data_25487
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25487
_Entry.PDB_ID 2MZG
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 25487
_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 LYS N N 2 121.111 121.111 120.098 1.013 25487
2 1 1 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.770 -0.445 25487
3 1 1 . 1 1 2 2 LYS CA C 2 53.663 53.663 57.200 -3.537 25487
4 1 1 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.295 -2.880 25487
5 1 1 . 1 1 2 2 LYS H H 2 8.492 8.492 8.550 -0.058 25487
6 1 1 . 1 1 3 3 ALA N N 3 126.440 126.440 123.822 2.618 25487
7 1 1 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.352 0.073 25487
8 1 1 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.212 -2.765 25487
9 1 1 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.803 -2.898 25487
10 1 1 . 1 1 3 3 ALA H H 3 8.357 8.357 7.934 0.423 25487
11 1 1 . 1 1 4 4 CYS N N 4 116.834 116.834 116.444 0.390 25487
12 1 1 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.647 0.256 25487
13 1 1 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.064 -4.271 25487
14 1 1 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.897 11.397 25487
15 1 1 . 1 1 4 4 CYS H H 4 8.145 8.145 8.333 -0.188 25487
16 1 1 . 1 1 5 5 THR N N 5 121.220 121.220 117.645 3.575 25487
17 1 1 . 1 1 5 5 THR HA H 5 4.481 4.481 4.732 -0.251 25487
18 1 1 . 1 1 5 5 THR CA C 5 58.256 58.256 60.115 -1.859 25487
19 1 1 . 1 1 5 5 THR CB C 5 67.043 67.043 68.017 -0.974 25487
20 1 1 . 1 1 5 5 THR H H 5 9.070 9.070 8.643 0.427 25487
21 1 1 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.358 -0.106 25487
22 1 1 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.167 -2.928 25487
23 1 1 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.413 -1.884 25487
24 1 1 . 1 1 7 7 LEU N N 7 119.270 119.270 120.061 -0.791 25487
25 1 1 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.871 -0.615 25487
26 1 1 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.425 -1.365 25487
27 1 1 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.340 -3.134 25487
28 1 1 . 1 1 7 7 LEU H H 7 7.797 7.797 7.919 -0.122 25487
29 1 1 . 1 1 8 8 LEU N N 8 119.586 119.586 121.641 -2.055 25487
30 1 1 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.886 -0.064 25487
31 1 1 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.682 -0.759 25487
32 1 1 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.476 -2.874 25487
33 1 1 . 1 1 8 8 LEU H H 8 9.465 9.465 8.711 0.754 25487
34 1 1 . 1 1 9 9 HIS N N 9 117.507 117.507 116.256 1.251 25487
35 1 1 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.718 0.028 25487
36 1 1 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.454 -2.027 25487
37 1 1 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.899 -6.791 25487
38 1 1 . 1 1 9 9 HIS H H 9 8.159 8.159 7.940 0.219 25487
39 1 1 . 1 1 10 10 ASP N N 10 119.492 119.492 121.932 -2.440 25487
40 1 1 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.741 0.142 25487
41 1 1 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.324 -2.986 25487
42 1 1 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.439 -0.969 25487
43 1 1 . 1 1 10 10 ASP H H 10 8.341 8.341 8.645 -0.304 25487
44 1 1 . 1 1 11 11 CYS N N 11 121.767 121.767 120.742 1.025 25487
45 1 1 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.779 0.350 25487
46 1 1 . 1 1 11 11 CYS CA C 11 52.756 52.756 57.005 -4.250 25487
47 1 1 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.162 14.074 25487
48 1 1 . 1 1 11 11 CYS H H 11 8.017 8.017 8.623 -0.606 25487
49 1 1 . 1 1 12 12 SER N N 12 118.618 118.618 119.130 -0.512 25487
50 1 1 . 1 1 12 12 SER HA H 12 3.759 3.759 4.070 -0.311 25487
51 1 1 . 1 1 12 12 SER CB C 12 59.972 59.972 62.769 -2.797 25487
52 1 1 . 1 1 12 12 SER H H 12 8.844 8.844 8.487 0.357 25487
53 1 1 . 1 1 13 13 HIS N N 13 117.166 117.166 115.510 1.656 25487
54 1 1 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.621 0.001 25487
55 1 1 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.155 -4.702 25487
56 1 1 . 1 1 13 13 HIS H H 13 8.547 8.547 7.940 0.607 25487
57 1 1 . 1 1 14 14 ASP N N 14 117.382 117.382 119.079 -1.697 25487
58 1 1 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.885 -0.194 25487
59 1 1 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.143 -2.951 25487
60 1 1 . 1 1 14 14 ASP CB C 14 36.424 36.424 43.299 -6.875 25487
61 1 1 . 1 1 14 14 ASP H H 14 7.224 7.224 7.985 -0.761 25487
62 1 1 . 1 1 15 15 ARG N N 15 124.498 124.498 122.978 1.520 25487
63 1 1 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.367 0.350 25487
64 1 1 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.711 -4.178 25487
65 1 1 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.700 -0.308 25487
66 1 1 . 1 1 15 15 ARG H H 15 9.004 9.004 8.612 0.392 25487
67 1 1 . 1 1 16 16 HIS N N 16 116.269 116.269 114.918 1.351 25487
68 1 1 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.737 0.331 25487
69 1 1 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.903 -3.428 25487
70 1 1 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.706 -4.030 25487
71 1 1 . 1 1 16 16 HIS H H 16 8.528 8.528 8.411 0.117 25487
72 1 1 . 1 1 17 17 SER N N 17 112.719 112.719 115.135 -2.416 25487
73 1 1 . 1 1 17 17 SER HA H 17 4.493 4.493 4.543 -0.050 25487
74 1 1 . 1 1 17 17 SER CA C 17 56.591 56.591 59.799 -3.208 25487
75 1 1 . 1 1 17 17 SER CB C 17 62.736 62.736 64.580 -1.844 25487
76 1 1 . 1 1 17 17 SER H H 17 7.503 7.503 8.121 -0.618 25487
77 1 1 . 1 1 18 18 CYS N N 18 122.070 122.070 120.126 1.944 25487
78 1 1 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.462 0.612 25487
79 1 1 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.892 -5.318 25487
80 1 1 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.417 9.408 25487
81 1 1 . 1 1 18 18 CYS H H 18 8.651 8.651 7.902 0.749 25487
82 1 1 . 1 1 19 19 CYS N N 19 118.243 118.243 122.294 -4.051 25487
83 1 1 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.451 0.069 25487
84 1 1 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.392 -6.844 25487
85 1 1 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.896 11.494 25487
86 1 1 . 1 1 19 19 CYS H H 19 8.936 8.936 8.292 0.644 25487
87 1 1 . 1 1 20 20 ARG N N 20 116.858 116.858 122.488 -5.630 25487
88 1 1 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.055 0.044 25487
89 1 1 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.693 -3.688 25487
90 1 1 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.102 -1.472 25487
91 1 1 . 1 1 20 20 ARG H H 20 8.136 8.136 8.429 -0.293 25487
92 1 1 . 1 1 21 21 GLY N N 21 110.611 110.611 108.490 2.121 25487
93 1 1 . 1 1 21 21 GLY CA C 21 41.796 41.796 44.559 -2.763 25487
94 1 1 . 1 1 21 21 GLY H H 21 7.569 7.569 7.625 -0.056 25487
95 1 1 . 1 1 22 22 ASP N N 22 121.161 121.161 119.279 1.882 25487
96 1 1 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.640 -0.305 25487
97 1 1 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.401 -2.739 25487
98 1 1 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.301 -4.917 25487
99 1 1 . 1 1 22 22 ASP H H 22 8.674 8.674 8.725 -0.051 25487
100 1 1 . 1 1 23 23 MET N N 23 114.811 114.811 116.145 -1.334 25487
101 1 1 . 1 1 23 23 MET HA H 23 4.218 4.218 4.281 -0.063 25487
102 1 1 . 1 1 23 23 MET CA C 23 53.190 53.190 56.578 -3.388 25487
103 1 1 . 1 1 23 23 MET CB C 23 30.586 30.586 34.636 -4.050 25487
104 1 1 . 1 1 23 23 MET H H 23 8.333 8.333 7.635 0.698 25487
105 1 1 . 1 1 24 24 PHE N N 24 116.019 116.019 114.896 1.123 25487
106 1 1 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.827 0.000 25487
107 1 1 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.450 2.091 25487
108 1 1 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.633 -2.837 25487
109 1 1 . 1 1 24 24 PHE H H 24 7.821 7.821 7.557 0.264 25487
110 1 1 . 1 1 25 25 LYS N N 25 123.768 123.768 119.989 3.779 25487
111 1 1 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.076 -0.030 25487
112 1 1 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.062 -1.424 25487
113 1 1 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.183 -2.106 25487
114 1 1 . 1 1 25 25 LYS H H 25 9.119 9.119 8.249 0.870 25487
115 1 1 . 1 1 26 26 TYR N N 26 123.059 123.059 123.309 -0.250 25487
116 1 1 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.189 0.810 25487
117 1 1 . 1 1 26 26 TYR CA C 26 53.820 53.820 59.363 -5.543 25487
118 1 1 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.024 -4.283 25487
119 1 1 . 1 1 26 26 TYR H H 26 7.884 7.884 7.678 0.206 25487
120 1 1 . 1 1 27 27 VAL N N 27 116.468 116.468 114.811 1.657 25487
121 1 1 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.482 -0.111 25487
122 1 1 . 1 1 27 27 VAL CA C 27 57.515 57.515 60.242 -2.727 25487
123 1 1 . 1 1 27 27 VAL CB C 27 31.945 31.945 33.845 -1.900 25487
124 1 1 . 1 1 27 27 VAL H H 27 9.012 9.012 9.124 -0.112 25487
125 1 1 . 1 1 28 28 CYS N N 28 124.932 124.932 126.028 -1.096 25487
126 1 1 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.726 0.028 25487
127 1 1 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.575 -6.375 25487
128 1 1 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.483 11.304 25487
129 1 1 . 1 1 28 28 CYS H H 28 8.874 8.874 8.920 -0.046 25487
130 1 1 . 1 1 29 29 ASP N N 29 131.592 131.592 129.014 2.578 25487
131 1 1 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.714 0.231 25487
132 1 1 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.874 -3.818 25487
133 1 1 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.587 -5.117 25487
134 1 1 . 1 1 29 29 ASP H H 29 8.603 8.603 8.619 -0.016 25487
135 1 1 . 1 1 30 30 CYS N N 30 122.694 122.694 118.472 4.222 25487
136 1 1 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.753 1.050 25487
137 1 1 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.770 -5.381 25487
138 1 1 . 1 1 30 30 CYS CB C 30 43.933 43.933 30.550 13.383 25487
139 1 1 . 1 1 30 30 CYS H H 30 8.480 8.480 8.168 0.312 25487
140 1 1 . 1 1 31 31 PHE N N 31 121.135 121.135 119.808 1.327 25487
141 1 1 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.531 0.256 25487
142 1 1 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.070 -4.742 25487
143 1 1 . 1 1 31 31 PHE H H 31 9.062 9.062 8.473 0.589 25487
144 1 1 . 1 1 32 32 TYR N N 32 120.021 120.021 119.529 0.492 25487
145 1 1 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.969 0.021 25487
146 1 1 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.673 -1.934 25487
147 1 1 . 1 1 32 32 TYR CB C 32 35.482 35.482 38.108 -2.626 25487
148 1 1 . 1 1 32 32 TYR H H 32 8.614 8.614 8.707 -0.093 25487
149 1 1 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.328 0.172 25487
150 1 1 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.158 -2.669 25487
151 1 1 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.311 -0.658 25487
152 1 1 . 1 1 34 34 GLU N N 34 119.222 119.222 119.317 -0.095 25487
153 1 1 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.953 0.392 25487
154 1 1 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.185 -3.488 25487
155 1 1 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.791 -2.732 25487
156 1 1 . 1 1 34 34 GLU H H 34 8.516 8.516 8.595 -0.079 25487
157 1 1 . 1 1 35 35 GLY N N 35 109.836 109.836 104.563 5.273 25487
158 1 1 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.202 -2.783 25487
159 1 1 . 1 1 35 35 GLY H H 35 8.209 8.209 7.498 0.711 25487
160 1 1 . 1 1 36 36 GLU N N 36 119.666 119.666 121.213 -1.547 25487
161 1 1 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.237 -0.012 25487
162 1 1 . 1 1 36 36 GLU CA C 36 53.566 53.566 57.827 -4.261 25487
163 1 1 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.788 -3.618 25487
164 1 1 . 1 1 36 36 GLU H H 36 8.190 8.190 8.482 -0.292 25487
165 1 1 . 1 1 37 37 ASP N N 37 117.788 117.788 117.626 0.162 25487
166 1 1 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.612 -0.082 25487
167 1 1 . 1 1 37 37 ASP CA C 37 50.834 50.834 53.834 -3.000 25487
168 1 1 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.479 -4.356 25487
169 1 1 . 1 1 37 37 ASP H H 37 8.305 8.305 8.241 0.064 25487
170 1 1 . 1 1 38 38 LYS N N 38 119.545 119.545 119.151 0.394 25487
171 1 1 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.524 -0.058 25487
172 1 1 . 1 1 38 38 LYS CA C 38 53.348 53.348 57.112 -3.764 25487
173 1 1 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.547 -3.933 25487
174 1 1 . 1 1 38 38 LYS H H 38 7.950 7.950 7.875 0.075 25487
175 1 1 . 1 1 39 39 THR N N 39 115.195 115.195 114.536 0.659 25487
176 1 1 . 1 1 39 39 THR HA H 39 4.323 4.323 4.563 -0.240 25487
177 1 1 . 1 1 39 39 THR CA C 39 59.508 59.508 62.131 -2.623 25487
178 1 1 . 1 1 39 39 THR CB C 39 67.653 67.653 70.373 -2.720 25487
179 1 1 . 1 1 39 39 THR H H 39 7.888 7.888 7.799 0.089 25487
180 1 1 . 1 1 40 40 GLU N N 40 124.664 124.664 125.490 -0.826 25487
181 1 1 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.607 -0.641 25487
182 1 1 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.436 -2.407 25487
183 1 1 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.522 -4.055 25487
184 1 1 . 1 1 40 40 GLU H H 40 8.345 8.345 8.399 -0.054 25487
185 1 1 . 1 1 41 41 VAL N N 41 124.551 124.551 125.084 -0.533 25487
186 1 1 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.211 -0.110 25487
187 1 1 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.976 -3.581 25487
188 1 1 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.283 -1.389 25487
189 1 1 . 1 1 41 41 VAL H H 41 8.377 8.377 8.403 -0.026 25487
190 1 1 . 1 1 42 42 CYS N N 42 122.732 122.732 127.004 -4.272 25487
191 1 1 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.207 0.548 25487
192 1 1 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.304 -5.460 25487
193 1 1 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.913 15.567 25487
194 1 1 . 1 1 42 42 CYS H H 42 8.712 8.712 8.936 -0.224 25487
195 1 1 . 1 1 43 43 SER N N 43 117.527 117.527 114.570 2.957 25487
196 1 1 . 1 1 43 43 SER HA H 43 5.220 5.220 5.347 -0.127 25487
197 1 1 . 1 1 43 43 SER CA C 43 54.110 54.110 56.604 -2.494 25487
198 1 1 . 1 1 43 43 SER CB C 43 64.091 64.091 65.700 -1.609 25487
199 1 1 . 1 1 43 43 SER H H 43 8.828 8.828 8.837 -0.009 25487
200 1 1 . 1 1 44 44 CYS N N 44 120.721 120.721 122.121 -1.400 25487
201 1 1 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.394 0.819 25487
202 1 1 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.013 -6.985 25487
203 1 1 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.309 10.516 25487
204 1 1 . 1 1 44 44 CYS H H 44 7.936 7.936 8.813 -0.877 25487
205 1 1 . 1 1 45 45 GLN N N 45 124.614 124.614 124.498 0.116 25487
206 1 1 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.678 -0.034 25487
207 1 1 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.886 -7.453 25487
208 1 1 . 1 1 45 45 GLN H H 45 9.892 9.892 9.200 0.692 25487
209 1 1 . 1 1 46 46 GLN N N 46 120.933 120.933 119.026 1.907 25487
210 1 1 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.739 0.287 25487
211 1 1 . 1 1 46 46 GLN CB C 46 25.665 25.665 28.840 -3.175 25487
212 1 1 . 1 1 46 46 GLN H H 46 8.849 8.849 8.772 0.077 25487
213 1 1 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.581 -0.061 25487
214 1 1 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.318 -1.911 25487
215 1 1 . 1 1 47 47 PRO CB C 47 29.749 29.749 33.087 -3.338 25487
216 1 1 . 1 1 48 48 LYS N N 48 124.003 124.003 120.588 3.415 25487
217 1 1 . 1 1 48 48 LYS HA H 48 4.053 4.053 4.000 0.053 25487
218 1 1 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.916 -3.332 25487
219 1 1 . 1 1 48 48 LYS CB C 48 30.564 30.564 31.903 -1.339 25487
220 1 1 . 1 1 48 48 LYS H H 48 8.931 8.931 8.777 0.154 25487
221 1 1 . 1 1 49 49 SER N N 49 113.527 113.527 115.065 -1.538 25487
222 1 1 . 1 1 49 49 SER HA H 49 3.995 3.995 4.290 -0.295 25487
223 1 1 . 1 1 49 49 SER CA C 49 55.458 55.458 61.952 -6.494 25487
224 1 1 . 1 1 49 49 SER CB C 49 61.270 61.270 62.650 -1.380 25487
225 1 1 . 1 1 49 49 SER H H 49 8.702 8.702 8.451 0.251 25487
226 1 1 . 1 1 50 50 HIS N N 50 119.669 119.669 121.115 -1.446 25487
227 1 1 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.319 0.008 25487
228 1 1 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.880 -3.425 25487
229 1 1 . 1 1 50 50 HIS H H 50 7.664 7.664 8.478 -0.814 25487
230 1 1 . 1 1 51 51 LYS N N 51 120.030 120.030 120.014 0.016 25487
231 1 1 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.023 0.070 25487
232 1 1 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.950 -3.198 25487
233 1 1 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.458 -2.077 25487
234 1 1 . 1 1 51 51 LYS H H 51 7.825 7.825 8.185 -0.360 25487
235 1 1 . 1 1 52 52 ILE N N 52 118.914 118.914 119.466 -0.552 25487
236 1 1 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.590 0.131 25487
237 1 1 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.124 -3.299 25487
238 1 1 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.719 -2.713 25487
239 1 1 . 1 1 52 52 ILE H H 52 8.223 8.223 7.990 0.233 25487
240 1 1 . 1 1 53 53 ALA N N 53 120.985 120.985 122.087 -1.102 25487
241 1 1 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.873 0.083 25487
242 1 1 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.586 -2.443 25487
243 1 1 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.802 -1.056 25487
244 1 1 . 1 1 53 53 ALA H H 53 8.066 8.066 8.260 -0.194 25487
245 1 1 . 1 1 54 54 GLU N N 54 115.137 115.137 118.227 -3.090 25487
246 1 1 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.926 0.007 25487
247 1 1 . 1 1 54 54 GLU CB C 54 26.848 26.848 28.841 -1.993 25487
248 1 1 . 1 1 54 54 GLU H H 54 8.160 8.160 8.103 0.057 25487
249 1 1 . 1 1 55 55 LYS N N 55 118.610 118.610 119.142 -0.532 25487
250 1 1 . 1 1 55 55 LYS HA H 55 4.156 4.156 3.976 0.180 25487
251 1 1 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.417 -2.990 25487
252 1 1 . 1 1 55 55 LYS H H 55 7.732 7.732 7.989 -0.257 25487
253 1 1 . 1 1 56 56 ILE N N 56 119.173 119.173 119.881 -0.708 25487
254 1 1 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.744 -0.117 25487
255 1 1 . 1 1 56 56 ILE CA C 56 62.898 62.898 63.968 -1.070 25487
256 1 1 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.751 -1.608 25487
257 1 1 . 1 1 56 56 ILE H H 56 8.022 8.022 8.078 -0.056 25487
258 1 1 . 1 1 57 57 ILE N N 57 120.239 120.239 121.252 -1.013 25487
259 1 1 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.447 0.141 25487
260 1 1 . 1 1 57 57 ILE CA C 57 62.898 62.898 66.274 -3.376 25487
261 1 1 . 1 1 57 57 ILE CB C 57 35.037 35.037 37.408 -2.371 25487
262 1 1 . 1 1 57 57 ILE H H 57 8.370 8.370 8.442 -0.072 25487
263 1 1 . 1 1 58 58 ASP N N 58 118.234 118.234 119.521 -1.287 25487
264 1 1 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.282 0.130 25487
265 1 1 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.483 -3.309 25487
266 1 1 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.155 -3.960 25487
267 1 1 . 1 1 58 58 ASP H H 58 8.458 8.458 8.494 -0.036 25487
268 1 1 . 1 1 59 59 LYS N N 59 119.380 119.380 120.493 -1.113 25487
269 1 1 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.858 0.392 25487
270 1 1 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.579 -4.648 25487
271 1 1 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.612 -2.551 25487
272 1 1 . 1 1 59 59 LYS H H 59 7.928 7.928 8.245 -0.317 25487
273 1 1 . 1 1 60 60 ALA N N 60 123.604 123.604 121.252 2.352 25487
274 1 1 . 1 1 60 60 ALA HA H 60 3.985 3.985 3.996 -0.011 25487
275 1 1 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.243 -2.430 25487
276 1 1 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.181 -2.384 25487
277 1 1 . 1 1 60 60 ALA H H 60 8.699 8.699 8.397 0.302 25487
278 1 1 . 1 1 61 61 LYS N N 61 115.317 115.317 118.556 -3.239 25487
279 1 1 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.038 -0.020 25487
280 1 1 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.758 -1.973 25487
281 1 1 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.340 -1.833 25487
282 1 1 . 1 1 61 61 LYS H H 61 8.361 8.361 8.332 0.029 25487
283 1 1 . 1 1 62 62 THR N N 62 107.298 107.298 113.481 -6.183 25487
284 1 1 . 1 1 62 62 THR HA H 62 4.368 4.368 4.241 0.127 25487
285 1 1 . 1 1 62 62 THR CA C 62 60.427 60.427 65.027 -4.600 25487
286 1 1 . 1 1 62 62 THR CB C 62 67.179 67.179 69.068 -1.889 25487
287 1 1 . 1 1 62 62 THR H H 62 7.510 7.510 8.080 -0.570 25487
288 1 1 . 1 1 63 63 THR N N 63 115.701 115.701 115.603 0.098 25487
289 1 1 . 1 1 63 63 THR HA H 63 4.328 4.328 4.252 0.076 25487
290 1 1 . 1 1 63 63 THR CA C 63 61.695 61.695 64.541 -2.846 25487
291 1 1 . 1 1 63 63 THR CB C 63 67.641 67.641 69.530 -1.889 25487
292 1 1 . 1 1 63 63 THR H H 63 7.651 7.651 7.746 -0.095 25487
293 1 2 . 1 1 2 2 LYS N N 2 121.111 121.111 122.138 -1.027 25487
294 1 2 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.650 -0.325 25487
295 1 2 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.411 -2.748 25487
296 1 2 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.301 -1.886 25487
297 1 2 . 1 1 2 2 LYS H H 2 8.492 8.492 8.370 0.122 25487
298 1 2 . 1 1 3 3 ALA N N 3 126.440 126.440 125.646 0.794 25487
299 1 2 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.524 -0.099 25487
300 1 2 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.708 -2.261 25487
301 1 2 . 1 1 3 3 ALA CB C 3 16.905 16.905 20.116 -3.211 25487
302 1 2 . 1 1 3 3 ALA H H 3 8.357 8.357 8.379 -0.022 25487
303 1 2 . 1 1 4 4 CYS N N 4 116.834 116.834 119.127 -2.293 25487
304 1 2 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.658 0.245 25487
305 1 2 . 1 1 4 4 CYS CA C 4 51.793 51.793 58.625 -6.832 25487
306 1 2 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.182 12.112 25487
307 1 2 . 1 1 4 4 CYS H H 4 8.145 8.145 8.427 -0.282 25487
308 1 2 . 1 1 5 5 THR N N 5 121.220 121.220 120.047 1.173 25487
309 1 2 . 1 1 5 5 THR HA H 5 4.481 4.481 4.646 -0.165 25487
310 1 2 . 1 1 5 5 THR CA C 5 58.256 58.256 60.511 -2.255 25487
311 1 2 . 1 1 5 5 THR CB C 5 67.043 67.043 69.303 -2.260 25487
312 1 2 . 1 1 5 5 THR H H 5 9.070 9.070 8.676 0.394 25487
313 1 2 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.434 -0.182 25487
314 1 2 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.312 -3.073 25487
315 1 2 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.307 -1.778 25487
316 1 2 . 1 1 7 7 LEU N N 7 119.270 119.270 120.010 -0.740 25487
317 1 2 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.918 -0.662 25487
318 1 2 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.836 -1.776 25487
319 1 2 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.329 -3.123 25487
320 1 2 . 1 1 7 7 LEU H H 7 7.797 7.797 7.724 0.073 25487
321 1 2 . 1 1 8 8 LEU N N 8 119.586 119.586 123.731 -4.145 25487
322 1 2 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.029 -0.207 25487
323 1 2 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.658 -0.736 25487
324 1 2 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.801 -3.200 25487
325 1 2 . 1 1 8 8 LEU H H 8 9.465 9.465 8.375 1.090 25487
326 1 2 . 1 1 9 9 HIS N N 9 117.507 117.507 115.937 1.570 25487
327 1 2 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.771 -0.025 25487
328 1 2 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.545 -2.118 25487
329 1 2 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.847 -6.739 25487
330 1 2 . 1 1 9 9 HIS H H 9 8.159 8.159 7.611 0.548 25487
331 1 2 . 1 1 10 10 ASP N N 10 119.492 119.492 120.645 -1.153 25487
332 1 2 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.692 0.191 25487
333 1 2 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.307 -2.969 25487
334 1 2 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.982 -1.512 25487
335 1 2 . 1 1 10 10 ASP H H 10 8.341 8.341 8.634 -0.293 25487
336 1 2 . 1 1 11 11 CYS N N 11 121.767 121.767 120.915 0.852 25487
337 1 2 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.768 0.361 25487
338 1 2 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.873 -4.117 25487
339 1 2 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.033 14.203 25487
340 1 2 . 1 1 11 11 CYS H H 11 8.017 8.017 8.626 -0.609 25487
341 1 2 . 1 1 12 12 SER N N 12 118.618 118.618 118.856 -0.238 25487
342 1 2 . 1 1 12 12 SER HA H 12 3.759 3.759 4.143 -0.384 25487
343 1 2 . 1 1 12 12 SER CB C 12 59.972 59.972 62.943 -2.971 25487
344 1 2 . 1 1 12 12 SER H H 12 8.844 8.844 8.464 0.380 25487
345 1 2 . 1 1 13 13 HIS N N 13 117.166 117.166 116.050 1.116 25487
346 1 2 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.560 0.062 25487
347 1 2 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.416 -4.963 25487
348 1 2 . 1 1 13 13 HIS H H 13 8.547 8.547 8.174 0.373 25487
349 1 2 . 1 1 14 14 ASP N N 14 117.382 117.382 118.245 -0.863 25487
350 1 2 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.879 -0.188 25487
351 1 2 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.544 -3.352 25487
352 1 2 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.774 -6.350 25487
353 1 2 . 1 1 14 14 ASP H H 14 7.224 7.224 7.887 -0.663 25487
354 1 2 . 1 1 15 15 ARG N N 15 124.498 124.498 123.242 1.256 25487
355 1 2 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.258 0.459 25487
356 1 2 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.741 -4.208 25487
357 1 2 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.582 -0.190 25487
358 1 2 . 1 1 15 15 ARG H H 15 9.004 9.004 8.686 0.318 25487
359 1 2 . 1 1 16 16 HIS N N 16 116.269 116.269 114.689 1.580 25487
360 1 2 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.772 0.296 25487
361 1 2 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.590 -3.115 25487
362 1 2 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.814 -4.138 25487
363 1 2 . 1 1 16 16 HIS H H 16 8.528 8.528 8.329 0.199 25487
364 1 2 . 1 1 17 17 SER N N 17 112.719 112.719 115.286 -2.567 25487
365 1 2 . 1 1 17 17 SER HA H 17 4.493 4.493 4.446 0.047 25487
366 1 2 . 1 1 17 17 SER CA C 17 56.591 56.591 59.619 -3.028 25487
367 1 2 . 1 1 17 17 SER CB C 17 62.736 62.736 64.465 -1.729 25487
368 1 2 . 1 1 17 17 SER H H 17 7.503 7.503 7.768 -0.265 25487
369 1 2 . 1 1 18 18 CYS N N 18 122.070 122.070 120.342 1.728 25487
370 1 2 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.569 0.505 25487
371 1 2 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.074 -4.500 25487
372 1 2 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.778 10.047 25487
373 1 2 . 1 1 18 18 CYS H H 18 8.651 8.651 8.019 0.632 25487
374 1 2 . 1 1 19 19 CYS N N 19 118.243 118.243 124.203 -5.960 25487
375 1 2 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.460 0.060 25487
376 1 2 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.737 -6.189 25487
377 1 2 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.600 10.790 25487
378 1 2 . 1 1 19 19 CYS H H 19 8.936 8.936 8.476 0.460 25487
379 1 2 . 1 1 20 20 ARG N N 20 116.858 116.858 121.405 -4.547 25487
380 1 2 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.225 -0.126 25487
381 1 2 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.246 -3.241 25487
382 1 2 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.405 -1.776 25487
383 1 2 . 1 1 20 20 ARG H H 20 8.136 8.136 8.527 -0.391 25487
384 1 2 . 1 1 21 21 GLY N N 21 110.611 110.611 110.056 0.555 25487
385 1 2 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.615 -1.819 25487
386 1 2 . 1 1 21 21 GLY H H 21 7.569 7.569 7.656 -0.087 25487
387 1 2 . 1 1 22 22 ASP N N 22 121.161 121.161 119.693 1.468 25487
388 1 2 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.569 -0.234 25487
389 1 2 . 1 1 22 22 ASP CA C 22 53.663 53.663 55.985 -2.322 25487
390 1 2 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.163 -4.779 25487
391 1 2 . 1 1 22 22 ASP H H 22 8.674 8.674 8.752 -0.078 25487
392 1 2 . 1 1 23 23 MET N N 23 114.811 114.811 117.121 -2.310 25487
393 1 2 . 1 1 23 23 MET HA H 23 4.218 4.218 4.300 -0.082 25487
394 1 2 . 1 1 23 23 MET CA C 23 53.190 53.190 56.710 -3.520 25487
395 1 2 . 1 1 23 23 MET CB C 23 30.586 30.586 34.230 -3.643 25487
396 1 2 . 1 1 23 23 MET H H 23 8.333 8.333 7.845 0.488 25487
397 1 2 . 1 1 24 24 PHE N N 24 116.019 116.019 113.536 2.483 25487
398 1 2 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.849 -0.022 25487
399 1 2 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.614 1.927 25487
400 1 2 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.786 -2.990 25487
401 1 2 . 1 1 24 24 PHE H H 24 7.821 7.821 7.890 -0.069 25487
402 1 2 . 1 1 25 25 LYS N N 25 123.768 123.768 120.498 3.270 25487
403 1 2 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.038 0.008 25487
404 1 2 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.024 -1.386 25487
405 1 2 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.501 -2.424 25487
406 1 2 . 1 1 25 25 LYS H H 25 9.119 9.119 8.279 0.840 25487
407 1 2 . 1 1 26 26 TYR N N 26 123.059 123.059 122.911 0.148 25487
408 1 2 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.328 0.671 25487
409 1 2 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.352 -4.532 25487
410 1 2 . 1 1 26 26 TYR CB C 26 34.741 34.741 38.788 -4.047 25487
411 1 2 . 1 1 26 26 TYR H H 26 7.884 7.884 7.439 0.445 25487
412 1 2 . 1 1 27 27 VAL N N 27 116.468 116.468 117.090 -0.622 25487
413 1 2 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.463 -0.092 25487
414 1 2 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.845 -2.330 25487
415 1 2 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.393 -3.448 25487
416 1 2 . 1 1 27 27 VAL H H 27 9.012 9.012 9.038 -0.026 25487
417 1 2 . 1 1 28 28 CYS N N 28 124.932 124.932 127.316 -2.384 25487
418 1 2 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.650 0.104 25487
419 1 2 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.136 -5.936 25487
420 1 2 . 1 1 28 28 CYS CB C 28 37.787 37.787 25.669 12.118 25487
421 1 2 . 1 1 28 28 CYS H H 28 8.874 8.874 8.938 -0.064 25487
422 1 2 . 1 1 29 29 ASP N N 29 131.592 131.592 129.174 2.418 25487
423 1 2 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.845 0.100 25487
424 1 2 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.525 -3.469 25487
425 1 2 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.906 -5.437 25487
426 1 2 . 1 1 29 29 ASP H H 29 8.603 8.603 8.729 -0.126 25487
427 1 2 . 1 1 30 30 CYS N N 30 122.694 122.694 118.973 3.721 25487
428 1 2 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.862 0.941 25487
429 1 2 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.076 -5.687 25487
430 1 2 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.889 14.044 25487
431 1 2 . 1 1 30 30 CYS H H 30 8.480 8.480 8.380 0.100 25487
432 1 2 . 1 1 31 31 PHE N N 31 121.135 121.135 120.977 0.158 25487
433 1 2 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.650 0.137 25487
434 1 2 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.356 -5.028 25487
435 1 2 . 1 1 31 31 PHE H H 31 9.062 9.062 8.728 0.334 25487
436 1 2 . 1 1 32 32 TYR N N 32 120.021 120.021 116.647 3.374 25487
437 1 2 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.343 -0.353 25487
438 1 2 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.647 -1.908 25487
439 1 2 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.752 -4.270 25487
440 1 2 . 1 1 32 32 TYR H H 32 8.614 8.614 8.570 0.044 25487
441 1 2 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.381 0.119 25487
442 1 2 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.403 -2.914 25487
443 1 2 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.237 -0.584 25487
444 1 2 . 1 1 34 34 GLU N N 34 119.222 119.222 118.021 1.201 25487
445 1 2 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.988 0.357 25487
446 1 2 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.548 -3.851 25487
447 1 2 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.875 -2.816 25487
448 1 2 . 1 1 34 34 GLU H H 34 8.516 8.516 8.609 -0.093 25487
449 1 2 . 1 1 35 35 GLY N N 35 109.836 109.836 104.908 4.928 25487
450 1 2 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.956 -2.537 25487
451 1 2 . 1 1 35 35 GLY H H 35 8.209 8.209 7.633 0.576 25487
452 1 2 . 1 1 36 36 GLU N N 36 119.666 119.666 121.243 -1.577 25487
453 1 2 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.644 0.581 25487
454 1 2 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.891 -3.325 25487
455 1 2 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.217 -3.047 25487
456 1 2 . 1 1 36 36 GLU H H 36 8.190 8.190 8.589 -0.399 25487
457 1 2 . 1 1 37 37 ASP N N 37 117.788 117.788 118.731 -0.943 25487
458 1 2 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.591 -0.061 25487
459 1 2 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.217 -3.382 25487
460 1 2 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.682 -4.559 25487
461 1 2 . 1 1 37 37 ASP H H 37 8.305 8.305 8.252 0.053 25487
462 1 2 . 1 1 38 38 LYS N N 38 119.545 119.545 119.010 0.535 25487
463 1 2 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.552 -0.086 25487
464 1 2 . 1 1 38 38 LYS CA C 38 53.348 53.348 57.166 -3.818 25487
465 1 2 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.554 -3.940 25487
466 1 2 . 1 1 38 38 LYS H H 38 7.950 7.950 7.611 0.339 25487
467 1 2 . 1 1 39 39 THR N N 39 115.195 115.195 114.466 0.729 25487
468 1 2 . 1 1 39 39 THR HA H 39 4.323 4.323 4.740 -0.417 25487
469 1 2 . 1 1 39 39 THR CA C 39 59.508 59.508 61.742 -2.234 25487
470 1 2 . 1 1 39 39 THR CB C 39 67.653 67.653 71.556 -3.903 25487
471 1 2 . 1 1 39 39 THR H H 39 7.888 7.888 7.948 -0.060 25487
472 1 2 . 1 1 40 40 GLU N N 40 124.664 124.664 125.055 -0.391 25487
473 1 2 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.863 -0.897 25487
474 1 2 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.423 -2.394 25487
475 1 2 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.274 -3.807 25487
476 1 2 . 1 1 40 40 GLU H H 40 8.345 8.345 8.611 -0.266 25487
477 1 2 . 1 1 41 41 VAL N N 41 124.551 124.551 125.792 -1.241 25487
478 1 2 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.448 -0.347 25487
479 1 2 . 1 1 41 41 VAL CA C 41 58.395 58.395 60.981 -2.586 25487
480 1 2 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.213 -2.318 25487
481 1 2 . 1 1 41 41 VAL H H 41 8.377 8.377 8.635 -0.258 25487
482 1 2 . 1 1 42 42 CYS N N 42 122.732 122.732 126.569 -3.837 25487
483 1 2 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.387 0.368 25487
484 1 2 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.541 -5.697 25487
485 1 2 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.576 15.903 25487
486 1 2 . 1 1 42 42 CYS H H 42 8.712 8.712 8.991 -0.279 25487
487 1 2 . 1 1 43 43 SER N N 43 117.527 117.527 115.331 2.196 25487
488 1 2 . 1 1 43 43 SER HA H 43 5.220 5.220 5.199 0.021 25487
489 1 2 . 1 1 43 43 SER CA C 43 54.110 54.110 56.570 -2.460 25487
490 1 2 . 1 1 43 43 SER CB C 43 64.091 64.091 65.970 -1.879 25487
491 1 2 . 1 1 43 43 SER H H 43 8.828 8.828 8.941 -0.113 25487
492 1 2 . 1 1 44 44 CYS N N 44 120.721 120.721 122.739 -2.018 25487
493 1 2 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.449 0.764 25487
494 1 2 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.160 -7.132 25487
495 1 2 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.027 10.798 25487
496 1 2 . 1 1 44 44 CYS H H 44 7.936 7.936 8.829 -0.893 25487
497 1 2 . 1 1 45 45 GLN N N 45 124.614 124.614 125.244 -0.630 25487
498 1 2 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.658 -0.014 25487
499 1 2 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.795 -7.362 25487
500 1 2 . 1 1 45 45 GLN H H 45 9.892 9.892 9.235 0.657 25487
501 1 2 . 1 1 46 46 GLN N N 46 120.933 120.933 120.484 0.449 25487
502 1 2 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.641 0.385 25487
503 1 2 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.786 -4.121 25487
504 1 2 . 1 1 46 46 GLN H H 46 8.849 8.849 8.540 0.308 25487
505 1 2 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.528 -0.008 25487
506 1 2 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.270 -1.863 25487
507 1 2 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.932 -3.183 25487
508 1 2 . 1 1 48 48 LYS N N 48 124.003 124.003 120.422 3.581 25487
509 1 2 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.934 0.119 25487
510 1 2 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.290 -3.706 25487
511 1 2 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.174 -1.610 25487
512 1 2 . 1 1 48 48 LYS H H 48 8.931 8.931 8.696 0.235 25487
513 1 2 . 1 1 49 49 SER N N 49 113.527 113.527 113.470 0.057 25487
514 1 2 . 1 1 49 49 SER HA H 49 3.995 3.995 4.107 -0.112 25487
515 1 2 . 1 1 49 49 SER CA C 49 55.458 55.458 61.382 -5.924 25487
516 1 2 . 1 1 49 49 SER CB C 49 61.270 61.270 62.306 -1.036 25487
517 1 2 . 1 1 49 49 SER H H 49 8.702 8.702 8.084 0.618 25487
518 1 2 . 1 1 50 50 HIS N N 50 119.669 119.669 122.264 -2.595 25487
519 1 2 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.331 -0.004 25487
520 1 2 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.758 -3.303 25487
521 1 2 . 1 1 50 50 HIS H H 50 7.664 7.664 8.324 -0.660 25487
522 1 2 . 1 1 51 51 LYS N N 51 120.030 120.030 120.096 -0.066 25487
523 1 2 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.056 0.037 25487
524 1 2 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.897 -3.145 25487
525 1 2 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.584 -2.203 25487
526 1 2 . 1 1 51 51 LYS H H 51 7.825 7.825 8.146 -0.321 25487
527 1 2 . 1 1 52 52 ILE N N 52 118.914 118.914 119.824 -0.910 25487
528 1 2 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.586 0.136 25487
529 1 2 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.111 -3.286 25487
530 1 2 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.709 -2.703 25487
531 1 2 . 1 1 52 52 ILE H H 52 8.223 8.223 7.969 0.254 25487
532 1 2 . 1 1 53 53 ALA N N 53 120.985 120.985 121.749 -0.764 25487
533 1 2 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.867 0.089 25487
534 1 2 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.553 -2.410 25487
535 1 2 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.725 -0.979 25487
536 1 2 . 1 1 53 53 ALA H H 53 8.066 8.066 8.416 -0.350 25487
537 1 2 . 1 1 54 54 GLU N N 54 115.137 115.137 117.973 -2.836 25487
538 1 2 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.953 -0.020 25487
539 1 2 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.344 -2.496 25487
540 1 2 . 1 1 54 54 GLU H H 54 8.160 8.160 8.126 0.034 25487
541 1 2 . 1 1 55 55 LYS N N 55 118.610 118.610 119.874 -1.264 25487
542 1 2 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.079 0.077 25487
543 1 2 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.237 -2.810 25487
544 1 2 . 1 1 55 55 LYS H H 55 7.732 7.732 7.980 -0.248 25487
545 1 2 . 1 1 56 56 ILE N N 56 119.173 119.173 120.744 -1.571 25487
546 1 2 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.723 -0.096 25487
547 1 2 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.520 -1.622 25487
548 1 2 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.916 -1.772 25487
549 1 2 . 1 1 56 56 ILE H H 56 8.022 8.022 8.163 -0.141 25487
550 1 2 . 1 1 57 57 ILE N N 57 120.239 120.239 119.956 0.283 25487
551 1 2 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.593 -0.005 25487
552 1 2 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.149 -1.251 25487
553 1 2 . 1 1 57 57 ILE CB C 57 35.037 35.037 35.939 -0.902 25487
554 1 2 . 1 1 57 57 ILE H H 57 8.370 8.370 8.304 0.066 25487
555 1 2 . 1 1 58 58 ASP N N 58 118.234 118.234 121.085 -2.851 25487
556 1 2 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.329 0.083 25487
557 1 2 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.542 -3.368 25487
558 1 2 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.237 -4.042 25487
559 1 2 . 1 1 58 58 ASP H H 58 8.458 8.458 8.345 0.113 25487
560 1 2 . 1 1 59 59 LYS N N 59 119.380 119.380 119.901 -0.521 25487
561 1 2 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.923 0.327 25487
562 1 2 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.051 -4.120 25487
563 1 2 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.520 -2.459 25487
564 1 2 . 1 1 59 59 LYS H H 59 7.928 7.928 8.044 -0.116 25487
565 1 2 . 1 1 60 60 ALA N N 60 123.604 123.604 121.961 1.643 25487
566 1 2 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.076 -0.091 25487
567 1 2 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.383 -2.570 25487
568 1 2 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.366 -2.569 25487
569 1 2 . 1 1 60 60 ALA H H 60 8.699 8.699 8.240 0.459 25487
570 1 2 . 1 1 61 61 LYS N N 61 115.317 115.317 116.957 -1.640 25487
571 1 2 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.375 -0.357 25487
572 1 2 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.501 -1.716 25487
573 1 2 . 1 1 61 61 LYS CB C 61 30.507 30.507 31.992 -1.485 25487
574 1 2 . 1 1 61 61 LYS H H 61 8.361 8.361 8.299 0.062 25487
575 1 2 . 1 1 62 62 THR N N 62 107.298 107.298 113.317 -6.019 25487
576 1 2 . 1 1 62 62 THR HA H 62 4.368 4.368 4.275 0.093 25487
577 1 2 . 1 1 62 62 THR CA C 62 60.427 60.427 64.506 -4.079 25487
578 1 2 . 1 1 62 62 THR CB C 62 67.179 67.179 68.982 -1.803 25487
579 1 2 . 1 1 62 62 THR H H 62 7.510 7.510 8.122 -0.612 25487
580 1 2 . 1 1 63 63 THR N N 63 115.701 115.701 115.007 0.694 25487
581 1 2 . 1 1 63 63 THR HA H 63 4.328 4.328 4.309 0.019 25487
582 1 2 . 1 1 63 63 THR CA C 63 61.695 61.695 64.880 -3.185 25487
583 1 2 . 1 1 63 63 THR CB C 63 67.641 67.641 70.419 -2.779 25487
584 1 2 . 1 1 63 63 THR H H 63 7.651 7.651 7.536 0.115 25487
585 1 3 . 1 1 2 2 LYS N N 2 121.111 121.111 120.463 0.648 25487
586 1 3 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.209 0.116 25487
587 1 3 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.515 -2.852 25487
588 1 3 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.559 -2.144 25487
589 1 3 . 1 1 2 2 LYS H H 2 8.492 8.492 8.424 0.068 25487
590 1 3 . 1 1 3 3 ALA N N 3 126.440 126.440 122.931 3.509 25487
591 1 3 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.439 -0.014 25487
592 1 3 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.542 -3.095 25487
593 1 3 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.718 -2.812 25487
594 1 3 . 1 1 3 3 ALA H H 3 8.357 8.357 8.228 0.129 25487
595 1 3 . 1 1 4 4 CYS N N 4 116.834 116.834 118.737 -1.903 25487
596 1 3 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.614 0.289 25487
597 1 3 . 1 1 4 4 CYS CA C 4 51.793 51.793 58.602 -6.809 25487
598 1 3 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.642 10.652 25487
599 1 3 . 1 1 4 4 CYS H H 4 8.145 8.145 8.381 -0.236 25487
600 1 3 . 1 1 5 5 THR N N 5 121.220 121.220 120.109 1.111 25487
601 1 3 . 1 1 5 5 THR HA H 5 4.481 4.481 4.556 -0.075 25487
602 1 3 . 1 1 5 5 THR CA C 5 58.256 58.256 60.755 -2.499 25487
603 1 3 . 1 1 5 5 THR CB C 5 67.043 67.043 69.124 -2.080 25487
604 1 3 . 1 1 5 5 THR H H 5 9.070 9.070 8.610 0.460 25487
605 1 3 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.340 -0.088 25487
606 1 3 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.362 -3.123 25487
607 1 3 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.228 -1.699 25487
608 1 3 . 1 1 7 7 LEU N N 7 119.270 119.270 119.608 -0.338 25487
609 1 3 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.902 -0.646 25487
610 1 3 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.930 -1.870 25487
611 1 3 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.242 -3.036 25487
612 1 3 . 1 1 7 7 LEU H H 7 7.797 7.797 7.489 0.308 25487
613 1 3 . 1 1 8 8 LEU N N 8 119.586 119.586 122.303 -2.717 25487
614 1 3 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.033 -0.211 25487
615 1 3 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.549 -0.626 25487
616 1 3 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.291 -2.689 25487
617 1 3 . 1 1 8 8 LEU H H 8 9.465 9.465 8.477 0.988 25487
618 1 3 . 1 1 9 9 HIS N N 9 117.507 117.507 115.784 1.723 25487
619 1 3 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.739 0.007 25487
620 1 3 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.536 -2.110 25487
621 1 3 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.778 -6.670 25487
622 1 3 . 1 1 9 9 HIS H H 9 8.159 8.159 7.640 0.519 25487
623 1 3 . 1 1 10 10 ASP N N 10 119.492 119.492 120.978 -1.486 25487
624 1 3 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.703 0.180 25487
625 1 3 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.473 -3.135 25487
626 1 3 . 1 1 10 10 ASP CB C 10 39.470 39.470 41.115 -1.645 25487
627 1 3 . 1 1 10 10 ASP H H 10 8.341 8.341 8.652 -0.311 25487
628 1 3 . 1 1 11 11 CYS N N 11 121.767 121.767 119.972 1.795 25487
629 1 3 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.883 0.246 25487
630 1 3 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.552 -3.796 25487
631 1 3 . 1 1 11 11 CYS CB C 11 42.236 42.236 29.025 13.211 25487
632 1 3 . 1 1 11 11 CYS H H 11 8.017 8.017 8.358 -0.341 25487
633 1 3 . 1 1 12 12 SER N N 12 118.618 118.618 117.838 0.780 25487
634 1 3 . 1 1 12 12 SER HA H 12 3.759 3.759 4.132 -0.373 25487
635 1 3 . 1 1 12 12 SER CB C 12 59.972 59.972 63.180 -3.208 25487
636 1 3 . 1 1 12 12 SER H H 12 8.844 8.844 8.374 0.470 25487
637 1 3 . 1 1 13 13 HIS N N 13 117.166 117.166 116.026 1.140 25487
638 1 3 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.667 -0.045 25487
639 1 3 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.062 -4.609 25487
640 1 3 . 1 1 13 13 HIS H H 13 8.547 8.547 7.997 0.550 25487
641 1 3 . 1 1 14 14 ASP N N 14 117.382 117.382 118.825 -1.443 25487
642 1 3 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.904 -0.213 25487
643 1 3 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.407 -3.215 25487
644 1 3 . 1 1 14 14 ASP CB C 14 36.424 36.424 43.134 -6.710 25487
645 1 3 . 1 1 14 14 ASP H H 14 7.224 7.224 7.810 -0.586 25487
646 1 3 . 1 1 15 15 ARG N N 15 124.498 124.498 122.557 1.941 25487
647 1 3 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.262 0.455 25487
648 1 3 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.527 -3.994 25487
649 1 3 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.718 -0.326 25487
650 1 3 . 1 1 15 15 ARG H H 15 9.004 9.004 8.580 0.424 25487
651 1 3 . 1 1 16 16 HIS N N 16 116.269 116.269 114.795 1.474 25487
652 1 3 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.801 0.267 25487
653 1 3 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.826 -3.351 25487
654 1 3 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.459 -3.783 25487
655 1 3 . 1 1 16 16 HIS H H 16 8.528 8.528 8.432 0.096 25487
656 1 3 . 1 1 17 17 SER N N 17 112.719 112.719 115.440 -2.721 25487
657 1 3 . 1 1 17 17 SER HA H 17 4.493 4.493 4.466 0.027 25487
658 1 3 . 1 1 17 17 SER CA C 17 56.591 56.591 59.498 -2.907 25487
659 1 3 . 1 1 17 17 SER CB C 17 62.736 62.736 64.875 -2.139 25487
660 1 3 . 1 1 17 17 SER H H 17 7.503 7.503 7.899 -0.396 25487
661 1 3 . 1 1 18 18 CYS N N 18 122.070 122.070 120.473 1.597 25487
662 1 3 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.554 0.520 25487
663 1 3 . 1 1 18 18 CYS CA C 18 54.574 54.574 58.999 -4.426 25487
664 1 3 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.468 10.357 25487
665 1 3 . 1 1 18 18 CYS H H 18 8.651 8.651 8.115 0.536 25487
666 1 3 . 1 1 19 19 CYS N N 19 118.243 118.243 124.455 -6.212 25487
667 1 3 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.527 -0.007 25487
668 1 3 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.817 -6.269 25487
669 1 3 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.852 10.538 25487
670 1 3 . 1 1 19 19 CYS H H 19 8.936 8.936 8.468 0.468 25487
671 1 3 . 1 1 20 20 ARG N N 20 116.858 116.858 121.458 -4.600 25487
672 1 3 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.246 -0.147 25487
673 1 3 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.534 -3.529 25487
674 1 3 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.257 -1.628 25487
675 1 3 . 1 1 20 20 ARG H H 20 8.136 8.136 8.585 -0.449 25487
676 1 3 . 1 1 21 21 GLY N N 21 110.611 110.611 109.837 0.774 25487
677 1 3 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.569 -1.773 25487
678 1 3 . 1 1 21 21 GLY H H 21 7.569 7.569 7.908 -0.339 25487
679 1 3 . 1 1 22 22 ASP N N 22 121.161 121.161 120.003 1.158 25487
680 1 3 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.637 -0.302 25487
681 1 3 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.330 -2.667 25487
682 1 3 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.139 -4.755 25487
683 1 3 . 1 1 22 22 ASP H H 22 8.674 8.674 8.737 -0.063 25487
684 1 3 . 1 1 23 23 MET N N 23 114.811 114.811 117.497 -2.686 25487
685 1 3 . 1 1 23 23 MET HA H 23 4.218 4.218 4.224 -0.006 25487
686 1 3 . 1 1 23 23 MET CA C 23 53.190 53.190 56.337 -3.147 25487
687 1 3 . 1 1 23 23 MET CB C 23 30.586 30.586 33.943 -3.357 25487
688 1 3 . 1 1 23 23 MET H H 23 8.333 8.333 7.955 0.378 25487
689 1 3 . 1 1 24 24 PHE N N 24 116.019 116.019 116.634 -0.615 25487
690 1 3 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.565 0.262 25487
691 1 3 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.423 2.118 25487
692 1 3 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.280 -2.484 25487
693 1 3 . 1 1 24 24 PHE H H 24 7.821 7.821 7.476 0.345 25487
694 1 3 . 1 1 25 25 LYS N N 25 123.768 123.768 120.575 3.193 25487
695 1 3 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.144 -0.098 25487
696 1 3 . 1 1 25 25 LYS CA C 25 54.638 54.638 55.906 -1.268 25487
697 1 3 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.836 -2.759 25487
698 1 3 . 1 1 25 25 LYS H H 25 9.119 9.119 8.340 0.779 25487
699 1 3 . 1 1 26 26 TYR N N 26 123.059 123.059 122.634 0.425 25487
700 1 3 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.577 0.422 25487
701 1 3 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.602 -4.782 25487
702 1 3 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.667 -4.926 25487
703 1 3 . 1 1 26 26 TYR H H 26 7.884 7.884 7.488 0.396 25487
704 1 3 . 1 1 27 27 VAL N N 27 116.468 116.468 117.719 -1.251 25487
705 1 3 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.447 -0.076 25487
706 1 3 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.303 -1.788 25487
707 1 3 . 1 1 27 27 VAL CB C 27 31.945 31.945 36.347 -4.402 25487
708 1 3 . 1 1 27 27 VAL H H 27 9.012 9.012 8.947 0.065 25487
709 1 3 . 1 1 28 28 CYS N N 28 124.932 124.932 122.460 2.472 25487
710 1 3 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.649 0.105 25487
711 1 3 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.928 -5.729 25487
712 1 3 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.437 11.350 25487
713 1 3 . 1 1 28 28 CYS H H 28 8.874 8.874 8.774 0.100 25487
714 1 3 . 1 1 29 29 ASP N N 29 131.592 131.592 129.605 1.987 25487
715 1 3 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.817 0.128 25487
716 1 3 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.316 -3.260 25487
717 1 3 . 1 1 29 29 ASP CB C 29 38.469 38.469 42.567 -4.098 25487
718 1 3 . 1 1 29 29 ASP H H 29 8.603 8.603 8.780 -0.177 25487
719 1 3 . 1 1 30 30 CYS N N 30 122.694 122.694 122.689 0.005 25487
720 1 3 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.878 0.925 25487
721 1 3 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.610 -6.221 25487
722 1 3 . 1 1 30 30 CYS CB C 30 43.933 43.933 27.913 16.020 25487
723 1 3 . 1 1 30 30 CYS H H 30 8.480 8.480 8.552 -0.072 25487
724 1 3 . 1 1 31 31 PHE N N 31 121.135 121.135 122.507 -1.372 25487
725 1 3 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.581 0.206 25487
726 1 3 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.288 -4.960 25487
727 1 3 . 1 1 31 31 PHE H H 31 9.062 9.062 8.933 0.129 25487
728 1 3 . 1 1 32 32 TYR N N 32 120.021 120.021 116.709 3.312 25487
729 1 3 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.360 -0.370 25487
730 1 3 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.690 -1.951 25487
731 1 3 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.761 -4.279 25487
732 1 3 . 1 1 32 32 TYR H H 32 8.614 8.614 8.605 0.009 25487
733 1 3 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.322 0.178 25487
734 1 3 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.344 -2.855 25487
735 1 3 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.303 -0.650 25487
736 1 3 . 1 1 34 34 GLU N N 34 119.222 119.222 120.168 -0.946 25487
737 1 3 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.957 0.388 25487
738 1 3 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.398 -3.701 25487
739 1 3 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.156 -3.097 25487
740 1 3 . 1 1 34 34 GLU H H 34 8.516 8.516 8.697 -0.181 25487
741 1 3 . 1 1 35 35 GLY N N 35 109.836 109.836 104.990 4.846 25487
742 1 3 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.983 -2.563 25487
743 1 3 . 1 1 35 35 GLY H H 35 8.209 8.209 7.570 0.639 25487
744 1 3 . 1 1 36 36 GLU N N 36 119.666 119.666 120.546 -0.880 25487
745 1 3 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.530 0.695 25487
746 1 3 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.968 -3.402 25487
747 1 3 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.404 -3.234 25487
748 1 3 . 1 1 36 36 GLU H H 36 8.190 8.190 8.534 -0.344 25487
749 1 3 . 1 1 37 37 ASP N N 37 117.788 117.788 119.190 -1.402 25487
750 1 3 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.618 -0.088 25487
751 1 3 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.075 -3.240 25487
752 1 3 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.586 -4.463 25487
753 1 3 . 1 1 37 37 ASP H H 37 8.305 8.305 8.233 0.072 25487
754 1 3 . 1 1 38 38 LYS N N 38 119.545 119.545 118.845 0.700 25487
755 1 3 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.623 -0.157 25487
756 1 3 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.826 -3.478 25487
757 1 3 . 1 1 38 38 LYS CB C 38 30.614 30.614 35.055 -4.441 25487
758 1 3 . 1 1 38 38 LYS H H 38 7.950 7.950 7.677 0.273 25487
759 1 3 . 1 1 39 39 THR N N 39 115.195 115.195 114.757 0.438 25487
760 1 3 . 1 1 39 39 THR HA H 39 4.323 4.323 4.725 -0.402 25487
761 1 3 . 1 1 39 39 THR CA C 39 59.508 59.508 61.880 -2.372 25487
762 1 3 . 1 1 39 39 THR CB C 39 67.653 67.653 71.567 -3.914 25487
763 1 3 . 1 1 39 39 THR H H 39 7.888 7.888 8.049 -0.161 25487
764 1 3 . 1 1 40 40 GLU N N 40 124.664 124.664 125.533 -0.869 25487
765 1 3 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.777 -0.811 25487
766 1 3 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.372 -2.343 25487
767 1 3 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.330 -3.863 25487
768 1 3 . 1 1 40 40 GLU H H 40 8.345 8.345 8.593 -0.248 25487
769 1 3 . 1 1 41 41 VAL N N 41 124.551 124.551 124.764 -0.213 25487
770 1 3 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.404 -0.303 25487
771 1 3 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.223 -2.828 25487
772 1 3 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.540 -2.645 25487
773 1 3 . 1 1 41 41 VAL H H 41 8.377 8.377 8.693 -0.316 25487
774 1 3 . 1 1 42 42 CYS N N 42 122.732 122.732 126.709 -3.977 25487
775 1 3 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.500 0.255 25487
776 1 3 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.441 -5.598 25487
777 1 3 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.433 16.047 25487
778 1 3 . 1 1 42 42 CYS H H 42 8.712 8.712 9.067 -0.355 25487
779 1 3 . 1 1 43 43 SER N N 43 117.527 117.527 117.179 0.348 25487
780 1 3 . 1 1 43 43 SER HA H 43 5.220 5.220 5.329 -0.109 25487
781 1 3 . 1 1 43 43 SER CA C 43 54.110 54.110 56.152 -2.042 25487
782 1 3 . 1 1 43 43 SER CB C 43 64.091 64.091 65.745 -1.654 25487
783 1 3 . 1 1 43 43 SER H H 43 8.828 8.828 8.956 -0.128 25487
784 1 3 . 1 1 44 44 CYS N N 44 120.721 120.721 123.548 -2.827 25487
785 1 3 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.867 0.346 25487
786 1 3 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.900 -6.872 25487
