0.444 0.052 0.443 19718
39 1 7 "Average Difference" C 79 2.838 2.633 1.066 19718
40 1 7 "Average Difference" CA 87 2.821 2.512 1.291 19718
41 1 7 "Average Difference" CB 82 3.296 2.985 1.407 19718
42 1 7 "Average Difference" HN 78 0.544 0.079 0.542 19718
43 1 8 "Average Difference" N 78 2.918 0.310 2.921 19718
44 1 8 "Average Difference" HA 88 0.414 0.059 0.412 19718
45 1 8 "Average Difference" C 79 2.792 2.586 1.061 19718
46 1 8 "Average Difference" CA 87 2.795 2.497 1.265 19718
47 1 8 "Average Difference" CB 82 3.392 3.114 1.355 19718
48 1 8 "Average Difference" HN 78 0.552 0.031 0.554 19718
49 1 9 "Average Difference" N 78 2.685 0.532 2.649 19718
50 1 9 "Average Difference" HA 88 0.410 0.076 0.405 19718
51 1 9 "Average Difference" C 79 2.825 2.619 1.064 19718
52 1 9 "Average Difference" CA 87 2.717 2.441 1.200 19718
53 1 9 "Average Difference" CB 82 3.312 3.032 1.341 19718
54 1 9 "Average Difference" HN 78 0.539 0.032 0.542 19718
55 1 10 "Average Difference" N 78 2.582 0.539 2.542 19718
56 1 10 "Average Difference" HA 88 0.428 0.062 0.426 19718
57 1 10 "Average Difference" C 79 2.798 2.614 1.004 19718
58 1 10 "Average Difference" CA 87 2.854 2.593 1.199 19718
59 1 10 "Average Difference" CB 82 3.327 3.110 1.191 19718
60 1 10 "Average Difference" HN 78 0.547 0.104 0.541 19718
61 1 11 "Average Difference" N 78 2.607 0.338 2.602 19718
62 1 11 "Average Difference" HA 88 0.393 0.052 0.392 19718
63 1 11 "Average Difference" C 79 2.768 2.569 1.035 19718
64 1 11 "Average Difference" CA 87 2.855 2.567 1.256 19718
65 1 11 "Average Difference" CB 82 3.361 3.064 1.390 19718
66 1 11 "Average Difference" HN 78 0.563 0.072 0.562 19718
67 1 12 "Average Difference" N 78 2.838 0.379 2.831 19718
68 1 12 "Average Difference" HA 88 0.430 0.055 0.429 19718
69 1 12 "Average Difference" C 79 2.799 2.609 1.021 19718
70 1 12 "Average Difference" CA 87 2.852 2.593 1.193 19718
71 1 12 "Average Difference" CB 82 3.351 3.050 1.396 19718
72 1 12 "Average Difference" HN 78 0.549 0.073 0.548 19718
73 1 13 "Average Difference" N 78 2.944 0.426 2.932 19718
74 1 13 "Average Difference" HA 88 0.419 0.074 0.414 19718
75 1 13 "Average Difference" C 79 2.799 2.590 1.067 19718
76 1 13 "Average Difference" CA 87 2.801 2.484 1.302 19718
77 1 13 "Average Difference" CB 82 3.346 3.081 1.312 19718
78 1 13 "Average Difference" HN 78 0.532 0.049 0.534 19718
79 1 14 "Average Difference" N 78 2.524 0.625 2.462 19718
80 1 14 "Average Difference" HA 88 0.445 0.079 0.440 19718
81 1 14 "Average Difference" C 79 2.834 2.619 1.090 19718
82 1 14 "Average Difference" CA 87 2.850 2.534 1.312 19718
83 1 14 "Average Difference" CB 82 3.243 2.983 1.280 19718
84 1 14 "Average Difference" HN 78 0.526 0.052 0.527 19718
85 1 15 "Average Difference" N 78 2.619 0.561 2.574 19718
86 1 15 "Average Difference" HA 88 0.432 0.064 0.430 19718
87 1 15 "Average Difference" C 79 2.775 2.590 1.003 19718
88 1 15 "Average Difference" CA 87 2.719 2.428 1.231 19718
89 1 15 "Average Difference" CB 82 3.243 3.014 1.205 19718
90 1 15 "Average Difference" HN 78 0.542 0.077 0.540 19718
91 1 16 "Average Difference" N 78 2.861 0.416 2.849 19718
92 1 16 "Average Difference" HA 88 0.402 0.074 0.397 19718
93 1 16 "Average Difference" C 79 2.791 2.592 1.041 19718
94 1 16 "Average Difference" CA 87 2.824 2.514 1.293 19718
95 1 16 "Average Difference" CB 82 3.191 2.900 1.339 19718
96 1 16 "Average Difference" HN 78 0.534 0.062 0.533 19718
97 1 17 "Average Difference" N 78 2.719 0.263 2.724 19718
98 1 17 "Average Difference" HA 88 0.418 0.073 0.414 19718
99 1 17 "Average Difference" C 79 2.781 2.596 1.005 19718
100 1 17 "Average Difference" CA 87 2.743 2.463 1.214 19718
101 1 17 "Average Difference" CB 82 3.341 3.072 1.321 19718
102 1 17 "Average Difference" HN 78 0.532 0.049 0.533 19718
103 1 18 "Average Difference" N 78 2.587 0.539 2.547 19718
104 1 18 "Average Difference" HA 88 0.440 0.063 0.438 19718
105 1 18 "Average Difference" C 79 2.858 2.634 1.115 19718
106 1 18 "Average Difference" CA 87 2.814 2.561 1.173 19718
107 1 18 "Average Difference" CB 82 3.390 3.077 1.431 19718
108 1 18 "Average Difference" HN 78 0.501 0.079 0.498 19718
109 1 19 "Average Difference" N 78 2.891 0.420 2.879 19718
110 1 19 "Average Difference" HA 88 0.441 0.090 0.435 19718
111 1 19 "Average Difference" C 79 2.765 2.566 1.037 19718
112 1 19 "Average Difference" CA 87 2.804 2.495 1.286 19718
