data_18952
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18952
_Entry.PDB_ID 2M3B
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 18952
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 GLU N N 2 121.800 121.800 121.193 0.607 18952
2 1 1 . 1 1 2 2 GLU H H 2 9.240 9.240 8.733 0.507 18952
3 1 1 . 1 1 3 3 LYS N N 3 120.200 120.200 120.005 0.195 18952
4 1 1 . 1 1 3 3 LYS H H 3 8.270 8.270 8.381 -0.111 18952
5 1 1 . 1 1 4 4 VAL N N 4 117.600 117.600 120.423 -2.823 18952
6 1 1 . 1 1 4 4 VAL H H 4 7.750 7.750 7.893 -0.143 18952
7 1 1 . 1 1 5 5 GLN N N 5 120.800 120.800 119.168 1.632 18952
8 1 1 . 1 1 5 5 GLN H H 5 8.190 8.190 8.495 -0.305 18952
9 1 1 . 1 1 6 6 TYR N N 6 119.300 119.300 122.157 -2.857 18952
10 1 1 . 1 1 6 6 TYR H H 6 8.020 8.020 8.422 -0.402 18952
11 1 1 . 1 1 7 7 LEU N N 7 120.400 120.400 119.826 0.574 18952
12 1 1 . 1 1 7 7 LEU H H 7 8.110 8.110 8.557 -0.447 18952
13 1 1 . 1 1 8 8 THR N N 8 111.200 111.200 116.326 -5.126 18952
14 1 1 . 1 1 8 8 THR H H 8 7.890 7.890 8.464 -0.574 18952
15 1 1 . 1 1 9 9 ARG N N 9 120.700 120.700 121.629 -0.929 18952
16 1 1 . 1 1 9 9 ARG H H 9 8.220 8.220 8.199 0.021 18952
17 1 1 . 1 1 10 10 SER N N 10 114.500 114.500 115.170 -0.670 18952
18 1 1 . 1 1 10 10 SER H H 10 7.990 7.990 8.150 -0.160 18952
19 1 1 . 1 1 11 11 ALA N N 11 124.000 124.000 124.857 -0.857 18952
20 1 1 . 1 1 11 11 ALA H H 11 8.060 8.060 8.150 -0.090 18952
21 1 1 . 1 1 12 12 ILE N N 12 115.900 115.900 118.800 -2.900 18952
22 1 1 . 1 1 12 12 ILE H H 12 7.780 7.780 7.994 -0.214 18952
23 1 1 . 1 1 13 13 ARG N N 13 121.100 121.100 119.874 1.226 18952
24 1 1 . 1 1 13 13 ARG H H 13 7.910 7.910 8.164 -0.254 18952
25 1 1 . 1 1 14 14 ARG N N 14 120.270 120.270 118.598 1.672 18952
26 1 1 . 1 1 14 14 ARG H H 14 8.060 8.060 7.989 0.071 18952
27 1 1 . 1 1 18 18 ILE N N 18 122.100 122.100 125.083 -2.983 18952
28 1 1 . 1 1 18 18 ILE H H 18 7.720 7.720 8.411 -0.691 18952
29 1 1 . 1 1 19 19 GLU N N 19 124.800 124.800 125.610 -0.810 18952
30 1 1 . 1 1 19 19 GLU H H 19 8.250 8.250 8.411 -0.161 18952
31 1 1 . 1 1 20 20 MET N N 20 122.700 122.700 121.084 1.616 18952
32 1 1 . 1 1 20 20 MET H H 20 8.480 8.480 8.696 -0.216 18952
33 1 1 . 1 1 22 22 GLN N N 22 121.600 121.600 117.866 3.734 18952
34 1 1 . 1 1 22 22 GLN H H 22 8.710 8.710 8.493 0.217 18952
35 1 1 . 1 1 23 23 GLN N N 23 119.000 119.000 117.736 1.264 18952
36 1 1 . 1 1 23 23 GLN H H 23 8.620 8.620 8.295 0.325 18952
37 1 1 . 1 1 24 24 ALA N N 24 122.400 122.400 124.304 -1.904 18952
38 1 1 . 1 1 24 24 ALA H H 24 7.840 7.840 7.519 0.321 18952
39 1 1 . 1 1 26 26 GLN N N 26 118.340 118.340 118.314 0.026 18952
40 1 1 . 1 1 26 26 GLN H H 26 8.780 8.780 8.018 0.762 18952
41 1 1 . 1 1 27 27 ASN N N 27 117.920 117.920 118.801 -0.881 18952
42 1 1 . 1 1 27 27 ASN H H 27 8.000 8.000 7.962 0.038 18952
43 1 1 . 1 1 28 28 LEU N N 28 121.400 121.400 120.075 1.325 18952
44 1 1 . 1 1 28 28 LEU H H 28 8.210 8.210 8.341 -0.131 18952
45 1 1 . 1 1 29 29 GLN N N 29 117.930 117.930 119.295 -1.365 18952
46 1 1 . 1 1 29 29 GLN H H 29 8.130 8.130 7.892 0.238 18952
47 1 1 . 1 1 30 30 ASN N N 30 117.040 117.040 119.324 -2.284 18952
48 1 1 . 1 1 30 30 ASN H H 30 8.100 8.100 8.198 -0.098 18952
49 1 1 . 1 1 31 31 LEU N N 31 121.200 121.200 120.918 0.282 18952
50 1 1 . 1 1 31 31 LEU H H 31 8.060 8.060 7.955 0.105 18952
51 1 1 . 1 1 32 32 PHE N N 32 118.310 118.310 117.349 0.961 18952
52 1 1 . 1 1 32 32 PHE H H 32 8.450 8.450 7.711 0.739 18952
53 1 1 . 1 1 33 33 ILE N N 33 119.700 119.700 119.907 -0.207 18952
54 1 1 . 1 1 33 33 ILE H H 33 8.420 8.420 8.806 -0.386 18952
55 1 1 . 1 1 34 34 ASN N N 34 117.580 117.580 118.167 -0.587 18952
56 1 1 . 1 1 34 34 ASN H H 34 8.030 8.030 8.014 0.016 18952
57 1 1 . 1 1 35 35 PHE N N 35 119.400 119.400 121.383 -1.983 18952
58 1 1 . 1 1 35 35 PHE H H 35 8.570 8.570 7.808 0.762 18952
59 1 1 . 1 1 36 36 CYS N N 36 116.680 116.680 118.547 -1.867 18952
60 1 1 . 1 1 36 36 CYS H H 36 8.160 8.160 8.010 0.150 18952
61 1 1 . 1 1 37 37 LEU N N 37 118.190 118.190 121.087 -2.897 18952
62 1 1 . 1 1 37 37 LEU H H 37 8.170 8.170 8.475 -0.305 18952
63 1 1 . 1 1 38 38 ILE N N 38 119.700 119.700 119.241 0.459 18952
64 1 1 . 1 1 38 38 ILE H H 38 8.390 8.390 8.501 -0.111 18952
65 1 1 . 1 1 39 39 LEU N N 39 119.400 119.400 120.076 -0.676 18952
66 1 1 . 1 1 39 39 LEU H H 39 7.990 7.990 7.599 0.391 18952
67 1 1 . 1 1 40 40 ILE N N 40 119.250 119.250 119.719 -0.469 18952
68 1 1 . 1 1 40 40 ILE H H 40 8.140 8.140 8.204 -0.064 18952
69 1 1 . 1 1 41 41 CYS N N 41 117.800 117.800 118.715 -0.915 18952
70 1 1 . 1 1 41 41 CYS H H 41 7.980 7.980 8.522 -0.542 18952
71 1 1 . 1 1 42 42 LEU N N 42 117.900 117.900 119.985 -2.085 18952
72 1 1 . 1 1 42 42 LEU H H 42 8.290 8.290 8.209 0.081 18952
73 1 1 . 1 1 43 43 LEU N N 43 119.700 119.700 119.995 -0.295 18952
74 1 1 . 1 1 43 43 LEU H H 43 8.390 8.390 7.990 0.400 18952
75 1 1 . 1 1 44 44 LEU N N 44 117.800 117.800 120.536 -2.736 18952
76 1 1 . 1 1 44 44 LEU H H 44 8.180 8.180 8.093 0.087 18952
77 1 1 . 1 1 45 45 ILE N N 45 117.690 117.690 120.604 -2.914 18952
78 1 1 . 1 1 45 45 ILE H H 45 8.170 8.170 8.022 0.148 18952
79 1 1 . 1 1 46 46 CYS N N 46 117.020 117.020 118.367 -1.347 18952
80 1 1 . 1 1 46 46 CYS H H 46 8.150 8.150 7.711 0.439 18952
81 1 1 . 1 1 47 47 ILE N N 47 117.300 117.300 121.035 -3.735 18952
82 1 1 . 1 1 47 47 ILE H H 47 8.230 8.230 7.610 0.620 18952
83 1 1 . 1 1 48 48 ILE N N 48 117.690 117.690 120.642 -2.952 18952
84 1 1 . 1 1 48 48 ILE H H 48 8.200 8.200 8.404 -0.204 18952
85 1 1 . 1 1 49 49 VAL N N 49 115.700 115.700 120.298 -4.598 18952
86 1 1 . 1 1 49 49 VAL H H 49 8.340 8.340 8.387 -0.047 18952
87 1 1 . 1 1 50 50 MET N N 50 115.500 115.500 118.062 -2.562 18952
88 1 1 . 1 1 50 50 MET H H 50 7.920 7.920 8.051 -0.131 18952
89 1 1 . 1 1 51 51 LEU N N 51 118.100 118.100 119.481 -1.381 18952
90 1 1 . 1 1 51 51 LEU H H 51 7.880 7.880 8.033 -0.153 18952
91 1 2 . 1 1 2 2 GLU N N 2 121.800 121.800 121.240 0.560 18952
92 1 2 . 1 1 2 2 GLU H H 2 9.240 9.240 8.730 0.510 18952
93 1 2 . 1 1 3 3 LYS N N 3 120.200 120.200 119.255 0.945 18952
94 1 2 . 1 1 3 3 LYS H H 3 8.270 8.270 8.372 -0.102 18952
95 1 2 . 1 1 4 4 VAL N N 4 117.600 117.600 120.393 -2.793 18952
96 1 2 . 1 1 4 4 VAL H H 4 7.750 7.750 7.898 -0.148 18952
97 1 2 . 1 1 5 5 GLN N N 5 120.800 120.800 119.166 1.634 18952
98 1 2 . 1 1 5 5 GLN H H 5 8.190 8.190 8.542 -0.352 18952
99 1 2 . 1 1 6 6 TYR N N 6 119.300 119.300 122.501 -3.201 18952
100 1 2 . 1 1 6 6 TYR H H 6 8.020 8.020 8.395 -0.375 18952
101 1 2 . 1 1 7 7 LEU N N 7 120.400 120.400 119.711 0.689 18952
102 1 2 . 1 1 7 7 LEU H H 7 8.110 8.110 8.440 -0.330 18952
103 1 2 . 1 1 8 8 THR N N 8 111.200 111.200 116.006 -4.806 18952
104 1 2 . 1 1 8 8 THR H H 8 7.890 7.890 8.289 -0.399 18952
105 1 2 . 1 1 9 9 ARG N N 9 120.700 120.700 121.630 -0.930 18952
106 1 2 . 1 1 9 9 ARG H H 9 8.220 8.220 8.280 -0.060 18952
107 1 2 . 1 1 10 10 SER N N 10 114.500 114.500 115.239 -0.739 18952
108 1 2 . 1 1 10 10 SER H H 10 7.990 7.990 8.150 -0.160 18952
109 1 2 . 1 1 11 11 ALA N N 11 124.000 124.000 124.676 -0.676 18952
110 1 2 . 1 1 11 11 ALA H H 11 8.060 8.060 7.943 0.117 18952
111 1 2 . 1 1 12 12 ILE N N 12 115.900 115.900 118.333 -2.433 18952
112 1 2 . 1 1 12 12 ILE H H 12 7.780 7.780 8.023 -0.243 18952
113 1 2 . 1 1 13 13 ARG N N 13 121.100 121.100 120.316 0.784 18952
114 1 2 . 1 1 13 13 ARG H H 13 7.910 7.910 8.194 -0.284 18952
115 1 2 . 1 1 14 14 ARG N N 14 120.270 120.270 117.654 2.616 18952
116 1 2 . 1 1 14 14 ARG H H 14 8.060 8.060 7.917 0.143 18952
117 1 2 . 1 1 18 18 ILE N N 18 122.100 122.100 121.295 0.805 18952
118 1 2 . 1 1 18 18 ILE H H 18 7.720 7.720 8.068 -0.348 18952
119 1 2 . 1 1 19 19 GLU N N 19 124.800 124.800 126.869 -2.069 18952
120 1 2 . 1 1 19 19 GLU H H 19 8.250 8.250 8.763 -0.513 18952
121 1 2 . 1 1 20 20 MET N N 20 122.700 122.700 121.281 1.419 18952
122 1 2 . 1 1 20 20 MET H H 20 8.480 8.480 7.891 0.589 18952
123 1 2 . 1 1 22 22 GLN N N 22 121.600 121.600 124.557 -2.957 18952
124 1 2 . 1 1 22 22 GLN H H 22 8.710 8.710 8.664 0.046 18952
125 1 2 . 1 1 23 23 GLN N N 23 119.000 119.000 118.579 0.421 18952
126 1 2 . 1 1 23 23 GLN H H 23 8.620 8.620 8.273 0.347 18952
127 1 2 . 1 1 24 24 ALA N N 24 122.400 122.400 122.784 -0.384 18952
128 1 2 . 1 1 24 24 ALA H H 24 7.840 7.840 7.625 0.215 18952
129 1 2 . 1 1 26 26 GLN N N 26 118.340 118.340 117.859 0.481 18952
130 1 2 . 1 1 26 26 GLN H H 26 8.780 8.780 8.207 0.573 18952
131 1 2 . 1 1 27 27 ASN N N 27 117.920 117.920 117.060 0.860 18952
132 1 2 . 1 1 27 27 ASN H H 27 8.000 8.000 7.845 0.155 18952
133 1 2 . 1 1 28 28 LEU N N 28 121.400 121.400 120.789 0.611 18952
134 1 2 . 1 1 28 28 LEU H H 28 8.210 8.210 8.239 -0.029 18952
135 1 2 . 1 1 29 29 GLN N N 29 117.930 117.930 118.351 -0.421 18952
136 1 2 . 1 1 29 29 GLN H H 29 8.130 8.130 7.782 0.348 18952
137 1 2 . 1 1 30 30 ASN N N 30 117.040 117.040 117.476 -0.436 18952
138 1 2 . 1 1 30 30 ASN H H 30 8.100 8.100 7.420 0.680 18952
139 1 2 . 1 1 31 31 LEU N N 31 121.200 121.200 121.477 -0.277 18952
140 1 2 . 1 1 31 31 LEU H H 31 8.060 8.060 7.183 0.877 18952
141 1 2 . 1 1 32 32 PHE N N 32 118.310 118.310 118.024 0.286 18952
142 1 2 . 1 1 32 32 PHE H H 32 8.450 8.450 6.945 1.505 18952
143 1 2 . 1 1 33 33 ILE N N 33 119.700 119.700 119.582 0.118 18952
144 1 2 . 1 1 33 33 ILE H H 33 8.420 8.420 8.519 -0.099 18952
145 1 2 . 1 1 34 34 ASN N N 34 117.580 117.580 118.721 -1.141 18952
146 1 2 . 1 1 34 34 ASN H H 34 8.030 8.030 8.401 -0.371 18952
147 1 2 . 1 1 35 35 PHE N N 35 119.400 119.400 121.994 -2.594 18952
148 1 2 . 1 1 35 35 PHE H H 35 8.570 8.570 8.426 0.144 18952
149 1 2 . 1 1 36 36 CYS N N 36 116.680 116.680 118.432 -1.752 18952
150 1 2 . 1 1 36 36 CYS H H 36 8.160 8.160 7.766 0.394 18952
151 1 2 . 1 1 37 37 LEU N N 37 118.190 118.190 120.997 -2.807 18952
152 1 2 . 1 1 37 37 LEU H H 37 8.170 8.170 7.905 0.265 18952
153 1 2 . 1 1 38 38 ILE N N 38 119.700 119.700 119.485 0.215 18952
154 1 2 . 1 1 38 38 ILE H H 38 8.390 8.390 8.579 -0.189 18952
155 1 2 . 1 1 39 39 LEU N N 39 119.400 119.400 120.368 -0.968 18952
156 1 2 . 1 1 39 39 LEU H H 39 7.990 7.990 7.663 0.327 18952
157 1 2 . 1 1 40 40 ILE N N 40 119.250 119.250 119.791 -0.541 18952
158 1 2 . 1 1 40 40 ILE H H 40 8.140 8.140 8.273 -0.133 18952
159 1 2 . 1 1 41 41 CYS N N 41 117.800 117.800 118.881 -1.081 18952
160 1 2 . 1 1 41 41 CYS H H 41 7.980 7.980 8.396 -0.416 18952
161 1 2 . 1 1 42 42 LEU N N 42 117.900 117.900 119.997 -2.097 18952
162 1 2 . 1 1 42 42 LEU H H 42 8.290 8.290 8.394 -0.104 18952
163 1 2 . 1 1 43 43 LEU N N 43 119.700 119.700 119.016 0.684 18952
164 1 2 . 1 1 43 43 LEU H H 43 8.390 8.390 7.941 0.449 18952
165 1 2 . 1 1 44 44 LEU N N 44 117.800 117.800 121.242 -3.442 18952
166 1 2 . 1 1 44 44 LEU H H 44 8.180 8.180 8.067 0.113 18952
167 1 2 . 1 1 45 45 ILE N N 45 117.690 117.690 120.245 -2.555 18952
168 1 2 . 1 1 45 45 ILE H H 45 8.170 8.170 7.771 0.399 18952
169 1 2 . 1 1 46 46 CYS N N 46 117.020 117.020 118.350 -1.330 18952
170 1 2 . 1 1 46 46 CYS H H 46 8.150 8.150 7.515 0.635 18952
171 1 2 . 1 1 47 47 ILE N N 47 117.300 117.300 121.259 -3.959 18952
172 1 2 . 1 1 47 47 ILE H H 47 8.230 8.230 7.926 0.304 18952
173 1 2 . 1 1 48 48 ILE N N 48 117.690 117.690 120.373 -2.683 18952
174 1 2 . 1 1 48 48 ILE H H 48 8.200 8.200 8.212 -0.012 18952
175 1 2 . 1 1 49 49 VAL N N 49 115.700 115.700 120.496 -4.796 18952
176 1 2 . 1 1 49 49 VAL H H 49 8.340 8.340 8.315 0.025 18952
177 1 2 . 1 1 50 50 MET N N 50 115.500 115.500 117.568 -2.068 18952
178 1 2 . 1 1 50 50 MET H H 50 7.920 7.920 8.266 -0.346 18952
179 1 2 . 1 1 51 51 LEU N N 51 118.100 118.100 119.866 -1.766 18952
180 1 2 . 1 1 51 51 LEU H H 51 7.880 7.880 7.698 0.182 18952
181 1 3 . 1 1 2 2 GLU N N 2 121.800 121.800 122.791 -0.991 18952
182 1 3 . 1 1 2 2 GLU H H 2 9.240 9.240 8.926 0.314 18952
183 1 3 . 1 1 3 3 LYS N N 3 120.200 120.200 119.910 0.290 18952
184 1 3 . 1 1 3 3 LYS H H 3 8.270 8.270 8.362 -0.092 18952
185 1 3 . 1 1 4 4 VAL N N 4 117.600 117.600 120.622 -3.022 18952
186 1 3 . 1 1 4 4 VAL H H 4 7.750 7.750 7.877 -0.127 18952
187 1 3 . 1 1 5 5 GLN N N 5 120.800 120.800 118.978 1.822 18952
188 1 3 . 1 1 5 5 GLN H H 5 8.190 8.190 8.579 -0.389 18952
189 1 3 . 1 1 6 6 TYR N N 6 119.300 119.300 121.861 -2.561 18952
190 1 3 . 1 1 6 6 TYR H H 6 8.020 8.020 8.273 -0.253 18952
191 1 3 . 1 1 7 7 LEU N N 7 120.400 120.400 120.037 0.363 18952
192 1 3 . 1 1 7 7 LEU H H 7 8.110 8.110 8.447 -0.337 18952
193 1 3 . 1 1 8 8 THR N N 8 111.200 111.200 115.989 -4.789 18952
194 1 3 . 1 1 8 8 THR H H 8 7.890 7.890 8.580 -0.690 18952
195 1 3 . 1 1 9 9 ARG N N 9 120.700 120.700 121.648 -0.948 18952
196 1 3 . 1 1 9 9 ARG H H 9 8.220 8.220 8.064 0.156 18952
197 1 3 . 1 1 10 10 SER N N 10 114.500 114.500 115.020 -0.520 18952
198 1 3 . 1 1 10 10 SER H H 10 7.990 7.990 8.125 -0.135 18952
199 1 3 . 1 1 11 11 ALA N N 11 124.000 124.000 124.923 -0.923 18952
200 1 3 . 1 1 11 11 ALA H H 11 8.060 8.060 8.183 -0.123 18952
201 1 3 . 1 1 12 12 ILE N N 12 115.900 115.900 118.567 -2.667 18952
202 1 3 . 1 1 12 12 ILE H H 12 7.780 7.780 8.029 -0.249 18952
203 1 3 . 1 1 13 13 ARG N N 13 121.100 121.100 119.030 2.070 18952
204 1 3 . 1 1 13 13 ARG H H 13 7.910 7.910 7.842 0.068 18952
205 1 3 . 1 1 14 14 ARG N N 14 120.270 120.270 118.248 2.022 18952
206 1 3 . 1 1 14 14 ARG H H 14 8.060 8.060 7.913 0.147 18952
207 1 3 . 1 1 18 18 ILE N N 18 122.100 122.100 119.901 2.199 18952
208 1 3 . 1 1 18 18 ILE H H 18 7.720 7.720 8.244 -0.524 18952