787 1 3 . 1 1 44 44 CYS CB C 44 36.825 36.825 25.543 11.283 25487
788 1 3 . 1 1 44 44 CYS H H 44 7.936 7.936 8.668 -0.732 25487
789 1 3 . 1 1 45 45 GLN N N 45 124.614 124.614 125.671 -1.057 25487
790 1 3 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.711 -0.067 25487
791 1 3 . 1 1 45 45 GLN CB C 45 26.433 26.433 34.017 -7.584 25487
792 1 3 . 1 1 45 45 GLN H H 45 9.892 9.892 9.187 0.705 25487
793 1 3 . 1 1 46 46 GLN N N 46 120.933 120.933 120.730 0.203 25487
794 1 3 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.759 0.267 25487
795 1 3 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.107 -3.442 25487
796 1 3 . 1 1 46 46 GLN H H 46 8.849 8.849 8.588 0.261 25487
797 1 3 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.506 0.014 25487
798 1 3 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.284 -1.877 25487
799 1 3 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.709 -2.960 25487
800 1 3 . 1 1 48 48 LYS N N 48 124.003 124.003 122.507 1.496 25487
801 1 3 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.848 0.205 25487
802 1 3 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.417 -3.833 25487
803 1 3 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.132 -1.568 25487
804 1 3 . 1 1 48 48 LYS H H 48 8.931 8.931 8.817 0.114 25487
805 1 3 . 1 1 49 49 SER N N 49 113.527 113.527 113.929 -0.402 25487
806 1 3 . 1 1 49 49 SER HA H 49 3.995 3.995 4.208 -0.213 25487
807 1 3 . 1 1 49 49 SER CA C 49 55.458 55.458 61.476 -6.018 25487
808 1 3 . 1 1 49 49 SER CB C 49 61.270 61.270 62.564 -1.294 25487
809 1 3 . 1 1 49 49 SER H H 49 8.702 8.702 8.397 0.305 25487
810 1 3 . 1 1 50 50 HIS N N 50 119.669 119.669 120.723 -1.054 25487
811 1 3 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.133 0.194 25487
812 1 3 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.744 -3.288 25487
813 1 3 . 1 1 50 50 HIS H H 50 7.664 7.664 7.560 0.104 25487
814 1 3 . 1 1 51 51 LYS N N 51 120.030 120.030 119.667 0.363 25487
815 1 3 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.007 0.086 25487
816 1 3 . 1 1 51 51 LYS CA C 51 56.752 56.752 58.740 -1.988 25487
817 1 3 . 1 1 51 51 LYS CB C 51 30.381 30.381 31.927 -1.546 25487
818 1 3 . 1 1 51 51 LYS H H 51 7.825 7.825 8.168 -0.343 25487
819 1 3 . 1 1 52 52 ILE N N 52 118.914 118.914 119.694 -0.780 25487
820 1 3 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.621 0.100 25487
821 1 3 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.143 -3.318 25487
822 1 3 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.566 -2.560 25487
823 1 3 . 1 1 52 52 ILE H H 52 8.223 8.223 7.986 0.237 25487
824 1 3 . 1 1 53 53 ALA N N 53 120.985 120.985 122.089 -1.104 25487
825 1 3 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.883 0.073 25487
826 1 3 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.598 -2.455 25487
827 1 3 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.839 -1.093 25487
828 1 3 . 1 1 53 53 ALA H H 53 8.066 8.066 8.159 -0.093 25487
829 1 3 . 1 1 54 54 GLU N N 54 115.137 115.137 118.014 -2.877 25487
830 1 3 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.962 -0.029 25487
831 1 3 . 1 1 54 54 GLU CB C 54 26.848 26.848 28.718 -1.870 25487
832 1 3 . 1 1 54 54 GLU H H 54 8.160 8.160 8.052 0.108 25487
833 1 3 . 1 1 55 55 LYS N N 55 118.610 118.610 119.445 -0.835 25487
834 1 3 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.009 0.147 25487
835 1 3 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.100 -2.673 25487
836 1 3 . 1 1 55 55 LYS H H 55 7.732 7.732 8.002 -0.270 25487
837 1 3 . 1 1 56 56 ILE N N 56 119.173 119.173 120.689 -1.516 25487
838 1 3 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.745 -0.118 25487
839 1 3 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.056 -1.159 25487
840 1 3 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.763 -1.620 25487
841 1 3 . 1 1 56 56 ILE H H 56 8.022 8.022 8.150 -0.128 25487
842 1 3 . 1 1 57 57 ILE N N 57 120.239 120.239 120.826 -0.587 25487
843 1 3 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.575 0.013 25487
844 1 3 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.500 -1.602 25487
845 1 3 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.094 -1.057 25487
846 1 3 . 1 1 57 57 ILE H H 57 8.370 8.370 8.333 0.037 25487
847 1 3 . 1 1 58 58 ASP N N 58 118.234 118.234 119.990 -1.756 25487
848 1 3 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.286 0.126 25487
849 1 3 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.646 -3.472 25487
850 1 3 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.050 -3.855 25487
851 1 3 . 1 1 58 58 ASP H H 58 8.458 8.458 8.536 -0.078 25487
852 1 3 . 1 1 59 59 LYS N N 59 119.380 119.380 120.060 -0.680 25487
853 1 3 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.951 0.299 25487
854 1 3 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.184 -4.253 25487
855 1 3 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.482 -2.421 25487
856 1 3 . 1 1 59 59 LYS H H 59 7.928 7.928 8.049 -0.121 25487
857 1 3 . 1 1 60 60 ALA N N 60 123.604 123.604 122.038 1.566 25487
858 1 3 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.078 -0.093 25487
859 1 3 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.325 -2.512 25487
860 1 3 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.340 -2.542 25487
861 1 3 . 1 1 60 60 ALA H H 60 8.699 8.699 8.228 0.471 25487
862 1 3 . 1 1 61 61 LYS N N 61 115.317 115.317 117.782 -2.465 25487
863 1 3 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.419 -0.401 25487
864 1 3 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.444 -1.659 25487
865 1 3 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.487 -1.980 25487
866 1 3 . 1 1 61 61 LYS H H 61 8.361 8.361 8.206 0.155 25487
867 1 3 . 1 1 62 62 THR N N 62 107.298 107.298 113.830 -6.532 25487
868 1 3 . 1 1 62 62 THR HA H 62 4.368 4.368 4.177 0.191 25487
869 1 3 . 1 1 62 62 THR CA C 62 60.427 60.427 65.165 -4.739 25487
870 1 3 . 1 1 62 62 THR CB C 62 67.179 67.179 69.120 -1.941 25487
871 1 3 . 1 1 62 62 THR H H 62 7.510 7.510 8.074 -0.564 25487
872 1 3 . 1 1 63 63 THR N N 63 115.701 115.701 115.537 0.164 25487
873 1 3 . 1 1 63 63 THR HA H 63 4.328 4.328 4.286 0.042 25487
874 1 3 . 1 1 63 63 THR CA C 63 61.695 61.695 65.045 -3.350 25487
875 1 3 . 1 1 63 63 THR CB C 63 67.641 67.641 69.885 -2.244 25487
876 1 3 . 1 1 63 63 THR H H 63 7.651 7.651 7.693 -0.042 25487
877 1 4 . 1 1 2 2 LYS N N 2 121.111 121.111 122.071 -0.960 25487
878 1 4 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.624 -0.299 25487
879 1 4 . 1 1 2 2 LYS CA C 2 53.663 53.663 55.978 -2.315 25487
880 1 4 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.760 -2.345 25487
881 1 4 . 1 1 2 2 LYS H H 2 8.492 8.492 8.440 0.052 25487
882 1 4 . 1 1 3 3 ALA N N 3 126.440 126.440 127.635 -1.195 25487
883 1 4 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.354 0.071 25487
884 1 4 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.980 -2.533 25487
885 1 4 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.463 -2.558 25487
886 1 4 . 1 1 3 3 ALA H H 3 8.357 8.357 8.383 -0.026 25487
887 1 4 . 1 1 4 4 CYS N N 4 116.834 116.834 120.013 -3.179 25487
888 1 4 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.613 0.290 25487
889 1 4 . 1 1 4 4 CYS CA C 4 51.793 51.793 57.918 -6.125 25487
890 1 4 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.252 12.042 25487
891 1 4 . 1 1 4 4 CYS H H 4 8.145 8.145 8.391 -0.246 25487
892 1 4 . 1 1 5 5 THR N N 5 121.220 121.220 118.289 2.931 25487
893 1 4 . 1 1 5 5 THR HA H 5 4.481 4.481 4.803 -0.322 25487
894 1 4 . 1 1 5 5 THR CA C 5 58.256 58.256 60.517 -2.261 25487
895 1 4 . 1 1 5 5 THR CB C 5 67.043 67.043 69.716 -2.672 25487
896 1 4 . 1 1 5 5 THR H H 5 9.070 9.070 8.510 0.560 25487
897 1 4 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.435 -0.183 25487
898 1 4 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.276 -3.037 25487
899 1 4 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.483 -1.954 25487
900 1 4 . 1 1 7 7 LEU N N 7 119.270 119.270 119.539 -0.269 25487
901 1 4 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.891 -0.635 25487
902 1 4 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.755 -1.695 25487
903 1 4 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.089 -2.883 25487
904 1 4 . 1 1 7 7 LEU H H 7 7.797 7.797 7.901 -0.104 25487
905 1 4 . 1 1 8 8 LEU N N 8 119.586 119.586 121.999 -2.413 25487
906 1 4 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.910 -0.088 25487
907 1 4 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.802 -0.879 25487
908 1 4 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.619 -3.017 25487
909 1 4 . 1 1 8 8 LEU H H 8 9.465 9.465 8.736 0.729 25487
910 1 4 . 1 1 9 9 HIS N N 9 117.507 117.507 116.769 0.738 25487
911 1 4 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.773 -0.027 25487
912 1 4 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.302 -1.875 25487
913 1 4 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.794 -6.686 25487
914 1 4 . 1 1 9 9 HIS H H 9 8.159 8.159 8.116 0.043 25487
915 1 4 . 1 1 10 10 ASP N N 10 119.492 119.492 121.762 -2.270 25487
916 1 4 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.621 0.262 25487
917 1 4 . 1 1 10 10 ASP CA C 10 52.338 52.338 56.102 -3.764 25487
918 1 4 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.524 -1.054 25487
919 1 4 . 1 1 10 10 ASP H H 10 8.341 8.341 8.669 -0.328 25487
920 1 4 . 1 1 11 11 CYS N N 11 121.767 121.767 120.200 1.567 25487
921 1 4 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.865 0.264 25487
922 1 4 . 1 1 11 11 CYS CA C 11 52.756 52.756 57.497 -4.741 25487
923 1 4 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.995 13.241 25487
924 1 4 . 1 1 11 11 CYS H H 11 8.017 8.017 8.586 -0.569 25487
925 1 4 . 1 1 12 12 SER N N 12 118.618 118.618 119.349 -0.731 25487
926 1 4 . 1 1 12 12 SER HA H 12 3.759 3.759 4.137 -0.378 25487
927 1 4 . 1 1 12 12 SER CB C 12 59.972 59.972 62.868 -2.896 25487
928 1 4 . 1 1 12 12 SER H H 12 8.844 8.844 8.608 0.236 25487
929 1 4 . 1 1 13 13 HIS N N 13 117.166 117.166 116.591 0.575 25487
930 1 4 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.668 -0.046 25487
931 1 4 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.160 -4.707 25487
932 1 4 . 1 1 13 13 HIS H H 13 8.547 8.547 8.180 0.367 25487
933 1 4 . 1 1 14 14 ASP N N 14 117.382 117.382 119.063 -1.681 25487
934 1 4 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.901 -0.210 25487
935 1 4 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.433 -3.241 25487
936 1 4 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.855 -6.431 25487
937 1 4 . 1 1 14 14 ASP H H 14 7.224 7.224 7.833 -0.609 25487
938 1 4 . 1 1 15 15 ARG N N 15 124.498 124.498 122.689 1.809 25487
939 1 4 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.231 0.486 25487
940 1 4 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.334 -3.801 25487
941 1 4 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.285 0.107 25487
942 1 4 . 1 1 15 15 ARG H H 15 9.004 9.004 8.512 0.491 25487
943 1 4 . 1 1 16 16 HIS N N 16 116.269 116.269 114.140 2.129 25487
944 1 4 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.858 0.210 25487
945 1 4 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.315 -2.840 25487
946 1 4 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.530 -3.854 25487
947 1 4 . 1 1 16 16 HIS H H 16 8.528 8.528 8.326 0.202 25487
948 1 4 . 1 1 17 17 SER N N 17 112.719 112.719 115.523 -2.804 25487
949 1 4 . 1 1 17 17 SER HA H 17 4.493 4.493 4.545 -0.052 25487
950 1 4 . 1 1 17 17 SER CA C 17 56.591 56.591 59.118 -2.527 25487
951 1 4 . 1 1 17 17 SER CB C 17 62.736 62.736 65.097 -2.361 25487
952 1 4 . 1 1 17 17 SER H H 17 7.503 7.503 7.811 -0.308 25487
953 1 4 . 1 1 18 18 CYS N N 18 122.070 122.070 120.860 1.210 25487
954 1 4 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.419 0.655 25487
955 1 4 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.477 -4.902 25487
956 1 4 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.360 10.465 25487
957 1 4 . 1 1 18 18 CYS H H 18 8.651 8.651 8.271 0.380 25487
958 1 4 . 1 1 19 19 CYS N N 19 118.243 118.243 124.940 -6.697 25487
959 1 4 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.366 0.154 25487
960 1 4 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.894 -7.346 25487
961 1 4 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.068 11.322 25487
962 1 4 . 1 1 19 19 CYS H H 19 8.936 8.936 8.389 0.547 25487
963 1 4 . 1 1 20 20 ARG N N 20 116.858 116.858 121.106 -4.248 25487
964 1 4 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.152 -0.053 25487
965 1 4 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.745 -3.740 25487
966 1 4 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.645 -2.016 25487
967 1 4 . 1 1 20 20 ARG H H 20 8.136 8.136 8.523 -0.387 25487
968 1 4 . 1 1 21 21 GLY N N 21 110.611 110.611 106.504 4.107 25487
969 1 4 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.307 -1.511 25487
970 1 4 . 1 1 21 21 GLY H H 21 7.569 7.569 8.086 -0.517 25487
971 1 4 . 1 1 22 22 ASP N N 22 121.161 121.161 119.960 1.201 25487
972 1 4 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.418 -0.083 25487
973 1 4 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.669 -3.006 25487
974 1 4 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.141 -4.757 25487
975 1 4 . 1 1 22 22 ASP H H 22 8.674 8.674 8.732 -0.058 25487
976 1 4 . 1 1 23 23 MET N N 23 114.811 114.811 114.459 0.352 25487
977 1 4 . 1 1 23 23 MET HA H 23 4.218 4.218 4.169 0.049 25487
978 1 4 . 1 1 23 23 MET CA C 23 53.190 53.190 56.206 -3.016 25487
979 1 4 . 1 1 23 23 MET CB C 23 30.586 30.586 35.285 -4.699 25487
980 1 4 . 1 1 23 23 MET H H 23 8.333 8.333 7.696 0.637 25487
981 1 4 . 1 1 24 24 PHE N N 24 116.019 116.019 117.467 -1.448 25487
982 1 4 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.785 0.042 25487
983 1 4 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.451 2.090 25487
984 1 4 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.785 -2.989 25487
985 1 4 . 1 1 24 24 PHE H H 24 7.821 7.821 7.915 -0.094 25487
986 1 4 . 1 1 25 25 LYS N N 25 123.768 123.768 122.877 0.891 25487
987 1 4 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.841 0.205 25487
988 1 4 . 1 1 25 25 LYS CA C 25 54.638 54.638 57.008 -2.370 25487
989 1 4 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.807 -1.730 25487
990 1 4 . 1 1 25 25 LYS H H 25 9.119 9.119 8.499 0.620 25487
991 1 4 . 1 1 26 26 TYR N N 26 123.059 123.059 118.959 4.100 25487
992 1 4 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.391 0.608 25487
993 1 4 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.321 -4.501 25487
994 1 4 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.081 -4.340 25487
995 1 4 . 1 1 26 26 TYR H H 26 7.884 7.884 7.333 0.551 25487
996 1 4 . 1 1 27 27 VAL N N 27 116.468 116.468 117.608 -1.140 25487
997 1 4 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.477 -0.106 25487
998 1 4 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.908 -2.393 25487
999 1 4 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.078 -3.133 25487
1000 1 4 . 1 1 27 27 VAL H H 27 9.012 9.012 9.036 -0.024 25487
1001 1 4 . 1 1 28 28 CYS N N 28 124.932 124.932 127.140 -2.208 25487
1002 1 4 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.749 0.005 25487
1003 1 4 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.600 -5.400 25487
1004 1 4 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.492 11.295 25487
1005 1 4 . 1 1 28 28 CYS H H 28 8.874 8.874 8.921 -0.047 25487
1006 1 4 . 1 1 29 29 ASP N N 29 131.592 131.592 129.480 2.112 25487
1007 1 4 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.721 0.224 25487
1008 1 4 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.596 -3.541 25487
1009 1 4 . 1 1 29 29 ASP CB C 29 38.469 38.469 42.493 -4.024 25487
1010 1 4 . 1 1 29 29 ASP H H 29 8.603 8.603 8.560 0.043 25487
1011 1 4 . 1 1 30 30 CYS N N 30 122.694 122.694 121.535 1.159 25487
1012 1 4 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.532 1.271 25487
1013 1 4 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.505 -6.116 25487
1014 1 4 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.729 14.204 25487
1015 1 4 . 1 1 30 30 CYS H H 30 8.480 8.480 8.564 -0.084 25487
1016 1 4 . 1 1 31 31 PHE N N 31 121.135 121.135 120.704 0.431 25487
1017 1 4 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.499 0.288 25487
1018 1 4 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.295 -4.967 25487
1019 1 4 . 1 1 31 31 PHE H H 31 9.062 9.062 8.415 0.647 25487
1020 1 4 . 1 1 32 32 TYR N N 32 120.021 120.021 119.346 0.675 25487
1021 1 4 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.976 0.014 25487
1022 1 4 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.596 -1.857 25487
1023 1 4 . 1 1 32 32 TYR CB C 32 35.482 35.482 38.136 -2.654 25487
1024 1 4 . 1 1 32 32 TYR H H 32 8.614 8.614 8.722 -0.108 25487
1025 1 4 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.313 0.187 25487
1026 1 4 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.132 -2.643 25487
1027 1 4 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.263 -0.610 25487
1028 1 4 . 1 1 34 34 GLU N N 34 119.222 119.222 119.234 -0.012 25487
1029 1 4 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.998 0.347 25487
1030 1 4 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.316 -3.619 25487
1031 1 4 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.817 -2.757 25487
1032 1 4 . 1 1 34 34 GLU H H 34 8.516 8.516 8.587 -0.071 25487
1033 1 4 . 1 1 35 35 GLY N N 35 109.836 109.836 105.828 4.008 25487
1034 1 4 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.357 -2.938 25487
1035 1 4 . 1 1 35 35 GLY H H 35 8.209 8.209 7.527 0.682 25487
1036 1 4 . 1 1 36 36 GLU N N 36 119.666 119.666 119.709 -0.043 25487
1037 1 4 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.576 -0.351 25487
1038 1 4 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.915 -3.349 25487
1039 1 4 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.373 -3.203 25487
1040 1 4 . 1 1 36 36 GLU H H 36 8.190 8.190 8.547 -0.357 25487
1041 1 4 . 1 1 37 37 ASP N N 37 117.788 117.788 121.275 -3.487 25487
1042 1 4 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.667 -0.137 25487
1043 1 4 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.659 -3.825 25487
1044 1 4 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.901 -4.778 25487
1045 1 4 . 1 1 37 37 ASP H H 37 8.305 8.305 8.397 -0.092 25487
1046 1 4 . 1 1 38 38 LYS N N 38 119.545 119.545 118.665 0.880 25487
1047 1 4 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.549 -0.083 25487
1048 1 4 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.336 -2.988 25487
1049 1 4 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.382 -3.768 25487
1050 1 4 . 1 1 38 38 LYS H H 38 7.950 7.950 7.964 -0.014 25487
1051 1 4 . 1 1 39 39 THR N N 39 115.195 115.195 115.614 -0.419 25487
1052 1 4 . 1 1 39 39 THR HA H 39 4.323 4.323 4.530 -0.207 25487
1053 1 4 . 1 1 39 39 THR CA C 39 59.508 59.508 61.946 -2.438 25487
1054 1 4 . 1 1 39 39 THR CB C 39 67.653 67.653 69.643 -1.990 25487
1055 1 4 . 1 1 39 39 THR H H 39 7.888 7.888 7.902 -0.014 25487
1056 1 4 . 1 1 40 40 GLU N N 40 124.664 124.664 122.002 2.662 25487
1057 1 4 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.668 -0.702 25487
1058 1 4 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.853 -2.824 25487
1059 1 4 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.449 -3.982 25487
1060 1 4 . 1 1 40 40 GLU H H 40 8.345 8.345 8.101 0.244 25487
1061 1 4 . 1 1 41 41 VAL N N 41 124.551 124.551 126.354 -1.803 25487
1062 1 4 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.313 -0.212 25487
1063 1 4 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.470 -3.075 25487
1064 1 4 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.495 -1.600 25487
1065 1 4 . 1 1 41 41 VAL H H 41 8.377 8.377 8.563 -0.186 25487
1066 1 4 . 1 1 42 42 CYS N N 42 122.732 122.732 126.684 -3.952 25487
1067 1 4 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.424 0.331 25487
1068 1 4 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.288 -5.444 25487
1069 1 4 . 1 1 42 42 CYS CB C 42 46.480 46.480 31.280 15.200 25487
1070 1 4 . 1 1 42 42 CYS H H 42 8.712 8.712 8.942 -0.230 25487
1071 1 4 . 1 1 43 43 SER N N 43 117.527 117.527 115.433 2.094 25487
1072 1 4 . 1 1 43 43 SER HA H 43 5.220 5.220 5.316 -0.096 25487
1073 1 4 . 1 1 43 43 SER CA C 43 54.110 54.110 56.562 -2.452 25487
1074 1 4 . 1 1 43 43 SER CB C 43 64.091 64.091 65.576 -1.485 25487
1075 1 4 . 1 1 43 43 SER H H 43 8.828 8.828 9.066 -0.238 25487
1076 1 4 . 1 1 44 44 CYS N N 44 120.721 120.721 122.572 -1.851 25487
1077 1 4 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.652 0.561 25487
1078 1 4 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.809 -6.780 25487
1079 1 4 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.467 10.358 25487
1080 1 4 . 1 1 44 44 CYS H H 44 7.936 7.936 8.759 -0.823 25487
1081 1 4 . 1 1 45 45 GLN N N 45 124.614 124.614 125.019 -0.405 25487
1082 1 4 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.640 0.004 25487
1083 1 4 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.917 -7.484 25487
1084 1 4 . 1 1 45 45 GLN H H 45 9.892 9.892 9.180 0.712 25487
1085 1 4 . 1 1 46 46 GLN N N 46 120.933 120.933 120.625 0.308 25487
1086 1 4 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.677 0.349 25487
1087 1 4 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.603 -3.938 25487
1088 1 4 . 1 1 46 46 GLN H H 46 8.849 8.849 8.487 0.362 25487
1089 1 4 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.532 -0.012 25487
1090 1 4 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.272 -1.865 25487
1091 1 4 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.951 -3.202 25487
1092 1 4 . 1 1 48 48 LYS N N 48 124.003 124.003 120.228 3.775 25487
1093 1 4 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.973 0.080 25487
1094 1 4 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.003 -3.419 25487
1095 1 4 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.060 -1.496 25487
1096 1 4 . 1 1 48 48 LYS H H 48 8.931 8.931 8.761 0.170 25487
1097 1 4 . 1 1 49 49 SER N N 49 113.527 113.527 114.135 -0.608 25487
1098 1 4 . 1 1 49 49 SER HA H 49 3.995 3.995 4.179 -0.184 25487
1099 1 4 . 1 1 49 49 SER CA C 49 55.458 55.458 62.424 -6.966 25487
1100 1 4 . 1 1 49 49 SER CB C 49 61.270 61.270 62.400 -1.130 25487
1101 1 4 . 1 1 49 49 SER H H 49 8.702 8.702 8.210 0.492 25487
1102 1 4 . 1 1 50 50 HIS N N 50 119.669 119.669 120.993 -1.324 25487
1103 1 4 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.421 -0.094 25487
1104 1 4 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.868 -3.413 25487
1105 1 4 . 1 1 50 50 HIS H H 50 7.664 7.664 8.372 -0.708 25487
1106 1 4 . 1 1 51 51 LYS N N 51 120.030 120.030 119.387 0.643 25487
1107 1 4 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.183 -0.090 25487
1108 1 4 . 1 1 51 51 LYS CA C 51 56.752 56.752 58.743 -1.992 25487
1109 1 4 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.165 -1.784 25487
1110 1 4 . 1 1 51 51 LYS H H 51 7.825 7.825 8.232 -0.407 25487
1111 1 4 . 1 1 52 52 ILE N N 52 118.914 118.914 119.903 -0.989 25487
1112 1 4 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.652 0.069 25487
1113 1 4 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.051 -3.226 25487
1114 1 4 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.545 -2.539 25487
1115 1 4 . 1 1 52 52 ILE H H 52 8.223 8.223 8.010 0.213 25487
1116 1 4 . 1 1 53 53 ALA N N 53 120.985 120.985 122.169 -1.184 25487
1117 1 4 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.926 0.030 25487
1118 1 4 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.569 -2.426 25487
1119 1 4 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.767 -1.021 25487
1120 1 4 . 1 1 53 53 ALA H H 53 8.066 8.066 8.465 -0.399 25487
1121 1 4 . 1 1 54 54 GLU N N 54 115.137 115.137 118.466 -3.329 25487
1122 1 4 . 1 1 54 54 GLU HA H 54 3.933 3.933 4.006 -0.073 25487
1123 1 4 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.397 -2.549 25487
1124 1 4 . 1 1 54 54 GLU H H 54 8.160 8.160 8.071 0.089 25487
1125 1 4 . 1 1 55 55 LYS N N 55 118.610 118.610 119.736 -1.126 25487
1126 1 4 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.094 0.062 25487
1127 1 4 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.764 -2.337 25487
1128 1 4 . 1 1 55 55 LYS H H 55 7.732 7.732 7.970 -0.238 25487
1129 1 4 . 1 1 56 56 ILE N N 56 119.173 119.173 120.981 -1.808 25487
1130 1 4 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.654 -0.027 25487
1131 1 4 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.311 -2.413 25487
1132 1 4 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.768 -2.625 25487
1133 1 4 . 1 1 56 56 ILE H H 56 8.022 8.022 8.200 -0.178 25487
1134 1 4 . 1 1 57 57 ILE N N 57 120.239 120.239 119.777 0.462 25487
1135 1 4 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.566 0.022 25487
1136 1 4 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.368 -1.470 25487
1137 1 4 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.125 -1.088 25487
1138 1 4 . 1 1 57 57 ILE H H 57 8.370 8.370 8.239 0.131 25487
1139 1 4 . 1 1 58 58 ASP N N 58 118.234 118.234 120.503 -2.269 25487
1140 1 4 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.216 0.196 25487
1141 1 4 . 1 1 58 58 ASP CA C 58 54.174 54.174 58.189 -4.015 25487
1142 1 4 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.431 -4.236 25487
1143 1 4 . 1 1 58 58 ASP H H 58 8.458 8.458 8.399 0.059 25487
1144 1 4 . 1 1 59 59 LYS N N 59 119.380 119.380 118.578 0.802 25487
1145 1 4 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.034 0.216 25487
1146 1 4 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.024 -4.093 25487
1147 1 4 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.338 -2.277 25487
1148 1 4 . 1 1 59 59 LYS H H 59 7.928 7.928 8.216 -0.288 25487
1149 1 4 . 1 1 60 60 ALA N N 60 123.604 123.604 122.272 1.332 25487
1150 1 4 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.035 -0.050 25487
1151 1 4 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.982 -2.169 25487
1152 1 4 . 1 1 60 60 ALA CB C 60 15.797 15.797 19.044 -3.247 25487
1153 1 4 . 1 1 60 60 ALA H H 60 8.699 8.699 8.065 0.634 25487
1154 1 4 . 1 1 61 61 LYS N N 61 115.317 115.317 116.587 -1.270 25487
1155 1 4 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.015 0.003 25487
1156 1 4 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.717 -1.932 25487
1157 1 4 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.879 -2.372 25487
1158 1 4 . 1 1 61 61 LYS H H 61 8.361 8.361 8.092 0.269 25487
1159 1 4 . 1 1 62 62 THR N N 62 107.298 107.298 109.141 -1.843 25487
1160 1 4 . 1 1 62 62 THR HA H 62 4.368 4.368 4.048 0.320 25487
1161 1 4 . 1 1 62 62 THR CA C 62 60.427 60.427 64.156 -3.729 25487
1162 1 4 . 1 1 62 62 THR CB C 62 67.179 67.179 67.067 0.112 25487
1163 1 4 . 1 1 62 62 THR H H 62 7.510 7.510 8.521 -1.011 25487
1164 1 4 . 1 1 63 63 THR N N 63 115.701 115.701 114.061 1.640 25487
1165 1 4 . 1 1 63 63 THR HA H 63 4.328 4.328 4.251 0.077 25487
1166 1 4 . 1 1 63 63 THR CA C 63 61.695 61.695 64.071 -2.376 25487
1167 1 4 . 1 1 63 63 THR CB C 63 67.641 67.641 69.289 -1.648 25487
1168 1 4 . 1 1 63 63 THR H H 63 7.651 7.651 8.246 -0.595 25487
1169 1 5 . 1 1 2 2 LYS N N 2 121.111 121.111 120.502 0.609 25487
1170 1 5 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.074 0.251 25487
1171 1 5 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.440 -2.777 25487
1172 1 5 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.048 -1.633 25487
1173 1 5 . 1 1 2 2 LYS H H 2 8.492 8.492 8.410 0.082 25487
1174 1 5 . 1 1 3 3 ALA N N 3 126.440 126.440 121.423 5.017 25487
1175 1 5 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.344 0.081 25487
1176 1 5 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.112 -2.665 25487
1177 1 5 . 1 1 3 3 ALA CB C 3 16.905 16.905 18.821 -1.916 25487
1178 1 5 . 1 1 3 3 ALA H H 3 8.357 8.357 8.037 0.320 25487
1179 1 5 . 1 1 4 4 CYS N N 4 116.834 116.834 117.673 -0.839 25487
1180 1 5 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.716 0.187 25487
1181 1 5 . 1 1 4 4 CYS CA C 4 51.793 51.793 57.964 -6.171 25487
1182 1 5 . 1 1 4 4 CYS CB C 4 41.294 41.294 31.459 9.835 25487
1183 1 5 . 1 1 4 4 CYS H H 4 8.145 8.145 7.761 0.385 25487
1184 1 5 . 1 1 5 5 THR N N 5 121.220 121.220 119.940 1.280 25487
1185 1 5 . 1 1 5 5 THR HA H 5 4.481 4.481 4.674 -0.193 25487
1186 1 5 . 1 1 5 5 THR CA C 5 58.256 58.256 60.002 -1.746 25487
1187 1 5 . 1 1 5 5 THR CB C 5 67.043 67.043 68.488 -1.445 25487
1188 1 5 . 1 1 5 5 THR H H 5 9.070 9.070 8.763 0.307 25487
1189 1 5 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.416 -0.164 25487
1190 1 5 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.066 -2.827 25487
1191 1 5 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.355 -1.826 25487
1192 1 5 . 1 1 7 7 LEU N N 7 119.270 119.270 120.372 -1.102 25487
1193 1 5 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.909 -0.653 25487
1194 1 5 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.326 -1.266 25487
1195 1 5 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.283 -3.077 25487
1196 1 5 . 1 1 7 7 LEU H H 7 7.797 7.797 7.845 -0.048 25487
1197 1 5 . 1 1 8 8 LEU N N 8 119.586 119.586 123.729 -4.143 25487
1198 1 5 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.034 -0.212 25487
1199 1 5 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.648 -0.725 25487
1200 1 5 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.792 -3.190 25487
1201 1 5 . 1 1 8 8 LEU H H 8 9.465 9.465 8.279 1.186 25487
1202 1 5 . 1 1 9 9 HIS N N 9 117.507 117.507 116.291 1.216 25487
1203 1 5 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.781 -0.035 25487
1204 1 5 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.517 -2.090 25487
1205 1 5 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.908 -6.800 25487
1206 1 5 . 1 1 9 9 HIS H H 9 8.159 8.159 7.616 0.543 25487
1207 1 5 . 1 1 10 10 ASP N N 10 119.492 119.492 120.851 -1.359 25487
1208 1 5 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.621 0.262 25487
1209 1 5 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.707 -2.369 25487
1210 1 5 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.778 -1.308 25487
1211 1 5 . 1 1 10 10 ASP H H 10 8.341 8.341 8.550 -0.209 25487
1212 1 5 . 1 1 11 11 CYS N N 11 121.767 121.767 122.654 -0.887 25487
1213 1 5 . 1 1 11 11 CYS HA H 11 5.129 5.129 5.063 0.066 25487
1214 1 5 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.599 -3.843 25487
1215 1 5 . 1 1 11 11 CYS CB C 11 42.236 42.236 27.504 14.732 25487
1216 1 5 . 1 1 11 11 CYS H H 11 8.017 8.017 8.330 -0.313 25487
1217 1 5 . 1 1 12 12 SER N N 12 118.618 118.618 119.630 -1.012 25487
1218 1 5 . 1 1 12 12 SER HA H 12 3.759 3.759 4.061 -0.302 25487
1219 1 5 . 1 1 12 12 SER CB C 12 59.972 59.972 63.054 -3.082 25487
1220 1 5 . 1 1 12 12 SER H H 12 8.844 8.844 7.990 0.854 25487
1221 1 5 . 1 1 13 13 HIS N N 13 117.166 117.166 116.331 0.835 25487
1222 1 5 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.611 0.011 25487
1223 1 5 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.241 -4.788 25487
1224 1 5 . 1 1 13 13 HIS H H 13 8.547 8.547 8.302 0.245 25487
1225 1 5 . 1 1 14 14 ASP N N 14 117.382 117.382 119.164 -1.782 25487
1226 1 5 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.935 -0.244 25487
1227 1 5 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.255 -3.062 25487
1228 1 5 . 1 1 14 14 ASP CB C 14 36.424 36.424 43.339 -6.915 25487
1229 1 5 . 1 1 14 14 ASP H H 14 7.224 7.224 7.713 -0.489 25487
1230 1 5 . 1 1 15 15 ARG N N 15 124.498 124.498 121.999 2.499 25487
1231 1 5 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.214 0.503 25487
1232 1 5 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.618 -4.085 25487
1233 1 5 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.518 -0.126 25487
1234 1 5 . 1 1 15 15 ARG H H 15 9.004 9.004 8.446 0.558 25487
1235 1 5 . 1 1 16 16 HIS N N 16 116.269 116.269 114.486 1.783 25487
1236 1 5 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.802 0.266 25487
1237 1 5 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.535 -3.059 25487
1238 1 5 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.262 -3.586 25487
1239 1 5 . 1 1 16 16 HIS H H 16 8.528 8.528 8.391 0.137 25487
1240 1 5 . 1 1 17 17 SER N N 17 112.719 112.719 115.145 -2.426 25487
1241 1 5 . 1 1 17 17 SER HA H 17 4.493 4.493 4.458 0.035 25487
1242 1 5 . 1 1 17 17 SER CA C 17 56.591 56.591 58.846 -2.255 25487
1243 1 5 . 1 1 17 17 SER CB C 17 62.736 62.736 64.501 -1.765 25487
1244 1 5 . 1 1 17 17 SER H H 17 7.503 7.503 7.652 -0.149 25487
1245 1 5 . 1 1 18 18 CYS N N 18 122.070 122.070 121.963 0.107 25487
1246 1 5 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.565 0.509 25487
1247 1 5 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.092 -4.518 25487
1248 1 5 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.358 10.466 25487
1249 1 5 . 1 1 18 18 CYS H H 18 8.651 8.651 8.038 0.613 25487
1250 1 5 . 1 1 19 19 CYS N N 19 118.243 118.243 125.094 -6.851 25487
1251 1 5 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.551 -0.031 25487
1252 1 5 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.240 -5.692 25487
1253 1 5 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.165 11.225 25487
1254 1 5 . 1 1 19 19 CYS H H 19 8.936 8.936 8.610 0.326 25487
1255 1 5 . 1 1 20 20 ARG N N 20 116.858 116.858 121.777 -4.919 25487
1256 1 5 . 1 1 20 20 ARG HA H 20 4.099 4.099 3.932 0.167 25487
1257 1 5 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.862 -3.857 25487
1258 1 5 . 1 1 20 20 ARG CB C 20 29.629 29.629 30.573 -0.944 25487
1259 1 5 . 1 1 20 20 ARG H H 20 8.136 8.136 8.399 -0.263 25487
1260 1 5 . 1 1 21 21 GLY N N 21 110.611 110.611 106.858 3.753 25487
1261 1 5 . 1 1 21 21 GLY CA C 21 41.796 41.796 44.215 -2.419 25487
1262 1 5 . 1 1 21 21 GLY H H 21 7.569 7.569 7.415 0.154 25487
1263 1 5 . 1 1 22 22 ASP N N 22 121.161 121.161 119.600 1.561 25487
1264 1 5 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.704 -0.369 25487
1265 1 5 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.310 -2.647 25487
1266 1 5 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.246 -4.862 25487
1267 1 5 . 1 1 22 22 ASP H H 22 8.674 8.674 8.854 -0.180 25487
1268 1 5 . 1 1 23 23 MET N N 23 114.811 114.811 116.106 -1.295 25487
1269 1 5 . 1 1 23 23 MET HA H 23 4.218 4.218 4.397 -0.179 25487
1270 1 5 . 1 1 23 23 MET CA C 23 53.190 53.190 55.984 -2.794 25487
1271 1 5 . 1 1 23 23 MET CB C 23 30.586 30.586 35.042 -4.456 25487
1272 1 5 . 1 1 23 23 MET H H 23 8.333 8.333 8.118 0.215 25487
1273 1 5 . 1 1 24 24 PHE N N 24 116.019 116.019 117.598 -1.579 25487
1274 1 5 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.789 0.038 25487
1275 1 5 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.310 2.231 25487
1276 1 5 . 1 1 24 24 PHE CB C 24 38.796 38.796 42.044 -3.248 25487
1277 1 5 . 1 1 24 24 PHE H H 24 7.821 7.821 7.684 0.137 25487
1278 1 5 . 1 1 25 25 LYS N N 25 123.768 123.768 120.143 3.625 25487
1279 1 5 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.079 -0.033 25487
1280 1 5 . 1 1 25 25 LYS CA C 25 54.638 54.638 55.930 -1.292 25487
1281 1 5 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.500 -2.423 25487
1282 1 5 . 1 1 25 25 LYS H H 25 9.119 9.119 8.133 0.986 25487
1283 1 5 . 1 1 26 26 TYR N N 26 123.059 123.059 122.710 0.349 25487
1284 1 5 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.382 0.617 25487
1285 1 5 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.340 -4.520 25487
1286 1 5 . 1 1 26 26 TYR CB C 26 34.741 34.741 38.776 -4.035 25487
1287 1 5 . 1 1 26 26 TYR H H 26 7.884 7.884 7.649 0.235 25487
1288 1 5 . 1 1 27 27 VAL N N 27 116.468 116.468 118.440 -1.972 25487
1289 1 5 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.486 -0.115 25487
1290 1 5 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.825 -2.310 25487
1291 1 5 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.776 -3.831 25487
1292 1 5 . 1 1 27 27 VAL H H 27 9.012 9.012 9.115 -0.103 25487
1293 1 5 . 1 1 28 28 CYS N N 28 124.932 124.932 127.070 -2.138 25487
1294 1 5 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.675 0.079 25487
1295 1 5 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.569 -5.369 25487
1296 1 5 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.453 11.334 25487
1297 1 5 . 1 1 28 28 CYS H H 28 8.874 8.874 8.952 -0.078 25487
1298 1 5 . 1 1 29 29 ASP N N 29 131.592 131.592 129.012 2.580 25487
1299 1 5 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.894 0.051 25487
1300 1 5 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.809 -3.753 25487
1301 1 5 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.587 -6.117 25487
1302 1 5 . 1 1 29 29 ASP H H 29 8.603 8.603 8.667 -0.064 25487
1303 1 5 . 1 1 30 30 CYS N N 30 122.694 122.694 117.715 4.979 25487
1304 1 5 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.968 0.835 25487
1305 1 5 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.987 -5.598 25487
1306 1 5 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.727 14.206 25487
1307 1 5 . 1 1 30 30 CYS H H 30 8.480 8.480 8.281 0.199 25487
1308 1 5 . 1 1 31 31 PHE N N 31 121.135 121.135 121.973 -0.838 25487
1309 1 5 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.576 0.211 25487
1310 1 5 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.444 -5.116 25487
1311 1 5 . 1 1 31 31 PHE H H 31 9.062 9.062 8.976 0.086 25487
1312 1 5 . 1 1 32 32 TYR N N 32 120.021 120.021 116.727 3.294 25487
1313 1 5 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.363 -0.373 25487
1314 1 5 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.579 -1.840 25487
1315 1 5 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.667 -4.186 25487
1316 1 5 . 1 1 32 32 TYR H H 32 8.614 8.614 8.563 0.051 25487
1317 1 5 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.348 0.152 25487
1318 1 5 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.415 -2.926 25487
1319 1 5 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.410 -0.757 25487
1320 1 5 . 1 1 34 34 GLU N N 34 119.222 119.222 120.317 -1.095 25487
1321 1 5 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.999 0.346 25487
1322 1 5 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.630 -3.933 25487
1323 1 5 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.203 -3.144 25487
1324 1 5 . 1 1 34 34 GLU H H 34 8.516 8.516 8.720 -0.204 25487
1325 1 5 . 1 1 35 35 GLY N N 35 109.836 109.836 104.131 5.705 25487
1326 1 5 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.051 -2.632 25487
1327 1 5 . 1 1 35 35 GLY H H 35 8.209 8.209 7.702 0.507 25487
1328 1 5 . 1 1 36 36 GLU N N 36 119.666 119.666 121.152 -1.486 25487
1329 1 5 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.641 0.584 25487
1330 1 5 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.845 -3.279 25487
1331 1 5 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.152 -2.982 25487
1332 1 5 . 1 1 36 36 GLU H H 36 8.190 8.190 8.556 -0.366 25487
1333 1 5 . 1 1 37 37 ASP N N 37 117.788 117.788 118.653 -0.865 25487
1334 1 5 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.579 -0.049 25487
1335 1 5 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.270 -3.436 25487
1336 1 5 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.782 -4.659 25487
1337 1 5 . 1 1 37 37 ASP H H 37 8.305 8.305 8.122 0.183 25487
1338 1 5 . 1 1 38 38 LYS N N 38 119.545 119.545 119.012 0.533 25487
1339 1 5 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.605 -0.139 25487
1340 1 5 . 1 1 38 38 LYS CA C 38 53.348 53.348 57.049 -3.701 25487
1341 1 5 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.649 -4.035 25487
1342 1 5 . 1 1 38 38 LYS H H 38 7.950 7.950 7.596 0.354 25487
1343 1 5 . 1 1 39 39 THR N N 39 115.195 115.195 114.273 0.922 25487
1344 1 5 . 1 1 39 39 THR HA H 39 4.323 4.323 4.699 -0.376 25487
1345 1 5 . 1 1 39 39 THR CA C 39 59.508 59.508 61.953 -2.445 25487
1346 1 5 . 1 1 39 39 THR CB C 39 67.653 67.653 71.602 -3.949 25487
1347 1 5 . 1 1 39 39 THR H H 39 7.888 7.888 7.947 -0.059 25487
1348 1 5 . 1 1 40 40 GLU N N 40 124.664 124.664 124.426 0.238 25487
1349 1 5 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.868 -0.902 25487
1350 1 5 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.145 -2.116 25487
1351 1 5 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.575 -4.108 25487
1352 1 5 . 1 1 40 40 GLU H H 40 8.345 8.345 8.499 -0.154 25487
1353 1 5 . 1 1 41 41 VAL N N 41 124.551 124.551 125.254 -0.703 25487
1354 1 5 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.383 -0.282 25487
1355 1 5 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.007 -2.612 25487
1356 1 5 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.663 -2.768 25487
1357 1 5 . 1 1 41 41 VAL H H 41 8.377 8.377 8.852 -0.475 25487
1358 1 5 . 1 1 42 42 CYS N N 42 122.732 122.732 126.057 -3.325 25487
1359 1 5 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.406 0.349 25487
1360 1 5 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.474 -5.630 25487
1361 1 5 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.401 16.079 25487
1362 1 5 . 1 1 42 42 CYS H H 42 8.712 8.712 9.081 -0.369 25487
1363 1 5 . 1 1 43 43 SER N N 43 117.527 117.527 115.747 1.780 25487
1364 1 5 . 1 1 43 43 SER HA H 43 5.220 5.220 5.351 -0.131 25487
1365 1 5 . 1 1 43 43 SER CA C 43 54.110 54.110 56.427 -2.317 25487
1366 1 5 . 1 1 43 43 SER CB C 43 64.091 64.091 66.121 -2.030 25487
1367 1 5 . 1 1 43 43 SER H H 43 8.828 8.828 8.922 -0.094 25487
1368 1 5 . 1 1 44 44 CYS N N 44 120.721 120.721 122.611 -1.890 25487
1369 1 5 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.439 0.774 25487
1370 1 5 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.245 -7.217 25487
1371 1 5 . 1 1 44 44 CYS CB C 44 36.825 36.825 25.933 10.892 25487
1372 1 5 . 1 1 44 44 CYS H H 44 7.936 7.936 8.791 -0.855 25487
1373 1 5 . 1 1 45 45 GLN N N 45 124.614 124.614 125.210 -0.596 25487
1374 1 5 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.684 -0.040 25487
1375 1 5 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.639 -7.206 25487
1376 1 5 . 1 1 45 45 GLN H H 45 9.892 9.892 9.293 0.599 25487
1377 1 5 . 1 1 46 46 GLN N N 46 120.933 120.933 119.659 1.274 25487
1378 1 5 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.735 0.291 25487
1379 1 5 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.192 -3.527 25487
1380 1 5 . 1 1 46 46 GLN H H 46 8.849 8.849 8.697 0.152 25487
1381 1 5 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.466 0.054 25487
1382 1 5 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.315 -1.908 25487
1383 1 5 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.635 -2.886 25487
1384 1 5 . 1 1 48 48 LYS N N 48 124.003 124.003 120.482 3.521 25487
1385 1 5 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.964 0.089 25487
1386 1 5 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.762 -3.178 25487
1387 1 5 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.325 -1.761 25487
1388 1 5 . 1 1 48 48 LYS H H 48 8.931 8.931 8.654 0.277 25487
1389 1 5 . 1 1 49 49 SER N N 49 113.527 113.527 115.086 -1.559 25487
1390 1 5 . 1 1 49 49 SER HA H 49 3.995 3.995 4.055 -0.060 25487
1391 1 5 . 1 1 49 49 SER CA C 49 55.458 55.458 61.918 -6.460 25487
1392 1 5 . 1 1 49 49 SER CB C 49 61.270 61.270 62.187 -0.917 25487
1393 1 5 . 1 1 49 49 SER H H 49 8.702 8.702 8.155 0.547 25487
1394 1 5 . 1 1 50 50 HIS N N 50 119.669 119.669 121.822 -2.153 25487
1395 1 5 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.325 0.002 25487
1396 1 5 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.866 -3.411 25487
1397 1 5 . 1 1 50 50 HIS H H 50 7.664 7.664 8.210 -0.546 25487
1398 1 5 . 1 1 51 51 LYS N N 51 120.030 120.030 120.124 -0.094 25487
1399 1 5 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.025 0.068 25487
1400 1 5 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.900 -3.148 25487
1401 1 5 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.527 -2.146 25487
1402 1 5 . 1 1 51 51 LYS H H 51 7.825 7.825 8.172 -0.347 25487
1403 1 5 . 1 1 52 52 ILE N N 52 118.914 118.914 119.912 -0.998 25487
1404 1 5 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.594 0.127 25487
1405 1 5 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.083 -3.258 25487
1406 1 5 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.700 -2.694 25487
1407 1 5 . 1 1 52 52 ILE H H 52 8.223 8.223 7.941 0.282 25487
1408 1 5 . 1 1 53 53 ALA N N 53 120.985 120.985 121.845 -0.860 25487
1409 1 5 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.899 0.057 25487
1410 1 5 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.611 -2.468 25487
1411 1 5 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.794 -1.048 25487
1412 1 5 . 1 1 53 53 ALA H H 53 8.066 8.066 8.513 -0.447 25487
1413 1 5 . 1 1 54 54 GLU N N 54 115.137 115.137 117.923 -2.786 25487
1414 1 5 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.939 -0.006 25487
1415 1 5 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.253 -2.405 25487
1416 1 5 . 1 1 54 54 GLU H H 54 8.160 8.160 8.044 0.116 25487
1417 1 5 . 1 1 55 55 LYS N N 55 118.610 118.610 119.197 -0.587 25487
1418 1 5 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.071 0.085 25487
1419 1 5 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.868 -2.441 25487
1420 1 5 . 1 1 55 55 LYS H H 55 7.732 7.732 8.039 -0.307 25487
1421 1 5 . 1 1 56 56 ILE N N 56 119.173 119.173 120.909 -1.736 25487
1422 1 5 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.755 -0.128 25487
1423 1 5 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.275 -1.377 25487
1424 1 5 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.916 -1.773 25487
1425 1 5 . 1 1 56 56 ILE H H 56 8.022 8.022 8.191 -0.169 25487
1426 1 5 . 1 1 57 57 ILE N N 57 120.239 120.239 119.761 0.478 25487
1427 1 5 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.610 -0.022 25487
1428 1 5 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.279 -1.381 25487
1429 1 5 . 1 1 57 57 ILE CB C 57 35.037 35.037 35.952 -0.915 25487
1430 1 5 . 1 1 57 57 ILE H H 57 8.370 8.370 8.305 0.065 25487
1431 1 5 . 1 1 58 58 ASP N N 58 118.234 118.234 121.451 -3.217 25487
1432 1 5 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.401 0.011 25487
1433 1 5 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.472 -3.298 25487
1434 1 5 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.323 -4.128 25487
1435 1 5 . 1 1 58 58 ASP H H 58 8.458 8.458 8.285 0.173 25487
1436 1 5 . 1 1 59 59 LYS N N 59 119.380 119.380 119.479 -0.099 25487
1437 1 5 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.975 0.275 25487
1438 1 5 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.295 -4.364 25487
1439 1 5 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.518 -2.457 25487
1440 1 5 . 1 1 59 59 LYS H H 59 7.928 7.928 8.100 -0.172 25487
1441 1 5 . 1 1 60 60 ALA N N 60 123.604 123.604 122.075 1.529 25487
1442 1 5 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.169 -0.184 25487
1443 1 5 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.282 -2.469 25487
1444 1 5 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.527 -2.730 25487
1445 1 5 . 1 1 60 60 ALA H H 60 8.699 8.699 8.277 0.422 25487
1446 1 5 . 1 1 61 61 LYS N N 61 115.317 115.317 118.222 -2.905 25487
1447 1 5 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.096 -0.078 25487
1448 1 5 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.976 -2.191 25487
1449 1 5 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.263 -1.756 25487
1450 1 5 . 1 1 61 61 LYS H H 61 8.361 8.361 8.249 0.112 25487
1451 1 5 . 1 1 62 62 THR N N 62 107.298 107.298 115.563 -8.265 25487
1452 1 5 . 1 1 62 62 THR HA H 62 4.368 4.368 4.259 0.109 25487
1453 1 5 . 1 1 62 62 THR CA C 62 60.427 60.427 64.927 -4.500 25487
1454 1 5 . 1 1 62 62 THR CB C 62 67.179 67.179 68.878 -1.699 25487
1455 1 5 . 1 1 62 62 THR H H 62 7.510 7.510 8.318 -0.808 25487
1456 1 5 . 1 1 63 63 THR N N 63 115.701 115.701 114.724 0.977 25487
1457 1 5 . 1 1 63 63 THR HA H 63 4.328 4.328 4.238 0.090 25487
1458 1 5 . 1 1 63 63 THR CA C 63 61.695 61.695 62.865 -1.170 25487
1459 1 5 . 1 1 63 63 THR CB C 63 67.641 67.641 69.479 -1.838 25487
1460 1 5 . 1 1 63 63 THR H H 63 7.651 7.651 7.271 0.380 25487
1461 1 6 . 1 1 2 2 LYS N N 2 121.111 121.111 121.486 -0.375 25487
1462 1 6 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.464 -0.139 25487
1463 1 6 . 1 1 2 2 LYS CA C 2 53.663 53.663 55.759 -2.096 25487
1464 1 6 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.914 -2.499 25487
1465 1 6 . 1 1 2 2 LYS H H 2 8.492 8.492 8.008 0.484 25487
1466 1 6 . 1 1 3 3 ALA N N 3 126.440 126.440 125.371 1.069 25487
1467 1 6 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.360 0.065 25487
1468 1 6 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.739 -2.292 25487
1469 1 6 . 1 1 3 3 ALA CB C 3 16.905 16.905 18.797 -1.892 25487
1470 1 6 . 1 1 3 3 ALA H H 3 8.357 8.357 8.279 0.078 25487
1471 1 6 . 1 1 4 4 CYS N N 4 116.834 116.834 120.902 -4.068 25487
1472 1 6 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.844 0.059 25487
1473 1 6 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.283 -4.490 25487
1474 1 6 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.963 11.331 25487
1475 1 6 . 1 1 4 4 CYS H H 4 8.145 8.145 8.244 -0.099 25487
1476 1 6 . 1 1 5 5 THR N N 5 121.220 121.220 118.140 3.080 25487
1477 1 6 . 1 1 5 5 THR HA H 5 4.481 4.481 4.934 -0.453 25487
1478 1 6 . 1 1 5 5 THR CA C 5 58.256 58.256 60.668 -2.412 25487
1479 1 6 . 1 1 5 5 THR CB C 5 67.043 67.043 68.225 -1.182 25487
1480 1 6 . 1 1 5 5 THR H H 5 9.070 9.070 8.528 0.542 25487
1481 1 6 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.454 -0.202 25487
1482 1 6 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.119 -2.880 25487
1483 1 6 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.475 -1.946 25487
1484 1 6 . 1 1 7 7 LEU N N 7 119.270 119.270 119.779 -0.509 25487
1485 1 6 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.816 -0.560 25487
1486 1 6 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.467 -1.407 25487
1487 1 6 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.039 -2.833 25487
1488 1 6 . 1 1 7 7 LEU H H 7 7.797 7.797 8.085 -0.288 25487
1489 1 6 . 1 1 8 8 LEU N N 8 119.586 119.586 122.383 -2.797 25487
1490 1 6 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.883 -0.061 25487
1491 1 6 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.829 -0.906 25487
1492 1 6 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.380 -2.777 25487
1493 1 6 . 1 1 8 8 LEU H H 8 9.465 9.465 8.731 0.734 25487
1494 1 6 . 1 1 9 9 HIS N N 9 117.507 117.507 115.392 2.115 25487
1495 1 6 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.727 0.019 25487
1496 1 6 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.169 -1.742 25487
1497 1 6 . 1 1 9 9 HIS CB C 9 27.108 27.108 34.150 -7.042 25487
1498 1 6 . 1 1 9 9 HIS H H 9 8.159 8.159 7.667 0.492 25487
1499 1 6 . 1 1 10 10 ASP N N 10 119.492 119.492 120.995 -1.503 25487
1500 1 6 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.561 0.322 25487
1501 1 6 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.517 -3.179 25487
1502 1 6 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.432 -0.962 25487
1503 1 6 . 1 1 10 10 ASP H H 10 8.341 8.341 8.639 -0.298 25487
1504 1 6 . 1 1 11 11 CYS N N 11 121.767 121.767 120.200 1.567 25487
1505 1 6 . 1 1 11 11 CYS HA H 11 5.129 5.129 5.301 -0.172 25487
1506 1 6 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.610 -3.854 25487
1507 1 6 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.733 13.503 25487
1508 1 6 . 1 1 11 11 CYS H H 11 8.017 8.017 8.197 -0.180 25487
1509 1 6 . 1 1 12 12 SER N N 12 118.618 118.618 119.772 -1.154 25487
1510 1 6 . 1 1 12 12 SER HA H 12 3.759 3.759 4.115 -0.356 25487
1511 1 6 . 1 1 12 12 SER CB C 12 59.972 59.972 63.008 -3.036 25487
1512 1 6 . 1 1 12 12 SER H H 12 8.844 8.844 8.499 0.345 25487
1513 1 6 . 1 1 13 13 HIS N N 13 117.166 117.166 116.160 1.006 25487
1514 1 6 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.805 -0.183 25487
1515 1 6 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.244 -3.791 25487
1516 1 6 . 1 1 13 13 HIS H H 13 8.547 8.547 8.182 0.365 25487
1517 1 6 . 1 1 14 14 ASP N N 14 117.382 117.382 119.988 -2.606 25487
1518 1 6 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.956 -0.265 25487
1519 1 6 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.880 -2.688 25487
1520 1 6 . 1 1 14 14 ASP CB C 14 36.424 36.424 41.997 -5.573 25487
1521 1 6 . 1 1 14 14 ASP H H 14 7.224 7.224 7.792 -0.568 25487
1522 1 6 . 1 1 15 15 ARG N N 15 124.498 124.498 121.954 2.544 25487
1523 1 6 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.284 0.433 25487
1524 1 6 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.254 -4.721 25487
1525 1 6 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.675 -0.283 25487
1526 1 6 . 1 1 15 15 ARG H H 15 9.004 9.004 8.647 0.357 25487
1527 1 6 . 1 1 16 16 HIS N N 16 116.269 116.269 118.889 -2.620 25487
1528 1 6 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.764 0.304 25487
1529 1 6 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.190 -2.715 25487
1530 1 6 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.968 -4.292 25487
1531 1 6 . 1 1 16 16 HIS H H 16 8.528 8.528 8.440 0.088 25487
1532 1 6 . 1 1 17 17 SER N N 17 112.719 112.719 115.148 -2.429 25487
1533 1 6 . 1 1 17 17 SER HA H 17 4.493 4.493 4.519 -0.026 25487
1534 1 6 . 1 1 17 17 SER CA C 17 56.591 56.591 59.234 -2.643 25487
1535 1 6 . 1 1 17 17 SER CB C 17 62.736 62.736 63.637 -0.901 25487
1536 1 6 . 1 1 17 17 SER H H 17 7.503 7.503 8.300 -0.797 25487
1537 1 6 . 1 1 18 18 CYS N N 18 122.070 122.070 122.262 -0.192 25487
1538 1 6 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.417 0.657 25487
1539 1 6 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.648 -6.074 25487
1540 1 6 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.621 10.204 25487
1541 1 6 . 1 1 18 18 CYS H H 18 8.651 8.651 7.787 0.864 25487
1542 1 6 . 1 1 19 19 CYS N N 19 118.243 118.243 125.119 -6.876 25487
1543 1 6 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.396 0.124 25487
1544 1 6 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.660 -7.112 25487
1545 1 6 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.583 10.807 25487
1546 1 6 . 1 1 19 19 CYS H H 19 8.936 8.936 8.394 0.542 25487
1547 1 6 . 1 1 20 20 ARG N N 20 116.858 116.858 120.021 -3.163 25487
1548 1 6 . 1 1 20 20 ARG HA H 20 4.099 4.099 3.954 0.145 25487
1549 1 6 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.511 -3.506 25487
1550 1 6 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.017 -1.388 25487
1551 1 6 . 1 1 20 20 ARG H H 20 8.136 8.136 8.330 -0.194 25487
1552 1 6 . 1 1 21 21 GLY N N 21 110.611 110.611 107.152 3.459 25487
1553 1 6 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.675 -1.879 25487
1554 1 6 . 1 1 21 21 GLY H H 21 7.569 7.569 7.709 -0.140 25487
1555 1 6 . 1 1 22 22 ASP N N 22 121.161 121.161 118.896 2.265 25487
1556 1 6 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.712 -0.377 25487
1557 1 6 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.637 -2.974 25487
1558 1 6 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.644 -5.260 25487
1559 1 6 . 1 1 22 22 ASP H H 22 8.674 8.674 8.671 0.003 25487
1560 1 6 . 1 1 23 23 MET N N 23 114.811 114.811 115.556 -0.745 25487
1561 1 6 . 1 1 23 23 MET HA H 23 4.218 4.218 4.235 -0.017 25487
1562 1 6 . 1 1 23 23 MET CA C 23 53.190 53.190 55.741 -2.551 25487
1563 1 6 . 1 1 23 23 MET CB C 23 30.586 30.586 34.855 -4.269 25487
1564 1 6 . 1 1 23 23 MET H H 23 8.333 8.333 7.899 0.434 25487
1565 1 6 . 1 1 24 24 PHE N N 24 116.019 116.019 118.244 -2.225 25487
1566 1 6 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.913 -0.086 25487