113 1 19 "Average Difference" CB 82 3.374 3.055 1.441 19718
114 1 19 "Average Difference" HN 78 0.534 0.091 0.529 19718
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 19718
_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 GLU HA H 2 4.240 4.240 4.318 -0.078 19718
2 1 . 1 1 2 2 GLU C C 2 173.400 173.400 175.665 -2.265 19718
3 1 . 1 1 2 2 GLU CA C 2 53.400 53.400 56.336 -2.936 19718
4 1 . 1 1 2 2 GLU CB C 2 27.000 27.000 30.370 -3.370 19718
5 1 . 1 1 3 3 GLU N N 3 121.200 121.200 121.189 0.011 19718
6 1 . 1 1 3 3 GLU HA H 3 4.380 4.380 4.506 -0.126 19718
7 1 . 1 1 3 3 GLU C C 3 173.000 173.000 175.884 -2.884 19718
8 1 . 1 1 3 3 GLU CA C 3 54.400 54.400 56.421 -2.021 19718
9 1 . 1 1 3 3 GLU CB C 3 27.400 27.400 30.515 -3.115 19718
10 1 . 1 1 3 3 GLU H H 3 8.510 8.510 8.367 0.143 19718
11 1 . 1 1 4 4 LEU N N 4 122.400 122.400 123.433 -1.033 19718
12 1 . 1 1 4 4 LEU HA H 4 4.550 4.550 4.814 -0.264 19718
13 1 . 1 1 4 4 LEU C C 4 172.900 172.900 175.301 -2.401 19718
14 1 . 1 1 4 4 LEU CA C 4 50.400 50.400 53.430 -3.030 19718
15 1 . 1 1 4 4 LEU CB C 4 41.700 41.700 45.835 -4.135 19718
16 1 . 1 1 4 4 LEU H H 4 8.460 8.460 8.564 -0.104 19718
17 1 . 1 1 5 5 LYS N N 5 119.300 119.300 119.105 0.195 19718
18 1 . 1 1 5 5 LYS HA H 5 5.420 5.420 5.310 0.110 19718
19 1 . 1 1 5 5 LYS C C 5 172.400 172.400 174.516 -2.116 19718
20 1 . 1 1 5 5 LYS CA C 5 52.300 52.300 54.743 -2.443 19718
21 1 . 1 1 5 5 LYS CB C 5 33.000 33.000 36.438 -3.438 19718
22 1 . 1 1 5 5 LYS H H 5 8.570 8.570 8.226 0.344 19718
23 1 . 1 1 6 6 ILE N N 6 116.900 116.900 121.658 -4.758 19718
24 1 . 1 1 6 6 ILE HA H 6 4.110 4.110 4.553 -0.443 19718
25 1 . 1 1 6 6 ILE C C 6 169.800 169.800 173.331 -3.531 19718
26 1 . 1 1 6 6 ILE CA C 6 55.500 55.500 59.410 -3.910 19718
27 1 . 1 1 6 6 ILE CB C 6 38.000 38.000 41.175 -3.175 19718
28 1 . 1 1 6 6 ILE H H 6 8.160 8.160 8.850 -0.690 19718
29 1 . 1 1 7 7 THR N N 7 123.000 123.000 125.306 -2.306 19718
30 1 . 1 1 7 7 THR HA H 7 5.220 5.220 5.089 0.131 19718
31 1 . 1 1 7 7 THR C C 7 169.900 169.900 173.509 -3.609 19718
32 1 . 1 1 7 7 THR CA C 7 58.400 58.400 61.246 -2.846 19718
33 1 . 1 1 7 7 THR CB C 7 68.700 68.700 69.763 -1.063 19718
34 1 . 1 1 7 7 THR H H 7 8.520 8.520 8.512 0.008 19718
35 1 . 1 1 8 8 PHE N N 8 124.000 124.000 124.244 -0.244 19718
36 1 . 1 1 8 8 PHE HA H 8 5.150 5.150 5.542 -0.392 19718
37 1 . 1 1 8 8 PHE C C 8 172.300 172.300 175.031 -2.731 19718
38 1 . 1 1 8 8 PHE CA C 8 53.600 53.600 55.202 -1.602 19718
39 1 . 1 1 8 8 PHE CB C 8 40.100 40.100 41.891 -1.791 19718
40 1 . 1 1 8 8 PHE H H 8 9.290 9.290 9.325 -0.035 19718
41 1 . 1 1 9 9 ILE N N 9 122.700 122.700 122.018 0.682 19718
42 1 . 1 1 9 9 ILE HA H 9 4.580 4.580 4.798 -0.218 19718
43 1 . 1 1 9 9 ILE C C 9 173.600 173.600 176.075 -2.475 19718
44 1 . 1 1 9 9 ILE CA C 9 58.200 58.200 60.429 -2.229 19718
45 1 . 1 1 9 9 ILE CB C 9 34.500 34.500 38.133 -3.633 19718
46 1 . 1 1 9 9 ILE H H 9 9.170 9.170 8.609 0.561 19718
47 1 . 1 1 10 10 LEU N N 10 126.700 126.700 126.833 -0.133 19718
48 1 . 1 1 10 10 LEU HA H 10 4.320 4.320 4.385 -0.065 19718
49 1 . 1 1 10 10 LEU C C 10 176.500 176.500 178.552 -2.052 19718
50 1 . 1 1 10 10 LEU CA C 10 52.200 52.200 54.959 -2.759 19718
51 1 . 1 1 10 10 LEU CB C 10 37.500 37.500 42.242 -4.742 19718
52 1 . 1 1 10 10 LEU H H 10 9.100 9.100 8.991 0.109 19718
53 1 . 1 1 11 11 LYS N N 11 118.900 118.900 120.785 -1.885 19718
54 1 . 1 1 11 11 LYS HA H 11 3.960 3.960 4.105 -0.145 19718
55 1 . 1 1 11 11 LYS C C 11 174.100 174.100 177.507 -3.407 19718
56 1 . 1 1 11 11 LYS CA C 11 57.400 57.400 58.813 -1.413 19718
57 1 . 1 1 11 11 LYS CB C 11 28.900 28.900 32.235 -3.335 19718
58 1 . 1 1 11 11 LYS H H 11 8.520 8.520 8.798 -0.278 19718
59 1 . 1 1 12 12 ASP N N 12 114.400 114.400 116.883 -2.483 19718
60 1 . 1 1 12 12 ASP HA H 12 4.520 4.520 4.648 -0.128 19718
61 1 . 1 1 12 12 ASP C C 12 174.500 174.500 176.894 -2.394 19718
62 1 . 1 1 12 12 ASP CA C 12 50.400 50.400 53.744 -3.344 19718
63 1 . 1 1 12 12 ASP CB C 12 37.200 37.200 40.731 -3.532 19718
64 1 . 1 1 12 12 ASP H H 12 7.690 7.690 8.030 -0.340 19718
65 1 . 1 1 13 13 GLY N N 13 109.200 109.200 107.930 1.270 19718
66 1 . 1 1 13 13 GLY C C 13 171.600 171.600 174.484 -2.884 19718
67 1 . 1 1 13 13 GLY CA C 13 42.400 42.400 45.450 -3.050 19718
68 1 . 1 1 13 13 GLY H H 13 8.100 8.100 7.882 0.218 19718
69 1 . 1 1 14 14 SER N N 14 118.000 118.000 116.054 1.946 19718
70 1 . 1 1 14 14 SER HA H 14 4.280 4.280 4.397 -0.117 19718