209 1 3 . 1 1 19 19 GLU N N 19 124.800 124.800 123.348 1.452 18952
210 1 3 . 1 1 19 19 GLU H H 19 8.250 8.250 8.504 -0.254 18952
211 1 3 . 1 1 20 20 MET N N 20 122.700 122.700 118.770 3.930 18952
212 1 3 . 1 1 20 20 MET H H 20 8.480 8.480 7.690 0.790 18952
213 1 3 . 1 1 22 22 GLN N N 22 121.600 121.600 114.848 6.752 18952
214 1 3 . 1 1 22 22 GLN H H 22 8.710 8.710 8.382 0.328 18952
215 1 3 . 1 1 23 23 GLN N N 23 119.000 119.000 119.859 -0.859 18952
216 1 3 . 1 1 23 23 GLN H H 23 8.620 8.620 8.030 0.590 18952
217 1 3 . 1 1 24 24 ALA N N 24 122.400 122.400 119.680 2.720 18952
218 1 3 . 1 1 24 24 ALA H H 24 7.840 7.840 7.495 0.345 18952
219 1 3 . 1 1 26 26 GLN N N 26 118.340 118.340 120.973 -2.633 18952
220 1 3 . 1 1 26 26 GLN H H 26 8.780 8.780 8.872 -0.092 18952
221 1 3 . 1 1 27 27 ASN N N 27 117.920 117.920 117.883 0.037 18952
222 1 3 . 1 1 27 27 ASN H H 27 8.000 8.000 8.230 -0.230 18952
223 1 3 . 1 1 28 28 LEU N N 28 121.400 121.400 119.936 1.464 18952
224 1 3 . 1 1 28 28 LEU H H 28 8.210 8.210 8.105 0.105 18952
225 1 3 . 1 1 29 29 GLN N N 29 117.930 117.930 119.173 -1.243 18952
226 1 3 . 1 1 29 29 GLN H H 29 8.130 8.130 8.124 0.006 18952
227 1 3 . 1 1 30 30 ASN N N 30 117.040 117.040 118.859 -1.819 18952
228 1 3 . 1 1 30 30 ASN H H 30 8.100 8.100 7.566 0.534 18952
229 1 3 . 1 1 31 31 LEU N N 31 121.200 121.200 120.948 0.252 18952
230 1 3 . 1 1 31 31 LEU H H 31 8.060 8.060 7.148 0.912 18952
231 1 3 . 1 1 32 32 PHE N N 32 118.310 118.310 118.199 0.111 18952
232 1 3 . 1 1 32 32 PHE H H 32 8.450 8.450 7.338 1.112 18952
233 1 3 . 1 1 33 33 ILE N N 33 119.700 119.700 119.705 -0.005 18952
234 1 3 . 1 1 33 33 ILE H H 33 8.420 8.420 8.756 -0.336 18952
235 1 3 . 1 1 34 34 ASN N N 34 117.580 117.580 118.463 -0.883 18952
236 1 3 . 1 1 34 34 ASN H H 34 8.030 8.030 8.279 -0.249 18952
237 1 3 . 1 1 35 35 PHE N N 35 119.400 119.400 121.546 -2.146 18952
238 1 3 . 1 1 35 35 PHE H H 35 8.570 8.570 8.040 0.530 18952
239 1 3 . 1 1 36 36 CYS N N 36 116.680 116.680 118.329 -1.649 18952
240 1 3 . 1 1 36 36 CYS H H 36 8.160 8.160 8.084 0.076 18952
241 1 3 . 1 1 37 37 LEU N N 37 118.190 118.190 121.481 -3.291 18952
242 1 3 . 1 1 37 37 LEU H H 37 8.170 8.170 8.539 -0.369 18952
243 1 3 . 1 1 38 38 ILE N N 38 119.700 119.700 119.393 0.307 18952
244 1 3 . 1 1 38 38 ILE H H 38 8.390 8.390 8.404 -0.014 18952
245 1 3 . 1 1 39 39 LEU N N 39 119.400 119.400 120.202 -0.802 18952
246 1 3 . 1 1 39 39 LEU H H 39 7.990 7.990 7.593 0.397 18952
247 1 3 . 1 1 40 40 ILE N N 40 119.250 119.250 118.893 0.357 18952
248 1 3 . 1 1 40 40 ILE H H 40 8.140 8.140 7.939 0.201 18952
249 1 3 . 1 1 41 41 CYS N N 41 117.800 117.800 118.697 -0.897 18952
250 1 3 . 1 1 41 41 CYS H H 41 7.980 7.980 8.357 -0.377 18952
251 1 3 . 1 1 42 42 LEU N N 42 117.900 117.900 120.011 -2.111 18952
252 1 3 . 1 1 42 42 LEU H H 42 8.290 8.290 8.189 0.101 18952
253 1 3 . 1 1 43 43 LEU N N 43 119.700 119.700 119.996 -0.296 18952
254 1 3 . 1 1 43 43 LEU H H 43 8.390 8.390 8.078 0.312 18952
255 1 3 . 1 1 44 44 LEU N N 44 117.800 117.800 120.447 -2.647 18952
256 1 3 . 1 1 44 44 LEU H H 44 8.180 8.180 8.304 -0.124 18952
257 1 3 . 1 1 45 45 ILE N N 45 117.690 117.690 119.858 -2.168 18952
258 1 3 . 1 1 45 45 ILE H H 45 8.170 8.170 7.582 0.588 18952
259 1 3 . 1 1 46 46 CYS N N 46 117.020 117.020 118.454 -1.434 18952
260 1 3 . 1 1 46 46 CYS H H 46 8.150 8.150 7.619 0.531 18952
261 1 3 . 1 1 47 47 ILE N N 47 117.300 117.300 121.277 -3.977 18952
262 1 3 . 1 1 47 47 ILE H H 47 8.230 8.230 7.983 0.247 18952
263 1 3 . 1 1 48 48 ILE N N 48 117.690 117.690 120.025 -2.335 18952
264 1 3 . 1 1 48 48 ILE H H 48 8.200 8.200 7.972 0.228 18952
265 1 3 . 1 1 49 49 VAL N N 49 115.700 115.700 119.017 -3.317 18952
266 1 3 . 1 1 49 49 VAL H H 49 8.340 8.340 8.115 0.225 18952
267 1 3 . 1 1 50 50 MET N N 50 115.500 115.500 118.075 -2.575 18952
268 1 3 . 1 1 50 50 MET H H 50 7.920 7.920 8.192 -0.272 18952
269 1 3 . 1 1 51 51 LEU N N 51 118.100 118.100 119.483 -1.383 18952
270 1 3 . 1 1 51 51 LEU H H 51 7.880 7.880 7.791 0.089 18952
271 1 4 . 1 1 2 2 GLU N N 2 121.800 121.800 122.782 -0.982 18952
272 1 4 . 1 1 2 2 GLU H H 2 9.240 9.240 8.928 0.312 18952
273 1 4 . 1 1 3 3 LYS N N 3 120.200 120.200 119.919 0.281 18952
274 1 4 . 1 1 3 3 LYS H H 3 8.270 8.270 8.365 -0.095 18952
275 1 4 . 1 1 4 4 VAL N N 4 117.600 117.600 120.642 -3.042 18952
276 1 4 . 1 1 4 4 VAL H H 4 7.750 7.750 7.871 -0.121 18952
277 1 4 . 1 1 5 5 GLN N N 5 120.800 120.800 118.927 1.873 18952
278 1 4 . 1 1 5 5 GLN H H 5 8.190 8.190 8.565 -0.375 18952
279 1 4 . 1 1 6 6 TYR N N 6 119.300 119.300 121.896 -2.596 18952
280 1 4 . 1 1 6 6 TYR H H 6 8.020 8.020 8.365 -0.345 18952
281 1 4 . 1 1 7 7 LEU N N 7 120.400 120.400 120.066 0.334 18952
282 1 4 . 1 1 7 7 LEU H H 7 8.110 8.110 8.519 -0.409 18952
283 1 4 . 1 1 8 8 THR N N 8 111.200 111.200 115.950 -4.750 18952
284 1 4 . 1 1 8 8 THR H H 8 7.890 7.890 8.544 -0.654 18952
285 1 4 . 1 1 9 9 ARG N N 9 120.700 120.700 121.587 -0.887 18952
286 1 4 . 1 1 9 9 ARG H H 9 8.220 8.220 7.931 0.289 18952
287 1 4 . 1 1 10 10 SER N N 10 114.500 114.500 115.103 -0.603 18952
288 1 4 . 1 1 10 10 SER H H 10 7.990 7.990 8.164 -0.174 18952
289 1 4 . 1 1 11 11 ALA N N 11 124.000 124.000 124.794 -0.794 18952
290 1 4 . 1 1 11 11 ALA H H 11 8.060 8.060 8.198 -0.138 18952
291 1 4 . 1 1 12 12 ILE N N 12 115.900 115.900 118.460 -2.560 18952
292 1 4 . 1 1 12 12 ILE H H 12 7.780 7.780 7.922 -0.142 18952
293 1 4 . 1 1 13 13 ARG N N 13 121.100 121.100 119.163 1.937 18952
294 1 4 . 1 1 13 13 ARG H H 13 7.910 7.910 7.908 0.002 18952
295 1 4 . 1 1 14 14 ARG N N 14 120.270 120.270 118.076 2.194 18952
296 1 4 . 1 1 14 14 ARG H H 14 8.060 8.060 8.010 0.050 18952
297 1 4 . 1 1 18 18 ILE N N 18 122.100 122.100 123.189 -1.089 18952
298 1 4 . 1 1 18 18 ILE H H 18 7.720 7.720 7.922 -0.202 18952
299 1 4 . 1 1 19 19 GLU N N 19 124.800 124.800 124.475 0.325 18952
300 1 4 . 1 1 19 19 GLU H H 19 8.250 8.250 8.550 -0.300 18952
301 1 4 . 1 1 20 20 MET N N 20 122.700 122.700 121.698 1.002 18952
302 1 4 . 1 1 20 20 MET H H 20 8.480 8.480 8.600 -0.120 18952
303 1 4 . 1 1 22 22 GLN N N 22 121.600 121.600 119.433 2.167 18952
304 1 4 . 1 1 22 22 GLN H H 22 8.710 8.710 8.357 0.353 18952
305 1 4 . 1 1 23 23 GLN N N 23 119.000 119.000 120.243 -1.243 18952
306 1 4 . 1 1 23 23 GLN H H 23 8.620 8.620 8.681 -0.061 18952
307 1 4 . 1 1 24 24 ALA N N 24 122.400 122.400 122.624 -0.224 18952
308 1 4 . 1 1 24 24 ALA H H 24 7.840 7.840 7.951 -0.111 18952
309 1 4 . 1 1 26 26 GLN N N 26 118.340 118.340 119.613 -1.273 18952
310 1 4 . 1 1 26 26 GLN H H 26 8.780 8.780 8.454 0.326 18952
311 1 4 . 1 1 27 27 ASN N N 27 117.920 117.920 118.347 -0.427 18952
312 1 4 . 1 1 27 27 ASN H H 27 8.000 8.000 7.730 0.270 18952
313 1 4 . 1 1 28 28 LEU N N 28 121.400 121.400 120.051 1.349 18952
314 1 4 . 1 1 28 28 LEU H H 28 8.210 8.210 7.428 0.781 18952
315 1 4 . 1 1 29 29 GLN N N 29 117.930 117.930 118.876 -0.946 18952
316 1 4 . 1 1 29 29 GLN H H 29 8.130 8.130 7.711 0.419 18952
317 1 4 . 1 1 30 30 ASN N N 30 117.040 117.040 119.239 -2.199 18952
318 1 4 . 1 1 30 30 ASN H H 30 8.100 8.100 7.860 0.240 18952
319 1 4 . 1 1 31 31 LEU N N 31 121.200 121.200 121.017 0.183 18952
320 1 4 . 1 1 31 31 LEU H H 31 8.060 8.060 8.083 -0.023 18952
321 1 4 . 1 1 32 32 PHE N N 32 118.310 118.310 117.745 0.565 18952
322 1 4 . 1 1 32 32 PHE H H 32 8.450 8.450 7.563 0.887 18952
323 1 4 . 1 1 33 33 ILE N N 33 119.700 119.700 119.841 -0.141 18952
324 1 4 . 1 1 33 33 ILE H H 33 8.420 8.420 8.646 -0.226 18952
325 1 4 . 1 1 34 34 ASN N N 34 117.580 117.580 118.101 -0.521 18952
326 1 4 . 1 1 34 34 ASN H H 34 8.030 8.030 7.951 0.079 18952
327 1 4 . 1 1 35 35 PHE N N 35 119.400 119.400 121.521 -2.121 18952
328 1 4 . 1 1 35 35 PHE H H 35 8.570 8.570 7.798 0.772 18952
329 1 4 . 1 1 36 36 CYS N N 36 116.680 116.680 118.523 -1.843 18952
330 1 4 . 1 1 36 36 CYS H H 36 8.160 8.160 7.956 0.204 18952
331 1 4 . 1 1 37 37 LEU N N 37 118.190 118.190 121.115 -2.925 18952
332 1 4 . 1 1 37 37 LEU H H 37 8.170 8.170 8.324 -0.154 18952
333 1 4 . 1 1 38 38 ILE N N 38 119.700 119.700 119.398 0.302 18952
334 1 4 . 1 1 38 38 ILE H H 38 8.390 8.390 8.533 -0.143 18952
335 1 4 . 1 1 39 39 LEU N N 39 119.400 119.400 120.246 -0.846 18952
336 1 4 . 1 1 39 39 LEU H H 39 7.990 7.990 7.593 0.397 18952
337 1 4 . 1 1 40 40 ILE N N 40 119.250 119.250 119.204 0.046 18952
338 1 4 . 1 1 40 40 ILE H H 40 8.140 8.140 8.247 -0.107 18952
339 1 4 . 1 1 41 41 CYS N N 41 117.800 117.800 118.787 -0.987 18952
340 1 4 . 1 1 41 41 CYS H H 41 7.980 7.980 8.402 -0.422 18952
341 1 4 . 1 1 42 42 LEU N N 42 117.900 117.900 119.676 -1.776 18952
342 1 4 . 1 1 42 42 LEU H H 42 8.290 8.290 8.103 0.187 18952
343 1 4 . 1 1 43 43 LEU N N 43 119.700 119.700 120.691 -0.991 18952
344 1 4 . 1 1 43 43 LEU H H 43 8.390 8.390 7.953 0.437 18952
345 1 4 . 1 1 44 44 LEU N N 44 117.800 117.800 120.724 -2.924 18952
346 1 4 . 1 1 44 44 LEU H H 44 8.180 8.180 8.330 -0.150 18952
347 1 4 . 1 1 45 45 ILE N N 45 117.690 117.690 119.792 -2.102 18952
348 1 4 . 1 1 45 45 ILE H H 45 8.170 8.170 7.562 0.608 18952
349 1 4 . 1 1 46 46 CYS N N 46 117.020 117.020 118.407 -1.387 18952
350 1 4 . 1 1 46 46 CYS H H 46 8.150 8.150 7.682 0.468 18952
351 1 4 . 1 1 47 47 ILE N N 47 117.300 117.300 121.573 -4.273 18952
352 1 4 . 1 1 47 47 ILE H H 47 8.230 8.230 8.284 -0.054 18952
353 1 4 . 1 1 48 48 ILE N N 48 117.690 117.690 120.192 -2.502 18952
354 1 4 . 1 1 48 48 ILE H H 48 8.200 8.200 8.064 0.136 18952
355 1 4 . 1 1 49 49 VAL N N 49 115.700 115.700 120.483 -4.783 18952
356 1 4 . 1 1 49 49 VAL H H 49 8.340 8.340 7.921 0.419 18952
357 1 4 . 1 1 50 50 MET N N 50 115.500 115.500 117.625 -2.125 18952
358 1 4 . 1 1 50 50 MET H H 50 7.920 7.920 8.323 -0.403 18952
359 1 4 . 1 1 51 51 LEU N N 51 118.100 118.100 120.202 -2.102 18952
360 1 4 . 1 1 51 51 LEU H H 51 7.880 7.880 7.901 -0.021 18952
361 1 5 . 1 1 2 2 GLU N N 2 121.800 121.800 121.189 0.611 18952
362 1 5 . 1 1 2 2 GLU H H 2 9.240 9.240 8.722 0.518 18952
363 1 5 . 1 1 3 3 LYS N N 3 120.200 120.200 119.273 0.927 18952
364 1 5 . 1 1 3 3 LYS H H 3 8.270 8.270 8.364 -0.094 18952
365 1 5 . 1 1 4 4 VAL N N 4 117.600 117.600 120.345 -2.745 18952
366 1 5 . 1 1 4 4 VAL H H 4 7.750 7.750 7.895 -0.145 18952
367 1 5 . 1 1 5 5 GLN N N 5 120.800 120.800 118.995 1.805 18952
368 1 5 . 1 1 5 5 GLN H H 5 8.190 8.190 8.509 -0.319 18952
369 1 5 . 1 1 6 6 TYR N N 6 119.300 119.300 122.709 -3.409 18952
370 1 5 . 1 1 6 6 TYR H H 6 8.020 8.020 8.448 -0.428 18952
371 1 5 . 1 1 7 7 LEU N N 7 120.400 120.400 119.564 0.836 18952
372 1 5 . 1 1 7 7 LEU H H 7 8.110 8.110 8.331 -0.221 18952
373 1 5 . 1 1 8 8 THR N N 8 111.200 111.200 115.918 -4.718 18952
374 1 5 . 1 1 8 8 THR H H 8 7.890 7.890 7.990 -0.100 18952
375 1 5 . 1 1 9 9 ARG N N 9 120.700 120.700 121.673 -0.973 18952
376 1 5 . 1 1 9 9 ARG H H 9 8.220 8.220 8.385 -0.165 18952
377 1 5 . 1 1 10 10 SER N N 10 114.500 114.500 115.187 -0.687 18952
378 1 5 . 1 1 10 10 SER H H 10 7.990 7.990 8.170 -0.180 18952
379 1 5 . 1 1 11 11 ALA N N 11 124.000 124.000 124.737 -0.737 18952
380 1 5 . 1 1 11 11 ALA H H 11 8.060 8.060 7.966 0.094 18952
381 1 5 . 1 1 12 12 ILE N N 12 115.900 115.900 118.759 -2.859 18952
382 1 5 . 1 1 12 12 ILE H H 12 7.780 7.780 7.889 -0.109 18952
383 1 5 . 1 1 13 13 ARG N N 13 121.100 121.100 120.041 1.059 18952
384 1 5 . 1 1 13 13 ARG H H 13 7.910 7.910 8.127 -0.217 18952
385 1 5 . 1 1 14 14 ARG N N 14 120.270 120.270 117.786 2.484 18952
386 1 5 . 1 1 14 14 ARG H H 14 8.060 8.060 7.803 0.257 18952
387 1 5 . 1 1 18 18 ILE N N 18 122.100 122.100 122.732 -0.632 18952
388 1 5 . 1 1 18 18 ILE H H 18 7.720 7.720 8.036 -0.316 18952
389 1 5 . 1 1 19 19 GLU N N 19 124.800 124.800 127.567 -2.767 18952
390 1 5 . 1 1 19 19 GLU H H 19 8.250 8.250 8.504 -0.254 18952
391 1 5 . 1 1 20 20 MET N N 20 122.700 122.700 122.505 0.195 18952
392 1 5 . 1 1 20 20 MET H H 20 8.480 8.480 8.420 0.060 18952
393 1 5 . 1 1 22 22 GLN N N 22 121.600 121.600 117.719 3.881 18952
394 1 5 . 1 1 22 22 GLN H H 22 8.710 8.710 8.605 0.105 18952
395 1 5 . 1 1 23 23 GLN N N 23 119.000 119.000 119.120 -0.120 18952
396 1 5 . 1 1 23 23 GLN H H 23 8.620 8.620 7.679 0.941 18952
397 1 5 . 1 1 24 24 ALA N N 24 122.400 122.400 119.164 3.236 18952
398 1 5 . 1 1 24 24 ALA H H 24 7.840 7.840 7.690 0.150 18952
399 1 5 . 1 1 26 26 GLN N N 26 118.340 118.340 116.847 1.493 18952
400 1 5 . 1 1 26 26 GLN H H 26 8.780 8.780 7.633 1.147 18952
401 1 5 . 1 1 27 27 ASN N N 27 117.920 117.920 117.435 0.485 18952
402 1 5 . 1 1 27 27 ASN H H 27 8.000 8.000 8.438 -0.438 18952
403 1 5 . 1 1 28 28 LEU N N 28 121.400 121.400 120.312 1.088 18952
404 1 5 . 1 1 28 28 LEU H H 28 8.210 8.210 7.791 0.419 18952
405 1 5 . 1 1 29 29 GLN N N 29 117.930 117.930 118.468 -0.538 18952
406 1 5 . 1 1 29 29 GLN H H 29 8.130 8.130 7.767 0.363 18952
407 1 5 . 1 1 30 30 ASN N N 30 117.040 117.040 118.197 -1.157 18952
408 1 5 . 1 1 30 30 ASN H H 30 8.100 8.100 7.324 0.776 18952
409 1 5 . 1 1 31 31 LEU N N 31 121.200 121.200 121.472 -0.272 18952
410 1 5 . 1 1 31 31 LEU H H 31 8.060 8.060 7.238 0.822 18952
411 1 5 . 1 1 32 32 PHE N N 32 118.310 118.310 118.078 0.232 18952
412 1 5 . 1 1 32 32 PHE H H 32 8.450 8.450 7.224 1.226 18952
413 1 5 . 1 1 33 33 ILE N N 33 119.700 119.700 119.880 -0.180 18952
414 1 5 . 1 1 33 33 ILE H H 33 8.420 8.420 8.681 -0.261 18952
415 1 5 . 1 1 34 34 ASN N N 34 117.580 117.580 118.293 -0.713 18952
416 1 5 . 1 1 34 34 ASN H H 34 8.030 8.030 8.378 -0.348 18952