1567 1 6 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.441 2.100 25487
1568 1 6 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.774 -2.978 25487
1569 1 6 . 1 1 24 24 PHE H H 24 7.821 7.821 7.910 -0.089 25487
1570 1 6 . 1 1 25 25 LYS N N 25 123.768 123.768 120.154 3.614 25487
1571 1 6 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.032 0.014 25487
1572 1 6 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.218 -1.580 25487
1573 1 6 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.597 -2.520 25487
1574 1 6 . 1 1 25 25 LYS H H 25 9.119 9.119 8.215 0.904 25487
1575 1 6 . 1 1 26 26 TYR N N 26 123.059 123.059 122.924 0.135 25487
1576 1 6 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.427 0.572 25487
1577 1 6 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.559 -4.739 25487
1578 1 6 . 1 1 26 26 TYR CB C 26 34.741 34.741 38.962 -4.221 25487
1579 1 6 . 1 1 26 26 TYR H H 26 7.884 7.884 7.423 0.461 25487
1580 1 6 . 1 1 27 27 VAL N N 27 116.468 116.468 118.020 -1.552 25487
1581 1 6 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.612 -0.241 25487
1582 1 6 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.747 -2.232 25487
1583 1 6 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.385 -3.439 25487
1584 1 6 . 1 1 27 27 VAL H H 27 9.012 9.012 8.966 0.046 25487
1585 1 6 . 1 1 28 28 CYS N N 28 124.932 124.932 127.198 -2.266 25487
1586 1 6 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.707 0.047 25487
1587 1 6 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.045 -5.845 25487
1588 1 6 . 1 1 28 28 CYS CB C 28 37.787 37.787 27.031 10.756 25487
1589 1 6 . 1 1 28 28 CYS H H 28 8.874 8.874 8.894 -0.020 25487
1590 1 6 . 1 1 29 29 ASP N N 29 131.592 131.592 128.947 2.645 25487
1591 1 6 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.922 0.023 25487
1592 1 6 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.392 -3.336 25487
1593 1 6 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.243 -5.774 25487
1594 1 6 . 1 1 29 29 ASP H H 29 8.603 8.603 8.683 -0.080 25487
1595 1 6 . 1 1 30 30 CYS N N 30 122.694 122.694 121.474 1.220 25487
1596 1 6 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.892 0.911 25487
1597 1 6 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.155 -5.766 25487
1598 1 6 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.302 14.631 25487
1599 1 6 . 1 1 30 30 CYS H H 30 8.480 8.480 8.670 -0.190 25487
1600 1 6 . 1 1 31 31 PHE N N 31 121.135 121.135 121.180 -0.045 25487
1601 1 6 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.565 0.222 25487
1602 1 6 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.405 -5.077 25487
1603 1 6 . 1 1 31 31 PHE H H 31 9.062 9.062 8.799 0.263 25487
1604 1 6 . 1 1 32 32 TYR N N 32 120.021 120.021 117.973 2.048 25487
1605 1 6 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.338 -0.348 25487
1606 1 6 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.342 -1.603 25487
1607 1 6 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.663 -4.181 25487
1608 1 6 . 1 1 32 32 TYR H H 32 8.614 8.614 8.547 0.067 25487
1609 1 6 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.300 0.200 25487
1610 1 6 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.391 -2.901 25487
1611 1 6 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.404 -0.751 25487
1612 1 6 . 1 1 34 34 GLU N N 34 119.222 119.222 119.895 -0.673 25487
1613 1 6 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.965 0.380 25487
1614 1 6 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.646 -3.949 25487
1615 1 6 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.202 -3.143 25487
1616 1 6 . 1 1 34 34 GLU H H 34 8.516 8.516 8.790 -0.274 25487
1617 1 6 . 1 1 35 35 GLY N N 35 109.836 109.836 104.749 5.087 25487
1618 1 6 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.980 -2.561 25487
1619 1 6 . 1 1 35 35 GLY H H 35 8.209 8.209 7.704 0.505 25487
1620 1 6 . 1 1 36 36 GLU N N 36 119.666 119.666 119.207 0.459 25487
1621 1 6 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.209 0.016 25487
1622 1 6 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.265 -2.699 25487
1623 1 6 . 1 1 36 36 GLU CB C 36 26.170 26.170 28.725 -2.555 25487
1624 1 6 . 1 1 36 36 GLU H H 36 8.190 8.190 8.451 -0.261 25487
1625 1 6 . 1 1 37 37 ASP N N 37 117.788 117.788 115.581 2.207 25487
1626 1 6 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.674 -0.144 25487
1627 1 6 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.169 -3.335 25487
1628 1 6 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.656 -4.533 25487
1629 1 6 . 1 1 37 37 ASP H H 37 8.305 8.305 8.039 0.266 25487
1630 1 6 . 1 1 38 38 LYS N N 38 119.545 119.545 119.509 0.036 25487
1631 1 6 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.660 -0.194 25487
1632 1 6 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.767 -3.419 25487
1633 1 6 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.907 -4.293 25487
1634 1 6 . 1 1 38 38 LYS H H 38 7.950 7.950 8.181 -0.231 25487
1635 1 6 . 1 1 39 39 THR N N 39 115.195 115.195 114.912 0.283 25487
1636 1 6 . 1 1 39 39 THR HA H 39 4.323 4.323 4.760 -0.437 25487
1637 1 6 . 1 1 39 39 THR CA C 39 59.508 59.508 61.833 -2.325 25487
1638 1 6 . 1 1 39 39 THR CB C 39 67.653 67.653 71.766 -4.113 25487
1639 1 6 . 1 1 39 39 THR H H 39 7.888 7.888 8.091 -0.203 25487
1640 1 6 . 1 1 40 40 GLU N N 40 124.664 124.664 124.441 0.223 25487
1641 1 6 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.807 -0.841 25487
1642 1 6 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.411 -2.382 25487
1643 1 6 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.272 -3.805 25487
1644 1 6 . 1 1 40 40 GLU H H 40 8.345 8.345 8.528 -0.183 25487
1645 1 6 . 1 1 41 41 VAL N N 41 124.551 124.551 125.464 -0.913 25487
1646 1 6 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.335 -0.234 25487
1647 1 6 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.599 -3.204 25487
1648 1 6 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.242 -2.347 25487
1649 1 6 . 1 1 41 41 VAL H H 41 8.377 8.377 8.630 -0.253 25487
1650 1 6 . 1 1 42 42 CYS N N 42 122.732 122.732 126.730 -3.998 25487
1651 1 6 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.518 0.237 25487
1652 1 6 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.358 -5.514 25487
1653 1 6 . 1 1 42 42 CYS CB C 42 46.480 46.480 31.215 15.265 25487
1654 1 6 . 1 1 42 42 CYS H H 42 8.712 8.712 9.056 -0.344 25487
1655 1 6 . 1 1 43 43 SER N N 43 117.527 117.527 115.924 1.603 25487
1656 1 6 . 1 1 43 43 SER HA H 43 5.220 5.220 5.304 -0.084 25487
1657 1 6 . 1 1 43 43 SER CA C 43 54.110 54.110 56.781 -2.671 25487
1658 1 6 . 1 1 43 43 SER CB C 43 64.091 64.091 65.642 -1.551 25487
1659 1 6 . 1 1 43 43 SER H H 43 8.828 8.828 9.153 -0.325 25487
1660 1 6 . 1 1 44 44 CYS N N 44 120.721 120.721 122.734 -2.013 25487
1661 1 6 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.661 0.552 25487
1662 1 6 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.779 -6.752 25487
1663 1 6 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.215 10.610 25487
1664 1 6 . 1 1 44 44 CYS H H 44 7.936 7.936 8.813 -0.877 25487
1665 1 6 . 1 1 45 45 GLN N N 45 124.614 124.614 125.318 -0.704 25487
1666 1 6 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.637 0.007 25487
1667 1 6 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.247 -6.814 25487
1668 1 6 . 1 1 45 45 GLN H H 45 9.892 9.892 9.209 0.683 25487
1669 1 6 . 1 1 46 46 GLN N N 46 120.933 120.933 119.823 1.110 25487
1670 1 6 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.666 0.360 25487
1671 1 6 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.189 -3.524 25487
1672 1 6 . 1 1 46 46 GLN H H 46 8.849 8.849 8.600 0.249 25487
1673 1 6 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.588 -0.068 25487
1674 1 6 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.450 -2.043 25487
1675 1 6 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.864 -3.115 25487
1676 1 6 . 1 1 48 48 LYS N N 48 124.003 124.003 120.417 3.586 25487
1677 1 6 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.977 0.076 25487
1678 1 6 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.183 -3.599 25487
1679 1 6 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.115 -1.551 25487
1680 1 6 . 1 1 48 48 LYS H H 48 8.931 8.931 8.719 0.212 25487
1681 1 6 . 1 1 49 49 SER N N 49 113.527 113.527 114.041 -0.514 25487
1682 1 6 . 1 1 49 49 SER HA H 49 3.995 3.995 4.135 -0.140 25487
1683 1 6 . 1 1 49 49 SER CA C 49 55.458 55.458 62.001 -6.543 25487
1684 1 6 . 1 1 49 49 SER CB C 49 61.270 61.270 62.392 -1.122 25487
1685 1 6 . 1 1 49 49 SER H H 49 8.702 8.702 8.196 0.506 25487
1686 1 6 . 1 1 50 50 HIS N N 50 119.669 119.669 120.267 -0.598 25487
1687 1 6 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.406 -0.079 25487
1688 1 6 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.833 -3.378 25487
1689 1 6 . 1 1 50 50 HIS H H 50 7.664 7.664 8.332 -0.668 25487
1690 1 6 . 1 1 51 51 LYS N N 51 120.030 120.030 119.793 0.237 25487
1691 1 6 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.082 0.011 25487
1692 1 6 . 1 1 51 51 LYS CA C 51 56.752 56.752 60.283 -3.531 25487
1693 1 6 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.568 -2.187 25487
1694 1 6 . 1 1 51 51 LYS H H 51 7.825 7.825 8.236 -0.411 25487
1695 1 6 . 1 1 52 52 ILE N N 52 118.914 118.914 119.803 -0.889 25487
1696 1 6 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.625 0.096 25487
1697 1 6 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.021 -3.196 25487
1698 1 6 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.683 -2.677 25487
1699 1 6 . 1 1 52 52 ILE H H 52 8.223 8.223 7.988 0.235 25487
1700 1 6 . 1 1 53 53 ALA N N 53 120.985 120.985 122.075 -1.090 25487
1701 1 6 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.895 0.061 25487
1702 1 6 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.521 -2.378 25487
1703 1 6 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.750 -1.004 25487
1704 1 6 . 1 1 53 53 ALA H H 53 8.066 8.066 8.472 -0.406 25487
1705 1 6 . 1 1 54 54 GLU N N 54 115.137 115.137 118.507 -3.370 25487
1706 1 6 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.958 -0.025 25487
1707 1 6 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.568 -2.720 25487
1708 1 6 . 1 1 54 54 GLU H H 54 8.160 8.160 8.223 -0.063 25487
1709 1 6 . 1 1 55 55 LYS N N 55 118.610 118.610 118.735 -0.125 25487
1710 1 6 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.083 0.073 25487
1711 1 6 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.211 -2.784 25487
1712 1 6 . 1 1 55 55 LYS H H 55 7.732 7.732 8.060 -0.328 25487
1713 1 6 . 1 1 56 56 ILE N N 56 119.173 119.173 121.089 -1.916 25487
1714 1 6 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.686 -0.059 25487
1715 1 6 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.329 -2.431 25487
1716 1 6 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.856 -2.713 25487
1717 1 6 . 1 1 56 56 ILE H H 56 8.022 8.022 8.163 -0.141 25487
1718 1 6 . 1 1 57 57 ILE N N 57 120.239 120.239 119.593 0.646 25487
1719 1 6 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.570 0.018 25487
1720 1 6 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.364 -1.466 25487
1721 1 6 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.019 -0.982 25487
1722 1 6 . 1 1 57 57 ILE H H 57 8.370 8.370 8.229 0.141 25487
1723 1 6 . 1 1 58 58 ASP N N 58 118.234 118.234 120.982 -2.748 25487
1724 1 6 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.319 0.093 25487
1725 1 6 . 1 1 58 58 ASP CA C 58 54.174 54.174 58.016 -3.842 25487
1726 1 6 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.501 -4.306 25487
1727 1 6 . 1 1 58 58 ASP H H 58 8.458 8.458 8.478 -0.020 25487
1728 1 6 . 1 1 59 59 LYS N N 59 119.380 119.380 119.185 0.195 25487
1729 1 6 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.009 0.241 25487
1730 1 6 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.093 -4.162 25487
1731 1 6 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.468 -2.407 25487
1732 1 6 . 1 1 59 59 LYS H H 59 7.928 7.928 8.082 -0.154 25487
1733 1 6 . 1 1 60 60 ALA N N 60 123.604 123.604 121.961 1.643 25487
1734 1 6 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.135 -0.150 25487
1735 1 6 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.366 -2.553 25487
1736 1 6 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.509 -2.712 25487
1737 1 6 . 1 1 60 60 ALA H H 60 8.699 8.699 8.268 0.431 25487
1738 1 6 . 1 1 61 61 LYS N N 61 115.317 115.317 117.674 -2.357 25487
1739 1 6 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.153 -0.135 25487
1740 1 6 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.868 -2.083 25487
1741 1 6 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.326 -1.819 25487
1742 1 6 . 1 1 61 61 LYS H H 61 8.361 8.361 8.239 0.122 25487
1743 1 6 . 1 1 62 62 THR N N 62 107.298 107.298 114.878 -7.580 25487
1744 1 6 . 1 1 62 62 THR HA H 62 4.368 4.368 4.239 0.129 25487
1745 1 6 . 1 1 62 62 THR CA C 62 60.427 60.427 65.441 -5.014 25487
1746 1 6 . 1 1 62 62 THR CB C 62 67.179 67.179 69.019 -1.841 25487
1747 1 6 . 1 1 62 62 THR H H 62 7.510 7.510 8.253 -0.743 25487
1748 1 6 . 1 1 63 63 THR N N 63 115.701 115.701 114.321 1.380 25487
1749 1 6 . 1 1 63 63 THR HA H 63 4.328 4.328 4.335 -0.007 25487
1750 1 6 . 1 1 63 63 THR CA C 63 61.695 61.695 62.715 -1.020 25487
1751 1 6 . 1 1 63 63 THR CB C 63 67.641 67.641 70.019 -2.378 25487
1752 1 6 . 1 1 63 63 THR H H 63 7.651 7.651 7.453 0.198 25487
1753 1 7 . 1 1 2 2 LYS N N 2 121.111 121.111 120.121 0.990 25487
1754 1 7 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.386 -0.061 25487
1755 1 7 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.542 -2.879 25487
1756 1 7 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.010 -2.595 25487
1757 1 7 . 1 1 2 2 LYS H H 2 8.492 8.492 8.623 -0.131 25487
1758 1 7 . 1 1 3 3 ALA N N 3 126.440 126.440 124.084 2.356 25487
1759 1 7 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.402 0.023 25487
1760 1 7 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.666 -2.219 25487
1761 1 7 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.627 -2.722 25487
1762 1 7 . 1 1 3 3 ALA H H 3 8.357 8.357 7.730 0.627 25487
1763 1 7 . 1 1 4 4 CYS N N 4 116.834 116.834 118.962 -2.128 25487
1764 1 7 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.626 0.277 25487
1765 1 7 . 1 1 4 4 CYS CA C 4 51.793 51.793 55.995 -4.202 25487
1766 1 7 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.473 11.821 25487
1767 1 7 . 1 1 4 4 CYS H H 4 8.145 8.145 8.283 -0.138 25487
1768 1 7 . 1 1 5 5 THR N N 5 121.220 121.220 118.215 3.005 25487
1769 1 7 . 1 1 5 5 THR HA H 5 4.481 4.481 4.772 -0.291 25487
1770 1 7 . 1 1 5 5 THR CA C 5 58.256 58.256 60.203 -1.947 25487
1771 1 7 . 1 1 5 5 THR CB C 5 67.043 67.043 68.544 -1.501 25487
1772 1 7 . 1 1 5 5 THR H H 5 9.070 9.070 8.629 0.441 25487
1773 1 7 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.470 -0.218 25487
1774 1 7 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.328 -3.089 25487
1775 1 7 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.351 -1.822 25487
1776 1 7 . 1 1 7 7 LEU N N 7 119.270 119.270 120.106 -0.836 25487
1777 1 7 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.914 -0.658 25487
1778 1 7 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.307 -1.247 25487
1779 1 7 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.226 -3.020 25487
1780 1 7 . 1 1 7 7 LEU H H 7 7.797 7.797 7.955 -0.158 25487
1781 1 7 . 1 1 8 8 LEU N N 8 119.586 119.586 121.677 -2.091 25487
1782 1 7 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.894 -0.072 25487
1783 1 7 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.802 -0.879 25487
1784 1 7 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.490 -2.888 25487
1785 1 7 . 1 1 8 8 LEU H H 8 9.465 9.465 8.718 0.747 25487
1786 1 7 . 1 1 9 9 HIS N N 9 117.507 117.507 116.593 0.914 25487
1787 1 7 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.734 0.012 25487
1788 1 7 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.420 -1.993 25487
1789 1 7 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.704 -6.596 25487
1790 1 7 . 1 1 9 9 HIS H H 9 8.159 8.159 8.013 0.146 25487
1791 1 7 . 1 1 10 10 ASP N N 10 119.492 119.492 122.035 -2.543 25487
1792 1 7 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.657 0.226 25487
1793 1 7 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.487 -3.149 25487
1794 1 7 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.499 -1.029 25487
1795 1 7 . 1 1 10 10 ASP H H 10 8.341 8.341 8.584 -0.243 25487
1796 1 7 . 1 1 11 11 CYS N N 11 121.767 121.767 119.806 1.961 25487
1797 1 7 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.918 0.211 25487
1798 1 7 . 1 1 11 11 CYS CA C 11 52.756 52.756 57.051 -4.295 25487
1799 1 7 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.725 13.511 25487
1800 1 7 . 1 1 11 11 CYS H H 11 8.017 8.017 8.227 -0.210 25487
1801 1 7 . 1 1 12 12 SER N N 12 118.618 118.618 119.267 -0.649 25487
1802 1 7 . 1 1 12 12 SER HA H 12 3.759 3.759 4.109 -0.350 25487
1803 1 7 . 1 1 12 12 SER CB C 12 59.972 59.972 62.812 -2.840 25487
1804 1 7 . 1 1 12 12 SER H H 12 8.844 8.844 8.364 0.480 25487
1805 1 7 . 1 1 13 13 HIS N N 13 117.166 117.166 116.182 0.984 25487
1806 1 7 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.637 -0.015 25487
1807 1 7 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.343 -3.890 25487
1808 1 7 . 1 1 13 13 HIS H H 13 8.547 8.547 8.231 0.316 25487
1809 1 7 . 1 1 14 14 ASP N N 14 117.382 117.382 119.848 -2.466 25487
1810 1 7 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.894 -0.203 25487
1811 1 7 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.989 -2.797 25487
1812 1 7 . 1 1 14 14 ASP CB C 14 36.424 36.424 41.669 -5.245 25487
1813 1 7 . 1 1 14 14 ASP H H 14 7.224 7.224 7.864 -0.640 25487
1814 1 7 . 1 1 15 15 ARG N N 15 124.498 124.498 121.573 2.925 25487
1815 1 7 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.282 0.435 25487
1816 1 7 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.779 -5.246 25487
1817 1 7 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.807 -0.415 25487
1818 1 7 . 1 1 15 15 ARG H H 15 9.004 9.004 8.397 0.607 25487
1819 1 7 . 1 1 16 16 HIS N N 16 116.269 116.269 117.388 -1.119 25487
1820 1 7 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.733 0.335 25487
1821 1 7 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.435 -2.960 25487
1822 1 7 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.199 -3.523 25487
1823 1 7 . 1 1 16 16 HIS H H 16 8.528 8.528 8.383 0.144 25487
1824 1 7 . 1 1 17 17 SER N N 17 112.719 112.719 115.541 -2.822 25487
1825 1 7 . 1 1 17 17 SER HA H 17 4.493 4.493 4.530 -0.037 25487
1826 1 7 . 1 1 17 17 SER CA C 17 56.591 56.591 59.691 -3.100 25487
1827 1 7 . 1 1 17 17 SER CB C 17 62.736 62.736 63.856 -1.120 25487
1828 1 7 . 1 1 17 17 SER H H 17 7.503 7.503 8.288 -0.785 25487
1829 1 7 . 1 1 18 18 CYS N N 18 122.070 122.070 120.384 1.686 25487
1830 1 7 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.419 0.655 25487
1831 1 7 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.133 -5.559 25487
1832 1 7 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.367 9.458 25487
1833 1 7 . 1 1 18 18 CYS H H 18 8.651 8.651 7.929 0.722 25487
1834 1 7 . 1 1 19 19 CYS N N 19 118.243 118.243 122.371 -4.128 25487
1835 1 7 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.443 0.077 25487
1836 1 7 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.226 -6.678 25487
1837 1 7 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.873 11.517 25487
1838 1 7 . 1 1 19 19 CYS H H 19 8.936 8.936 8.269 0.667 25487
1839 1 7 . 1 1 20 20 ARG N N 20 116.858 116.858 123.142 -6.284 25487
1840 1 7 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.058 0.041 25487
1841 1 7 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.511 -3.506 25487
1842 1 7 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.239 -1.610 25487
1843 1 7 . 1 1 20 20 ARG H H 20 8.136 8.136 8.420 -0.284 25487
1844 1 7 . 1 1 21 21 GLY N N 21 110.611 110.611 108.271 2.340 25487
1845 1 7 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.925 -2.129 25487
1846 1 7 . 1 1 21 21 GLY H H 21 7.569 7.569 7.951 -0.382 25487
1847 1 7 . 1 1 22 22 ASP N N 22 121.161 121.161 119.143 2.018 25487
1848 1 7 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.652 -0.317 25487
1849 1 7 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.535 -2.872 25487
1850 1 7 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.051 -4.667 25487
1851 1 7 . 1 1 22 22 ASP H H 22 8.674 8.674 8.702 -0.028 25487
1852 1 7 . 1 1 23 23 MET N N 23 114.811 114.811 115.779 -0.968 25487
1853 1 7 . 1 1 23 23 MET HA H 23 4.218 4.218 4.273 -0.055 25487
1854 1 7 . 1 1 23 23 MET CA C 23 53.190 53.190 55.669 -2.479 25487
1855 1 7 . 1 1 23 23 MET CB C 23 30.586 30.586 34.960 -4.374 25487
1856 1 7 . 1 1 23 23 MET H H 23 8.333 8.333 7.867 0.467 25487
1857 1 7 . 1 1 24 24 PHE N N 24 116.019 116.019 117.734 -1.715 25487
1858 1 7 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.685 0.142 25487
1859 1 7 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.833 1.708 25487
1860 1 7 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.581 -2.785 25487
1861 1 7 . 1 1 24 24 PHE H H 24 7.821 7.821 7.882 -0.061 25487
1862 1 7 . 1 1 25 25 LYS N N 25 123.768 123.768 122.804 0.964 25487
1863 1 7 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.825 0.221 25487
1864 1 7 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.849 -2.211 25487
1865 1 7 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.949 -1.872 25487
1866 1 7 . 1 1 25 25 LYS H H 25 9.119 9.119 8.396 0.723 25487
1867 1 7 . 1 1 26 26 TYR N N 26 123.059 123.059 117.854 5.205 25487
1868 1 7 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.482 0.517 25487
1869 1 7 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.937 -4.117 25487
1870 1 7 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.195 -4.454 25487
1871 1 7 . 1 1 26 26 TYR H H 26 7.884 7.884 7.372 0.512 25487
1872 1 7 . 1 1 27 27 VAL N N 27 116.468 116.468 118.772 -2.304 25487
1873 1 7 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.577 -0.206 25487
1874 1 7 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.255 -1.740 25487
1875 1 7 . 1 1 27 27 VAL CB C 27 31.945 31.945 36.047 -4.102 25487
1876 1 7 . 1 1 27 27 VAL H H 27 9.012 9.012 9.068 -0.056 25487
1877 1 7 . 1 1 28 28 CYS N N 28 124.932 124.932 127.340 -2.408 25487
1878 1 7 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.711 0.043 25487
1879 1 7 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.860 -5.660 25487
1880 1 7 . 1 1 28 28 CYS CB C 28 37.787 37.787 27.361 10.426 25487
1881 1 7 . 1 1 28 28 CYS H H 28 8.874 8.874 8.846 0.028 25487
1882 1 7 . 1 1 29 29 ASP N N 29 131.592 131.592 129.210 2.382 25487
1883 1 7 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.833 0.112 25487
1884 1 7 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.224 -3.168 25487
1885 1 7 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.663 -5.194 25487
1886 1 7 . 1 1 29 29 ASP H H 29 8.603 8.603 8.624 -0.021 25487
1887 1 7 . 1 1 30 30 CYS N N 30 122.694 122.694 121.316 1.378 25487
1888 1 7 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.671 1.132 25487
1889 1 7 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.241 -5.852 25487
1890 1 7 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.019 14.914 25487
1891 1 7 . 1 1 30 30 CYS H H 30 8.480 8.480 8.539 -0.059 25487
1892 1 7 . 1 1 31 31 PHE N N 31 121.135 121.135 120.953 0.182 25487
1893 1 7 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.630 0.157 25487
1894 1 7 . 1 1 31 31 PHE CB C 31 38.328 38.328 42.926 -4.598 25487
1895 1 7 . 1 1 31 31 PHE H H 31 9.062 9.062 8.695 0.367 25487
1896 1 7 . 1 1 32 32 TYR N N 32 120.021 120.021 116.420 3.601 25487
1897 1 7 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.365 -0.375 25487
1898 1 7 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.657 -1.917 25487
1899 1 7 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.868 -4.386 25487
1900 1 7 . 1 1 32 32 TYR H H 32 8.614 8.614 8.564 0.050 25487
1901 1 7 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.405 0.095 25487
1902 1 7 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.296 -2.807 25487
1903 1 7 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.388 -0.735 25487
1904 1 7 . 1 1 34 34 GLU N N 34 119.222 119.222 118.598 0.624 25487
1905 1 7 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.987 0.358 25487
1906 1 7 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.604 -3.907 25487
1907 1 7 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.654 -2.595 25487
1908 1 7 . 1 1 34 34 GLU H H 34 8.516 8.516 8.706 -0.190 25487
1909 1 7 . 1 1 35 35 GLY N N 35 109.836 109.836 104.638 5.198 25487
1910 1 7 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.797 -2.378 25487
1911 1 7 . 1 1 35 35 GLY H H 35 8.209 8.209 7.495 0.714 25487
1912 1 7 . 1 1 36 36 GLU N N 36 119.666 119.666 120.277 -0.611 25487
1913 1 7 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.646 0.579 25487
1914 1 7 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.825 -3.259 25487
1915 1 7 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.372 -3.202 25487
1916 1 7 . 1 1 36 36 GLU H H 36 8.190 8.190 8.501 -0.311 25487
1917 1 7 . 1 1 37 37 ASP N N 37 117.788 117.788 119.307 -1.519 25487
1918 1 7 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.619 -0.089 25487
1919 1 7 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.343 -3.509 25487
1920 1 7 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.709 -4.586 25487
1921 1 7 . 1 1 37 37 ASP H H 37 8.305 8.305 8.406 -0.101 25487
1922 1 7 . 1 1 38 38 LYS N N 38 119.545 119.545 119.274 0.271 25487
1923 1 7 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.563 -0.097 25487
1924 1 7 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.537 -3.189 25487
1925 1 7 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.743 -4.129 25487
1926 1 7 . 1 1 38 38 LYS H H 38 7.950 7.950 7.535 0.415 25487
1927 1 7 . 1 1 39 39 THR N N 39 115.195 115.195 115.674 -0.479 25487
1928 1 7 . 1 1 39 39 THR HA H 39 4.323 4.323 4.629 -0.306 25487
1929 1 7 . 1 1 39 39 THR CA C 39 59.508 59.508 61.977 -2.470 25487
1930 1 7 . 1 1 39 39 THR CB C 39 67.653 67.653 71.756 -4.103 25487
1931 1 7 . 1 1 39 39 THR H H 39 7.888 7.888 8.157 -0.269 25487
1932 1 7 . 1 1 40 40 GLU N N 40 124.664 124.664 125.871 -1.207 25487
1933 1 7 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.853 -0.887 25487
1934 1 7 . 1 1 40 40 GLU CA C 40 53.029 53.029 56.284 -3.255 25487
1935 1 7 . 1 1 40 40 GLU CB C 40 26.467 26.467 29.943 -3.476 25487
1936 1 7 . 1 1 40 40 GLU H H 40 8.345 8.345 8.673 -0.328 25487
1937 1 7 . 1 1 41 41 VAL N N 41 124.551 124.551 126.125 -1.574 25487
1938 1 7 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.249 -0.148 25487
1939 1 7 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.457 -3.062 25487
1940 1 7 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.677 -1.782 25487
1941 1 7 . 1 1 41 41 VAL H H 41 8.377 8.377 8.792 -0.415 25487
1942 1 7 . 1 1 42 42 CYS N N 42 122.732 122.732 126.619 -3.887 25487
1943 1 7 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.528 0.227 25487
1944 1 7 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.284 -5.440 25487
1945 1 7 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.797 15.683 25487
1946 1 7 . 1 1 42 42 CYS H H 42 8.712 8.712 8.854 -0.142 25487
1947 1 7 . 1 1 43 43 SER N N 43 117.527 117.527 115.547 1.980 25487
1948 1 7 . 1 1 43 43 SER HA H 43 5.220 5.220 5.330 -0.110 25487
1949 1 7 . 1 1 43 43 SER CA C 43 54.110 54.110 56.700 -2.590 25487
1950 1 7 . 1 1 43 43 SER CB C 43 64.091 64.091 66.178 -2.087 25487
1951 1 7 . 1 1 43 43 SER H H 43 8.828 8.828 9.208 -0.380 25487
1952 1 7 . 1 1 44 44 CYS N N 44 120.721 120.721 123.105 -2.384 25487
1953 1 7 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.652 0.561 25487
1954 1 7 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.932 -6.904 25487
1955 1 7 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.207 10.618 25487
1956 1 7 . 1 1 44 44 CYS H H 44 7.936 7.936 8.785 -0.849 25487
1957 1 7 . 1 1 45 45 GLN N N 45 124.614 124.614 124.974 -0.360 25487
1958 1 7 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.649 -0.005 25487
1959 1 7 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.795 -7.362 25487
1960 1 7 . 1 1 45 45 GLN H H 45 9.892 9.892 9.152 0.740 25487
1961 1 7 . 1 1 46 46 GLN N N 46 120.933 120.933 120.094 0.839 25487
1962 1 7 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.737 0.289 25487
1963 1 7 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.915 -4.250 25487
1964 1 7 . 1 1 46 46 GLN H H 46 8.849 8.849 8.561 0.288 25487
1965 1 7 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.536 -0.016 25487
1966 1 7 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.352 -1.946 25487
1967 1 7 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.700 -2.950 25487
1968 1 7 . 1 1 48 48 LYS N N 48 124.003 124.003 120.755 3.248 25487
1969 1 7 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.983 0.070 25487
1970 1 7 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.877 -3.293 25487
1971 1 7 . 1 1 48 48 LYS CB C 48 30.564 30.564 31.940 -1.376 25487
1972 1 7 . 1 1 48 48 LYS H H 48 8.931 8.931 8.802 0.129 25487
1973 1 7 . 1 1 49 49 SER N N 49 113.527 113.527 114.342 -0.815 25487
1974 1 7 . 1 1 49 49 SER HA H 49 3.995 3.995 4.206 -0.211 25487
1975 1 7 . 1 1 49 49 SER CA C 49 55.458 55.458 62.510 -7.052 25487
1976 1 7 . 1 1 49 49 SER CB C 49 61.270 61.270 62.480 -1.210 25487
1977 1 7 . 1 1 49 49 SER H H 49 8.702 8.702 8.212 0.490 25487
1978 1 7 . 1 1 50 50 HIS N N 50 119.669 119.669 121.247 -1.578 25487
1979 1 7 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.374 -0.047 25487
1980 1 7 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.855 -3.400 25487
1981 1 7 . 1 1 50 50 HIS H H 50 7.664 7.664 8.356 -0.692 25487
1982 1 7 . 1 1 51 51 LYS N N 51 120.030 120.030 119.614 0.416 25487
1983 1 7 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.179 -0.086 25487
1984 1 7 . 1 1 51 51 LYS CA C 51 56.752 56.752 58.718 -1.966 25487
1985 1 7 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.120 -1.739 25487
1986 1 7 . 1 1 51 51 LYS H H 51 7.825 7.825 8.203 -0.378 25487
1987 1 7 . 1 1 52 52 ILE N N 52 118.914 118.914 120.094 -1.180 25487
1988 1 7 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.640 0.081 25487
1989 1 7 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.248 -3.423 25487
1990 1 7 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.605 -2.599 25487
1991 1 7 . 1 1 52 52 ILE H H 52 8.223 8.223 8.020 0.203 25487
1992 1 7 . 1 1 53 53 ALA N N 53 120.985 120.985 121.577 -0.592 25487
1993 1 7 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.886 0.070 25487
1994 1 7 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.541 -2.398 25487
1995 1 7 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.738 -0.992 25487
1996 1 7 . 1 1 53 53 ALA H H 53 8.066 8.066 8.539 -0.473 25487
1997 1 7 . 1 1 54 54 GLU N N 54 115.137 115.137 118.195 -3.058 25487
1998 1 7 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.944 -0.011 25487
1999 1 7 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.511 -2.663 25487
2000 1 7 . 1 1 54 54 GLU H H 54 8.160 8.160 8.043 0.117 25487
2001 1 7 . 1 1 55 55 LYS N N 55 118.610 118.610 120.092 -1.482 25487
2002 1 7 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.096 0.060 25487
2003 1 7 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.019 -2.592 25487
2004 1 7 . 1 1 55 55 LYS H H 55 7.732 7.732 7.967 -0.235 25487
2005 1 7 . 1 1 56 56 ILE N N 56 119.173 119.173 121.147 -1.974 25487
2006 1 7 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.647 -0.020 25487
2007 1 7 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.652 -2.754 25487
2008 1 7 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.794 -2.651 25487
2009 1 7 . 1 1 56 56 ILE H H 56 8.022 8.022 8.174 -0.152 25487
2010 1 7 . 1 1 57 57 ILE N N 57 120.239 120.239 119.962 0.277 25487
2011 1 7 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.590 -0.002 25487
2012 1 7 . 1 1 57 57 ILE CA C 57 62.898 62.898 63.925 -1.026 25487
2013 1 7 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.141 -1.103 25487
2014 1 7 . 1 1 57 57 ILE H H 57 8.370 8.370 8.173 0.197 25487
2015 1 7 . 1 1 58 58 ASP N N 58 118.234 118.234 120.722 -2.488 25487
2016 1 7 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.362 0.050 25487
2017 1 7 . 1 1 58 58 ASP CA C 58 54.174 54.174 58.310 -4.136 25487
2018 1 7 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.580 -4.385 25487
2019 1 7 . 1 1 58 58 ASP H H 58 8.458 8.458 8.435 0.023 25487
2020 1 7 . 1 1 59 59 LYS N N 59 119.380 119.380 119.053 0.327 25487
2021 1 7 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.029 0.221 25487
2022 1 7 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.934 -4.003 25487
2023 1 7 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.436 -2.375 25487
2024 1 7 . 1 1 59 59 LYS H H 59 7.928 7.928 7.959 -0.031 25487
2025 1 7 . 1 1 60 60 ALA N N 60 123.604 123.604 122.087 1.517 25487
2026 1 7 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.042 -0.057 25487
2027 1 7 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.837 -2.024 25487
2028 1 7 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.900 -3.103 25487
2029 1 7 . 1 1 60 60 ALA H H 60 8.699 8.699 8.463 0.236 25487
2030 1 7 . 1 1 61 61 LYS N N 61 115.317 115.317 119.179 -3.862 25487
2031 1 7 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.041 -0.023 25487
2032 1 7 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.379 -1.594 25487
2033 1 7 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.564 -2.057 25487
2034 1 7 . 1 1 61 61 LYS H H 61 8.361 8.361 8.202 0.159 25487
2035 1 7 . 1 1 62 62 THR N N 62 107.298 107.298 109.562 -2.264 25487
2036 1 7 . 1 1 62 62 THR HA H 62 4.368 4.368 4.029 0.339 25487
2037 1 7 . 1 1 62 62 THR CA C 62 60.427 60.427 64.034 -3.607 25487
2038 1 7 . 1 1 62 62 THR CB C 62 67.179 67.179 67.253 -0.074 25487
2039 1 7 . 1 1 62 62 THR H H 62 7.510 7.510 8.501 -0.991 25487
2040 1 7 . 1 1 63 63 THR N N 63 115.701 115.701 114.499 1.202 25487
2041 1 7 . 1 1 63 63 THR HA H 63 4.328 4.328 4.328 0.000 25487
2042 1 7 . 1 1 63 63 THR CA C 63 61.695 61.695 63.708 -2.013 25487
2043 1 7 . 1 1 63 63 THR CB C 63 67.641 67.641 69.514 -1.873 25487
2044 1 7 . 1 1 63 63 THR H H 63 7.651 7.651 8.308 -0.657 25487
2045 1 8 . 1 1 2 2 LYS N N 2 121.111 121.111 120.407 0.704 25487
2046 1 8 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.555 -0.230 25487
2047 1 8 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.099 -2.436 25487
2048 1 8 . 1 1 2 2 LYS CB C 2 30.415 30.415 34.889 -4.474 25487
2049 1 8 . 1 1 2 2 LYS H H 2 8.492 8.492 8.762 -0.270 25487
2050 1 8 . 1 1 3 3 ALA N N 3 126.440 126.440 125.816 0.624 25487
2051 1 8 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.475 -0.050 25487
2052 1 8 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.947 -2.500 25487
2053 1 8 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.457 -2.553 25487
2054 1 8 . 1 1 3 3 ALA H H 3 8.357 8.357 8.390 -0.033 25487
2055 1 8 . 1 1 4 4 CYS N N 4 116.834 116.834 121.004 -4.170 25487
2056 1 8 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.614 0.289 25487
2057 1 8 . 1 1 4 4 CYS CA C 4 51.793 51.793 58.516 -6.723 25487
2058 1 8 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.221 12.073 25487
2059 1 8 . 1 1 4 4 CYS H H 4 8.145 8.145 8.507 -0.362 25487
2060 1 8 . 1 1 5 5 THR N N 5 121.220 121.220 119.775 1.445 25487
2061 1 8 . 1 1 5 5 THR HA H 5 4.481 4.481 4.571 -0.090 25487
2062 1 8 . 1 1 5 5 THR CA C 5 58.256 58.256 60.255 -1.999 25487
2063 1 8 . 1 1 5 5 THR CB C 5 67.043 67.043 69.425 -2.382 25487
2064 1 8 . 1 1 5 5 THR H H 5 9.070 9.070 8.537 0.533 25487
2065 1 8 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.325 -0.073 25487
2066 1 8 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.265 -3.026 25487
2067 1 8 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.315 -1.786 25487
2068 1 8 . 1 1 7 7 LEU N N 7 119.270 119.270 119.430 -0.160 25487
2069 1 8 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.898 -0.642 25487
2070 1 8 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.778 -1.718 25487
2071 1 8 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.315 -3.109 25487
2072 1 8 . 1 1 7 7 LEU H H 7 7.797 7.797 7.521 0.276 25487
2073 1 8 . 1 1 8 8 LEU N N 8 119.586 119.586 122.153 -2.567 25487
2074 1 8 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.043 -0.221 25487
2075 1 8 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.573 -0.650 25487
2076 1 8 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.373 -2.771 25487
2077 1 8 . 1 1 8 8 LEU H H 8 9.465 9.465 8.476 0.989 25487
2078 1 8 . 1 1 9 9 HIS N N 9 117.507 117.507 115.854 1.653 25487
2079 1 8 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.778 -0.032 25487
2080 1 8 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.595 -2.168 25487
2081 1 8 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.861 -6.753 25487
2082 1 8 . 1 1 9 9 HIS H H 9 8.159 8.159 7.671 0.488 25487
2083 1 8 . 1 1 10 10 ASP N N 10 119.492 119.492 121.004 -1.512 25487
2084 1 8 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.769 0.114 25487
2085 1 8 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.869 -3.531 25487
2086 1 8 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.759 -1.289 25487
2087 1 8 . 1 1 10 10 ASP H H 10 8.341 8.341 8.590 -0.249 25487
2088 1 8 . 1 1 11 11 CYS N N 11 121.767 121.767 120.494 1.273 25487
2089 1 8 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.905 0.224 25487
2090 1 8 . 1 1 11 11 CYS CA C 11 52.756 52.756 57.291 -4.535 25487
2091 1 8 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.679 13.557 25487
2092 1 8 . 1 1 11 11 CYS H H 11 8.017 8.017 8.292 -0.275 25487
2093 1 8 . 1 1 12 12 SER N N 12 118.618 118.618 118.943 -0.325 25487
2094 1 8 . 1 1 12 12 SER HA H 12 3.759 3.759 4.177 -0.418 25487
2095 1 8 . 1 1 12 12 SER CB C 12 59.972 59.972 63.065 -3.093 25487
2096 1 8 . 1 1 12 12 SER H H 12 8.844 8.844 8.431 0.413 25487
2097 1 8 . 1 1 13 13 HIS N N 13 117.166 117.166 116.460 0.706 25487
2098 1 8 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.680 -0.058 25487
2099 1 8 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.243 -4.790 25487
2100 1 8 . 1 1 13 13 HIS H H 13 8.547 8.547 8.187 0.360 25487
2101 1 8 . 1 1 14 14 ASP N N 14 117.382 117.382 118.751 -1.369 25487
2102 1 8 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.913 -0.222 25487
2103 1 8 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.438 -3.246 25487
2104 1 8 . 1 1 14 14 ASP CB C 14 36.424 36.424 43.179 -6.755 25487
2105 1 8 . 1 1 14 14 ASP H H 14 7.224 7.224 7.834 -0.610 25487
2106 1 8 . 1 1 15 15 ARG N N 15 124.498 124.498 122.882 1.616 25487
2107 1 8 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.311 0.406 25487
2108 1 8 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.599 -4.066 25487
2109 1 8 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.774 -0.382 25487
2110 1 8 . 1 1 15 15 ARG H H 15 9.004 9.004 8.635 0.369 25487
2111 1 8 . 1 1 16 16 HIS N N 16 116.269 116.269 114.865 1.404 25487
2112 1 8 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.783 0.285 25487
2113 1 8 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.834 -3.359 25487
2114 1 8 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.681 -4.005 25487
2115 1 8 . 1 1 16 16 HIS H H 16 8.528 8.528 8.415 0.113 25487
2116 1 8 . 1 1 17 17 SER N N 17 112.719 112.719 115.413 -2.694 25487
2117 1 8 . 1 1 17 17 SER HA H 17 4.493 4.493 4.475 0.018 25487
2118 1 8 . 1 1 17 17 SER CA C 17 56.591 56.591 59.470 -2.879 25487
2119 1 8 . 1 1 17 17 SER CB C 17 62.736 62.736 64.627 -1.891 25487
2120 1 8 . 1 1 17 17 SER H H 17 7.503 7.503 7.840 -0.337 25487
2121 1 8 . 1 1 18 18 CYS N N 18 122.070 122.070 120.673 1.397 25487
2122 1 8 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.560 0.514 25487
2123 1 8 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.191 -4.617 25487
2124 1 8 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.595 10.230 25487
2125 1 8 . 1 1 18 18 CYS H H 18 8.651 8.651 8.081 0.570 25487
2126 1 8 . 1 1 19 19 CYS N N 19 118.243 118.243 124.283 -6.040 25487
2127 1 8 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.514 0.006 25487
2128 1 8 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.964 -6.416 25487
2129 1 8 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.915 10.475 25487
2130 1 8 . 1 1 19 19 CYS H H 19 8.936 8.936 8.485 0.451 25487
2131 1 8 . 1 1 20 20 ARG N N 20 116.858 116.858 121.115 -4.257 25487
2132 1 8 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.189 -0.090 25487
2133 1 8 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.576 -3.571 25487
2134 1 8 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.426 -1.797 25487
2135 1 8 . 1 1 20 20 ARG H H 20 8.136 8.136 8.590 -0.454 25487
2136 1 8 . 1 1 21 21 GLY N N 21 110.611 110.611 107.972 2.639 25487
2137 1 8 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.851 -2.055 25487
2138 1 8 . 1 1 21 21 GLY H H 21 7.569 7.569 7.995 -0.426 25487
2139 1 8 . 1 1 22 22 ASP N N 22 121.161 121.161 121.286 -0.125 25487
2140 1 8 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.328 0.007 25487
2141 1 8 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.745 -3.082 25487
2142 1 8 . 1 1 22 22 ASP CB C 22 36.384 36.384 40.795 -4.411 25487
2143 1 8 . 1 1 22 22 ASP H H 22 8.674 8.674 8.639 0.035 25487
2144 1 8 . 1 1 23 23 MET N N 23 114.811 114.811 115.671 -0.860 25487
2145 1 8 . 1 1 23 23 MET HA H 23 4.218 4.218 4.061 0.157 25487
2146 1 8 . 1 1 23 23 MET CA C 23 53.190 53.190 56.369 -3.179 25487
2147 1 8 . 1 1 23 23 MET CB C 23 30.586 30.586 34.123 -3.537 25487
2148 1 8 . 1 1 23 23 MET H H 23 8.333 8.333 8.046 0.287 25487
2149 1 8 . 1 1 24 24 PHE N N 24 116.019 116.019 114.899 1.120 25487
2150 1 8 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.546 0.281 25487
2151 1 8 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.083 2.458 25487
2152 1 8 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.324 -2.528 25487
2153 1 8 . 1 1 24 24 PHE H H 24 7.821 7.821 7.292 0.529 25487
2154 1 8 . 1 1 25 25 LYS N N 25 123.768 123.768 121.554 2.214 25487
2155 1 8 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.168 -0.122 25487
2156 1 8 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.083 -1.445 25487
2157 1 8 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.698 -2.621 25487
2158 1 8 . 1 1 25 25 LYS H H 25 9.119 9.119 8.460 0.659 25487
2159 1 8 . 1 1 26 26 TYR N N 26 123.059 123.059 123.801 -0.742 25487
2160 1 8 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.592 0.407 25487
2161 1 8 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.264 -4.444 25487
2162 1 8 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.280 -4.539 25487
2163 1 8 . 1 1 26 26 TYR H H 26 7.884 7.884 7.504 0.380 25487
2164 1 8 . 1 1 27 27 VAL N N 27 116.468 116.468 118.883 -2.415 25487
2165 1 8 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.416 -0.045 25487
2166 1 8 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.766 -2.251 25487
2167 1 8 . 1 1 27 27 VAL CB C 27 31.945 31.945 36.933 -4.988 25487
2168 1 8 . 1 1 27 27 VAL H H 27 9.012 9.012 9.064 -0.052 25487
2169 1 8 . 1 1 28 28 CYS N N 28 124.932 124.932 122.684 2.248 25487
2170 1 8 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.729 0.025 25487
2171 1 8 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.004 -5.804 25487
2172 1 8 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.434 11.353 25487
2173 1 8 . 1 1 28 28 CYS H H 28 8.874 8.874 8.826 0.048 25487
2174 1 8 . 1 1 29 29 ASP N N 29 131.592 131.592 129.453 2.139 25487
2175 1 8 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.779 0.166 25487
2176 1 8 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.533 -3.477 25487
2177 1 8 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.099 -4.630 25487
2178 1 8 . 1 1 29 29 ASP H H 29 8.603 8.603 8.674 -0.071 25487
2179 1 8 . 1 1 30 30 CYS N N 30 122.694 122.694 121.581 1.113 25487
2180 1 8 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.865 0.938 25487
2181 1 8 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.314 -5.925 25487
2182 1 8 . 1 1 30 30 CYS CB C 30 43.933 43.933 28.922 15.011 25487
2183 1 8 . 1 1 30 30 CYS H H 30 8.480 8.480 8.461 0.019 25487
2184 1 8 . 1 1 31 31 PHE N N 31 121.135 121.135 119.463 1.672 25487
2185 1 8 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.518 0.269 25487
2186 1 8 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.311 -4.983 25487
2187 1 8 . 1 1 31 31 PHE H H 31 9.062 9.062 8.506 0.556 25487
2188 1 8 . 1 1 32 32 TYR N N 32 120.021 120.021 120.800 -0.779 25487
2189 1 8 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.978 0.012 25487
2190 1 8 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.421 -1.682 25487
2191 1 8 . 1 1 32 32 TYR CB C 32 35.482 35.482 37.665 -2.183 25487
2192 1 8 . 1 1 32 32 TYR H H 32 8.614 8.614 8.733 -0.119 25487
2193 1 8 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.326 0.174 25487
2194 1 8 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.157 -2.668 25487
2195 1 8 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.433 -0.780 25487
2196 1 8 . 1 1 34 34 GLU N N 34 119.222 119.222 119.382 -0.160 25487
2197 1 8 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.989 0.356 25487
2198 1 8 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.447 -3.751 25487
2199 1 8 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.832 -2.773 25487
2200 1 8 . 1 1 34 34 GLU H H 34 8.516 8.516 8.645 -0.129 25487
2201 1 8 . 1 1 35 35 GLY N N 35 109.836 109.836 105.664 4.172 25487
2202 1 8 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.228 -2.809 25487
2203 1 8 . 1 1 35 35 GLY H H 35 8.209 8.209 7.543 0.666 25487
2204 1 8 . 1 1 36 36 GLU N N 36 119.666 119.666 123.021 -3.355 25487
2205 1 8 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.082 0.143 25487
2206 1 8 . 1 1 36 36 GLU CA C 36 53.566 53.566 58.692 -5.126 25487
2207 1 8 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.779 -3.609 25487
2208 1 8 . 1 1 36 36 GLU H H 36 8.190 8.190 8.703 -0.513 25487
2209 1 8 . 1 1 37 37 ASP N N 37 117.788 117.788 116.534 1.254 25487
2210 1 8 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.682 -0.152 25487
2211 1 8 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.712 -3.877 25487
2212 1 8 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.189 -4.066 25487
2213 1 8 . 1 1 37 37 ASP H H 37 8.305 8.305 8.575 -0.270 25487
2214 1 8 . 1 1 38 38 LYS N N 38 119.545 119.545 118.736 0.809 25487
2215 1 8 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.552 -0.086 25487
2216 1 8 . 1 1 38 38 LYS CA C 38 53.348 53.348 57.114 -3.766 25487
2217 1 8 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.686 -4.072 25487
2218 1 8 . 1 1 38 38 LYS H H 38 7.950 7.950 7.679 0.271 25487
2219 1 8 . 1 1 39 39 THR N N 39 115.195 115.195 114.963 0.232 25487
2220 1 8 . 1 1 39 39 THR HA H 39 4.323 4.323 4.480 -0.157 25487
2221 1 8 . 1 1 39 39 THR CA C 39 59.508 59.508 62.140 -2.632 25487
2222 1 8 . 1 1 39 39 THR CB C 39 67.653 67.653 70.441 -2.788 25487
2223 1 8 . 1 1 39 39 THR H H 39 7.888 7.888 7.688 0.200 25487
2224 1 8 . 1 1 40 40 GLU N N 40 124.664 124.664 125.010 -0.346 25487
2225 1 8 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.749 -0.783 25487
2226 1 8 . 1 1 40 40 GLU CA C 40 53.029 53.029 54.830 -1.800 25487
2227 1 8 . 1 1 40 40 GLU CB C 40 26.467 26.467 31.433 -4.966 25487
2228 1 8 . 1 1 40 40 GLU H H 40 8.345 8.345 8.166 0.179 25487
2229 1 8 . 1 1 41 41 VAL N N 41 124.551 124.551 123.241 1.310 25487
2230 1 8 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.319 -0.218 25487
2231 1 8 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.819 -3.424 25487
2232 1 8 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.525 -2.630 25487
2233 1 8 . 1 1 41 41 VAL H H 41 8.377 8.377 8.461 -0.084 25487
2234 1 8 . 1 1 42 42 CYS N N 42 122.732 122.732 126.155 -3.423 25487
2235 1 8 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.499 0.256 25487
2236 1 8 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.358 -5.514 25487
2237 1 8 . 1 1 42 42 CYS CB C 42 46.480 46.480 29.610 16.869 25487
2238 1 8 . 1 1 42 42 CYS H H 42 8.712 8.712 9.116 -0.404 25487
2239 1 8 . 1 1 43 43 SER N N 43 117.527 117.527 117.117 0.410 25487
2240 1 8 . 1 1 43 43 SER HA H 43 5.220 5.220 5.453 -0.233 25487
2241 1 8 . 1 1 43 43 SER CA C 43 54.110 54.110 56.319 -2.209 25487
2242 1 8 . 1 1 43 43 SER CB C 43 64.091 64.091 66.395 -2.304 25487
2243 1 8 . 1 1 43 43 SER H H 43 8.828 8.828 9.099 -0.271 25487
2244 1 8 . 1 1 44 44 CYS N N 44 120.721 120.721 123.223 -2.502 25487
2245 1 8 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.898 0.315 25487
2246 1 8 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.787 -6.759 25487
2247 1 8 . 1 1 44 44 CYS CB C 44 36.825 36.825 25.310 11.515 25487
2248 1 8 . 1 1 44 44 CYS H H 44 7.936 7.936 8.732 -0.796 25487
2249 1 8 . 1 1 45 45 GLN N N 45 124.614 124.614 125.500 -0.886 25487
2250 1 8 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.695 -0.051 25487
2251 1 8 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.704 -7.271 25487
2252 1 8 . 1 1 45 45 GLN H H 45 9.892 9.892 9.199 0.693 25487
2253 1 8 . 1 1 46 46 GLN N N 46 120.933 120.933 119.963 0.970 25487
2254 1 8 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.676 0.350 25487
2255 1 8 . 1 1 46 46 GLN CB C 46 25.665 25.665 28.480 -2.815 25487
2256 1 8 . 1 1 46 46 GLN H H 46 8.849 8.849 8.507 0.342 25487
2257 1 8 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.601 -0.081 25487
2258 1 8 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.511 -2.104 25487
2259 1 8 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.823 -3.074 25487
2260 1 8 . 1 1 48 48 LYS N N 48 124.003 124.003 122.063 1.940 25487
2261 1 8 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.946 0.107 25487
2262 1 8 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.158 -3.574 25487
2263 1 8 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.254 -1.690 25487
2264 1 8 . 1 1 48 48 LYS H H 48 8.931 8.931 8.829 0.102 25487
2265 1 8 . 1 1 49 49 SER N N 49 113.527 113.527 114.638 -1.111 25487
2266 1 8 . 1 1 49 49 SER HA H 49 3.995 3.995 4.215 -0.220 25487
2267 1 8 . 1 1 49 49 SER CA C 49 55.458 55.458 62.082 -6.624 25487
2268 1 8 . 1 1 49 49 SER CB C 49 61.270 61.270 62.760 -1.490 25487
2269 1 8 . 1 1 49 49 SER H H 49 8.702 8.702 8.425 0.277 25487
2270 1 8 . 1 1 50 50 HIS N N 50 119.669 119.669 120.462 -0.793 25487
2271 1 8 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.378 -0.051 25487
2272 1 8 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.583 -3.128 25487
2273 1 8 . 1 1 50 50 HIS H H 50 7.664 7.664 7.705 -0.041 25487
2274 1 8 . 1 1 51 51 LYS N N 51 120.030 120.030 120.730 -0.700 25487
2275 1 8 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.073 0.020 25487
2276 1 8 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.450 -2.698 25487
2277 1 8 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.427 -2.046 25487
2278 1 8 . 1 1 51 51 LYS H H 51 7.825 7.825 8.091 -0.266 25487
2279 1 8 . 1 1 52 52 ILE N N 52 118.914 118.914 120.035 -1.121 25487
2280 1 8 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.768 -0.047 25487
2281 1 8 . 1 1 52 52 ILE CA C 52 61.825 61.825 63.880 -2.055 25487
2282 1 8 . 1 1 52 52 ILE CB C 52 35.006 35.006 36.846 -1.839 25487
2283 1 8 . 1 1 52 52 ILE H H 52 8.223 8.223 8.025 0.198 25487
2284 1 8 . 1 1 53 53 ALA N N 53 120.985 120.985 122.337 -1.352 25487
2285 1 8 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.935 0.021 25487
2286 1 8 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.760 -2.617 25487
2287 1 8 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.942 -1.196 25487
2288 1 8 . 1 1 53 53 ALA H H 53 8.066 8.066 8.246 -0.180 25487
2289 1 8 . 1 1 54 54 GLU N N 54 115.137 115.137 118.336 -3.199 25487
2290 1 8 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.994 -0.061 25487
2291 1 8 . 1 1 54 54 GLU CB C 54 26.848 26.848 28.881 -2.033 25487
2292 1 8 . 1 1 54 54 GLU H H 54 8.160 8.160 8.087 0.073 25487
2293 1 8 . 1 1 55 55 LYS N N 55 118.610 118.610 119.954 -1.344 25487
2294 1 8 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.058 0.098 25487
2295 1 8 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.533 -3.106 25487
2296 1 8 . 1 1 55 55 LYS H H 55 7.732 7.732 7.855 -0.123 25487
2297 1 8 . 1 1 56 56 ILE N N 56 119.173 119.173 120.815 -1.642 25487
2298 1 8 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.594 0.033 25487
2299 1 8 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.557 -2.659 25487
2300 1 8 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.745 -2.602 25487
2301 1 8 . 1 1 56 56 ILE H H 56 8.022 8.022 8.010 0.012 25487
2302 1 8 . 1 1 57 57 ILE N N 57 120.239 120.239 119.887 0.352 25487
2303 1 8 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.558 0.030 25487
2304 1 8 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.382 -1.484 25487
2305 1 8 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.116 -1.079 25487
2306 1 8 . 1 1 57 57 ILE H H 57 8.370 8.370 8.216 0.154 25487
2307 1 8 . 1 1 58 58 ASP N N 58 118.234 118.234 120.399 -2.165 25487
2308 1 8 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.313 0.099 25487
2309 1 8 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.655 -3.481 25487
2310 1 8 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.151 -3.957 25487
2311 1 8 . 1 1 58 58 ASP H H 58 8.458 8.458 8.480 -0.022 25487
2312 1 8 . 1 1 59 59 LYS N N 59 119.380 119.380 119.974 -0.594 25487
2313 1 8 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.003 0.247 25487
2314 1 8 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.014 -4.083 25487
2315 1 8 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.326 -2.265 25487
2316 1 8 . 1 1 59 59 LYS H H 59 7.928 7.928 8.157 -0.229 25487
2317 1 8 . 1 1 60 60 ALA N N 60 123.604 123.604 122.550 1.054 25487
2318 1 8 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.092 -0.107 25487
2319 1 8 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.381 -2.568 25487
2320 1 8 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.327 -2.530 25487
2321 1 8 . 1 1 60 60 ALA H H 60 8.699 8.699 8.266 0.433 25487
2322 1 8 . 1 1 61 61 LYS N N 61 115.317 115.317 117.737 -2.420 25487
2323 1 8 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.174 -0.156 25487
2324 1 8 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.173 -1.388 25487
2325 1 8 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.093 -1.586 25487
2326 1 8 . 1 1 61 61 LYS H H 61 8.361 8.361 8.252 0.109 25487
2327 1 8 . 1 1 62 62 THR N N 62 107.298 107.298 113.927 -6.629 25487
2328 1 8 . 1 1 62 62 THR HA H 62 4.368 4.368 4.206 0.162 25487
2329 1 8 . 1 1 62 62 THR CA C 62 60.427 60.427 65.193 -4.766 25487
2330 1 8 . 1 1 62 62 THR CB C 62 67.179 67.179 69.182 -2.003 25487
2331 1 8 . 1 1 62 62 THR H H 62 7.510 7.510 8.125 -0.615 25487
2332 1 8 . 1 1 63 63 THR N N 63 115.701 115.701 115.112 0.589 25487
2333 1 8 . 1 1 63 63 THR HA H 63 4.328 4.328 4.310 0.018 25487
2334 1 8 . 1 1 63 63 THR CA C 63 61.695 61.695 64.391 -2.696 25487
2335 1 8 . 1 1 63 63 THR CB C 63 67.641 67.641 69.799 -2.158 25487
2336 1 8 . 1 1 63 63 THR H H 63 7.651 7.651 7.767 -0.116 25487
2337 1 9 . 1 1 2 2 LYS N N 2 121.111 121.111 119.936 1.175 25487
2338 1 9 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.417 -0.092 25487
2339 1 9 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.145 -2.482 25487
2340 1 9 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.947 -2.532 25487