71 1 . 1 1 14 14 SER C C 14 169.000 169.000 173.741 -4.741 19718
72 1 . 1 1 14 14 SER CA C 14 56.500 56.500 58.673 -2.173 19718
73 1 . 1 1 14 14 SER CB C 14 61.000 61.000 63.887 -2.887 19718
74 1 . 1 1 14 14 SER H H 14 8.110 8.110 8.024 0.086 19718
75 1 . 1 1 15 15 GLN N N 15 116.300 116.300 120.510 -4.210 19718
76 1 . 1 1 15 15 GLN HA H 15 5.660 5.660 5.246 0.414 19718
77 1 . 1 1 15 15 GLN C C 15 173.500 173.500 176.052 -2.552 19718
78 1 . 1 1 15 15 GLN CA C 15 51.700 51.700 54.973 -3.273 19718
79 1 . 1 1 15 15 GLN CB C 15 29.000 29.000 31.295 -2.295 19718
80 1 . 1 1 15 15 GLN H H 15 8.330 8.330 8.502 -0.172 19718
81 1 . 1 1 16 16 LYS N N 16 122.500 122.500 124.874 -2.374 19718
82 1 . 1 1 16 16 LYS HA H 16 4.330 4.330 4.608 -0.278 19718
83 1 . 1 1 16 16 LYS C C 16 171.300 171.300 174.478 -3.178 19718
84 1 . 1 1 16 16 LYS CA C 16 51.900 51.900 55.079 -3.179 19718
85 1 . 1 1 16 16 LYS CB C 16 34.000 34.000 35.660 -1.660 19718
86 1 . 1 1 16 16 LYS H H 16 8.780 8.780 8.764 0.016 19718
87 1 . 1 1 17 17 THR N N 17 120.000 120.000 119.583 0.417 19718
88 1 . 1 1 17 17 THR HA H 17 5.220 5.220 4.948 0.272 19718
89 1 . 1 1 17 17 THR C C 17 170.500 170.500 173.547 -3.047 19718
90 1 . 1 1 17 17 THR CA C 17 58.700 58.700 61.073 -2.373 19718
91 1 . 1 1 17 17 THR CB C 17 67.900 67.900 69.709 -1.809 19718
92 1 . 1 1 17 17 THR H H 17 8.160 8.160 8.444 -0.284 19718
93 1 . 1 1 18 18 TYR N N 18 125.600 125.600 126.841 -1.241 19718
94 1 . 1 1 18 18 TYR HA H 18 4.840 4.840 4.778 0.062 19718
95 1 . 1 1 18 18 TYR CA C 18 53.000 53.000 54.940 -1.940 19718
96 1 . 1 1 18 18 TYR CB C 18 39.100 39.100 41.985 -2.885 19718
97 1 . 1 1 18 18 TYR H H 18 9.020 9.020 9.146 -0.126 19718
98 1 . 1 1 19 19 GLU C C 19 174.200 174.200 175.742 -1.542 19718
99 1 . 1 1 19 19 GLU CA C 19 52.900 52.900 55.904 -3.004 19718
100 1 . 1 1 19 19 GLU CB C 19 27.300 27.300 30.823 -3.523 19718
101 1 . 1 1 20 20 VAL N N 20 119.000 119.000 118.875 0.125 19718
102 1 . 1 1 20 20 VAL HA H 20 4.840 4.840 4.687 0.153 19718
103 1 . 1 1 20 20 VAL C C 20 171.200 171.200 174.060 -2.860 19718
104 1 . 1 1 20 20 VAL CA C 20 56.600 56.600 59.633 -3.033 19718
105 1 . 1 1 20 20 VAL CB C 20 32.700 32.700 34.988 -2.288 19718
106 1 . 1 1 20 20 VAL H H 20 9.160 9.160 8.715 0.445 19718
107 1 . 1 1 21 21 CYS N N 21 117.500 117.500 119.059 -1.559 19718
108 1 . 1 1 21 21 CYS HA H 21 4.760 4.760 4.934 -0.174 19718
109 1 . 1 1 21 21 CYS C C 21 171.400 171.400 174.630 -3.230 19718
110 1 . 1 1 21 21 CYS CA C 21 54.900 54.900 57.191 -2.291 19718
111 1 . 1 1 21 21 CYS CB C 21 27.200 27.200 30.436 -3.236 19718
112 1 . 1 1 21 21 CYS H H 21 8.720 8.720 8.729 -0.009 19718
113 1 . 1 1 22 22 GLU N N 22 120.900 120.900 122.317 -1.417 19718
114 1 . 1 1 22 22 GLU HA H 22 3.410 3.410 3.977 -0.567 19718
115 1 . 1 1 22 22 GLU C C 22 174.300 174.300 177.195 -2.895 19718
116 1 . 1 1 22 22 GLU CA C 22 55.100 55.100 58.228 -3.128 19718
117 1 . 1 1 22 22 GLU CB C 22 26.800 26.800 29.839 -3.039 19718
118 1 . 1 1 22 22 GLU H H 22 8.540 8.540 8.619 -0.079 19718
119 1 . 1 1 23 23 GLY N N 23 112.400 112.400 115.028 -2.628 19718
120 1 . 1 1 23 23 GLY C C 23 171.000 171.000 174.514 -3.514 19718
121 1 . 1 1 23 23 GLY CA C 23 42.400 42.400 44.997 -2.597 19718
122 1 . 1 1 23 23 GLY H H 23 8.720 8.720 8.899 -0.179 19718
123 1 . 1 1 24 24 GLU N N 24 119.600 119.600 122.114 -2.514 19718
124 1 . 1 1 24 24 GLU HA H 24 4.330 4.330 4.380 -0.050 19718
125 1 . 1 1 24 24 GLU C C 24 174.400 174.400 175.989 -1.589 19718
126 1 . 1 1 24 24 GLU CA C 24 54.100 54.100 56.568 -2.468 19718
127 1 . 1 1 24 24 GLU CB C 24 28.100 28.100 30.204 -2.104 19718
128 1 . 1 1 24 24 GLU H H 24 7.060 7.060 7.780 -0.720 19718
129 1 . 1 1 25 25 THR N N 25 113.600 113.600 117.785 -4.185 19718
130 1 . 1 1 25 25 THR HA H 25 5.510 5.510 4.753 0.757 19718
131 1 . 1 1 25 25 THR C C 25 173.100 173.100 175.559 -2.459 19718
132 1 . 1 1 25 25 THR CA C 25 57.000 57.000 61.346 -4.346 19718
133 1 . 1 1 25 25 THR CB C 25 68.700 68.700 70.562 -1.862 19718
134 1 . 1 1 25 25 THR H H 25 9.080 9.080 8.460 0.620 19718
135 1 . 1 1 26 26 ILE N N 26 120.300 120.300 124.005 -3.705 19718
136 1 . 1 1 26 26 ILE HA H 26 3.630 3.630 3.924 -0.294 19718
137 1 . 1 1 26 26 ILE C C 26 174.700 174.700 177.623 -2.923 19718
138 1 . 1 1 26 26 ILE CA C 26 63.700 63.700 64.169 -0.469 19718
139 1 . 1 1 26 26 ILE CB C 26 33.000 33.000 37.357 -4.357 19718