417 1 5 . 1 1 35 35 PHE N N 35 119.400 119.400 121.384 -1.984 18952
418 1 5 . 1 1 35 35 PHE H H 35 8.570 8.570 8.280 0.290 18952
419 1 5 . 1 1 36 36 CYS N N 36 116.680 116.680 117.858 -1.178 18952
420 1 5 . 1 1 36 36 CYS H H 36 8.160 8.160 8.039 0.121 18952
421 1 5 . 1 1 37 37 LEU N N 37 118.190 118.190 121.492 -3.302 18952
422 1 5 . 1 1 37 37 LEU H H 37 8.170 8.170 7.773 0.397 18952
423 1 5 . 1 1 38 38 ILE N N 38 119.700 119.700 119.029 0.671 18952
424 1 5 . 1 1 38 38 ILE H H 38 8.390 8.390 8.229 0.161 18952
425 1 5 . 1 1 39 39 LEU N N 39 119.400 119.400 119.088 0.312 18952
426 1 5 . 1 1 39 39 LEU H H 39 7.990 7.990 7.656 0.334 18952
427 1 5 . 1 1 40 40 ILE N N 40 119.250 119.250 118.915 0.335 18952
428 1 5 . 1 1 40 40 ILE H H 40 8.140 8.140 8.209 -0.069 18952
429 1 5 . 1 1 41 41 CYS N N 41 117.800 117.800 118.584 -0.784 18952
430 1 5 . 1 1 41 41 CYS H H 41 7.980 7.980 8.082 -0.102 18952
431 1 5 . 1 1 42 42 LEU N N 42 117.900 117.900 119.922 -2.022 18952
432 1 5 . 1 1 42 42 LEU H H 42 8.290 8.290 8.025 0.265 18952
433 1 5 . 1 1 43 43 LEU N N 43 119.700 119.700 120.277 -0.577 18952
434 1 5 . 1 1 43 43 LEU H H 43 8.390 8.390 8.046 0.344 18952
435 1 5 . 1 1 44 44 LEU N N 44 117.800 117.800 120.498 -2.698 18952
436 1 5 . 1 1 44 44 LEU H H 44 8.180 8.180 8.346 -0.166 18952
437 1 5 . 1 1 45 45 ILE N N 45 117.690 117.690 120.189 -2.499 18952
438 1 5 . 1 1 45 45 ILE H H 45 8.170 8.170 7.660 0.510 18952
439 1 5 . 1 1 46 46 CYS N N 46 117.020 117.020 118.489 -1.469 18952
440 1 5 . 1 1 46 46 CYS H H 46 8.150 8.150 7.745 0.405 18952
441 1 5 . 1 1 47 47 ILE N N 47 117.300 117.300 121.204 -3.904 18952
442 1 5 . 1 1 47 47 ILE H H 47 8.230 8.230 7.853 0.377 18952
443 1 5 . 1 1 48 48 ILE N N 48 117.690 117.690 120.583 -2.893 18952
444 1 5 . 1 1 48 48 ILE H H 48 8.200 8.200 8.137 0.063 18952
445 1 5 . 1 1 49 49 VAL N N 49 115.700 115.700 120.314 -4.614 18952
446 1 5 . 1 1 49 49 VAL H H 49 8.340 8.340 8.390 -0.050 18952
447 1 5 . 1 1 50 50 MET N N 50 115.500 115.500 118.119 -2.619 18952
448 1 5 . 1 1 50 50 MET H H 50 7.920 7.920 8.094 -0.174 18952
449 1 5 . 1 1 51 51 LEU N N 51 118.100 118.100 118.252 -0.152 18952
450 1 5 . 1 1 51 51 LEU H H 51 7.880 7.880 7.843 0.037 18952
451 1 6 . 1 1 2 2 GLU N N 2 121.800 121.800 122.735 -0.935 18952
452 1 6 . 1 1 2 2 GLU H H 2 9.240 9.240 8.924 0.316 18952
453 1 6 . 1 1 3 3 LYS N N 3 120.200 120.200 119.853 0.347 18952
454 1 6 . 1 1 3 3 LYS H H 3 8.270 8.270 8.370 -0.100 18952
455 1 6 . 1 1 4 4 VAL N N 4 117.600 117.600 120.369 -2.769 18952
456 1 6 . 1 1 4 4 VAL H H 4 7.750 7.750 7.882 -0.132 18952
457 1 6 . 1 1 5 5 GLN N N 5 120.800 120.800 119.253 1.547 18952
458 1 6 . 1 1 5 5 GLN H H 5 8.190 8.190 8.544 -0.354 18952
459 1 6 . 1 1 6 6 TYR N N 6 119.300 119.300 122.272 -2.972 18952
460 1 6 . 1 1 6 6 TYR H H 6 8.020 8.020 8.422 -0.402 18952
461 1 6 . 1 1 7 7 LEU N N 7 120.400 120.400 119.852 0.548 18952
462 1 6 . 1 1 7 7 LEU H H 7 8.110 8.110 8.478 -0.368 18952
463 1 6 . 1 1 8 8 THR N N 8 111.200 111.200 115.983 -4.783 18952
464 1 6 . 1 1 8 8 THR H H 8 7.890 7.890 8.336 -0.446 18952
465 1 6 . 1 1 9 9 ARG N N 9 120.700 120.700 121.609 -0.909 18952
466 1 6 . 1 1 9 9 ARG H H 9 8.220 8.220 8.238 -0.018 18952
467 1 6 . 1 1 10 10 SER N N 10 114.500 114.500 115.207 -0.707 18952
468 1 6 . 1 1 10 10 SER H H 10 7.990 7.990 8.153 -0.163 18952
469 1 6 . 1 1 11 11 ALA N N 11 124.000 124.000 124.868 -0.868 18952
470 1 6 . 1 1 11 11 ALA H H 11 8.060 8.060 8.069 -0.009 18952
471 1 6 . 1 1 12 12 ILE N N 12 115.900 115.900 118.485 -2.585 18952
472 1 6 . 1 1 12 12 ILE H H 12 7.780 7.780 7.959 -0.179 18952
473 1 6 . 1 1 13 13 ARG N N 13 121.100 121.100 118.901 2.199 18952
474 1 6 . 1 1 13 13 ARG H H 13 7.910 7.910 8.024 -0.114 18952
475 1 6 . 1 1 14 14 ARG N N 14 120.270 120.270 119.673 0.597 18952
476 1 6 . 1 1 14 14 ARG H H 14 8.060 8.060 8.139 -0.079 18952
477 1 6 . 1 1 18 18 ILE N N 18 122.100 122.100 126.289 -4.189 18952
478 1 6 . 1 1 18 18 ILE H H 18 7.720 7.720 8.145 -0.425 18952
479 1 6 . 1 1 19 19 GLU N N 19 124.800 124.800 126.559 -1.759 18952
480 1 6 . 1 1 19 19 GLU H H 19 8.250 8.250 8.383 -0.133 18952
481 1 6 . 1 1 20 20 MET N N 20 122.700 122.700 118.125 4.575 18952
482 1 6 . 1 1 20 20 MET H H 20 8.480 8.480 8.442 0.038 18952
483 1 6 . 1 1 22 22 GLN N N 22 121.600 121.600 117.089 4.511 18952
484 1 6 . 1 1 22 22 GLN H H 22 8.710 8.710 7.782 0.928 18952
485 1 6 . 1 1 23 23 GLN N N 23 119.000 119.000 118.970 0.030 18952
486 1 6 . 1 1 23 23 GLN H H 23 8.620 8.620 8.382 0.238 18952
487 1 6 . 1 1 24 24 ALA N N 24 122.400 122.400 121.733 0.667 18952
488 1 6 . 1 1 24 24 ALA H H 24 7.840 7.840 7.800 0.040 18952
489 1 6 . 1 1 26 26 GLN N N 26 118.340 118.340 119.276 -0.936 18952
490 1 6 . 1 1 26 26 GLN H H 26 8.780 8.780 8.534 0.246 18952
491 1 6 . 1 1 27 27 ASN N N 27 117.920 117.920 118.844 -0.924 18952
492 1 6 . 1 1 27 27 ASN H H 27 8.000 8.000 8.094 -0.094 18952
493 1 6 . 1 1 28 28 LEU N N 28 121.400 121.400 119.968 1.432 18952
494 1 6 . 1 1 28 28 LEU H H 28 8.210 8.210 8.618 -0.408 18952
495 1 6 . 1 1 29 29 GLN N N 29 117.930 117.930 118.499 -0.569 18952
496 1 6 . 1 1 29 29 GLN H H 29 8.130 8.130 7.574 0.556 18952
497 1 6 . 1 1 30 30 ASN N N 30 117.040 117.040 119.264 -2.224 18952
498 1 6 . 1 1 30 30 ASN H H 30 8.100 8.100 7.926 0.174 18952
499 1 6 . 1 1 31 31 LEU N N 31 121.200 121.200 120.795 0.405 18952
500 1 6 . 1 1 31 31 LEU H H 31 8.060 8.060 7.705 0.355 18952
501 1 6 . 1 1 32 32 PHE N N 32 118.310 118.310 118.325 -0.015 18952
502 1 6 . 1 1 32 32 PHE H H 32 8.450 8.450 7.774 0.676 18952
503 1 6 . 1 1 33 33 ILE N N 33 119.700 119.700 119.587 0.113 18952
504 1 6 . 1 1 33 33 ILE H H 33 8.420 8.420 8.749 -0.329 18952
505 1 6 . 1 1 34 34 ASN N N 34 117.580 117.580 117.884 -0.304 18952
506 1 6 . 1 1 34 34 ASN H H 34 8.030 8.030 8.024 0.006 18952
507 1 6 . 1 1 35 35 PHE N N 35 119.400 119.400 121.993 -2.593 18952
508 1 6 . 1 1 35 35 PHE H H 35 8.570 8.570 7.762 0.808 18952
509 1 6 . 1 1 36 36 CYS N N 36 116.680 116.680 118.661 -1.981 18952
510 1 6 . 1 1 36 36 CYS H H 36 8.160 8.160 7.916 0.244 18952
511 1 6 . 1 1 37 37 LEU N N 37 118.190 118.190 121.312 -3.122 18952
512 1 6 . 1 1 37 37 LEU H H 37 8.170 8.170 8.439 -0.269 18952
513 1 6 . 1 1 38 38 ILE N N 38 119.700 119.700 119.726 -0.026 18952
514 1 6 . 1 1 38 38 ILE H H 38 8.390 8.390 8.440 -0.050 18952
515 1 6 . 1 1 39 39 LEU N N 39 119.400 119.400 120.048 -0.648 18952
516 1 6 . 1 1 39 39 LEU H H 39 7.990 7.990 7.838 0.152 18952
517 1 6 . 1 1 40 40 ILE N N 40 119.250 119.250 119.524 -0.274 18952
518 1 6 . 1 1 40 40 ILE H H 40 8.140 8.140 7.764 0.376 18952
519 1 6 . 1 1 41 41 CYS N N 41 117.800 117.800 118.777 -0.977 18952
520 1 6 . 1 1 41 41 CYS H H 41 7.980 7.980 8.465 -0.485 18952
521 1 6 . 1 1 42 42 LEU N N 42 117.900 117.900 119.682 -1.782 18952
522 1 6 . 1 1 42 42 LEU H H 42 8.290 8.290 8.190 0.100 18952
523 1 6 . 1 1 43 43 LEU N N 43 119.700 119.700 120.187 -0.487 18952
524 1 6 . 1 1 43 43 LEU H H 43 8.390 8.390 7.840 0.550 18952
525 1 6 . 1 1 44 44 LEU N N 44 117.800 117.800 120.438 -2.638 18952
526 1 6 . 1 1 44 44 LEU H H 44 8.180 8.180 8.228 -0.048 18952
527 1 6 . 1 1 45 45 ILE N N 45 117.690 117.690 119.887 -2.197 18952
528 1 6 . 1 1 45 45 ILE H H 45 8.170 8.170 7.656 0.514 18952
529 1 6 . 1 1 46 46 CYS N N 46 117.020 117.020 118.452 -1.432 18952
530 1 6 . 1 1 46 46 CYS H H 46 8.150 8.150 7.723 0.427 18952
531 1 6 . 1 1 47 47 ILE N N 47 117.300 117.300 121.431 -4.131 18952
532 1 6 . 1 1 47 47 ILE H H 47 8.230 8.230 8.061 0.169 18952
533 1 6 . 1 1 48 48 ILE N N 48 117.690 117.690 120.135 -2.445 18952
534 1 6 . 1 1 48 48 ILE H H 48 8.200 8.200 7.890 0.310 18952
535 1 6 . 1 1 49 49 VAL N N 49 115.700 115.700 120.488 -4.788 18952
536 1 6 . 1 1 49 49 VAL H H 49 8.340 8.340 8.025 0.315 18952
537 1 6 . 1 1 50 50 MET N N 50 115.500 115.500 117.751 -2.251 18952
538 1 6 . 1 1 50 50 MET H H 50 7.920 7.920 8.137 -0.217 18952
539 1 6 . 1 1 51 51 LEU N N 51 118.100 118.100 119.694 -1.594 18952
540 1 6 . 1 1 51 51 LEU H H 51 7.880 7.880 7.871 0.009 18952
541 1 7 . 1 1 2 2 GLU N N 2 121.800 121.800 122.791 -0.991 18952
542 1 7 . 1 1 2 2 GLU H H 2 9.240 9.240 8.916 0.324 18952
543 1 7 . 1 1 3 3 LYS N N 3 120.200 120.200 119.197 1.003 18952
544 1 7 . 1 1 3 3 LYS H H 3 8.270 8.270 8.366 -0.096 18952
545 1 7 . 1 1 4 4 VAL N N 4 117.600 117.600 120.439 -2.839 18952
546 1 7 . 1 1 4 4 VAL H H 4 7.750 7.750 7.889 -0.139 18952
547 1 7 . 1 1 5 5 GLN N N 5 120.800 120.800 119.161 1.639 18952
548 1 7 . 1 1 5 5 GLN H H 5 8.190 8.190 8.547 -0.357 18952
549 1 7 . 1 1 6 6 TYR N N 6 119.300 119.300 122.582 -3.282 18952
550 1 7 . 1 1 6 6 TYR H H 6 8.020 8.020 8.397 -0.377 18952
551 1 7 . 1 1 7 7 LEU N N 7 120.400 120.400 119.706 0.694 18952
552 1 7 . 1 1 7 7 LEU H H 7 8.110 8.110 8.415 -0.305 18952
553 1 7 . 1 1 8 8 THR N N 8 111.200 111.200 115.991 -4.791 18952
554 1 7 . 1 1 8 8 THR H H 8 7.890 7.890 8.190 -0.300 18952
555 1 7 . 1 1 9 9 ARG N N 9 120.700 120.700 121.656 -0.956 18952
556 1 7 . 1 1 9 9 ARG H H 9 8.220 8.220 8.325 -0.105 18952
557 1 7 . 1 1 10 10 SER N N 10 114.500 114.500 115.194 -0.694 18952
558 1 7 . 1 1 10 10 SER H H 10 7.990 7.990 8.170 -0.180 18952
559 1 7 . 1 1 11 11 ALA N N 11 124.000 124.000 124.790 -0.790 18952
560 1 7 . 1 1 11 11 ALA H H 11 8.060 8.060 8.009 0.051 18952
561 1 7 . 1 1 12 12 ILE N N 12 115.900 115.900 118.488 -2.588 18952
562 1 7 . 1 1 12 12 ILE H H 12 7.780 7.780 7.928 -0.148 18952
563 1 7 . 1 1 13 13 ARG N N 13 121.100 121.100 118.562 2.538 18952
564 1 7 . 1 1 13 13 ARG H H 13 7.910 7.910 8.021 -0.111 18952
565 1 7 . 1 1 14 14 ARG N N 14 120.270 120.270 118.604 1.666 18952
566 1 7 . 1 1 14 14 ARG H H 14 8.060 8.060 7.942 0.118 18952
567 1 7 . 1 1 18 18 ILE N N 18 122.100 122.100 124.590 -2.490 18952
568 1 7 . 1 1 18 18 ILE H H 18 7.720 7.720 8.267 -0.547 18952
569 1 7 . 1 1 19 19 GLU N N 19 124.800 124.800 127.845 -3.045 18952
570 1 7 . 1 1 19 19 GLU H H 19 8.250 8.250 8.852 -0.602 18952
571 1 7 . 1 1 20 20 MET N N 20 122.700 122.700 120.088 2.612 18952
572 1 7 . 1 1 20 20 MET H H 20 8.480 8.480 7.703 0.777 18952
573 1 7 . 1 1 22 22 GLN N N 22 121.600 121.600 122.484 -0.884 18952
574 1 7 . 1 1 22 22 GLN H H 22 8.710 8.710 8.826 -0.116 18952
575 1 7 . 1 1 23 23 GLN N N 23 119.000 119.000 118.329 0.671 18952
576 1 7 . 1 1 23 23 GLN H H 23 8.620 8.620 8.805 -0.185 18952
577 1 7 . 1 1 24 24 ALA N N 24 122.400 122.400 123.299 -0.899 18952
578 1 7 . 1 1 24 24 ALA H H 24 7.840 7.840 8.207 -0.367 18952
579 1 7 . 1 1 26 26 GLN N N 26 118.340 118.340 117.096 1.244 18952
580 1 7 . 1 1 26 26 GLN H H 26 8.780 8.780 8.457 0.323 18952
581 1 7 . 1 1 27 27 ASN N N 27 117.920 117.920 118.529 -0.609 18952
582 1 7 . 1 1 27 27 ASN H H 27 8.000 8.000 7.813 0.187 18952
583 1 7 . 1 1 28 28 LEU N N 28 121.400 121.400 121.039 0.361 18952
584 1 7 . 1 1 28 28 LEU H H 28 8.210 8.210 7.867 0.343 18952
585 1 7 . 1 1 29 29 GLN N N 29 117.930 117.930 117.353 0.577 18952
586 1 7 . 1 1 29 29 GLN H H 29 8.130 8.130 7.559 0.571 18952
587 1 7 . 1 1 30 30 ASN N N 30 117.040 117.040 119.673 -2.633 18952
588 1 7 . 1 1 30 30 ASN H H 30 8.100 8.100 7.979 0.121 18952
589 1 7 . 1 1 31 31 LEU N N 31 121.200 121.200 121.183 0.017 18952
590 1 7 . 1 1 31 31 LEU H H 31 8.060 8.060 7.747 0.313 18952
591 1 7 . 1 1 32 32 PHE N N 32 118.310 118.310 118.391 -0.081 18952
592 1 7 . 1 1 32 32 PHE H H 32 8.450 8.450 7.301 1.149 18952
593 1 7 . 1 1 33 33 ILE N N 33 119.700 119.700 119.961 -0.261 18952
594 1 7 . 1 1 33 33 ILE H H 33 8.420 8.420 8.856 -0.436 18952
595 1 7 . 1 1 34 34 ASN N N 34 117.580 117.580 118.278 -0.698 18952
596 1 7 . 1 1 34 34 ASN H H 34 8.030 8.030 7.865 0.165 18952
597 1 7 . 1 1 35 35 PHE N N 35 119.400 119.400 122.002 -2.602 18952
598 1 7 . 1 1 35 35 PHE H H 35 8.570 8.570 8.771 -0.201 18952
599 1 7 . 1 1 36 36 CYS N N 36 116.680 116.680 118.211 -1.531 18952
600 1 7 . 1 1 36 36 CYS H H 36 8.160 8.160 8.477 -0.317 18952
601 1 7 . 1 1 37 37 LEU N N 37 118.190 118.190 121.274 -3.084 18952
602 1 7 . 1 1 37 37 LEU H H 37 8.170 8.170 7.840 0.330 18952
603 1 7 . 1 1 38 38 ILE N N 38 119.700 119.700 120.044 -0.344 18952
604 1 7 . 1 1 38 38 ILE H H 38 8.390 8.390 8.595 -0.205 18952
605 1 7 . 1 1 39 39 LEU N N 39 119.400 119.400 120.114 -0.714 18952
606 1 7 . 1 1 39 39 LEU H H 39 7.990 7.990 8.073 -0.083 18952
607 1 7 . 1 1 40 40 ILE N N 40 119.250 119.250 119.512 -0.262 18952
608 1 7 . 1 1 40 40 ILE H H 40 8.140 8.140 7.666 0.474 18952
609 1 7 . 1 1 41 41 CYS N N 41 117.800 117.800 119.447 -1.647 18952
610 1 7 . 1 1 41 41 CYS H H 41 7.980 7.980 8.483 -0.503 18952
611 1 7 . 1 1 42 42 LEU N N 42 117.900 117.900 119.929 -2.029 18952
612 1 7 . 1 1 42 42 LEU H H 42 8.290 8.290 8.425 -0.135 18952
613 1 7 . 1 1 43 43 LEU N N 43 119.700 119.700 120.631 -0.931 18952
614 1 7 . 1 1 43 43 LEU H H 43 8.390 8.390 7.945 0.445 18952
615 1 7 . 1 1 44 44 LEU N N 44 117.800 117.800 120.000 -2.200 18952
616 1 7 . 1 1 44 44 LEU H H 44 8.180 8.180 8.558 -0.378 18952
617 1 7 . 1 1 45 45 ILE N N 45 117.690 117.690 119.398 -1.708 18952
618 1 7 . 1 1 45 45 ILE H H 45 8.170 8.170 7.923 0.247 18952
619 1 7 . 1 1 46 46 CYS N N 46 117.020 117.020 118.707 -1.687 18952
620 1 7 . 1 1 46 46 CYS H H 46 8.150 8.150 7.725 0.425 18952
621 1 7 . 1 1 47 47 ILE N N 47 117.300 117.300 121.398 -4.098 18952
622 1 7 . 1 1 47 47 ILE H H 47 8.230 8.230 8.463 -0.233 18952
623 1 7 . 1 1 48 48 ILE N N 48 117.690 117.690 120.342 -2.652 18952
624 1 7 . 1 1 48 48 ILE H H 48 8.200 8.200 8.185 0.015 18952
625 1 7 . 1 1 49 49 VAL N N 49 115.700 115.700 121.050 -5.350 18952