2341 1 9 . 1 1 2 2 LYS H H 2 8.492 8.492 8.345 0.147 25487
2342 1 9 . 1 1 3 3 ALA N N 3 126.440 126.440 123.102 3.338 25487
2343 1 9 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.438 -0.013 25487
2344 1 9 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.060 -2.613 25487
2345 1 9 . 1 1 3 3 ALA CB C 3 16.905 16.905 18.085 -1.180 25487
2346 1 9 . 1 1 3 3 ALA H H 3 8.357 8.357 7.868 0.489 25487
2347 1 9 . 1 1 4 4 CYS N N 4 116.834 116.834 115.540 1.294 25487
2348 1 9 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.655 0.248 25487
2349 1 9 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.421 -4.628 25487
2350 1 9 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.857 10.437 25487
2351 1 9 . 1 1 4 4 CYS H H 4 8.145 8.145 7.242 0.903 25487
2352 1 9 . 1 1 5 5 THR N N 5 121.220 121.220 117.838 3.382 25487
2353 1 9 . 1 1 5 5 THR HA H 5 4.481 4.481 4.882 -0.401 25487
2354 1 9 . 1 1 5 5 THR CA C 5 58.256 58.256 60.787 -2.531 25487
2355 1 9 . 1 1 5 5 THR CB C 5 67.043 67.043 68.348 -1.305 25487
2356 1 9 . 1 1 5 5 THR H H 5 9.070 9.070 8.541 0.529 25487
2357 1 9 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.478 -0.226 25487
2358 1 9 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.288 -3.050 25487
2359 1 9 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.379 -1.850 25487
2360 1 9 . 1 1 7 7 LEU N N 7 119.270 119.270 120.125 -0.855 25487
2361 1 9 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.866 -0.610 25487
2362 1 9 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.054 -0.994 25487
2363 1 9 . 1 1 7 7 LEU CB C 7 39.206 39.206 41.921 -2.715 25487
2364 1 9 . 1 1 7 7 LEU H H 7 7.797 7.797 7.913 -0.116 25487
2365 1 9 . 1 1 8 8 LEU N N 8 119.586 119.586 123.957 -4.371 25487
2366 1 9 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.994 -0.172 25487
2367 1 9 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.881 -0.958 25487
2368 1 9 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.625 -3.023 25487
2369 1 9 . 1 1 8 8 LEU H H 8 9.465 9.465 8.381 1.084 25487
2370 1 9 . 1 1 9 9 HIS N N 9 117.507 117.507 115.152 2.355 25487
2371 1 9 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.759 -0.013 25487
2372 1 9 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.229 -1.802 25487
2373 1 9 . 1 1 9 9 HIS CB C 9 27.108 27.108 34.171 -7.063 25487
2374 1 9 . 1 1 9 9 HIS H H 9 8.159 8.159 7.765 0.394 25487
2375 1 9 . 1 1 10 10 ASP N N 10 119.492 119.492 121.429 -1.937 25487
2376 1 9 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.629 0.254 25487
2377 1 9 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.706 -3.368 25487
2378 1 9 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.298 -0.828 25487
2379 1 9 . 1 1 10 10 ASP H H 10 8.341 8.341 8.602 -0.261 25487
2380 1 9 . 1 1 11 11 CYS N N 11 121.767 121.767 119.987 1.780 25487
2381 1 9 . 1 1 11 11 CYS HA H 11 5.129 5.129 5.127 0.002 25487
2382 1 9 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.838 -4.082 25487
2383 1 9 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.003 14.233 25487
2384 1 9 . 1 1 11 11 CYS H H 11 8.017 8.017 8.367 -0.350 25487
2385 1 9 . 1 1 12 12 SER N N 12 118.618 118.618 119.766 -1.148 25487
2386 1 9 . 1 1 12 12 SER HA H 12 3.759 3.759 4.103 -0.344 25487
2387 1 9 . 1 1 12 12 SER CB C 12 59.972 59.972 63.059 -3.087 25487
2388 1 9 . 1 1 12 12 SER H H 12 8.844 8.844 8.540 0.304 25487
2389 1 9 . 1 1 13 13 HIS N N 13 117.166 117.166 115.719 1.447 25487
2390 1 9 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.789 -0.167 25487
2391 1 9 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.943 -4.490 25487
2392 1 9 . 1 1 13 13 HIS H H 13 8.547 8.547 8.377 0.170 25487
2393 1 9 . 1 1 14 14 ASP N N 14 117.382 117.382 119.325 -1.943 25487
2394 1 9 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.863 -0.172 25487
2395 1 9 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.849 -2.658 25487
2396 1 9 . 1 1 14 14 ASP CB C 14 36.424 36.424 41.408 -4.984 25487
2397 1 9 . 1 1 14 14 ASP H H 14 7.224 7.224 7.877 -0.653 25487
2398 1 9 . 1 1 15 15 ARG N N 15 124.498 124.498 121.260 3.238 25487
2399 1 9 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.059 0.658 25487
2400 1 9 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.707 -5.174 25487
2401 1 9 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.556 -0.164 25487
2402 1 9 . 1 1 15 15 ARG H H 15 9.004 9.004 8.357 0.647 25487
2403 1 9 . 1 1 16 16 HIS N N 16 116.269 116.269 117.206 -0.937 25487
2404 1 9 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.841 0.227 25487
2405 1 9 . 1 1 16 16 HIS CA C 16 52.475 52.475 56.040 -3.565 25487
2406 1 9 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.163 -3.487 25487
2407 1 9 . 1 1 16 16 HIS H H 16 8.528 8.528 8.409 0.119 25487
2408 1 9 . 1 1 17 17 SER N N 17 112.719 112.719 115.585 -2.866 25487
2409 1 9 . 1 1 17 17 SER HA H 17 4.493 4.493 4.529 -0.036 25487
2410 1 9 . 1 1 17 17 SER CA C 17 56.591 56.591 59.343 -2.752 25487
2411 1 9 . 1 1 17 17 SER CB C 17 62.736 62.736 63.781 -1.045 25487
2412 1 9 . 1 1 17 17 SER H H 17 7.503 7.503 8.271 -0.768 25487
2413 1 9 . 1 1 18 18 CYS N N 18 122.070 122.070 120.128 1.942 25487
2414 1 9 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.430 0.644 25487
2415 1 9 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.056 -5.482 25487
2416 1 9 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.444 9.381 25487
2417 1 9 . 1 1 18 18 CYS H H 18 8.651 8.651 7.607 1.044 25487
2418 1 9 . 1 1 19 19 CYS N N 19 118.243 118.243 122.208 -3.965 25487
2419 1 9 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.441 0.079 25487
2420 1 9 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.373 -6.825 25487
2421 1 9 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.855 11.535 25487
2422 1 9 . 1 1 19 19 CYS H H 19 8.936 8.936 8.300 0.636 25487
2423 1 9 . 1 1 20 20 ARG N N 20 116.858 116.858 123.163 -6.305 25487
2424 1 9 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.061 0.038 25487
2425 1 9 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.606 -3.601 25487
2426 1 9 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.121 -1.492 25487
2427 1 9 . 1 1 20 20 ARG H H 20 8.136 8.136 8.404 -0.268 25487
2428 1 9 . 1 1 21 21 GLY N N 21 110.611 110.611 108.967 1.644 25487
2429 1 9 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.413 -1.617 25487
2430 1 9 . 1 1 21 21 GLY H H 21 7.569 7.569 7.942 -0.373 25487
2431 1 9 . 1 1 22 22 ASP N N 22 121.161 121.161 118.120 3.041 25487
2432 1 9 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.504 -0.169 25487
2433 1 9 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.351 -2.688 25487
2434 1 9 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.137 -4.753 25487
2435 1 9 . 1 1 22 22 ASP H H 22 8.674 8.674 8.676 -0.002 25487
2436 1 9 . 1 1 23 23 MET N N 23 114.811 114.811 117.575 -2.764 25487
2437 1 9 . 1 1 23 23 MET HA H 23 4.218 4.218 4.272 -0.054 25487
2438 1 9 . 1 1 23 23 MET CA C 23 53.190 53.190 56.377 -3.187 25487
2439 1 9 . 1 1 23 23 MET CB C 23 30.586 30.586 35.206 -4.620 25487
2440 1 9 . 1 1 23 23 MET H H 23 8.333 8.333 7.683 0.650 25487
2441 1 9 . 1 1 24 24 PHE N N 24 116.019 116.019 116.005 0.014 25487
2442 1 9 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.856 -0.029 25487
2443 1 9 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.428 2.113 25487
2444 1 9 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.810 -3.014 25487
2445 1 9 . 1 1 24 24 PHE H H 24 7.821 7.821 7.870 -0.049 25487
2446 1 9 . 1 1 25 25 LYS N N 25 123.768 123.768 120.288 3.480 25487
2447 1 9 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.868 0.178 25487
2448 1 9 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.845 -2.207 25487
2449 1 9 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.930 -1.853 25487
2450 1 9 . 1 1 25 25 LYS H H 25 9.119 9.119 8.250 0.869 25487
2451 1 9 . 1 1 26 26 TYR N N 26 123.059 123.059 117.842 5.217 25487
2452 1 9 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.431 0.568 25487
2453 1 9 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.477 -3.657 25487
2454 1 9 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.682 -4.941 25487
2455 1 9 . 1 1 26 26 TYR H H 26 7.884 7.884 7.532 0.352 25487
2456 1 9 . 1 1 27 27 VAL N N 27 116.468 116.468 114.973 1.495 25487
2457 1 9 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.594 -0.223 25487
2458 1 9 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.220 -1.705 25487
2459 1 9 . 1 1 27 27 VAL CB C 27 31.945 31.945 33.559 -1.614 25487
2460 1 9 . 1 1 27 27 VAL H H 27 9.012 9.012 8.918 0.094 25487
2461 1 9 . 1 1 28 28 CYS N N 28 124.932 124.932 125.693 -0.761 25487
2462 1 9 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.598 0.156 25487
2463 1 9 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.336 -6.136 25487
2464 1 9 . 1 1 28 28 CYS CB C 28 37.787 37.787 27.491 10.296 25487
2465 1 9 . 1 1 28 28 CYS H H 28 8.874 8.874 8.825 0.049 25487
2466 1 9 . 1 1 29 29 ASP N N 29 131.592 131.592 128.355 3.237 25487
2467 1 9 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.797 0.148 25487
2468 1 9 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.526 -3.470 25487
2469 1 9 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.562 -6.093 25487
2470 1 9 . 1 1 29 29 ASP H H 29 8.603 8.603 8.575 0.028 25487
2471 1 9 . 1 1 30 30 CYS N N 30 122.694 122.694 120.631 2.063 25487
2472 1 9 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.780 1.023 25487
2473 1 9 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.045 -5.657 25487
2474 1 9 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.642 14.291 25487
2475 1 9 . 1 1 30 30 CYS H H 30 8.480 8.480 8.463 0.017 25487
2476 1 9 . 1 1 31 31 PHE N N 31 121.135 121.135 119.389 1.746 25487
2477 1 9 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.460 0.327 25487
2478 1 9 . 1 1 31 31 PHE CB C 31 38.328 38.328 42.967 -4.639 25487
2479 1 9 . 1 1 31 31 PHE H H 31 9.062 9.062 8.414 0.648 25487
2480 1 9 . 1 1 32 32 TYR N N 32 120.021 120.021 118.598 1.423 25487
2481 1 9 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.939 0.051 25487
2482 1 9 . 1 1 32 32 TYR CA C 32 52.739 52.739 55.032 -2.292 25487
2483 1 9 . 1 1 32 32 TYR CB C 32 35.482 35.482 38.225 -2.743 25487
2484 1 9 . 1 1 32 32 TYR H H 32 8.614 8.614 8.656 -0.042 25487
2485 1 9 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.400 0.100 25487
2486 1 9 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.183 -2.694 25487
2487 1 9 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.411 -0.758 25487
2488 1 9 . 1 1 34 34 GLU N N 34 119.222 119.222 118.998 0.224 25487
2489 1 9 . 1 1 34 34 GLU HA H 34 4.345 4.345 4.051 0.294 25487
2490 1 9 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.310 -3.613 25487
2491 1 9 . 1 1 34 34 GLU CB C 34 26.059 26.059 27.720 -1.661 25487
2492 1 9 . 1 1 34 34 GLU H H 34 8.516 8.516 8.561 -0.045 25487
2493 1 9 . 1 1 35 35 GLY N N 35 109.836 109.836 105.923 3.913 25487
2494 1 9 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.309 -2.890 25487
2495 1 9 . 1 1 35 35 GLY H H 35 8.209 8.209 7.735 0.474 25487
2496 1 9 . 1 1 36 36 GLU N N 36 119.666 119.666 121.286 -1.620 25487
2497 1 9 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.140 0.085 25487
2498 1 9 . 1 1 36 36 GLU CA C 36 53.566 53.566 58.115 -4.549 25487
2499 1 9 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.021 -2.852 25487
2500 1 9 . 1 1 36 36 GLU H H 36 8.190 8.190 8.388 -0.198 25487
2501 1 9 . 1 1 37 37 ASP N N 37 117.788 117.788 117.463 0.325 25487
2502 1 9 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.586 -0.056 25487
2503 1 9 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.286 -3.452 25487
2504 1 9 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.428 -4.305 25487
2505 1 9 . 1 1 37 37 ASP H H 37 8.305 8.305 8.462 -0.157 25487
2506 1 9 . 1 1 38 38 LYS N N 38 119.545 119.545 118.896 0.649 25487
2507 1 9 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.552 -0.086 25487
2508 1 9 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.956 -3.608 25487
2509 1 9 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.645 -4.030 25487
2510 1 9 . 1 1 38 38 LYS H H 38 7.950 7.950 7.639 0.311 25487
2511 1 9 . 1 1 39 39 THR N N 39 115.195 115.195 114.836 0.359 25487
2512 1 9 . 1 1 39 39 THR HA H 39 4.323 4.323 4.492 -0.169 25487
2513 1 9 . 1 1 39 39 THR CA C 39 59.508 59.508 61.786 -2.278 25487
2514 1 9 . 1 1 39 39 THR CB C 39 67.653 67.653 69.940 -2.287 25487
2515 1 9 . 1 1 39 39 THR H H 39 7.888 7.888 7.927 -0.039 25487
2516 1 9 . 1 1 40 40 GLU N N 40 124.664 124.664 127.006 -2.342 25487
2517 1 9 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.553 -0.587 25487
2518 1 9 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.512 -2.483 25487
2519 1 9 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.264 -3.797 25487
2520 1 9 . 1 1 40 40 GLU H H 40 8.345 8.345 8.411 -0.066 25487
2521 1 9 . 1 1 41 41 VAL N N 41 124.551 124.551 123.746 0.805 25487
2522 1 9 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.290 -0.189 25487
2523 1 9 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.587 -3.192 25487
2524 1 9 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.636 -1.742 25487
2525 1 9 . 1 1 41 41 VAL H H 41 8.377 8.377 8.350 0.027 25487
2526 1 9 . 1 1 42 42 CYS N N 42 122.732 122.732 126.190 -3.458 25487
2527 1 9 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.541 0.214 25487
2528 1 9 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.276 -5.432 25487
2529 1 9 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.786 15.694 25487
2530 1 9 . 1 1 42 42 CYS H H 42 8.712 8.712 9.029 -0.317 25487
2531 1 9 . 1 1 43 43 SER N N 43 117.527 117.527 115.771 1.756 25487
2532 1 9 . 1 1 43 43 SER HA H 43 5.220 5.220 5.366 -0.146 25487
2533 1 9 . 1 1 43 43 SER CA C 43 54.110 54.110 56.497 -2.387 25487
2534 1 9 . 1 1 43 43 SER CB C 43 64.091 64.091 66.194 -2.103 25487
2535 1 9 . 1 1 43 43 SER H H 43 8.828 8.828 9.220 -0.392 25487
2536 1 9 . 1 1 44 44 CYS N N 44 120.721 120.721 122.553 -1.832 25487
2537 1 9 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.405 0.808 25487
2538 1 9 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.172 -7.144 25487
2539 1 9 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.271 10.554 25487
2540 1 9 . 1 1 44 44 CYS H H 44 7.936 7.936 8.764 -0.828 25487
2541 1 9 . 1 1 45 45 GLN N N 45 124.614 124.614 124.705 -0.091 25487
2542 1 9 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.636 0.008 25487
2543 1 9 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.669 -7.236 25487
2544 1 9 . 1 1 45 45 GLN H H 45 9.892 9.892 9.079 0.813 25487
2545 1 9 . 1 1 46 46 GLN N N 46 120.933 120.933 119.552 1.381 25487
2546 1 9 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.665 0.361 25487
2547 1 9 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.045 -3.380 25487
2548 1 9 . 1 1 46 46 GLN H H 46 8.849 8.849 8.643 0.206 25487
2549 1 9 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.562 -0.042 25487
2550 1 9 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.325 -1.918 25487
2551 1 9 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.959 -3.210 25487
2552 1 9 . 1 1 48 48 LYS N N 48 124.003 124.003 120.234 3.769 25487
2553 1 9 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.992 0.061 25487
2554 1 9 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.128 -3.544 25487
2555 1 9 . 1 1 48 48 LYS CB C 48 30.564 30.564 31.905 -1.341 25487
2556 1 9 . 1 1 48 48 LYS H H 48 8.931 8.931 8.719 0.212 25487
2557 1 9 . 1 1 49 49 SER N N 49 113.527 113.527 114.392 -0.865 25487
2558 1 9 . 1 1 49 49 SER HA H 49 3.995 3.995 4.203 -0.208 25487
2559 1 9 . 1 1 49 49 SER CA C 49 55.458 55.458 61.242 -5.784 25487
2560 1 9 . 1 1 49 49 SER CB C 49 61.270 61.270 62.281 -1.011 25487
2561 1 9 . 1 1 49 49 SER H H 49 8.702 8.702 8.202 0.500 25487
2562 1 9 . 1 1 50 50 HIS N N 50 119.669 119.669 120.762 -1.093 25487
2563 1 9 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.423 -0.096 25487
2564 1 9 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.927 -3.471 25487
2565 1 9 . 1 1 50 50 HIS H H 50 7.664 7.664 8.491 -0.827 25487
2566 1 9 . 1 1 51 51 LYS N N 51 120.030 120.030 119.963 0.067 25487
2567 1 9 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.056 0.037 25487
2568 1 9 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.950 -3.198 25487
2569 1 9 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.574 -2.193 25487
2570 1 9 . 1 1 51 51 LYS H H 51 7.825 7.825 8.209 -0.384 25487
2571 1 9 . 1 1 52 52 ILE N N 52 118.914 118.914 119.933 -1.019 25487
2572 1 9 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.621 0.100 25487
2573 1 9 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.117 -3.292 25487
2574 1 9 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.671 -2.665 25487
2575 1 9 . 1 1 52 52 ILE H H 52 8.223 8.223 8.019 0.204 25487
2576 1 9 . 1 1 53 53 ALA N N 53 120.985 120.985 121.978 -0.993 25487
2577 1 9 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.814 0.142 25487
2578 1 9 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.803 -2.660 25487
2579 1 9 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.904 -1.158 25487
2580 1 9 . 1 1 53 53 ALA H H 53 8.066 8.066 8.581 -0.515 25487
2581 1 9 . 1 1 54 54 GLU N N 54 115.137 115.137 118.447 -3.310 25487
2582 1 9 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.958 -0.025 25487
2583 1 9 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.503 -2.655 25487
2584 1 9 . 1 1 54 54 GLU H H 54 8.160 8.160 8.123 0.037 25487
2585 1 9 . 1 1 55 55 LYS N N 55 118.610 118.610 120.117 -1.507 25487
2586 1 9 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.071 0.085 25487
2587 1 9 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.429 -3.002 25487
2588 1 9 . 1 1 55 55 LYS H H 55 7.732 7.732 7.988 -0.256 25487
2589 1 9 . 1 1 56 56 ILE N N 56 119.173 119.173 120.099 -0.926 25487
2590 1 9 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.730 -0.103 25487
2591 1 9 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.189 -1.291 25487
2592 1 9 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.015 -1.872 25487
2593 1 9 . 1 1 56 56 ILE H H 56 8.022 8.022 8.042 -0.020 25487
2594 1 9 . 1 1 57 57 ILE N N 57 120.239 120.239 120.787 -0.548 25487
2595 1 9 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.488 0.100 25487
2596 1 9 . 1 1 57 57 ILE CA C 57 62.898 62.898 66.188 -3.290 25487
2597 1 9 . 1 1 57 57 ILE CB C 57 35.037 35.037 37.401 -2.364 25487
2598 1 9 . 1 1 57 57 ILE H H 57 8.370 8.370 8.337 0.033 25487
2599 1 9 . 1 1 58 58 ASP N N 58 118.234 118.234 120.706 -2.472 25487
2600 1 9 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.349 0.063 25487
2601 1 9 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.655 -3.481 25487
2602 1 9 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.168 -3.973 25487
2603 1 9 . 1 1 58 58 ASP H H 58 8.458 8.458 8.442 0.016 25487
2604 1 9 . 1 1 59 59 LYS N N 59 119.380 119.380 118.796 0.584 25487
2605 1 9 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.103 0.147 25487
2606 1 9 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.485 -3.554 25487
2607 1 9 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.378 -2.317 25487
2608 1 9 . 1 1 59 59 LYS H H 59 7.928 7.928 8.095 -0.167 25487
2609 1 9 . 1 1 60 60 ALA N N 60 123.604 123.604 122.135 1.469 25487
2610 1 9 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.158 -0.173 25487
2611 1 9 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.671 -1.858 25487
2612 1 9 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.924 -3.127 25487
2613 1 9 . 1 1 60 60 ALA H H 60 8.699 8.699 8.103 0.596 25487
2614 1 9 . 1 1 61 61 LYS N N 61 115.317 115.317 117.990 -2.673 25487
2615 1 9 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.103 -0.085 25487
2616 1 9 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.526 -1.741 25487
2617 1 9 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.779 -2.272 25487
2618 1 9 . 1 1 61 61 LYS H H 61 8.361 8.361 8.242 0.119 25487
2619 1 9 . 1 1 62 62 THR N N 62 107.298 107.298 109.594 -2.296 25487
2620 1 9 . 1 1 62 62 THR HA H 62 4.368 4.368 4.043 0.325 25487
2621 1 9 . 1 1 62 62 THR CA C 62 60.427 60.427 64.296 -3.869 25487
2622 1 9 . 1 1 62 62 THR CB C 62 67.179 67.179 66.615 0.564 25487
2623 1 9 . 1 1 62 62 THR H H 62 7.510 7.510 8.613 -1.103 25487
2624 1 9 . 1 1 63 63 THR N N 63 115.701 115.701 113.616 2.085 25487
2625 1 9 . 1 1 63 63 THR HA H 63 4.328 4.328 4.280 0.048 25487
2626 1 9 . 1 1 63 63 THR CA C 63 61.695 61.695 63.643 -1.948 25487
2627 1 9 . 1 1 63 63 THR CB C 63 67.641 67.641 69.397 -1.756 25487
2628 1 9 . 1 1 63 63 THR H H 63 7.651 7.651 8.385 -0.734 25487
2629 1 10 . 1 1 2 2 LYS N N 2 121.111 121.111 119.781 1.330 25487
2630 1 10 . 1 1 2 2 LYS HA H 2 4.325 4.325 3.941 0.384 25487
2631 1 10 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.548 -2.885 25487
2632 1 10 . 1 1 2 2 LYS CB C 2 30.415 30.415 31.171 -0.755 25487
2633 1 10 . 1 1 2 2 LYS H H 2 8.492 8.492 8.422 0.070 25487
2634 1 10 . 1 1 3 3 ALA N N 3 126.440 126.440 121.407 5.033 25487
2635 1 10 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.351 0.074 25487
2636 1 10 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.419 -2.972 25487
2637 1 10 . 1 1 3 3 ALA CB C 3 16.905 16.905 18.805 -1.901 25487
2638 1 10 . 1 1 3 3 ALA H H 3 8.357 8.357 7.915 0.442 25487
2639 1 10 . 1 1 4 4 CYS N N 4 116.834 116.834 115.483 1.351 25487
2640 1 10 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.662 0.241 25487
2641 1 10 . 1 1 4 4 CYS CA C 4 51.793 51.793 55.680 -3.887 25487
2642 1 10 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.245 11.049 25487
2643 1 10 . 1 1 4 4 CYS H H 4 8.145 8.145 7.496 0.649 25487
2644 1 10 . 1 1 5 5 THR N N 5 121.220 121.220 117.995 3.225 25487
2645 1 10 . 1 1 5 5 THR HA H 5 4.481 4.481 4.780 -0.299 25487
2646 1 10 . 1 1 5 5 THR CA C 5 58.256 58.256 60.074 -1.818 25487
2647 1 10 . 1 1 5 5 THR CB C 5 67.043 67.043 68.487 -1.444 25487
2648 1 10 . 1 1 5 5 THR H H 5 9.070 9.070 8.629 0.441 25487
2649 1 10 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.447 -0.195 25487
2650 1 10 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.325 -3.086 25487
2651 1 10 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.345 -1.816 25487
2652 1 10 . 1 1 7 7 LEU N N 7 119.270 119.270 120.127 -0.857 25487
2653 1 10 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.914 -0.658 25487
2654 1 10 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.328 -1.268 25487
2655 1 10 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.248 -3.042 25487
2656 1 10 . 1 1 7 7 LEU H H 7 7.797 7.797 7.975 -0.178 25487
2657 1 10 . 1 1 8 8 LEU N N 8 119.586 119.586 121.571 -1.985 25487
2658 1 10 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.895 -0.073 25487
2659 1 10 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.779 -0.856 25487
2660 1 10 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.512 -2.910 25487
2661 1 10 . 1 1 8 8 LEU H H 8 9.465 9.465 8.729 0.736 25487
2662 1 10 . 1 1 9 9 HIS N N 9 117.507 117.507 116.149 1.358 25487
2663 1 10 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.694 0.052 25487
2664 1 10 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.457 -2.030 25487
2665 1 10 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.929 -6.821 25487
2666 1 10 . 1 1 9 9 HIS H H 9 8.159 8.159 7.908 0.251 25487
2667 1 10 . 1 1 10 10 ASP N N 10 119.492 119.492 121.612 -2.120 25487
2668 1 10 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.658 0.225 25487
2669 1 10 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.556 -3.217 25487
2670 1 10 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.580 -1.110 25487
2671 1 10 . 1 1 10 10 ASP H H 10 8.341 8.341 8.606 -0.265 25487
2672 1 10 . 1 1 11 11 CYS N N 11 121.767 121.767 121.412 0.355 25487
2673 1 10 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.859 0.270 25487
2674 1 10 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.786 -4.030 25487
2675 1 10 . 1 1 11 11 CYS CB C 11 42.236 42.236 27.756 14.479 25487
2676 1 10 . 1 1 11 11 CYS H H 11 8.017 8.017 8.438 -0.421 25487
2677 1 10 . 1 1 12 12 SER N N 12 118.618 118.618 119.800 -1.182 25487
2678 1 10 . 1 1 12 12 SER HA H 12 3.759 3.759 4.100 -0.341 25487
2679 1 10 . 1 1 12 12 SER CB C 12 59.972 59.972 62.901 -2.929 25487
2680 1 10 . 1 1 12 12 SER H H 12 8.844 8.844 8.505 0.339 25487
2681 1 10 . 1 1 13 13 HIS N N 13 117.166 117.166 116.954 0.212 25487
2682 1 10 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.763 -0.141 25487
2683 1 10 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.858 -4.405 25487
2684 1 10 . 1 1 13 13 HIS H H 13 8.547 8.547 8.302 0.245 25487
2685 1 10 . 1 1 14 14 ASP N N 14 117.382 117.382 119.792 -2.410 25487
2686 1 10 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.947 -0.256 25487
2687 1 10 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.745 -2.553 25487
2688 1 10 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.007 -5.583 25487
2689 1 10 . 1 1 14 14 ASP H H 14 7.224 7.224 7.800 -0.576 25487
2690 1 10 . 1 1 15 15 ARG N N 15 124.498 124.498 121.526 2.972 25487
2691 1 10 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.239 0.478 25487
2692 1 10 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.616 -5.083 25487
2693 1 10 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.866 -0.474 25487
2694 1 10 . 1 1 15 15 ARG H H 15 9.004 9.004 8.389 0.615 25487
2695 1 10 . 1 1 16 16 HIS N N 16 116.269 116.269 117.960 -1.691 25487
2696 1 10 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.787 0.281 25487
2697 1 10 . 1 1 16 16 HIS CA C 16 52.475 52.475 54.792 -2.317 25487
2698 1 10 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.628 -3.952 25487
2699 1 10 . 1 1 16 16 HIS H H 16 8.528 8.528 8.424 0.104 25487
2700 1 10 . 1 1 17 17 SER N N 17 112.719 112.719 115.898 -3.179 25487
2701 1 10 . 1 1 17 17 SER HA H 17 4.493 4.493 4.468 0.025 25487
2702 1 10 . 1 1 17 17 SER CA C 17 56.591 56.591 58.810 -2.219 25487
2703 1 10 . 1 1 17 17 SER CB C 17 62.736 62.736 63.512 -0.776 25487
2704 1 10 . 1 1 17 17 SER H H 17 7.503 7.503 8.407 -0.904 25487
2705 1 10 . 1 1 18 18 CYS N N 18 122.070 122.070 119.670 2.400 25487
2706 1 10 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.431 0.643 25487
2707 1 10 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.765 -5.191 25487
2708 1 10 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.342 9.483 25487
2709 1 10 . 1 1 18 18 CYS H H 18 8.651 8.651 7.948 0.703 25487
2710 1 10 . 1 1 19 19 CYS N N 19 118.243 118.243 122.362 -4.119 25487
2711 1 10 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.449 0.071 25487
2712 1 10 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.316 -6.768 25487
2713 1 10 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.873 11.517 25487
2714 1 10 . 1 1 19 19 CYS H H 19 8.936 8.936 8.256 0.680 25487
2715 1 10 . 1 1 20 20 ARG N N 20 116.858 116.858 122.834 -5.976 25487
2716 1 10 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.032 0.068 25487
2717 1 10 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.644 -3.639 25487
2718 1 10 . 1 1 20 20 ARG CB C 20 29.629 29.629 30.961 -1.332 25487
2719 1 10 . 1 1 20 20 ARG H H 20 8.136 8.136 8.393 -0.257 25487
2720 1 10 . 1 1 21 21 GLY N N 21 110.611 110.611 109.628 0.983 25487
2721 1 10 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.376 -1.580 25487
2722 1 10 . 1 1 21 21 GLY H H 21 7.569 7.569 7.575 -0.007 25487
2723 1 10 . 1 1 22 22 ASP N N 22 121.161 121.161 119.952 1.209 25487
2724 1 10 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.548 -0.213 25487
2725 1 10 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.432 -2.769 25487
2726 1 10 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.156 -4.772 25487
2727 1 10 . 1 1 22 22 ASP H H 22 8.674 8.674 8.887 -0.213 25487
2728 1 10 . 1 1 23 23 MET N N 23 114.811 114.811 116.416 -1.605 25487
2729 1 10 . 1 1 23 23 MET HA H 23 4.218 4.218 4.242 -0.024 25487
2730 1 10 . 1 1 23 23 MET CA C 23 53.190 53.190 55.941 -2.751 25487
2731 1 10 . 1 1 23 23 MET CB C 23 30.586 30.586 34.147 -3.561 25487
2732 1 10 . 1 1 23 23 MET H H 23 8.333 8.333 7.911 0.422 25487
2733 1 10 . 1 1 24 24 PHE N N 24 116.019 116.019 114.618 1.401 25487
2734 1 10 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.804 0.023 25487
2735 1 10 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.958 1.583 25487
2736 1 10 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.737 -2.942 25487
2737 1 10 . 1 1 24 24 PHE H H 24 7.821 7.821 7.911 -0.090 25487
2738 1 10 . 1 1 25 25 LYS N N 25 123.768 123.768 119.804 3.964 25487
2739 1 10 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.992 0.054 25487
2740 1 10 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.413 -1.775 25487
2741 1 10 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.376 -2.299 25487
2742 1 10 . 1 1 25 25 LYS H H 25 9.119 9.119 8.161 0.958 25487
2743 1 10 . 1 1 26 26 TYR N N 26 123.059 123.059 120.090 2.969 25487
2744 1 10 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.388 0.611 25487
2745 1 10 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.071 -4.251 25487
2746 1 10 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.221 -4.480 25487
2747 1 10 . 1 1 26 26 TYR H H 26 7.884 7.884 7.550 0.334 25487
2748 1 10 . 1 1 27 27 VAL N N 27 116.468 116.468 118.766 -2.298 25487
2749 1 10 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.558 -0.187 25487
2750 1 10 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.563 -2.048 25487
2751 1 10 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.706 -3.761 25487
2752 1 10 . 1 1 27 27 VAL H H 27 9.012 9.012 9.020 -0.008 25487
2753 1 10 . 1 1 28 28 CYS N N 28 124.932 124.932 127.399 -2.467 25487
2754 1 10 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.716 0.038 25487
2755 1 10 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.895 -5.695 25487
2756 1 10 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.736 11.050 25487
2757 1 10 . 1 1 28 28 CYS H H 28 8.874 8.874 8.877 -0.003 25487
2758 1 10 . 1 1 29 29 ASP N N 29 131.592 131.592 129.181 2.411 25487
2759 1 10 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.847 0.098 25487
2760 1 10 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.715 -3.659 25487
2761 1 10 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.178 -5.709 25487
2762 1 10 . 1 1 29 29 ASP H H 29 8.603 8.603 8.743 -0.140 25487
2763 1 10 . 1 1 30 30 CYS N N 30 122.694 122.694 118.564 4.130 25487
2764 1 10 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.972 0.831 25487
2765 1 10 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.016 -5.627 25487
2766 1 10 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.877 14.056 25487
2767 1 10 . 1 1 30 30 CYS H H 30 8.480 8.480 8.307 0.173 25487
2768 1 10 . 1 1 31 31 PHE N N 31 121.135 121.135 121.067 0.068 25487
2769 1 10 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.683 0.104 25487
2770 1 10 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.432 -5.104 25487
2771 1 10 . 1 1 31 31 PHE H H 31 9.062 9.062 8.863 0.199 25487
2772 1 10 . 1 1 32 32 TYR N N 32 120.021 120.021 116.648 3.373 25487
2773 1 10 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.330 -0.340 25487
2774 1 10 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.686 -1.947 25487
2775 1 10 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.727 -4.245 25487
2776 1 10 . 1 1 32 32 TYR H H 32 8.614 8.614 8.599 0.015 25487
2777 1 10 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.345 0.155 25487
2778 1 10 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.393 -2.904 25487
2779 1 10 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.683 -1.030 25487
2780 1 10 . 1 1 34 34 GLU N N 34 119.222 119.222 118.904 0.318 25487
2781 1 10 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.996 0.349 25487
2782 1 10 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.676 -3.979 25487
2783 1 10 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.637 -2.578 25487
2784 1 10 . 1 1 34 34 GLU H H 34 8.516 8.516 8.831 -0.315 25487
2785 1 10 . 1 1 35 35 GLY N N 35 109.836 109.836 104.864 4.972 25487
2786 1 10 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.918 -2.499 25487
2787 1 10 . 1 1 35 35 GLY H H 35 8.209 8.209 7.670 0.539 25487
2788 1 10 . 1 1 36 36 GLU N N 36 119.666 119.666 121.384 -1.718 25487
2789 1 10 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.688 0.537 25487
2790 1 10 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.731 -3.165 25487
2791 1 10 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.361 -3.191 25487
2792 1 10 . 1 1 36 36 GLU H H 36 8.190 8.190 8.604 -0.414 25487
2793 1 10 . 1 1 37 37 ASP N N 37 117.788 117.788 118.772 -0.984 25487
2794 1 10 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.559 -0.029 25487
2795 1 10 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.837 -4.003 25487
2796 1 10 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.531 -4.408 25487
2797 1 10 . 1 1 37 37 ASP H H 37 8.305 8.305 8.480 -0.175 25487
2798 1 10 . 1 1 38 38 LYS N N 38 119.545 119.545 119.516 0.029 25487
2799 1 10 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.574 -0.108 25487
2800 1 10 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.813 -3.465 25487
2801 1 10 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.541 -3.927 25487
2802 1 10 . 1 1 38 38 LYS H H 38 7.950 7.950 7.567 0.383 25487
2803 1 10 . 1 1 39 39 THR N N 39 115.195 115.195 114.663 0.532 25487
2804 1 10 . 1 1 39 39 THR HA H 39 4.323 4.323 4.758 -0.435 25487
2805 1 10 . 1 1 39 39 THR CA C 39 59.508 59.508 61.827 -2.319 25487
2806 1 10 . 1 1 39 39 THR CB C 39 67.653 67.653 71.897 -4.244 25487
2807 1 10 . 1 1 39 39 THR H H 39 7.888 7.888 8.018 -0.130 25487
2808 1 10 . 1 1 40 40 GLU N N 40 124.664 124.664 123.938 0.726 25487
2809 1 10 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.895 -0.929 25487
2810 1 10 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.267 -2.238 25487
2811 1 10 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.359 -3.892 25487
2812 1 10 . 1 1 40 40 GLU H H 40 8.345 8.345 8.573 -0.228 25487
2813 1 10 . 1 1 41 41 VAL N N 41 124.551 124.551 126.702 -2.151 25487
2814 1 10 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.381 -0.280 25487
2815 1 10 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.456 -3.061 25487
2816 1 10 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.276 -2.381 25487
2817 1 10 . 1 1 41 41 VAL H H 41 8.377 8.377 8.818 -0.441 25487
2818 1 10 . 1 1 42 42 CYS N N 42 122.732 122.732 126.588 -3.856 25487
2819 1 10 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.346 0.409 25487
2820 1 10 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.523 -5.679 25487
2821 1 10 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.688 15.792 25487
2822 1 10 . 1 1 42 42 CYS H H 42 8.712 8.712 9.116 -0.404 25487
2823 1 10 . 1 1 43 43 SER N N 43 117.527 117.527 115.783 1.744 25487
2824 1 10 . 1 1 43 43 SER HA H 43 5.220 5.220 5.288 -0.068 25487
2825 1 10 . 1 1 43 43 SER CA C 43 54.110 54.110 56.808 -2.698 25487
2826 1 10 . 1 1 43 43 SER CB C 43 64.091 64.091 65.852 -1.761 25487
2827 1 10 . 1 1 43 43 SER H H 43 8.828 8.828 8.980 -0.152 25487
2828 1 10 . 1 1 44 44 CYS N N 44 120.721 120.721 122.838 -2.117 25487
2829 1 10 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.667 0.546 25487
2830 1 10 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.844 -6.816 25487
2831 1 10 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.242 10.583 25487
2832 1 10 . 1 1 44 44 CYS H H 44 7.936 7.936 8.803 -0.867 25487
2833 1 10 . 1 1 45 45 GLN N N 45 124.614 124.614 124.666 -0.052 25487
2834 1 10 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.696 -0.052 25487
2835 1 10 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.683 -7.250 25487
2836 1 10 . 1 1 45 45 GLN H H 45 9.892 9.892 9.364 0.528 25487
2837 1 10 . 1 1 46 46 GLN N N 46 120.933 120.933 118.726 2.207 25487
2838 1 10 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.669 0.357 25487
2839 1 10 . 1 1 46 46 GLN CB C 46 25.665 25.665 28.407 -2.742 25487
2840 1 10 . 1 1 46 46 GLN H H 46 8.849 8.849 8.628 0.221 25487
2841 1 10 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.623 -0.103 25487
2842 1 10 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.307 -1.900 25487
2843 1 10 . 1 1 47 47 PRO CB C 47 29.749 29.749 33.003 -3.254 25487
2844 1 10 . 1 1 48 48 LYS N N 48 124.003 124.003 120.920 3.083 25487
2845 1 10 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.945 0.108 25487
2846 1 10 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.526 -3.942 25487
2847 1 10 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.167 -1.603 25487
2848 1 10 . 1 1 48 48 LYS H H 48 8.931 8.931 8.781 0.150 25487
2849 1 10 . 1 1 49 49 SER N N 49 113.527 113.527 114.030 -0.503 25487
2850 1 10 . 1 1 49 49 SER HA H 49 3.995 3.995 4.158 -0.163 25487
2851 1 10 . 1 1 49 49 SER CA C 49 55.458 55.458 62.199 -6.741 25487
2852 1 10 . 1 1 49 49 SER CB C 49 61.270 61.270 62.583 -1.313 25487
2853 1 10 . 1 1 49 49 SER H H 49 8.702 8.702 8.223 0.479 25487
2854 1 10 . 1 1 50 50 HIS N N 50 119.669 119.669 120.922 -1.253 25487
2855 1 10 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.330 -0.003 25487
2856 1 10 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.848 -3.393 25487
2857 1 10 . 1 1 50 50 HIS H H 50 7.664 7.664 8.521 -0.857 25487
2858 1 10 . 1 1 51 51 LYS N N 51 120.030 120.030 119.436 0.594 25487
2859 1 10 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.075 0.018 25487
2860 1 10 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.187 -2.435 25487
2861 1 10 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.141 -1.760 25487
2862 1 10 . 1 1 51 51 LYS H H 51 7.825 7.825 8.120 -0.295 25487
2863 1 10 . 1 1 52 52 ILE N N 52 118.914 118.914 119.833 -0.919 25487
2864 1 10 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.623 0.098 25487
2865 1 10 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.263 -3.438 25487
2866 1 10 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.550 -2.544 25487
2867 1 10 . 1 1 52 52 ILE H H 52 8.223 8.223 8.065 0.158 25487
2868 1 10 . 1 1 53 53 ALA N N 53 120.985 120.985 121.865 -0.880 25487
2869 1 10 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.873 0.083 25487
2870 1 10 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.556 -2.413 25487
2871 1 10 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.779 -1.033 25487
2872 1 10 . 1 1 53 53 ALA H H 53 8.066 8.066 8.262 -0.196 25487
2873 1 10 . 1 1 54 54 GLU N N 54 115.137 115.137 118.042 -2.905 25487
2874 1 10 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.947 -0.014 25487
2875 1 10 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.351 -2.503 25487
2876 1 10 . 1 1 54 54 GLU H H 54 8.160 8.160 8.193 -0.033 25487
2877 1 10 . 1 1 55 55 LYS N N 55 118.610 118.610 119.799 -1.189 25487
2878 1 10 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.068 0.088 25487
2879 1 10 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.694 -3.267 25487
2880 1 10 . 1 1 55 55 LYS H H 55 7.732 7.732 8.041 -0.309 25487
2881 1 10 . 1 1 56 56 ILE N N 56 119.173 119.173 120.854 -1.681 25487
2882 1 10 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.608 0.019 25487
2883 1 10 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.405 -2.507 25487
2884 1 10 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.682 -2.539 25487
2885 1 10 . 1 1 56 56 ILE H H 56 8.022 8.022 8.233 -0.211 25487
2886 1 10 . 1 1 57 57 ILE N N 57 120.239 120.239 120.114 0.125 25487
2887 1 10 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.549 0.039 25487
2888 1 10 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.435 -1.537 25487
2889 1 10 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.094 -1.057 25487
2890 1 10 . 1 1 57 57 ILE H H 57 8.370 8.370 8.182 0.188 25487
2891 1 10 . 1 1 58 58 ASP N N 58 118.234 118.234 120.191 -1.957 25487
2892 1 10 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.266 0.146 25487
2893 1 10 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.618 -3.444 25487
2894 1 10 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.000 -3.805 25487
2895 1 10 . 1 1 58 58 ASP H H 58 8.458 8.458 8.457 0.001 25487
2896 1 10 . 1 1 59 59 LYS N N 59 119.380 119.380 120.145 -0.765 25487
2897 1 10 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.944 0.306 25487
2898 1 10 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.293 -4.362 25487
2899 1 10 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.502 -2.441 25487
2900 1 10 . 1 1 59 59 LYS H H 59 7.928 7.928 8.063 -0.135 25487
2901 1 10 . 1 1 60 60 ALA N N 60 123.604 123.604 121.212 2.392 25487
2902 1 10 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.080 -0.095 25487
2903 1 10 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.802 -1.989 25487
2904 1 10 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.536 -2.739 25487
2905 1 10 . 1 1 60 60 ALA H H 60 8.699 8.699 7.843 0.856 25487
2906 1 10 . 1 1 61 61 LYS N N 61 115.317 115.317 116.715 -1.398 25487
2907 1 10 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.124 -0.106 25487
2908 1 10 . 1 1 61 61 LYS CA C 61 56.785 56.785 57.643 -0.858 25487
2909 1 10 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.954 -2.447 25487
2910 1 10 . 1 1 61 61 LYS H H 61 8.361 8.361 8.018 0.343 25487
2911 1 10 . 1 1 62 62 THR N N 62 107.298 107.298 110.953 -3.655 25487
2912 1 10 . 1 1 62 62 THR HA H 62 4.368 4.368 4.036 0.332 25487
2913 1 10 . 1 1 62 62 THR CA C 62 60.427 60.427 63.939 -3.512 25487
2914 1 10 . 1 1 62 62 THR CB C 62 67.179 67.179 67.674 -0.495 25487
2915 1 10 . 1 1 62 62 THR H H 62 7.510 7.510 8.615 -1.105 25487
2916 1 10 . 1 1 63 63 THR N N 63 115.701 115.701 114.505 1.196 25487
2917 1 10 . 1 1 63 63 THR HA H 63 4.328 4.328 4.275 0.053 25487
2918 1 10 . 1 1 63 63 THR CA C 63 61.695 61.695 63.941 -2.246 25487
2919 1 10 . 1 1 63 63 THR CB C 63 67.641 67.641 69.318 -1.677 25487
2920 1 10 . 1 1 63 63 THR H H 63 7.651 7.651 8.104 -0.453 25487
2921 1 11 . 1 1 2 2 LYS N N 2 121.111 121.111 120.401 0.710 25487
2922 1 11 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.490 -0.165 25487
2923 1 11 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.465 -2.802 25487
2924 1 11 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.401 -2.986 25487
2925 1 11 . 1 1 2 2 LYS H H 2 8.492 8.492 8.360 0.132 25487
2926 1 11 . 1 1 3 3 ALA N N 3 126.440 126.440 126.073 0.367 25487
2927 1 11 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.335 0.090 25487
2928 1 11 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.233 -2.786 25487
2929 1 11 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.132 -2.227 25487
2930 1 11 . 1 1 3 3 ALA H H 3 8.357 8.357 7.844 0.513 25487
2931 1 11 . 1 1 4 4 CYS N N 4 116.834 116.834 120.507 -3.673 25487
2932 1 11 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.649 0.254 25487
2933 1 11 . 1 1 4 4 CYS CA C 4 51.793 51.793 57.972 -6.179 25487
2934 1 11 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.151 11.143 25487
2935 1 11 . 1 1 4 4 CYS H H 4 8.145 8.145 8.389 -0.244 25487
2936 1 11 . 1 1 5 5 THR N N 5 121.220 121.220 118.397 2.823 25487
2937 1 11 . 1 1 5 5 THR HA H 5 4.481 4.481 4.799 -0.318 25487
2938 1 11 . 1 1 5 5 THR CA C 5 58.256 58.256 60.510 -2.254 25487
2939 1 11 . 1 1 5 5 THR CB C 5 67.043 67.043 69.770 -2.727 25487
2940 1 11 . 1 1 5 5 THR H H 5 9.070 9.070 8.521 0.549 25487
2941 1 11 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.458 -0.206 25487
2942 1 11 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.087 -2.848 25487
2943 1 11 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.451 -1.922 25487
2944 1 11 . 1 1 7 7 LEU N N 7 119.270 119.270 119.874 -0.604 25487
2945 1 11 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.877 -0.621 25487
2946 1 11 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.448 -1.388 25487
2947 1 11 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.274 -3.068 25487
2948 1 11 . 1 1 7 7 LEU H H 7 7.797 7.797 7.950 -0.153 25487
2949 1 11 . 1 1 8 8 LEU N N 8 119.586 119.586 121.588 -2.002 25487
2950 1 11 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.905 -0.083 25487
2951 1 11 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.762 -0.839 25487
2952 1 11 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.505 -2.903 25487
2953 1 11 . 1 1 8 8 LEU H H 8 9.465 9.465 8.731 0.734 25487
2954 1 11 . 1 1 9 9 HIS N N 9 117.507 117.507 116.614 0.893 25487
2955 1 11 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.752 -0.006 25487
2956 1 11 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.358 -1.931 25487
2957 1 11 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.782 -6.674 25487
2958 1 11 . 1 1 9 9 HIS H H 9 8.159 8.159 8.087 0.072 25487
2959 1 11 . 1 1 10 10 ASP N N 10 119.492 119.492 121.494 -2.002 25487
2960 1 11 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.742 0.141 25487
2961 1 11 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.800 -3.462 25487
2962 1 11 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.867 -1.397 25487
2963 1 11 . 1 1 10 10 ASP H H 10 8.341 8.341 8.610 -0.269 25487
2964 1 11 . 1 1 11 11 CYS N N 11 121.767 121.767 119.455 2.312 25487
2965 1 11 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.930 0.199 25487
2966 1 11 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.851 -4.095 25487
2967 1 11 . 1 1 11 11 CYS CB C 11 42.236 42.236 29.010 13.226 25487
2968 1 11 . 1 1 11 11 CYS H H 11 8.017 8.017 8.434 -0.417 25487
2969 1 11 . 1 1 12 12 SER N N 12 118.618 118.618 119.345 -0.727 25487
2970 1 11 . 1 1 12 12 SER HA H 12 3.759 3.759 4.126 -0.367 25487
2971 1 11 . 1 1 12 12 SER CB C 12 59.972 59.972 62.632 -2.659 25487
2972 1 11 . 1 1 12 12 SER H H 12 8.844 8.844 8.530 0.314 25487
2973 1 11 . 1 1 13 13 HIS N N 13 117.166 117.166 116.112 1.054 25487
2974 1 11 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.570 0.052 25487
2975 1 11 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.212 -4.759 25487
2976 1 11 . 1 1 13 13 HIS H H 13 8.547 8.547 7.944 0.603 25487
2977 1 11 . 1 1 14 14 ASP N N 14 117.382 117.382 118.438 -1.056 25487
2978 1 11 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.830 -0.139 25487
2979 1 11 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.995 -2.803 25487
2980 1 11 . 1 1 14 14 ASP CB C 14 36.424 36.424 41.988 -5.564 25487
2981 1 11 . 1 1 14 14 ASP H H 14 7.224 7.224 7.758 -0.534 25487
2982 1 11 . 1 1 15 15 ARG N N 15 124.498 124.498 124.784 -0.286 25487
2983 1 11 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.330 0.387 25487
2984 1 11 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.415 -3.882 25487
2985 1 11 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.511 -0.119 25487
2986 1 11 . 1 1 15 15 ARG H H 15 9.004 9.004 8.593 0.411 25487
2987 1 11 . 1 1 16 16 HIS N N 16 116.269 116.269 115.621 0.648 25487
2988 1 11 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.724 0.344 25487
2989 1 11 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.080 -2.605 25487
2990 1 11 . 1 1 16 16 HIS CB C 16 25.676 25.676 30.319 -4.643 25487
2991 1 11 . 1 1 16 16 HIS H H 16 8.528 8.528 8.468 0.060 25487
2992 1 11 . 1 1 17 17 SER N N 17 112.719 112.719 113.889 -1.170 25487
2993 1 11 . 1 1 17 17 SER HA H 17 4.493 4.493 4.503 -0.010 25487
2994 1 11 . 1 1 17 17 SER CA C 17 56.591 56.591 58.766 -2.175 25487
2995 1 11 . 1 1 17 17 SER CB C 17 62.736 62.736 64.501 -1.765 25487
2996 1 11 . 1 1 17 17 SER H H 17 7.503 7.503 7.649 -0.146 25487
2997 1 11 . 1 1 18 18 CYS N N 18 122.070 122.070 122.400 -0.330 25487
2998 1 11 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.434 0.640 25487
2999 1 11 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.877 -5.303 25487
3000 1 11 . 1 1 18 18 CYS CB C 18 36.825 36.825 25.995 10.830 25487
3001 1 11 . 1 1 18 18 CYS H H 18 8.651 8.651 8.029 0.622 25487
3002 1 11 . 1 1 19 19 CYS N N 19 118.243 118.243 124.961 -6.718 25487
3003 1 11 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.367 0.153 25487
3004 1 11 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.771 -7.223 25487
3005 1 11 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.063 11.327 25487
3006 1 11 . 1 1 19 19 CYS H H 19 8.936 8.936 8.390 0.546 25487
3007 1 11 . 1 1 20 20 ARG N N 20 116.858 116.858 121.280 -4.422 25487
3008 1 11 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.115 -0.016 25487
3009 1 11 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.658 -3.653 25487
3010 1 11 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.889 -2.260 25487
3011 1 11 . 1 1 20 20 ARG H H 20 8.136 8.136 8.553 -0.417 25487
3012 1 11 . 1 1 21 21 GLY N N 21 110.611 110.611 105.968 4.643 25487
3013 1 11 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.067 -1.271 25487
3014 1 11 . 1 1 21 21 GLY H H 21 7.569 7.569 8.136 -0.567 25487
3015 1 11 . 1 1 22 22 ASP N N 22 121.161 121.161 120.383 0.778 25487
3016 1 11 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.390 -0.055 25487
3017 1 11 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.950 -3.287 25487
3018 1 11 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.047 -4.663 25487
3019 1 11 . 1 1 22 22 ASP H H 22 8.674 8.674 8.769 -0.095 25487
3020 1 11 . 1 1 23 23 MET N N 23 114.811 114.811 114.512 0.299 25487
3021 1 11 . 1 1 23 23 MET HA H 23 4.218 4.218 4.227 -0.009 25487
3022 1 11 . 1 1 23 23 MET CA C 23 53.190 53.190 55.304 -2.114 25487
3023 1 11 . 1 1 23 23 MET CB C 23 30.586 30.586 34.709 -4.123 25487
3024 1 11 . 1 1 23 23 MET H H 23 8.333 8.333 7.679 0.654 25487
3025 1 11 . 1 1 24 24 PHE N N 24 116.019 116.019 117.626 -1.607 25487
3026 1 11 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.738 0.089 25487
3027 1 11 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.434 2.107 25487
3028 1 11 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.739 -2.943 25487
3029 1 11 . 1 1 24 24 PHE H H 24 7.821 7.821 7.897 -0.076 25487
3030 1 11 . 1 1 25 25 LYS N N 25 123.768 123.768 122.846 0.922 25487
3031 1 11 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.805 0.241 25487
3032 1 11 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.977 -2.339 25487
3033 1 11 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.740 -1.663 25487
3034 1 11 . 1 1 25 25 LYS H H 25 9.119 9.119 8.426 0.693 25487
3035 1 11 . 1 1 26 26 TYR N N 26 123.059 123.059 118.666 4.393 25487
3036 1 11 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.337 0.662 25487
3037 1 11 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.446 -4.626 25487
3038 1 11 . 1 1 26 26 TYR CB C 26 34.741 34.741 38.977 -4.236 25487
3039 1 11 . 1 1 26 26 TYR H H 26 7.884 7.884 7.434 0.450 25487
3040 1 11 . 1 1 27 27 VAL N N 27 116.468 116.468 119.130 -2.662 25487
3041 1 11 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.528 -0.157 25487
3042 1 11 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.619 -2.104 25487
3043 1 11 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.594 -3.649 25487
3044 1 11 . 1 1 27 27 VAL H H 27 9.012 9.012 9.184 -0.172 25487
3045 1 11 . 1 1 28 28 CYS N N 28 124.932 124.932 127.597 -2.665 25487
3046 1 11 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.888 -0.134 25487
3047 1 11 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.382 -5.182 25487
3048 1 11 . 1 1 28 28 CYS CB C 28 37.787 37.787 27.619 10.168 25487
3049 1 11 . 1 1 28 28 CYS H H 28 8.874 8.874 8.962 -0.088 25487
3050 1 11 . 1 1 29 29 ASP N N 29 131.592 131.592 128.960 2.632 25487
3051 1 11 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.849 0.096 25487
3052 1 11 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.830 -3.774 25487
3053 1 11 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.967 -5.498 25487
3054 1 11 . 1 1 29 29 ASP H H 29 8.603 8.603 8.571 0.032 25487
3055 1 11 . 1 1 30 30 CYS N N 30 122.694 122.694 118.020 4.674 25487
3056 1 11 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.857 0.946 25487
3057 1 11 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.864 -5.475 25487
3058 1 11 . 1 1 30 30 CYS CB C 30 43.933 43.933 30.619 13.314 25487
3059 1 11 . 1 1 30 30 CYS H H 30 8.480 8.480 8.131 0.349 25487
3060 1 11 . 1 1 31 31 PHE N N 31 121.135 121.135 119.533 1.602 25487
3061 1 11 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.476 0.311 25487
3062 1 11 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.192 -4.864 25487
3063 1 11 . 1 1 31 31 PHE H H 31 9.062 9.062 8.542 0.520 25487
3064 1 11 . 1 1 32 32 TYR N N 32 120.021 120.021 119.002 1.019 25487
3065 1 11 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.978 0.012 25487
3066 1 11 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.622 -1.883 25487
3067 1 11 . 1 1 32 32 TYR CB C 32 35.482 35.482 38.028 -2.546 25487
3068 1 11 . 1 1 32 32 TYR H H 32 8.614 8.614 8.638 -0.024 25487
3069 1 11 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.335 0.165 25487
3070 1 11 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.179 -2.691 25487
3071 1 11 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.576 -0.923 25487
3072 1 11 . 1 1 34 34 GLU N N 34 119.222 119.222 119.575 -0.353 25487
3073 1 11 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.964 0.381 25487
3074 1 11 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.450 -3.753 25487
3075 1 11 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.934 -2.875 25487
3076 1 11 . 1 1 34 34 GLU H H 34 8.516 8.516 8.669 -0.153 25487
3077 1 11 . 1 1 35 35 GLY N N 35 109.836 109.836 105.011 4.825 25487
3078 1 11 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.406 -2.987 25487
3079 1 11 . 1 1 35 35 GLY H H 35 8.209 8.209 7.426 0.783 25487
3080 1 11 . 1 1 36 36 GLU N N 36 119.666 119.666 119.807 -0.141 25487
3081 1 11 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.408 -0.183 25487
3082 1 11 . 1 1 36 36 GLU CA C 36 53.566 53.566 57.007 -3.441 25487
3083 1 11 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.803 -3.633 25487
3084 1 11 . 1 1 36 36 GLU H H 36 8.190 8.190 8.523 -0.333 25487
3085 1 11 . 1 1 37 37 ASP N N 37 117.788 117.788 120.509 -2.721 25487
3086 1 11 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.692 -0.162 25487
3087 1 11 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.293 -3.459 25487
3088 1 11 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.732 -4.609 25487
3089 1 11 . 1 1 37 37 ASP H H 37 8.305 8.305 8.474 -0.169 25487
3090 1 11 . 1 1 38 38 LYS N N 38 119.545 119.545 116.644 2.901 25487
3091 1 11 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.564 -0.098 25487
3092 1 11 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.675 -3.327 25487
3093 1 11 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.248 -3.634 25487
3094 1 11 . 1 1 38 38 LYS H H 38 7.950 7.950 8.038 -0.088 25487
3095 1 11 . 1 1 39 39 THR N N 39 115.195 115.195 117.304 -2.109 25487
3096 1 11 . 1 1 39 39 THR HA H 39 4.323 4.323 4.472 -0.149 25487
3097 1 11 . 1 1 39 39 THR CA C 39 59.508 59.508 62.747 -3.239 25487
3098 1 11 . 1 1 39 39 THR CB C 39 67.653 67.653 70.975 -3.322 25487
3099 1 11 . 1 1 39 39 THR H H 39 7.888 7.888 7.585 0.303 25487
3100 1 11 . 1 1 40 40 GLU N N 40 124.664 124.664 125.712 -1.048 25487
3101 1 11 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.728 -0.762 25487
3102 1 11 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.075 -2.046 25487
3103 1 11 . 1 1 40 40 GLU CB C 40 26.467 26.467 31.179 -4.712 25487
3104 1 11 . 1 1 40 40 GLU H H 40 8.345 8.345 8.405 -0.060 25487
3105 1 11 . 1 1 41 41 VAL N N 41 124.551 124.551 123.545 1.006 25487
3106 1 11 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.309 -0.208 25487
3107 1 11 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.223 -2.828 25487
3108 1 11 . 1 1 41 41 VAL CB C 41 30.895 30.895 31.513 -0.618 25487
3109 1 11 . 1 1 41 41 VAL H H 41 8.377 8.377 8.327 0.050 25487