140 1 . 1 1 26 26 ILE H H 26 7.860 7.860 8.405 -0.545 19718
141 1 . 1 1 27 27 LEU N N 27 117.600 117.600 120.864 -3.264 19718
142 1 . 1 1 27 27 LEU HA H 27 3.750 3.750 4.008 -0.258 19718
143 1 . 1 1 27 27 LEU C C 27 174.000 174.000 178.362 -4.362 19718
144 1 . 1 1 27 27 LEU CA C 27 54.900 54.900 58.254 -3.354 19718
145 1 . 1 1 27 27 LEU CB C 27 39.300 39.300 41.189 -1.889 19718
146 1 . 1 1 27 27 LEU H H 27 6.580 6.580 8.230 -1.650 19718
147 1 . 1 1 28 28 ASP N N 28 120.000 120.000 119.728 0.272 19718
148 1 . 1 1 28 28 ASP HA H 28 4.250 4.250 4.428 -0.178 19718
149 1 . 1 1 28 28 ASP C C 28 177.900 177.900 178.846 -0.946 19718
150 1 . 1 1 28 28 ASP CA C 28 55.000 55.000 57.960 -2.960 19718
151 1 . 1 1 28 28 ASP CB C 28 36.900 36.900 40.689 -3.789 19718
152 1 . 1 1 28 28 ASP H H 28 7.880 7.880 8.320 -0.440 19718
153 1 . 1 1 29 29 ILE N N 29 122.100 122.100 120.390 1.710 19718
154 1 . 1 1 29 29 ILE HA H 29 3.740 3.740 3.963 -0.223 19718
155 1 . 1 1 29 29 ILE C C 29 175.700 175.700 177.864 -2.164 19718
156 1 . 1 1 29 29 ILE CA C 29 62.100 62.100 64.822 -2.722 19718
157 1 . 1 1 29 29 ILE CB C 29 36.500 36.500 38.034 -1.534 19718
158 1 . 1 1 29 29 ILE H H 29 8.340 8.340 8.354 -0.014 19718
159 1 . 1 1 30 30 ALA N N 30 124.100 124.100 123.319 0.781 19718
160 1 . 1 1 30 30 ALA HA H 30 3.340 3.340 3.694 -0.354 19718
161 1 . 1 1 30 30 ALA C C 30 177.600 177.600 179.562 -1.962 19718
162 1 . 1 1 30 30 ALA CA C 30 52.800 52.800 55.524 -2.724 19718
163 1 . 1 1 30 30 ALA CB C 30 16.800 16.800 18.139 -1.339 19718
164 1 . 1 1 30 30 ALA H H 30 8.430 8.430 8.367 0.063 19718
165 1 . 1 1 31 31 GLN N N 31 116.000 116.000 116.508 -0.508 19718
166 1 . 1 1 31 31 GLN HA H 31 4.160 4.160 4.211 -0.051 19718
167 1 . 1 1 31 31 GLN C C 31 178.100 178.100 178.674 -0.574 19718
168 1 . 1 1 31 31 GLN CA C 31 56.700 56.700 57.749 -1.049 19718
169 1 . 1 1 31 31 GLN CB C 31 25.200 25.200 28.942 -3.742 19718
170 1 . 1 1 31 31 GLN H H 31 8.760 8.760 8.388 0.372 19718
171 1 . 1 1 32 32 GLY N N 32 108.700 108.700 107.585 1.115 19718
172 1 . 1 1 32 32 GLY C C 32 171.700 171.700 175.271 -3.571 19718
173 1 . 1 1 32 32 GLY CA C 32 43.200 43.200 46.263 -3.063 19718
174 1 . 1 1 32 32 GLY H H 32 8.220 8.220 7.979 0.241 19718
175 1 . 1 1 33 33 HIS N N 33 115.000 115.000 119.186 -4.186 19718
176 1 . 1 1 33 33 HIS HA H 33 4.430 4.430 4.609 -0.179 19718
177 1 . 1 1 33 33 HIS C C 33 169.800 169.800 174.407 -4.607 19718
178 1 . 1 1 33 33 HIS CA C 33 53.400 53.400 56.342 -2.942 19718
179 1 . 1 1 33 33 HIS CB C 33 25.500 25.500 30.697 -5.197 19718
180 1 . 1 1 33 33 HIS H H 33 6.980 6.980 7.995 -1.015 19718
181 1 . 1 1 34 34 ASN N N 34 113.700 113.700 115.901 -2.201 19718
182 1 . 1 1 34 34 ASN HA H 34 4.330 4.330 4.359 -0.029 19718
183 1 . 1 1 34 34 ASN C C 34 172.000 172.000 175.034 -3.034 19718
184 1 . 1 1 34 34 ASN CA C 34 52.100 52.100 53.844 -1.744 19718
185 1 . 1 1 34 34 ASN CB C 34 34.000 34.000 36.485 -2.485 19718
186 1 . 1 1 34 34 ASN H H 34 7.700 7.700 7.872 -0.172 19718
187 1 . 1 1 35 35 LEU N N 35 115.600 115.600 118.781 -3.181 19718
188 1 . 1 1 35 35 LEU HA H 35 4.250 4.250 4.187 0.063 19718
189 1 . 1 1 35 35 LEU C C 35 174.900 174.900 177.179 -2.279 19718
190 1 . 1 1 35 35 LEU CA C 35 51.300 51.300 55.515 -4.215 19718
191 1 . 1 1 35 35 LEU CB C 35 39.200 39.200 42.401 -3.201 19718
192 1 . 1 1 35 35 LEU H H 35 7.980 7.980 7.732 0.248 19718
193 1 . 1 1 36 36 ASP N N 36 120.100 120.100 124.634 -4.534 19718
194 1 . 1 1 36 36 ASP HA H 36 4.430 4.430 4.637 -0.207 19718
195 1 . 1 1 36 36 ASP C C 36 171.100 171.100 174.862 -3.762 19718
196 1 . 1 1 36 36 ASP CA C 36 51.000 51.000 54.536 -3.536 19718
197 1 . 1 1 36 36 ASP CB C 36 36.200 36.200 39.780 -3.580 19718
198 1 . 1 1 36 36 ASP H H 36 8.610 8.610 8.650 -0.040 19718
199 1 . 1 1 37 37 MET N N 37 123.900 123.900 119.263 4.637 19718
200 1 . 1 1 37 37 MET HA H 37 4.280 4.280 4.817 -0.537 19718
201 1 . 1 1 37 37 MET C C 37 171.200 171.200 174.496 -3.296 19718
202 1 . 1 1 37 37 MET CA C 37 52.800 52.800 54.677 -1.877 19718
203 1 . 1 1 37 37 MET CB C 37 33.000 33.000 35.917 -2.917 19718
204 1 . 1 1 37 37 MET H H 37 7.670 7.670 7.720 -0.050 19718
205 1 . 1 1 38 38 GLU N N 38 128.600 128.600 121.547 7.053 19718
206 1 . 1 1 38 38 GLU HA H 38 4.290 4.290 4.505 -0.215 19718
207 1 . 1 1 38 38 GLU CA C 38 53.200 53.200 56.238 -3.038 19718
208 1 . 1 1 38 38 GLU CB C 38 29.400 29.400 31.090 -1.690 19718