626 1 7 . 1 1 49 49 VAL H H 49 8.340 8.340 8.141 0.199 18952
627 1 7 . 1 1 50 50 MET N N 50 115.500 115.500 117.659 -2.159 18952
628 1 7 . 1 1 50 50 MET H H 50 7.920 7.920 8.120 -0.200 18952
629 1 7 . 1 1 51 51 LEU N N 51 118.100 118.100 120.116 -2.016 18952
630 1 7 . 1 1 51 51 LEU H H 51 7.880 7.880 7.822 0.058 18952
631 1 8 . 1 1 2 2 GLU N N 2 121.800 121.800 121.250 0.550 18952
632 1 8 . 1 1 2 2 GLU H H 2 9.240 9.240 8.734 0.506 18952
633 1 8 . 1 1 3 3 LYS N N 3 120.200 120.200 119.992 0.208 18952
634 1 8 . 1 1 3 3 LYS H H 3 8.270 8.270 8.366 -0.096 18952
635 1 8 . 1 1 4 4 VAL N N 4 117.600 117.600 120.419 -2.819 18952
636 1 8 . 1 1 4 4 VAL H H 4 7.750 7.750 7.900 -0.150 18952
637 1 8 . 1 1 5 5 GLN N N 5 120.800 120.800 119.206 1.594 18952
638 1 8 . 1 1 5 5 GLN H H 5 8.190 8.190 8.480 -0.290 18952
639 1 8 . 1 1 6 6 TYR N N 6 119.300 119.300 122.324 -3.024 18952
640 1 8 . 1 1 6 6 TYR H H 6 8.020 8.020 8.437 -0.417 18952
641 1 8 . 1 1 7 7 LEU N N 7 120.400 120.400 119.808 0.592 18952
642 1 8 . 1 1 7 7 LEU H H 7 8.110 8.110 8.488 -0.378 18952
643 1 8 . 1 1 8 8 THR N N 8 111.200 111.200 116.080 -4.880 18952
644 1 8 . 1 1 8 8 THR H H 8 7.890 7.890 8.339 -0.449 18952
645 1 8 . 1 1 9 9 ARG N N 9 120.700 120.700 121.705 -1.005 18952
646 1 8 . 1 1 9 9 ARG H H 9 8.220 8.220 8.297 -0.077 18952
647 1 8 . 1 1 10 10 SER N N 10 114.500 114.500 115.420 -0.920 18952
648 1 8 . 1 1 10 10 SER H H 10 7.990 7.990 8.189 -0.199 18952
649 1 8 . 1 1 11 11 ALA N N 11 124.000 124.000 124.915 -0.915 18952
650 1 8 . 1 1 11 11 ALA H H 11 8.060 8.060 8.085 -0.025 18952
651 1 8 . 1 1 12 12 ILE N N 12 115.900 115.900 118.448 -2.548 18952
652 1 8 . 1 1 12 12 ILE H H 12 7.780 7.780 7.928 -0.148 18952
653 1 8 . 1 1 13 13 ARG N N 13 121.100 121.100 118.925 2.175 18952
654 1 8 . 1 1 13 13 ARG H H 13 7.910 7.910 8.046 -0.136 18952
655 1 8 . 1 1 14 14 ARG N N 14 120.270 120.270 117.844 2.426 18952
656 1 8 . 1 1 14 14 ARG H H 14 8.060 8.060 7.817 0.243 18952
657 1 8 . 1 1 18 18 ILE N N 18 122.100 122.100 119.580 2.520 18952
658 1 8 . 1 1 18 18 ILE H H 18 7.720 7.720 7.894 -0.174 18952
659 1 8 . 1 1 19 19 GLU N N 19 124.800 124.800 127.458 -2.658 18952
660 1 8 . 1 1 19 19 GLU H H 19 8.250 8.250 8.297 -0.047 18952
661 1 8 . 1 1 20 20 MET N N 20 122.700 122.700 123.468 -0.768 18952
662 1 8 . 1 1 20 20 MET H H 20 8.480 8.480 8.685 -0.205 18952
663 1 8 . 1 1 22 22 GLN N N 22 121.600 121.600 116.552 5.048 18952
664 1 8 . 1 1 22 22 GLN H H 22 8.710 8.710 8.300 0.410 18952
665 1 8 . 1 1 23 23 GLN N N 23 119.000 119.000 119.843 -0.843 18952
666 1 8 . 1 1 23 23 GLN H H 23 8.620 8.620 8.445 0.175 18952
667 1 8 . 1 1 24 24 ALA N N 24 122.400 122.400 120.609 1.791 18952
668 1 8 . 1 1 24 24 ALA H H 24 7.840 7.840 7.815 0.025 18952
669 1 8 . 1 1 26 26 GLN N N 26 118.340 118.340 125.031 -6.691 18952
670 1 8 . 1 1 26 26 GLN H H 26 8.780 8.780 8.954 -0.174 18952
671 1 8 . 1 1 27 27 ASN N N 27 117.920 117.920 117.081 0.839 18952
672 1 8 . 1 1 27 27 ASN H H 27 8.000 8.000 8.483 -0.483 18952
673 1 8 . 1 1 28 28 LEU N N 28 121.400 121.400 121.048 0.352 18952
674 1 8 . 1 1 28 28 LEU H H 28 8.210 8.210 7.905 0.305 18952
675 1 8 . 1 1 29 29 GLN N N 29 117.930 117.930 118.651 -0.721 18952
676 1 8 . 1 1 29 29 GLN H H 29 8.130 8.130 7.736 0.394 18952
677 1 8 . 1 1 30 30 ASN N N 30 117.040 117.040 118.239 -1.199 18952
678 1 8 . 1 1 30 30 ASN H H 30 8.100 8.100 7.849 0.251 18952
679 1 8 . 1 1 31 31 LEU N N 31 121.200 121.200 121.248 -0.048 18952
680 1 8 . 1 1 31 31 LEU H H 31 8.060 8.060 7.127 0.933 18952
681 1 8 . 1 1 32 32 PHE N N 32 118.310 118.310 118.130 0.180 18952
682 1 8 . 1 1 32 32 PHE H H 32 8.450 8.450 7.145 1.305 18952
683 1 8 . 1 1 33 33 ILE N N 33 119.700 119.700 119.715 -0.015 18952
684 1 8 . 1 1 33 33 ILE H H 33 8.420 8.420 8.737 -0.317 18952
685 1 8 . 1 1 34 34 ASN N N 34 117.580 117.580 118.451 -0.871 18952
686 1 8 . 1 1 34 34 ASN H H 34 8.030 8.030 8.336 -0.306 18952
687 1 8 . 1 1 35 35 PHE N N 35 119.400 119.400 122.110 -2.710 18952
688 1 8 . 1 1 35 35 PHE H H 35 8.570 8.570 8.246 0.324 18952
689 1 8 . 1 1 36 36 CYS N N 36 116.680 116.680 118.240 -1.560 18952
690 1 8 . 1 1 36 36 CYS H H 36 8.160 8.160 7.953 0.207 18952
691 1 8 . 1 1 37 37 LEU N N 37 118.190 118.190 121.269 -3.079 18952
692 1 8 . 1 1 37 37 LEU H H 37 8.170 8.170 7.753 0.417 18952
693 1 8 . 1 1 38 38 ILE N N 38 119.700 119.700 120.063 -0.363 18952
694 1 8 . 1 1 38 38 ILE H H 38 8.390 8.390 8.602 -0.212 18952
695 1 8 . 1 1 39 39 LEU N N 39 119.400 119.400 120.210 -0.810 18952
696 1 8 . 1 1 39 39 LEU H H 39 7.990 7.990 7.940 0.050 18952
697 1 8 . 1 1 40 40 ILE N N 40 119.250 119.250 119.579 -0.329 18952
698 1 8 . 1 1 40 40 ILE H H 40 8.140 8.140 7.715 0.425 18952
699 1 8 . 1 1 41 41 CYS N N 41 117.800 117.800 119.646 -1.846 18952
700 1 8 . 1 1 41 41 CYS H H 41 7.980 7.980 8.503 -0.523 18952
701 1 8 . 1 1 42 42 LEU N N 42 117.900 117.900 119.948 -2.048 18952
702 1 8 . 1 1 42 42 LEU H H 42 8.290 8.290 8.548 -0.258 18952
703 1 8 . 1 1 43 43 LEU N N 43 119.700 119.700 120.504 -0.804 18952
704 1 8 . 1 1 43 43 LEU H H 43 8.390 8.390 8.035 0.355 18952
705 1 8 . 1 1 44 44 LEU N N 44 117.800 117.800 120.269 -2.469 18952
706 1 8 . 1 1 44 44 LEU H H 44 8.180 8.180 8.556 -0.376 18952
707 1 8 . 1 1 45 45 ILE N N 45 117.690 117.690 119.416 -1.726 18952
708 1 8 . 1 1 45 45 ILE H H 45 8.170 8.170 8.099 0.071 18952
709 1 8 . 1 1 46 46 CYS N N 46 117.020 117.020 118.604 -1.584 18952
710 1 8 . 1 1 46 46 CYS H H 46 8.150 8.150 7.477 0.673 18952
711 1 8 . 1 1 47 47 ILE N N 47 117.300 117.300 121.588 -4.288 18952
712 1 8 . 1 1 47 47 ILE H H 47 8.230 8.230 8.387 -0.157 18952
713 1 8 . 1 1 48 48 ILE N N 48 117.690 117.690 120.454 -2.764 18952
714 1 8 . 1 1 48 48 ILE H H 48 8.200 8.200 8.395 -0.195 18952
715 1 8 . 1 1 49 49 VAL N N 49 115.700 115.700 120.404 -4.704 18952
716 1 8 . 1 1 49 49 VAL H H 49 8.340 8.340 8.088 0.252 18952
717 1 8 . 1 1 50 50 MET N N 50 115.500 115.500 118.165 -2.665 18952
718 1 8 . 1 1 50 50 MET H H 50 7.920 7.920 8.140 -0.220 18952
719 1 8 . 1 1 51 51 LEU N N 51 118.100 118.100 119.340 -1.240 18952
720 1 8 . 1 1 51 51 LEU H H 51 7.880 7.880 7.991 -0.111 18952
721 1 9 . 1 1 2 2 GLU N N 2 121.800 121.800 122.728 -0.928 18952
722 1 9 . 1 1 2 2 GLU H H 2 9.240 9.240 8.921 0.319 18952
723 1 9 . 1 1 3 3 LYS N N 3 120.200 120.200 119.947 0.253 18952
724 1 9 . 1 1 3 3 LYS H H 3 8.270 8.270 8.367 -0.097 18952
725 1 9 . 1 1 4 4 VAL N N 4 117.600 117.600 120.533 -2.933 18952
726 1 9 . 1 1 4 4 VAL H H 4 7.750 7.750 7.884 -0.134 18952
727 1 9 . 1 1 5 5 GLN N N 5 120.800 120.800 118.857 1.943 18952
728 1 9 . 1 1 5 5 GLN H H 5 8.190 8.190 8.547 -0.357 18952
729 1 9 . 1 1 6 6 TYR N N 6 119.300 119.300 122.237 -2.937 18952
730 1 9 . 1 1 6 6 TYR H H 6 8.020 8.020 8.393 -0.373 18952
731 1 9 . 1 1 7 7 LEU N N 7 120.400 120.400 119.878 0.522 18952
732 1 9 . 1 1 7 7 LEU H H 7 8.110 8.110 8.548 -0.438 18952
733 1 9 . 1 1 8 8 THR N N 8 111.200 111.200 115.998 -4.798 18952
734 1 9 . 1 1 8 8 THR H H 8 7.890 7.890 8.373 -0.483 18952
735 1 9 . 1 1 9 9 ARG N N 9 120.700 120.700 121.643 -0.943 18952
736 1 9 . 1 1 9 9 ARG H H 9 8.220 8.220 8.167 0.053 18952
737 1 9 . 1 1 10 10 SER N N 10 114.500 114.500 115.460 -0.960 18952
738 1 9 . 1 1 10 10 SER H H 10 7.990 7.990 8.172 -0.182 18952
739 1 9 . 1 1 11 11 ALA N N 11 124.000 124.000 124.959 -0.959 18952
740 1 9 . 1 1 11 11 ALA H H 11 8.060 8.060 8.150 -0.090 18952
741 1 9 . 1 1 12 12 ILE N N 12 115.900 115.900 118.788 -2.888 18952
742 1 9 . 1 1 12 12 ILE H H 12 7.780 7.780 7.952 -0.172 18952
743 1 9 . 1 1 13 13 ARG N N 13 121.100 121.100 120.010 1.090 18952
744 1 9 . 1 1 13 13 ARG H H 13 7.910 7.910 8.021 -0.111 18952
745 1 9 . 1 1 14 14 ARG N N 14 120.270 120.270 118.044 2.226 18952
746 1 9 . 1 1 14 14 ARG H H 14 8.060 8.060 7.927 0.133 18952
747 1 9 . 1 1 18 18 ILE N N 18 122.100 122.100 123.103 -1.003 18952
748 1 9 . 1 1 18 18 ILE H H 18 7.720 7.720 7.854 -0.134 18952
749 1 9 . 1 1 19 19 GLU N N 19 124.800 124.800 126.589 -1.789 18952
750 1 9 . 1 1 19 19 GLU H H 19 8.250 8.250 8.510 -0.260 18952
751 1 9 . 1 1 20 20 MET N N 20 122.700 122.700 121.061 1.639 18952
752 1 9 . 1 1 20 20 MET H H 20 8.480 8.480 8.425 0.055 18952
753 1 9 . 1 1 22 22 GLN N N 22 121.600 121.600 118.353 3.247 18952
754 1 9 . 1 1 22 22 GLN H H 22 8.710 8.710 8.518 0.192 18952
755 1 9 . 1 1 23 23 GLN N N 23 119.000 119.000 116.150 2.850 18952
756 1 9 . 1 1 23 23 GLN H H 23 8.620 8.620 8.227 0.393 18952
757 1 9 . 1 1 24 24 ALA N N 24 122.400 122.400 122.273 0.127 18952
758 1 9 . 1 1 24 24 ALA H H 24 7.840 7.840 7.764 0.076 18952
759 1 9 . 1 1 26 26 GLN N N 26 118.340 118.340 117.545 0.795 18952
760 1 9 . 1 1 26 26 GLN H H 26 8.780 8.780 8.243 0.537 18952
761 1 9 . 1 1 27 27 ASN N N 27 117.920 117.920 115.997 1.923 18952
762 1 9 . 1 1 27 27 ASN H H 27 8.000 8.000 8.542 -0.542 18952
763 1 9 . 1 1 28 28 LEU N N 28 121.400 121.400 119.735 1.665 18952
764 1 9 . 1 1 28 28 LEU H H 28 8.210 8.210 7.634 0.576 18952
765 1 9 . 1 1 29 29 GLN N N 29 117.930 117.930 118.335 -0.405 18952
766 1 9 . 1 1 29 29 GLN H H 29 8.130 8.130 7.779 0.351 18952
767 1 9 . 1 1 30 30 ASN N N 30 117.040 117.040 119.346 -2.306 18952
768 1 9 . 1 1 30 30 ASN H H 30 8.100 8.100 7.447 0.653 18952
769 1 9 . 1 1 31 31 LEU N N 31 121.200 121.200 121.234 -0.034 18952
770 1 9 . 1 1 31 31 LEU H H 31 8.060 8.060 8.034 0.026 18952
771 1 9 . 1 1 32 32 PHE N N 32 118.310 118.310 118.095 0.215 18952
772 1 9 . 1 1 32 32 PHE H H 32 8.450 8.450 7.231 1.219 18952
773 1 9 . 1 1 33 33 ILE N N 33 119.700 119.700 119.822 -0.122 18952
774 1 9 . 1 1 33 33 ILE H H 33 8.420 8.420 8.808 -0.388 18952
775 1 9 . 1 1 34 34 ASN N N 34 117.580 117.580 118.200 -0.620 18952
776 1 9 . 1 1 34 34 ASN H H 34 8.030 8.030 8.306 -0.276 18952
777 1 9 . 1 1 35 35 PHE N N 35 119.400 119.400 121.658 -2.258 18952
778 1 9 . 1 1 35 35 PHE H H 35 8.570 8.570 7.945 0.625 18952
779 1 9 . 1 1 36 36 CYS N N 36 116.680 116.680 118.175 -1.495 18952
780 1 9 . 1 1 36 36 CYS H H 36 8.160 8.160 7.881 0.279 18952
781 1 9 . 1 1 37 37 LEU N N 37 118.190 118.190 121.428 -3.238 18952
782 1 9 . 1 1 37 37 LEU H H 37 8.170 8.170 7.825 0.345 18952
783 1 9 . 1 1 38 38 ILE N N 38 119.700 119.700 119.803 -0.103 18952
784 1 9 . 1 1 38 38 ILE H H 38 8.390 8.390 8.508 -0.118 18952
785 1 9 . 1 1 39 39 LEU N N 39 119.400 119.400 120.089 -0.689 18952
786 1 9 . 1 1 39 39 LEU H H 39 7.990 7.990 7.884 0.106 18952
787 1 9 . 1 1 40 40 ILE N N 40 119.250 119.250 119.133 0.117 18952
788 1 9 . 1 1 40 40 ILE H H 40 8.140 8.140 7.882 0.258 18952
789 1 9 . 1 1 41 41 CYS N N 41 117.800 117.800 118.781 -0.981 18952
790 1 9 . 1 1 41 41 CYS H H 41 7.980 7.980 8.378 -0.398 18952
791 1 9 . 1 1 42 42 LEU N N 42 117.900 117.900 119.804 -1.904 18952
792 1 9 . 1 1 42 42 LEU H H 42 8.290 8.290 8.132 0.158 18952
793 1 9 . 1 1 43 43 LEU N N 43 119.700 119.700 120.276 -0.576 18952
794 1 9 . 1 1 43 43 LEU H H 43 8.390 8.390 7.904 0.486 18952
795 1 9 . 1 1 44 44 LEU N N 44 117.800 117.800 120.766 -2.966 18952
796 1 9 . 1 1 44 44 LEU H H 44 8.180 8.180 8.289 -0.109 18952
797 1 9 . 1 1 45 45 ILE N N 45 117.690 117.690 119.913 -2.223 18952
798 1 9 . 1 1 45 45 ILE H H 45 8.170 8.170 7.680 0.490 18952
799 1 9 . 1 1 46 46 CYS N N 46 117.020 117.020 118.463 -1.443 18952
800 1 9 . 1 1 46 46 CYS H H 46 8.150 8.150 7.658 0.492 18952
801 1 9 . 1 1 47 47 ILE N N 47 117.300 117.300 121.457 -4.157 18952
802 1 9 . 1 1 47 47 ILE H H 47 8.230 8.230 8.238 -0.008 18952
803 1 9 . 1 1 48 48 ILE N N 48 117.690 117.690 120.257 -2.567 18952
804 1 9 . 1 1 48 48 ILE H H 48 8.200 8.200 8.239 -0.039 18952
805 1 9 . 1 1 49 49 VAL N N 49 115.700 115.700 120.519 -4.819 18952
806 1 9 . 1 1 49 49 VAL H H 49 8.340 8.340 8.134 0.206 18952
807 1 9 . 1 1 50 50 MET N N 50 115.500 115.500 117.754 -2.254 18952
808 1 9 . 1 1 50 50 MET H H 50 7.920 7.920 8.121 -0.201 18952
809 1 9 . 1 1 51 51 LEU N N 51 118.100 118.100 119.716 -1.616 18952
810 1 9 . 1 1 51 51 LEU H H 51 7.880 7.880 7.892 -0.012 18952
811 1 10 . 1 1 2 2 GLU N N 2 121.800 121.800 121.245 0.555 18952
812 1 10 . 1 1 2 2 GLU H H 2 9.240 9.240 8.734 0.506 18952
813 1 10 . 1 1 3 3 LYS N N 3 120.200 120.200 119.980 0.220 18952
814 1 10 . 1 1 3 3 LYS H H 3 8.270 8.270 8.365 -0.095 18952
815 1 10 . 1 1 4 4 VAL N N 4 117.600 117.600 120.378 -2.778 18952
816 1 10 . 1 1 4 4 VAL H H 4 7.750 7.750 7.898 -0.148 18952
817 1 10 . 1 1 5 5 GLN N N 5 120.800 120.800 119.221 1.579 18952
818 1 10 . 1 1 5 5 GLN H H 5 8.190 8.190 8.549 -0.359 18952
819 1 10 . 1 1 6 6 TYR N N 6 119.300 119.300 122.329 -3.029 18952
820 1 10 . 1 1 6 6 TYR H H 6 8.020 8.020 8.429 -0.409 18952
821 1 10 . 1 1 7 7 LEU N N 7 120.400 120.400 119.827 0.573 18952
822 1 10 . 1 1 7 7 LEU H H 7 8.110 8.110 8.472 -0.362 18952
823 1 10 . 1 1 8 8 THR N N 8 111.200 111.200 116.055 -4.855 18952
824 1 10 . 1 1 8 8 THR H H 8 7.890 7.890 8.310 -0.420 18952
825 1 10 . 1 1 9 9 ARG N N 9 120.700 120.700 121.673 -0.973 18952
826 1 10 . 1 1 9 9 ARG H H 9 8.220 8.220 8.321 -0.101 18952
827 1 10 . 1 1 10 10 SER N N 10 114.500 114.500 115.485 -0.985 18952
828 1 10 . 1 1 10 10 SER H H 10 7.990 7.990 8.178 -0.188 18952
829 1 10 . 1 1 11 11 ALA N N 11 124.000 124.000 124.958 -0.958 18952
830 1 10 . 1 1 11 11 ALA H H 11 8.060 8.060 8.125 -0.065 18952
831 1 10 . 1 1 12 12 ILE N N 12 115.900 115.900 118.505 -2.605 18952
832 1 10 . 1 1 12 12 ILE H H 12 7.780 7.780 7.958 -0.178 18952
833 1 10 . 1 1 13 13 ARG N N 13 121.100 121.100 118.684 2.416 18952