3110 1 11 . 1 1 42 42 CYS N N 42 122.732 122.732 127.159 -4.427 25487
3111 1 11 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.263 0.492 25487
3112 1 11 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.637 -5.793 25487
3113 1 11 . 1 1 42 42 CYS CB C 42 46.480 46.480 31.295 15.185 25487
3114 1 11 . 1 1 42 42 CYS H H 42 8.712 8.712 8.850 -0.138 25487
3115 1 11 . 1 1 43 43 SER N N 43 117.527 117.527 115.849 1.678 25487
3116 1 11 . 1 1 43 43 SER HA H 43 5.220 5.220 5.306 -0.086 25487
3117 1 11 . 1 1 43 43 SER CA C 43 54.110 54.110 56.492 -2.382 25487
3118 1 11 . 1 1 43 43 SER CB C 43 64.091 64.091 65.483 -1.392 25487
3119 1 11 . 1 1 43 43 SER H H 43 8.828 8.828 8.991 -0.163 25487
3120 1 11 . 1 1 44 44 CYS N N 44 120.721 120.721 122.281 -1.560 25487
3121 1 11 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.689 0.524 25487
3122 1 11 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.813 -6.785 25487
3123 1 11 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.503 10.322 25487
3124 1 11 . 1 1 44 44 CYS H H 44 7.936 7.936 8.757 -0.821 25487
3125 1 11 . 1 1 45 45 GLN N N 45 124.614 124.614 124.915 -0.301 25487
3126 1 11 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.645 -0.001 25487
3127 1 11 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.964 -7.531 25487
3128 1 11 . 1 1 45 45 GLN H H 45 9.892 9.892 9.246 0.646 25487
3129 1 11 . 1 1 46 46 GLN N N 46 120.933 120.933 120.427 0.506 25487
3130 1 11 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.715 0.311 25487
3131 1 11 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.979 -4.314 25487
3132 1 11 . 1 1 46 46 GLN H H 46 8.849 8.849 8.549 0.300 25487
3133 1 11 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.560 -0.040 25487
3134 1 11 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.336 -1.929 25487
3135 1 11 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.952 -3.203 25487
3136 1 11 . 1 1 48 48 LYS N N 48 124.003 124.003 120.936 3.067 25487
3137 1 11 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.949 0.104 25487
3138 1 11 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.332 -3.748 25487
3139 1 11 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.143 -1.579 25487
3140 1 11 . 1 1 48 48 LYS H H 48 8.931 8.931 8.733 0.198 25487
3141 1 11 . 1 1 49 49 SER N N 49 113.527 113.527 114.015 -0.488 25487
3142 1 11 . 1 1 49 49 SER HA H 49 3.995 3.995 4.150 -0.155 25487
3143 1 11 . 1 1 49 49 SER CA C 49 55.458 55.458 62.003 -6.545 25487
3144 1 11 . 1 1 49 49 SER CB C 49 61.270 61.270 62.525 -1.255 25487
3145 1 11 . 1 1 49 49 SER H H 49 8.702 8.702 8.186 0.516 25487
3146 1 11 . 1 1 50 50 HIS N N 50 119.669 119.669 119.583 0.086 25487
3147 1 11 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.421 -0.094 25487
3148 1 11 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.890 -3.435 25487
3149 1 11 . 1 1 50 50 HIS H H 50 7.664 7.664 8.314 -0.650 25487
3150 1 11 . 1 1 51 51 LYS N N 51 120.030 120.030 120.560 -0.530 25487
3151 1 11 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.363 -0.270 25487
3152 1 11 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.432 -2.680 25487
3153 1 11 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.351 -1.970 25487
3154 1 11 . 1 1 51 51 LYS H H 51 7.825 7.825 8.084 -0.259 25487
3155 1 11 . 1 1 52 52 ILE N N 52 118.914 118.914 120.048 -1.134 25487
3156 1 11 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.693 0.028 25487
3157 1 11 . 1 1 52 52 ILE CA C 52 61.825 61.825 64.811 -2.986 25487
3158 1 11 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.622 -2.616 25487
3159 1 11 . 1 1 52 52 ILE H H 52 8.223 8.223 8.117 0.106 25487
3160 1 11 . 1 1 53 53 ALA N N 53 120.985 120.985 122.224 -1.239 25487
3161 1 11 . 1 1 53 53 ALA HA H 53 3.956 3.956 4.013 -0.057 25487
3162 1 11 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.568 -2.425 25487
3163 1 11 . 1 1 53 53 ALA CB C 53 16.746 16.746 18.012 -1.266 25487
3164 1 11 . 1 1 53 53 ALA H H 53 8.066 8.066 8.289 -0.223 25487
3165 1 11 . 1 1 54 54 GLU N N 54 115.137 115.137 117.855 -2.718 25487
3166 1 11 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.982 -0.049 25487
3167 1 11 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.102 -2.254 25487
3168 1 11 . 1 1 54 54 GLU H H 54 8.160 8.160 8.235 -0.075 25487
3169 1 11 . 1 1 55 55 LYS N N 55 118.610 118.610 120.260 -1.650 25487
3170 1 11 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.173 -0.017 25487
3171 1 11 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.956 -2.530 25487
3172 1 11 . 1 1 55 55 LYS H H 55 7.732 7.732 7.967 -0.235 25487
3173 1 11 . 1 1 56 56 ILE N N 56 119.173 119.173 120.614 -1.441 25487
3174 1 11 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.634 -0.007 25487
3175 1 11 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.407 -2.509 25487
3176 1 11 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.944 -2.801 25487
3177 1 11 . 1 1 56 56 ILE H H 56 8.022 8.022 7.933 0.089 25487
3178 1 11 . 1 1 57 57 ILE N N 57 120.239 120.239 120.200 0.039 25487
3179 1 11 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.517 0.072 25487
3180 1 11 . 1 1 57 57 ILE CA C 57 62.898 62.898 66.044 -3.146 25487
3181 1 11 . 1 1 57 57 ILE CB C 57 35.037 35.037 37.429 -2.392 25487
3182 1 11 . 1 1 57 57 ILE H H 57 8.370 8.370 8.339 0.031 25487
3183 1 11 . 1 1 58 58 ASP N N 58 118.234 118.234 120.438 -2.204 25487
3184 1 11 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.325 0.087 25487
3185 1 11 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.640 -3.466 25487
3186 1 11 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.172 -3.977 25487
3187 1 11 . 1 1 58 58 ASP H H 58 8.458 8.458 8.110 0.348 25487
3188 1 11 . 1 1 59 59 LYS N N 59 119.380 119.380 119.755 -0.375 25487
3189 1 11 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.032 0.218 25487
3190 1 11 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.879 -3.948 25487
3191 1 11 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.677 -2.616 25487
3192 1 11 . 1 1 59 59 LYS H H 59 7.928 7.928 8.063 -0.135 25487
3193 1 11 . 1 1 60 60 ALA N N 60 123.604 123.604 121.838 1.766 25487
3194 1 11 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.016 -0.031 25487
3195 1 11 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.011 -2.198 25487
3196 1 11 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.848 -3.051 25487
3197 1 11 . 1 1 60 60 ALA H H 60 8.699 8.699 8.136 0.563 25487
3198 1 11 . 1 1 61 61 LYS N N 61 115.317 115.317 117.958 -2.641 25487
3199 1 11 . 1 1 61 61 LYS HA H 61 4.018 4.018 3.990 0.028 25487
3200 1 11 . 1 1 61 61 LYS CA C 61 56.785 56.785 59.018 -2.233 25487
3201 1 11 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.840 -2.333 25487
3202 1 11 . 1 1 61 61 LYS H H 61 8.361 8.361 8.223 0.138 25487
3203 1 11 . 1 1 62 62 THR N N 62 107.298 107.298 110.629 -3.331 25487
3204 1 11 . 1 1 62 62 THR HA H 62 4.368 4.368 4.077 0.291 25487
3205 1 11 . 1 1 62 62 THR CA C 62 60.427 60.427 63.799 -3.372 25487
3206 1 11 . 1 1 62 62 THR CB C 62 67.179 67.179 67.412 -0.233 25487
3207 1 11 . 1 1 62 62 THR H H 62 7.510 7.510 8.524 -1.014 25487
3208 1 11 . 1 1 63 63 THR N N 63 115.701 115.701 113.863 1.838 25487
3209 1 11 . 1 1 63 63 THR HA H 63 4.328 4.328 4.277 0.051 25487
3210 1 11 . 1 1 63 63 THR CA C 63 61.695 61.695 63.755 -2.060 25487
3211 1 11 . 1 1 63 63 THR CB C 63 67.641 67.641 69.423 -1.782 25487
3212 1 11 . 1 1 63 63 THR H H 63 7.651 7.651 8.369 -0.718 25487
3213 1 12 . 1 1 2 2 LYS N N 2 121.111 121.111 119.958 1.153 25487
3214 1 12 . 1 1 2 2 LYS HA H 2 4.325 4.325 5.148 -0.823 25487
3215 1 12 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.230 -2.567 25487
3216 1 12 . 1 1 2 2 LYS CB C 2 30.415 30.415 35.279 -4.864 25487
3217 1 12 . 1 1 2 2 LYS H H 2 8.492 8.492 10.238 -1.746 25487
3218 1 12 . 1 1 3 3 ALA N N 3 126.440 126.440 123.581 2.859 25487
3219 1 12 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.698 -0.273 25487
3220 1 12 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.756 -2.309 25487
3221 1 12 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.777 -2.872 25487
3222 1 12 . 1 1 3 3 ALA H H 3 8.357 8.357 8.711 -0.354 25487
3223 1 12 . 1 1 4 4 CYS N N 4 116.834 116.834 118.909 -2.075 25487
3224 1 12 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.728 0.175 25487
3225 1 12 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.840 -5.047 25487
3226 1 12 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.467 11.827 25487
3227 1 12 . 1 1 4 4 CYS H H 4 8.145 8.145 8.344 -0.199 25487
3228 1 12 . 1 1 5 5 THR N N 5 121.220 121.220 118.000 3.220 25487
3229 1 12 . 1 1 5 5 THR HA H 5 4.481 4.481 4.779 -0.298 25487
3230 1 12 . 1 1 5 5 THR CA C 5 58.256 58.256 60.401 -2.145 25487
3231 1 12 . 1 1 5 5 THR CB C 5 67.043 67.043 68.266 -1.223 25487
3232 1 12 . 1 1 5 5 THR H H 5 9.070 9.070 8.674 0.396 25487
3233 1 12 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.482 -0.230 25487
3234 1 12 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.259 -3.020 25487
3235 1 12 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.468 -1.939 25487
3236 1 12 . 1 1 7 7 LEU N N 7 119.270 119.270 119.656 -0.386 25487
3237 1 12 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.922 -0.666 25487
3238 1 12 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.256 -1.196 25487
3239 1 12 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.317 -3.111 25487
3240 1 12 . 1 1 7 7 LEU H H 7 7.797 7.797 7.910 -0.113 25487
3241 1 12 . 1 1 8 8 LEU N N 8 119.586 119.586 122.079 -2.493 25487
3242 1 12 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.902 -0.080 25487
3243 1 12 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.741 -0.818 25487
3244 1 12 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.507 -2.905 25487
3245 1 12 . 1 1 8 8 LEU H H 8 9.465 9.465 8.848 0.617 25487
3246 1 12 . 1 1 9 9 HIS N N 9 117.507 117.507 116.440 1.067 25487
3247 1 12 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.744 0.002 25487
3248 1 12 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.486 -2.059 25487
3249 1 12 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.831 -6.723 25487
3250 1 12 . 1 1 9 9 HIS H H 9 8.159 8.159 8.070 0.089 25487
3251 1 12 . 1 1 10 10 ASP N N 10 119.492 119.492 121.479 -1.987 25487
3252 1 12 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.743 0.140 25487
3253 1 12 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.212 -2.874 25487
3254 1 12 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.932 -1.462 25487
3255 1 12 . 1 1 10 10 ASP H H 10 8.341 8.341 8.610 -0.269 25487
3256 1 12 . 1 1 11 11 CYS N N 11 121.767 121.767 119.500 2.267 25487
3257 1 12 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.886 0.243 25487
3258 1 12 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.547 -3.791 25487
3259 1 12 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.850 13.386 25487
3260 1 12 . 1 1 11 11 CYS H H 11 8.017 8.017 8.369 -0.352 25487
3261 1 12 . 1 1 12 12 SER N N 12 118.618 118.618 117.880 0.738 25487
3262 1 12 . 1 1 12 12 SER HA H 12 3.759 3.759 4.092 -0.333 25487
3263 1 12 . 1 1 12 12 SER CB C 12 59.972 59.972 63.159 -3.187 25487
3264 1 12 . 1 1 12 12 SER H H 12 8.844 8.844 8.411 0.433 25487
3265 1 12 . 1 1 13 13 HIS N N 13 117.166 117.166 116.418 0.748 25487
3266 1 12 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.619 0.003 25487
3267 1 12 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.296 -4.843 25487
3268 1 12 . 1 1 13 13 HIS H H 13 8.547 8.547 7.998 0.549 25487
3269 1 12 . 1 1 14 14 ASP N N 14 117.382 117.382 117.899 -0.517 25487
3270 1 12 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.866 -0.175 25487
3271 1 12 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.434 -3.242 25487
3272 1 12 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.995 -6.572 25487
3273 1 12 . 1 1 14 14 ASP H H 14 7.224 7.224 7.970 -0.746 25487
3274 1 12 . 1 1 15 15 ARG N N 15 124.498 124.498 123.096 1.402 25487
3275 1 12 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.232 0.485 25487
3276 1 12 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.689 -4.156 25487
3277 1 12 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.387 0.005 25487
3278 1 12 . 1 1 15 15 ARG H H 15 9.004 9.004 8.569 0.435 25487
3279 1 12 . 1 1 16 16 HIS N N 16 116.269 116.269 115.358 0.911 25487
3280 1 12 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.865 0.203 25487
3281 1 12 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.179 -2.704 25487
3282 1 12 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.863 -4.187 25487
3283 1 12 . 1 1 16 16 HIS H H 16 8.528 8.528 8.302 0.226 25487
3284 1 12 . 1 1 17 17 SER N N 17 112.719 112.719 115.641 -2.922 25487
3285 1 12 . 1 1 17 17 SER HA H 17 4.493 4.493 4.461 0.032 25487
3286 1 12 . 1 1 17 17 SER CA C 17 56.591 56.591 59.366 -2.775 25487
3287 1 12 . 1 1 17 17 SER CB C 17 62.736 62.736 63.848 -1.112 25487
3288 1 12 . 1 1 17 17 SER H H 17 7.503 7.503 7.634 -0.131 25487
3289 1 12 . 1 1 18 18 CYS N N 18 122.070 122.070 122.136 -0.066 25487
3290 1 12 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.462 0.612 25487
3291 1 12 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.288 -5.714 25487
3292 1 12 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.186 9.639 25487
3293 1 12 . 1 1 18 18 CYS H H 18 8.651 8.651 8.123 0.528 25487
3294 1 12 . 1 1 19 19 CYS N N 19 118.243 118.243 121.843 -3.600 25487
3295 1 12 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.469 0.051 25487
3296 1 12 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.359 -6.811 25487
3297 1 12 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.996 11.394 25487
3298 1 12 . 1 1 19 19 CYS H H 19 8.936 8.936 8.230 0.706 25487
3299 1 12 . 1 1 20 20 ARG N N 20 116.858 116.858 122.010 -5.152 25487
3300 1 12 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.084 0.015 25487
3301 1 12 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.816 -3.811 25487
3302 1 12 . 1 1 20 20 ARG CB C 20 29.629 29.629 30.927 -1.298 25487
3303 1 12 . 1 1 20 20 ARG H H 20 8.136 8.136 8.435 -0.299 25487
3304 1 12 . 1 1 21 21 GLY N N 21 110.611 110.611 107.962 2.649 25487
3305 1 12 . 1 1 21 21 GLY CA C 21 41.796 41.796 44.412 -2.616 25487
3306 1 12 . 1 1 21 21 GLY H H 21 7.569 7.569 7.948 -0.379 25487
3307 1 12 . 1 1 22 22 ASP N N 22 121.161 121.161 119.636 1.525 25487
3308 1 12 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.442 -0.107 25487
3309 1 12 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.465 -2.802 25487
3310 1 12 . 1 1 22 22 ASP CB C 22 36.384 36.384 40.884 -4.500 25487
3311 1 12 . 1 1 22 22 ASP H H 22 8.674 8.674 8.762 -0.088 25487
3312 1 12 . 1 1 23 23 MET N N 23 114.811 114.811 116.526 -1.715 25487
3313 1 12 . 1 1 23 23 MET HA H 23 4.218 4.218 4.227 -0.009 25487
3314 1 12 . 1 1 23 23 MET CA C 23 53.190 53.190 55.480 -2.290 25487
3315 1 12 . 1 1 23 23 MET CB C 23 30.586 30.586 34.150 -3.564 25487
3316 1 12 . 1 1 23 23 MET H H 23 8.333 8.333 7.852 0.481 25487
3317 1 12 . 1 1 24 24 PHE N N 24 116.019 116.019 117.626 -1.607 25487
3318 1 12 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.702 0.125 25487
3319 1 12 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.536 2.005 25487
3320 1 12 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.056 -2.260 25487
3321 1 12 . 1 1 24 24 PHE H H 24 7.821 7.821 7.667 0.154 25487
3322 1 12 . 1 1 25 25 LYS N N 25 123.768 123.768 122.705 1.063 25487
3323 1 12 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.996 0.050 25487
3324 1 12 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.884 -2.246 25487
3325 1 12 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.988 -1.911 25487
3326 1 12 . 1 1 25 25 LYS H H 25 9.119 9.119 8.438 0.681 25487
3327 1 12 . 1 1 26 26 TYR N N 26 123.059 123.059 121.099 1.960 25487
3328 1 12 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.346 0.653 25487
3329 1 12 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.380 -4.560 25487
3330 1 12 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.000 -4.259 25487
3331 1 12 . 1 1 26 26 TYR H H 26 7.884 7.884 7.649 0.235 25487
3332 1 12 . 1 1 27 27 VAL N N 27 116.468 116.468 115.262 1.206 25487
3333 1 12 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.524 -0.153 25487
3334 1 12 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.714 -2.199 25487
3335 1 12 . 1 1 27 27 VAL CB C 27 31.945 31.945 33.648 -1.704 25487
3336 1 12 . 1 1 27 27 VAL H H 27 9.012 9.012 9.122 -0.110 25487
3337 1 12 . 1 1 28 28 CYS N N 28 124.932 124.932 126.264 -1.332 25487
3338 1 12 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.708 0.046 25487
3339 1 12 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.470 -6.270 25487
3340 1 12 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.432 11.355 25487
3341 1 12 . 1 1 28 28 CYS H H 28 8.874 8.874 9.052 -0.178 25487
3342 1 12 . 1 1 29 29 ASP N N 29 131.592 131.592 129.237 2.355 25487
3343 1 12 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.728 0.217 25487
3344 1 12 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.965 -3.909 25487
3345 1 12 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.776 -5.307 25487
3346 1 12 . 1 1 29 29 ASP H H 29 8.603 8.603 8.610 -0.007 25487
3347 1 12 . 1 1 30 30 CYS N N 30 122.694 122.694 118.032 4.662 25487
3348 1 12 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.758 1.045 25487
3349 1 12 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.800 -5.411 25487
3350 1 12 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.660 14.273 25487
3351 1 12 . 1 1 30 30 CYS H H 30 8.480 8.480 7.986 0.494 25487
3352 1 12 . 1 1 31 31 PHE N N 31 121.135 121.135 120.612 0.523 25487
3353 1 12 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.681 0.106 25487
3354 1 12 . 1 1 31 31 PHE CB C 31 38.328 38.328 42.509 -4.181 25487
3355 1 12 . 1 1 31 31 PHE H H 31 9.062 9.062 8.745 0.317 25487
3356 1 12 . 1 1 32 32 TYR N N 32 120.021 120.021 116.377 3.644 25487
3357 1 12 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.350 -0.360 25487
3358 1 12 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.727 -1.988 25487
3359 1 12 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.844 -4.362 25487
3360 1 12 . 1 1 32 32 TYR H H 32 8.614 8.614 8.522 0.092 25487
3361 1 12 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.325 0.175 25487
3362 1 12 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.328 -2.839 25487
3363 1 12 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.331 -0.678 25487
3364 1 12 . 1 1 34 34 GLU N N 34 119.222 119.222 120.106 -0.884 25487
3365 1 12 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.955 0.390 25487
3366 1 12 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.387 -3.690 25487
3367 1 12 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.146 -3.087 25487
3368 1 12 . 1 1 34 34 GLU H H 34 8.516 8.516 8.672 -0.156 25487
3369 1 12 . 1 1 35 35 GLY N N 35 109.836 109.836 105.173 4.663 25487
3370 1 12 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.945 -2.526 25487
3371 1 12 . 1 1 35 35 GLY H H 35 8.209 8.209 7.576 0.633 25487
3372 1 12 . 1 1 36 36 GLU N N 36 119.666 119.666 121.095 -1.429 25487
3373 1 12 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.547 0.678 25487
3374 1 12 . 1 1 36 36 GLU CA C 36 53.566 53.566 57.131 -3.565 25487
3375 1 12 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.585 -3.415 25487
3376 1 12 . 1 1 36 36 GLU H H 36 8.190 8.190 8.527 -0.337 25487
3377 1 12 . 1 1 37 37 ASP N N 37 117.788 117.788 118.989 -1.201 25487
3378 1 12 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.603 -0.073 25487
3379 1 12 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.305 -3.471 25487
3380 1 12 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.359 -4.236 25487
3381 1 12 . 1 1 37 37 ASP H H 37 8.305 8.305 8.213 0.092 25487
3382 1 12 . 1 1 38 38 LYS N N 38 119.545 119.545 118.775 0.770 25487
3383 1 12 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.661 -0.195 25487
3384 1 12 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.508 -3.160 25487
3385 1 12 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.982 -4.368 25487
3386 1 12 . 1 1 38 38 LYS H H 38 7.950 7.950 7.880 0.070 25487
3387 1 12 . 1 1 39 39 THR N N 39 115.195 115.195 114.808 0.387 25487
3388 1 12 . 1 1 39 39 THR HA H 39 4.323 4.323 4.651 -0.328 25487
3389 1 12 . 1 1 39 39 THR CA C 39 59.508 59.508 62.062 -2.554 25487
3390 1 12 . 1 1 39 39 THR CB C 39 67.653 67.653 71.456 -3.803 25487
3391 1 12 . 1 1 39 39 THR H H 39 7.888 7.888 8.102 -0.214 25487
3392 1 12 . 1 1 40 40 GLU N N 40 124.664 124.664 126.278 -1.614 25487
3393 1 12 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.729 -0.763 25487
3394 1 12 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.416 -2.387 25487
3395 1 12 . 1 1 40 40 GLU CB C 40 26.467 26.467 29.872 -3.405 25487
3396 1 12 . 1 1 40 40 GLU H H 40 8.345 8.345 8.588 -0.243 25487
3397 1 12 . 1 1 41 41 VAL N N 41 124.551 124.551 124.970 -0.419 25487
3398 1 12 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.363 -0.262 25487
3399 1 12 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.049 -2.654 25487
3400 1 12 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.669 -2.774 25487
3401 1 12 . 1 1 41 41 VAL H H 41 8.377 8.377 8.477 -0.100 25487
3402 1 12 . 1 1 42 42 CYS N N 42 122.732 122.732 126.384 -3.652 25487
3403 1 12 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.318 0.437 25487
3404 1 12 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.456 -5.612 25487
3405 1 12 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.552 15.928 25487
3406 1 12 . 1 1 42 42 CYS H H 42 8.712 8.712 9.019 -0.307 25487
3407 1 12 . 1 1 43 43 SER N N 43 117.527 117.527 116.008 1.519 25487
3408 1 12 . 1 1 43 43 SER HA H 43 5.220 5.220 5.272 -0.052 25487
3409 1 12 . 1 1 43 43 SER CA C 43 54.110 54.110 56.332 -2.222 25487
3410 1 12 . 1 1 43 43 SER CB C 43 64.091 64.091 65.625 -1.534 25487
3411 1 12 . 1 1 43 43 SER H H 43 8.828 8.828 8.900 -0.072 25487
3412 1 12 . 1 1 44 44 CYS N N 44 120.721 120.721 122.654 -1.933 25487
3413 1 12 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.532 0.681 25487
3414 1 12 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.934 -6.906 25487
3415 1 12 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.107 10.718 25487
3416 1 12 . 1 1 44 44 CYS H H 44 7.936 7.936 8.715 -0.779 25487
3417 1 12 . 1 1 45 45 GLN N N 45 124.614 124.614 125.487 -0.873 25487
3418 1 12 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.694 -0.050 25487
3419 1 12 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.918 -7.485 25487
3420 1 12 . 1 1 45 45 GLN H H 45 9.892 9.892 9.202 0.690 25487
3421 1 12 . 1 1 46 46 GLN N N 46 120.933 120.933 120.144 0.789 25487
3422 1 12 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.765 0.261 25487
3423 1 12 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.195 -3.530 25487
3424 1 12 . 1 1 46 46 GLN H H 46 8.849 8.849 8.569 0.280 25487
3425 1 12 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.612 -0.092 25487
3426 1 12 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.648 -2.241 25487
3427 1 12 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.915 -3.166 25487
3428 1 12 . 1 1 48 48 LYS N N 48 124.003 124.003 122.497 1.506 25487
3429 1 12 . 1 1 48 48 LYS HA H 48 4.053 4.053 4.021 0.032 25487
3430 1 12 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.541 -2.957 25487
3431 1 12 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.184 -1.620 25487
3432 1 12 . 1 1 48 48 LYS H H 48 8.931 8.931 8.776 0.155 25487
3433 1 12 . 1 1 49 49 SER N N 49 113.527 113.527 114.452 -0.925 25487
3434 1 12 . 1 1 49 49 SER HA H 49 3.995 3.995 4.176 -0.181 25487
3435 1 12 . 1 1 49 49 SER CA C 49 55.458 55.458 61.741 -6.283 25487
3436 1 12 . 1 1 49 49 SER CB C 49 61.270 61.270 62.681 -1.411 25487
3437 1 12 . 1 1 49 49 SER H H 49 8.702 8.702 8.449 0.253 25487
3438 1 12 . 1 1 50 50 HIS N N 50 119.669 119.669 120.811 -1.142 25487
3439 1 12 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.487 -0.160 25487
3440 1 12 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.797 -3.342 25487
3441 1 12 . 1 1 50 50 HIS H H 50 7.664 7.664 7.973 -0.309 25487
3442 1 12 . 1 1 51 51 LYS N N 51 120.030 120.030 119.917 0.113 25487
3443 1 12 . 1 1 51 51 LYS HA H 51 4.093 4.093 3.593 0.500 25487
3444 1 12 . 1 1 51 51 LYS CA C 51 56.752 56.752 60.038 -3.286 25487
3445 1 12 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.384 -2.003 25487
3446 1 12 . 1 1 51 51 LYS H H 51 7.825 7.825 8.071 -0.246 25487
3447 1 12 . 1 1 52 52 ILE N N 52 118.914 118.914 119.523 -0.609 25487
3448 1 12 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.641 0.080 25487
3449 1 12 . 1 1 52 52 ILE CA C 52 61.825 61.825 64.981 -3.156 25487
3450 1 12 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.834 -2.828 25487
3451 1 12 . 1 1 52 52 ILE H H 52 8.223 8.223 7.835 0.389 25487
3452 1 12 . 1 1 53 53 ALA N N 53 120.985 120.985 122.279 -1.294 25487
3453 1 12 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.938 0.018 25487
3454 1 12 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.602 -2.459 25487
3455 1 12 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.850 -1.104 25487
3456 1 12 . 1 1 53 53 ALA H H 53 8.066 8.066 8.178 -0.112 25487
3457 1 12 . 1 1 54 54 GLU N N 54 115.137 115.137 118.313 -3.176 25487
3458 1 12 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.979 -0.046 25487
3459 1 12 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.233 -2.385 25487
3460 1 12 . 1 1 54 54 GLU H H 54 8.160 8.160 8.028 0.132 25487
3461 1 12 . 1 1 55 55 LYS N N 55 118.610 118.610 119.386 -0.776 25487
3462 1 12 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.068 0.088 25487
3463 1 12 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.922 -2.495 25487
3464 1 12 . 1 1 55 55 LYS H H 55 7.732 7.732 7.916 -0.184 25487
3465 1 12 . 1 1 56 56 ILE N N 56 119.173 119.173 120.124 -0.951 25487
3466 1 12 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.643 -0.016 25487
3467 1 12 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.316 -2.418 25487
3468 1 12 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.893 -2.750 25487
3469 1 12 . 1 1 56 56 ILE H H 56 8.022 8.022 8.044 -0.022 25487
3470 1 12 . 1 1 57 57 ILE N N 57 120.239 120.239 120.015 0.224 25487
3471 1 12 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.481 0.107 25487
3472 1 12 . 1 1 57 57 ILE CA C 57 62.898 62.898 65.889 -2.991 25487
3473 1 12 . 1 1 57 57 ILE CB C 57 35.037 35.037 37.294 -2.257 25487
3474 1 12 . 1 1 57 57 ILE H H 57 8.370 8.370 8.057 0.313 25487
3475 1 12 . 1 1 58 58 ASP N N 58 118.234 118.234 121.208 -2.974 25487
3476 1 12 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.314 0.098 25487
3477 1 12 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.499 -3.325 25487
3478 1 12 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.212 -4.017 25487
3479 1 12 . 1 1 58 58 ASP H H 58 8.458 8.458 8.488 -0.030 25487
3480 1 12 . 1 1 59 59 LYS N N 59 119.380 119.380 118.813 0.567 25487
3481 1 12 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.031 0.219 25487
3482 1 12 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.806 -3.875 25487
3483 1 12 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.210 -2.149 25487
3484 1 12 . 1 1 59 59 LYS H H 59 7.928 7.928 8.078 -0.150 25487
3485 1 12 . 1 1 60 60 ALA N N 60 123.604 123.604 122.552 1.052 25487
3486 1 12 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.112 -0.127 25487
3487 1 12 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.357 -2.544 25487
3488 1 12 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.405 -2.608 25487
3489 1 12 . 1 1 60 60 ALA H H 60 8.699 8.699 8.256 0.443 25487
3490 1 12 . 1 1 61 61 LYS N N 61 115.317 115.317 117.999 -2.682 25487
3491 1 12 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.128 -0.110 25487
3492 1 12 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.721 -1.936 25487
3493 1 12 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.041 -1.534 25487
3494 1 12 . 1 1 61 61 LYS H H 61 8.361 8.361 8.188 0.173 25487
3495 1 12 . 1 1 62 62 THR N N 62 107.298 107.298 114.562 -7.264 25487
3496 1 12 . 1 1 62 62 THR HA H 62 4.368 4.368 4.214 0.154 25487
3497 1 12 . 1 1 62 62 THR CA C 62 60.427 60.427 65.326 -4.899 25487
3498 1 12 . 1 1 62 62 THR CB C 62 67.179 67.179 69.219 -2.040 25487
3499 1 12 . 1 1 62 62 THR H H 62 7.510 7.510 8.250 -0.740 25487
3500 1 12 . 1 1 63 63 THR N N 63 115.701 115.701 114.730 0.971 25487
3501 1 12 . 1 1 63 63 THR HA H 63 4.328 4.328 4.310 0.018 25487
3502 1 12 . 1 1 63 63 THR CA C 63 61.695 61.695 62.976 -1.281 25487
3503 1 12 . 1 1 63 63 THR CB C 63 67.641 67.641 70.236 -2.595 25487
3504 1 12 . 1 1 63 63 THR H H 63 7.651 7.651 7.519 0.132 25487
3505 1 13 . 1 1 2 2 LYS N N 2 121.111 121.111 121.838 -0.727 25487
3506 1 13 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.472 -0.147 25487
3507 1 13 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.146 -2.483 25487
3508 1 13 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.858 -3.442 25487
3509 1 13 . 1 1 2 2 LYS H H 2 8.492 8.492 8.432 0.060 25487
3510 1 13 . 1 1 3 3 ALA N N 3 126.440 126.440 122.734 3.706 25487
3511 1 13 . 1 1 3 3 ALA HA H 3 4.425 4.425 3.919 0.506 25487
3512 1 13 . 1 1 3 3 ALA CA C 3 49.447 49.447 53.150 -3.703 25487
3513 1 13 . 1 1 3 3 ALA CB C 3 16.905 16.905 17.443 -0.538 25487
3514 1 13 . 1 1 3 3 ALA H H 3 8.357 8.357 8.582 -0.225 25487
3515 1 13 . 1 1 4 4 CYS N N 4 116.834 116.834 117.844 -1.010 25487
3516 1 13 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.738 0.165 25487
3517 1 13 . 1 1 4 4 CYS CA C 4 51.793 51.793 57.945 -6.152 25487
3518 1 13 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.724 10.570 25487
3519 1 13 . 1 1 4 4 CYS H H 4 8.145 8.145 7.912 0.233 25487
3520 1 13 . 1 1 5 5 THR N N 5 121.220 121.220 120.838 0.382 25487
3521 1 13 . 1 1 5 5 THR HA H 5 4.481 4.481 4.608 -0.127 25487
3522 1 13 . 1 1 5 5 THR CA C 5 58.256 58.256 60.782 -2.526 25487
3523 1 13 . 1 1 5 5 THR CB C 5 67.043 67.043 69.040 -1.997 25487
3524 1 13 . 1 1 5 5 THR H H 5 9.070 9.070 8.567 0.503 25487
3525 1 13 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.425 -0.173 25487
3526 1 13 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.410 -3.171 25487
3527 1 13 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.150 -1.621 25487
3528 1 13 . 1 1 7 7 LEU N N 7 119.270 119.270 120.027 -0.757 25487
3529 1 13 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.905 -0.649 25487
3530 1 13 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.847 -1.787 25487
3531 1 13 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.221 -3.015 25487
3532 1 13 . 1 1 7 7 LEU H H 7 7.797 7.797 7.713 0.084 25487
3533 1 13 . 1 1 8 8 LEU N N 8 119.586 119.586 123.701 -4.115 25487
3534 1 13 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.020 -0.198 25487
3535 1 13 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.649 -0.726 25487
3536 1 13 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.791 -3.189 25487
3537 1 13 . 1 1 8 8 LEU H H 8 9.465 9.465 8.352 1.113 25487
3538 1 13 . 1 1 9 9 HIS N N 9 117.507 117.507 116.823 0.684 25487
3539 1 13 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.802 -0.056 25487
3540 1 13 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.360 -1.933 25487
3541 1 13 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.841 -6.733 25487
3542 1 13 . 1 1 9 9 HIS H H 9 8.159 8.159 7.778 0.381 25487
3543 1 13 . 1 1 10 10 ASP N N 10 119.492 119.492 120.189 -0.697 25487
3544 1 13 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.497 0.386 25487
3545 1 13 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.257 -1.919 25487
3546 1 13 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.111 -0.641 25487
3547 1 13 . 1 1 10 10 ASP H H 10 8.341 8.341 8.496 -0.155 25487
3548 1 13 . 1 1 11 11 CYS N N 11 121.767 121.767 118.348 3.419 25487
3549 1 13 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.767 0.362 25487
3550 1 13 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.721 -3.965 25487
3551 1 13 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.766 13.470 25487
3552 1 13 . 1 1 11 11 CYS H H 11 8.017 8.017 8.344 -0.327 25487
3553 1 13 . 1 1 12 12 SER N N 12 118.618 118.618 118.791 -0.173 25487
3554 1 13 . 1 1 12 12 SER HA H 12 3.759 3.759 4.149 -0.390 25487
3555 1 13 . 1 1 12 12 SER CB C 12 59.972 59.972 63.090 -3.118 25487
3556 1 13 . 1 1 12 12 SER H H 12 8.844 8.844 8.390 0.454 25487
3557 1 13 . 1 1 13 13 HIS N N 13 117.166 117.166 115.971 1.195 25487
3558 1 13 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.700 -0.078 25487
3559 1 13 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.864 -4.411 25487
3560 1 13 . 1 1 13 13 HIS H H 13 8.547 8.547 7.762 0.785 25487
3561 1 13 . 1 1 14 14 ASP N N 14 117.382 117.382 118.945 -1.563 25487
3562 1 13 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.872 -0.181 25487
3563 1 13 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.567 -3.375 25487
3564 1 13 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.807 -6.383 25487
3565 1 13 . 1 1 14 14 ASP H H 14 7.224 7.224 7.814 -0.590 25487
3566 1 13 . 1 1 15 15 ARG N N 15 124.498 124.498 123.001 1.497 25487
3567 1 13 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.201 0.516 25487
3568 1 13 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.633 -4.100 25487
3569 1 13 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.480 -0.088 25487
3570 1 13 . 1 1 15 15 ARG H H 15 9.004 9.004 8.632 0.372 25487
3571 1 13 . 1 1 16 16 HIS N N 16 116.269 116.269 115.319 0.950 25487
3572 1 13 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.816 0.252 25487
3573 1 13 . 1 1 16 16 HIS CA C 16 52.475 52.475 56.138 -3.663 25487
3574 1 13 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.985 -4.309 25487
3575 1 13 . 1 1 16 16 HIS H H 16 8.528 8.528 8.338 0.190 25487
3576 1 13 . 1 1 17 17 SER N N 17 112.719 112.719 116.298 -3.579 25487
3577 1 13 . 1 1 17 17 SER HA H 17 4.493 4.493 4.384 0.109 25487
3578 1 13 . 1 1 17 17 SER CA C 17 56.591 56.591 60.392 -3.800 25487
3579 1 13 . 1 1 17 17 SER CB C 17 62.736 62.736 64.089 -1.353 25487
3580 1 13 . 1 1 17 17 SER H H 17 7.503 7.503 7.634 -0.131 25487
3581 1 13 . 1 1 18 18 CYS N N 18 122.070 122.070 120.443 1.627 25487
3582 1 13 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.525 0.549 25487
3583 1 13 . 1 1 18 18 CYS CA C 18 54.574 54.574 58.867 -4.293 25487
3584 1 13 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.691 10.134 25487
3585 1 13 . 1 1 18 18 CYS H H 18 8.651 8.651 8.072 0.579 25487
3586 1 13 . 1 1 19 19 CYS N N 19 118.243 118.243 123.067 -4.824 25487
3587 1 13 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.471 0.049 25487
3588 1 13 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.022 -6.474 25487
3589 1 13 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.904 10.486 25487
3590 1 13 . 1 1 19 19 CYS H H 19 8.936 8.936 8.482 0.454 25487
3591 1 13 . 1 1 20 20 ARG N N 20 116.858 116.858 121.392 -4.534 25487
3592 1 13 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.220 -0.121 25487
3593 1 13 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.427 -3.422 25487
3594 1 13 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.312 -1.683 25487
3595 1 13 . 1 1 20 20 ARG H H 20 8.136 8.136 8.545 -0.409 25487
3596 1 13 . 1 1 21 21 GLY N N 21 110.611 110.611 111.184 -0.573 25487
3597 1 13 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.763 -1.967 25487
3598 1 13 . 1 1 21 21 GLY H H 21 7.569 7.569 7.688 -0.119 25487
3599 1 13 . 1 1 22 22 ASP N N 22 121.161 121.161 119.577 1.584 25487
3600 1 13 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.563 -0.228 25487
3601 1 13 . 1 1 22 22 ASP CA C 22 53.663 53.663 55.995 -2.332 25487
3602 1 13 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.213 -4.829 25487
3603 1 13 . 1 1 22 22 ASP H H 22 8.674 8.674 8.689 -0.015 25487
3604 1 13 . 1 1 23 23 MET N N 23 114.811 114.811 116.535 -1.724 25487
3605 1 13 . 1 1 23 23 MET HA H 23 4.218 4.218 4.091 0.127 25487
3606 1 13 . 1 1 23 23 MET CA C 23 53.190 53.190 56.007 -2.817 25487
3607 1 13 . 1 1 23 23 MET CB C 23 30.586 30.586 33.520 -2.934 25487
3608 1 13 . 1 1 23 23 MET H H 23 8.333 8.333 7.870 0.463 25487
3609 1 13 . 1 1 24 24 PHE N N 24 116.019 116.019 114.727 1.292 25487
3610 1 13 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.852 -0.025 25487
3611 1 13 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.455 2.086 25487
3612 1 13 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.444 -2.648 25487
3613 1 13 . 1 1 24 24 PHE H H 24 7.821 7.821 7.891 -0.070 25487
3614 1 13 . 1 1 25 25 LYS N N 25 123.768 123.768 119.887 3.881 25487
3615 1 13 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.071 -0.025 25487
3616 1 13 . 1 1 25 25 LYS CA C 25 54.638 54.638 55.861 -1.223 25487
3617 1 13 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.697 -2.620 25487
3618 1 13 . 1 1 25 25 LYS H H 25 9.119 9.119 8.305 0.815 25487
3619 1 13 . 1 1 26 26 TYR N N 26 123.059 123.059 120.530 2.529 25487
3620 1 13 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.452 0.547 25487
3621 1 13 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.632 -3.812 25487
3622 1 13 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.019 -4.278 25487
3623 1 13 . 1 1 26 26 TYR H H 26 7.884 7.884 7.617 0.267 25487
3624 1 13 . 1 1 27 27 VAL N N 27 116.468 116.468 118.308 -1.840 25487
3625 1 13 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.396 -0.025 25487
3626 1 13 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.708 -2.193 25487
3627 1 13 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.967 -4.022 25487
3628 1 13 . 1 1 27 27 VAL H H 27 9.012 9.012 9.011 0.001 25487
3629 1 13 . 1 1 28 28 CYS N N 28 124.932 124.932 127.533 -2.601 25487
3630 1 13 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.702 0.052 25487
3631 1 13 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.828 -5.628 25487
3632 1 13 . 1 1 28 28 CYS CB C 28 37.787 37.787 25.942 11.845 25487
3633 1 13 . 1 1 28 28 CYS H H 28 8.874 8.874 8.841 0.033 25487
3634 1 13 . 1 1 29 29 ASP N N 29 131.592 131.592 129.059 2.533 25487
3635 1 13 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.724 0.221 25487
3636 1 13 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.508 -3.452 25487
3637 1 13 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.554 -5.085 25487
3638 1 13 . 1 1 29 29 ASP H H 29 8.603 8.603 8.676 -0.073 25487
3639 1 13 . 1 1 30 30 CYS N N 30 122.694 122.694 117.926 4.768 25487
3640 1 13 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.860 0.943 25487
3641 1 13 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.995 -5.606 25487
3642 1 13 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.871 14.062 25487
3643 1 13 . 1 1 30 30 CYS H H 30 8.480 8.480 8.093 0.387 25487
3644 1 13 . 1 1 31 31 PHE N N 31 121.135 121.135 122.077 -0.942 25487
3645 1 13 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.611 0.176 25487
3646 1 13 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.407 -5.079 25487
3647 1 13 . 1 1 31 31 PHE H H 31 9.062 9.062 8.934 0.129 25487
3648 1 13 . 1 1 32 32 TYR N N 32 120.021 120.021 116.661 3.360 25487
3649 1 13 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.328 -0.338 25487
3650 1 13 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.677 -1.938 25487
3651 1 13 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.790 -4.308 25487
3652 1 13 . 1 1 32 32 TYR H H 32 8.614 8.614 8.585 0.029 25487
3653 1 13 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.396 0.104 25487
3654 1 13 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.219 -2.730 25487
3655 1 13 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.247 -0.594 25487
3656 1 13 . 1 1 34 34 GLU N N 34 119.222 119.222 118.060 1.162 25487
3657 1 13 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.965 0.380 25487
3658 1 13 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.506 -3.809 25487
3659 1 13 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.860 -2.801 25487
3660 1 13 . 1 1 34 34 GLU H H 34 8.516 8.516 8.666 -0.150 25487
3661 1 13 . 1 1 35 35 GLY N N 35 109.836 109.836 103.869 5.967 25487
3662 1 13 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.838 -2.419 25487
3663 1 13 . 1 1 35 35 GLY H H 35 8.209 8.209 7.633 0.576 25487
3664 1 13 . 1 1 36 36 GLU N N 36 119.666 119.666 120.997 -1.331 25487
3665 1 13 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.623 0.602 25487
3666 1 13 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.851 -3.285 25487
3667 1 13 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.291 -3.121 25487
3668 1 13 . 1 1 36 36 GLU H H 36 8.190 8.190 8.540 -0.350 25487
3669 1 13 . 1 1 37 37 ASP N N 37 117.788 117.788 119.115 -1.327 25487
3670 1 13 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.597 -0.067 25487
3671 1 13 . 1 1 37 37 ASP CA C 37 50.834 50.834 53.775 -2.941 25487
3672 1 13 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.574 -4.451 25487
3673 1 13 . 1 1 37 37 ASP H H 37 8.305 8.305 8.286 0.019 25487
3674 1 13 . 1 1 38 38 LYS N N 38 119.545 119.545 119.118 0.427 25487
3675 1 13 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.524 -0.058 25487
3676 1 13 . 1 1 38 38 LYS CA C 38 53.348 53.348 57.024 -3.676 25487
3677 1 13 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.574 -3.960 25487
3678 1 13 . 1 1 38 38 LYS H H 38 7.950 7.950 7.549 0.401 25487
3679 1 13 . 1 1 39 39 THR N N 39 115.195 115.195 114.241 0.954 25487
3680 1 13 . 1 1 39 39 THR HA H 39 4.323 4.323 4.733 -0.410 25487
3681 1 13 . 1 1 39 39 THR CA C 39 59.508 59.508 61.648 -2.140 25487
3682 1 13 . 1 1 39 39 THR CB C 39 67.653 67.653 71.579 -3.926 25487
3683 1 13 . 1 1 39 39 THR H H 39 7.888 7.888 8.017 -0.129 25487
3684 1 13 . 1 1 40 40 GLU N N 40 124.664 124.664 125.066 -0.402 25487
3685 1 13 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.889 -0.923 25487
3686 1 13 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.097 -2.068 25487
3687 1 13 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.327 -3.860 25487
3688 1 13 . 1 1 40 40 GLU H H 40 8.345 8.345 8.533 -0.188 25487
3689 1 13 . 1 1 41 41 VAL N N 41 124.551 124.551 125.784 -1.233 25487
3690 1 13 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.349 -0.248 25487
3691 1 13 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.130 -2.735 25487
3692 1 13 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.092 -2.197 25487
3693 1 13 . 1 1 41 41 VAL H H 41 8.377 8.377 8.813 -0.436 25487
3694 1 13 . 1 1 42 42 CYS N N 42 122.732 122.732 126.177 -3.445 25487
3695 1 13 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.297 0.458 25487
3696 1 13 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.463 -5.619 25487
3697 1 13 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.517 15.963 25487
3698 1 13 . 1 1 42 42 CYS H H 42 8.712 8.712 9.049 -0.337 25487
3699 1 13 . 1 1 43 43 SER N N 43 117.527 117.527 115.504 2.023 25487
3700 1 13 . 1 1 43 43 SER HA H 43 5.220 5.220 5.289 -0.069 25487
3701 1 13 . 1 1 43 43 SER CA C 43 54.110 54.110 56.292 -2.182 25487
3702 1 13 . 1 1 43 43 SER CB C 43 64.091 64.091 66.093 -2.002 25487
3703 1 13 . 1 1 43 43 SER H H 43 8.828 8.828 8.785 0.043 25487
3704 1 13 . 1 1 44 44 CYS N N 44 120.721 120.721 122.575 -1.854 25487
3705 1 13 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.453 0.760 25487
3706 1 13 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.004 -6.976 25487
3707 1 13 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.010 10.815 25487
3708 1 13 . 1 1 44 44 CYS H H 44 7.936 7.936 8.766 -0.830 25487
3709 1 13 . 1 1 45 45 GLN N N 45 124.614 124.614 125.247 -0.633 25487
3710 1 13 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.631 0.013 25487
3711 1 13 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.708 -7.275 25487
3712 1 13 . 1 1 45 45 GLN H H 45 9.892 9.892 9.187 0.705 25487
3713 1 13 . 1 1 46 46 GLN N N 46 120.933 120.933 120.620 0.313 25487
3714 1 13 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.640 0.386 25487
3715 1 13 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.508 -3.843 25487
3716 1 13 . 1 1 46 46 GLN H H 46 8.849 8.849 8.485 0.364 25487
3717 1 13 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.542 -0.022 25487
3718 1 13 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.321 -1.914 25487
3719 1 13 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.994 -3.245 25487
3720 1 13 . 1 1 48 48 LYS N N 48 124.003 124.003 120.663 3.340 25487
3721 1 13 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.920 0.133 25487
3722 1 13 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.375 -3.791 25487
3723 1 13 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.178 -1.614 25487
3724 1 13 . 1 1 48 48 LYS H H 48 8.931 8.931 8.731 0.200 25487
3725 1 13 . 1 1 49 49 SER N N 49 113.527 113.527 114.006 -0.479 25487
3726 1 13 . 1 1 49 49 SER HA H 49 3.995 3.995 4.126 -0.131 25487
3727 1 13 . 1 1 49 49 SER CA C 49 55.458 55.458 61.777 -6.319 25487
3728 1 13 . 1 1 49 49 SER CB C 49 61.270 61.270 62.259 -0.989 25487
3729 1 13 . 1 1 49 49 SER H H 49 8.702 8.702 8.247 0.455 25487
3730 1 13 . 1 1 50 50 HIS N N 50 119.669 119.669 121.404 -1.735 25487
3731 1 13 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.398 -0.071 25487
3732 1 13 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.780 -3.325 25487
3733 1 13 . 1 1 50 50 HIS H H 50 7.664 7.664 8.315 -0.651 25487
3734 1 13 . 1 1 51 51 LYS N N 51 120.030 120.030 120.382 -0.352 25487
3735 1 13 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.098 -0.005 25487
3736 1 13 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.516 -2.764 25487
3737 1 13 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.316 -1.935 25487
3738 1 13 . 1 1 51 51 LYS H H 51 7.825 7.825 8.072 -0.247 25487
3739 1 13 . 1 1 52 52 ILE N N 52 118.914 118.914 120.230 -1.316 25487
3740 1 13 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.759 -0.038 25487
3741 1 13 . 1 1 52 52 ILE CA C 52 61.825 61.825 63.868 -2.043 25487
3742 1 13 . 1 1 52 52 ILE CB C 52 35.006 35.006 36.726 -1.720 25487
3743 1 13 . 1 1 52 52 ILE H H 52 8.223 8.223 8.075 0.148 25487
3744 1 13 . 1 1 53 53 ALA N N 53 120.985 120.985 121.527 -0.542 25487
3745 1 13 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.926 0.030 25487
3746 1 13 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.593 -2.450 25487
3747 1 13 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.974 -1.228 25487
3748 1 13 . 1 1 53 53 ALA H H 53 8.066 8.066 8.386 -0.320 25487
3749 1 13 . 1 1 54 54 GLU N N 54 115.137 115.137 118.341 -3.204 25487
3750 1 13 . 1 1 54 54 GLU HA H 54 3.933 3.933 4.054 -0.121 25487
3751 1 13 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.588 -2.740 25487
3752 1 13 . 1 1 54 54 GLU H H 54 8.160 8.160 8.167 -0.007 25487
3753 1 13 . 1 1 55 55 LYS N N 55 118.610 118.610 119.723 -1.113 25487
3754 1 13 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.092 0.064 25487
3755 1 13 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.298 -2.872 25487
3756 1 13 . 1 1 55 55 LYS H H 55 7.732 7.732 8.032 -0.300 25487
3757 1 13 . 1 1 56 56 ILE N N 56 119.173 119.173 121.936 -2.763 25487
3758 1 13 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.726 -0.099 25487
3759 1 13 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.194 -2.296 25487
3760 1 13 . 1 1 56 56 ILE CB C 56 35.143 35.143 38.092 -2.949 25487
3761 1 13 . 1 1 56 56 ILE H H 56 8.022 8.022 8.002 0.020 25487
3762 1 13 . 1 1 57 57 ILE N N 57 120.239 120.239 120.037 0.202 25487
3763 1 13 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.607 -0.019 25487
3764 1 13 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.248 -1.350 25487
3765 1 13 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.210 -1.173 25487
3766 1 13 . 1 1 57 57 ILE H H 57 8.370 8.370 8.118 0.252 25487
3767 1 13 . 1 1 58 58 ASP N N 58 118.234 118.234 120.455 -2.221 25487
3768 1 13 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.381 0.031 25487
3769 1 13 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.815 -3.641 25487
3770 1 13 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.334 -4.139 25487
3771 1 13 . 1 1 58 58 ASP H H 58 8.458 8.458 8.463 -0.005 25487
3772 1 13 . 1 1 59 59 LYS N N 59 119.380 119.380 120.215 -0.835 25487
3773 1 13 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.933 0.317 25487
3774 1 13 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.173 -4.242 25487
3775 1 13 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.419 -2.358 25487
3776 1 13 . 1 1 59 59 LYS H H 59 7.928 7.928 7.920 0.008 25487
3777 1 13 . 1 1 60 60 ALA N N 60 123.604 123.604 121.289 2.315 25487
3778 1 13 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.105 -0.120 25487
3779 1 13 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.320 -2.507 25487
3780 1 13 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.431 -2.634 25487
3781 1 13 . 1 1 60 60 ALA H H 60 8.699 8.699 8.231 0.468 25487
3782 1 13 . 1 1 61 61 LYS N N 61 115.317 115.317 118.042 -2.725 25487
3783 1 13 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.277 -0.259 25487
3784 1 13 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.370 -1.585 25487
3785 1 13 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.060 -1.554 25487
3786 1 13 . 1 1 61 61 LYS H H 61 8.361 8.361 8.224 0.137 25487
3787 1 13 . 1 1 62 62 THR N N 62 107.298 107.298 114.611 -7.313 25487
3788 1 13 . 1 1 62 62 THR HA H 62 4.368 4.368 4.233 0.135 25487
3789 1 13 . 1 1 62 62 THR CA C 62 60.427 60.427 64.949 -4.522 25487
3790 1 13 . 1 1 62 62 THR CB C 62 67.179 67.179 69.205 -2.026 25487
3791 1 13 . 1 1 62 62 THR H H 62 7.510 7.510 8.155 -0.645 25487
3792 1 13 . 1 1 63 63 THR N N 63 115.701 115.701 115.733 -0.032 25487
3793 1 13 . 1 1 63 63 THR HA H 63 4.328 4.328 4.324 0.004 25487
3794 1 13 . 1 1 63 63 THR CA C 63 61.695 61.695 64.167 -2.472 25487
3795 1 13 . 1 1 63 63 THR CB C 63 67.641 67.641 69.538 -1.897 25487
3796 1 13 . 1 1 63 63 THR H H 63 7.651 7.651 7.615 0.036 25487
3797 1 14 . 1 1 2 2 LYS N N 2 121.111 121.111 121.632 -0.521 25487
3798 1 14 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.518 -0.193 25487
3799 1 14 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.255 -2.591 25487
3800 1 14 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.536 -3.121 25487
3801 1 14 . 1 1 2 2 LYS H H 2 8.492 8.492 8.180 0.312 25487
3802 1 14 . 1 1 3 3 ALA N N 3 126.440 126.440 127.295 -0.855 25487
3803 1 14 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.475 -0.050 25487
3804 1 14 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.798 -2.351 25487
3805 1 14 . 1 1 3 3 ALA CB C 3 16.905 16.905 17.387 -0.482 25487
3806 1 14 . 1 1 3 3 ALA H H 3 8.357 8.357 8.773 -0.416 25487
3807 1 14 . 1 1 4 4 CYS N N 4 116.834 116.834 117.275 -0.441 25487
3808 1 14 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.726 0.177 25487
3809 1 14 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.739 -4.946 25487
3810 1 14 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.568 10.726 25487
3811 1 14 . 1 1 4 4 CYS H H 4 8.145 8.145 7.424 0.721 25487
3812 1 14 . 1 1 5 5 THR N N 5 121.220 121.220 117.439 3.781 25487
3813 1 14 . 1 1 5 5 THR HA H 5 4.481 4.481 4.830 -0.349 25487
3814 1 14 . 1 1 5 5 THR CA C 5 58.256 58.256 60.400 -2.144 25487
3815 1 14 . 1 1 5 5 THR CB C 5 67.043 67.043 68.546 -1.503 25487
3816 1 14 . 1 1 5 5 THR H H 5 9.070 9.070 8.483 0.587 25487
3817 1 14 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.444 -0.193 25487
3818 1 14 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.153 -2.914 25487
3819 1 14 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.453 -1.924 25487
3820 1 14 . 1 1 7 7 LEU N N 7 119.270 119.270 120.193 -0.923 25487
3821 1 14 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.930 -0.674 25487
3822 1 14 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.351 -1.291 25487
3823 1 14 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.270 -3.064 25487
3824 1 14 . 1 1 7 7 LEU H H 7 7.797 7.797 8.024 -0.227 25487
3825 1 14 . 1 1 8 8 LEU N N 8 119.586 119.586 121.858 -2.272 25487
3826 1 14 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.885 -0.063 25487
3827 1 14 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.809 -0.885 25487
3828 1 14 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.521 -2.919 25487
3829 1 14 . 1 1 8 8 LEU H H 8 9.465 9.465 8.726 0.739 25487
3830 1 14 . 1 1 9 9 HIS N N 9 117.507 117.507 116.406 1.101 25487
3831 1 14 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.704 0.042 25487
3832 1 14 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.432 -2.005 25487
3833 1 14 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.802 -6.694 25487
3834 1 14 . 1 1 9 9 HIS H H 9 8.159 8.159 7.989 0.170 25487
3835 1 14 . 1 1 10 10 ASP N N 10 119.492 119.492 121.816 -2.324 25487
3836 1 14 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.679 0.204 25487
3837 1 14 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.867 -3.529 25487
3838 1 14 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.772 -1.302 25487
3839 1 14 . 1 1 10 10 ASP H H 10 8.341 8.341 8.659 -0.318 25487
3840 1 14 . 1 1 11 11 CYS N N 11 121.767 121.767 120.906 0.861 25487
3841 1 14 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.939 0.190 25487
3842 1 14 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.802 -4.046 25487
3843 1 14 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.187 14.049 25487
3844 1 14 . 1 1 11 11 CYS H H 11 8.017 8.017 8.358 -0.341 25487
3845 1 14 . 1 1 12 12 SER N N 12 118.618 118.618 120.263 -1.645 25487
3846 1 14 . 1 1 12 12 SER HA H 12 3.759 3.759 4.154 -0.395 25487
3847 1 14 . 1 1 12 12 SER CB C 12 59.972 59.972 62.449 -2.477 25487
3848 1 14 . 1 1 12 12 SER H H 12 8.844 8.844 8.251 0.593 25487
3849 1 14 . 1 1 13 13 HIS N N 13 117.166 117.166 117.829 -0.663 25487
3850 1 14 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.780 -0.158 25487
3851 1 14 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.075 -4.622 25487
3852 1 14 . 1 1 13 13 HIS H H 13 8.547 8.547 8.081 0.466 25487
3853 1 14 . 1 1 14 14 ASP N N 14 117.382 117.382 119.993 -2.611 25487
3854 1 14 . 1 1 14 14 ASP HA H 14 4.691 4.691 5.011 -0.320 25487
3855 1 14 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.755 -2.562 25487
3856 1 14 . 1 1 14 14 ASP CB C 14 36.424 36.424 41.853 -5.429 25487
3857 1 14 . 1 1 14 14 ASP H H 14 7.224 7.224 7.859 -0.635 25487
3858 1 14 . 1 1 15 15 ARG N N 15 124.498 124.498 122.317 2.181 25487
3859 1 14 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.296 0.421 25487
3860 1 14 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.495 -4.962 25487
3861 1 14 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.985 -0.593 25487
3862 1 14 . 1 1 15 15 ARG H H 15 9.004 9.004 8.513 0.491 25487
3863 1 14 . 1 1 16 16 HIS N N 16 116.269 116.269 117.109 -0.840 25487
3864 1 14 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.779 0.289 25487
3865 1 14 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.766 -3.291 25487
3866 1 14 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.395 -3.719 25487
3867 1 14 . 1 1 16 16 HIS H H 16 8.528 8.528 8.522 0.006 25487
3868 1 14 . 1 1 17 17 SER N N 17 112.719 112.719 115.461 -2.742 25487
3869 1 14 . 1 1 17 17 SER HA H 17 4.493 4.493 4.497 -0.004 25487
3870 1 14 . 1 1 17 17 SER CA C 17 56.591 56.591 59.520 -2.929 25487
3871 1 14 . 1 1 17 17 SER CB C 17 62.736 62.736 63.800 -1.064 25487
3872 1 14 . 1 1 17 17 SER H H 17 7.503 7.503 8.311 -0.808 25487
3873 1 14 . 1 1 18 18 CYS N N 18 122.070 122.070 120.944 1.126 25487
3874 1 14 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.408 0.666 25487
3875 1 14 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.090 -5.516 25487
3876 1 14 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.251 9.574 25487