209 1 . 1 1 38 38 GLU H H 38 9.060 9.060 8.702 0.358 19718
210 1 . 1 1 51 51 HIS C C 51 170.700 170.700 174.181 -3.481 19718
211 1 . 1 1 51 51 HIS CA C 51 52.800 52.800 55.000 -2.200 19718
212 1 . 1 1 51 51 HIS CB C 51 27.700 27.700 29.779 -2.079 19718
213 1 . 1 1 53 53 ILE N N 53 122.200 122.200 120.610 1.590 19718
214 1 . 1 1 53 53 ILE HA H 53 4.010 4.010 4.820 -0.810 19718
215 1 . 1 1 53 53 ILE C C 53 174.400 174.400 173.475 0.925 19718
216 1 . 1 1 53 53 ILE CA C 53 58.700 58.700 58.703 -0.003 19718
217 1 . 1 1 53 53 ILE CB C 53 36.300 36.300 42.022 -5.722 19718
218 1 . 1 1 53 53 ILE H H 53 8.800 8.800 8.245 0.555 19718
219 1 . 1 1 54 54 VAL N N 54 130.200 130.200 125.860 4.340 19718
220 1 . 1 1 54 54 VAL HA H 54 3.870 3.870 4.747 -0.877 19718
221 1 . 1 1 54 54 VAL C C 54 172.500 172.500 174.884 -2.384 19718
222 1 . 1 1 54 54 VAL CA C 54 60.900 60.900 59.553 1.347 19718
223 1 . 1 1 54 54 VAL CB C 54 29.600 29.600 35.075 -5.475 19718
224 1 . 1 1 54 54 VAL H H 54 8.380 8.380 8.736 -0.356 19718
225 1 . 1 1 55 55 ASP N N 55 129.100 129.100 127.365 1.735 19718
226 1 . 1 1 55 55 ASP HA H 55 4.590 4.590 4.670 -0.080 19718
227 1 . 1 1 55 55 ASP CA C 55 50.700 50.700 53.588 -2.888 19718
228 1 . 1 1 55 55 ASP CB C 55 40.500 40.500 41.762 -1.262 19718
229 1 . 1 1 55 55 ASP H H 55 8.160 8.160 8.134 0.026 19718
230 1 . 1 1 56 56 PRO HA H 56 4.170 4.170 4.304 -0.134 19718
231 1 . 1 1 56 56 PRO C C 56 174.900 174.900 177.212 -2.312 19718
232 1 . 1 1 56 56 PRO CA C 56 63.000 63.000 64.723 -1.723 19718
233 1 . 1 1 56 56 PRO CB C 56 29.400 29.400 31.737 -2.337 19718
234 1 . 1 1 57 57 ASP N N 57 117.100 117.100 117.628 -0.528 19718
235 1 . 1 1 57 57 ASP HA H 57 4.370 4.370 4.406 -0.036 19718
236 1 . 1 1 57 57 ASP C C 57 174.100 174.100 177.485 -3.385 19718
237 1 . 1 1 57 57 ASP CA C 57 53.700 53.700 56.708 -3.008 19718
238 1 . 1 1 57 57 ASP CB C 57 36.800 36.800 40.954 -4.154 19718
239 1 . 1 1 57 57 ASP H H 57 9.110 9.110 8.689 0.421 19718
240 1 . 1 1 58 58 TYR N N 58 115.800 115.800 117.516 -1.716 19718
241 1 . 1 1 58 58 TYR HA H 58 4.360 4.360 4.474 -0.114 19718
242 1 . 1 1 58 58 TYR C C 58 173.200 173.200 177.721 -4.521 19718
243 1 . 1 1 58 58 TYR CA C 58 56.700 56.700 59.416 -2.716 19718
244 1 . 1 1 58 58 TYR CB C 58 38.900 38.900 39.069 -0.169 19718
245 1 . 1 1 58 58 TYR H H 58 8.190 8.190 7.851 0.339 19718
246 1 . 1 1 59 59 TYR N N 59 120.100 120.100 121.413 -1.313 19718
247 1 . 1 1 59 59 TYR HA H 59 3.780 3.780 4.160 -0.380 19718
248 1 . 1 1 59 59 TYR CA C 59 60.100 60.100 60.163 -0.063 19718
249 1 . 1 1 59 59 TYR CB C 59 36.400 36.400 38.309 -1.909 19718
250 1 . 1 1 59 59 TYR H H 59 7.420 7.420 8.211 -0.791 19718
251 1 . 1 1 60 60 ASP N N 60 115.200 115.200 118.550 -3.350 19718
252 1 . 1 1 60 60 ASP HA H 60 4.360 4.360 4.481 -0.121 19718
253 1 . 1 1 60 60 ASP C C 60 173.100 173.100 176.283 -3.183 19718
254 1 . 1 1 60 60 ASP CA C 60 53.400 53.400 55.835 -2.435 19718
255 1 . 1 1 60 60 ASP CB C 60 37.500 37.500 40.440 -2.940 19718
256 1 . 1 1 60 60 ASP H H 60 8.440 8.440 8.292 0.148 19718
257 1 . 1 1 61 61 ALA N N 61 120.200 120.200 120.606 -0.406 19718
258 1 . 1 1 61 61 ALA HA H 61 4.180 4.180 4.421 -0.241 19718
259 1 . 1 1 61 61 ALA C C 61 175.000 175.000 177.133 -2.133 19718
260 1 . 1 1 61 61 ALA CA C 61 49.300 49.300 52.037 -2.737 19718
261 1 . 1 1 61 61 ALA CB C 61 16.200 16.200 19.963 -3.763 19718
262 1 . 1 1 61 61 ALA H H 61 7.300 7.300 7.555 -0.255 19718
263 1 . 1 1 62 62 LEU N N 62 118.000 118.000 121.806 -3.806 19718
264 1 . 1 1 62 62 LEU HA H 62 4.290 4.290 4.658 -0.368 19718
265 1 . 1 1 62 62 LEU CA C 62 50.100 50.100 52.543 -2.443 19718
266 1 . 1 1 62 62 LEU CB C 62 38.700 38.700 42.219 -3.519 19718
267 1 . 1 1 62 62 LEU H H 62 6.680 6.680 7.554 -0.874 19718
268 1 . 1 1 63 63 PRO HA H 63 4.320 4.320 4.520 -0.200 19718
269 1 . 1 1 63 63 PRO C C 63 173.500 173.500 175.969 -2.469 19718
270 1 . 1 1 63 63 PRO CA C 63 59.700 59.700 62.119 -2.419 19718
271 1 . 1 1 63 63 PRO CB C 63 28.500 28.500 32.407 -3.907 19718
272 1 . 1 1 64 64 GLU N N 64 124.500 124.500 119.864 4.636 19718
273 1 . 1 1 64 64 GLU HA H 64 4.180 4.180 4.525 -0.345 19718
274 1 . 1 1 64 64 GLU CA C 64 52.500 52.500 54.446 -1.946 19718
275 1 . 1 1 64 64 GLU CB C 64 25.800 25.800 30.174 -4.374 19718
276 1 . 1 1 64 64 GLU H H 64 8.590 8.590 8.393 0.197 19718
277 1 . 1 1 65 65 PRO HA H 65 4.170 4.170 4.541 -0.371 19718
278 1 . 1 1 65 65 PRO C C 65 174.900 174.900 176.414 -1.514 19718