834 1 10 . 1 1 13 13 ARG H H 13 7.910 7.910 8.163 -0.253 18952
835 1 10 . 1 1 14 14 ARG N N 14 120.270 120.270 118.279 1.991 18952
836 1 10 . 1 1 14 14 ARG H H 14 8.060 8.060 7.841 0.219 18952
837 1 10 . 1 1 18 18 ILE N N 18 122.100 122.100 122.791 -0.691 18952
838 1 10 . 1 1 18 18 ILE H H 18 7.720 7.720 7.782 -0.062 18952
839 1 10 . 1 1 19 19 GLU N N 19 124.800 124.800 126.644 -1.844 18952
840 1 10 . 1 1 19 19 GLU H H 19 8.250 8.250 8.275 -0.025 18952
841 1 10 . 1 1 20 20 MET N N 20 122.700 122.700 120.480 2.220 18952
842 1 10 . 1 1 20 20 MET H H 20 8.480 8.480 8.293 0.187 18952
843 1 10 . 1 1 22 22 GLN N N 22 121.600 121.600 122.056 -0.456 18952
844 1 10 . 1 1 22 22 GLN H H 22 8.710 8.710 8.610 0.100 18952
845 1 10 . 1 1 23 23 GLN N N 23 119.000 119.000 118.589 0.411 18952
846 1 10 . 1 1 23 23 GLN H H 23 8.620 8.620 7.827 0.793 18952
847 1 10 . 1 1 24 24 ALA N N 24 122.400 122.400 122.483 -0.083 18952
848 1 10 . 1 1 24 24 ALA H H 24 7.840 7.840 8.334 -0.494 18952
849 1 10 . 1 1 26 26 GLN N N 26 118.340 118.340 118.052 0.288 18952
850 1 10 . 1 1 26 26 GLN H H 26 8.780 8.780 8.706 0.074 18952
851 1 10 . 1 1 27 27 ASN N N 27 117.920 117.920 117.226 0.694 18952
852 1 10 . 1 1 27 27 ASN H H 27 8.000 8.000 8.327 -0.327 18952
853 1 10 . 1 1 28 28 LEU N N 28 121.400 121.400 120.676 0.724 18952
854 1 10 . 1 1 28 28 LEU H H 28 8.210 8.210 7.423 0.787 18952
855 1 10 . 1 1 29 29 GLN N N 29 117.930 117.930 119.000 -1.070 18952
856 1 10 . 1 1 29 29 GLN H H 29 8.130 8.130 8.132 -0.002 18952
857 1 10 . 1 1 30 30 ASN N N 30 117.040 117.040 118.566 -1.526 18952
858 1 10 . 1 1 30 30 ASN H H 30 8.100 8.100 8.300 -0.200 18952
859 1 10 . 1 1 31 31 LEU N N 31 121.200 121.200 121.894 -0.694 18952
860 1 10 . 1 1 31 31 LEU H H 31 8.060 8.060 7.893 0.167 18952
861 1 10 . 1 1 32 32 PHE N N 32 118.310 118.310 116.746 1.564 18952
862 1 10 . 1 1 32 32 PHE H H 32 8.450 8.450 7.863 0.587 18952
863 1 10 . 1 1 33 33 ILE N N 33 119.700 119.700 120.396 -0.696 18952
864 1 10 . 1 1 33 33 ILE H H 33 8.420 8.420 7.564 0.856 18952
865 1 10 . 1 1 34 34 ASN N N 34 117.580 117.580 118.605 -1.025 18952
866 1 10 . 1 1 34 34 ASN H H 34 8.030 8.030 7.589 0.441 18952
867 1 10 . 1 1 35 35 PHE N N 35 119.400 119.400 119.683 -0.283 18952
868 1 10 . 1 1 35 35 PHE H H 35 8.570 8.570 7.834 0.736 18952
869 1 10 . 1 1 36 36 CYS N N 36 116.680 116.680 118.844 -2.164 18952
870 1 10 . 1 1 36 36 CYS H H 36 8.160 8.160 8.309 -0.149 18952
871 1 10 . 1 1 37 37 LEU N N 37 118.190 118.190 121.549 -3.359 18952
872 1 10 . 1 1 37 37 LEU H H 37 8.170 8.170 8.365 -0.195 18952
873 1 10 . 1 1 38 38 ILE N N 38 119.700 119.700 119.714 -0.014 18952
874 1 10 . 1 1 38 38 ILE H H 38 8.390 8.390 8.556 -0.166 18952
875 1 10 . 1 1 39 39 LEU N N 39 119.400 119.400 120.341 -0.941 18952
876 1 10 . 1 1 39 39 LEU H H 39 7.990 7.990 8.063 -0.073 18952
877 1 10 . 1 1 40 40 ILE N N 40 119.250 119.250 118.855 0.395 18952
878 1 10 . 1 1 40 40 ILE H H 40 8.140 8.140 8.193 -0.053 18952
879 1 10 . 1 1 41 41 CYS N N 41 117.800 117.800 118.916 -1.116 18952
880 1 10 . 1 1 41 41 CYS H H 41 7.980 7.980 8.430 -0.450 18952
881 1 10 . 1 1 42 42 LEU N N 42 117.900 117.900 120.060 -2.160 18952
882 1 10 . 1 1 42 42 LEU H H 42 8.290 8.290 8.261 0.029 18952
883 1 10 . 1 1 43 43 LEU N N 43 119.700 119.700 119.876 -0.176 18952
884 1 10 . 1 1 43 43 LEU H H 43 8.390 8.390 7.994 0.396 18952
885 1 10 . 1 1 44 44 LEU N N 44 117.800 117.800 120.593 -2.793 18952
886 1 10 . 1 1 44 44 LEU H H 44 8.180 8.180 8.275 -0.095 18952
887 1 10 . 1 1 45 45 ILE N N 45 117.690 117.690 120.544 -2.854 18952
888 1 10 . 1 1 45 45 ILE H H 45 8.170 8.170 7.886 0.284 18952
889 1 10 . 1 1 46 46 CYS N N 46 117.020 117.020 118.380 -1.360 18952
890 1 10 . 1 1 46 46 CYS H H 46 8.150 8.150 7.594 0.556 18952
891 1 10 . 1 1 47 47 ILE N N 47 117.300 117.300 121.163 -3.863 18952
892 1 10 . 1 1 47 47 ILE H H 47 8.230 8.230 7.654 0.576 18952
893 1 10 . 1 1 48 48 ILE N N 48 117.690 117.690 120.680 -2.990 18952
894 1 10 . 1 1 48 48 ILE H H 48 8.200 8.200 8.373 -0.173 18952
895 1 10 . 1 1 49 49 VAL N N 49 115.700 115.700 120.239 -4.539 18952
896 1 10 . 1 1 49 49 VAL H H 49 8.340 8.340 8.356 -0.016 18952
897 1 10 . 1 1 50 50 MET N N 50 115.500 115.500 118.249 -2.749 18952
898 1 10 . 1 1 50 50 MET H H 50 7.920 7.920 8.195 -0.275 18952
899 1 10 . 1 1 51 51 LEU N N 51 118.100 118.100 119.948 -1.848 18952
900 1 10 . 1 1 51 51 LEU H H 51 7.880 7.880 8.051 -0.171 18952
901 1 11 . 1 1 2 2 GLU N N 2 121.800 121.800 121.242 0.558 18952
902 1 11 . 1 1 2 2 GLU H H 2 9.240 9.240 8.727 0.513 18952
903 1 11 . 1 1 3 3 LYS N N 3 120.200 120.200 119.272 0.928 18952
904 1 11 . 1 1 3 3 LYS H H 3 8.270 8.270 8.365 -0.095 18952
905 1 11 . 1 1 4 4 VAL N N 4 117.600 117.600 120.439 -2.839 18952
906 1 11 . 1 1 4 4 VAL H H 4 7.750 7.750 7.892 -0.142 18952
907 1 11 . 1 1 5 5 GLN N N 5 120.800 120.800 119.151 1.649 18952
908 1 11 . 1 1 5 5 GLN H H 5 8.190 8.190 8.529 -0.339 18952
909 1 11 . 1 1 6 6 TYR N N 6 119.300 119.300 122.491 -3.191 18952
910 1 11 . 1 1 6 6 TYR H H 6 8.020 8.020 8.374 -0.354 18952
911 1 11 . 1 1 7 7 LEU N N 7 120.400 120.400 119.721 0.679 18952
912 1 11 . 1 1 7 7 LEU H H 7 8.110 8.110 8.401 -0.291 18952
913 1 11 . 1 1 8 8 THR N N 8 111.200 111.200 115.940 -4.740 18952
914 1 11 . 1 1 8 8 THR H H 8 7.890 7.890 8.243 -0.353 18952
915 1 11 . 1 1 9 9 ARG N N 9 120.700 120.700 121.636 -0.936 18952
916 1 11 . 1 1 9 9 ARG H H 9 8.220 8.220 8.241 -0.021 18952
917 1 11 . 1 1 10 10 SER N N 10 114.500 114.500 115.239 -0.739 18952
918 1 11 . 1 1 10 10 SER H H 10 7.990 7.990 8.163 -0.173 18952
919 1 11 . 1 1 11 11 ALA N N 11 124.000 124.000 124.764 -0.764 18952
920 1 11 . 1 1 11 11 ALA H H 11 8.060 8.060 7.978 0.082 18952
921 1 11 . 1 1 12 12 ILE N N 12 115.900 115.900 118.589 -2.689 18952
922 1 11 . 1 1 12 12 ILE H H 12 7.780 7.780 7.788 -0.008 18952
923 1 11 . 1 1 13 13 ARG N N 13 121.100 121.100 118.855 2.245 18952
924 1 11 . 1 1 13 13 ARG H H 13 7.910 7.910 8.033 -0.123 18952
925 1 11 . 1 1 14 14 ARG N N 14 120.270 120.270 117.668 2.602 18952
926 1 11 . 1 1 14 14 ARG H H 14 8.060 8.060 7.851 0.209 18952
927 1 11 . 1 1 18 18 ILE N N 18 122.100 122.100 125.866 -3.766 18952
928 1 11 . 1 1 18 18 ILE H H 18 7.720 7.720 8.298 -0.578 18952
929 1 11 . 1 1 19 19 GLU N N 19 124.800 124.800 126.411 -1.611 18952
930 1 11 . 1 1 19 19 GLU H H 19 8.250 8.250 8.060 0.190 18952
931 1 11 . 1 1 20 20 MET N N 20 122.700 122.700 122.141 0.559 18952
932 1 11 . 1 1 20 20 MET H H 20 8.480 8.480 8.387 0.093 18952
933 1 11 . 1 1 22 22 GLN N N 22 121.600 121.600 123.767 -2.167 18952
934 1 11 . 1 1 22 22 GLN H H 22 8.710 8.710 8.895 -0.185 18952
935 1 11 . 1 1 23 23 GLN N N 23 119.000 119.000 117.815 1.185 18952
936 1 11 . 1 1 23 23 GLN H H 23 8.620 8.620 8.168 0.452 18952
937 1 11 . 1 1 24 24 ALA N N 24 122.400 122.400 120.141 2.259 18952
938 1 11 . 1 1 24 24 ALA H H 24 7.840 7.840 8.315 -0.475 18952
939 1 11 . 1 1 26 26 GLN N N 26 118.340 118.340 116.061 2.279 18952
940 1 11 . 1 1 26 26 GLN H H 26 8.780 8.780 8.545 0.235 18952
941 1 11 . 1 1 27 27 ASN N N 27 117.920 117.920 117.888 0.032 18952
942 1 11 . 1 1 27 27 ASN H H 27 8.000 8.000 8.075 -0.075 18952
943 1 11 . 1 1 28 28 LEU N N 28 121.400 121.400 120.772 0.628 18952
944 1 11 . 1 1 28 28 LEU H H 28 8.210 8.210 8.367 -0.157 18952
945 1 11 . 1 1 29 29 GLN N N 29 117.930 117.930 118.798 -0.868 18952
946 1 11 . 1 1 29 29 GLN H H 29 8.130 8.130 7.781 0.349 18952
947 1 11 . 1 1 30 30 ASN N N 30 117.040 117.040 118.890 -1.850 18952
948 1 11 . 1 1 30 30 ASN H H 30 8.100 8.100 7.450 0.650 18952
949 1 11 . 1 1 31 31 LEU N N 31 121.200 121.200 121.394 -0.194 18952
950 1 11 . 1 1 31 31 LEU H H 31 8.060 8.060 7.968 0.092 18952
951 1 11 . 1 1 32 32 PHE N N 32 118.310 118.310 118.051 0.259 18952
952 1 11 . 1 1 32 32 PHE H H 32 8.450 8.450 7.589 0.861 18952
953 1 11 . 1 1 33 33 ILE N N 33 119.700 119.700 119.647 0.053 18952
954 1 11 . 1 1 33 33 ILE H H 33 8.420 8.420 8.768 -0.348 18952
955 1 11 . 1 1 34 34 ASN N N 34 117.580 117.580 118.032 -0.452 18952
956 1 11 . 1 1 34 34 ASN H H 34 8.030 8.030 8.155 -0.125 18952
957 1 11 . 1 1 35 35 PHE N N 35 119.400 119.400 121.567 -2.167 18952
958 1 11 . 1 1 35 35 PHE H H 35 8.570 8.570 7.750 0.820 18952
959 1 11 . 1 1 36 36 CYS N N 36 116.680 116.680 118.552 -1.872 18952
960 1 11 . 1 1 36 36 CYS H H 36 8.160 8.160 7.781 0.379 18952
961 1 11 . 1 1 37 37 LEU N N 37 118.190 118.190 121.072 -2.882 18952
962 1 11 . 1 1 37 37 LEU H H 37 8.170 8.170 8.540 -0.370 18952
963 1 11 . 1 1 38 38 ILE N N 38 119.700 119.700 118.851 0.849 18952
964 1 11 . 1 1 38 38 ILE H H 38 8.390 8.390 8.417 -0.027 18952
965 1 11 . 1 1 39 39 LEU N N 39 119.400 119.400 119.802 -0.402 18952
966 1 11 . 1 1 39 39 LEU H H 39 7.990 7.990 7.580 0.410 18952
967 1 11 . 1 1 40 40 ILE N N 40 119.250 119.250 119.726 -0.476 18952
968 1 11 . 1 1 40 40 ILE H H 40 8.140 8.140 8.253 -0.113 18952
969 1 11 . 1 1 41 41 CYS N N 41 117.800 117.800 118.810 -1.010 18952
970 1 11 . 1 1 41 41 CYS H H 41 7.980 7.980 8.432 -0.452 18952
971 1 11 . 1 1 42 42 LEU N N 42 117.900 117.900 120.030 -2.130 18952
972 1 11 . 1 1 42 42 LEU H H 42 8.290 8.290 8.079 0.211 18952
973 1 11 . 1 1 43 43 LEU N N 43 119.700 119.700 120.296 -0.596 18952
974 1 11 . 1 1 43 43 LEU H H 43 8.390 8.390 8.149 0.241 18952
975 1 11 . 1 1 44 44 LEU N N 44 117.800 117.800 120.503 -2.703 18952
976 1 11 . 1 1 44 44 LEU H H 44 8.180 8.180 8.223 -0.043 18952
977 1 11 . 1 1 45 45 ILE N N 45 117.690 117.690 119.914 -2.224 18952
978 1 11 . 1 1 45 45 ILE H H 45 8.170 8.170 7.694 0.476 18952
979 1 11 . 1 1 46 46 CYS N N 46 117.020 117.020 118.599 -1.579 18952
980 1 11 . 1 1 46 46 CYS H H 46 8.150 8.150 7.835 0.315 18952
981 1 11 . 1 1 47 47 ILE N N 47 117.300 117.300 121.389 -4.089 18952
982 1 11 . 1 1 47 47 ILE H H 47 8.230 8.230 8.198 0.032 18952
983 1 11 . 1 1 48 48 ILE N N 48 117.690 117.690 120.106 -2.416 18952
984 1 11 . 1 1 48 48 ILE H H 48 8.200 8.200 8.024 0.176 18952
985 1 11 . 1 1 49 49 VAL N N 49 115.700 115.700 120.333 -4.633 18952
986 1 11 . 1 1 49 49 VAL H H 49 8.340 8.340 8.143 0.197 18952
987 1 11 . 1 1 50 50 MET N N 50 115.500 115.500 116.949 -1.449 18952
988 1 11 . 1 1 50 50 MET H H 50 7.920 7.920 8.428 -0.508 18952
989 1 11 . 1 1 51 51 LEU N N 51 118.100 118.100 119.516 -1.416 18952
990 1 11 . 1 1 51 51 LEU H H 51 7.880 7.880 7.827 0.053 18952
991 1 12 . 1 1 2 2 GLU N N 2 121.800 121.800 120.888 0.912 18952
992 1 12 . 1 1 2 2 GLU H H 2 9.240 9.240 8.764 0.476 18952
993 1 12 . 1 1 3 3 LYS N N 3 120.200 120.200 119.225 0.975 18952
994 1 12 . 1 1 3 3 LYS H H 3 8.270 8.270 8.410 -0.140 18952
995 1 12 . 1 1 4 4 VAL N N 4 117.600 117.600 119.799 -2.199 18952
996 1 12 . 1 1 4 4 VAL H H 4 7.750 7.750 7.301 0.449 18952
997 1 12 . 1 1 5 5 GLN N N 5 120.800 120.800 118.729 2.071 18952
998 1 12 . 1 1 5 5 GLN H H 5 8.190 8.190 8.207 -0.017 18952
999 1 12 . 1 1 6 6 TYR N N 6 119.300 119.300 122.934 -3.634 18952
1000 1 12 . 1 1 6 6 TYR H H 6 8.020 8.020 8.428 -0.408 18952
1001 1 12 . 1 1 7 7 LEU N N 7 120.400 120.400 119.363 1.037 18952
1002 1 12 . 1 1 7 7 LEU H H 7 8.110 8.110 8.295 -0.185 18952
1003 1 12 . 1 1 8 8 THR N N 8 111.200 111.200 116.297 -5.097 18952
1004 1 12 . 1 1 8 8 THR H H 8 7.890 7.890 7.779 0.111 18952
1005 1 12 . 1 1 9 9 ARG N N 9 120.700 120.700 121.534 -0.834 18952
1006 1 12 . 1 1 9 9 ARG H H 9 8.220 8.220 8.563 -0.343 18952
1007 1 12 . 1 1 10 10 SER N N 10 114.500 114.500 114.509 -0.009 18952
1008 1 12 . 1 1 10 10 SER H H 10 7.990 7.990 8.089 -0.099 18952
1009 1 12 . 1 1 11 11 ALA N N 11 124.000 124.000 123.815 0.185 18952
1010 1 12 . 1 1 11 11 ALA H H 11 8.060 8.060 7.664 0.396 18952
1011 1 12 . 1 1 12 12 ILE N N 12 115.900 115.900 118.501 -2.601 18952
1012 1 12 . 1 1 12 12 ILE H H 12 7.780 7.780 7.829 -0.049 18952
1013 1 12 . 1 1 13 13 ARG N N 13 121.100 121.100 119.391 1.709 18952
1014 1 12 . 1 1 13 13 ARG H H 13 7.910 7.910 8.307 -0.397 18952
1015 1 12 . 1 1 14 14 ARG N N 14 120.270 120.270 119.495 0.775 18952
1016 1 12 . 1 1 14 14 ARG H H 14 8.060 8.060 8.006 0.054 18952
1017 1 12 . 1 1 18 18 ILE N N 18 122.100 122.100 122.278 -0.178 18952
1018 1 12 . 1 1 18 18 ILE H H 18 7.720 7.720 8.433 -0.713 18952
1019 1 12 . 1 1 19 19 GLU N N 19 124.800 124.800 126.484 -1.684 18952
1020 1 12 . 1 1 19 19 GLU H H 19 8.250 8.250 8.583 -0.333 18952
1021 1 12 . 1 1 20 20 MET N N 20 122.700 122.700 126.428 -3.728 18952
1022 1 12 . 1 1 20 20 MET H H 20 8.480 8.480 8.654 -0.174 18952
1023 1 12 . 1 1 22 22 GLN N N 22 121.600 121.600 122.102 -0.502 18952
1024 1 12 . 1 1 22 22 GLN H H 22 8.710 8.710 8.295 0.415 18952
1025 1 12 . 1 1 23 23 GLN N N 23 119.000 119.000 116.557 2.443 18952
1026 1 12 . 1 1 23 23 GLN H H 23 8.620 8.620 7.986 0.634 18952
1027 1 12 . 1 1 24 24 ALA N N 24 122.400 122.400 121.767 0.633 18952
1028 1 12 . 1 1 24 24 ALA H H 24 7.840 7.840 7.904 -0.064 18952
1029 1 12 . 1 1 26 26 GLN N N 26 118.340 118.340 120.842 -2.502 18952
1030 1 12 . 1 1 26 26 GLN H H 26 8.780 8.780 8.746 0.034 18952
1031 1 12 . 1 1 27 27 ASN N N 27 117.920 117.920 116.401 1.519 18952
1032 1 12 . 1 1 27 27 ASN H H 27 8.000 8.000 8.475 -0.475 18952
1033 1 12 . 1 1 28 28 LEU N N 28 121.400 121.400 120.593 0.807 18952
1034 1 12 . 1 1 28 28 LEU H H 28 8.210 8.210 7.544 0.666 18952
1035 1 12 . 1 1 29 29 GLN N N 29 117.930 117.930 118.992 -1.062 18952
1036 1 12 . 1 1 29 29 GLN H H 29 8.130 8.130 7.978 0.152 18952
1037 1 12 . 1 1 30 30 ASN N N 30 117.040 117.040 119.554 -2.514 18952
1038 1 12 . 1 1 30 30 ASN H H 30 8.100 8.100 8.448 -0.348 18952