3877 1 14 . 1 1 18 18 CYS H H 18 8.651 8.651 7.882 0.769 25487
3878 1 14 . 1 1 19 19 CYS N N 19 118.243 118.243 122.470 -4.227 25487
3879 1 14 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.456 0.064 25487
3880 1 14 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.346 -6.798 25487
3881 1 14 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.819 11.571 25487
3882 1 14 . 1 1 19 19 CYS H H 19 8.936 8.936 8.257 0.679 25487
3883 1 14 . 1 1 20 20 ARG N N 20 116.858 116.858 122.889 -6.031 25487
3884 1 14 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.001 0.098 25487
3885 1 14 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.417 -3.412 25487
3886 1 14 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.311 -1.682 25487
3887 1 14 . 1 1 20 20 ARG H H 20 8.136 8.136 8.480 -0.344 25487
3888 1 14 . 1 1 21 21 GLY N N 21 110.611 110.611 109.588 1.023 25487
3889 1 14 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.449 -1.653 25487
3890 1 14 . 1 1 21 21 GLY H H 21 7.569 7.569 7.621 -0.052 25487
3891 1 14 . 1 1 22 22 ASP N N 22 121.161 121.161 118.635 2.526 25487
3892 1 14 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.564 -0.229 25487
3893 1 14 . 1 1 22 22 ASP CA C 22 53.663 53.663 55.923 -2.260 25487
3894 1 14 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.131 -4.747 25487
3895 1 14 . 1 1 22 22 ASP H H 22 8.674 8.674 8.605 0.069 25487
3896 1 14 . 1 1 23 23 MET N N 23 114.811 114.811 114.897 -0.086 25487
3897 1 14 . 1 1 23 23 MET HA H 23 4.218 4.218 4.097 0.121 25487
3898 1 14 . 1 1 23 23 MET CA C 23 53.190 53.190 55.995 -2.805 25487
3899 1 14 . 1 1 23 23 MET CB C 23 30.586 30.586 33.934 -3.349 25487
3900 1 14 . 1 1 23 23 MET H H 23 8.333 8.333 7.649 0.684 25487
3901 1 14 . 1 1 24 24 PHE N N 24 116.019 116.019 113.479 2.540 25487
3902 1 14 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.752 0.075 25487
3903 1 14 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.872 1.669 25487
3904 1 14 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.827 -3.031 25487
3905 1 14 . 1 1 24 24 PHE H H 24 7.821 7.821 7.603 0.218 25487
3906 1 14 . 1 1 25 25 LYS N N 25 123.768 123.768 119.625 4.143 25487
3907 1 14 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.065 -0.019 25487
3908 1 14 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.089 -1.451 25487
3909 1 14 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.664 -2.587 25487
3910 1 14 . 1 1 25 25 LYS H H 25 9.119 9.119 8.191 0.928 25487
3911 1 14 . 1 1 26 26 TYR N N 26 123.059 123.059 120.538 2.521 25487
3912 1 14 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.268 0.731 25487
3913 1 14 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.935 -4.115 25487
3914 1 14 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.277 -4.536 25487
3915 1 14 . 1 1 26 26 TYR H H 26 7.884 7.884 7.544 0.340 25487
3916 1 14 . 1 1 27 27 VAL N N 27 116.468 116.468 117.262 -0.794 25487
3917 1 14 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.382 -0.011 25487
3918 1 14 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.794 -2.279 25487
3919 1 14 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.528 -3.583 25487
3920 1 14 . 1 1 27 27 VAL H H 27 9.012 9.012 9.036 -0.024 25487
3921 1 14 . 1 1 28 28 CYS N N 28 124.932 124.932 127.213 -2.281 25487
3922 1 14 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.759 -0.005 25487
3923 1 14 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.776 -5.576 25487
3924 1 14 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.467 11.320 25487
3925 1 14 . 1 1 28 28 CYS H H 28 8.874 8.874 8.703 0.171 25487
3926 1 14 . 1 1 29 29 ASP N N 29 131.592 131.592 129.070 2.522 25487
3927 1 14 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.925 0.020 25487
3928 1 14 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.719 -3.663 25487
3929 1 14 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.680 -6.211 25487
3930 1 14 . 1 1 29 29 ASP H H 29 8.603 8.603 8.732 -0.129 25487
3931 1 14 . 1 1 30 30 CYS N N 30 122.694 122.694 118.681 4.013 25487
3932 1 14 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.931 0.872 25487
3933 1 14 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.189 -5.800 25487
3934 1 14 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.322 14.611 25487
3935 1 14 . 1 1 30 30 CYS H H 30 8.480 8.480 8.439 0.041 25487
3936 1 14 . 1 1 31 31 PHE N N 31 121.135 121.135 121.572 -0.437 25487
3937 1 14 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.363 0.424 25487
3938 1 14 . 1 1 31 31 PHE CB C 31 38.328 38.328 42.760 -4.432 25487
3939 1 14 . 1 1 31 31 PHE H H 31 9.062 9.062 8.833 0.229 25487
3940 1 14 . 1 1 32 32 TYR N N 32 120.021 120.021 116.019 4.002 25487
3941 1 14 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.068 -0.078 25487
3942 1 14 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.823 -2.084 25487
3943 1 14 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.624 -4.142 25487
3944 1 14 . 1 1 32 32 TYR H H 32 8.614 8.614 8.485 0.129 25487
3945 1 14 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.353 0.147 25487
3946 1 14 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.370 -2.881 25487
3947 1 14 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.439 -0.786 25487
3948 1 14 . 1 1 34 34 GLU N N 34 119.222 119.222 118.599 0.623 25487
3949 1 14 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.969 0.376 25487
3950 1 14 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.663 -3.966 25487
3951 1 14 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.811 -2.752 25487
3952 1 14 . 1 1 34 34 GLU H H 34 8.516 8.516 8.778 -0.262 25487
3953 1 14 . 1 1 35 35 GLY N N 35 109.836 109.836 103.988 5.848 25487
3954 1 14 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.789 -2.370 25487
3955 1 14 . 1 1 35 35 GLY H H 35 8.209 8.209 7.726 0.483 25487
3956 1 14 . 1 1 36 36 GLU N N 36 119.666 119.666 119.739 -0.073 25487
3957 1 14 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.057 0.168 25487
3958 1 14 . 1 1 36 36 GLU CA C 36 53.566 53.566 55.992 -2.425 25487
3959 1 14 . 1 1 36 36 GLU CB C 36 26.170 26.170 28.575 -2.405 25487
3960 1 14 . 1 1 36 36 GLU H H 36 8.190 8.190 8.333 -0.143 25487
3961 1 14 . 1 1 37 37 ASP N N 37 117.788 117.788 118.407 -0.619 25487
3962 1 14 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.618 -0.088 25487
3963 1 14 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.148 -3.314 25487
3964 1 14 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.328 -4.205 25487
3965 1 14 . 1 1 37 37 ASP H H 37 8.305 8.305 7.868 0.437 25487
3966 1 14 . 1 1 38 38 LYS N N 38 119.545 119.545 117.627 1.918 25487
3967 1 14 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.652 -0.186 25487
3968 1 14 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.568 -3.220 25487
3969 1 14 . 1 1 38 38 LYS CB C 38 30.614 30.614 33.895 -3.281 25487
3970 1 14 . 1 1 38 38 LYS H H 38 7.950 7.950 8.300 -0.350 25487
3971 1 14 . 1 1 39 39 THR N N 39 115.195 115.195 115.381 -0.186 25487
3972 1 14 . 1 1 39 39 THR HA H 39 4.323 4.323 4.650 -0.327 25487
3973 1 14 . 1 1 39 39 THR CA C 39 59.508 59.508 62.086 -2.578 25487
3974 1 14 . 1 1 39 39 THR CB C 39 67.653 67.653 71.739 -4.086 25487
3975 1 14 . 1 1 39 39 THR H H 39 7.888 7.888 7.846 0.042 25487
3976 1 14 . 1 1 40 40 GLU N N 40 124.664 124.664 123.946 0.718 25487
3977 1 14 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.864 -0.898 25487
3978 1 14 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.114 -2.085 25487
3979 1 14 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.733 -4.266 25487
3980 1 14 . 1 1 40 40 GLU H H 40 8.345 8.345 8.506 -0.161 25487
3981 1 14 . 1 1 41 41 VAL N N 41 124.551 124.551 124.681 -0.130 25487
3982 1 14 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.384 -0.283 25487
3983 1 14 . 1 1 41 41 VAL CA C 41 58.395 58.395 60.818 -2.422 25487
3984 1 14 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.094 -1.199 25487
3985 1 14 . 1 1 41 41 VAL H H 41 8.377 8.377 8.720 -0.343 25487
3986 1 14 . 1 1 42 42 CYS N N 42 122.732 122.732 127.099 -4.367 25487
3987 1 14 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.326 0.429 25487
3988 1 14 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.681 -5.837 25487
3989 1 14 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.673 15.807 25487
3990 1 14 . 1 1 42 42 CYS H H 42 8.712 8.712 9.061 -0.349 25487
3991 1 14 . 1 1 43 43 SER N N 43 117.527 117.527 115.716 1.811 25487
3992 1 14 . 1 1 43 43 SER HA H 43 5.220 5.220 5.308 -0.088 25487
3993 1 14 . 1 1 43 43 SER CA C 43 54.110 54.110 56.521 -2.411 25487
3994 1 14 . 1 1 43 43 SER CB C 43 64.091 64.091 65.945 -1.854 25487
3995 1 14 . 1 1 43 43 SER H H 43 8.828 8.828 8.971 -0.143 25487
3996 1 14 . 1 1 44 44 CYS N N 44 120.721 120.721 122.668 -1.947 25487
3997 1 14 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.641 0.572 25487
3998 1 14 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.804 -6.776 25487
3999 1 14 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.248 10.577 25487
4000 1 14 . 1 1 44 44 CYS H H 44 7.936 7.936 8.769 -0.833 25487
4001 1 14 . 1 1 45 45 GLN N N 45 124.614 124.614 124.526 0.088 25487
4002 1 14 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.673 -0.029 25487
4003 1 14 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.718 -7.285 25487
4004 1 14 . 1 1 45 45 GLN H H 45 9.892 9.892 9.343 0.549 25487
4005 1 14 . 1 1 46 46 GLN N N 46 120.933 120.933 118.634 2.299 25487
4006 1 14 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.607 0.419 25487
4007 1 14 . 1 1 46 46 GLN CB C 46 25.665 25.665 28.927 -3.262 25487
4008 1 14 . 1 1 46 46 GLN H H 46 8.849 8.849 8.612 0.237 25487
4009 1 14 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.577 -0.057 25487
4010 1 14 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.254 -1.847 25487
4011 1 14 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.930 -3.181 25487
4012 1 14 . 1 1 48 48 LYS N N 48 124.003 124.003 121.003 3.000 25487
4013 1 14 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.955 0.098 25487
4014 1 14 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.599 -4.016 25487
4015 1 14 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.183 -1.619 25487
4016 1 14 . 1 1 48 48 LYS H H 48 8.931 8.931 8.673 0.258 25487
4017 1 14 . 1 1 49 49 SER N N 49 113.527 113.527 112.971 0.556 25487
4018 1 14 . 1 1 49 49 SER HA H 49 3.995 3.995 4.187 -0.192 25487
4019 1 14 . 1 1 49 49 SER CA C 49 55.458 55.458 61.027 -5.569 25487
4020 1 14 . 1 1 49 49 SER CB C 49 61.270 61.270 62.544 -1.274 25487
4021 1 14 . 1 1 49 49 SER H H 49 8.702 8.702 8.264 0.438 25487
4022 1 14 . 1 1 50 50 HIS N N 50 119.669 119.669 123.061 -3.392 25487
4023 1 14 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.406 -0.079 25487
4024 1 14 . 1 1 50 50 HIS CB C 50 26.455 26.455 30.027 -3.572 25487
4025 1 14 . 1 1 50 50 HIS H H 50 7.664 7.664 8.069 -0.405 25487
4026 1 14 . 1 1 51 51 LYS N N 51 120.030 120.030 119.349 0.681 25487
4027 1 14 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.092 0.001 25487
4028 1 14 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.543 -2.791 25487
4029 1 14 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.178 -1.797 25487
4030 1 14 . 1 1 51 51 LYS H H 51 7.825 7.825 8.193 -0.368 25487
4031 1 14 . 1 1 52 52 ILE N N 52 118.914 118.914 120.709 -1.795 25487
4032 1 14 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.781 -0.060 25487
4033 1 14 . 1 1 52 52 ILE CA C 52 61.825 61.825 63.166 -1.341 25487
4034 1 14 . 1 1 52 52 ILE CB C 52 35.006 35.006 36.540 -1.534 25487
4035 1 14 . 1 1 52 52 ILE H H 52 8.223 8.223 8.297 -0.074 25487
4036 1 14 . 1 1 53 53 ALA N N 53 120.985 120.985 122.493 -1.508 25487
4037 1 14 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.920 0.036 25487
4038 1 14 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.650 -2.507 25487
4039 1 14 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.926 -1.180 25487
4040 1 14 . 1 1 53 53 ALA H H 53 8.066 8.066 8.428 -0.362 25487
4041 1 14 . 1 1 54 54 GLU N N 54 115.137 115.137 118.001 -2.864 25487
4042 1 14 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.963 -0.030 25487
4043 1 14 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.617 -2.769 25487
4044 1 14 . 1 1 54 54 GLU H H 54 8.160 8.160 8.250 -0.090 25487
4045 1 14 . 1 1 55 55 LYS N N 55 118.610 118.610 119.927 -1.317 25487
4046 1 14 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.060 0.096 25487
4047 1 14 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.415 -2.988 25487
4048 1 14 . 1 1 55 55 LYS H H 55 7.732 7.732 8.025 -0.293 25487
4049 1 14 . 1 1 56 56 ILE N N 56 119.173 119.173 120.123 -0.950 25487
4050 1 14 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.752 -0.125 25487
4051 1 14 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.187 -1.289 25487
4052 1 14 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.143 -2.000 25487
4053 1 14 . 1 1 56 56 ILE H H 56 8.022 8.022 8.162 -0.140 25487
4054 1 14 . 1 1 57 57 ILE N N 57 120.239 120.239 120.813 -0.574 25487
4055 1 14 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.490 0.098 25487
4056 1 14 . 1 1 57 57 ILE CA C 57 62.898 62.898 66.108 -3.210 25487
4057 1 14 . 1 1 57 57 ILE CB C 57 35.037 35.037 37.366 -2.329 25487
4058 1 14 . 1 1 57 57 ILE H H 57 8.370 8.370 8.271 0.099 25487
4059 1 14 . 1 1 58 58 ASP N N 58 118.234 118.234 120.080 -1.846 25487
4060 1 14 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.402 0.010 25487
4061 1 14 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.458 -3.284 25487
4062 1 14 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.187 -3.992 25487
4063 1 14 . 1 1 58 58 ASP H H 58 8.458 8.458 8.500 -0.042 25487
4064 1 14 . 1 1 59 59 LYS N N 59 119.380 119.380 120.153 -0.773 25487
4065 1 14 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.039 0.211 25487
4066 1 14 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.160 -4.229 25487
4067 1 14 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.563 -2.502 25487
4068 1 14 . 1 1 59 59 LYS H H 59 7.928 7.928 7.976 -0.048 25487
4069 1 14 . 1 1 60 60 ALA N N 60 123.604 123.604 122.395 1.209 25487
4070 1 14 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.158 -0.173 25487
4071 1 14 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.751 -1.938 25487
4072 1 14 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.545 -2.748 25487
4073 1 14 . 1 1 60 60 ALA H H 60 8.699 8.699 8.211 0.488 25487
4074 1 14 . 1 1 61 61 LYS N N 61 115.317 115.317 118.406 -3.089 25487
4075 1 14 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.105 -0.087 25487
4076 1 14 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.433 -1.648 25487
4077 1 14 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.998 -2.491 25487
4078 1 14 . 1 1 61 61 LYS H H 61 8.361 8.361 8.055 0.306 25487
4079 1 14 . 1 1 62 62 THR N N 62 107.298 107.298 111.191 -3.893 25487
4080 1 14 . 1 1 62 62 THR HA H 62 4.368 4.368 4.107 0.261 25487
4081 1 14 . 1 1 62 62 THR CA C 62 60.427 60.427 64.254 -3.827 25487
4082 1 14 . 1 1 62 62 THR CB C 62 67.179 67.179 66.926 0.253 25487
4083 1 14 . 1 1 62 62 THR H H 62 7.510 7.510 8.536 -1.026 25487
4084 1 14 . 1 1 63 63 THR N N 63 115.701 115.701 114.295 1.406 25487
4085 1 14 . 1 1 63 63 THR HA H 63 4.328 4.328 4.289 0.039 25487
4086 1 14 . 1 1 63 63 THR CA C 63 61.695 61.695 63.790 -2.095 25487
4087 1 14 . 1 1 63 63 THR CB C 63 67.641 67.641 69.447 -1.806 25487
4088 1 14 . 1 1 63 63 THR H H 63 7.651 7.651 8.357 -0.706 25487
4089 1 15 . 1 1 2 2 LYS N N 2 121.111 121.111 120.598 0.513 25487
4090 1 15 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.415 -0.090 25487
4091 1 15 . 1 1 2 2 LYS CA C 2 53.663 53.663 55.976 -2.313 25487
4092 1 15 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.109 -2.694 25487
4093 1 15 . 1 1 2 2 LYS H H 2 8.492 8.492 8.310 0.182 25487
4094 1 15 . 1 1 3 3 ALA N N 3 126.440 126.440 124.067 2.373 25487
4095 1 15 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.484 -0.059 25487
4096 1 15 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.674 -2.227 25487
4097 1 15 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.595 -2.690 25487
4098 1 15 . 1 1 3 3 ALA H H 3 8.357 8.357 7.683 0.674 25487
4099 1 15 . 1 1 4 4 CYS N N 4 116.834 116.834 120.223 -3.389 25487
4100 1 15 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.676 0.227 25487
4101 1 15 . 1 1 4 4 CYS CA C 4 51.793 51.793 58.128 -6.335 25487
4102 1 15 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.640 11.654 25487
4103 1 15 . 1 1 4 4 CYS H H 4 8.145 8.145 8.660 -0.515 25487
4104 1 15 . 1 1 5 5 THR N N 5 121.220 121.220 120.006 1.214 25487
4105 1 15 . 1 1 5 5 THR HA H 5 4.481 4.481 4.650 -0.169 25487
4106 1 15 . 1 1 5 5 THR CA C 5 58.256 58.256 60.463 -2.207 25487
4107 1 15 . 1 1 5 5 THR CB C 5 67.043 67.043 69.213 -2.170 25487
4108 1 15 . 1 1 5 5 THR H H 5 9.070 9.070 8.689 0.381 25487
4109 1 15 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.384 -0.132 25487
4110 1 15 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.269 -3.030 25487
4111 1 15 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.276 -1.747 25487
4112 1 15 . 1 1 7 7 LEU N N 7 119.270 119.270 119.964 -0.694 25487
4113 1 15 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.905 -0.649 25487
4114 1 15 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.814 -1.754 25487
4115 1 15 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.315 -3.109 25487
4116 1 15 . 1 1 7 7 LEU H H 7 7.797 7.797 7.654 0.143 25487
4117 1 15 . 1 1 8 8 LEU N N 8 119.586 119.586 123.771 -4.185 25487
4118 1 15 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.041 -0.219 25487
4119 1 15 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.669 -0.746 25487
4120 1 15 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.800 -3.198 25487
4121 1 15 . 1 1 8 8 LEU H H 8 9.465 9.465 8.303 1.162 25487
4122 1 15 . 1 1 9 9 HIS N N 9 117.507 117.507 116.174 1.333 25487
4123 1 15 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.755 -0.009 25487
4124 1 15 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.420 -1.993 25487
4125 1 15 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.803 -6.694 25487
4126 1 15 . 1 1 9 9 HIS H H 9 8.159 8.159 7.687 0.472 25487
4127 1 15 . 1 1 10 10 ASP N N 10 119.492 119.492 121.088 -1.596 25487
4128 1 15 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.732 0.151 25487
4129 1 15 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.830 -2.492 25487
4130 1 15 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.403 -0.933 25487
4131 1 15 . 1 1 10 10 ASP H H 10 8.341 8.341 8.576 -0.235 25487
4132 1 15 . 1 1 11 11 CYS N N 11 121.767 121.767 119.245 2.522 25487
4133 1 15 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.848 0.281 25487
4134 1 15 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.873 -4.117 25487
4135 1 15 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.827 13.409 25487
4136 1 15 . 1 1 11 11 CYS H H 11 8.017 8.017 8.432 -0.415 25487
4137 1 15 . 1 1 12 12 SER N N 12 118.618 118.618 118.451 0.167 25487
4138 1 15 . 1 1 12 12 SER HA H 12 3.759 3.759 4.130 -0.371 25487
4139 1 15 . 1 1 12 12 SER CB C 12 59.972 59.972 63.176 -3.204 25487
4140 1 15 . 1 1 12 12 SER H H 12 8.844 8.844 8.513 0.331 25487
4141 1 15 . 1 1 13 13 HIS N N 13 117.166 117.166 115.587 1.579 25487
4142 1 15 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.684 -0.062 25487
4143 1 15 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.242 -4.790 25487
4144 1 15 . 1 1 13 13 HIS H H 13 8.547 8.547 8.274 0.273 25487
4145 1 15 . 1 1 14 14 ASP N N 14 117.382 117.382 119.043 -1.661 25487
4146 1 15 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.858 -0.167 25487
4147 1 15 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.127 -2.935 25487
4148 1 15 . 1 1 14 14 ASP CB C 14 36.424 36.424 43.062 -6.638 25487
4149 1 15 . 1 1 14 14 ASP H H 14 7.224 7.224 7.927 -0.703 25487
4150 1 15 . 1 1 15 15 ARG N N 15 124.498 124.498 122.840 1.658 25487
4151 1 15 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.163 0.554 25487
4152 1 15 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.933 -4.400 25487
4153 1 15 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.391 0.001 25487
4154 1 15 . 1 1 15 15 ARG H H 15 9.004 9.004 8.535 0.469 25487
4155 1 15 . 1 1 16 16 HIS N N 16 116.269 116.269 114.553 1.716 25487
4156 1 15 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.752 0.316 25487
4157 1 15 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.653 -3.178 25487
4158 1 15 . 1 1 16 16 HIS CB C 16 25.676 25.676 28.950 -3.274 25487
4159 1 15 . 1 1 16 16 HIS H H 16 8.528 8.528 8.345 0.183 25487
4160 1 15 . 1 1 17 17 SER N N 17 112.719 112.719 115.644 -2.925 25487
4161 1 15 . 1 1 17 17 SER HA H 17 4.493 4.493 4.406 0.087 25487
4162 1 15 . 1 1 17 17 SER CA C 17 56.591 56.591 60.249 -3.658 25487
4163 1 15 . 1 1 17 17 SER CB C 17 62.736 62.736 64.407 -1.671 25487
4164 1 15 . 1 1 17 17 SER H H 17 7.503 7.503 7.665 -0.162 25487
4165 1 15 . 1 1 18 18 CYS N N 18 122.070 122.070 120.225 1.845 25487
4166 1 15 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.539 0.535 25487
4167 1 15 . 1 1 18 18 CYS CA C 18 54.574 54.574 58.842 -4.268 25487
4168 1 15 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.696 10.129 25487
4169 1 15 . 1 1 18 18 CYS H H 18 8.651 8.651 8.143 0.508 25487
4170 1 15 . 1 1 19 19 CYS N N 19 118.243 118.243 123.612 -5.369 25487
4171 1 15 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.501 0.019 25487
4172 1 15 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.764 -6.216 25487
4173 1 15 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.667 10.723 25487
4174 1 15 . 1 1 19 19 CYS H H 19 8.936 8.936 8.512 0.424 25487
4175 1 15 . 1 1 20 20 ARG N N 20 116.858 116.858 121.645 -4.787 25487
4176 1 15 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.185 -0.086 25487
4177 1 15 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.517 -3.512 25487
4178 1 15 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.124 -1.495 25487
4179 1 15 . 1 1 20 20 ARG H H 20 8.136 8.136 8.564 -0.428 25487
4180 1 15 . 1 1 21 21 GLY N N 21 110.611 110.611 109.485 1.126 25487
4181 1 15 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.788 -1.992 25487
4182 1 15 . 1 1 21 21 GLY H H 21 7.569 7.569 8.018 -0.449 25487
4183 1 15 . 1 1 22 22 ASP N N 22 121.161 121.161 118.674 2.487 25487
4184 1 15 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.515 -0.180 25487
4185 1 15 . 1 1 22 22 ASP CA C 22 53.663 53.663 55.852 -2.189 25487
4186 1 15 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.221 -4.837 25487
4187 1 15 . 1 1 22 22 ASP H H 22 8.674 8.674 8.604 0.070 25487
4188 1 15 . 1 1 23 23 MET N N 23 114.811 114.811 116.833 -2.022 25487
4189 1 15 . 1 1 23 23 MET HA H 23 4.218 4.218 4.164 0.054 25487
4190 1 15 . 1 1 23 23 MET CA C 23 53.190 53.190 55.638 -2.448 25487
4191 1 15 . 1 1 23 23 MET CB C 23 30.586 30.586 33.585 -2.999 25487
4192 1 15 . 1 1 23 23 MET H H 23 8.333 8.333 7.604 0.729 25487
4193 1 15 . 1 1 24 24 PHE N N 24 116.019 116.019 117.462 -1.443 25487
4194 1 15 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.603 0.224 25487
4195 1 15 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.015 2.526 25487
4196 1 15 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.222 -2.426 25487
4197 1 15 . 1 1 24 24 PHE H H 24 7.821 7.821 7.622 0.199 25487
4198 1 15 . 1 1 25 25 LYS N N 25 123.768 123.768 123.180 0.588 25487
4199 1 15 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.844 0.202 25487
4200 1 15 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.648 -2.010 25487
4201 1 15 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.111 -2.034 25487
4202 1 15 . 1 1 25 25 LYS H H 25 9.119 9.119 8.368 0.751 25487
4203 1 15 . 1 1 26 26 TYR N N 26 123.059 123.059 118.000 5.059 25487
4204 1 15 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.479 0.520 25487
4205 1 15 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.711 -3.891 25487
4206 1 15 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.373 -4.632 25487
4207 1 15 . 1 1 26 26 TYR H H 26 7.884 7.884 7.467 0.417 25487
4208 1 15 . 1 1 27 27 VAL N N 27 116.468 116.468 118.572 -2.104 25487
4209 1 15 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.468 -0.097 25487
4210 1 15 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.763 -2.248 25487
4211 1 15 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.666 -3.721 25487
4212 1 15 . 1 1 27 27 VAL H H 27 9.012 9.012 9.120 -0.108 25487
4213 1 15 . 1 1 28 28 CYS N N 28 124.932 124.932 127.292 -2.360 25487
4214 1 15 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.623 0.131 25487
4215 1 15 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.061 -5.861 25487
4216 1 15 . 1 1 28 28 CYS CB C 28 37.787 37.787 25.965 11.822 25487
4217 1 15 . 1 1 28 28 CYS H H 28 8.874 8.874 8.897 -0.023 25487
4218 1 15 . 1 1 29 29 ASP N N 29 131.592 131.592 129.053 2.539 25487
4219 1 15 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.738 0.207 25487
4220 1 15 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.456 -3.400 25487
4221 1 15 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.703 -5.234 25487
4222 1 15 . 1 1 29 29 ASP H H 29 8.603 8.603 8.708 -0.105 25487
4223 1 15 . 1 1 30 30 CYS N N 30 122.694 122.694 118.249 4.445 25487
4224 1 15 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.916 0.887 25487
4225 1 15 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.927 -5.538 25487
4226 1 15 . 1 1 30 30 CYS CB C 30 43.933 43.933 30.214 13.719 25487
4227 1 15 . 1 1 30 30 CYS H H 30 8.480 8.480 8.153 0.327 25487
4228 1 15 . 1 1 31 31 PHE N N 31 121.135 121.135 120.806 0.329 25487
4229 1 15 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.681 0.106 25487
4230 1 15 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.319 -4.991 25487
4231 1 15 . 1 1 31 31 PHE H H 31 9.062 9.062 8.819 0.243 25487
4232 1 15 . 1 1 32 32 TYR N N 32 120.021 120.021 116.597 3.424 25487
4233 1 15 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.334 -0.344 25487
4234 1 15 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.696 -1.957 25487
4235 1 15 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.837 -4.355 25487
4236 1 15 . 1 1 32 32 TYR H H 32 8.614 8.614 8.556 0.058 25487
4237 1 15 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.345 0.155 25487
4238 1 15 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.364 -2.875 25487
4239 1 15 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.690 -1.037 25487
4240 1 15 . 1 1 34 34 GLU N N 34 119.222 119.222 118.253 0.969 25487
4241 1 15 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.928 0.417 25487
4242 1 15 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.719 -4.022 25487
4243 1 15 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.740 -2.681 25487
4244 1 15 . 1 1 34 34 GLU H H 34 8.516 8.516 8.814 -0.298 25487
4245 1 15 . 1 1 35 35 GLY N N 35 109.836 109.836 103.044 6.792 25487
4246 1 15 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.900 -2.481 25487
4247 1 15 . 1 1 35 35 GLY H H 35 8.209 8.209 7.699 0.510 25487
4248 1 15 . 1 1 36 36 GLU N N 36 119.666 119.666 119.971 -0.305 25487
4249 1 15 . 1 1 36 36 GLU HA H 36 4.225 4.225 3.753 0.472 25487
4250 1 15 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.697 -3.131 25487
4251 1 15 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.437 -3.267 25487
4252 1 15 . 1 1 36 36 GLU H H 36 8.190 8.190 8.452 -0.262 25487
4253 1 15 . 1 1 37 37 ASP N N 37 117.788 117.788 119.274 -1.486 25487
4254 1 15 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.604 -0.074 25487
4255 1 15 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.002 -3.168 25487
4256 1 15 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.639 -4.516 25487
4257 1 15 . 1 1 37 37 ASP H H 37 8.305 8.305 8.289 0.016 25487
4258 1 15 . 1 1 38 38 LYS N N 38 119.545 119.545 119.288 0.257 25487
4259 1 15 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.555 -0.089 25487
4260 1 15 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.925 -3.576 25487
4261 1 15 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.940 -4.326 25487
4262 1 15 . 1 1 38 38 LYS H H 38 7.950 7.950 7.775 0.175 25487
4263 1 15 . 1 1 39 39 THR N N 39 115.195 115.195 114.567 0.628 25487
4264 1 15 . 1 1 39 39 THR HA H 39 4.323 4.323 4.768 -0.445 25487
4265 1 15 . 1 1 39 39 THR CA C 39 59.508 59.508 61.764 -2.256 25487
4266 1 15 . 1 1 39 39 THR CB C 39 67.653 67.653 71.725 -4.072 25487
4267 1 15 . 1 1 39 39 THR H H 39 7.888 7.888 8.097 -0.209 25487
4268 1 15 . 1 1 40 40 GLU N N 40 124.664 124.664 124.409 0.255 25487
4269 1 15 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.921 -0.955 25487
4270 1 15 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.277 -2.248 25487
4271 1 15 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.244 -3.776 25487
4272 1 15 . 1 1 40 40 GLU H H 40 8.345 8.345 8.527 -0.182 25487
4273 1 15 . 1 1 41 41 VAL N N 41 124.551 124.551 126.425 -1.874 25487
4274 1 15 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.415 -0.314 25487
4275 1 15 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.170 -2.775 25487
4276 1 15 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.322 -2.427 25487
4277 1 15 . 1 1 41 41 VAL H H 41 8.377 8.377 8.630 -0.253 25487
4278 1 15 . 1 1 42 42 CYS N N 42 122.732 122.732 126.898 -4.166 25487
4279 1 15 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.344 0.411 25487
4280 1 15 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.543 -5.699 25487
4281 1 15 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.747 15.732 25487
4282 1 15 . 1 1 42 42 CYS H H 42 8.712 8.712 9.082 -0.370 25487
4283 1 15 . 1 1 43 43 SER N N 43 117.527 117.527 116.143 1.384 25487
4284 1 15 . 1 1 43 43 SER HA H 43 5.220 5.220 5.308 -0.088 25487
4285 1 15 . 1 1 43 43 SER CA C 43 54.110 54.110 56.439 -2.329 25487
4286 1 15 . 1 1 43 43 SER CB C 43 64.091 64.091 65.438 -1.347 25487
4287 1 15 . 1 1 43 43 SER H H 43 8.828 8.828 8.895 -0.067 25487
4288 1 15 . 1 1 44 44 CYS N N 44 120.721 120.721 122.512 -1.791 25487
4289 1 15 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.466 0.747 25487
4290 1 15 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.149 -7.121 25487
4291 1 15 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.102 10.723 25487
4292 1 15 . 1 1 44 44 CYS H H 44 7.936 7.936 8.802 -0.866 25487
4293 1 15 . 1 1 45 45 GLN N N 45 124.614 124.614 125.380 -0.766 25487
4294 1 15 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.718 -0.074 25487
4295 1 15 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.918 -7.485 25487
4296 1 15 . 1 1 45 45 GLN H H 45 9.892 9.892 9.284 0.608 25487
4297 1 15 . 1 1 46 46 GLN N N 46 120.933 120.933 119.885 1.048 25487
4298 1 15 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.807 0.219 25487
4299 1 15 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.228 -3.563 25487
4300 1 15 . 1 1 46 46 GLN H H 46 8.849 8.849 8.637 0.212 25487
4301 1 15 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.591 -0.071 25487
4302 1 15 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.683 -2.276 25487
4303 1 15 . 1 1 47 47 PRO CB C 47 29.749 29.749 33.038 -3.289 25487
4304 1 15 . 1 1 48 48 LYS N N 48 124.003 124.003 122.413 1.590 25487
4305 1 15 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.953 0.100 25487
4306 1 15 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.982 -3.398 25487
4307 1 15 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.292 -1.728 25487
4308 1 15 . 1 1 48 48 LYS H H 48 8.931 8.931 8.783 0.148 25487
4309 1 15 . 1 1 49 49 SER N N 49 113.527 113.527 114.584 -1.057 25487
4310 1 15 . 1 1 49 49 SER HA H 49 3.995 3.995 4.166 -0.171 25487
4311 1 15 . 1 1 49 49 SER CA C 49 55.458 55.458 61.431 -5.973 25487
4312 1 15 . 1 1 49 49 SER CB C 49 61.270 61.270 62.662 -1.392 25487
4313 1 15 . 1 1 49 49 SER H H 49 8.702 8.702 8.231 0.471 25487
4314 1 15 . 1 1 50 50 HIS N N 50 119.669 119.669 120.218 -0.549 25487
4315 1 15 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.096 0.231 25487
4316 1 15 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.456 -3.001 25487
4317 1 15 . 1 1 50 50 HIS H H 50 7.664 7.664 8.031 -0.367 25487
4318 1 15 . 1 1 51 51 LYS N N 51 120.030 120.030 119.494 0.536 25487
4319 1 15 . 1 1 51 51 LYS HA H 51 4.093 4.093 3.456 0.637 25487
4320 1 15 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.844 -3.092 25487
4321 1 15 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.450 -2.069 25487
4322 1 15 . 1 1 51 51 LYS H H 51 7.825 7.825 7.918 -0.093 25487
4323 1 15 . 1 1 52 52 ILE N N 52 118.914 118.914 119.739 -0.825 25487
4324 1 15 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.564 0.157 25487
4325 1 15 . 1 1 52 52 ILE CA C 52 61.825 61.825 64.960 -3.135 25487
4326 1 15 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.722 -2.716 25487
4327 1 15 . 1 1 52 52 ILE H H 52 8.223 8.223 7.734 0.489 25487
4328 1 15 . 1 1 53 53 ALA N N 53 120.985 120.985 121.335 -0.350 25487
4329 1 15 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.870 0.086 25487
4330 1 15 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.499 -2.356 25487
4331 1 15 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.733 -0.987 25487
4332 1 15 . 1 1 53 53 ALA H H 53 8.066 8.066 8.045 0.021 25487
4333 1 15 . 1 1 54 54 GLU N N 54 115.137 115.137 117.683 -2.546 25487
4334 1 15 . 1 1 54 54 GLU HA H 54 3.933 3.933 4.045 -0.112 25487
4335 1 15 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.363 -2.515 25487
4336 1 15 . 1 1 54 54 GLU H H 54 8.160 8.160 7.832 0.328 25487
4337 1 15 . 1 1 55 55 LYS N N 55 118.610 118.610 120.171 -1.561 25487
4338 1 15 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.149 0.007 25487
4339 1 15 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.897 -2.470 25487
4340 1 15 . 1 1 55 55 LYS H H 55 7.732 7.732 7.807 -0.075 25487
4341 1 15 . 1 1 56 56 ILE N N 56 119.173 119.173 121.401 -2.228 25487
4342 1 15 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.765 -0.138 25487
4343 1 15 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.121 -2.223 25487
4344 1 15 . 1 1 56 56 ILE CB C 56 35.143 35.143 38.140 -2.997 25487
4345 1 15 . 1 1 56 56 ILE H H 56 8.022 8.022 8.218 -0.196 25487
4346 1 15 . 1 1 57 57 ILE N N 57 120.239 120.239 120.112 0.127 25487
4347 1 15 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.694 -0.106 25487
4348 1 15 . 1 1 57 57 ILE CA C 57 62.898 62.898 63.945 -1.047 25487
4349 1 15 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.288 -1.251 25487
4350 1 15 . 1 1 57 57 ILE H H 57 8.370 8.370 8.239 0.131 25487
4351 1 15 . 1 1 58 58 ASP N N 58 118.234 118.234 120.752 -2.518 25487
4352 1 15 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.392 0.020 25487
4353 1 15 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.689 -3.515 25487
4354 1 15 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.180 -3.985 25487
4355 1 15 . 1 1 58 58 ASP H H 58 8.458 8.458 8.278 0.180 25487
4356 1 15 . 1 1 59 59 LYS N N 59 119.380 119.380 120.028 -0.648 25487
4357 1 15 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.060 0.190 25487
4358 1 15 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.682 -3.751 25487
4359 1 15 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.521 -2.460 25487
4360 1 15 . 1 1 59 59 LYS H H 59 7.928 7.928 7.723 0.205 25487
4361 1 15 . 1 1 60 60 ALA N N 60 123.604 123.604 121.679 1.925 25487
4362 1 15 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.022 -0.037 25487
4363 1 15 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.013 -2.200 25487
4364 1 15 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.759 -2.962 25487
4365 1 15 . 1 1 60 60 ALA H H 60 8.699 8.699 7.983 0.716 25487
4366 1 15 . 1 1 61 61 LYS N N 61 115.317 115.317 118.265 -2.948 25487
4367 1 15 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.045 -0.027 25487
4368 1 15 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.838 -2.053 25487
4369 1 15 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.723 -2.216 25487
4370 1 15 . 1 1 61 61 LYS H H 61 8.361 8.361 8.082 0.279 25487
4371 1 15 . 1 1 62 62 THR N N 62 107.298 107.298 110.781 -3.483 25487
4372 1 15 . 1 1 62 62 THR HA H 62 4.368 4.368 4.050 0.318 25487
4373 1 15 . 1 1 62 62 THR CA C 62 60.427 60.427 64.297 -3.870 25487
4374 1 15 . 1 1 62 62 THR CB C 62 67.179 67.179 66.901 0.278 25487
4375 1 15 . 1 1 62 62 THR H H 62 7.510 7.510 8.597 -1.087 25487
4376 1 15 . 1 1 63 63 THR N N 63 115.701 115.701 114.484 1.217 25487
4377 1 15 . 1 1 63 63 THR HA H 63 4.328 4.328 4.316 0.012 25487
4378 1 15 . 1 1 63 63 THR CA C 63 61.695 61.695 63.713 -2.018 25487
4379 1 15 . 1 1 63 63 THR CB C 63 67.641 67.641 69.255 -1.614 25487
4380 1 15 . 1 1 63 63 THR H H 63 7.651 7.651 8.113 -0.462 25487
4381 1 16 . 1 1 2 2 LYS N N 2 121.111 121.111 120.880 0.231 25487
4382 1 16 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.364 -0.039 25487
4383 1 16 . 1 1 2 2 LYS CA C 2 53.663 53.663 55.993 -2.330 25487
4384 1 16 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.865 -2.450 25487
4385 1 16 . 1 1 2 2 LYS H H 2 8.492 8.492 8.262 0.230 25487
4386 1 16 . 1 1 3 3 ALA N N 3 126.440 126.440 124.164 2.276 25487
4387 1 16 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.157 0.268 25487
4388 1 16 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.456 -3.009 25487
4389 1 16 . 1 1 3 3 ALA CB C 3 16.905 16.905 16.771 0.134 25487
4390 1 16 . 1 1 3 3 ALA H H 3 8.357 8.357 8.161 0.196 25487
4391 1 16 . 1 1 4 4 CYS N N 4 116.834 116.834 115.797 1.037 25487
4392 1 16 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.576 0.327 25487
4393 1 16 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.410 -4.617 25487
4394 1 16 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.893 11.401 25487
4395 1 16 . 1 1 4 4 CYS H H 4 8.145 8.145 7.959 0.186 25487
4396 1 16 . 1 1 5 5 THR N N 5 121.220 121.220 118.698 2.522 25487
4397 1 16 . 1 1 5 5 THR HA H 5 4.481 4.481 4.768 -0.287 25487
4398 1 16 . 1 1 5 5 THR CA C 5 58.256 58.256 60.561 -2.305 25487
4399 1 16 . 1 1 5 5 THR CB C 5 67.043 67.043 68.656 -1.613 25487
4400 1 16 . 1 1 5 5 THR H H 5 9.070 9.070 8.461 0.609 25487
4401 1 16 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.444 -0.192 25487
4402 1 16 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.232 -2.993 25487
4403 1 16 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.314 -1.785 25487
4404 1 16 . 1 1 7 7 LEU N N 7 119.270 119.270 119.309 -0.039 25487
4405 1 16 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.719 -0.463 25487
4406 1 16 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.213 -1.153 25487
4407 1 16 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.067 -2.861 25487
4408 1 16 . 1 1 7 7 LEU H H 7 7.797 7.797 7.859 -0.062 25487
4409 1 16 . 1 1 8 8 LEU N N 8 119.586 119.586 122.474 -2.888 25487
4410 1 16 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.889 -0.067 25487
4411 1 16 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.752 -0.829 25487
4412 1 16 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.525 -2.923 25487
4413 1 16 . 1 1 8 8 LEU H H 8 9.465 9.465 8.867 0.598 25487
4414 1 16 . 1 1 9 9 HIS N N 9 117.507 117.507 116.762 0.745 25487
4415 1 16 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.801 -0.055 25487
4416 1 16 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.410 -1.983 25487
4417 1 16 . 1 1 9 9 HIS CB C 9 27.108 27.108 34.102 -6.994 25487
4418 1 16 . 1 1 9 9 HIS H H 9 8.159 8.159 8.033 0.126 25487
4419 1 16 . 1 1 10 10 ASP N N 10 119.492 119.492 120.132 -0.640 25487
4420 1 16 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.827 0.057 25487
4421 1 16 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.026 -1.688 25487
4422 1 16 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.795 -1.325 25487
4423 1 16 . 1 1 10 10 ASP H H 10 8.341 8.341 8.549 -0.208 25487
4424 1 16 . 1 1 11 11 CYS N N 11 121.767 121.767 118.482 3.285 25487
4425 1 16 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.824 0.305 25487
4426 1 16 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.536 -3.780 25487
4427 1 16 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.587 13.649 25487
4428 1 16 . 1 1 11 11 CYS H H 11 8.017 8.017 8.205 -0.188 25487
4429 1 16 . 1 1 12 12 SER N N 12 118.618 118.618 119.152 -0.534 25487
4430 1 16 . 1 1 12 12 SER HA H 12 3.759 3.759 4.104 -0.345 25487
4431 1 16 . 1 1 12 12 SER CB C 12 59.972 59.972 62.966 -2.994 25487
4432 1 16 . 1 1 12 12 SER H H 12 8.844 8.844 8.263 0.581 25487
4433 1 16 . 1 1 13 13 HIS N N 13 117.166 117.166 116.603 0.563 25487
4434 1 16 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.633 -0.011 25487
4435 1 16 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.267 -4.814 25487
4436 1 16 . 1 1 13 13 HIS H H 13 8.547 8.547 8.243 0.304 25487
4437 1 16 . 1 1 14 14 ASP N N 14 117.382 117.382 119.169 -1.787 25487
4438 1 16 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.894 -0.203 25487
4439 1 16 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.520 -3.328 25487
4440 1 16 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.889 -6.465 25487
4441 1 16 . 1 1 14 14 ASP H H 14 7.224 7.224 7.800 -0.576 25487
4442 1 16 . 1 1 15 15 ARG N N 15 124.498 124.498 123.589 0.909 25487
4443 1 16 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.394 0.323 25487
4444 1 16 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.268 -3.735 25487
4445 1 16 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.517 -0.124 25487
4446 1 16 . 1 1 15 15 ARG H H 15 9.004 9.004 8.613 0.391 25487
4447 1 16 . 1 1 16 16 HIS N N 16 116.269 116.269 114.874 1.395 25487
4448 1 16 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.825 0.243 25487
4449 1 16 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.471 -2.996 25487
4450 1 16 . 1 1 16 16 HIS CB C 16 25.676 25.676 30.649 -4.973 25487
4451 1 16 . 1 1 16 16 HIS H H 16 8.528 8.528 8.374 0.154 25487
4452 1 16 . 1 1 17 17 SER N N 17 112.719 112.719 116.544 -3.825 25487
4453 1 16 . 1 1 17 17 SER HA H 17 4.493 4.493 4.541 -0.048 25487
4454 1 16 . 1 1 17 17 SER CA C 17 56.591 56.591 59.607 -3.016 25487
4455 1 16 . 1 1 17 17 SER CB C 17 62.736 62.736 64.360 -1.624 25487
4456 1 16 . 1 1 17 17 SER H H 17 7.503 7.503 7.766 -0.263 25487
4457 1 16 . 1 1 18 18 CYS N N 18 122.070 122.070 121.378 0.692 25487
4458 1 16 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.477 0.597 25487
4459 1 16 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.023 -5.449 25487
4460 1 16 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.761 10.064 25487
4461 1 16 . 1 1 18 18 CYS H H 18 8.651 8.651 8.301 0.350 25487
4462 1 16 . 1 1 19 19 CYS N N 19 118.243 118.243 124.610 -6.367 25487
4463 1 16 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.401 0.119 25487
4464 1 16 . 1 1 19 19 CYS CA C 19 52.548 52.548 60.106 -7.558 25487
4465 1 16 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.590 10.800 25487
4466 1 16 . 1 1 19 19 CYS H H 19 8.936 8.936 8.398 0.538 25487
4467 1 16 . 1 1 20 20 ARG N N 20 116.858 116.858 120.202 -3.344 25487
4468 1 16 . 1 1 20 20 ARG HA H 20 4.099 4.099 3.998 0.101 25487
4469 1 16 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.614 -3.609 25487
4470 1 16 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.574 -1.945 25487
4471 1 16 . 1 1 20 20 ARG H H 20 8.136 8.136 8.348 -0.212 25487
4472 1 16 . 1 1 21 21 GLY N N 21 110.611 110.611 105.540 5.071 25487
4473 1 16 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.627 -1.831 25487
4474 1 16 . 1 1 21 21 GLY H H 21 7.569 7.569 7.810 -0.241 25487
4475 1 16 . 1 1 22 22 ASP N N 22 121.161 121.161 119.484 1.677 25487
4476 1 16 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.518 -0.183 25487
4477 1 16 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.426 -2.763 25487
4478 1 16 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.096 -4.712 25487
4479 1 16 . 1 1 22 22 ASP H H 22 8.674 8.674 8.649 0.025 25487
4480 1 16 . 1 1 23 23 MET N N 23 114.811 114.811 115.940 -1.129 25487
4481 1 16 . 1 1 23 23 MET HA H 23 4.218 4.218 4.196 0.022 25487
4482 1 16 . 1 1 23 23 MET CA C 23 53.190 53.190 55.769 -2.579 25487
4483 1 16 . 1 1 23 23 MET CB C 23 30.586 30.586 33.887 -3.301 25487
4484 1 16 . 1 1 23 23 MET H H 23 8.333 8.333 7.780 0.553 25487
4485 1 16 . 1 1 24 24 PHE N N 24 116.019 116.019 116.886 -0.867 25487
4486 1 16 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.784 0.043 25487
4487 1 16 . 1 1 24 24 PHE CA C 24 58.541 58.541 55.960 2.581 25487
4488 1 16 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.775 -2.979 25487
4489 1 16 . 1 1 24 24 PHE H H 24 7.821 7.821 7.115 0.706 25487
4490 1 16 . 1 1 25 25 LYS N N 25 123.768 123.768 121.311 2.457 25487
4491 1 16 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.041 0.005 25487
4492 1 16 . 1 1 25 25 LYS CA C 25 54.638 54.638 57.241 -2.603 25487
4493 1 16 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.960 -1.883 25487
4494 1 16 . 1 1 25 25 LYS H H 25 9.119 9.119 8.195 0.924 25487
4495 1 16 . 1 1 26 26 TYR N N 26 123.059 123.059 121.641 1.418 25487
4496 1 16 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.503 0.496 25487
4497 1 16 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.206 -4.386 25487
4498 1 16 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.302 -4.561 25487
4499 1 16 . 1 1 26 26 TYR H H 26 7.884 7.884 7.501 0.383 25487
4500 1 16 . 1 1 27 27 VAL N N 27 116.468 116.468 117.775 -1.307 25487
4501 1 16 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.508 -0.137 25487
4502 1 16 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.949 -2.434 25487
4503 1 16 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.449 -3.504 25487
4504 1 16 . 1 1 27 27 VAL H H 27 9.012 9.012 9.047 -0.035 25487
4505 1 16 . 1 1 28 28 CYS N N 28 124.932 124.932 127.420 -2.488 25487
4506 1 16 . 1 1 28 28 CYS HA H 28 4.754 4.754 5.037 -0.283 25487
4507 1 16 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.732 -5.532 25487
4508 1 16 . 1 1 28 28 CYS CB C 28 37.787 37.787 25.928 11.859 25487
4509 1 16 . 1 1 28 28 CYS H H 28 8.874 8.874 8.987 -0.113 25487
4510 1 16 . 1 1 29 29 ASP N N 29 131.592 131.592 129.280 2.312 25487
4511 1 16 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.891 0.054 25487
4512 1 16 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.664 -3.608 25487
4513 1 16 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.616 -6.147 25487
4514 1 16 . 1 1 29 29 ASP H H 29 8.603 8.603 8.760 -0.157 25487
4515 1 16 . 1 1 30 30 CYS N N 30 122.694 122.694 120.600 2.094 25487
4516 1 16 . 1 1 30 30 CYS HA H 30 5.803 5.803 5.242 0.561 25487
4517 1 16 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.401 -5.012 25487
4518 1 16 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.103 14.830 25487
4519 1 16 . 1 1 30 30 CYS H H 30 8.480 8.480 8.494 -0.014 25487
4520 1 16 . 1 1 31 31 PHE N N 31 121.135 121.135 121.756 -0.621 25487
4521 1 16 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.785 0.002 25487
4522 1 16 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.881 -5.553 25487
4523 1 16 . 1 1 31 31 PHE H H 31 9.062 9.062 8.793 0.269 25487
4524 1 16 . 1 1 32 32 TYR N N 32 120.021 120.021 120.401 -0.380 25487
4525 1 16 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.810 0.180 25487
4526 1 16 . 1 1 32 32 TYR CA C 32 52.739 52.739 55.869 -3.130 25487
4527 1 16 . 1 1 32 32 TYR CB C 32 35.482 35.482 38.440 -2.958 25487
4528 1 16 . 1 1 32 32 TYR H H 32 8.614 8.614 9.039 -0.425 25487
4529 1 16 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.278 0.222 25487
4530 1 16 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.294 -2.805 25487
4531 1 16 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.387 -0.734 25487
4532 1 16 . 1 1 34 34 GLU N N 34 119.222 119.222 118.555 0.667 25487
4533 1 16 . 1 1 34 34 GLU HA H 34 4.345 4.345 4.018 0.327 25487
4534 1 16 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.570 -3.873 25487
4535 1 16 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.045 -2.986 25487
4536 1 16 . 1 1 34 34 GLU H H 34 8.516 8.516 8.569 -0.053 25487
4537 1 16 . 1 1 35 35 GLY N N 35 109.836 109.836 106.864 2.972 25487
4538 1 16 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.730 -2.311 25487
4539 1 16 . 1 1 35 35 GLY H H 35 8.209 8.209 7.959 0.250 25487
4540 1 16 . 1 1 36 36 GLU N N 36 119.666 119.666 122.668 -3.002 25487
4541 1 16 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.216 0.009 25487
4542 1 16 . 1 1 36 36 GLU CA C 36 53.566 53.566 55.817 -2.251 25487
4543 1 16 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.167 -2.997 25487
4544 1 16 . 1 1 36 36 GLU H H 36 8.190 8.190 8.548 -0.358 25487
4545 1 16 . 1 1 37 37 ASP N N 37 117.788 117.788 124.815 -7.027 25487
4546 1 16 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.454 0.076 25487
4547 1 16 . 1 1 37 37 ASP CA C 37 50.834 50.834 56.710 -5.876 25487
4548 1 16 . 1 1 37 37 ASP CB C 37 36.123 36.123 41.517 -5.394 25487
4549 1 16 . 1 1 37 37 ASP H H 37 8.305 8.305 8.254 0.051 25487
4550 1 16 . 1 1 38 38 LYS N N 38 119.545 119.545 116.690 2.855 25487
4551 1 16 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.516 -0.050 25487
4552 1 16 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.619 -3.271 25487
4553 1 16 . 1 1 38 38 LYS CB C 38 30.614 30.614 33.821 -3.207 25487
4554 1 16 . 1 1 38 38 LYS H H 38 7.950 7.950 8.518 -0.568 25487
4555 1 16 . 1 1 39 39 THR N N 39 115.195 115.195 114.822 0.373 25487
4556 1 16 . 1 1 39 39 THR HA H 39 4.323 4.323 4.789 -0.466 25487
4557 1 16 . 1 1 39 39 THR CA C 39 59.508 59.508 61.438 -1.929 25487
4558 1 16 . 1 1 39 39 THR CB C 39 67.653 67.653 71.636 -3.983 25487
4559 1 16 . 1 1 39 39 THR H H 39 7.888 7.888 7.867 0.021 25487
4560 1 16 . 1 1 40 40 GLU N N 40 124.664 124.664 120.641 4.023 25487
4561 1 16 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.019 -0.053 25487
4562 1 16 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.144 -2.115 25487
4563 1 16 . 1 1 40 40 GLU CB C 40 26.467 26.467 29.553 -3.086 25487
4564 1 16 . 1 1 40 40 GLU H H 40 8.345 8.345 8.221 0.124 25487
4565 1 16 . 1 1 41 41 VAL N N 41 124.551 124.551 121.964 2.587 25487
4566 1 16 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.231 -0.130 25487
4567 1 16 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.321 -2.926 25487
4568 1 16 . 1 1 41 41 VAL CB C 41 30.895 30.895 33.100 -2.205 25487
4569 1 16 . 1 1 41 41 VAL H H 41 8.377 8.377 8.513 -0.136 25487
4570 1 16 . 1 1 42 42 CYS N N 42 122.732 122.732 127.110 -4.378 25487
4571 1 16 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.405 0.350 25487
4572 1 16 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.912 -6.068 25487
4573 1 16 . 1 1 42 42 CYS CB C 42 46.480 46.480 27.513 18.967 25487
4574 1 16 . 1 1 42 42 CYS H H 42 8.712 8.712 9.053 -0.341 25487
4575 1 16 . 1 1 43 43 SER N N 43 117.527 117.527 118.787 -1.260 25487
4576 1 16 . 1 1 43 43 SER HA H 43 5.220 5.220 5.419 -0.199 25487
4577 1 16 . 1 1 43 43 SER CA C 43 54.110 54.110 56.301 -2.191 25487
4578 1 16 . 1 1 43 43 SER CB C 43 64.091 64.091 66.117 -2.026 25487
4579 1 16 . 1 1 43 43 SER H H 43 8.828 8.828 9.259 -0.431 25487
4580 1 16 . 1 1 44 44 CYS N N 44 120.721 120.721 122.662 -1.941 25487
4581 1 16 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.884 0.329 25487
4582 1 16 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.334 -6.306 25487
4583 1 16 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.056 10.768 25487
4584 1 16 . 1 1 44 44 CYS H H 44 7.936 7.936 8.730 -0.794 25487
4585 1 16 . 1 1 45 45 GLN N N 45 124.614 124.614 125.236 -0.622 25487
4586 1 16 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.715 -0.071 25487
4587 1 16 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.382 -6.949 25487
4588 1 16 . 1 1 45 45 GLN H H 45 9.892 9.892 9.302 0.590 25487
4589 1 16 . 1 1 46 46 GLN N N 46 120.933 120.933 119.302 1.631 25487
4590 1 16 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.703 0.323 25487
4591 1 16 . 1 1 46 46 GLN CB C 46 25.665 25.665 28.237 -2.572 25487
4592 1 16 . 1 1 46 46 GLN H H 46 8.849 8.849 8.652 0.197 25487
4593 1 16 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.500 0.020 25487
4594 1 16 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.155 -1.748 25487
4595 1 16 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.824 -3.075 25487
4596 1 16 . 1 1 48 48 LYS N N 48 124.003 124.003 120.173 3.830 25487
4597 1 16 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.995 0.058 25487
4598 1 16 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.821 -3.237 25487
4599 1 16 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.217 -1.653 25487
4600 1 16 . 1 1 48 48 LYS H H 48 8.931 8.931 8.629 0.302 25487
4601 1 16 . 1 1 49 49 SER N N 49 113.527 113.527 114.810 -1.283 25487
4602 1 16 . 1 1 49 49 SER HA H 49 3.995 3.995 4.143 -0.148 25487
4603 1 16 . 1 1 49 49 SER CA C 49 55.458 55.458 62.147 -6.689 25487
4604 1 16 . 1 1 49 49 SER CB C 49 61.270 61.270 62.482 -1.212 25487
4605 1 16 . 1 1 49 49 SER H H 49 8.702 8.702 8.182 0.520 25487
4606 1 16 . 1 1 50 50 HIS N N 50 119.669 119.669 119.248 0.421 25487
4607 1 16 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.454 -0.127 25487
4608 1 16 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.893 -3.438 25487
4609 1 16 . 1 1 50 50 HIS H H 50 7.664 7.664 8.441 -0.777 25487
4610 1 16 . 1 1 51 51 LYS N N 51 120.030 120.030 120.972 -0.942 25487
4611 1 16 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.213 -0.120 25487
4612 1 16 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.479 -2.727 25487
4613 1 16 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.301 -1.920 25487
4614 1 16 . 1 1 51 51 LYS H H 51 7.825 7.825 8.552 -0.727 25487
4615 1 16 . 1 1 52 52 ILE N N 52 118.914 118.914 120.217 -1.303 25487
4616 1 16 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.713 0.008 25487
4617 1 16 . 1 1 52 52 ILE CA C 52 61.825 61.825 64.675 -2.850 25487
4618 1 16 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.715 -2.709 25487
4619 1 16 . 1 1 52 52 ILE H H 52 8.223 8.223 7.726 0.497 25487
4620 1 16 . 1 1 53 53 ALA N N 53 120.985 120.985 122.025 -1.040 25487
4621 1 16 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.960 -0.004 25487
4622 1 16 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.645 -2.502 25487
4623 1 16 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.869 -1.123 25487
4624 1 16 . 1 1 53 53 ALA H H 53 8.066 8.066 8.260 -0.194 25487
4625 1 16 . 1 1 54 54 GLU N N 54 115.137 115.137 117.868 -2.731 25487
4626 1 16 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.941 -0.008 25487
4627 1 16 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.118 -2.270 25487
4628 1 16 . 1 1 54 54 GLU H H 54 8.160 8.160 7.858 0.302 25487
4629 1 16 . 1 1 55 55 LYS N N 55 118.610 118.610 119.954 -1.344 25487
4630 1 16 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.062 0.094 25487
4631 1 16 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.898 -2.471 25487
4632 1 16 . 1 1 55 55 LYS H H 55 7.732 7.732 7.992 -0.260 25487
4633 1 16 . 1 1 56 56 ILE N N 56 119.173 119.173 120.938 -1.765 25487
4634 1 16 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.722 -0.095 25487
4635 1 16 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.400 -1.502 25487
4636 1 16 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.931 -1.788 25487
4637 1 16 . 1 1 56 56 ILE H H 56 8.022 8.022 8.089 -0.067 25487
4638 1 16 . 1 1 57 57 ILE N N 57 120.239 120.239 119.965 0.274 25487
4639 1 16 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.580 0.008 25487
4640 1 16 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.447 -1.549 25487
4641 1 16 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.088 -1.051 25487
4642 1 16 . 1 1 57 57 ILE H H 57 8.370 8.370 8.303 0.067 25487
4643 1 16 . 1 1 58 58 ASP N N 58 118.234 118.234 120.690 -2.456 25487