279 1 . 1 1 65 65 PRO CA C 65 63.000 63.000 62.394 0.606 19718
280 1 . 1 1 65 65 PRO CB C 65 28.500 28.500 32.936 -4.436 19718
281 1 . 1 1 66 66 GLU N N 66 123.300 123.300 119.383 3.917 19718
282 1 . 1 1 66 66 GLU HA H 66 4.330 4.330 4.102 0.228 19718
283 1 . 1 1 66 66 GLU C C 66 174.200 174.200 177.373 -3.173 19718
284 1 . 1 1 66 66 GLU CA C 66 52.500 52.500 56.953 -4.453 19718
285 1 . 1 1 66 66 GLU CB C 66 27.400 27.400 30.423 -3.023 19718
286 1 . 1 1 66 66 GLU H H 66 9.080 9.080 8.632 0.448 19718
287 1 . 1 1 67 67 ASP N N 67 120.100 120.100 121.188 -1.088 19718
288 1 . 1 1 67 67 ASP HA H 67 4.240 4.240 4.511 -0.271 19718
289 1 . 1 1 67 67 ASP C C 67 174.900 174.900 177.084 -2.184 19718
290 1 . 1 1 67 67 ASP CA C 67 55.400 55.400 56.678 -1.278 19718
291 1 . 1 1 67 67 ASP CB C 67 37.800 37.800 40.899 -3.099 19718
292 1 . 1 1 67 67 ASP H H 67 8.690 8.690 8.713 -0.023 19718
293 1 . 1 1 68 68 ASP N N 68 116.800 116.800 116.550 0.250 19718
294 1 . 1 1 68 68 ASP HA H 68 4.240 4.240 4.543 -0.303 19718
295 1 . 1 1 68 68 ASP C C 68 175.500 175.500 177.391 -1.891 19718
296 1 . 1 1 68 68 ASP CA C 68 54.300 54.300 55.777 -1.477 19718
297 1 . 1 1 68 68 ASP CB C 68 36.100 36.100 40.955 -4.855 19718
298 1 . 1 1 68 68 ASP H H 68 8.400 8.400 8.419 -0.019 19718
299 1 . 1 1 69 69 GLU N N 69 123.600 123.600 119.129 4.471 19718
300 1 . 1 1 69 69 GLU HA H 69 4.150 4.150 4.176 -0.026 19718
301 1 . 1 1 69 69 GLU C C 69 175.200 175.200 178.584 -3.384 19718
302 1 . 1 1 69 69 GLU CA C 69 56.200 56.200 58.569 -2.369 19718
303 1 . 1 1 69 69 GLU CB C 69 26.000 26.000 30.238 -4.238 19718
304 1 . 1 1 69 69 GLU H H 69 7.530 7.530 7.809 -0.279 19718
305 1 . 1 1 70 70 ASN N N 70 119.100 119.100 118.375 0.725 19718
306 1 . 1 1 70 70 ASN HA H 70 4.360 4.360 4.472 -0.112 19718
307 1 . 1 1 70 70 ASN C C 70 175.200 175.200 176.686 -1.486 19718
308 1 . 1 1 70 70 ASN CA C 70 53.700 53.700 55.722 -2.022 19718
309 1 . 1 1 70 70 ASN CB C 70 34.800 34.800 37.786 -2.986 19718
310 1 . 1 1 70 70 ASN H H 70 7.960 7.960 8.665 -0.705 19718
311 1 . 1 1 71 71 ASP N N 71 118.400 118.400 119.980 -1.580 19718
312 1 . 1 1 71 71 ASP HA H 71 4.250 4.250 4.468 -0.218 19718
313 1 . 1 1 71 71 ASP C C 71 176.000 176.000 177.684 -1.684 19718
314 1 . 1 1 71 71 ASP CA C 71 54.600 54.600 56.682 -2.082 19718
315 1 . 1 1 71 71 ASP CB C 71 37.500 37.500 40.830 -3.330 19718
316 1 . 1 1 71 71 ASP H H 71 8.250 8.250 8.161 0.089 19718
317 1 . 1 1 72 72 MET N N 72 117.300 117.300 116.455 0.845 19718
318 1 . 1 1 72 72 MET HA H 72 4.370 4.370 4.202 0.168 19718
319 1 . 1 1 72 72 MET C C 72 177.800 177.800 177.484 0.316 19718
320 1 . 1 1 72 72 MET CA C 72 53.700 53.700 57.989 -4.289 19718
321 1 . 1 1 72 72 MET CB C 72 32.400 32.400 32.615 -0.215 19718
322 1 . 1 1 72 72 MET H H 72 7.240 7.240 7.593 -0.353 19718
323 1 . 1 1 73 73 LEU N N 73 123.000 123.000 118.955 4.045 19718
324 1 . 1 1 73 73 LEU HA H 73 3.760 3.760 4.336 -0.576 19718
325 1 . 1 1 73 73 LEU C C 73 175.700 175.700 179.179 -3.479 19718
326 1 . 1 1 73 73 LEU CA C 73 54.900 54.900 56.877 -1.977 19718
327 1 . 1 1 73 73 LEU CB C 73 38.100 38.100 41.920 -3.820 19718
328 1 . 1 1 73 73 LEU H H 73 8.600 8.600 7.270 1.330 19718
329 1 . 1 1 74 74 ASP N N 74 118.500 118.500 119.070 -0.570 19718
330 1 . 1 1 74 74 ASP HA H 74 4.340 4.340 4.378 -0.038 19718
331 1 . 1 1 74 74 ASP C C 74 174.700 174.700 177.791 -3.091 19718
332 1 . 1 1 74 74 ASP CA C 74 54.300 54.300 56.938 -2.638 19718
333 1 . 1 1 74 74 ASP CB C 74 38.200 38.200 40.700 -2.500 19718
334 1 . 1 1 74 74 ASP H H 74 7.250 7.250 7.777 -0.527 19718
335 1 . 1 1 75 75 LEU N N 75 116.300 116.300 117.762 -1.462 19718
336 1 . 1 1 75 75 LEU HA H 75 4.300 4.300 4.176 0.124 19718
337 1 . 1 1 75 75 LEU C C 75 174.500 174.500 176.936 -2.436 19718
338 1 . 1 1 75 75 LEU CA C 75 51.300 51.300 55.620 -4.320 19718
339 1 . 1 1 75 75 LEU CB C 75 39.600 39.600 41.651 -2.051 19718
340 1 . 1 1 75 75 LEU H H 75 7.000 7.000 7.419 -0.419 19718
341 1 . 1 1 76 76 ALA N N 76 124.600 124.600 120.415 4.185 19718
342 1 . 1 1 76 76 ALA HA H 76 4.100 4.100 4.360 -0.260 19718
343 1 . 1 1 76 76 ALA C C 76 174.200 174.200 176.148 -1.948 19718
344 1 . 1 1 76 76 ALA CA C 76 49.500 49.500 50.943 -1.443 19718
345 1 . 1 1 76 76 ALA CB C 76 15.200 15.200 20.356 -5.156 19718
346 1 . 1 1 76 76 ALA H H 76 7.590 7.590 7.525 0.065 19718
347 1 . 1 1 77 77 TYR N N 77 122.900 122.900 122.939 -0.039 19718