1039 1 12 . 1 1 31 31 LEU N N 31 121.200 121.200 121.166 0.034 18952
1040 1 12 . 1 1 31 31 LEU H H 31 8.060 8.060 7.924 0.136 18952
1041 1 12 . 1 1 32 32 PHE N N 32 118.310 118.310 118.538 -0.228 18952
1042 1 12 . 1 1 32 32 PHE H H 32 8.450 8.450 7.657 0.793 18952
1043 1 12 . 1 1 33 33 ILE N N 33 119.700 119.700 119.916 -0.216 18952
1044 1 12 . 1 1 33 33 ILE H H 33 8.420 8.420 9.008 -0.588 18952
1045 1 12 . 1 1 34 34 ASN N N 34 117.580 117.580 118.426 -0.846 18952
1046 1 12 . 1 1 34 34 ASN H H 34 8.030 8.030 8.172 -0.142 18952
1047 1 12 . 1 1 35 35 PHE N N 35 119.400 119.400 121.686 -2.286 18952
1048 1 12 . 1 1 35 35 PHE H H 35 8.570 8.570 8.442 0.128 18952
1049 1 12 . 1 1 36 36 CYS N N 36 116.680 116.680 118.528 -1.848 18952
1050 1 12 . 1 1 36 36 CYS H H 36 8.160 8.160 8.394 -0.234 18952
1051 1 12 . 1 1 37 37 LEU N N 37 118.190 118.190 121.352 -3.162 18952
1052 1 12 . 1 1 37 37 LEU H H 37 8.170 8.170 8.463 -0.293 18952
1053 1 12 . 1 1 38 38 ILE N N 38 119.700 119.700 119.349 0.351 18952
1054 1 12 . 1 1 38 38 ILE H H 38 8.390 8.390 8.396 -0.006 18952
1055 1 12 . 1 1 39 39 LEU N N 39 119.400 119.400 120.046 -0.646 18952
1056 1 12 . 1 1 39 39 LEU H H 39 7.990 7.990 7.734 0.256 18952
1057 1 12 . 1 1 40 40 ILE N N 40 119.250 119.250 119.044 0.206 18952
1058 1 12 . 1 1 40 40 ILE H H 40 8.140 8.140 7.954 0.186 18952
1059 1 12 . 1 1 41 41 CYS N N 41 117.800 117.800 118.735 -0.935 18952
1060 1 12 . 1 1 41 41 CYS H H 41 7.980 7.980 8.379 -0.399 18952
1061 1 12 . 1 1 42 42 LEU N N 42 117.900 117.900 119.898 -1.998 18952
1062 1 12 . 1 1 42 42 LEU H H 42 8.290 8.290 8.039 0.251 18952
1063 1 12 . 1 1 43 43 LEU N N 43 119.700 119.700 120.264 -0.564 18952
1064 1 12 . 1 1 43 43 LEU H H 43 8.390 8.390 8.164 0.226 18952
1065 1 12 . 1 1 44 44 LEU N N 44 117.800 117.800 120.254 -2.454 18952
1066 1 12 . 1 1 44 44 LEU H H 44 8.180 8.180 8.380 -0.200 18952
1067 1 12 . 1 1 45 45 ILE N N 45 117.690 117.690 119.310 -1.620 18952
1068 1 12 . 1 1 45 45 ILE H H 45 8.170 8.170 7.406 0.764 18952
1069 1 12 . 1 1 46 46 CYS N N 46 117.020 117.020 118.352 -1.332 18952
1070 1 12 . 1 1 46 46 CYS H H 46 8.150 8.150 7.632 0.518 18952
1071 1 12 . 1 1 47 47 ILE N N 47 117.300 117.300 121.530 -4.230 18952
1072 1 12 . 1 1 47 47 ILE H H 47 8.230 8.230 8.279 -0.049 18952
1073 1 12 . 1 1 48 48 ILE N N 48 117.690 117.690 119.914 -2.224 18952
1074 1 12 . 1 1 48 48 ILE H H 48 8.200 8.200 7.491 0.709 18952
1075 1 12 . 1 1 49 49 VAL N N 49 115.700 115.700 120.471 -4.771 18952
1076 1 12 . 1 1 49 49 VAL H H 49 8.340 8.340 7.612 0.728 18952
1077 1 12 . 1 1 50 50 MET N N 50 115.500 115.500 116.860 -1.360 18952
1078 1 12 . 1 1 50 50 MET H H 50 7.920 7.920 8.260 -0.340 18952
1079 1 12 . 1 1 51 51 LEU N N 51 118.100 118.100 119.539 -1.439 18952
1080 1 12 . 1 1 51 51 LEU H H 51 7.880 7.880 7.934 -0.054 18952
1081 1 13 . 1 1 2 2 GLU N N 2 121.800 121.800 122.528 -0.728 18952
1082 1 13 . 1 1 2 2 GLU H H 2 9.240 9.240 8.884 0.356 18952
1083 1 13 . 1 1 3 3 LYS N N 3 120.200 120.200 118.743 1.457 18952
1084 1 13 . 1 1 3 3 LYS H H 3 8.270 8.270 8.424 -0.154 18952
1085 1 13 . 1 1 4 4 VAL N N 4 117.600 117.600 120.209 -2.609 18952
1086 1 13 . 1 1 4 4 VAL H H 4 7.750 7.750 7.366 0.384 18952
1087 1 13 . 1 1 5 5 GLN N N 5 120.800 120.800 118.675 2.125 18952
1088 1 13 . 1 1 5 5 GLN H H 5 8.190 8.190 8.022 0.168 18952
1089 1 13 . 1 1 6 6 TYR N N 6 119.300 119.300 121.801 -2.501 18952
1090 1 13 . 1 1 6 6 TYR H H 6 8.020 8.020 7.773 0.247 18952
1091 1 13 . 1 1 7 7 LEU N N 7 120.400 120.400 120.094 0.306 18952
1092 1 13 . 1 1 7 7 LEU H H 7 8.110 8.110 8.574 -0.464 18952
1093 1 13 . 1 1 8 8 THR N N 8 111.200 111.200 115.828 -4.628 18952
1094 1 13 . 1 1 8 8 THR H H 8 7.890 7.890 8.606 -0.716 18952
1095 1 13 . 1 1 9 9 ARG N N 9 120.700 120.700 121.613 -0.913 18952
1096 1 13 . 1 1 9 9 ARG H H 9 8.220 8.220 7.778 0.442 18952
1097 1 13 . 1 1 10 10 SER N N 10 114.500 114.500 115.020 -0.520 18952
1098 1 13 . 1 1 10 10 SER H H 10 7.990 7.990 8.065 -0.075 18952
1099 1 13 . 1 1 11 11 ALA N N 11 124.000 124.000 124.561 -0.561 18952
1100 1 13 . 1 1 11 11 ALA H H 11 8.060 8.060 8.161 -0.101 18952
1101 1 13 . 1 1 12 12 ILE N N 12 115.900 115.900 118.937 -3.037 18952
1102 1 13 . 1 1 12 12 ILE H H 12 7.780 7.780 7.937 -0.157 18952
1103 1 13 . 1 1 13 13 ARG N N 13 121.100 121.100 118.796 2.304 18952
1104 1 13 . 1 1 13 13 ARG H H 13 7.910 7.910 8.026 -0.116 18952
1105 1 13 . 1 1 14 14 ARG N N 14 120.270 120.270 117.535 2.735 18952
1106 1 13 . 1 1 14 14 ARG H H 14 8.060 8.060 7.514 0.546 18952
1107 1 13 . 1 1 18 18 ILE N N 18 122.100 122.100 121.125 0.975 18952
1108 1 13 . 1 1 18 18 ILE H H 18 7.720 7.720 7.983 -0.263 18952
1109 1 13 . 1 1 19 19 GLU N N 19 124.800 124.800 120.175 4.625 18952
1110 1 13 . 1 1 19 19 GLU H H 19 8.250 8.250 7.816 0.434 18952
1111 1 13 . 1 1 20 20 MET N N 20 122.700 122.700 121.514 1.186 18952
1112 1 13 . 1 1 20 20 MET H H 20 8.480 8.480 8.477 0.003 18952
1113 1 13 . 1 1 22 22 GLN N N 22 121.600 121.600 115.865 5.735 18952
1114 1 13 . 1 1 22 22 GLN H H 22 8.710 8.710 8.561 0.149 18952
1115 1 13 . 1 1 23 23 GLN N N 23 119.000 119.000 118.340 0.660 18952
1116 1 13 . 1 1 23 23 GLN H H 23 8.620 8.620 7.793 0.827 18952
1117 1 13 . 1 1 24 24 ALA N N 24 122.400 122.400 122.056 0.344 18952
1118 1 13 . 1 1 24 24 ALA H H 24 7.840 7.840 7.604 0.236 18952
1119 1 13 . 1 1 26 26 GLN N N 26 118.340 118.340 120.120 -1.780 18952
1120 1 13 . 1 1 26 26 GLN H H 26 8.780 8.780 8.873 -0.093 18952
1121 1 13 . 1 1 27 27 ASN N N 27 117.920 117.920 117.842 0.078 18952
1122 1 13 . 1 1 27 27 ASN H H 27 8.000 8.000 8.071 -0.071 18952
1123 1 13 . 1 1 28 28 LEU N N 28 121.400 121.400 120.669 0.731 18952
1124 1 13 . 1 1 28 28 LEU H H 28 8.210 8.210 7.704 0.506 18952
1125 1 13 . 1 1 29 29 GLN N N 29 117.930 117.930 118.504 -0.574 18952
1126 1 13 . 1 1 29 29 GLN H H 29 8.130 8.130 8.282 -0.152 18952
1127 1 13 . 1 1 30 30 ASN N N 30 117.040 117.040 119.116 -2.076 18952
1128 1 13 . 1 1 30 30 ASN H H 30 8.100 8.100 8.137 -0.037 18952
1129 1 13 . 1 1 31 31 LEU N N 31 121.200 121.200 120.848 0.352 18952
1130 1 13 . 1 1 31 31 LEU H H 31 8.060 8.060 7.336 0.724 18952
1131 1 13 . 1 1 32 32 PHE N N 32 118.310 118.310 118.435 -0.125 18952
1132 1 13 . 1 1 32 32 PHE H H 32 8.450 8.450 7.260 1.190 18952
1133 1 13 . 1 1 33 33 ILE N N 33 119.700 119.700 119.764 -0.064 18952
1134 1 13 . 1 1 33 33 ILE H H 33 8.420 8.420 8.926 -0.506 18952
1135 1 13 . 1 1 34 34 ASN N N 34 117.580 117.580 118.735 -1.155 18952
1136 1 13 . 1 1 34 34 ASN H H 34 8.030 8.030 8.611 -0.581 18952
1137 1 13 . 1 1 35 35 PHE N N 35 119.400 119.400 121.715 -2.315 18952
1138 1 13 . 1 1 35 35 PHE H H 35 8.570 8.570 8.405 0.165 18952
1139 1 13 . 1 1 36 36 CYS N N 36 116.680 116.680 119.010 -2.330 18952
1140 1 13 . 1 1 36 36 CYS H H 36 8.160 8.160 7.894 0.266 18952
1141 1 13 . 1 1 37 37 LEU N N 37 118.190 118.190 121.077 -2.887 18952
1142 1 13 . 1 1 37 37 LEU H H 37 8.170 8.170 8.546 -0.376 18952
1143 1 13 . 1 1 38 38 ILE N N 38 119.700 119.700 119.277 0.423 18952
1144 1 13 . 1 1 38 38 ILE H H 38 8.390 8.390 8.429 -0.039 18952
1145 1 13 . 1 1 39 39 LEU N N 39 119.400 119.400 120.403 -1.003 18952
1146 1 13 . 1 1 39 39 LEU H H 39 7.990 7.990 7.846 0.144 18952
1147 1 13 . 1 1 40 40 ILE N N 40 119.250 119.250 120.014 -0.764 18952
1148 1 13 . 1 1 40 40 ILE H H 40 8.140 8.140 8.355 -0.215 18952
1149 1 13 . 1 1 41 41 CYS N N 41 117.800 117.800 119.328 -1.528 18952
1150 1 13 . 1 1 41 41 CYS H H 41 7.980 7.980 8.637 -0.657 18952
1151 1 13 . 1 1 42 42 LEU N N 42 117.900 117.900 119.984 -2.084 18952
1152 1 13 . 1 1 42 42 LEU H H 42 8.290 8.290 8.322 -0.032 18952
1153 1 13 . 1 1 43 43 LEU N N 43 119.700 119.700 120.727 -1.027 18952
1154 1 13 . 1 1 43 43 LEU H H 43 8.390 8.390 8.080 0.310 18952
1155 1 13 . 1 1 44 44 LEU N N 44 117.800 117.800 120.040 -2.240 18952
1156 1 13 . 1 1 44 44 LEU H H 44 8.180 8.180 8.600 -0.420 18952
1157 1 13 . 1 1 45 45 ILE N N 45 117.690 117.690 119.506 -1.816 18952
1158 1 13 . 1 1 45 45 ILE H H 45 8.170 8.170 7.878 0.292 18952
1159 1 13 . 1 1 46 46 CYS N N 46 117.020 117.020 118.757 -1.737 18952
1160 1 13 . 1 1 46 46 CYS H H 46 8.150 8.150 7.839 0.311 18952
1161 1 13 . 1 1 47 47 ILE N N 47 117.300 117.300 121.467 -4.167 18952
1162 1 13 . 1 1 47 47 ILE H H 47 8.230 8.230 8.549 -0.319 18952
1163 1 13 . 1 1 48 48 ILE N N 48 117.690 117.690 120.251 -2.561 18952
1164 1 13 . 1 1 48 48 ILE H H 48 8.200 8.200 8.232 -0.032 18952
1165 1 13 . 1 1 49 49 VAL N N 49 115.700 115.700 120.345 -4.645 18952
1166 1 13 . 1 1 49 49 VAL H H 49 8.340 8.340 8.186 0.154 18952
1167 1 13 . 1 1 50 50 MET N N 50 115.500 115.500 117.346 -1.846 18952
1168 1 13 . 1 1 50 50 MET H H 50 7.920 7.920 8.190 -0.270 18952
1169 1 13 . 1 1 51 51 LEU N N 51 118.100 118.100 119.414 -1.314 18952
1170 1 13 . 1 1 51 51 LEU H H 51 7.880 7.880 7.862 0.018 18952
1171 1 14 . 1 1 2 2 GLU N N 2 121.800 121.800 122.729 -0.929 18952
1172 1 14 . 1 1 2 2 GLU H H 2 9.240 9.240 8.913 0.327 18952
1173 1 14 . 1 1 3 3 LYS N N 3 120.200 120.200 119.202 0.998 18952
1174 1 14 . 1 1 3 3 LYS H H 3 8.270 8.270 8.370 -0.100 18952
1175 1 14 . 1 1 4 4 VAL N N 4 117.600 117.600 120.403 -2.803 18952
1176 1 14 . 1 1 4 4 VAL H H 4 7.750 7.750 7.879 -0.129 18952
1177 1 14 . 1 1 5 5 GLN N N 5 120.800 120.800 119.161 1.639 18952
1178 1 14 . 1 1 5 5 GLN H H 5 8.190 8.190 8.513 -0.323 18952
1179 1 14 . 1 1 6 6 TYR N N 6 119.300 119.300 122.468 -3.168 18952
1180 1 14 . 1 1 6 6 TYR H H 6 8.020 8.020 8.362 -0.342 18952
1181 1 14 . 1 1 7 7 LEU N N 7 120.400 120.400 119.827 0.573 18952
1182 1 14 . 1 1 7 7 LEU H H 7 8.110 8.110 8.457 -0.347 18952
1183 1 14 . 1 1 8 8 THR N N 8 111.200 111.200 115.936 -4.736 18952
1184 1 14 . 1 1 8 8 THR H H 8 7.890 7.890 8.279 -0.389 18952
1185 1 14 . 1 1 9 9 ARG N N 9 120.700 120.700 121.627 -0.927 18952
1186 1 14 . 1 1 9 9 ARG H H 9 8.220 8.220 8.267 -0.047 18952
1187 1 14 . 1 1 10 10 SER N N 10 114.500 114.500 115.455 -0.955 18952
1188 1 14 . 1 1 10 10 SER H H 10 7.990 7.990 8.198 -0.208 18952
1189 1 14 . 1 1 11 11 ALA N N 11 124.000 124.000 125.009 -1.009 18952
1190 1 14 . 1 1 11 11 ALA H H 11 8.060 8.060 8.093 -0.033 18952
1191 1 14 . 1 1 12 12 ILE N N 12 115.900 115.900 118.429 -2.529 18952
1192 1 14 . 1 1 12 12 ILE H H 12 7.780 7.780 7.817 -0.037 18952
1193 1 14 . 1 1 13 13 ARG N N 13 121.100 121.100 118.788 2.312 18952
1194 1 14 . 1 1 13 13 ARG H H 13 7.910 7.910 8.008 -0.098 18952
1195 1 14 . 1 1 14 14 ARG N N 14 120.270 120.270 119.713 0.557 18952
1196 1 14 . 1 1 14 14 ARG H H 14 8.060 8.060 8.208 -0.148 18952
1197 1 14 . 1 1 18 18 ILE N N 18 122.100 122.100 121.119 0.981 18952
1198 1 14 . 1 1 18 18 ILE H H 18 7.720 7.720 7.897 -0.177 18952
1199 1 14 . 1 1 19 19 GLU N N 19 124.800 124.800 117.518 7.282 18952
1200 1 14 . 1 1 19 19 GLU H H 19 8.250 8.250 9.038 -0.788 18952
1201 1 14 . 1 1 20 20 MET N N 20 122.700 122.700 115.102 7.598 18952
1202 1 14 . 1 1 20 20 MET H H 20 8.480 8.480 8.145 0.335 18952
1203 1 14 . 1 1 22 22 GLN N N 22 121.600 121.600 116.284 5.316 18952
1204 1 14 . 1 1 22 22 GLN H H 22 8.710 8.710 8.508 0.202 18952
1205 1 14 . 1 1 23 23 GLN N N 23 119.000 119.000 120.363 -1.363 18952
1206 1 14 . 1 1 23 23 GLN H H 23 8.620 8.620 7.346 1.274 18952
1207 1 14 . 1 1 24 24 ALA N N 24 122.400 122.400 126.682 -4.282 18952
1208 1 14 . 1 1 24 24 ALA H H 24 7.840 7.840 8.017 -0.177 18952
1209 1 14 . 1 1 26 26 GLN N N 26 118.340 118.340 122.012 -3.672 18952
1210 1 14 . 1 1 26 26 GLN H H 26 8.780 8.780 8.842 -0.062 18952
1211 1 14 . 1 1 27 27 ASN N N 27 117.920 117.920 118.027 -0.107 18952
1212 1 14 . 1 1 27 27 ASN H H 27 8.000 8.000 7.984 0.016 18952
1213 1 14 . 1 1 28 28 LEU N N 28 121.400 121.400 120.051 1.349 18952
1214 1 14 . 1 1 28 28 LEU H H 28 8.210 8.210 7.860 0.350 18952
1215 1 14 . 1 1 29 29 GLN N N 29 117.930 117.930 118.874 -0.944 18952
1216 1 14 . 1 1 29 29 GLN H H 29 8.130 8.130 7.820 0.310 18952
1217 1 14 . 1 1 30 30 ASN N N 30 117.040 117.040 119.261 -2.221 18952
1218 1 14 . 1 1 30 30 ASN H H 30 8.100 8.100 8.502 -0.402 18952
1219 1 14 . 1 1 31 31 LEU N N 31 121.200 121.200 121.106 0.094 18952
1220 1 14 . 1 1 31 31 LEU H H 31 8.060 8.060 7.933 0.127 18952
1221 1 14 . 1 1 32 32 PHE N N 32 118.310 118.310 118.117 0.193 18952
1222 1 14 . 1 1 32 32 PHE H H 32 8.450 8.450 7.322 1.128 18952
1223 1 14 . 1 1 33 33 ILE N N 33 119.700 119.700 119.793 -0.093 18952
1224 1 14 . 1 1 33 33 ILE H H 33 8.420 8.420 8.766 -0.346 18952
1225 1 14 . 1 1 34 34 ASN N N 34 117.580 117.580 118.442 -0.862 18952
1226 1 14 . 1 1 34 34 ASN H H 34 8.030 8.030 8.364 -0.334 18952
1227 1 14 . 1 1 35 35 PHE N N 35 119.400 119.400 121.696 -2.296 18952
1228 1 14 . 1 1 35 35 PHE H H 35 8.570 8.570 7.791 0.779 18952
1229 1 14 . 1 1 36 36 CYS N N 36 116.680 116.680 118.840 -2.160 18952
1230 1 14 . 1 1 36 36 CYS H H 36 8.160 8.160 7.910 0.250 18952
1231 1 14 . 1 1 37 37 LEU N N 37 118.190 118.190 121.010 -2.820 18952
1232 1 14 . 1 1 37 37 LEU H H 37 8.170 8.170 8.564 -0.394 18952
1233 1 14 . 1 1 38 38 ILE N N 38 119.700 119.700 119.123 0.577 18952
1234 1 14 . 1 1 38 38 ILE H H 38 8.390 8.390 8.481 -0.091 18952
1235 1 14 . 1 1 39 39 LEU N N 39 119.400 119.400 120.122 -0.722 18952
1236 1 14 . 1 1 39 39 LEU H H 39 7.990 7.990 7.717 0.273 18952
1237 1 14 . 1 1 40 40 ILE N N 40 119.250 119.250 119.486 -0.236 18952
1238 1 14 . 1 1 40 40 ILE H H 40 8.140 8.140 8.265 -0.125 18952
1239 1 14 . 1 1 41 41 CYS N N 41 117.800 117.800 118.808 -1.008 18952
1240 1 14 . 1 1 41 41 CYS H H 41 7.980 7.980 8.363 -0.383 18952