4644 1 16 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.310 0.102 25487
4645 1 16 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.714 -3.540 25487
4646 1 16 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.305 -4.110 25487
4647 1 16 . 1 1 58 58 ASP H H 58 8.458 8.458 8.351 0.107 25487
4648 1 16 . 1 1 59 59 LYS N N 59 119.380 119.380 119.535 -0.155 25487
4649 1 16 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.970 0.280 25487
4650 1 16 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.862 -3.931 25487
4651 1 16 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.485 -2.424 25487
4652 1 16 . 1 1 59 59 LYS H H 59 7.928 7.928 8.198 -0.270 25487
4653 1 16 . 1 1 60 60 ALA N N 60 123.604 123.604 121.636 1.968 25487
4654 1 16 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.083 -0.098 25487
4655 1 16 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.358 -2.546 25487
4656 1 16 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.409 -2.612 25487
4657 1 16 . 1 1 60 60 ALA H H 60 8.699 8.699 8.109 0.590 25487
4658 1 16 . 1 1 61 61 LYS N N 61 115.317 115.317 118.463 -3.146 25487
4659 1 16 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.449 -0.431 25487
4660 1 16 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.161 -1.376 25487
4661 1 16 . 1 1 61 61 LYS CB C 61 30.507 30.507 31.935 -1.428 25487
4662 1 16 . 1 1 61 61 LYS H H 61 8.361 8.361 8.281 0.080 25487
4663 1 16 . 1 1 62 62 THR N N 62 107.298 107.298 114.540 -7.242 25487
4664 1 16 . 1 1 62 62 THR HA H 62 4.368 4.368 4.195 0.173 25487
4665 1 16 . 1 1 62 62 THR CA C 62 60.427 60.427 64.906 -4.479 25487
4666 1 16 . 1 1 62 62 THR CB C 62 67.179 67.179 69.156 -1.977 25487
4667 1 16 . 1 1 62 62 THR H H 62 7.510 7.510 8.194 -0.684 25487
4668 1 16 . 1 1 63 63 THR N N 63 115.701 115.701 115.678 0.023 25487
4669 1 16 . 1 1 63 63 THR HA H 63 4.328 4.328 4.289 0.039 25487
4670 1 16 . 1 1 63 63 THR CA C 63 61.695 61.695 64.691 -2.996 25487
4671 1 16 . 1 1 63 63 THR CB C 63 67.641 67.641 69.737 -2.096 25487
4672 1 16 . 1 1 63 63 THR H H 63 7.651 7.651 7.532 0.119 25487
4673 1 17 . 1 1 2 2 LYS N N 2 121.111 121.111 122.528 -1.417 25487
4674 1 17 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.760 -0.435 25487
4675 1 17 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.458 -2.795 25487
4676 1 17 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.810 -2.395 25487
4677 1 17 . 1 1 2 2 LYS H H 2 8.492 8.492 8.604 -0.112 25487
4678 1 17 . 1 1 3 3 ALA N N 3 126.440 126.440 125.362 1.078 25487
4679 1 17 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.573 -0.148 25487
4680 1 17 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.617 -2.170 25487
4681 1 17 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.959 -3.054 25487
4682 1 17 . 1 1 3 3 ALA H H 3 8.357 8.357 8.413 -0.056 25487
4683 1 17 . 1 1 4 4 CYS N N 4 116.834 116.834 118.776 -1.942 25487
4684 1 17 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.673 0.230 25487
4685 1 17 . 1 1 4 4 CYS CA C 4 51.793 51.793 58.527 -6.734 25487
4686 1 17 . 1 1 4 4 CYS CB C 4 41.294 41.294 28.489 12.805 25487
4687 1 17 . 1 1 4 4 CYS H H 4 8.145 8.145 8.432 -0.287 25487
4688 1 17 . 1 1 5 5 THR N N 5 121.220 121.220 120.022 1.198 25487
4689 1 17 . 1 1 5 5 THR HA H 5 4.481 4.481 4.605 -0.124 25487
4690 1 17 . 1 1 5 5 THR CA C 5 58.256 58.256 60.523 -2.267 25487
4691 1 17 . 1 1 5 5 THR CB C 5 67.043 67.043 69.234 -2.191 25487
4692 1 17 . 1 1 5 5 THR H H 5 9.070 9.070 8.692 0.378 25487
4693 1 17 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.327 -0.075 25487
4694 1 17 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.199 -2.959 25487
4695 1 17 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.258 -1.728 25487
4696 1 17 . 1 1 7 7 LEU N N 7 119.270 119.270 119.775 -0.505 25487
4697 1 17 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.903 -0.647 25487
4698 1 17 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.754 -1.694 25487
4699 1 17 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.206 -3.000 25487
4700 1 17 . 1 1 7 7 LEU H H 7 7.797 7.797 7.379 0.418 25487
4701 1 17 . 1 1 8 8 LEU N N 8 119.586 119.586 123.675 -4.089 25487
4702 1 17 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.022 -0.200 25487
4703 1 17 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.651 -0.728 25487
4704 1 17 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.800 -3.198 25487
4705 1 17 . 1 1 8 8 LEU H H 8 9.465 9.465 8.389 1.076 25487
4706 1 17 . 1 1 9 9 HIS N N 9 117.507 117.507 117.961 -0.454 25487
4707 1 17 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.744 0.002 25487
4708 1 17 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.497 -2.070 25487
4709 1 17 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.512 -6.404 25487
4710 1 17 . 1 1 9 9 HIS H H 9 8.159 8.159 7.824 0.335 25487
4711 1 17 . 1 1 10 10 ASP N N 10 119.492 119.492 121.531 -2.039 25487
4712 1 17 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.777 0.106 25487
4713 1 17 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.408 -3.070 25487
4714 1 17 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.564 -1.094 25487
4715 1 17 . 1 1 10 10 ASP H H 10 8.341 8.341 8.635 -0.294 25487
4716 1 17 . 1 1 11 11 CYS N N 11 121.767 121.767 120.482 1.285 25487
4717 1 17 . 1 1 11 11 CYS HA H 11 5.129 5.129 5.004 0.125 25487
4718 1 17 . 1 1 11 11 CYS CA C 11 52.756 52.756 57.220 -4.464 25487
4719 1 17 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.509 13.727 25487
4720 1 17 . 1 1 11 11 CYS H H 11 8.017 8.017 8.291 -0.274 25487
4721 1 17 . 1 1 12 12 SER N N 12 118.618 118.618 118.962 -0.344 25487
4722 1 17 . 1 1 12 12 SER HA H 12 3.759 3.759 4.158 -0.399 25487
4723 1 17 . 1 1 12 12 SER CB C 12 59.972 59.972 63.022 -3.050 25487
4724 1 17 . 1 1 12 12 SER H H 12 8.844 8.844 8.382 0.462 25487
4725 1 17 . 1 1 13 13 HIS N N 13 117.166 117.166 116.705 0.461 25487
4726 1 17 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.645 -0.023 25487
4727 1 17 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.257 -4.804 25487
4728 1 17 . 1 1 13 13 HIS H H 13 8.547 8.547 8.059 0.488 25487
4729 1 17 . 1 1 14 14 ASP N N 14 117.382 117.382 118.055 -0.673 25487
4730 1 17 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.899 -0.208 25487
4731 1 17 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.144 -2.952 25487
4732 1 17 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.638 -6.214 25487
4733 1 17 . 1 1 14 14 ASP H H 14 7.224 7.224 7.782 -0.558 25487
4734 1 17 . 1 1 15 15 ARG N N 15 124.498 124.498 123.260 1.238 25487
4735 1 17 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.142 0.575 25487
4736 1 17 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.067 -4.534 25487
4737 1 17 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.601 -0.209 25487
4738 1 17 . 1 1 15 15 ARG H H 15 9.004 9.004 8.583 0.421 25487
4739 1 17 . 1 1 16 16 HIS N N 16 116.269 116.269 115.394 0.875 25487
4740 1 17 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.831 0.237 25487
4741 1 17 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.434 -2.959 25487
4742 1 17 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.429 -3.753 25487
4743 1 17 . 1 1 16 16 HIS H H 16 8.528 8.528 8.303 0.225 25487
4744 1 17 . 1 1 17 17 SER N N 17 112.719 112.719 115.359 -2.640 25487
4745 1 17 . 1 1 17 17 SER HA H 17 4.493 4.493 4.420 0.073 25487
4746 1 17 . 1 1 17 17 SER CA C 17 56.591 56.591 59.701 -3.110 25487
4747 1 17 . 1 1 17 17 SER CB C 17 62.736 62.736 64.251 -1.515 25487
4748 1 17 . 1 1 17 17 SER H H 17 7.503 7.503 7.609 -0.106 25487
4749 1 17 . 1 1 18 18 CYS N N 18 122.070 122.070 122.118 -0.048 25487
4750 1 17 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.594 0.480 25487
4751 1 17 . 1 1 18 18 CYS CA C 18 54.574 54.574 58.790 -4.216 25487
4752 1 17 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.379 10.446 25487
4753 1 17 . 1 1 18 18 CYS H H 18 8.651 8.651 8.060 0.591 25487
4754 1 17 . 1 1 19 19 CYS N N 19 118.243 118.243 123.855 -5.612 25487
4755 1 17 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.558 -0.038 25487
4756 1 17 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.945 -6.397 25487
4757 1 17 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.774 10.616 25487
4758 1 17 . 1 1 19 19 CYS H H 19 8.936 8.936 8.559 0.377 25487
4759 1 17 . 1 1 20 20 ARG N N 20 116.858 116.858 121.700 -4.842 25487
4760 1 17 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.261 -0.162 25487
4761 1 17 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.558 -3.553 25487
4762 1 17 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.461 -1.832 25487
4763 1 17 . 1 1 20 20 ARG H H 20 8.136 8.136 8.598 -0.462 25487
4764 1 17 . 1 1 21 21 GLY N N 21 110.611 110.611 108.443 2.168 25487
4765 1 17 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.927 -2.131 25487
4766 1 17 . 1 1 21 21 GLY H H 21 7.569 7.569 8.158 -0.589 25487
4767 1 17 . 1 1 22 22 ASP N N 22 121.161 121.161 121.733 -0.572 25487
4768 1 17 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.391 -0.056 25487
4769 1 17 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.318 -2.655 25487
4770 1 17 . 1 1 22 22 ASP CB C 22 36.384 36.384 40.999 -4.615 25487
4771 1 17 . 1 1 22 22 ASP H H 22 8.674 8.674 8.632 0.042 25487
4772 1 17 . 1 1 23 23 MET N N 23 114.811 114.811 116.236 -1.425 25487
4773 1 17 . 1 1 23 23 MET HA H 23 4.218 4.218 4.057 0.161 25487
4774 1 17 . 1 1 23 23 MET CA C 23 53.190 53.190 56.342 -3.152 25487
4775 1 17 . 1 1 23 23 MET CB C 23 30.586 30.586 33.647 -3.061 25487
4776 1 17 . 1 1 23 23 MET H H 23 8.333 8.333 7.733 0.600 25487
4777 1 17 . 1 1 24 24 PHE N N 24 116.019 116.019 116.388 -0.369 25487
4778 1 17 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.390 0.437 25487
4779 1 17 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.504 2.037 25487
4780 1 17 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.535 -2.740 25487
4781 1 17 . 1 1 24 24 PHE H H 24 7.821 7.821 7.465 0.356 25487
4782 1 17 . 1 1 25 25 LYS N N 25 123.768 123.768 121.361 2.407 25487
4783 1 17 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.324 -0.278 25487
4784 1 17 . 1 1 25 25 LYS CA C 25 54.638 54.638 55.668 -1.030 25487
4785 1 17 . 1 1 25 25 LYS CB C 25 31.077 31.077 34.211 -3.134 25487
4786 1 17 . 1 1 25 25 LYS H H 25 9.119 9.119 8.427 0.692 25487
4787 1 17 . 1 1 26 26 TYR N N 26 123.059 123.059 123.576 -0.517 25487
4788 1 17 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.641 0.358 25487
4789 1 17 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.886 -4.066 25487
4790 1 17 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.055 -4.314 25487
4791 1 17 . 1 1 26 26 TYR H H 26 7.884 7.884 7.607 0.277 25487
4792 1 17 . 1 1 27 27 VAL N N 27 116.468 116.468 116.940 -0.472 25487
4793 1 17 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.557 -0.186 25487
4794 1 17 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.876 -2.361 25487
4795 1 17 . 1 1 27 27 VAL CB C 27 31.945 31.945 34.734 -2.789 25487
4796 1 17 . 1 1 27 27 VAL H H 27 9.012 9.012 9.172 -0.160 25487
4797 1 17 . 1 1 28 28 CYS N N 28 124.932 124.932 123.279 1.653 25487
4798 1 17 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.533 0.221 25487
4799 1 17 . 1 1 28 28 CYS CA C 28 52.200 52.200 59.768 -7.568 25487
4800 1 17 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.185 11.602 25487
4801 1 17 . 1 1 28 28 CYS H H 28 8.874 8.874 8.902 -0.028 25487
4802 1 17 . 1 1 29 29 ASP N N 29 131.592 131.592 129.080 2.512 25487
4803 1 17 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.895 0.050 25487
4804 1 17 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.173 -3.117 25487
4805 1 17 . 1 1 29 29 ASP CB C 29 38.469 38.469 44.419 -5.950 25487
4806 1 17 . 1 1 29 29 ASP H H 29 8.603 8.603 8.656 -0.053 25487
4807 1 17 . 1 1 30 30 CYS N N 30 122.694 122.694 121.434 1.260 25487
4808 1 17 . 1 1 30 30 CYS HA H 30 5.803 5.803 5.026 0.777 25487
4809 1 17 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.101 -5.712 25487
4810 1 17 . 1 1 30 30 CYS CB C 30 43.933 43.933 28.694 15.239 25487
4811 1 17 . 1 1 30 30 CYS H H 30 8.480 8.480 8.620 -0.140 25487
4812 1 17 . 1 1 31 31 PHE N N 31 121.135 121.135 120.740 0.395 25487
4813 1 17 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.446 0.341 25487
4814 1 17 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.063 -4.735 25487
4815 1 17 . 1 1 31 31 PHE H H 31 9.062 9.062 8.643 0.419 25487
4816 1 17 . 1 1 32 32 TYR N N 32 120.021 120.021 117.718 2.303 25487
4817 1 17 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.068 -0.078 25487
4818 1 17 . 1 1 32 32 TYR CA C 32 52.739 52.739 55.275 -2.536 25487
4819 1 17 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.005 -3.523 25487
4820 1 17 . 1 1 32 32 TYR H H 32 8.614 8.614 8.423 0.191 25487
4821 1 17 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.355 0.145 25487
4822 1 17 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.621 -3.132 25487
4823 1 17 . 1 1 33 33 PRO CB C 33 29.653 29.653 31.983 -2.330 25487
4824 1 17 . 1 1 34 34 GLU N N 34 119.222 119.222 115.139 4.083 25487
4825 1 17 . 1 1 34 34 GLU HA H 34 4.345 4.345 4.112 0.233 25487
4826 1 17 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.294 -3.597 25487
4827 1 17 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.191 -2.132 25487
4828 1 17 . 1 1 34 34 GLU H H 34 8.516 8.516 8.586 -0.070 25487
4829 1 17 . 1 1 35 35 GLY N N 35 109.836 109.836 106.153 3.683 25487
4830 1 17 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.774 -3.355 25487
4831 1 17 . 1 1 35 35 GLY H H 35 8.209 8.209 8.374 -0.165 25487
4832 1 17 . 1 1 36 36 GLU N N 36 119.666 119.666 122.144 -2.478 25487
4833 1 17 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.485 -0.260 25487
4834 1 17 . 1 1 36 36 GLU CA C 36 53.566 53.566 55.690 -2.124 25487
4835 1 17 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.013 -2.843 25487
4836 1 17 . 1 1 36 36 GLU H H 36 8.190 8.190 8.261 -0.071 25487
4837 1 17 . 1 1 37 37 ASP N N 37 117.788 117.788 122.802 -5.014 25487
4838 1 17 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.418 0.112 25487
4839 1 17 . 1 1 37 37 ASP CA C 37 50.834 50.834 55.533 -4.699 25487
4840 1 17 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.661 -4.538 25487
4841 1 17 . 1 1 37 37 ASP H H 37 8.305 8.305 8.232 0.073 25487
4842 1 17 . 1 1 38 38 LYS N N 38 119.545 119.545 118.719 0.826 25487
4843 1 17 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.521 -0.055 25487
4844 1 17 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.347 -2.999 25487
4845 1 17 . 1 1 38 38 LYS CB C 38 30.614 30.614 32.558 -1.944 25487
4846 1 17 . 1 1 38 38 LYS H H 38 7.950 7.950 8.175 -0.225 25487
4847 1 17 . 1 1 39 39 THR N N 39 115.195 115.195 114.620 0.575 25487
4848 1 17 . 1 1 39 39 THR HA H 39 4.323 4.323 4.492 -0.170 25487
4849 1 17 . 1 1 39 39 THR CA C 39 59.508 59.508 62.202 -2.693 25487
4850 1 17 . 1 1 39 39 THR CB C 39 67.653 67.653 70.223 -2.570 25487
4851 1 17 . 1 1 39 39 THR H H 39 7.888 7.888 7.619 0.269 25487
4852 1 17 . 1 1 40 40 GLU N N 40 124.664 124.664 124.674 -0.010 25487
4853 1 17 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.703 -0.737 25487
4854 1 17 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.197 -2.168 25487
4855 1 17 . 1 1 40 40 GLU CB C 40 26.467 26.467 31.285 -4.818 25487
4856 1 17 . 1 1 40 40 GLU H H 40 8.345 8.345 8.078 0.267 25487
4857 1 17 . 1 1 41 41 VAL N N 41 124.551 124.551 124.869 -0.318 25487
4858 1 17 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.342 -0.241 25487
4859 1 17 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.644 -3.249 25487
4860 1 17 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.893 -1.998 25487
4861 1 17 . 1 1 41 41 VAL H H 41 8.377 8.377 8.543 -0.166 25487
4862 1 17 . 1 1 42 42 CYS N N 42 122.732 122.732 126.832 -4.100 25487
4863 1 17 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.514 0.241 25487
4864 1 17 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.448 -5.604 25487
4865 1 17 . 1 1 42 42 CYS CB C 42 46.480 46.480 29.014 17.466 25487
4866 1 17 . 1 1 42 42 CYS H H 42 8.712 8.712 9.090 -0.378 25487
4867 1 17 . 1 1 43 43 SER N N 43 117.527 117.527 116.739 0.788 25487
4868 1 17 . 1 1 43 43 SER HA H 43 5.220 5.220 5.330 -0.110 25487
4869 1 17 . 1 1 43 43 SER CA C 43 54.110 54.110 56.507 -2.397 25487
4870 1 17 . 1 1 43 43 SER CB C 43 64.091 64.091 66.213 -2.122 25487
4871 1 17 . 1 1 43 43 SER H H 43 8.828 8.828 9.073 -0.245 25487
4872 1 17 . 1 1 44 44 CYS N N 44 120.721 120.721 122.534 -1.813 25487
4873 1 17 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.422 0.791 25487
4874 1 17 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.328 -7.301 25487
4875 1 17 . 1 1 44 44 CYS CB C 44 36.825 36.825 25.472 11.353 25487
4876 1 17 . 1 1 44 44 CYS H H 44 7.936 7.936 8.744 -0.808 25487
4877 1 17 . 1 1 45 45 GLN N N 45 124.614 124.614 124.935 -0.321 25487
4878 1 17 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.737 -0.093 25487
4879 1 17 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.983 -7.550 25487
4880 1 17 . 1 1 45 45 GLN H H 45 9.892 9.892 9.140 0.752 25487
4881 1 17 . 1 1 46 46 GLN N N 46 120.933 120.933 119.170 1.763 25487
4882 1 17 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.817 0.209 25487
4883 1 17 . 1 1 46 46 GLN CB C 46 25.665 25.665 28.112 -2.447 25487
4884 1 17 . 1 1 46 46 GLN H H 46 8.849 8.849 8.691 0.158 25487
4885 1 17 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.584 -0.064 25487
4886 1 17 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.282 -1.875 25487
4887 1 17 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.982 -3.233 25487
4888 1 17 . 1 1 48 48 LYS N N 48 124.003 124.003 122.689 1.314 25487
4889 1 17 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.857 0.196 25487
4890 1 17 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.796 -4.212 25487
4891 1 17 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.041 -1.477 25487
4892 1 17 . 1 1 48 48 LYS H H 48 8.931 8.931 8.789 0.142 25487
4893 1 17 . 1 1 49 49 SER N N 49 113.527 113.527 113.950 -0.423 25487
4894 1 17 . 1 1 49 49 SER HA H 49 3.995 3.995 4.198 -0.203 25487
4895 1 17 . 1 1 49 49 SER CA C 49 55.458 55.458 61.295 -5.837 25487
4896 1 17 . 1 1 49 49 SER CB C 49 61.270 61.270 62.525 -1.255 25487
4897 1 17 . 1 1 49 49 SER H H 49 8.702 8.702 8.251 0.451 25487
4898 1 17 . 1 1 50 50 HIS N N 50 119.669 119.669 120.133 -0.464 25487
4899 1 17 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.394 -0.067 25487
4900 1 17 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.703 -3.248 25487
4901 1 17 . 1 1 50 50 HIS H H 50 7.664 7.664 8.193 -0.529 25487
4902 1 17 . 1 1 51 51 LYS N N 51 120.030 120.030 120.958 -0.928 25487
4903 1 17 . 1 1 51 51 LYS HA H 51 4.093 4.093 3.942 0.151 25487
4904 1 17 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.884 -3.132 25487
4905 1 17 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.460 -2.079 25487
4906 1 17 . 1 1 51 51 LYS H H 51 7.825 7.825 8.040 -0.215 25487
4907 1 17 . 1 1 52 52 ILE N N 52 118.914 118.914 119.759 -0.845 25487
4908 1 17 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.630 0.091 25487
4909 1 17 . 1 1 52 52 ILE CA C 52 61.825 61.825 65.095 -3.270 25487
4910 1 17 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.753 -2.747 25487
4911 1 17 . 1 1 52 52 ILE H H 52 8.223 8.223 8.020 0.203 25487
4912 1 17 . 1 1 53 53 ALA N N 53 120.985 120.985 122.115 -1.130 25487
4913 1 17 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.944 0.012 25487
4914 1 17 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.667 -2.524 25487
4915 1 17 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.862 -1.116 25487
4916 1 17 . 1 1 53 53 ALA H H 53 8.066 8.066 8.319 -0.253 25487
4917 1 17 . 1 1 54 54 GLU N N 54 115.137 115.137 118.067 -2.930 25487
4918 1 17 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.972 -0.039 25487
4919 1 17 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.316 -2.468 25487
4920 1 17 . 1 1 54 54 GLU H H 54 8.160 8.160 8.081 0.079 25487
4921 1 17 . 1 1 55 55 LYS N N 55 118.610 118.610 118.988 -0.378 25487
4922 1 17 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.072 0.084 25487
4923 1 17 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.017 -2.590 25487
4924 1 17 . 1 1 55 55 LYS H H 55 7.732 7.732 8.007 -0.275 25487
4925 1 17 . 1 1 56 56 ILE N N 56 119.173 119.173 120.336 -1.163 25487
4926 1 17 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.647 -0.020 25487
4927 1 17 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.368 -2.470 25487
4928 1 17 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.861 -2.718 25487
4929 1 17 . 1 1 56 56 ILE H H 56 8.022 8.022 8.234 -0.212 25487
4930 1 17 . 1 1 57 57 ILE N N 57 120.239 120.239 120.453 -0.214 25487
4931 1 17 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.470 0.118 25487
4932 1 17 . 1 1 57 57 ILE CA C 57 62.898 62.898 66.064 -3.166 25487
4933 1 17 . 1 1 57 57 ILE CB C 57 35.037 35.037 37.406 -2.369 25487
4934 1 17 . 1 1 57 57 ILE H H 57 8.370 8.370 8.134 0.236 25487
4935 1 17 . 1 1 58 58 ASP N N 58 118.234 118.234 120.307 -2.073 25487
4936 1 17 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.336 0.076 25487
4937 1 17 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.479 -3.305 25487
4938 1 17 . 1 1 58 58 ASP CB C 58 36.195 36.195 39.991 -3.796 25487
4939 1 17 . 1 1 58 58 ASP H H 58 8.458 8.458 8.454 0.004 25487
4940 1 17 . 1 1 59 59 LYS N N 59 119.380 119.380 119.478 -0.098 25487
4941 1 17 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.049 0.201 25487
4942 1 17 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.987 -4.056 25487
4943 1 17 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.149 -2.088 25487
4944 1 17 . 1 1 59 59 LYS H H 59 7.928 7.928 8.259 -0.331 25487
4945 1 17 . 1 1 60 60 ALA N N 60 123.604 123.604 122.171 1.433 25487
4946 1 17 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.116 -0.131 25487
4947 1 17 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.427 -1.614 25487
4948 1 17 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.831 -3.034 25487
4949 1 17 . 1 1 60 60 ALA H H 60 8.699 8.699 8.099 0.600 25487
4950 1 17 . 1 1 61 61 LYS N N 61 115.317 115.317 117.045 -1.728 25487
4951 1 17 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.030 -0.012 25487
4952 1 17 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.355 -1.570 25487
4953 1 17 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.919 -2.412 25487
4954 1 17 . 1 1 61 61 LYS H H 61 8.361 8.361 8.046 0.315 25487
4955 1 17 . 1 1 62 62 THR N N 62 107.298 107.298 108.769 -1.471 25487
4956 1 17 . 1 1 62 62 THR HA H 62 4.368 4.368 4.074 0.294 25487
4957 1 17 . 1 1 62 62 THR CA C 62 60.427 60.427 63.840 -3.413 25487
4958 1 17 . 1 1 62 62 THR CB C 62 67.179 67.179 67.471 -0.292 25487
4959 1 17 . 1 1 62 62 THR H H 62 7.510 7.510 8.474 -0.964 25487
4960 1 17 . 1 1 63 63 THR N N 63 115.701 115.701 113.236 2.465 25487
4961 1 17 . 1 1 63 63 THR HA H 63 4.328 4.328 4.298 0.030 25487
4962 1 17 . 1 1 63 63 THR CA C 63 61.695 61.695 63.517 -1.822 25487
4963 1 17 . 1 1 63 63 THR CB C 63 67.641 67.641 69.231 -1.591 25487
4964 1 17 . 1 1 63 63 THR H H 63 7.651 7.651 8.343 -0.692 25487
4965 1 18 . 1 1 2 2 LYS N N 2 121.111 121.111 119.806 1.305 25487
4966 1 18 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.436 -0.111 25487
4967 1 18 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.004 -2.341 25487
4968 1 18 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.585 -2.170 25487
4969 1 18 . 1 1 2 2 LYS H H 2 8.492 8.492 8.257 0.235 25487
4970 1 18 . 1 1 3 3 ALA N N 3 126.440 126.440 125.591 0.849 25487
4971 1 18 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.475 -0.050 25487
4972 1 18 . 1 1 3 3 ALA CA C 3 49.447 49.447 51.911 -2.464 25487
4973 1 18 . 1 1 3 3 ALA CB C 3 16.905 16.905 17.000 -0.095 25487
4974 1 18 . 1 1 3 3 ALA H H 3 8.357 8.357 8.473 -0.115 25487
4975 1 18 . 1 1 4 4 CYS N N 4 116.834 116.834 116.172 0.662 25487
4976 1 18 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.732 0.171 25487
4977 1 18 . 1 1 4 4 CYS CA C 4 51.793 51.793 57.175 -5.383 25487
4978 1 18 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.334 10.960 25487
4979 1 18 . 1 1 4 4 CYS H H 4 8.145 8.145 7.464 0.681 25487
4980 1 18 . 1 1 5 5 THR N N 5 121.220 121.220 117.605 3.615 25487
4981 1 18 . 1 1 5 5 THR HA H 5 4.481 4.481 4.852 -0.371 25487
4982 1 18 . 1 1 5 5 THR CA C 5 58.256 58.256 60.375 -2.119 25487
4983 1 18 . 1 1 5 5 THR CB C 5 67.043 67.043 68.641 -1.598 25487
4984 1 18 . 1 1 5 5 THR H H 5 9.070 9.070 8.489 0.581 25487
4985 1 18 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.480 -0.228 25487
4986 1 18 . 1 1 6 6 PRO CA C 6 59.239 59.239 61.996 -2.757 25487
4987 1 18 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.475 -1.946 25487
4988 1 18 . 1 1 7 7 LEU N N 7 119.270 119.270 119.875 -0.605 25487
4989 1 18 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.907 -0.651 25487
4990 1 18 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.441 -1.381 25487
4991 1 18 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.195 -2.989 25487
4992 1 18 . 1 1 7 7 LEU H H 7 7.797 7.797 8.004 -0.207 25487
4993 1 18 . 1 1 8 8 LEU N N 8 119.586 119.586 121.787 -2.201 25487
4994 1 18 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.899 -0.077 25487
4995 1 18 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.806 -0.883 25487
4996 1 18 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.492 -2.890 25487
4997 1 18 . 1 1 8 8 LEU H H 8 9.465 9.465 8.713 0.752 25487
4998 1 18 . 1 1 9 9 HIS N N 9 117.507 117.507 116.791 0.716 25487
4999 1 18 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.778 -0.032 25487
5000 1 18 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.415 -1.988 25487
5001 1 18 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.938 -6.830 25487
5002 1 18 . 1 1 9 9 HIS H H 9 8.159 8.159 8.023 0.136 25487
5003 1 18 . 1 1 10 10 ASP N N 10 119.492 119.492 120.797 -1.305 25487
5004 1 18 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.599 0.284 25487
5005 1 18 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.982 -2.644 25487
5006 1 18 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.059 -0.589 25487
5007 1 18 . 1 1 10 10 ASP H H 10 8.341 8.341 8.549 -0.208 25487
5008 1 18 . 1 1 11 11 CYS N N 11 121.767 121.767 118.146 3.621 25487
5009 1 18 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.879 0.250 25487
5010 1 18 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.952 -4.196 25487
5011 1 18 . 1 1 11 11 CYS CB C 11 42.236 42.236 27.124 15.112 25487
5012 1 18 . 1 1 11 11 CYS H H 11 8.017 8.017 8.431 -0.414 25487
5013 1 18 . 1 1 12 12 SER N N 12 118.618 118.618 119.882 -1.264 25487
5014 1 18 . 1 1 12 12 SER HA H 12 3.759 3.759 4.111 -0.352 25487
5015 1 18 . 1 1 12 12 SER CB C 12 59.972 59.972 62.962 -2.990 25487
5016 1 18 . 1 1 12 12 SER H H 12 8.844 8.844 8.453 0.391 25487
5017 1 18 . 1 1 13 13 HIS N N 13 117.166 117.166 115.148 2.018 25487
5018 1 18 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.636 -0.014 25487
5019 1 18 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.807 -4.354 25487
5020 1 18 . 1 1 13 13 HIS H H 13 8.547 8.547 8.462 0.085 25487
5021 1 18 . 1 1 14 14 ASP N N 14 117.382 117.382 119.874 -2.492 25487
5022 1 18 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.904 -0.213 25487
5023 1 18 . 1 1 14 14 ASP CA C 14 51.192 51.192 53.981 -2.789 25487
5024 1 18 . 1 1 14 14 ASP CB C 14 36.424 36.424 41.579 -5.155 25487
5025 1 18 . 1 1 14 14 ASP H H 14 7.224 7.224 7.900 -0.676 25487
5026 1 18 . 1 1 15 15 ARG N N 15 124.498 124.498 121.409 3.089 25487
5027 1 18 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.330 0.387 25487
5028 1 18 . 1 1 15 15 ARG CA C 15 53.533 53.533 58.813 -5.280 25487
5029 1 18 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.827 -0.435 25487
5030 1 18 . 1 1 15 15 ARG H H 15 9.004 9.004 8.429 0.575 25487
5031 1 18 . 1 1 16 16 HIS N N 16 116.269 116.269 117.195 -0.926 25487
5032 1 18 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.827 0.241 25487
5033 1 18 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.071 -2.596 25487
5034 1 18 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.609 -3.933 25487
5035 1 18 . 1 1 16 16 HIS H H 16 8.528 8.528 8.410 0.118 25487
5036 1 18 . 1 1 17 17 SER N N 17 112.719 112.719 114.310 -1.591 25487
5037 1 18 . 1 1 17 17 SER HA H 17 4.493 4.493 4.598 -0.105 25487
5038 1 18 . 1 1 17 17 SER CA C 17 56.591 56.591 59.230 -2.639 25487
5039 1 18 . 1 1 17 17 SER CB C 17 62.736 62.736 64.194 -1.458 25487
5040 1 18 . 1 1 17 17 SER H H 17 7.503 7.503 8.322 -0.819 25487
5041 1 18 . 1 1 18 18 CYS N N 18 122.070 122.070 120.616 1.454 25487
5042 1 18 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.433 0.641 25487
5043 1 18 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.206 -5.632 25487
5044 1 18 . 1 1 18 18 CYS CB C 18 36.825 36.825 27.225 9.600 25487
5045 1 18 . 1 1 18 18 CYS H H 18 8.651 8.651 7.915 0.736 25487
5046 1 18 . 1 1 19 19 CYS N N 19 118.243 118.243 125.018 -6.775 25487
5047 1 18 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.393 0.127 25487
5048 1 18 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.378 -6.830 25487
5049 1 18 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.628 11.762 25487
5050 1 18 . 1 1 19 19 CYS H H 19 8.936 8.936 8.428 0.508 25487
5051 1 18 . 1 1 20 20 ARG N N 20 116.858 116.858 121.330 -4.472 25487
5052 1 18 . 1 1 20 20 ARG HA H 20 4.099 4.099 3.977 0.122 25487
5053 1 18 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.391 -3.386 25487
5054 1 18 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.420 -1.791 25487
5055 1 18 . 1 1 20 20 ARG H H 20 8.136 8.136 8.384 -0.248 25487
5056 1 18 . 1 1 21 21 GLY N N 21 110.611 110.611 108.808 1.803 25487
5057 1 18 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.846 -2.050 25487
5058 1 18 . 1 1 21 21 GLY H H 21 7.569 7.569 7.374 0.195 25487
5059 1 18 . 1 1 22 22 ASP N N 22 121.161 121.161 119.399 1.762 25487
5060 1 18 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.676 -0.341 25487
5061 1 18 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.483 -2.820 25487
5062 1 18 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.308 -4.924 25487
5063 1 18 . 1 1 22 22 ASP H H 22 8.674 8.674 8.822 -0.148 25487
5064 1 18 . 1 1 23 23 MET N N 23 114.811 114.811 115.400 -0.589 25487
5065 1 18 . 1 1 23 23 MET HA H 23 4.218 4.218 4.307 -0.089 25487
5066 1 18 . 1 1 23 23 MET CA C 23 53.190 53.190 56.350 -3.160 25487
5067 1 18 . 1 1 23 23 MET CB C 23 30.586 30.586 35.912 -5.326 25487
5068 1 18 . 1 1 23 23 MET H H 23 8.333 8.333 7.835 0.498 25487
5069 1 18 . 1 1 24 24 PHE N N 24 116.019 116.019 117.168 -1.149 25487
5070 1 18 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.719 0.108 25487
5071 1 18 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.090 2.451 25487
5072 1 18 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.993 -3.197 25487
5073 1 18 . 1 1 24 24 PHE H H 24 7.821 7.821 7.401 0.420 25487
5074 1 18 . 1 1 25 25 LYS N N 25 123.768 123.768 120.868 2.900 25487
5075 1 18 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.029 0.017 25487
5076 1 18 . 1 1 25 25 LYS CA C 25 54.638 54.638 55.860 -1.222 25487
5077 1 18 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.209 -2.131 25487
5078 1 18 . 1 1 25 25 LYS H H 25 9.119 9.119 8.096 1.023 25487
5079 1 18 . 1 1 26 26 TYR N N 26 123.059 123.059 123.372 -0.313 25487
5080 1 18 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.439 0.560 25487
5081 1 18 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.175 -4.354 25487
5082 1 18 . 1 1 26 26 TYR CB C 26 34.741 34.741 38.694 -3.953 25487
5083 1 18 . 1 1 26 26 TYR H H 26 7.884 7.884 7.480 0.404 25487
5084 1 18 . 1 1 27 27 VAL N N 27 116.468 116.468 120.509 -4.041 25487
5085 1 18 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.411 -0.040 25487
5086 1 18 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.789 -2.274 25487
5087 1 18 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.238 -3.293 25487
5088 1 18 . 1 1 27 27 VAL H H 27 9.012 9.012 8.742 0.270 25487
5089 1 18 . 1 1 28 28 CYS N N 28 124.932 124.932 127.015 -2.083 25487
5090 1 18 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.627 0.127 25487
5091 1 18 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.952 -5.752 25487
5092 1 18 . 1 1 28 28 CYS CB C 28 37.787 37.787 27.151 10.636 25487
5093 1 18 . 1 1 28 28 CYS H H 28 8.874 8.874 8.977 -0.103 25487
5094 1 18 . 1 1 29 29 ASP N N 29 131.592 131.592 129.295 2.297 25487
5095 1 18 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.859 0.086 25487
5096 1 18 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.203 -3.147 25487
5097 1 18 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.089 -4.620 25487
5098 1 18 . 1 1 29 29 ASP H H 29 8.603 8.603 8.567 0.036 25487
5099 1 18 . 1 1 30 30 CYS N N 30 122.694 122.694 122.112 0.582 25487
5100 1 18 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.596 1.207 25487
5101 1 18 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.774 -6.385 25487
5102 1 18 . 1 1 30 30 CYS CB C 30 43.933 43.933 28.846 15.087 25487
5103 1 18 . 1 1 30 30 CYS H H 30 8.480 8.480 8.700 -0.220 25487
5104 1 18 . 1 1 31 31 PHE N N 31 121.135 121.135 121.488 -0.353 25487
5105 1 18 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.532 0.255 25487
5106 1 18 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.395 -5.067 25487
5107 1 18 . 1 1 31 31 PHE H H 31 9.062 9.062 8.639 0.423 25487
5108 1 18 . 1 1 32 32 TYR N N 32 120.021 120.021 116.735 3.286 25487
5109 1 18 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.294 -0.304 25487
5110 1 18 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.585 -1.846 25487
5111 1 18 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.793 -4.311 25487
5112 1 18 . 1 1 32 32 TYR H H 32 8.614 8.614 8.547 0.067 25487
5113 1 18 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.386 0.114 25487
5114 1 18 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.278 -2.789 25487
5115 1 18 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.221 -0.568 25487
5116 1 18 . 1 1 34 34 GLU N N 34 119.222 119.222 118.270 0.952 25487
5117 1 18 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.960 0.385 25487
5118 1 18 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.537 -3.840 25487
5119 1 18 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.918 -2.859 25487
5120 1 18 . 1 1 34 34 GLU H H 34 8.516 8.516 8.689 -0.173 25487
5121 1 18 . 1 1 35 35 GLY N N 35 109.836 109.836 103.452 6.384 25487
5122 1 18 . 1 1 35 35 GLY CA C 35 42.419 42.419 44.855 -2.436 25487
5123 1 18 . 1 1 35 35 GLY H H 35 8.209 8.209 7.757 0.452 25487
5124 1 18 . 1 1 36 36 GLU N N 36 119.666 119.666 119.679 -0.013 25487
5125 1 18 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.058 0.167 25487
5126 1 18 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.429 -2.863 25487
5127 1 18 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.419 -3.249 25487
5128 1 18 . 1 1 36 36 GLU H H 36 8.190 8.190 8.343 -0.153 25487
5129 1 18 . 1 1 37 37 ASP N N 37 117.788 117.788 117.883 -0.095 25487
5130 1 18 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.708 -0.178 25487
5131 1 18 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.518 -3.684 25487
5132 1 18 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.566 -4.443 25487
5133 1 18 . 1 1 37 37 ASP H H 37 8.305 8.305 8.112 0.193 25487
5134 1 18 . 1 1 38 38 LYS N N 38 119.545 119.545 118.985 0.560 25487
5135 1 18 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.651 -0.185 25487
5136 1 18 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.971 -3.623 25487
5137 1 18 . 1 1 38 38 LYS CB C 38 30.614 30.614 35.386 -4.772 25487
5138 1 18 . 1 1 38 38 LYS H H 38 7.950 7.950 8.273 -0.323 25487
5139 1 18 . 1 1 39 39 THR N N 39 115.195 115.195 115.223 -0.028 25487
5140 1 18 . 1 1 39 39 THR HA H 39 4.323 4.323 4.660 -0.337 25487
5141 1 18 . 1 1 39 39 THR CA C 39 59.508 59.508 61.634 -2.126 25487
5142 1 18 . 1 1 39 39 THR CB C 39 67.653 67.653 71.409 -3.756 25487
5143 1 18 . 1 1 39 39 THR H H 39 7.888 7.888 8.246 -0.358 25487
5144 1 18 . 1 1 40 40 GLU N N 40 124.664 124.664 125.366 -0.702 25487
5145 1 18 . 1 1 40 40 GLU HA H 40 3.966 3.966 5.001 -1.035 25487
5146 1 18 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.129 -2.100 25487
5147 1 18 . 1 1 40 40 GLU CB C 40 26.467 26.467 29.924 -3.457 25487
5148 1 18 . 1 1 40 40 GLU H H 40 8.345 8.345 8.616 -0.271 25487
5149 1 18 . 1 1 41 41 VAL N N 41 124.551 124.551 126.554 -2.003 25487
5150 1 18 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.257 -0.156 25487
5151 1 18 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.496 -3.101 25487
5152 1 18 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.517 -1.621 25487
5153 1 18 . 1 1 41 41 VAL H H 41 8.377 8.377 8.715 -0.338 25487
5154 1 18 . 1 1 42 42 CYS N N 42 122.732 122.732 126.756 -4.024 25487
5155 1 18 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.499 0.256 25487
5156 1 18 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.317 -5.473 25487
5157 1 18 . 1 1 42 42 CYS CB C 42 46.480 46.480 31.315 15.165 25487
5158 1 18 . 1 1 42 42 CYS H H 42 8.712 8.712 8.948 -0.236 25487
5159 1 18 . 1 1 43 43 SER N N 43 117.527 117.527 115.510 2.017 25487
5160 1 18 . 1 1 43 43 SER HA H 43 5.220 5.220 5.192 0.028 25487
5161 1 18 . 1 1 43 43 SER CA C 43 54.110 54.110 56.847 -2.737 25487
5162 1 18 . 1 1 43 43 SER CB C 43 64.091 64.091 65.650 -1.558 25487
5163 1 18 . 1 1 43 43 SER H H 43 8.828 8.828 8.936 -0.108 25487
5164 1 18 . 1 1 44 44 CYS N N 44 120.721 120.721 123.306 -2.585 25487
5165 1 18 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.604 0.609 25487
5166 1 18 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.138 -7.110 25487
5167 1 18 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.548 10.277 25487
5168 1 18 . 1 1 44 44 CYS H H 44 7.936 7.936 8.826 -0.890 25487
5169 1 18 . 1 1 45 45 GLN N N 45 124.614 124.614 124.550 0.064 25487
5170 1 18 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.662 -0.018 25487
5171 1 18 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.895 -7.462 25487
5172 1 18 . 1 1 45 45 GLN H H 45 9.892 9.892 9.090 0.802 25487
5173 1 18 . 1 1 46 46 GLN N N 46 120.933 120.933 120.427 0.506 25487
5174 1 18 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.824 0.202 25487
5175 1 18 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.683 -4.018 25487
5176 1 18 . 1 1 46 46 GLN H H 46 8.849 8.849 8.534 0.315 25487
5177 1 18 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.531 -0.011 25487
5178 1 18 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.227 -1.820 25487
5179 1 18 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.898 -3.150 25487
5180 1 18 . 1 1 48 48 LYS N N 48 124.003 124.003 120.965 3.038 25487
5181 1 18 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.892 0.161 25487
5182 1 18 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.254 -3.670 25487
5183 1 18 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.252 -1.688 25487
5184 1 18 . 1 1 48 48 LYS H H 48 8.931 8.931 8.612 0.319 25487
5185 1 18 . 1 1 49 49 SER N N 49 113.527 113.527 114.208 -0.681 25487
5186 1 18 . 1 1 49 49 SER HA H 49 3.995 3.995 3.959 0.036 25487
5187 1 18 . 1 1 49 49 SER CA C 49 55.458 55.458 62.209 -6.751 25487
5188 1 18 . 1 1 49 49 SER CB C 49 61.270 61.270 62.010 -0.740 25487
5189 1 18 . 1 1 49 49 SER H H 49 8.702 8.702 8.133 0.569 25487
5190 1 18 . 1 1 50 50 HIS N N 50 119.669 119.669 119.813 -0.144 25487
5191 1 18 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.227 0.100 25487
5192 1 18 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.865 -3.410 25487
5193 1 18 . 1 1 50 50 HIS H H 50 7.664 7.664 8.354 -0.690 25487
5194 1 18 . 1 1 51 51 LYS N N 51 120.030 120.030 119.127 0.903 25487
5195 1 18 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.086 0.007 25487
5196 1 18 . 1 1 51 51 LYS CA C 51 56.752 56.752 58.857 -2.105 25487
5197 1 18 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.227 -1.846 25487
5198 1 18 . 1 1 51 51 LYS H H 51 7.825 7.825 8.205 -0.380 25487
5199 1 18 . 1 1 52 52 ILE N N 52 118.914 118.914 119.900 -0.986 25487
5200 1 18 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.718 0.003 25487
5201 1 18 . 1 1 52 52 ILE CA C 52 61.825 61.825 63.886 -2.061 25487
5202 1 18 . 1 1 52 52 ILE CB C 52 35.006 35.006 36.550 -1.544 25487
5203 1 18 . 1 1 52 52 ILE H H 52 8.223 8.223 8.023 0.200 25487
5204 1 18 . 1 1 53 53 ALA N N 53 120.985 120.985 121.939 -0.954 25487
5205 1 18 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.899 0.057 25487
5206 1 18 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.662 -2.519 25487
5207 1 18 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.911 -1.165 25487
5208 1 18 . 1 1 53 53 ALA H H 53 8.066 8.066 8.659 -0.593 25487
5209 1 18 . 1 1 54 54 GLU N N 54 115.137 115.137 118.261 -3.124 25487
5210 1 18 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.918 0.015 25487
5211 1 18 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.425 -2.577 25487
5212 1 18 . 1 1 54 54 GLU H H 54 8.160 8.160 8.017 0.143 25487
5213 1 18 . 1 1 55 55 LYS N N 55 118.610 118.610 119.801 -1.191 25487
5214 1 18 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.034 0.122 25487
5215 1 18 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.729 -3.302 25487
5216 1 18 . 1 1 55 55 LYS H H 55 7.732 7.732 8.017 -0.285 25487
5217 1 18 . 1 1 56 56 ILE N N 56 119.173 119.173 120.692 -1.519 25487
5218 1 18 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.735 -0.108 25487
5219 1 18 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.525 -1.627 25487
5220 1 18 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.908 -1.765 25487
5221 1 18 . 1 1 56 56 ILE H H 56 8.022 8.022 8.146 -0.124 25487
5222 1 18 . 1 1 57 57 ILE N N 57 120.239 120.239 120.270 -0.031 25487
5223 1 18 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.612 -0.024 25487
5224 1 18 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.242 -1.344 25487
5225 1 18 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.014 -0.978 25487
5226 1 18 . 1 1 57 57 ILE H H 57 8.370 8.370 8.345 0.025 25487
5227 1 18 . 1 1 58 58 ASP N N 58 118.234 118.234 120.801 -2.567 25487
5228 1 18 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.378 0.034 25487
5229 1 18 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.640 -3.466 25487
5230 1 18 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.236 -4.041 25487
5231 1 18 . 1 1 58 58 ASP H H 58 8.458 8.458 8.342 0.116 25487
5232 1 18 . 1 1 59 59 LYS N N 59 119.380 119.380 119.984 -0.604 25487
5233 1 18 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.021 0.229 25487
5234 1 18 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.244 -4.313 25487
5235 1 18 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.633 -2.572 25487
5236 1 18 . 1 1 59 59 LYS H H 59 7.928 7.928 8.014 -0.086 25487
5237 1 18 . 1 1 60 60 ALA N N 60 123.604 123.604 122.522 1.082 25487
5238 1 18 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.146 -0.161 25487
5239 1 18 . 1 1 60 60 ALA CA C 60 52.813 52.813 54.754 -1.941 25487
5240 1 18 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.502 -2.705 25487
5241 1 18 . 1 1 60 60 ALA H H 60 8.699 8.699 8.265 0.434 25487
5242 1 18 . 1 1 61 61 LYS N N 61 115.317 115.317 118.471 -3.154 25487
5243 1 18 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.071 -0.053 25487
5244 1 18 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.664 -1.879 25487
5245 1 18 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.931 -2.424 25487
5246 1 18 . 1 1 61 61 LYS H H 61 8.361 8.361 8.155 0.206 25487
5247 1 18 . 1 1 62 62 THR N N 62 107.298 107.298 111.076 -3.778 25487
5248 1 18 . 1 1 62 62 THR HA H 62 4.368 4.368 4.105 0.263 25487
5249 1 18 . 1 1 62 62 THR CA C 62 60.427 60.427 64.304 -3.877 25487
5250 1 18 . 1 1 62 62 THR CB C 62 67.179 67.179 66.838 0.341 25487
5251 1 18 . 1 1 62 62 THR H H 62 7.510 7.510 8.588 -1.078 25487
5252 1 18 . 1 1 63 63 THR N N 63 115.701 115.701 114.850 0.851 25487
5253 1 18 . 1 1 63 63 THR HA H 63 4.328 4.328 4.258 0.070 25487
5254 1 18 . 1 1 63 63 THR CA C 63 61.695 61.695 63.197 -1.502 25487
5255 1 18 . 1 1 63 63 THR CB C 63 67.641 67.641 69.358 -1.717 25487
5256 1 18 . 1 1 63 63 THR H H 63 7.651 7.651 7.960 -0.309 25487
5257 1 19 . 1 1 2 2 LYS N N 2 121.111 121.111 121.398 -0.287 25487
5258 1 19 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.576 -0.251 25487
5259 1 19 . 1 1 2 2 LYS CA C 2 53.663 53.663 55.963 -2.300 25487
5260 1 19 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.353 -2.938 25487
5261 1 19 . 1 1 2 2 LYS H H 2 8.492 8.492 8.227 0.265 25487
5262 1 19 . 1 1 3 3 ALA N N 3 126.440 126.440 125.405 1.035 25487
5263 1 19 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.314 0.111 25487
5264 1 19 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.112 -2.665 25487
5265 1 19 . 1 1 3 3 ALA CB C 3 16.905 16.905 19.564 -2.659 25487
5266 1 19 . 1 1 3 3 ALA H H 3 8.357 8.357 8.505 -0.148 25487
5267 1 19 . 1 1 4 4 CYS N N 4 116.834 116.834 119.158 -2.324 25487
5268 1 19 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.663 0.240 25487
5269 1 19 . 1 1 4 4 CYS CA C 4 51.793 51.793 56.394 -4.601 25487
5270 1 19 . 1 1 4 4 CYS CB C 4 41.294 41.294 30.250 11.044 25487
5271 1 19 . 1 1 4 4 CYS H H 4 8.145 8.145 8.224 -0.079 25487
5272 1 19 . 1 1 5 5 THR N N 5 121.220 121.220 117.806 3.414 25487
5273 1 19 . 1 1 5 5 THR HA H 5 4.481 4.481 4.733 -0.252 25487
5274 1 19 . 1 1 5 5 THR CA C 5 58.256 58.256 60.166 -1.910 25487
5275 1 19 . 1 1 5 5 THR CB C 5 67.043 67.043 68.079 -1.036 25487
5276 1 19 . 1 1 5 5 THR H H 5 9.070 9.070 8.629 0.441 25487
5277 1 19 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.372 -0.120 25487
5278 1 19 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.190 -2.951 25487
5279 1 19 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.413 -1.884 25487
5280 1 19 . 1 1 7 7 LEU N N 7 119.270 119.270 119.666 -0.396 25487
5281 1 19 . 1 1 7 7 LEU HA H 7 3.256 3.256 4.015 -0.759 25487
5282 1 19 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.392 -1.332 25487
5283 1 19 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.396 -3.190 25487
5284 1 19 . 1 1 7 7 LEU H H 7 7.797 7.797 7.899 -0.102 25487
5285 1 19 . 1 1 8 8 LEU N N 8 119.586 119.586 121.913 -2.327 25487
5286 1 19 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.899 -0.077 25487
5287 1 19 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.700 -0.777 25487
5288 1 19 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.593 -2.991 25487
5289 1 19 . 1 1 8 8 LEU H H 8 9.465 9.465 8.841 0.624 25487
5290 1 19 . 1 1 9 9 HIS N N 9 117.507 117.507 116.575 0.932 25487
5291 1 19 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.800 -0.054 25487
5292 1 19 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.501 -2.074 25487
5293 1 19 . 1 1 9 9 HIS CB C 9 27.108 27.108 34.017 -6.909 25487
5294 1 19 . 1 1 9 9 HIS H H 9 8.159 8.159 8.040 0.119 25487
5295 1 19 . 1 1 10 10 ASP N N 10 119.492 119.492 120.141 -0.649 25487
5296 1 19 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.720 0.163 25487
5297 1 19 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.694 -2.356 25487
5298 1 19 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.813 -1.343 25487
5299 1 19 . 1 1 10 10 ASP H H 10 8.341 8.341 8.602 -0.261 25487
5300 1 19 . 1 1 11 11 CYS N N 11 121.767 121.767 117.941 3.826 25487
5301 1 19 . 1 1 11 11 CYS HA H 11 5.129 5.129 5.070 0.059 25487
5302 1 19 . 1 1 11 11 CYS CA C 11 52.756 52.756 57.058 -4.302 25487
5303 1 19 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.477 13.759 25487
5304 1 19 . 1 1 11 11 CYS H H 11 8.017 8.017 8.300 -0.283 25487
5305 1 19 . 1 1 12 12 SER N N 12 118.618 118.618 119.887 -1.269 25487
5306 1 19 . 1 1 12 12 SER HA H 12 3.759 3.759 4.075 -0.316 25487
5307 1 19 . 1 1 12 12 SER CB C 12 59.972 59.972 62.811 -2.839 25487
5308 1 19 . 1 1 12 12 SER H H 12 8.844 8.844 8.442 0.402 25487
5309 1 19 . 1 1 13 13 HIS N N 13 117.166 117.166 115.652 1.514 25487
5310 1 19 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.576 0.046 25487
5311 1 19 . 1 1 13 13 HIS CB C 13 25.453 25.453 29.984 -4.531 25487
5312 1 19 . 1 1 13 13 HIS H H 13 8.547 8.547 8.431 0.116 25487
5313 1 19 . 1 1 14 14 ASP N N 14 117.382 117.382 119.816 -2.434 25487
5314 1 19 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.889 -0.198 25487
5315 1 19 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.212 -3.020 25487
5316 1 19 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.613 -6.189 25487
5317 1 19 . 1 1 14 14 ASP H H 14 7.224 7.224 7.795 -0.571 25487
5318 1 19 . 1 1 15 15 ARG N N 15 124.498 124.498 122.020 2.478 25487
5319 1 19 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.237 0.480 25487
5320 1 19 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.929 -4.396 25487
5321 1 19 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.538 -0.146 25487
5322 1 19 . 1 1 15 15 ARG H H 15 9.004 9.004 8.558 0.446 25487
5323 1 19 . 1 1 16 16 HIS N N 16 116.269 116.269 115.145 1.124 25487
5324 1 19 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.758 0.310 25487
5325 1 19 . 1 1 16 16 HIS CA C 16 52.475 52.475 56.621 -4.146 25487
5326 1 19 . 1 1 16 16 HIS CB C 16 25.676 25.676 28.757 -3.081 25487
5327 1 19 . 1 1 16 16 HIS H H 16 8.528 8.528 8.479 0.049 25487
5328 1 19 . 1 1 17 17 SER N N 17 112.719 112.719 114.412 -1.693 25487
5329 1 19 . 1 1 17 17 SER HA H 17 4.493 4.493 4.516 -0.023 25487
5330 1 19 . 1 1 17 17 SER CA C 17 56.591 56.591 58.987 -2.396 25487
5331 1 19 . 1 1 17 17 SER CB C 17 62.736 62.736 64.076 -1.340 25487
5332 1 19 . 1 1 17 17 SER H H 17 7.503 7.503 7.937 -0.434 25487
5333 1 19 . 1 1 18 18 CYS N N 18 122.070 122.070 122.034 0.036 25487
5334 1 19 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.493 0.581 25487
5335 1 19 . 1 1 18 18 CYS CA C 18 54.574 54.574 60.456 -5.883 25487
5336 1 19 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.975 9.850 25487
5337 1 19 . 1 1 18 18 CYS H H 18 8.651 8.651 7.646 1.005 25487
5338 1 19 . 1 1 19 19 CYS N N 19 118.243 118.243 122.365 -4.122 25487
5339 1 19 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.523 -0.003 25487
5340 1 19 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.944 -6.396 25487
5341 1 19 . 1 1 19 19 CYS CB C 19 39.390 39.390 27.907 11.483 25487
5342 1 19 . 1 1 19 19 CYS H H 19 8.936 8.936 8.329 0.607 25487
5343 1 19 . 1 1 20 20 ARG N N 20 116.858 116.858 123.423 -6.565 25487
5344 1 19 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.026 0.073 25487
5345 1 19 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.621 -3.616 25487
5346 1 19 . 1 1 20 20 ARG CB C 20 29.629 29.629 30.879 -1.250 25487
5347 1 19 . 1 1 20 20 ARG H H 20 8.136 8.136 8.425 -0.289 25487
5348 1 19 . 1 1 21 21 GLY N N 21 110.611 110.611 106.522 4.089 25487
5349 1 19 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.760 -1.964 25487
5350 1 19 . 1 1 21 21 GLY H H 21 7.569 7.569 8.085 -0.516 25487
5351 1 19 . 1 1 22 22 ASP N N 22 121.161 121.161 119.705 1.456 25487
5352 1 19 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.555 -0.220 25487
5353 1 19 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.943 -3.280 25487
5354 1 19 . 1 1 22 22 ASP CB C 22 36.384 36.384 40.976 -4.592 25487
5355 1 19 . 1 1 22 22 ASP H H 22 8.674 8.674 8.664 0.010 25487
5356 1 19 . 1 1 23 23 MET N N 23 114.811 114.811 115.519 -0.708 25487
5357 1 19 . 1 1 23 23 MET HA H 23 4.218 4.218 4.308 -0.090 25487
5358 1 19 . 1 1 23 23 MET CA C 23 53.190 53.190 55.640 -2.450 25487
5359 1 19 . 1 1 23 23 MET CB C 23 30.586 30.586 34.694 -4.108 25487
5360 1 19 . 1 1 23 23 MET H H 23 8.333 8.333 7.962 0.371 25487
5361 1 19 . 1 1 24 24 PHE N N 24 116.019 116.019 118.317 -2.298 25487
5362 1 19 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.717 0.110 25487
5363 1 19 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.491 2.050 25487
5364 1 19 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.347 -2.551 25487
5365 1 19 . 1 1 24 24 PHE H H 24 7.821 7.821 7.745 0.076 25487
5366 1 19 . 1 1 25 25 LYS N N 25 123.768 123.768 123.260 0.508 25487
5367 1 19 . 1 1 25 25 LYS HA H 25 4.046 4.046 3.882 0.164 25487
5368 1 19 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.843 -2.205 25487
5369 1 19 . 1 1 25 25 LYS CB C 25 31.077 31.077 32.940 -1.863 25487
5370 1 19 . 1 1 25 25 LYS H H 25 9.119 9.119 8.446 0.673 25487
5371 1 19 . 1 1 26 26 TYR N N 26 123.059 123.059 118.254 4.805 25487
5372 1 19 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.392 0.607 25487
5373 1 19 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.667 -4.847 25487
5374 1 19 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.038 -4.297 25487
5375 1 19 . 1 1 26 26 TYR H H 26 7.884 7.884 7.530 0.354 25487
5376 1 19 . 1 1 27 27 VAL N N 27 116.468 116.468 117.914 -1.446 25487
5377 1 19 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.489 -0.118 25487
5378 1 19 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.696 -2.181 25487
5379 1 19 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.886 -3.942 25487
5380 1 19 . 1 1 27 27 VAL H H 27 9.012 9.012 8.892 0.120 25487
5381 1 19 . 1 1 28 28 CYS N N 28 124.932 124.932 126.986 -2.054 25487
5382 1 19 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.838 -0.084 25487
5383 1 19 . 1 1 28 28 CYS CA C 28 52.200 52.200 57.685 -5.485 25487
5384 1 19 . 1 1 28 28 CYS CB C 28 37.787 37.787 27.230 10.556 25487
5385 1 19 . 1 1 28 28 CYS H H 28 8.874 8.874 8.786 0.088 25487
5386 1 19 . 1 1 29 29 ASP N N 29 131.592 131.592 129.422 2.170 25487
5387 1 19 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.738 0.207 25487
5388 1 19 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.480 -3.424 25487
5389 1 19 . 1 1 29 29 ASP CB C 29 38.469 38.469 42.530 -4.061 25487
5390 1 19 . 1 1 29 29 ASP H H 29 8.603 8.603 8.578 0.025 25487
5391 1 19 . 1 1 30 30 CYS N N 30 122.694 122.694 121.354 1.340 25487
5392 1 19 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.631 1.172 25487
5393 1 19 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.282 -5.893 25487
5394 1 19 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.583 14.350 25487
5395 1 19 . 1 1 30 30 CYS H H 30 8.480 8.480 8.529 -0.049 25487
5396 1 19 . 1 1 31 31 PHE N N 31 121.135 121.135 119.774 1.361 25487
5397 1 19 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.467 0.320 25487
5398 1 19 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.066 -4.738 25487
5399 1 19 . 1 1 31 31 PHE H H 31 9.062 9.062 8.498 0.564 25487
5400 1 19 . 1 1 32 32 TYR N N 32 120.021 120.021 119.492 0.529 25487
5401 1 19 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.971 0.019 25487
5402 1 19 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.685 -1.946 25487
5403 1 19 . 1 1 32 32 TYR CB C 32 35.482 35.482 37.909 -2.427 25487
5404 1 19 . 1 1 32 32 TYR H H 32 8.614 8.614 8.679 -0.065 25487
5405 1 19 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.319 0.181 25487
5406 1 19 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.156 -2.667 25487
5407 1 19 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.388 -0.735 25487
5408 1 19 . 1 1 34 34 GLU N N 34 119.222 119.222 119.278 -0.056 25487
5409 1 19 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.976 0.369 25487
5410 1 19 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.446 -3.749 25487
5411 1 19 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.041 -2.982 25487
5412 1 19 . 1 1 34 34 GLU H H 34 8.516 8.516 8.663 -0.147 25487
5413 1 19 . 1 1 35 35 GLY N N 35 109.836 109.836 105.450 4.386 25487
5414 1 19 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.236 -2.817 25487
5415 1 19 . 1 1 35 35 GLY H H 35 8.209 8.209 7.547 0.662 25487