348 1 . 1 1 77 77 TYR HA H 77 4.430 4.430 4.280 0.150 19718
349 1 . 1 1 77 77 TYR C C 77 174.100 174.100 177.047 -2.947 19718
350 1 . 1 1 77 77 TYR CA C 77 54.900 54.900 59.314 -4.414 19718
351 1 . 1 1 77 77 TYR CB C 77 35.900 35.900 39.275 -3.375 19718
352 1 . 1 1 77 77 TYR H H 77 8.150 8.150 8.278 -0.128 19718
353 1 . 1 1 78 78 GLY N N 78 112.900 112.900 113.827 -0.927 19718
354 1 . 1 1 78 78 GLY C C 78 171.800 171.800 173.763 -1.963 19718
355 1 . 1 1 78 78 GLY CA C 78 43.700 43.700 44.707 -1.007 19718
356 1 . 1 1 78 78 GLY H H 78 8.320 8.320 8.008 0.312 19718
357 1 . 1 1 79 79 LEU N N 79 119.300 119.300 119.220 0.080 19718
358 1 . 1 1 79 79 LEU HA H 79 3.790 3.790 4.288 -0.498 19718
359 1 . 1 1 79 79 LEU C C 79 174.000 174.000 176.597 -2.597 19718
360 1 . 1 1 79 79 LEU CA C 79 54.000 54.000 55.298 -1.298 19718
361 1 . 1 1 79 79 LEU CB C 79 39.900 39.900 42.756 -2.856 19718
362 1 . 1 1 79 79 LEU H H 79 7.120 7.120 7.882 -0.762 19718
363 1 . 1 1 80 80 THR N N 80 118.500 118.500 119.026 -0.526 19718
364 1 . 1 1 80 80 THR HA H 80 4.860 4.860 4.477 0.383 19718
365 1 . 1 1 80 80 THR C C 80 173.300 173.300 175.200 -1.900 19718
366 1 . 1 1 80 80 THR CA C 80 57.600 57.600 60.718 -3.118 19718
367 1 . 1 1 80 80 THR CB C 80 71.000 71.000 70.188 0.812 19718
368 1 . 1 1 80 80 THR H H 80 9.240 9.240 7.951 1.289 19718
369 1 . 1 1 81 81 GLU N N 81 118.000 118.000 120.497 -2.497 19718
370 1 . 1 1 81 81 GLU HA H 81 4.110 4.110 4.097 0.013 19718
371 1 . 1 1 81 81 GLU C C 81 173.900 173.900 176.345 -2.445 19718
372 1 . 1 1 81 81 GLU CA C 81 55.400 55.400 58.544 -3.144 19718
373 1 . 1 1 81 81 GLU CB C 81 26.700 26.700 29.403 -2.703 19718
374 1 . 1 1 81 81 GLU H H 81 9.020 9.020 8.791 0.229 19718
375 1 . 1 1 82 82 THR N N 82 106.400 106.400 106.518 -0.118 19718
376 1 . 1 1 82 82 THR HA H 82 3.950 3.950 2.967 0.983 19718
377 1 . 1 1 82 82 THR C C 82 171.700 171.700 173.586 -1.886 19718
378 1 . 1 1 82 82 THR CA C 82 56.800 56.800 59.435 -2.635 19718
379 1 . 1 1 82 82 THR CB C 82 63.800 63.800 68.205 -4.405 19718
380 1 . 1 1 82 82 THR H H 82 7.630 7.630 7.469 0.161 19718
381 1 . 1 1 83 83 SER N N 83 121.500 121.500 118.917 2.583 19718
382 1 . 1 1 83 83 SER HA H 83 5.080 5.080 4.390 0.690 19718
383 1 . 1 1 83 83 SER C C 83 170.900 170.900 174.049 -3.149 19718
384 1 . 1 1 83 83 SER CA C 83 59.000 59.000 59.754 -0.754 19718
385 1 . 1 1 83 83 SER CB C 83 61.700 61.700 63.791 -2.091 19718
386 1 . 1 1 83 83 SER H H 83 6.930 6.930 7.708 -0.778 19718
387 1 . 1 1 84 84 ARG N N 84 119.300 119.300 124.018 -4.718 19718
388 1 . 1 1 84 84 ARG HA H 84 4.870 4.870 4.793 0.077 19718
389 1 . 1 1 84 84 ARG C C 84 172.400 172.400 174.417 -2.017 19718
390 1 . 1 1 84 84 ARG CA C 84 49.300 49.300 53.998 -4.698 19718
391 1 . 1 1 84 84 ARG CB C 84 32.400 32.400 34.546 -2.146 19718
392 1 . 1 1 84 84 ARG H H 84 9.280 9.280 8.870 0.410 19718
393 1 . 1 1 88 88 GLN HA H 88 4.430 4.430 4.428 0.002 19718
394 1 . 1 1 88 88 GLN C C 88 172.500 172.500 174.952 -2.452 19718
395 1 . 1 1 88 88 GLN CA C 88 51.000 51.000 55.904 -4.904 19718
396 1 . 1 1 88 88 GLN CB C 88 27.000 27.000 29.768 -2.768 19718
397 1 . 1 1 90 90 LYS N N 90 123.700 123.700 125.376 -1.676 19718
398 1 . 1 1 90 90 LYS HA H 90 4.450 4.450 5.006 -0.556 19718
399 1 . 1 1 90 90 LYS C C 90 173.500 173.500 175.459 -1.959 19718
400 1 . 1 1 90 90 LYS CA C 90 51.500 51.500 53.716 -2.216 19718
401 1 . 1 1 90 90 LYS CB C 90 31.900 31.900 34.719 -2.819 19718
402 1 . 1 1 90 90 LYS H H 90 8.330 8.330 8.085 0.245 19718
403 1 . 1 1 91 91 MET N N 91 118.200 118.200 119.936 -1.736 19718
404 1 . 1 1 91 91 MET HA H 91 4.330 4.330 4.618 -0.288 19718
405 1 . 1 1 91 91 MET C C 91 174.300 174.300 175.981 -1.681 19718
406 1 . 1 1 91 91 MET CA C 91 51.800 51.800 55.141 -3.341 19718
407 1 . 1 1 91 91 MET CB C 91 27.200 27.200 31.752 -4.552 19718
408 1 . 1 1 91 91 MET H H 91 8.620 8.620 8.521 0.099 19718
409 1 . 1 1 92 92 SER N N 92 117.000 117.000 117.633 -0.633 19718
410 1 . 1 1 92 92 SER HA H 92 4.610 4.610 4.825 -0.215 19718
411 1 . 1 1 92 92 SER C C 92 171.300 171.300 175.078 -3.778 19718
412 1 . 1 1 92 92 SER CA C 92 54.000 54.000 56.664 -2.664 19718
413 1 . 1 1 92 92 SER CB C 92 63.700 63.700 66.236 -2.536 19718
414 1 . 1 1 92 92 SER H H 92 6.970 6.970 8.229 -1.259 19718
415 1 . 1 1 93 93 LYS N N 93 121.700 121.700 120.355 1.345 19718
416 1 . 1 1 93 93 LYS HA H 93 3.970 3.970 4.129 -0.159 19718