1241 1 14 . 1 1 42 42 LEU N N 42 117.900 117.900 120.133 -2.233 18952
1242 1 14 . 1 1 42 42 LEU H H 42 8.290 8.290 8.311 -0.021 18952
1243 1 14 . 1 1 43 43 LEU N N 43 119.700 119.700 119.733 -0.033 18952
1244 1 14 . 1 1 43 43 LEU H H 43 8.390 8.390 7.997 0.393 18952
1245 1 14 . 1 1 44 44 LEU N N 44 117.800 117.800 120.495 -2.695 18952
1246 1 14 . 1 1 44 44 LEU H H 44 8.180 8.180 8.121 0.059 18952
1247 1 14 . 1 1 45 45 ILE N N 45 117.690 117.690 120.753 -3.063 18952
1248 1 14 . 1 1 45 45 ILE H H 45 8.170 8.170 8.012 0.158 18952
1249 1 14 . 1 1 46 46 CYS N N 46 117.020 117.020 118.284 -1.264 18952
1250 1 14 . 1 1 46 46 CYS H H 46 8.150 8.150 7.775 0.375 18952
1251 1 14 . 1 1 47 47 ILE N N 47 117.300 117.300 120.942 -3.642 18952
1252 1 14 . 1 1 47 47 ILE H H 47 8.230 8.230 7.538 0.692 18952
1253 1 14 . 1 1 48 48 ILE N N 48 117.690 117.690 120.637 -2.947 18952
1254 1 14 . 1 1 48 48 ILE H H 48 8.200 8.200 8.368 -0.168 18952
1255 1 14 . 1 1 49 49 VAL N N 49 115.700 115.700 120.284 -4.584 18952
1256 1 14 . 1 1 49 49 VAL H H 49 8.340 8.340 8.352 -0.012 18952
1257 1 14 . 1 1 50 50 MET N N 50 115.500 115.500 118.110 -2.610 18952
1258 1 14 . 1 1 50 50 MET H H 50 7.920 7.920 8.088 -0.168 18952
1259 1 14 . 1 1 51 51 LEU N N 51 118.100 118.100 119.568 -1.468 18952
1260 1 14 . 1 1 51 51 LEU H H 51 7.880 7.880 8.045 -0.165 18952
1261 1 15 . 1 1 2 2 GLU N N 2 121.800 121.800 121.299 0.501 18952
1262 1 15 . 1 1 2 2 GLU H H 2 9.240 9.240 8.729 0.511 18952
1263 1 15 . 1 1 3 3 LYS N N 3 120.200 120.200 119.288 0.912 18952
1264 1 15 . 1 1 3 3 LYS H H 3 8.270 8.270 8.367 -0.097 18952
1265 1 15 . 1 1 4 4 VAL N N 4 117.600 117.600 120.401 -2.801 18952
1266 1 15 . 1 1 4 4 VAL H H 4 7.750 7.750 7.895 -0.145 18952
1267 1 15 . 1 1 5 5 GLN N N 5 120.800 120.800 119.274 1.526 18952
1268 1 15 . 1 1 5 5 GLN H H 5 8.190 8.190 8.521 -0.331 18952
1269 1 15 . 1 1 6 6 TYR N N 6 119.300 119.300 122.391 -3.091 18952
1270 1 15 . 1 1 6 6 TYR H H 6 8.020 8.020 8.401 -0.381 18952
1271 1 15 . 1 1 7 7 LEU N N 7 120.400 120.400 119.797 0.603 18952
1272 1 15 . 1 1 7 7 LEU H H 7 8.110 8.110 8.405 -0.295 18952
1273 1 15 . 1 1 8 8 THR N N 8 111.200 111.200 115.987 -4.787 18952
1274 1 15 . 1 1 8 8 THR H H 8 7.890 7.890 8.295 -0.405 18952
1275 1 15 . 1 1 9 9 ARG N N 9 120.700 120.700 121.612 -0.912 18952
1276 1 15 . 1 1 9 9 ARG H H 9 8.220 8.220 8.295 -0.075 18952
1277 1 15 . 1 1 10 10 SER N N 10 114.500 114.500 115.249 -0.749 18952
1278 1 15 . 1 1 10 10 SER H H 10 7.990 7.990 8.169 -0.179 18952
1279 1 15 . 1 1 11 11 ALA N N 11 124.000 124.000 124.827 -0.827 18952
1280 1 15 . 1 1 11 11 ALA H H 11 8.060 8.060 8.052 0.008 18952
1281 1 15 . 1 1 12 12 ILE N N 12 115.900 115.900 118.500 -2.600 18952
1282 1 15 . 1 1 12 12 ILE H H 12 7.780 7.780 7.939 -0.159 18952
1283 1 15 . 1 1 13 13 ARG N N 13 121.100 121.100 118.767 2.333 18952
1284 1 15 . 1 1 13 13 ARG H H 13 7.910 7.910 7.993 -0.083 18952
1285 1 15 . 1 1 14 14 ARG N N 14 120.270 120.270 119.502 0.768 18952
1286 1 15 . 1 1 14 14 ARG H H 14 8.060 8.060 7.962 0.098 18952
1287 1 15 . 1 1 18 18 ILE N N 18 122.100 122.100 120.004 2.096 18952
1288 1 15 . 1 1 18 18 ILE H H 18 7.720 7.720 8.204 -0.484 18952
1289 1 15 . 1 1 19 19 GLU N N 19 124.800 124.800 127.419 -2.619 18952
1290 1 15 . 1 1 19 19 GLU H H 19 8.250 8.250 8.390 -0.140 18952
1291 1 15 . 1 1 20 20 MET N N 20 122.700 122.700 120.954 1.746 18952
1292 1 15 . 1 1 20 20 MET H H 20 8.480 8.480 8.543 -0.063 18952
1293 1 15 . 1 1 22 22 GLN N N 22 121.600 121.600 119.821 1.779 18952
1294 1 15 . 1 1 22 22 GLN H H 22 8.710 8.710 8.759 -0.049 18952
1295 1 15 . 1 1 23 23 GLN N N 23 119.000 119.000 116.739 2.261 18952
1296 1 15 . 1 1 23 23 GLN H H 23 8.620 8.620 7.713 0.907 18952
1297 1 15 . 1 1 24 24 ALA N N 24 122.400 122.400 121.660 0.740 18952
1298 1 15 . 1 1 24 24 ALA H H 24 7.840 7.840 8.266 -0.426 18952
1299 1 15 . 1 1 26 26 GLN N N 26 118.340 118.340 119.837 -1.497 18952
1300 1 15 . 1 1 26 26 GLN H H 26 8.780 8.780 8.347 0.433 18952
1301 1 15 . 1 1 27 27 ASN N N 27 117.920 117.920 117.854 0.066 18952
1302 1 15 . 1 1 27 27 ASN H H 27 8.000 8.000 7.799 0.201 18952
1303 1 15 . 1 1 28 28 LEU N N 28 121.400 121.400 120.542 0.858 18952
1304 1 15 . 1 1 28 28 LEU H H 28 8.210 8.210 8.279 -0.069 18952
1305 1 15 . 1 1 29 29 GLN N N 29 117.930 117.930 119.044 -1.114 18952
1306 1 15 . 1 1 29 29 GLN H H 29 8.130 8.130 8.675 -0.545 18952
1307 1 15 . 1 1 30 30 ASN N N 30 117.040 117.040 119.773 -2.733 18952
1308 1 15 . 1 1 30 30 ASN H H 30 8.100 8.100 8.371 -0.271 18952
1309 1 15 . 1 1 31 31 LEU N N 31 121.200 121.200 121.308 -0.108 18952
1310 1 15 . 1 1 31 31 LEU H H 31 8.060 8.060 7.900 0.160 18952
1311 1 15 . 1 1 32 32 PHE N N 32 118.310 118.310 118.594 -0.284 18952
1312 1 15 . 1 1 32 32 PHE H H 32 8.450 8.450 7.715 0.735 18952
1313 1 15 . 1 1 33 33 ILE N N 33 119.700 119.700 119.685 0.015 18952
1314 1 15 . 1 1 33 33 ILE H H 33 8.420 8.420 9.007 -0.587 18952
1315 1 15 . 1 1 34 34 ASN N N 34 117.580 117.580 118.574 -0.994 18952
1316 1 15 . 1 1 34 34 ASN H H 34 8.030 8.030 8.149 -0.119 18952
1317 1 15 . 1 1 35 35 PHE N N 35 119.400 119.400 121.526 -2.126 18952
1318 1 15 . 1 1 35 35 PHE H H 35 8.570 8.570 8.503 0.067 18952
1319 1 15 . 1 1 36 36 CYS N N 36 116.680 116.680 118.727 -2.047 18952
1320 1 15 . 1 1 36 36 CYS H H 36 8.160 8.160 8.319 -0.159 18952
1321 1 15 . 1 1 37 37 LEU N N 37 118.190 118.190 121.010 -2.820 18952
1322 1 15 . 1 1 37 37 LEU H H 37 8.170 8.170 8.598 -0.428 18952
1323 1 15 . 1 1 38 38 ILE N N 38 119.700 119.700 119.043 0.657 18952
1324 1 15 . 1 1 38 38 ILE H H 38 8.390 8.390 8.320 0.070 18952
1325 1 15 . 1 1 39 39 LEU N N 39 119.400 119.400 120.226 -0.826 18952
1326 1 15 . 1 1 39 39 LEU H H 39 7.990 7.990 7.662 0.328 18952
1327 1 15 . 1 1 40 40 ILE N N 40 119.250 119.250 119.644 -0.394 18952
1328 1 15 . 1 1 40 40 ILE H H 40 8.140 8.140 8.255 -0.115 18952
1329 1 15 . 1 1 41 41 CYS N N 41 117.800 117.800 119.061 -1.261 18952
1330 1 15 . 1 1 41 41 CYS H H 41 7.980 7.980 8.445 -0.465 18952
1331 1 15 . 1 1 42 42 LEU N N 42 117.900 117.900 119.892 -1.992 18952
1332 1 15 . 1 1 42 42 LEU H H 42 8.290 8.290 8.236 0.054 18952
1333 1 15 . 1 1 43 43 LEU N N 43 119.700 119.700 120.380 -0.680 18952
1334 1 15 . 1 1 43 43 LEU H H 43 8.390 8.390 8.170 0.220 18952
1335 1 15 . 1 1 44 44 LEU N N 44 117.800 117.800 119.697 -1.897 18952
1336 1 15 . 1 1 44 44 LEU H H 44 8.180 8.180 8.485 -0.305 18952
1337 1 15 . 1 1 45 45 ILE N N 45 117.690 117.690 119.222 -1.532 18952
1338 1 15 . 1 1 45 45 ILE H H 45 8.170 8.170 7.697 0.473 18952
1339 1 15 . 1 1 46 46 CYS N N 46 117.020 117.020 118.702 -1.682 18952
1340 1 15 . 1 1 46 46 CYS H H 46 8.150 8.150 7.766 0.384 18952
1341 1 15 . 1 1 47 47 ILE N N 47 117.300 117.300 121.384 -4.084 18952
1342 1 15 . 1 1 47 47 ILE H H 47 8.230 8.230 8.011 0.219 18952
1343 1 15 . 1 1 48 48 ILE N N 48 117.690 117.690 120.676 -2.986 18952
1344 1 15 . 1 1 48 48 ILE H H 48 8.200 8.200 8.334 -0.134 18952
1345 1 15 . 1 1 49 49 VAL N N 49 115.700 115.700 120.214 -4.514 18952
1346 1 15 . 1 1 49 49 VAL H H 49 8.340 8.340 8.344 -0.004 18952
1347 1 15 . 1 1 50 50 MET N N 50 115.500 115.500 118.234 -2.734 18952
1348 1 15 . 1 1 50 50 MET H H 50 7.920 7.920 8.150 -0.230 18952
1349 1 15 . 1 1 51 51 LEU N N 51 118.100 118.100 119.983 -1.883 18952
1350 1 15 . 1 1 51 51 LEU H H 51 7.880 7.880 7.917 -0.037 18952
1351 1 16 . 1 1 2 2 GLU N N 2 121.800 121.800 122.770 -0.970 18952
1352 1 16 . 1 1 2 2 GLU H H 2 9.240 9.240 8.926 0.314 18952
1353 1 16 . 1 1 3 3 LYS N N 3 120.200 120.200 119.869 0.331 18952
1354 1 16 . 1 1 3 3 LYS H H 3 8.270 8.270 8.366 -0.096 18952
1355 1 16 . 1 1 4 4 VAL N N 4 117.600 117.600 120.458 -2.858 18952
1356 1 16 . 1 1 4 4 VAL H H 4 7.750 7.750 7.896 -0.146 18952
1357 1 16 . 1 1 5 5 GLN N N 5 120.800 120.800 119.247 1.553 18952
1358 1 16 . 1 1 5 5 GLN H H 5 8.190 8.190 8.650 -0.460 18952
1359 1 16 . 1 1 6 6 TYR N N 6 119.300 119.300 122.206 -2.906 18952
1360 1 16 . 1 1 6 6 TYR H H 6 8.020 8.020 8.420 -0.400 18952
1361 1 16 . 1 1 7 7 LEU N N 7 120.400 120.400 119.893 0.507 18952
1362 1 16 . 1 1 7 7 LEU H H 7 8.110 8.110 8.533 -0.423 18952
1363 1 16 . 1 1 8 8 THR N N 8 111.200 111.200 116.120 -4.920 18952
1364 1 16 . 1 1 8 8 THR H H 8 7.890 7.890 8.390 -0.500 18952
1365 1 16 . 1 1 9 9 ARG N N 9 120.700 120.700 121.651 -0.951 18952
1366 1 16 . 1 1 9 9 ARG H H 9 8.220 8.220 8.294 -0.074 18952
1367 1 16 . 1 1 10 10 SER N N 10 114.500 114.500 115.120 -0.620 18952
1368 1 16 . 1 1 10 10 SER H H 10 7.990 7.990 8.160 -0.170 18952
1369 1 16 . 1 1 11 11 ALA N N 11 124.000 124.000 124.923 -0.923 18952
1370 1 16 . 1 1 11 11 ALA H H 11 8.060 8.060 8.197 -0.137 18952
1371 1 16 . 1 1 12 12 ILE N N 12 115.900 115.900 118.618 -2.718 18952
1372 1 16 . 1 1 12 12 ILE H H 12 7.780 7.780 8.093 -0.313 18952
1373 1 16 . 1 1 13 13 ARG N N 13 121.100 121.100 118.679 2.421 18952
1374 1 16 . 1 1 13 13 ARG H H 13 7.910 7.910 7.971 -0.061 18952
1375 1 16 . 1 1 14 14 ARG N N 14 120.270 120.270 119.401 0.869 18952
1376 1 16 . 1 1 14 14 ARG H H 14 8.060 8.060 8.113 -0.053 18952
1377 1 16 . 1 1 18 18 ILE N N 18 122.100 122.100 120.055 2.045 18952
1378 1 16 . 1 1 18 18 ILE H H 18 7.720 7.720 8.007 -0.287 18952
1379 1 16 . 1 1 19 19 GLU N N 19 124.800 124.800 123.209 1.591 18952
1380 1 16 . 1 1 19 19 GLU H H 19 8.250 8.250 7.860 0.390 18952
1381 1 16 . 1 1 20 20 MET N N 20 122.700 122.700 122.822 -0.122 18952
1382 1 16 . 1 1 20 20 MET H H 20 8.480 8.480 8.157 0.323 18952
1383 1 16 . 1 1 22 22 GLN N N 22 121.600 121.600 117.820 3.780 18952
1384 1 16 . 1 1 22 22 GLN H H 22 8.710 8.710 8.281 0.429 18952
1385 1 16 . 1 1 23 23 GLN N N 23 119.000 119.000 118.382 0.618 18952
1386 1 16 . 1 1 23 23 GLN H H 23 8.620 8.620 7.494 1.126 18952
1387 1 16 . 1 1 24 24 ALA N N 24 122.400 122.400 123.702 -1.302 18952
1388 1 16 . 1 1 24 24 ALA H H 24 7.840 7.840 7.532 0.308 18952
1389 1 16 . 1 1 26 26 GLN N N 26 118.340 118.340 119.565 -1.225 18952
1390 1 16 . 1 1 26 26 GLN H H 26 8.780 8.780 8.730 0.050 18952
1391 1 16 . 1 1 27 27 ASN N N 27 117.920 117.920 118.210 -0.290 18952
1392 1 16 . 1 1 27 27 ASN H H 27 8.000 8.000 8.388 -0.388 18952
1393 1 16 . 1 1 28 28 LEU N N 28 121.400 121.400 119.325 2.075 18952
1394 1 16 . 1 1 28 28 LEU H H 28 8.210 8.210 8.079 0.131 18952
1395 1 16 . 1 1 29 29 GLN N N 29 117.930 117.930 118.877 -0.947 18952
1396 1 16 . 1 1 29 29 GLN H H 29 8.130 8.130 7.557 0.573 18952
1397 1 16 . 1 1 30 30 ASN N N 30 117.040 117.040 119.896 -2.856 18952
1398 1 16 . 1 1 30 30 ASN H H 30 8.100 8.100 8.320 -0.220 18952
1399 1 16 . 1 1 31 31 LEU N N 31 121.200 121.200 121.376 -0.176 18952
1400 1 16 . 1 1 31 31 LEU H H 31 8.060 8.060 7.744 0.316 18952
1401 1 16 . 1 1 32 32 PHE N N 32 118.310 118.310 118.503 -0.193 18952
1402 1 16 . 1 1 32 32 PHE H H 32 8.450 8.450 7.409 1.041 18952
1403 1 16 . 1 1 33 33 ILE N N 33 119.700 119.700 119.779 -0.079 18952
1404 1 16 . 1 1 33 33 ILE H H 33 8.420 8.420 8.988 -0.568 18952
1405 1 16 . 1 1 34 34 ASN N N 34 117.580 117.580 118.608 -1.028 18952
1406 1 16 . 1 1 34 34 ASN H H 34 8.030 8.030 8.393 -0.363 18952
1407 1 16 . 1 1 35 35 PHE N N 35 119.400 119.400 121.590 -2.190 18952
1408 1 16 . 1 1 35 35 PHE H H 35 8.570 8.570 8.479 0.091 18952
1409 1 16 . 1 1 36 36 CYS N N 36 116.680 116.680 118.805 -2.125 18952
1410 1 16 . 1 1 36 36 CYS H H 36 8.160 8.160 8.235 -0.075 18952
1411 1 16 . 1 1 37 37 LEU N N 37 118.190 118.190 121.037 -2.847 18952
1412 1 16 . 1 1 37 37 LEU H H 37 8.170 8.170 8.561 -0.391 18952
1413 1 16 . 1 1 38 38 ILE N N 38 119.700 119.700 119.388 0.312 18952
1414 1 16 . 1 1 38 38 ILE H H 38 8.390 8.390 8.319 0.071 18952
1415 1 16 . 1 1 39 39 LEU N N 39 119.400 119.400 120.313 -0.913 18952
1416 1 16 . 1 1 39 39 LEU H H 39 7.990 7.990 7.857 0.133 18952
1417 1 16 . 1 1 40 40 ILE N N 40 119.250 119.250 119.935 -0.685 18952
1418 1 16 . 1 1 40 40 ILE H H 40 8.140 8.140 8.395 -0.255 18952
1419 1 16 . 1 1 41 41 CYS N N 41 117.800 117.800 119.127 -1.327 18952
1420 1 16 . 1 1 41 41 CYS H H 41 7.980 7.980 8.544 -0.564 18952
1421 1 16 . 1 1 42 42 LEU N N 42 117.900 117.900 119.863 -1.963 18952
1422 1 16 . 1 1 42 42 LEU H H 42 8.290 8.290 8.248 0.042 18952
1423 1 16 . 1 1 43 43 LEU N N 43 119.700 119.700 120.729 -1.029 18952
1424 1 16 . 1 1 43 43 LEU H H 43 8.390 8.390 7.956 0.434 18952
1425 1 16 . 1 1 44 44 LEU N N 44 117.800 117.800 119.879 -2.079 18952
1426 1 16 . 1 1 44 44 LEU H H 44 8.180 8.180 8.583 -0.403 18952
1427 1 16 . 1 1 45 45 ILE N N 45 117.690 117.690 119.372 -1.682 18952
1428 1 16 . 1 1 45 45 ILE H H 45 8.170 8.170 7.661 0.509 18952
1429 1 16 . 1 1 46 46 CYS N N 46 117.020 117.020 118.684 -1.664 18952
1430 1 16 . 1 1 46 46 CYS H H 46 8.150 8.150 7.755 0.395 18952
1431 1 16 . 1 1 47 47 ILE N N 47 117.300 117.300 121.738 -4.438 18952
1432 1 16 . 1 1 47 47 ILE H H 47 8.230 8.230 8.597 -0.367 18952
1433 1 16 . 1 1 48 48 ILE N N 48 117.690 117.690 120.336 -2.646 18952
1434 1 16 . 1 1 48 48 ILE H H 48 8.200 8.200 8.141 0.059 18952
1435 1 16 . 1 1 49 49 VAL N N 49 115.700 115.700 120.180 -4.480 18952
1436 1 16 . 1 1 49 49 VAL H H 49 8.340 8.340 8.067 0.273 18952
1437 1 16 . 1 1 50 50 MET N N 50 115.500 115.500 118.312 -2.812 18952
1438 1 16 . 1 1 50 50 MET H H 50 7.920 7.920 8.201 -0.281 18952
1439 1 16 . 1 1 51 51 LEU N N 51 118.100 118.100 120.025 -1.925 18952
1440 1 16 . 1 1 51 51 LEU H H 51 7.880 7.880 7.843 0.037 18952
1441 1 17 . 1 1 2 2 GLU N N 2 121.800 121.800 122.786 -0.986 18952
1442 1 17 . 1 1 2 2 GLU H H 2 9.240 9.240 8.923 0.317 18952