5416 1 19 . 1 1 36 36 GLU N N 36 119.666 119.666 122.090 -2.424 25487
5417 1 19 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.155 0.070 25487
5418 1 19 . 1 1 36 36 GLU CA C 36 53.566 53.566 58.475 -4.909 25487
5419 1 19 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.801 -3.631 25487
5420 1 19 . 1 1 36 36 GLU H H 36 8.190 8.190 8.603 -0.413 25487
5421 1 19 . 1 1 37 37 ASP N N 37 117.788 117.788 116.835 0.953 25487
5422 1 19 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.652 -0.122 25487
5423 1 19 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.592 -3.757 25487
5424 1 19 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.803 -4.680 25487
5425 1 19 . 1 1 37 37 ASP H H 37 8.305 8.305 8.241 0.064 25487
5426 1 19 . 1 1 38 38 LYS N N 38 119.545 119.545 118.280 1.265 25487
5427 1 19 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.489 -0.023 25487
5428 1 19 . 1 1 38 38 LYS CA C 38 53.348 53.348 57.012 -3.664 25487
5429 1 19 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.353 -3.739 25487
5430 1 19 . 1 1 38 38 LYS H H 38 7.950 7.950 7.904 0.046 25487
5431 1 19 . 1 1 39 39 THR N N 39 115.195 115.195 114.978 0.217 25487
5432 1 19 . 1 1 39 39 THR HA H 39 4.323 4.323 4.489 -0.166 25487
5433 1 19 . 1 1 39 39 THR CA C 39 59.508 59.508 62.192 -2.684 25487
5434 1 19 . 1 1 39 39 THR CB C 39 67.653 67.653 70.783 -3.130 25487
5435 1 19 . 1 1 39 39 THR H H 39 7.888 7.888 7.699 0.189 25487
5436 1 19 . 1 1 40 40 GLU N N 40 124.664 124.664 126.311 -1.647 25487
5437 1 19 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.651 -0.685 25487
5438 1 19 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.730 -2.701 25487
5439 1 19 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.768 -4.301 25487
5440 1 19 . 1 1 40 40 GLU H H 40 8.345 8.345 8.380 -0.035 25487
5441 1 19 . 1 1 41 41 VAL N N 41 124.551 124.551 125.381 -0.830 25487
5442 1 19 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.223 -0.122 25487
5443 1 19 . 1 1 41 41 VAL CA C 41 58.395 58.395 60.997 -2.602 25487
5444 1 19 . 1 1 41 41 VAL CB C 41 30.895 30.895 31.192 -0.297 25487
5445 1 19 . 1 1 41 41 VAL H H 41 8.377 8.377 8.536 -0.159 25487
5446 1 19 . 1 1 42 42 CYS N N 42 122.732 122.732 127.066 -4.334 25487
5447 1 19 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.509 0.246 25487
5448 1 19 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.289 -5.445 25487
5449 1 19 . 1 1 42 42 CYS CB C 42 46.480 46.480 31.344 15.136 25487
5450 1 19 . 1 1 42 42 CYS H H 42 8.712 8.712 8.179 0.533 25487
5451 1 19 . 1 1 43 43 SER N N 43 117.527 117.527 115.594 1.933 25487
5452 1 19 . 1 1 43 43 SER HA H 43 5.220 5.220 5.236 -0.016 25487
5453 1 19 . 1 1 43 43 SER CA C 43 54.110 54.110 56.849 -2.739 25487
5454 1 19 . 1 1 43 43 SER CB C 43 64.091 64.091 66.087 -1.996 25487
5455 1 19 . 1 1 43 43 SER H H 43 8.828 8.828 9.054 -0.226 25487
5456 1 19 . 1 1 44 44 CYS N N 44 120.721 120.721 123.128 -2.407 25487
5457 1 19 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.646 0.567 25487
5458 1 19 . 1 1 44 44 CYS CA C 44 53.028 53.028 60.003 -6.975 25487
5459 1 19 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.011 10.814 25487
5460 1 19 . 1 1 44 44 CYS H H 44 7.936 7.936 8.722 -0.786 25487
5461 1 19 . 1 1 45 45 GLN N N 45 124.614 124.614 125.492 -0.878 25487
5462 1 19 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.666 -0.022 25487
5463 1 19 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.692 -7.259 25487
5464 1 19 . 1 1 45 45 GLN H H 45 9.892 9.892 9.238 0.654 25487
5465 1 19 . 1 1 46 46 GLN N N 46 120.933 120.933 121.000 -0.067 25487
5466 1 19 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.724 0.302 25487
5467 1 19 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.729 -4.064 25487
5468 1 19 . 1 1 46 46 GLN H H 46 8.849 8.849 8.587 0.262 25487
5469 1 19 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.608 -0.088 25487
5470 1 19 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.564 -2.157 25487
5471 1 19 . 1 1 47 47 PRO CB C 47 29.749 29.749 33.054 -3.305 25487
5472 1 19 . 1 1 48 48 LYS N N 48 124.003 124.003 122.510 1.493 25487
5473 1 19 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.955 0.098 25487
5474 1 19 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.622 -3.038 25487
5475 1 19 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.260 -1.696 25487
5476 1 19 . 1 1 48 48 LYS H H 48 8.931 8.931 8.774 0.157 25487
5477 1 19 . 1 1 49 49 SER N N 49 113.527 113.527 113.741 -0.214 25487
5478 1 19 . 1 1 49 49 SER HA H 49 3.995 3.995 4.068 -0.073 25487
5479 1 19 . 1 1 49 49 SER CA C 49 55.458 55.458 61.358 -5.900 25487
5480 1 19 . 1 1 49 49 SER CB C 49 61.270 61.270 62.410 -1.140 25487
5481 1 19 . 1 1 49 49 SER H H 49 8.702 8.702 8.189 0.513 25487
5482 1 19 . 1 1 50 50 HIS N N 50 119.669 119.669 122.822 -3.153 25487
5483 1 19 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.531 -0.204 25487
5484 1 19 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.635 -3.180 25487
5485 1 19 . 1 1 50 50 HIS H H 50 7.664 7.664 8.159 -0.495 25487
5486 1 19 . 1 1 51 51 LYS N N 51 120.030 120.030 119.825 0.205 25487
5487 1 19 . 1 1 51 51 LYS HA H 51 4.093 4.093 3.563 0.530 25487
5488 1 19 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.491 -2.739 25487
5489 1 19 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.342 -1.960 25487
5490 1 19 . 1 1 51 51 LYS H H 51 7.825 7.825 8.048 -0.223 25487
5491 1 19 . 1 1 52 52 ILE N N 52 118.914 118.914 118.733 0.181 25487
5492 1 19 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.731 -0.010 25487
5493 1 19 . 1 1 52 52 ILE CA C 52 61.825 61.825 63.265 -1.440 25487
5494 1 19 . 1 1 52 52 ILE CB C 52 35.006 35.006 36.414 -1.408 25487
5495 1 19 . 1 1 52 52 ILE H H 52 8.223 8.223 7.688 0.535 25487
5496 1 19 . 1 1 53 53 ALA N N 53 120.985 120.985 122.931 -1.946 25487
5497 1 19 . 1 1 53 53 ALA HA H 53 3.956 3.956 4.005 -0.049 25487
5498 1 19 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.699 -2.556 25487
5499 1 19 . 1 1 53 53 ALA CB C 53 16.746 16.746 18.110 -1.364 25487
5500 1 19 . 1 1 53 53 ALA H H 53 8.066 8.066 8.115 -0.049 25487
5501 1 19 . 1 1 54 54 GLU N N 54 115.137 115.137 118.757 -3.620 25487
5502 1 19 . 1 1 54 54 GLU HA H 54 3.933 3.933 4.050 -0.117 25487
5503 1 19 . 1 1 54 54 GLU CB C 54 26.848 26.848 28.834 -1.986 25487
5504 1 19 . 1 1 54 54 GLU H H 54 8.160 8.160 8.195 -0.035 25487
5505 1 19 . 1 1 55 55 LYS N N 55 118.610 118.610 120.213 -1.603 25487
5506 1 19 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.078 0.078 25487
5507 1 19 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.373 -2.946 25487
5508 1 19 . 1 1 55 55 LYS H H 55 7.732 7.732 7.821 -0.089 25487
5509 1 19 . 1 1 56 56 ILE N N 56 119.173 119.173 120.918 -1.745 25487
5510 1 19 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.655 -0.028 25487
5511 1 19 . 1 1 56 56 ILE CA C 56 62.898 62.898 65.454 -2.556 25487
5512 1 19 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.910 -2.767 25487
5513 1 19 . 1 1 56 56 ILE H H 56 8.022 8.022 7.984 0.038 25487
5514 1 19 . 1 1 57 57 ILE N N 57 120.239 120.239 119.720 0.519 25487
5515 1 19 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.598 -0.010 25487
5516 1 19 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.430 -1.532 25487
5517 1 19 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.141 -1.104 25487
5518 1 19 . 1 1 57 57 ILE H H 57 8.370 8.370 8.185 0.185 25487
5519 1 19 . 1 1 58 58 ASP N N 58 118.234 118.234 120.890 -2.656 25487
5520 1 19 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.348 0.064 25487
5521 1 19 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.635 -3.461 25487
5522 1 19 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.172 -3.977 25487
5523 1 19 . 1 1 58 58 ASP H H 58 8.458 8.458 8.178 0.280 25487
5524 1 19 . 1 1 59 59 LYS N N 59 119.380 119.380 119.830 -0.450 25487
5525 1 19 . 1 1 59 59 LYS HA H 59 4.250 4.250 3.997 0.253 25487
5526 1 19 . 1 1 59 59 LYS CA C 59 54.931 54.931 58.998 -4.067 25487
5527 1 19 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.510 -2.449 25487
5528 1 19 . 1 1 59 59 LYS H H 59 7.928 7.928 8.108 -0.180 25487
5529 1 19 . 1 1 60 60 ALA N N 60 123.604 123.604 121.811 1.793 25487
5530 1 19 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.106 -0.121 25487
5531 1 19 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.249 -2.436 25487
5532 1 19 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.569 -2.772 25487
5533 1 19 . 1 1 60 60 ALA H H 60 8.699 8.699 8.163 0.536 25487
5534 1 19 . 1 1 61 61 LYS N N 61 115.317 115.317 118.668 -3.351 25487
5535 1 19 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.047 -0.029 25487
5536 1 19 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.804 -2.019 25487
5537 1 19 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.156 -1.649 25487
5538 1 19 . 1 1 61 61 LYS H H 61 8.361 8.361 8.416 -0.055 25487
5539 1 19 . 1 1 62 62 THR N N 62 107.298 107.298 114.206 -6.908 25487
5540 1 19 . 1 1 62 62 THR HA H 62 4.368 4.368 4.227 0.141 25487
5541 1 19 . 1 1 62 62 THR CA C 62 60.427 60.427 64.723 -4.296 25487
5542 1 19 . 1 1 62 62 THR CB C 62 67.179 67.179 69.127 -1.948 25487
5543 1 19 . 1 1 62 62 THR H H 62 7.510 7.510 8.267 -0.757 25487
5544 1 19 . 1 1 63 63 THR N N 63 115.701 115.701 115.898 -0.197 25487
5545 1 19 . 1 1 63 63 THR HA H 63 4.328 4.328 4.291 0.037 25487
5546 1 19 . 1 1 63 63 THR CA C 63 61.695 61.695 63.757 -2.062 25487
5547 1 19 . 1 1 63 63 THR CB C 63 67.641 67.641 69.465 -1.824 25487
5548 1 19 . 1 1 63 63 THR H H 63 7.651 7.651 7.714 -0.063 25487
5549 1 20 . 1 1 2 2 LYS N N 2 121.111 121.111 121.250 -0.139 25487
5550 1 20 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.318 0.007 25487
5551 1 20 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.668 -3.005 25487
5552 1 20 . 1 1 2 2 LYS CB C 2 30.415 30.415 32.893 -2.478 25487
5553 1 20 . 1 1 2 2 LYS H H 2 8.492 8.492 8.662 -0.170 25487
5554 1 20 . 1 1 3 3 ALA N N 3 126.440 126.440 123.975 2.465 25487
5555 1 20 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.137 0.288 25487
5556 1 20 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.155 -2.708 25487
5557 1 20 . 1 1 3 3 ALA CB C 3 16.905 16.905 17.113 -0.208 25487
5558 1 20 . 1 1 3 3 ALA H H 3 8.357 8.357 8.148 0.209 25487
5559 1 20 . 1 1 4 4 CYS N N 4 116.834 116.834 116.050 0.784 25487
5560 1 20 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.503 0.400 25487
5561 1 20 . 1 1 4 4 CYS CA C 4 51.793 51.793 58.439 -6.646 25487
5562 1 20 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.046 12.248 25487
5563 1 20 . 1 1 4 4 CYS H H 4 8.145 8.145 8.093 0.052 25487
5564 1 20 . 1 1 5 5 THR N N 5 121.220 121.220 120.517 0.703 25487
5565 1 20 . 1 1 5 5 THR HA H 5 4.481 4.481 4.547 -0.066 25487
5566 1 20 . 1 1 5 5 THR CA C 5 58.256 58.256 60.173 -1.917 25487
5567 1 20 . 1 1 5 5 THR CB C 5 67.043 67.043 69.110 -2.067 25487
5568 1 20 . 1 1 5 5 THR H H 5 9.070 9.070 8.582 0.488 25487
5569 1 20 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.471 -0.219 25487
5570 1 20 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.332 -3.093 25487
5571 1 20 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.406 -1.877 25487
5572 1 20 . 1 1 7 7 LEU N N 7 119.270 119.270 119.487 -0.217 25487
5573 1 20 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.836 -0.580 25487
5574 1 20 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.904 -1.844 25487
5575 1 20 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.272 -3.066 25487
5576 1 20 . 1 1 7 7 LEU H H 7 7.797 7.797 7.480 0.317 25487
5577 1 20 . 1 1 8 8 LEU N N 8 119.586 119.586 121.992 -2.406 25487
5578 1 20 . 1 1 8 8 LEU HA H 8 3.822 3.822 4.026 -0.204 25487
5579 1 20 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.540 -0.617 25487
5580 1 20 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.239 -2.637 25487
5581 1 20 . 1 1 8 8 LEU H H 8 9.465 9.465 8.502 0.963 25487
5582 1 20 . 1 1 9 9 HIS N N 9 117.507 117.507 116.258 1.249 25487
5583 1 20 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.850 -0.104 25487
5584 1 20 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.677 -2.250 25487
5585 1 20 . 1 1 9 9 HIS CB C 9 27.108 27.108 34.052 -6.944 25487
5586 1 20 . 1 1 9 9 HIS H H 9 8.159 8.159 7.754 0.405 25487
5587 1 20 . 1 1 10 10 ASP N N 10 119.492 119.492 119.959 -0.467 25487
5588 1 20 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.718 0.165 25487
5589 1 20 . 1 1 10 10 ASP CA C 10 52.338 52.338 54.258 -1.920 25487
5590 1 20 . 1 1 10 10 ASP CB C 10 39.470 39.470 39.844 -0.374 25487
5591 1 20 . 1 1 10 10 ASP H H 10 8.341 8.341 8.403 -0.062 25487
5592 1 20 . 1 1 11 11 CYS N N 11 121.767 121.767 119.725 2.042 25487
5593 1 20 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.959 0.170 25487
5594 1 20 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.851 -4.095 25487
5595 1 20 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.341 13.895 25487
5596 1 20 . 1 1 11 11 CYS H H 11 8.017 8.017 8.396 -0.379 25487
5597 1 20 . 1 1 12 12 SER N N 12 118.618 118.618 119.372 -0.754 25487
5598 1 20 . 1 1 12 12 SER HA H 12 3.759 3.759 4.134 -0.375 25487
5599 1 20 . 1 1 12 12 SER CB C 12 59.972 59.972 62.835 -2.863 25487
5600 1 20 . 1 1 12 12 SER H H 12 8.844 8.844 8.279 0.565 25487
5601 1 20 . 1 1 13 13 HIS N N 13 117.166 117.166 115.997 1.169 25487
5602 1 20 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.685 -0.063 25487
5603 1 20 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.197 -4.744 25487
5604 1 20 . 1 1 13 13 HIS H H 13 8.547 8.547 8.152 0.395 25487
5605 1 20 . 1 1 14 14 ASP N N 14 117.382 117.382 118.854 -1.472 25487
5606 1 20 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.923 -0.232 25487
5607 1 20 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.353 -3.161 25487
5608 1 20 . 1 1 14 14 ASP CB C 14 36.424 36.424 43.112 -6.688 25487
5609 1 20 . 1 1 14 14 ASP H H 14 7.224 7.224 7.798 -0.574 25487
5610 1 20 . 1 1 15 15 ARG N N 15 124.498 124.498 123.023 1.475 25487
5611 1 20 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.337 0.380 25487
5612 1 20 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.615 -4.082 25487
5613 1 20 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.886 -0.493 25487
5614 1 20 . 1 1 15 15 ARG H H 15 9.004 9.004 8.628 0.376 25487
5615 1 20 . 1 1 16 16 HIS N N 16 116.269 116.269 114.866 1.403 25487
5616 1 20 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.855 0.213 25487
5617 1 20 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.434 -2.959 25487
5618 1 20 . 1 1 16 16 HIS CB C 16 25.676 25.676 30.350 -4.674 25487
5619 1 20 . 1 1 16 16 HIS H H 16 8.528 8.528 8.510 0.018 25487
5620 1 20 . 1 1 17 17 SER N N 17 112.719 112.719 115.826 -3.107 25487
5621 1 20 . 1 1 17 17 SER HA H 17 4.493 4.493 4.450 0.043 25487
5622 1 20 . 1 1 17 17 SER CA C 17 56.591 56.591 59.193 -2.602 25487
5623 1 20 . 1 1 17 17 SER CB C 17 62.736 62.736 64.229 -1.493 25487
5624 1 20 . 1 1 17 17 SER H H 17 7.503 7.503 7.621 -0.118 25487
5625 1 20 . 1 1 18 18 CYS N N 18 122.070 122.070 122.439 -0.369 25487
5626 1 20 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.497 0.577 25487
5627 1 20 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.849 -5.275 25487
5628 1 20 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.309 10.516 25487
5629 1 20 . 1 1 18 18 CYS H H 18 8.651 8.651 8.299 0.352 25487
5630 1 20 . 1 1 19 19 CYS N N 19 118.243 118.243 123.530 -5.287 25487
5631 1 20 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.468 0.052 25487
5632 1 20 . 1 1 19 19 CYS CA C 19 52.548 52.548 58.481 -5.934 25487
5633 1 20 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.883 10.507 25487
5634 1 20 . 1 1 19 19 CYS H H 19 8.936 8.936 8.391 0.545 25487
5635 1 20 . 1 1 20 20 ARG N N 20 116.858 116.858 121.478 -4.620 25487
5636 1 20 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.006 0.093 25487
5637 1 20 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.677 -3.672 25487
5638 1 20 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.175 -1.546 25487
5639 1 20 . 1 1 20 20 ARG H H 20 8.136 8.136 8.450 -0.314 25487
5640 1 20 . 1 1 21 21 GLY N N 21 110.611 110.611 110.039 0.572 25487
5641 1 20 . 1 1 21 21 GLY CA C 21 41.796 41.796 44.121 -2.325 25487
5642 1 20 . 1 1 21 21 GLY H H 21 7.569 7.569 7.978 -0.409 25487
5643 1 20 . 1 1 22 22 ASP N N 22 121.161 121.161 119.116 2.045 25487
5644 1 20 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.609 -0.274 25487
5645 1 20 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.150 -2.487 25487
5646 1 20 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.229 -4.845 25487
5647 1 20 . 1 1 22 22 ASP H H 22 8.674 8.674 8.746 -0.072 25487
5648 1 20 . 1 1 23 23 MET N N 23 114.811 114.811 116.006 -1.195 25487
5649 1 20 . 1 1 23 23 MET HA H 23 4.218 4.218 4.302 -0.084 25487
5650 1 20 . 1 1 23 23 MET CA C 23 53.190 53.190 55.997 -2.807 25487
5651 1 20 . 1 1 23 23 MET CB C 23 30.586 30.586 34.850 -4.264 25487
5652 1 20 . 1 1 23 23 MET H H 23 8.333 8.333 8.190 0.143 25487
5653 1 20 . 1 1 24 24 PHE N N 24 116.019 116.019 116.564 -0.545 25487
5654 1 20 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.870 -0.043 25487
5655 1 20 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.549 1.992 25487
5656 1 20 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.768 -2.972 25487
5657 1 20 . 1 1 24 24 PHE H H 24 7.821 7.821 7.904 -0.083 25487
5658 1 20 . 1 1 25 25 LYS N N 25 123.768 123.768 120.482 3.286 25487
5659 1 20 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.039 0.007 25487
5660 1 20 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.517 -1.879 25487
5661 1 20 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.395 -2.318 25487
5662 1 20 . 1 1 25 25 LYS H H 25 9.119 9.119 8.214 0.905 25487
5663 1 20 . 1 1 26 26 TYR N N 26 123.059 123.059 120.863 2.196 25487
5664 1 20 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.656 0.343 25487
5665 1 20 . 1 1 26 26 TYR CA C 26 53.820 53.820 57.422 -3.602 25487
5666 1 20 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.612 -4.871 25487
5667 1 20 . 1 1 26 26 TYR H H 26 7.884 7.884 7.466 0.418 25487
5668 1 20 . 1 1 27 27 VAL N N 27 116.468 116.468 117.662 -1.194 25487
5669 1 20 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.466 -0.095 25487
5670 1 20 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.843 -2.328 25487
5671 1 20 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.719 -3.774 25487
5672 1 20 . 1 1 27 27 VAL H H 27 9.012 9.012 8.956 0.056 25487
5673 1 20 . 1 1 28 28 CYS N N 28 124.932 124.932 126.771 -1.839 25487
5674 1 20 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.856 -0.102 25487
5675 1 20 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.458 -6.258 25487
5676 1 20 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.321 11.466 25487
5677 1 20 . 1 1 28 28 CYS H H 28 8.874 8.874 8.993 -0.119 25487
5678 1 20 . 1 1 29 29 ASP N N 29 131.592 131.592 129.101 2.491 25487
5679 1 20 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.901 0.044 25487
5680 1 20 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.114 -3.058 25487
5681 1 20 . 1 1 29 29 ASP CB C 29 38.469 38.469 45.013 -6.544 25487
5682 1 20 . 1 1 29 29 ASP H H 29 8.603 8.603 8.815 -0.212 25487
5683 1 20 . 1 1 30 30 CYS N N 30 122.694 122.694 120.657 2.037 25487
5684 1 20 . 1 1 30 30 CYS HA H 30 5.803 5.803 5.390 0.413 25487
5685 1 20 . 1 1 30 30 CYS CA C 30 52.389 52.389 57.666 -5.277 25487
5686 1 20 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.039 14.894 25487
5687 1 20 . 1 1 30 30 CYS H H 30 8.480 8.480 8.509 -0.029 25487
5688 1 20 . 1 1 31 31 PHE N N 31 121.135 121.135 121.265 -0.130 25487
5689 1 20 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.312 0.474 25487
5690 1 20 . 1 1 31 31 PHE CB C 31 38.328 38.328 42.958 -4.630 25487
5691 1 20 . 1 1 31 31 PHE H H 31 9.062 9.062 8.954 0.108 25487
5692 1 20 . 1 1 32 32 TYR N N 32 120.021 120.021 118.829 1.192 25487
5693 1 20 . 1 1 32 32 TYR HA H 32 4.990 4.990 4.961 0.029 25487
5694 1 20 . 1 1 32 32 TYR CA C 32 52.739 52.739 55.360 -2.621 25487
5695 1 20 . 1 1 32 32 TYR CB C 32 35.482 35.482 38.337 -2.855 25487
5696 1 20 . 1 1 32 32 TYR H H 32 8.614 8.614 8.219 0.395 25487
5697 1 20 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.320 0.180 25487
5698 1 20 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.618 -3.129 25487
5699 1 20 . 1 1 33 33 PRO CB C 33 29.653 29.653 32.193 -2.540 25487
5700 1 20 . 1 1 34 34 GLU N N 34 119.222 119.222 117.057 2.165 25487
5701 1 20 . 1 1 34 34 GLU HA H 34 4.345 4.345 4.237 0.108 25487
5702 1 20 . 1 1 34 34 GLU CA C 34 53.697 53.697 56.443 -2.746 25487
5703 1 20 . 1 1 34 34 GLU CB C 34 26.059 26.059 29.173 -3.114 25487
5704 1 20 . 1 1 34 34 GLU H H 34 8.516 8.516 8.551 -0.035 25487
5705 1 20 . 1 1 35 35 GLY N N 35 109.836 109.836 107.441 2.395 25487
5706 1 20 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.124 -2.705 25487
5707 1 20 . 1 1 35 35 GLY H H 35 8.209 8.209 8.100 0.109 25487
5708 1 20 . 1 1 36 36 GLU N N 36 119.666 119.666 123.255 -3.589 25487
5709 1 20 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.551 -0.326 25487
5710 1 20 . 1 1 36 36 GLU CA C 36 53.566 53.566 55.377 -1.811 25487
5711 1 20 . 1 1 36 36 GLU CB C 36 26.170 26.170 28.710 -2.540 25487
5712 1 20 . 1 1 36 36 GLU H H 36 8.190 8.190 8.481 -0.291 25487
5713 1 20 . 1 1 37 37 ASP N N 37 117.788 117.788 123.219 -5.431 25487
5714 1 20 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.710 -0.180 25487
5715 1 20 . 1 1 37 37 ASP CA C 37 50.834 50.834 53.804 -2.970 25487
5716 1 20 . 1 1 37 37 ASP CB C 37 36.123 36.123 39.359 -3.236 25487
5717 1 20 . 1 1 37 37 ASP H H 37 8.305 8.305 8.376 -0.071 25487
5718 1 20 . 1 1 38 38 LYS N N 38 119.545 119.545 120.335 -0.790 25487
5719 1 20 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.400 0.066 25487
5720 1 20 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.715 -3.367 25487
5721 1 20 . 1 1 38 38 LYS CB C 38 30.614 30.614 33.835 -3.221 25487
5722 1 20 . 1 1 38 38 LYS H H 38 7.950 7.950 8.370 -0.420 25487
5723 1 20 . 1 1 39 39 THR N N 39 115.195 115.195 115.839 -0.644 25487
5724 1 20 . 1 1 39 39 THR HA H 39 4.323 4.323 4.501 -0.178 25487
5725 1 20 . 1 1 39 39 THR CA C 39 59.508 59.508 61.490 -1.982 25487
5726 1 20 . 1 1 39 39 THR CB C 39 67.653 67.653 70.320 -2.667 25487
5727 1 20 . 1 1 39 39 THR H H 39 7.888 7.888 7.818 0.070 25487
5728 1 20 . 1 1 40 40 GLU N N 40 124.664 124.664 125.883 -1.219 25487
5729 1 20 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.266 -0.300 25487
5730 1 20 . 1 1 40 40 GLU CA C 40 53.029 53.029 56.837 -3.808 25487
5731 1 20 . 1 1 40 40 GLU CB C 40 26.467 26.467 29.905 -3.438 25487
5732 1 20 . 1 1 40 40 GLU H H 40 8.345 8.345 8.560 -0.215 25487
5733 1 20 . 1 1 41 41 VAL N N 41 124.551 124.551 125.819 -1.268 25487
5734 1 20 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.177 -0.076 25487
5735 1 20 . 1 1 41 41 VAL CA C 41 58.395 58.395 62.048 -3.653 25487
5736 1 20 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.669 -1.774 25487
5737 1 20 . 1 1 41 41 VAL H H 41 8.377 8.377 8.456 -0.079 25487
5738 1 20 . 1 1 42 42 CYS N N 42 122.732 122.732 127.890 -5.158 25487
5739 1 20 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.420 0.335 25487
5740 1 20 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.727 -5.883 25487
5741 1 20 . 1 1 42 42 CYS CB C 42 46.480 46.480 28.279 18.201 25487
5742 1 20 . 1 1 42 42 CYS H H 42 8.712 8.712 9.067 -0.355 25487
5743 1 20 . 1 1 43 43 SER N N 43 117.527 117.527 118.401 -0.874 25487
5744 1 20 . 1 1 43 43 SER HA H 43 5.220 5.220 5.407 -0.186 25487
5745 1 20 . 1 1 43 43 SER CA C 43 54.110 54.110 55.809 -1.699 25487
5746 1 20 . 1 1 43 43 SER CB C 43 64.091 64.091 65.806 -1.715 25487
5747 1 20 . 1 1 43 43 SER H H 43 8.828 8.828 9.305 -0.477 25487
5748 1 20 . 1 1 44 44 CYS N N 44 120.721 120.721 123.271 -2.550 25487
5749 1 20 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.692 0.521 25487
5750 1 20 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.888 -6.860 25487
5751 1 20 . 1 1 44 44 CYS CB C 44 36.825 36.825 25.701 11.124 25487
5752 1 20 . 1 1 44 44 CYS H H 44 7.936 7.936 8.719 -0.783 25487
5753 1 20 . 1 1 45 45 GLN N N 45 124.614 124.614 125.714 -1.100 25487
5754 1 20 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.717 -0.073 25487
5755 1 20 . 1 1 45 45 GLN CB C 45 26.433 26.433 32.520 -6.087 25487
5756 1 20 . 1 1 45 45 GLN H H 45 9.892 9.892 9.110 0.782 25487
5757 1 20 . 1 1 46 46 GLN N N 46 120.933 120.933 120.293 0.640 25487
5758 1 20 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.687 0.339 25487
5759 1 20 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.605 -3.940 25487
5760 1 20 . 1 1 46 46 GLN H H 46 8.849 8.849 8.533 0.316 25487
5761 1 20 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.556 -0.036 25487
5762 1 20 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.307 -1.900 25487
5763 1 20 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.941 -3.192 25487
5764 1 20 . 1 1 48 48 LYS N N 48 124.003 124.003 120.002 4.001 25487
5765 1 20 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.972 0.081 25487
5766 1 20 . 1 1 48 48 LYS CA C 48 56.584 56.584 59.794 -3.211 25487
5767 1 20 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.305 -1.741 25487
5768 1 20 . 1 1 48 48 LYS H H 48 8.931 8.931 8.656 0.275 25487
5769 1 20 . 1 1 49 49 SER N N 49 113.527 113.527 115.092 -1.565 25487
5770 1 20 . 1 1 49 49 SER HA H 49 3.995 3.995 4.058 -0.063 25487
5771 1 20 . 1 1 49 49 SER CA C 49 55.458 55.458 62.084 -6.626 25487
5772 1 20 . 1 1 49 49 SER CB C 49 61.270 61.270 61.862 -0.592 25487
5773 1 20 . 1 1 49 49 SER H H 49 8.702 8.702 8.108 0.594 25487
5774 1 20 . 1 1 50 50 HIS N N 50 119.669 119.669 120.146 -0.477 25487
5775 1 20 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.334 -0.007 25487
5776 1 20 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.691 -3.236 25487
5777 1 20 . 1 1 50 50 HIS H H 50 7.664 7.664 8.252 -0.588 25487
5778 1 20 . 1 1 51 51 LYS N N 51 120.030 120.030 120.456 -0.426 25487
5779 1 20 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.132 -0.039 25487
5780 1 20 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.682 -2.930 25487
5781 1 20 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.346 -1.965 25487
5782 1 20 . 1 1 51 51 LYS H H 51 7.825 7.825 8.216 -0.391 25487
5783 1 20 . 1 1 52 52 ILE N N 52 118.914 118.914 120.126 -1.212 25487
5784 1 20 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.740 -0.019 25487
5785 1 20 . 1 1 52 52 ILE CA C 52 61.825 61.825 63.875 -2.050 25487
5786 1 20 . 1 1 52 52 ILE CB C 52 35.006 35.006 36.738 -1.732 25487
5787 1 20 . 1 1 52 52 ILE H H 52 8.223 8.223 7.752 0.471 25487
5788 1 20 . 1 1 53 53 ALA N N 53 120.985 120.985 121.783 -0.798 25487
5789 1 20 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.937 0.019 25487
5790 1 20 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.589 -2.446 25487
5791 1 20 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.954 -1.208 25487
5792 1 20 . 1 1 53 53 ALA H H 53 8.066 8.066 8.367 -0.301 25487
5793 1 20 . 1 1 54 54 GLU N N 54 115.137 115.137 118.547 -3.410 25487
5794 1 20 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.959 -0.026 25487
5795 1 20 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.312 -2.464 25487
5796 1 20 . 1 1 54 54 GLU H H 54 8.160 8.160 7.910 0.250 25487
5797 1 20 . 1 1 55 55 LYS N N 55 118.610 118.610 118.886 -0.276 25487
5798 1 20 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.086 0.070 25487
5799 1 20 . 1 1 55 55 LYS CA C 55 56.427 56.427 58.821 -2.393 25487
5800 1 20 . 1 1 55 55 LYS H H 55 7.732 7.732 8.008 -0.276 25487
5801 1 20 . 1 1 56 56 ILE N N 56 119.173 119.173 120.961 -1.788 25487
5802 1 20 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.716 -0.089 25487
5803 1 20 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.517 -1.619 25487
5804 1 20 . 1 1 56 56 ILE CB C 56 35.143 35.143 36.895 -1.752 25487
5805 1 20 . 1 1 56 56 ILE H H 56 8.022 8.022 8.076 -0.054 25487
5806 1 20 . 1 1 57 57 ILE N N 57 120.239 120.239 120.516 -0.277 25487
5807 1 20 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.603 -0.015 25487
5808 1 20 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.535 -1.637 25487
5809 1 20 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.203 -1.165 25487
5810 1 20 . 1 1 57 57 ILE H H 57 8.370 8.370 8.709 -0.339 25487
5811 1 20 . 1 1 58 58 ASP N N 58 118.234 118.234 120.869 -2.635 25487
5812 1 20 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.295 0.117 25487
5813 1 20 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.675 -3.501 25487
5814 1 20 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.117 -3.922 25487
5815 1 20 . 1 1 58 58 ASP H H 58 8.458 8.458 8.488 -0.030 25487
5816 1 20 . 1 1 59 59 LYS N N 59 119.380 119.380 119.628 -0.248 25487
5817 1 20 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.029 0.221 25487
5818 1 20 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.006 -4.075 25487
5819 1 20 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.426 -2.365 25487
5820 1 20 . 1 1 59 59 LYS H H 59 7.928 7.928 8.320 -0.392 25487
5821 1 20 . 1 1 60 60 ALA N N 60 123.604 123.604 122.110 1.494 25487
5822 1 20 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.056 -0.071 25487
5823 1 20 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.064 -2.251 25487
5824 1 20 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.422 -2.624 25487
5825 1 20 . 1 1 60 60 ALA H H 60 8.699 8.699 8.146 0.553 25487
5826 1 20 . 1 1 61 61 LYS N N 61 115.317 115.317 116.355 -1.038 25487
5827 1 20 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.189 -0.172 25487
5828 1 20 . 1 1 61 61 LYS CA C 61 56.785 56.785 57.056 -0.271 25487
5829 1 20 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.957 -2.450 25487
5830 1 20 . 1 1 61 61 LYS H H 61 8.361 8.361 7.974 0.387 25487
5831 1 20 . 1 1 62 62 THR N N 62 107.298 107.298 111.050 -3.752 25487
5832 1 20 . 1 1 62 62 THR HA H 62 4.368 4.368 4.037 0.331 25487
5833 1 20 . 1 1 62 62 THR CA C 62 60.427 60.427 63.845 -3.418 25487
5834 1 20 . 1 1 62 62 THR CB C 62 67.179 67.179 67.786 -0.607 25487
5835 1 20 . 1 1 62 62 THR H H 62 7.510 7.510 8.601 -1.091 25487
5836 1 20 . 1 1 63 63 THR N N 63 115.701 115.701 114.497 1.204 25487
5837 1 20 . 1 1 63 63 THR HA H 63 4.328 4.328 4.309 0.019 25487
5838 1 20 . 1 1 63 63 THR CA C 63 61.695 61.695 63.831 -2.136 25487
5839 1 20 . 1 1 63 63 THR CB C 63 67.641 67.641 69.238 -1.597 25487
5840 1 20 . 1 1 63 63 THR H H 63 7.651 7.651 8.116 -0.465 25487
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 59 2.286 -0.002 2.306 25487
2 1 1 "Average Difference" HA 64 0.309 -0.063 0.305 25487
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25487
4 1 1 "Average Difference" CA 55 3.658 3.305 1.580 25487
5 1 1 "Average Difference" CB 59 5.468 0.871 5.444 25487
6 1 1 "Average Difference" HN 59 0.401 -0.046 0.402 25487
7 1 2 "Average Difference" N 59 2.269 0.281 2.271 25487
8 1 2 "Average Difference" HA 64 0.316 -0.033 0.317 25487
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25487
10 1 2 "Average Difference" CA 55 3.541 3.180 1.573 25487
11 1 2 "Average Difference" CB 59 5.633 0.941 5.602 25487
12 1 2 "Average Difference" HN 59 0.396 -0.050 0.396 25487
13 1 3 "Average Difference" N 59 2.190 0.355 2.180 25487
14 1 3 "Average Difference" HA 64 0.298 -0.033 0.299 25487
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25487
16 1 3 "Average Difference" CA 55 3.547 3.169 1.609 25487
17 1 3 "Average Difference" CB 59 5.614 0.925 5.585 25487
18 1 3 "Average Difference" HN 59 0.369 -0.061 0.367 25487
19 1 4 "Average Difference" N 59 2.190 0.244 2.195 25487
20 1 4 "Average Difference" HA 64 0.304 -0.050 0.302 25487
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25487
22 1 4 "Average Difference" CA 55 3.579 3.201 1.616 25487
23 1 4 "Average Difference" CB 59 5.501 0.858 5.481 25487
24 1 4 "Average Difference" HN 59 0.412 -0.014 0.415 25487
25 1 5 "Average Difference" N 59 2.631 0.304 2.635 25487
26 1 5 "Average Difference" HA 64 0.302 -0.037 0.302 25487
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25487
28 1 5 "Average Difference" CA 55 3.458 3.076 1.594 25487
29 1 5 "Average Difference" CB 59 5.611 0.943 5.579 25487
30 1 5 "Average Difference" HN 59 0.406 -0.077 0.402 25487
31 1 6 "Average Difference" N 59 2.432 0.325 2.431 25487
32 1 6 "Average Difference" HA 64 0.295 -0.017 0.297 25487
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25487
34 1 6 "Average Difference" CA 55 3.545 3.154 1.632 25487
35 1 6 "Average Difference" CB 59 5.497 0.938 5.463 25487
36 1 6 "Average Difference" HN 59 0.403 -0.030 0.406 25487
37 1 7 "Average Difference" N 59 2.311 0.254 2.317 25487
38 1 7 "Average Difference" HA 64 0.309 -0.048 0.307 25487
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25487
40 1 7 "Average Difference" CA 55 3.508 3.141 1.576 25487
41 1 7 "Average Difference" CB 59 5.517 0.884 5.492 25487
42 1 7 "Average Difference" HN 59 0.430 -0.016 0.433 25487
43 1 8 "Average Difference" N 59 2.147 0.419 2.124 25487
44 1 8 "Average Difference" HA 64 0.267 -0.021 0.268 25487
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25487
46 1 8 "Average Difference" CA 55 3.636 3.247 1.652 25487
47 1 8 "Average Difference" CB 59 5.678 0.914 5.652 25487
48 1 8 "Average Difference" HN 59 0.377 -0.059 0.376 25487
49 1 9 "Average Difference" N 59 2.360 -0.098 2.378 25487
50 1 9 "Average Difference" HA 64 0.294 -0.041 0.293 25487
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25487
52 1 9 "Average Difference" CA 55 3.544 3.186 1.568 25487
53 1 9 "Average Difference" CB 59 5.417 0.781 5.407 25487
54 1 9 "Average Difference" HN 59 0.480 -0.064 0.480 25487
55 1 10 "Average Difference" N 59 2.363 0.021 2.383 25487
56 1 10 "Average Difference" HA 64 0.306 -0.050 0.304 25487
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25487
58 1 10 "Average Difference" CA 55 3.486 3.123 1.564 25487
59 1 10 "Average Difference" CB 59 5.509 0.849 5.490 25487
60 1 10 "Average Difference" HN 59 0.445 -0.024 0.448 25487
61 1 11 "Average Difference" N 59 2.340 0.218 2.350 25487
62 1 11 "Average Difference" HA 64 0.283 -0.043 0.282 25487
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25487
64 1 11 "Average Difference" CA 55 3.539 3.176 1.575 25487
65 1 11 "Average Difference" CB 59 5.445 0.994 5.400 25487
66 1 11 "Average Difference" HN 59 0.416 -0.049 0.416 25487
67 1 12 "Average Difference" N 59 2.242 0.189 2.253 25487
68 1 12 "Average Difference" HA 64 0.330 -0.042 0.330 25487
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25487
70 1 12 "Average Difference" CA 55 3.537 3.183 1.557 25487
71 1 12 "Average Difference" CB 59 5.572 0.948 5.538 25487
72 1 12 "Average Difference" HN 59 0.427 -0.021 0.430 25487
73 1 13 "Average Difference" N 59 2.481 0.244 2.490 25487
74 1 13 "Average Difference" HA 64 0.322 -0.040 0.322 25487
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25487
76 1 13 "Average Difference" CA 55 3.491 3.122 1.575 25487
77 1 13 "Average Difference" CB 59 5.514 0.924 5.483 25487
78 1 13 "Average Difference" HN 59 0.392 -0.075 0.388 25487
79 1 14 "Average Difference" N 59 2.365 0.110 2.383 25487
80 1 14 "Average Difference" HA 64 0.302 -0.027 0.304 25487
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25487
82 1 14 "Average Difference" CA 55 3.438 3.074 1.555 25487
83 1 14 "Average Difference" CB 59 5.511 0.829 5.495 25487
84 1 14 "Average Difference" HN 59 0.438 -0.038 0.440 25487
85 1 15 "Average Difference" N 59 2.397 0.169 2.412 25487
86 1 15 "Average Difference" HA 64 0.318 -0.055 0.315 25487
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25487
88 1 15 "Average Difference" CA 55 3.452 3.081 1.571 25487
89 1 15 "Average Difference" CB 59 5.541 0.933 5.509 25487
90 1 15 "Average Difference" HN 59 0.427 -0.077 0.424 25487
91 1 16 "Average Difference" N 59 2.585 0.297 2.590 25487
92 1 16 "Average Difference" HA 64 0.239 -0.043 0.237 25487
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25487
94 1 16 "Average Difference" CA 55 3.526 3.123 1.653 25487
95 1 16 "Average Difference" CB 59 5.742 0.797 5.735 25487
96 1 16 "Average Difference" HN 59 0.397 -0.047 0.398 25487
97 1 17 "Average Difference" N 59 2.038 0.341 2.027 25487
98 1 17 "Average Difference" HA 64 0.283 -0.031 0.283 25487
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25487
100 1 17 "Average Difference" CA 55 3.612 3.221 1.651 25487
101 1 17 "Average Difference" CB 59 5.722 0.801 5.714 25487
102 1 17 "Average Difference" HN 59 0.406 -0.037 0.408 25487
103 1 18 "Average Difference" N 59 2.313 0.204 2.324 25487
104 1 18 "Average Difference" HA 64 0.313 -0.040 0.313 25487
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25487
106 1 18 "Average Difference" CA 55 3.521 3.090 1.704 25487
107 1 18 "Average Difference" CB 59 5.542 0.800 5.531 25487
108 1 18 "Average Difference" HN 59 0.443 -0.040 0.445 25487
109 1 19 "Average Difference" N 59 2.427 0.398 2.415 25487
110 1 19 "Average Difference" HA 64 0.295 -0.047 0.293 25487
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25487
112 1 19 "Average Difference" CA 55 3.532 3.176 1.561 25487
113 1 19 "Average Difference" CB 59 5.437 0.835 5.419 25487
114 1 19 "Average Difference" HN 59 0.381 -0.076 0.377 25487
115 1 20 "Average Difference" N 59 2.175 0.462 2.143 25487
116 1 20 "Average Difference" HA 64 0.240 -0.041 0.239 25487
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25487
118 1 20 "Average Difference" CA 55 3.445 3.046 1.624 25487
119 1 20 "Average Difference" CB 59 5.705 0.733 5.706 25487
120 1 20 "Average Difference" HN 59 0.413 -0.022 0.416 25487
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 25487
_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 LYS N N 2 121.111 121.111 120.865 0.246 25487
2 1 . 1 1 2 2 LYS HA H 2 4.325 4.325 4.479 -0.154 25487
3 1 . 1 1 2 2 LYS CA C 2 53.663 53.663 56.290 -2.627 25487
4 1 . 1 1 2 2 LYS CB C 2 30.415 30.415 33.079 -2.664 25487
5 1 . 1 1 2 2 LYS H H 2 8.492 8.492 8.494 -0.002 25487
6 1 . 1 1 3 3 ALA N N 3 126.440 126.440 124.474 1.966 25487
7 1 . 1 1 3 3 ALA HA H 3 4.425 4.425 4.380 0.045 25487
8 1 . 1 1 3 3 ALA CA C 3 49.447 49.447 52.062 -2.615 25487
9 1 . 1 1 3 3 ALA CB C 3 16.905 16.905 18.822 -1.917 25487
10 1 . 1 1 3 3 ALA H H 3 8.357 8.357 8.222 0.135 25487
11 1 . 1 1 4 4 CYS N N 4 116.834 116.834 118.230 -1.396 25487
12 1 . 1 1 4 4 CYS HA H 4 4.903 4.903 4.666 0.237 25487
13 1 . 1 1 4 4 CYS CA C 4 51.793 51.793 57.332 -5.539 25487
14 1 . 1 1 4 4 CYS CB C 4 41.294 41.294 29.938 11.356 25487
15 1 . 1 1 4 4 CYS H H 4 8.145 8.145 8.098 0.047 25487
16 1 . 1 1 5 5 THR N N 5 121.220 121.220 118.866 2.354 25487
17 1 . 1 1 5 5 THR HA H 5 4.481 4.481 4.726 -0.245 25487
18 1 . 1 1 5 5 THR CA C 5 58.256 58.256 60.412 -2.156 25487
19 1 . 1 1 5 5 THR CB C 5 67.043 67.043 68.812 -1.769 25487
20 1 . 1 1 5 5 THR H H 5 9.070 9.070 8.593 0.477 25487
21 1 . 1 1 6 6 PRO HA H 6 4.252 4.252 4.422 -0.170 25487
22 1 . 1 1 6 6 PRO CA C 6 59.239 59.239 62.232 -2.993 25487
23 1 . 1 1 6 6 PRO CB C 6 30.529 30.529 32.366 -1.837 25487
24 1 . 1 1 7 7 LEU N N 7 119.270 119.270 119.849 -0.579 25487
25 1 . 1 1 7 7 LEU HA H 7 3.256 3.256 3.891 -0.635 25487
26 1 . 1 1 7 7 LEU CA C 7 54.060 54.060 55.531 -1.471 25487
27 1 . 1 1 7 7 LEU CB C 7 39.206 39.206 42.228 -3.022 25487
28 1 . 1 1 7 7 LEU H H 7 7.797 7.797 7.810 -0.013 25487
29 1 . 1 1 8 8 LEU N N 8 119.586 119.586 122.499 -2.913 25487
30 1 . 1 1 8 8 LEU HA H 8 3.822 3.822 3.954 -0.132 25487
31 1 . 1 1 8 8 LEU CA C 8 54.923 54.923 55.714 -0.791 25487
32 1 . 1 1 8 8 LEU CB C 8 36.602 36.602 39.557 -2.955 25487
33 1 . 1 1 8 8 LEU H H 8 9.465 9.465 8.594 0.871 25487
34 1 . 1 1 9 9 HIS N N 9 117.507 117.507 116.349 1.158 25487
35 1 . 1 1 9 9 HIS HA H 9 4.746 4.746 4.760 -0.014 25487
36 1 . 1 1 9 9 HIS CA C 9 52.427 52.427 54.439 -2.012 25487
37 1 . 1 1 9 9 HIS CB C 9 27.108 27.108 33.886 -6.778 25487
38 1 . 1 1 9 9 HIS H H 9 8.159 8.159 7.862 0.297 25487
39 1 . 1 1 10 10 ASP N N 10 119.492 119.492 121.093 -1.601 25487
40 1 . 1 1 10 10 ASP HA H 10 4.883 4.883 4.684 0.199 25487
41 1 . 1 1 10 10 ASP CA C 10 52.338 52.338 55.219 -2.881 25487
42 1 . 1 1 10 10 ASP CB C 10 39.470 39.470 40.578 -1.108 25487
43 1 . 1 1 10 10 ASP H H 10 8.341 8.341 8.593 -0.252 25487
44 1 . 1 1 11 11 CYS N N 11 121.767 121.767 119.931 1.836 25487
45 1 . 1 1 11 11 CYS HA H 11 5.129 5.129 4.929 0.200 25487
46 1 . 1 1 11 11 CYS CA C 11 52.756 52.756 56.876 -4.120 25487
47 1 . 1 1 11 11 CYS CB C 11 42.236 42.236 28.415 13.821 25487
48 1 . 1 1 11 11 CYS H H 11 8.017 8.017 8.380 -0.363 25487
49 1 . 1 1 12 12 SER N N 12 118.618 118.618 119.217 -0.599 25487
50 1 . 1 1 12 12 SER HA H 12 3.759 3.759 4.119 -0.360 25487
51 1 . 1 1 12 12 SER CB C 12 59.972 59.972 62.938 -2.966 25487
52 1 . 1 1 12 12 SER H H 12 8.844 8.844 8.409 0.435 25487
53 1 . 1 1 13 13 HIS N N 13 117.166 117.166 116.200 0.966 25487
54 1 . 1 1 13 13 HIS HA H 13 4.622 4.622 4.666 -0.044 25487
55 1 . 1 1 13 13 HIS CB C 13 25.453 25.453 30.043 -4.590 25487
56 1 . 1 1 13 13 HIS H H 13 8.547 8.547 8.164 0.383 25487
57 1 . 1 1 14 14 ASP N N 14 117.382 117.382 119.108 -1.726 25487
58 1 . 1 1 14 14 ASP HA H 14 4.691 4.691 4.901 -0.210 25487
59 1 . 1 1 14 14 ASP CA C 14 51.192 51.192 54.189 -2.997 25487
60 1 . 1 1 14 14 ASP CB C 14 36.424 36.424 42.560 -6.136 25487
61 1 . 1 1 14 14 ASP H H 14 7.224 7.224 7.840 -0.616 25487
62 1 . 1 1 15 15 ARG N N 15 124.498 124.498 122.600 1.898 25487
63 1 . 1 1 15 15 ARG HA H 15 4.717 4.717 4.258 0.459 25487
64 1 . 1 1 15 15 ARG CA C 15 53.533 53.533 57.937 -4.404 25487
65 1 . 1 1 15 15 ARG CB C 15 30.392 30.392 30.630 -0.238 25487
66 1 . 1 1 15 15 ARG H H 15 9.004 9.004 8.546 0.458 25487
67 1 . 1 1 16 16 HIS N N 16 116.269 116.269 115.739 0.531 25487
68 1 . 1 1 16 16 HIS HA H 16 5.068 5.068 4.796 0.273 25487
69 1 . 1 1 16 16 HIS CA C 16 52.475 52.475 55.565 -3.090 25487
70 1 . 1 1 16 16 HIS CB C 16 25.676 25.676 29.636 -3.960 25487
71 1 . 1 1 16 16 HIS H H 16 8.528 8.528 8.401 0.127 25487
72 1 . 1 1 17 17 SER N N 17 112.719 112.719 115.375 -2.656 25487
73 1 . 1 1 17 17 SER HA H 17 4.493 4.493 4.488 0.005 25487
74 1 . 1 1 17 17 SER CA C 17 56.591 56.591 59.422 -2.831 25487
75 1 . 1 1 17 17 SER CB C 17 62.736 62.736 64.234 -1.498 25487
76 1 . 1 1 17 17 SER H H 17 7.503 7.503 7.925 -0.422 25487
77 1 . 1 1 18 18 CYS N N 18 122.070 122.070 121.081 0.989 25487
78 1 . 1 1 18 18 CYS HA H 18 5.074 5.074 4.484 0.590 25487
79 1 . 1 1 18 18 CYS CA C 18 54.574 54.574 59.681 -5.107 25487
80 1 . 1 1 18 18 CYS CB C 18 36.825 36.825 26.811 10.014 25487
81 1 . 1 1 18 18 CYS H H 18 8.651 8.651 8.008 0.643 25487
82 1 . 1 1 19 19 CYS N N 19 118.243 118.243 123.633 -5.390 25487
83 1 . 1 1 19 19 CYS HA H 19 4.520 4.520 4.460 0.060 25487
84 1 . 1 1 19 19 CYS CA C 19 52.548 52.548 59.187 -6.639 25487
85 1 . 1 1 19 19 CYS CB C 19 39.390 39.390 28.296 11.094 25487
86 1 . 1 1 19 19 CYS H H 19 8.936 8.936 8.396 0.540 25487
87 1 . 1 1 20 20 ARG N N 20 116.858 116.858 121.793 -4.935 25487
88 1 . 1 1 20 20 ARG HA H 20 4.099 4.099 4.089 0.010 25487
89 1 . 1 1 20 20 ARG CA C 20 53.005 53.005 56.581 -3.576 25487
90 1 . 1 1 20 20 ARG CB C 20 29.629 29.629 31.241 -1.612 25487
91 1 . 1 1 20 20 ARG H H 20 8.136 8.136 8.469 -0.333 25487
92 1 . 1 1 21 21 GLY N N 21 110.611 110.611 108.364 2.247 25487
93 1 . 1 1 21 21 GLY CA C 21 41.796 41.796 43.763 -1.967 25487
94 1 . 1 1 21 21 GLY H H 21 7.569 7.569 7.834 -0.265 25487
95 1 . 1 1 22 22 ASP N N 22 121.161 121.161 119.614 1.547 25487
96 1 . 1 1 22 22 ASP HA H 22 4.335 4.335 4.547 -0.212 25487
97 1 . 1 1 22 22 ASP CA C 22 53.663 53.663 56.395 -2.732 25487
98 1 . 1 1 22 22 ASP CB C 22 36.384 36.384 41.144 -4.760 25487
99 1 . 1 1 22 22 ASP H H 22 8.674 8.674 8.716 -0.042 25487
100 1 . 1 1 23 23 MET N N 23 114.811 114.811 116.036 -1.225 25487
101 1 . 1 1 23 23 MET HA H 23 4.218 4.218 4.222 -0.004 25487
102 1 . 1 1 23 23 MET CA C 23 53.190 53.190 56.022 -2.832 25487
103 1 . 1 1 23 23 MET CB C 23 30.586 30.586 34.466 -3.880 25487
104 1 . 1 1 23 23 MET H H 23 8.333 8.333 7.840 0.493 25487
105 1 . 1 1 24 24 PHE N N 24 116.019 116.019 116.394 -0.375 25487
106 1 . 1 1 24 24 PHE HA H 24 4.827 4.827 4.737 0.090 25487
107 1 . 1 1 24 24 PHE CA C 24 58.541 58.541 56.445 2.096 25487
108 1 . 1 1 24 24 PHE CB C 24 38.796 38.796 41.623 -2.827 25487
109 1 . 1 1 24 24 PHE H H 24 7.821 7.821 7.685 0.136 25487
110 1 . 1 1 25 25 LYS N N 25 123.768 123.768 121.211 2.557 25487
111 1 . 1 1 25 25 LYS HA H 25 4.046 4.046 4.008 0.038 25487
112 1 . 1 1 25 25 LYS CA C 25 54.638 54.638 56.396 -1.758 25487
113 1 . 1 1 25 25 LYS CB C 25 31.077 31.077 33.315 -2.238 25487
114 1 . 1 1 25 25 LYS H H 25 9.119 9.119 8.304 0.815 25487
115 1 . 1 1 26 26 TYR N N 26 123.059 123.059 120.979 2.080 25487
116 1 . 1 1 26 26 TYR HA H 26 4.999 4.999 4.435 0.564 25487
117 1 . 1 1 26 26 TYR CA C 26 53.820 53.820 58.187 -4.367 25487
118 1 . 1 1 26 26 TYR CB C 26 34.741 34.741 39.151 -4.410 25487
119 1 . 1 1 26 26 TYR H H 26 7.884 7.884 7.513 0.371 25487
120 1 . 1 1 27 27 VAL N N 27 116.468 116.468 117.721 -1.253 25487
121 1 . 1 1 27 27 VAL HA H 27 4.371 4.371 4.492 -0.121 25487
122 1 . 1 1 27 27 VAL CA C 27 57.515 57.515 59.721 -2.206 25487
123 1 . 1 1 27 27 VAL CB C 27 31.945 31.945 35.375 -3.430 25487
124 1 . 1 1 27 27 VAL H H 27 9.012 9.012 9.029 -0.017 25487
125 1 . 1 1 28 28 CYS N N 28 124.932 124.932 126.385 -1.453 25487
126 1 . 1 1 28 28 CYS HA H 28 4.754 4.754 4.724 0.030 25487
127 1 . 1 1 28 28 CYS CA C 28 52.200 52.200 58.053 -5.853 25487
128 1 . 1 1 28 28 CYS CB C 28 37.787 37.787 26.591 11.196 25487
129 1 . 1 1 28 28 CYS H H 28 8.874 8.874 8.894 -0.020 25487
130 1 . 1 1 29 29 ASP N N 29 131.592 131.592 129.149 2.443 25487
131 1 . 1 1 29 29 ASP HA H 29 4.945 4.945 4.821 0.124 25487
132 1 . 1 1 29 29 ASP CA C 29 50.056 50.056 53.531 -3.475 25487
133 1 . 1 1 29 29 ASP CB C 29 38.469 38.469 43.812 -5.343 25487
134 1 . 1 1 29 29 ASP H H 29 8.603 8.603 8.666 -0.063 25487
135 1 . 1 1 30 30 CYS N N 30 122.694 122.694 120.001 2.693 25487
136 1 . 1 1 30 30 CYS HA H 30 5.803 5.803 4.869 0.934 25487
137 1 . 1 1 30 30 CYS CA C 30 52.389 52.389 58.086 -5.697 25487
138 1 . 1 1 30 30 CYS CB C 30 43.933 43.933 29.476 14.457 25487
139 1 . 1 1 30 30 CYS H H 30 8.480 8.480 8.402 0.078 25487
140 1 . 1 1 31 31 PHE N N 31 121.135 121.135 120.882 0.253 25487
141 1 . 1 1 31 31 PHE HA H 31 4.787 4.787 4.552 0.235 25487
142 1 . 1 1 31 31 PHE CB C 31 38.328 38.328 43.202 -4.874 25487
143 1 . 1 1 31 31 PHE H H 31 9.062 9.062 8.710 0.352 25487
144 1 . 1 1 32 32 TYR N N 32 120.021 120.021 117.861 2.160 25487
145 1 . 1 1 32 32 TYR HA H 32 4.990 4.990 5.156 -0.166 25487
146 1 . 1 1 32 32 TYR CA C 32 52.739 52.739 54.782 -2.043 25487
147 1 . 1 1 32 32 TYR CB C 32 35.482 35.482 39.059 -3.577 25487
148 1 . 1 1 32 32 TYR H H 32 8.614 8.614 8.598 0.016 25487
149 1 . 1 1 33 33 PRO HA H 33 4.500 4.500 4.344 0.156 25487
150 1 . 1 1 33 33 PRO CA C 33 60.489 60.489 63.315 -2.826 25487
151 1 . 1 1 33 33 PRO CB C 33 29.653 29.653 30.565 -0.912 25487
152 1 . 1 1 34 34 GLU N N 34 119.222 119.222 118.786 0.436 25487
153 1 . 1 1 34 34 GLU HA H 34 4.345 4.345 3.998 0.347 25487
154 1 . 1 1 34 34 GLU CA C 34 53.697 53.697 57.439 -3.742 25487
155 1 . 1 1 34 34 GLU CB C 34 26.059 26.059 28.837 -2.778 25487
156 1 . 1 1 34 34 GLU H H 34 8.516 8.516 8.670 -0.154 25487
157 1 . 1 1 35 35 GLY N N 35 109.836 109.836 105.035 4.801 25487
158 1 . 1 1 35 35 GLY CA C 35 42.419 42.419 45.069 -2.650 25487
159 1 . 1 1 35 35 GLY H H 35 8.209 8.209 7.694 0.515 25487
160 1 . 1 1 36 36 GLU N N 36 119.666 119.666 121.024 -1.358 25487
161 1 . 1 1 36 36 GLU HA H 36 4.225 4.225 4.012 0.213 25487
162 1 . 1 1 36 36 GLU CA C 36 53.566 53.566 56.877 -3.311 25487
163 1 . 1 1 36 36 GLU CB C 36 26.170 26.170 29.300 -3.130 25487
164 1 . 1 1 36 36 GLU H H 36 8.190 8.190 8.498 -0.308 25487
165 1 . 1 1 37 37 ASP N N 37 117.788 117.788 119.249 -1.461 25487
166 1 . 1 1 37 37 ASP HA H 37 4.530 4.530 4.612 -0.082 25487
167 1 . 1 1 37 37 ASP CA C 37 50.834 50.834 54.454 -3.620 25487
168 1 . 1 1 37 37 ASP CB C 37 36.123 36.123 40.574 -4.451 25487
169 1 . 1 1 37 37 ASP H H 37 8.305 8.305 8.278 0.027 25487
170 1 . 1 1 38 38 LYS N N 38 119.545 119.545 118.754 0.791 25487
171 1 . 1 1 38 38 LYS HA H 38 4.466 4.466 4.564 -0.098 25487
172 1 . 1 1 38 38 LYS CA C 38 53.348 53.348 56.802 -3.454 25487
173 1 . 1 1 38 38 LYS CB C 38 30.614 30.614 34.465 -3.851 25487
174 1 . 1 1 38 38 LYS H H 38 7.950 7.950 7.905 0.045 25487
175 1 . 1 1 39 39 THR N N 39 115.195 115.195 115.024 0.171 25487
176 1 . 1 1 39 39 THR HA H 39 4.323 4.323 4.629 -0.306 25487
177 1 . 1 1 39 39 THR CA C 39 59.508 59.508 61.924 -2.416 25487
178 1 . 1 1 39 39 THR CB C 39 67.653 67.653 71.119 -3.466 25487
179 1 . 1 1 39 39 THR H H 39 7.888 7.888 7.921 -0.033 25487
180 1 . 1 1 40 40 GLU N N 40 124.664 124.664 124.853 -0.189 25487
181 1 . 1 1 40 40 GLU HA H 40 3.966 3.966 4.721 -0.755 25487
182 1 . 1 1 40 40 GLU CA C 40 53.029 53.029 55.427 -2.398 25487
183 1 . 1 1 40 40 GLU CB C 40 26.467 26.467 30.411 -3.943 25487
184 1 . 1 1 40 40 GLU H H 40 8.345 8.345 8.448 -0.103 25487
185 1 . 1 1 41 41 VAL N N 41 124.551 124.551 125.126 -0.575 25487
186 1 . 1 1 41 41 VAL HA H 41 4.101 4.101 4.319 -0.218 25487
187 1 . 1 1 41 41 VAL CA C 41 58.395 58.395 61.374 -2.978 25487
188 1 . 1 1 41 41 VAL CB C 41 30.895 30.895 32.831 -1.936 25487
189 1 . 1 1 41 41 VAL H H 41 8.377 8.377 8.596 -0.219 25487
190 1 . 1 1 42 42 CYS N N 42 122.732 122.732 126.734 -4.002 25487
191 1 . 1 1 42 42 CYS HA H 42 5.755 5.755 5.413 0.342 25487
192 1 . 1 1 42 42 CYS CA C 42 51.844 51.844 57.466 -5.622 25487
193 1 . 1 1 42 42 CYS CB C 42 46.480 46.480 30.397 16.082 25487
194 1 . 1 1 42 42 CYS H H 42 8.712 8.712 8.979 -0.267 25487
195 1 . 1 1 43 43 SER N N 43 117.527 117.527 116.133 1.394 25487
196 1 . 1 1 43 43 SER HA H 43 5.220 5.220 5.317 -0.097 25487
197 1 . 1 1 43 43 SER CA C 43 54.110 54.110 56.490 -2.380 25487
198 1 . 1 1 43 43 SER CB C 43 64.091 64.091 65.892 -1.800 25487
199 1 . 1 1 43 43 SER H H 43 8.828 8.828 9.028 -0.200 25487
200 1 . 1 1 44 44 CYS N N 44 120.721 120.721 122.782 -2.061 25487
201 1 . 1 1 44 44 CYS HA H 44 5.213 5.213 4.606 0.607 25487
202 1 . 1 1 44 44 CYS CA C 44 53.028 53.028 59.952 -6.924 25487
203 1 . 1 1 44 44 CYS CB C 44 36.825 36.825 26.064 10.761 25487
204 1 . 1 1 44 44 CYS H H 44 7.936 7.936 8.765 -0.829 25487
205 1 . 1 1 45 45 GLN N N 45 124.614 124.614 125.114 -0.500 25487
206 1 . 1 1 45 45 GLN HA H 45 4.644 4.644 4.677 -0.033 25487
207 1 . 1 1 45 45 GLN CB C 45 26.433 26.433 33.703 -7.269 25487
208 1 . 1 1 45 45 GLN H H 45 9.892 9.892 9.212 0.680 25487
209 1 . 1 1 46 46 GLN N N 46 120.933 120.933 119.929 1.004 25487
210 1 . 1 1 46 46 GLN HA H 46 5.026 5.026 4.713 0.313 25487
211 1 . 1 1 46 46 GLN CB C 46 25.665 25.665 29.188 -3.523 25487
212 1 . 1 1 46 46 GLN H H 46 8.849 8.849 8.594 0.255 25487
213 1 . 1 1 47 47 PRO HA H 47 4.520 4.520 4.559 -0.039 25487
214 1 . 1 1 47 47 PRO CA C 47 60.407 60.407 62.359 -1.952 25487
215 1 . 1 1 47 47 PRO CB C 47 29.749 29.749 32.910 -3.161 25487
216 1 . 1 1 48 48 LYS N N 48 124.003 124.003 121.123 2.880 25487
217 1 . 1 1 48 48 LYS HA H 48 4.053 4.053 3.952 0.101 25487
218 1 . 1 1 48 48 LYS CA C 48 56.584 56.584 60.119 -3.535 25487
219 1 . 1 1 48 48 LYS CB C 48 30.564 30.564 32.151 -1.587 25487
220 1 . 1 1 48 48 LYS H H 48 8.931 8.931 8.736 0.195 25487
221 1 . 1 1 49 49 SER N N 49 113.527 113.527 114.248 -0.721 25487
222 1 . 1 1 49 49 SER HA H 49 3.995 3.995 4.149 -0.154 25487
223 1 . 1 1 49 49 SER CA C 49 55.458 55.458 61.813 -6.355 25487
224 1 . 1 1 49 49 SER CB C 49 61.270 61.270 62.428 -1.158 25487
225 1 . 1 1 49 49 SER H H 49 8.702 8.702 8.240 0.462 25487
226 1 . 1 1 50 50 HIS N N 50 119.669 119.669 120.891 -1.222 25487
227 1 . 1 1 50 50 HIS HA H 50 4.327 4.327 4.359 -0.032 25487
228 1 . 1 1 50 50 HIS CB C 50 26.455 26.455 29.795 -3.340 25487
229 1 . 1 1 50 50 HIS H H 50 7.664 7.664 8.223 -0.558 25487
230 1 . 1 1 51 51 LYS N N 51 120.030 120.030 119.993 0.037 25487
231 1 . 1 1 51 51 LYS HA H 51 4.093 4.093 4.015 0.078 25487
232 1 . 1 1 51 51 LYS CA C 51 56.752 56.752 59.529 -2.777 25487
233 1 . 1 1 51 51 LYS CB C 51 30.381 30.381 32.342 -1.961 25487
234 1 . 1 1 51 51 LYS H H 51 7.825 7.825 8.158 -0.333 25487
235 1 . 1 1 52 52 ILE N N 52 118.914 118.914 119.874 -0.960 25487
236 1 . 1 1 52 52 ILE HA H 52 3.721 3.721 3.664 0.057 25487
237 1 . 1 1 52 52 ILE CA C 52 61.825 61.825 64.631 -2.806 25487
238 1 . 1 1 52 52 ILE CB C 52 35.006 35.006 37.360 -2.354 25487
239 1 . 1 1 52 52 ILE H H 52 8.223 8.223 7.964 0.259 25487
240 1 . 1 1 53 53 ALA N N 53 120.985 120.985 122.021 -1.036 25487
241 1 . 1 1 53 53 ALA HA H 53 3.956 3.956 3.913 0.043 25487
242 1 . 1 1 53 53 ALA CA C 53 53.143 53.143 55.614 -2.471 25487
243 1 . 1 1 53 53 ALA CB C 53 16.746 16.746 17.862 -1.116 25487
244 1 . 1 1 53 53 ALA H H 53 8.066 8.066 8.348 -0.282 25487
245 1 . 1 1 54 54 GLU N N 54 115.137 115.137 118.191 -3.054 25487
246 1 . 1 1 54 54 GLU HA H 54 3.933 3.933 3.973 -0.040 25487
247 1 . 1 1 54 54 GLU CB C 54 26.848 26.848 29.264 -2.416 25487
248 1 . 1 1 54 54 GLU H H 54 8.160 8.160 8.082 0.078 25487
249 1 . 1 1 55 55 LYS N N 55 118.610 118.610 119.670 -1.060 25487
250 1 . 1 1 55 55 LYS HA H 55 4.156 4.156 4.074 0.082 25487
251 1 . 1 1 55 55 LYS CA C 55 56.427 56.427 59.180 -2.753 25487
252 1 . 1 1 55 55 LYS H H 55 7.732 7.732 7.974 -0.242 25487
253 1 . 1 1 56 56 ILE N N 56 119.173 119.173 120.763 -1.590 25487
254 1 . 1 1 56 56 ILE HA H 56 3.627 3.627 3.694 -0.067 25487
255 1 . 1 1 56 56 ILE CA C 56 62.898 62.898 64.888 -1.990 25487
256 1 . 1 1 56 56 ILE CB C 56 35.143 35.143 37.446 -2.303 25487
257 1 . 1 1 56 56 ILE H H 56 8.022 8.022 8.115 -0.093 25487
258 1 . 1 1 57 57 ILE N N 57 120.239 120.239 120.201 0.038 25487
259 1 . 1 1 57 57 ILE HA H 57 3.588 3.588 3.560 0.028 25487
260 1 . 1 1 57 57 ILE CA C 57 62.898 62.898 64.841 -1.943 25487
261 1 . 1 1 57 57 ILE CB C 57 35.037 35.037 36.486 -1.449 25487
262 1 . 1 1 57 57 ILE H H 57 8.370 8.370 8.273 0.097 25487
263 1 . 1 1 58 58 ASP N N 58 118.234 118.234 120.602 -2.368 25487
264 1 . 1 1 58 58 ASP HA H 58 4.412 4.412 4.330 0.082 25487
265 1 . 1 1 58 58 ASP CA C 58 54.174 54.174 57.691 -3.518 25487
266 1 . 1 1 58 58 ASP CB C 58 36.195 36.195 40.225 -4.030 25487
267 1 . 1 1 58 58 ASP H H 58 8.458 8.458 8.400 0.058 25487
268 1 . 1 1 59 59 LYS N N 59 119.380 119.380 119.654 -0.274 25487
269 1 . 1 1 59 59 LYS HA H 59 4.250 4.250 4.000 0.251 25487
270 1 . 1 1 59 59 LYS CA C 59 54.931 54.931 59.037 -4.106 25487
271 1 . 1 1 59 59 LYS CB C 59 30.061 30.061 32.459 -2.398 25487
272 1 . 1 1 59 59 LYS H H 59 7.928 7.928 8.083 -0.155 25487
273 1 . 1 1 60 60 ALA N N 60 123.604 123.604 121.977 1.627 25487
274 1 . 1 1 60 60 ALA HA H 60 3.985 3.985 4.089 -0.104 25487
275 1 . 1 1 60 60 ALA CA C 60 52.813 52.813 55.079 -2.266 25487
276 1 . 1 1 60 60 ALA CB C 60 15.797 15.797 18.569 -2.772 25487
277 1 . 1 1 60 60 ALA H H 60 8.699 8.699 8.187 0.512 25487
278 1 . 1 1 61 61 LYS N N 61 115.317 115.317 117.854 -2.537 25487
279 1 . 1 1 61 61 LYS HA H 61 4.018 4.018 4.143 -0.126 25487
280 1 . 1 1 61 61 LYS CA C 61 56.785 56.785 58.470 -1.685 25487
281 1 . 1 1 61 61 LYS CB C 61 30.507 30.507 32.512 -2.005 25487
282 1 . 1 1 61 61 LYS H H 61 8.361 8.361 8.189 0.172 25487
283 1 . 1 1 62 62 THR N N 62 107.298 107.298 112.283 -4.985 25487
284 1 . 1 1 62 62 THR HA H 62 4.368 4.368 4.144 0.224 25487
285 1 . 1 1 62 62 THR CA C 62 60.427 60.427 64.546 -4.119 25487
286 1 . 1 1 62 62 THR CB C 62 67.179 67.179 68.145 -0.966 25487
287 1 . 1 1 62 62 THR H H 62 7.510 7.510 8.370 -0.860 25487
288 1 . 1 1 63 63 THR N N 63 115.701 115.701 114.712 0.989 25487
289 1 . 1 1 63 63 THR HA H 63 4.328 4.328 4.291 0.037 25487
290 1 . 1 1 63 63 THR CA C 63 61.695 61.695 63.860 -2.165 25487
291 1 . 1 1 63 63 THR CB C 63 67.641 67.641 69.579 -1.938 25487
292 1 . 1 1 63 63 THR H H 63 7.651 7.651 7.907 -0.256 25487
stop_
save_