417 1 . 1 1 93 93 LYS C C 93 175.200 175.200 177.829 -2.629 19718
418 1 . 1 1 93 93 LYS CA C 93 56.700 56.700 58.819 -2.119 19718
419 1 . 1 1 93 93 LYS CB C 93 29.100 29.100 32.032 -2.932 19718
420 1 . 1 1 93 93 LYS H H 93 9.260 9.260 8.845 0.415 19718
421 1 . 1 1 94 94 ASP N N 94 116.700 116.700 119.313 -2.613 19718
422 1 . 1 1 94 94 ASP HA H 94 4.360 4.360 4.562 -0.202 19718
423 1 . 1 1 94 94 ASP C C 94 174.300 174.300 177.361 -3.061 19718
424 1 . 1 1 94 94 ASP CA C 94 53.700 53.700 56.125 -2.425 19718
425 1 . 1 1 94 94 ASP CB C 94 37.900 37.900 41.180 -3.280 19718
426 1 . 1 1 94 94 ASP H H 94 8.020 8.020 7.887 0.133 19718
427 1 . 1 1 95 95 ILE N N 95 109.000 109.000 112.442 -3.442 19718
428 1 . 1 1 95 95 ILE HA H 95 4.660 4.660 4.514 0.146 19718
429 1 . 1 1 95 95 ILE C C 95 170.600 170.600 174.955 -4.355 19718
430 1 . 1 1 95 95 ILE CA C 95 57.300 57.300 60.337 -3.037 19718
431 1 . 1 1 95 95 ILE CB C 95 35.200 35.200 38.679 -3.479 19718
432 1 . 1 1 95 95 ILE H H 95 7.240 7.240 7.480 -0.240 19718
433 1 . 1 1 96 96 ASP N N 96 119.800 119.800 122.605 -2.805 19718
434 1 . 1 1 96 96 ASP HA H 96 4.180 4.180 4.439 -0.259 19718
435 1 . 1 1 96 96 ASP C C 96 174.900 174.900 176.671 -1.771 19718
436 1 . 1 1 96 96 ASP CA C 96 53.700 53.700 54.966 -1.266 19718
437 1 . 1 1 96 96 ASP CB C 96 39.000 39.000 39.485 -0.485 19718
438 1 . 1 1 96 96 ASP H H 96 6.950 6.950 7.933 -0.983 19718
439 1 . 1 1 97 97 GLY N N 97 118.500 118.500 112.971 5.529 19718
440 1 . 1 1 97 97 GLY C C 97 170.500 170.500 174.009 -3.509 19718
441 1 . 1 1 97 97 GLY CA C 97 42.300 42.300 44.350 -2.050 19718
442 1 . 1 1 97 97 GLY H H 97 9.210 9.210 8.308 0.902 19718
443 1 . 1 1 98 98 ILE N N 98 121.300 121.300 121.534 -0.234 19718
444 1 . 1 1 98 98 ILE HA H 98 4.600 4.600 2.346 2.254 19718
445 1 . 1 1 98 98 ILE CA C 98 58.600 58.600 61.837 -3.237 19718
446 1 . 1 1 98 98 ILE CB C 98 34.700 34.700 38.488 -3.788 19718
447 1 . 1 1 98 98 ILE H H 98 7.660 7.660 7.968 -0.308 19718
448 1 . 1 1 99 99 ARG HA H 99 5.350 5.350 5.241 0.109 19718
449 1 . 1 1 99 99 ARG C C 99 172.200 172.200 175.132 -2.932 19718
450 1 . 1 1 99 99 ARG CA C 99 50.100 50.100 54.293 -4.193 19718
451 1 . 1 1 99 99 ARG CB C 99 30.500 30.500 33.447 -2.947 19718
452 1 . 1 1 100 100 VAL N N 100 114.900 114.900 116.409 -1.509 19718
453 1 . 1 1 100 100 VAL HA H 100 4.820 4.820 5.118 -0.298 19718
454 1 . 1 1 100 100 VAL C C 100 169.600 169.600 173.363 -3.763 19718
455 1 . 1 1 100 100 VAL CA C 100 55.200 55.200 59.327 -4.127 19718
456 1 . 1 1 100 100 VAL CB C 100 32.300 32.300 36.183 -3.883 19718
457 1 . 1 1 100 100 VAL H H 100 8.440 8.440 8.849 -0.409 19718
458 1 . 1 1 101 101 ALA N N 101 123.400 123.400 122.732 0.668 19718
459 1 . 1 1 101 101 ALA HA H 101 5.310 5.310 4.910 0.400 19718
460 1 . 1 1 101 101 ALA C C 101 174.400 174.400 175.532 -1.132 19718
461 1 . 1 1 101 101 ALA CA C 101 46.800 46.800 50.119 -3.319 19718
462 1 . 1 1 101 101 ALA CB C 101 18.800 18.800 21.775 -2.975 19718
463 1 . 1 1 101 101 ALA H H 101 9.040 9.040 8.852 0.188 19718
464 1 . 1 1 102 102 LEU N N 102 120.600 120.600 122.242 -1.642 19718
465 1 . 1 1 102 102 LEU HA H 102 4.570 4.570 5.044 -0.474 19718
466 1 . 1 1 102 102 LEU CA C 102 52.200 52.200 52.119 0.081 19718
467 1 . 1 1 102 102 LEU CB C 102 37.900 37.900 44.100 -6.200 19718
468 1 . 1 1 102 102 LEU H H 102 8.260 8.260 8.204 0.057 19718
469 1 . 1 1 112 112 ASN HA H 112 4.580 4.580 4.675 -0.095 19718
470 1 . 1 1 112 112 ASN C C 112 171.900 171.900 174.133 -2.233 19718
471 1 . 1 1 112 112 ASN CA C 112 50.400 50.400 53.392 -2.992 19718
472 1 . 1 1 112 112 ASN CB C 112 36.700 36.700 39.675 -2.975 19718
473 1 . 1 1 113 113 ASP N N 113 120.300 120.300 120.515 -0.215 19718
474 1 . 1 1 113 113 ASP HA H 113 4.440 4.440 4.651 -0.211 19718
475 1 . 1 1 113 113 ASP C C 113 173.000 173.000 175.329 -2.329 19718
476 1 . 1 1 113 113 ASP CA C 113 51.600 51.600 54.337 -2.737 19718
477 1 . 1 1 113 113 ASP CB C 113 38.100 38.100 41.335 -3.235 19718
478 1 . 1 1 113 113 ASP H H 113 8.040 8.040 8.480 -0.440 19718
479 1 . 1 1 114 114 PHE N N 114 120.100 120.100 120.420 -0.320 19718
480 1 . 1 1 114 114 PHE HA H 114 4.610 4.610 4.644 -0.034 19718
481 1 . 1 1 114 114 PHE C C 114 172.200 172.200 175.208 -3.008 19718
482 1 . 1 1 114 114 PHE CA C 114 54.900 54.900 58.276 -3.376 19718
483 1 . 1 1 114 114 PHE CB C 114 36.500 36.500 39.946 -3.446 19718
484 1 . 1 1 114 114 PHE H H 114 8.110 8.110 8.390 -0.280 19718
stop_
save_