1443 1 17 . 1 1 3 3 LYS N N 3 120.200 120.200 119.785 0.415 18952
1444 1 17 . 1 1 3 3 LYS H H 3 8.270 8.270 8.373 -0.103 18952
1445 1 17 . 1 1 4 4 VAL N N 4 117.600 117.600 120.731 -3.131 18952
1446 1 17 . 1 1 4 4 VAL H H 4 7.750 7.750 7.898 -0.148 18952
1447 1 17 . 1 1 5 5 GLN N N 5 120.800 120.800 119.348 1.452 18952
1448 1 17 . 1 1 5 5 GLN H H 5 8.190 8.190 8.669 -0.479 18952
1449 1 17 . 1 1 6 6 TYR N N 6 119.300 119.300 122.201 -2.901 18952
1450 1 17 . 1 1 6 6 TYR H H 6 8.020 8.020 8.434 -0.414 18952
1451 1 17 . 1 1 7 7 LEU N N 7 120.400 120.400 119.786 0.614 18952
1452 1 17 . 1 1 7 7 LEU H H 7 8.110 8.110 8.530 -0.420 18952
1453 1 17 . 1 1 8 8 THR N N 8 111.200 111.200 116.320 -5.120 18952
1454 1 17 . 1 1 8 8 THR H H 8 7.890 7.890 8.311 -0.421 18952
1455 1 17 . 1 1 9 9 ARG N N 9 120.700 120.700 121.652 -0.952 18952
1456 1 17 . 1 1 9 9 ARG H H 9 8.220 8.220 8.279 -0.059 18952
1457 1 17 . 1 1 10 10 SER N N 10 114.500 114.500 115.369 -0.869 18952
1458 1 17 . 1 1 10 10 SER H H 10 7.990 7.990 8.165 -0.175 18952
1459 1 17 . 1 1 11 11 ALA N N 11 124.000 124.000 124.963 -0.963 18952
1460 1 17 . 1 1 11 11 ALA H H 11 8.060 8.060 8.094 -0.034 18952
1461 1 17 . 1 1 12 12 ILE N N 12 115.900 115.900 118.307 -2.407 18952
1462 1 17 . 1 1 12 12 ILE H H 12 7.780 7.780 8.029 -0.249 18952
1463 1 17 . 1 1 13 13 ARG N N 13 121.100 121.100 120.038 1.062 18952
1464 1 17 . 1 1 13 13 ARG H H 13 7.910 7.910 7.968 -0.058 18952
1465 1 17 . 1 1 14 14 ARG N N 14 120.270 120.270 118.025 2.245 18952
1466 1 17 . 1 1 14 14 ARG H H 14 8.060 8.060 7.998 0.062 18952
1467 1 17 . 1 1 18 18 ILE N N 18 122.100 122.100 123.602 -1.502 18952
1468 1 17 . 1 1 18 18 ILE H H 18 7.720 7.720 7.601 0.119 18952
1469 1 17 . 1 1 19 19 GLU N N 19 124.800 124.800 127.773 -2.973 18952
1470 1 17 . 1 1 19 19 GLU H H 19 8.250 8.250 8.577 -0.327 18952
1471 1 17 . 1 1 20 20 MET N N 20 122.700 122.700 123.312 -0.612 18952
1472 1 17 . 1 1 20 20 MET H H 20 8.480 8.480 8.503 -0.023 18952
1473 1 17 . 1 1 22 22 GLN N N 22 121.600 121.600 116.450 5.150 18952
1474 1 17 . 1 1 22 22 GLN H H 22 8.710 8.710 8.226 0.484 18952
1475 1 17 . 1 1 23 23 GLN N N 23 119.000 119.000 118.850 0.150 18952
1476 1 17 . 1 1 23 23 GLN H H 23 8.620 8.620 7.373 1.247 18952
1477 1 17 . 1 1 24 24 ALA N N 24 122.400 122.400 126.587 -4.187 18952
1478 1 17 . 1 1 24 24 ALA H H 24 7.840 7.840 7.697 0.143 18952
1479 1 17 . 1 1 26 26 GLN N N 26 118.340 118.340 115.846 2.494 18952
1480 1 17 . 1 1 26 26 GLN H H 26 8.780 8.780 8.660 0.120 18952
1481 1 17 . 1 1 27 27 ASN N N 27 117.920 117.920 117.862 0.058 18952
1482 1 17 . 1 1 27 27 ASN H H 27 8.000 8.000 7.889 0.111 18952
1483 1 17 . 1 1 28 28 LEU N N 28 121.400 121.400 120.377 1.023 18952
1484 1 17 . 1 1 28 28 LEU H H 28 8.210 8.210 8.180 0.030 18952
1485 1 17 . 1 1 29 29 GLN N N 29 117.930 117.930 118.999 -1.069 18952
1486 1 17 . 1 1 29 29 GLN H H 29 8.130 8.130 8.197 -0.067 18952
1487 1 17 . 1 1 30 30 ASN N N 30 117.040 117.040 119.328 -2.288 18952
1488 1 17 . 1 1 30 30 ASN H H 30 8.100 8.100 7.619 0.481 18952
1489 1 17 . 1 1 31 31 LEU N N 31 121.200 121.200 121.242 -0.042 18952
1490 1 17 . 1 1 31 31 LEU H H 31 8.060 8.060 7.912 0.148 18952
1491 1 17 . 1 1 32 32 PHE N N 32 118.310 118.310 117.914 0.396 18952
1492 1 17 . 1 1 32 32 PHE H H 32 8.450 8.450 7.752 0.698 18952
1493 1 17 . 1 1 33 33 ILE N N 33 119.700 119.700 119.864 -0.164 18952
1494 1 17 . 1 1 33 33 ILE H H 33 8.420 8.420 8.754 -0.334 18952
1495 1 17 . 1 1 34 34 ASN N N 34 117.580 117.580 118.339 -0.759 18952
1496 1 17 . 1 1 34 34 ASN H H 34 8.030 8.030 8.269 -0.239 18952
1497 1 17 . 1 1 35 35 PHE N N 35 119.400 119.400 121.480 -2.080 18952
1498 1 17 . 1 1 35 35 PHE H H 35 8.570 8.570 7.810 0.760 18952
1499 1 17 . 1 1 36 36 CYS N N 36 116.680 116.680 118.340 -1.660 18952
1500 1 17 . 1 1 36 36 CYS H H 36 8.160 8.160 7.874 0.286 18952
1501 1 17 . 1 1 37 37 LEU N N 37 118.190 118.190 121.497 -3.307 18952
1502 1 17 . 1 1 37 37 LEU H H 37 8.170 8.170 8.358 -0.188 18952
1503 1 17 . 1 1 38 38 ILE N N 38 119.700 119.700 119.635 0.065 18952
1504 1 17 . 1 1 38 38 ILE H H 38 8.390 8.390 8.505 -0.115 18952
1505 1 17 . 1 1 39 39 LEU N N 39 119.400 119.400 120.031 -0.631 18952
1506 1 17 . 1 1 39 39 LEU H H 39 7.990 7.990 7.735 0.255 18952
1507 1 17 . 1 1 40 40 ILE N N 40 119.250 119.250 119.464 -0.214 18952
1508 1 17 . 1 1 40 40 ILE H H 40 8.140 8.140 7.754 0.386 18952
1509 1 17 . 1 1 41 41 CYS N N 41 117.800 117.800 118.884 -1.084 18952
1510 1 17 . 1 1 41 41 CYS H H 41 7.980 7.980 8.435 -0.455 18952
1511 1 17 . 1 1 42 42 LEU N N 42 117.900 117.900 119.929 -2.029 18952
1512 1 17 . 1 1 42 42 LEU H H 42 8.290 8.290 8.329 -0.039 18952
1513 1 17 . 1 1 43 43 LEU N N 43 119.700 119.700 119.927 -0.227 18952
1514 1 17 . 1 1 43 43 LEU H H 43 8.390 8.390 7.981 0.409 18952
1515 1 17 . 1 1 44 44 LEU N N 44 117.800 117.800 120.489 -2.689 18952
1516 1 17 . 1 1 44 44 LEU H H 44 8.180 8.180 8.097 0.083 18952
1517 1 17 . 1 1 45 45 ILE N N 45 117.690 117.690 120.669 -2.979 18952
1518 1 17 . 1 1 45 45 ILE H H 45 8.170 8.170 7.988 0.182 18952
1519 1 17 . 1 1 46 46 CYS N N 46 117.020 117.020 118.313 -1.293 18952
1520 1 17 . 1 1 46 46 CYS H H 46 8.150 8.150 7.671 0.479 18952
1521 1 17 . 1 1 47 47 ILE N N 47 117.300 117.300 120.959 -3.659 18952
1522 1 17 . 1 1 47 47 ILE H H 47 8.230 8.230 7.463 0.767 18952
1523 1 17 . 1 1 48 48 ILE N N 48 117.690 117.690 120.631 -2.941 18952
1524 1 17 . 1 1 48 48 ILE H H 48 8.200 8.200 8.414 -0.214 18952
1525 1 17 . 1 1 49 49 VAL N N 49 115.700 115.700 120.416 -4.716 18952
1526 1 17 . 1 1 49 49 VAL H H 49 8.340 8.340 8.395 -0.055 18952
1527 1 17 . 1 1 50 50 MET N N 50 115.500 115.500 118.003 -2.503 18952
1528 1 17 . 1 1 50 50 MET H H 50 7.920 7.920 8.103 -0.183 18952
1529 1 17 . 1 1 51 51 LEU N N 51 118.100 118.100 119.285 -1.185 18952
1530 1 17 . 1 1 51 51 LEU H H 51 7.880 7.880 7.974 -0.094 18952
1531 1 18 . 1 1 2 2 GLU N N 2 121.800 121.800 121.258 0.542 18952
1532 1 18 . 1 1 2 2 GLU H H 2 9.240 9.240 8.726 0.514 18952
1533 1 18 . 1 1 3 3 LYS N N 3 120.200 120.200 119.996 0.204 18952
1534 1 18 . 1 1 3 3 LYS H H 3 8.270 8.270 8.366 -0.096 18952
1535 1 18 . 1 1 4 4 VAL N N 4 117.600 117.600 120.420 -2.820 18952
1536 1 18 . 1 1 4 4 VAL H H 4 7.750 7.750 7.902 -0.152 18952
1537 1 18 . 1 1 5 5 GLN N N 5 120.800 120.800 119.374 1.426 18952
1538 1 18 . 1 1 5 5 GLN H H 5 8.190 8.190 8.566 -0.376 18952
1539 1 18 . 1 1 6 6 TYR N N 6 119.300 119.300 122.221 -2.921 18952
1540 1 18 . 1 1 6 6 TYR H H 6 8.020 8.020 8.321 -0.301 18952
1541 1 18 . 1 1 7 7 LEU N N 7 120.400 120.400 119.895 0.505 18952
1542 1 18 . 1 1 7 7 LEU H H 7 8.110 8.110 8.466 -0.356 18952
1543 1 18 . 1 1 8 8 THR N N 8 111.200 111.200 115.981 -4.781 18952
1544 1 18 . 1 1 8 8 THR H H 8 7.890 7.890 8.340 -0.450 18952
1545 1 18 . 1 1 9 9 ARG N N 9 120.700 120.700 121.616 -0.916 18952
1546 1 18 . 1 1 9 9 ARG H H 9 8.220 8.220 8.162 0.058 18952
1547 1 18 . 1 1 10 10 SER N N 10 114.500 114.500 115.155 -0.655 18952
1548 1 18 . 1 1 10 10 SER H H 10 7.990 7.990 8.153 -0.163 18952
1549 1 18 . 1 1 11 11 ALA N N 11 124.000 124.000 124.871 -0.871 18952
1550 1 18 . 1 1 11 11 ALA H H 11 8.060 8.060 8.152 -0.092 18952
1551 1 18 . 1 1 12 12 ILE N N 12 115.900 115.900 118.502 -2.602 18952
1552 1 18 . 1 1 12 12 ILE H H 12 7.780 7.780 7.968 -0.188 18952
1553 1 18 . 1 1 13 13 ARG N N 13 121.100 121.100 118.551 2.549 18952
1554 1 18 . 1 1 13 13 ARG H H 13 7.910 7.910 7.928 -0.018 18952
1555 1 18 . 1 1 14 14 ARG N N 14 120.270 120.270 118.064 2.206 18952
1556 1 18 . 1 1 14 14 ARG H H 14 8.060 8.060 7.899 0.161 18952
1557 1 18 . 1 1 18 18 ILE N N 18 122.100 122.100 119.957 2.143 18952
1558 1 18 . 1 1 18 18 ILE H H 18 7.720 7.720 8.202 -0.482 18952
1559 1 18 . 1 1 19 19 GLU N N 19 124.800 124.800 127.774 -2.974 18952
1560 1 18 . 1 1 19 19 GLU H H 19 8.250 8.250 8.766 -0.516 18952
1561 1 18 . 1 1 20 20 MET N N 20 122.700 122.700 118.394 4.306 18952
1562 1 18 . 1 1 20 20 MET H H 20 8.480 8.480 8.181 0.299 18952
1563 1 18 . 1 1 22 22 GLN N N 22 121.600 121.600 118.858 2.742 18952
1564 1 18 . 1 1 22 22 GLN H H 22 8.710 8.710 8.678 0.032 18952
1565 1 18 . 1 1 23 23 GLN N N 23 119.000 119.000 116.807 2.193 18952
1566 1 18 . 1 1 23 23 GLN H H 23 8.620 8.620 8.613 0.007 18952
1567 1 18 . 1 1 24 24 ALA N N 24 122.400 122.400 121.815 0.585 18952
1568 1 18 . 1 1 24 24 ALA H H 24 7.840 7.840 7.456 0.384 18952
1569 1 18 . 1 1 26 26 GLN N N 26 118.340 118.340 120.673 -2.333 18952
1570 1 18 . 1 1 26 26 GLN H H 26 8.780 8.780 8.751 0.029 18952
1571 1 18 . 1 1 27 27 ASN N N 27 117.920 117.920 117.860 0.060 18952
1572 1 18 . 1 1 27 27 ASN H H 27 8.000 8.000 8.262 -0.262 18952
1573 1 18 . 1 1 28 28 LEU N N 28 121.400 121.400 119.494 1.906 18952
1574 1 18 . 1 1 28 28 LEU H H 28 8.210 8.210 7.840 0.370 18952
1575 1 18 . 1 1 29 29 GLN N N 29 117.930 117.930 118.407 -0.477 18952
1576 1 18 . 1 1 29 29 GLN H H 29 8.130 8.130 7.833 0.297 18952
1577 1 18 . 1 1 30 30 ASN N N 30 117.040 117.040 118.425 -1.385 18952
1578 1 18 . 1 1 30 30 ASN H H 30 8.100 8.100 7.451 0.649 18952
1579 1 18 . 1 1 31 31 LEU N N 31 121.200 121.200 121.442 -0.242 18952
1580 1 18 . 1 1 31 31 LEU H H 31 8.060 8.060 7.162 0.898 18952
1581 1 18 . 1 1 32 32 PHE N N 32 118.310 118.310 117.795 0.515 18952
1582 1 18 . 1 1 32 32 PHE H H 32 8.450 8.450 7.021 1.429 18952
1583 1 18 . 1 1 33 33 ILE N N 33 119.700 119.700 119.794 -0.094 18952
1584 1 18 . 1 1 33 33 ILE H H 33 8.420 8.420 8.309 0.111 18952
1585 1 18 . 1 1 34 34 ASN N N 34 117.580 117.580 118.519 -0.939 18952
1586 1 18 . 1 1 34 34 ASN H H 34 8.030 8.030 8.243 -0.213 18952
1587 1 18 . 1 1 35 35 PHE N N 35 119.400 119.400 121.895 -2.495 18952
1588 1 18 . 1 1 35 35 PHE H H 35 8.570 8.570 8.392 0.178 18952
1589 1 18 . 1 1 36 36 CYS N N 36 116.680 116.680 118.329 -1.649 18952
1590 1 18 . 1 1 36 36 CYS H H 36 8.160 8.160 8.070 0.090 18952
1591 1 18 . 1 1 37 37 LEU N N 37 118.190 118.190 121.092 -2.902 18952
1592 1 18 . 1 1 37 37 LEU H H 37 8.170 8.170 8.131 0.039 18952
1593 1 18 . 1 1 38 38 ILE N N 38 119.700 119.700 119.311 0.389 18952
1594 1 18 . 1 1 38 38 ILE H H 38 8.390 8.390 8.559 -0.169 18952
1595 1 18 . 1 1 39 39 LEU N N 39 119.400 119.400 119.896 -0.496 18952
1596 1 18 . 1 1 39 39 LEU H H 39 7.990 7.990 7.728 0.262 18952
1597 1 18 . 1 1 40 40 ILE N N 40 119.250 119.250 119.954 -0.704 18952
1598 1 18 . 1 1 40 40 ILE H H 40 8.140 8.140 8.299 -0.159 18952
1599 1 18 . 1 1 41 41 CYS N N 41 117.800 117.800 118.955 -1.155 18952
1600 1 18 . 1 1 41 41 CYS H H 41 7.980 7.980 8.428 -0.448 18952
1601 1 18 . 1 1 42 42 LEU N N 42 117.900 117.900 119.889 -1.989 18952
1602 1 18 . 1 1 42 42 LEU H H 42 8.290 8.290 8.215 0.075 18952
1603 1 18 . 1 1 43 43 LEU N N 43 119.700 119.700 120.188 -0.488 18952
1604 1 18 . 1 1 43 43 LEU H H 43 8.390 8.390 8.058 0.332 18952
1605 1 18 . 1 1 44 44 LEU N N 44 117.800 117.800 120.596 -2.796 18952
1606 1 18 . 1 1 44 44 LEU H H 44 8.180 8.180 8.257 -0.077 18952
1607 1 18 . 1 1 45 45 ILE N N 45 117.690 117.690 119.971 -2.281 18952
1608 1 18 . 1 1 45 45 ILE H H 45 8.170 8.170 7.820 0.350 18952
1609 1 18 . 1 1 46 46 CYS N N 46 117.020 117.020 118.513 -1.493 18952
1610 1 18 . 1 1 46 46 CYS H H 46 8.150 8.150 7.800 0.350 18952
1611 1 18 . 1 1 47 47 ILE N N 47 117.300 117.300 121.358 -4.058 18952
1612 1 18 . 1 1 47 47 ILE H H 47 8.230 8.230 8.119 0.111 18952
1613 1 18 . 1 1 48 48 ILE N N 48 117.690 117.690 120.217 -2.527 18952
1614 1 18 . 1 1 48 48 ILE H H 48 8.200 8.200 8.034 0.166 18952
1615 1 18 . 1 1 49 49 VAL N N 49 115.700 115.700 120.544 -4.844 18952
1616 1 18 . 1 1 49 49 VAL H H 49 8.340 8.340 8.124 0.216 18952
1617 1 18 . 1 1 50 50 MET N N 50 115.500 115.500 117.688 -2.188 18952
1618 1 18 . 1 1 50 50 MET H H 50 7.920 7.920 8.218 -0.298 18952
1619 1 18 . 1 1 51 51 LEU N N 51 118.100 118.100 120.208 -2.108 18952
1620 1 18 . 1 1 51 51 LEU H H 51 7.880 7.880 7.704 0.176 18952
1621 1 19 . 1 1 2 2 GLU N N 2 121.800 121.800 122.769 -0.969 18952
1622 1 19 . 1 1 2 2 GLU H H 2 9.240 9.240 8.914 0.326 18952
1623 1 19 . 1 1 3 3 LYS N N 3 120.200 120.200 119.155 1.045 18952
1624 1 19 . 1 1 3 3 LYS H H 3 8.270 8.270 8.363 -0.093 18952
1625 1 19 . 1 1 4 4 VAL N N 4 117.600 117.600 120.389 -2.789 18952
1626 1 19 . 1 1 4 4 VAL H H 4 7.750 7.750 7.884 -0.134 18952
1627 1 19 . 1 1 5 5 GLN N N 5 120.800 120.800 118.966 1.834 18952
1628 1 19 . 1 1 5 5 GLN H H 5 8.190 8.190 8.573 -0.383 18952
1629 1 19 . 1 1 6 6 TYR N N 6 119.300 119.300 122.772 -3.472 18952
1630 1 19 . 1 1 6 6 TYR H H 6 8.020 8.020 8.417 -0.397 18952
1631 1 19 . 1 1 7 7 LEU N N 7 120.400 120.400 119.567 0.833 18952
1632 1 19 . 1 1 7 7 LEU H H 7 8.110 8.110 8.373 -0.263 18952
1633 1 19 . 1 1 8 8 THR N N 8 111.200 111.200 116.015 -4.815 18952
1634 1 19 . 1 1 8 8 THR H H 8 7.890 7.890 8.111 -0.221 18952
1635 1 19 . 1 1 9 9 ARG N N 9 120.700 120.700 121.638 -0.938 18952
1636 1 19 . 1 1 9 9 ARG H H 9 8.220 8.220 8.406 -0.186 18952
1637 1 19 . 1 1 10 10 SER N N 10 114.500 114.500 115.226 -0.726 18952
1638 1 19 . 1 1 10 10 SER H H 10 7.990 7.990 8.164 -0.174 18952
1639 1 19 . 1 1 11 11 ALA N N 11 124.000 124.000 124.774 -0.774 18952
1640 1 19 . 1 1 11 11 ALA H H 11 8.060 8.060 8.026 0.034 18952
1641 1 19 . 1 1 12 12 ILE N N 12 115.900 115.900 118.560 -2.660 18952
1642 1 19 . 1 1 12 12 ILE H H 12 7.780 7.780 7.846 -0.066 18952
1643 1 19 . 1 1 13 13 ARG N N 13 121.100 121.100 118.733 2.367 18952
1644 1 19 . 1 1 13 13 ARG H H 13 7.910 7.910 8.035 -0.125 18952
1645 1 19 . 1 1 14 14 ARG N N 14 120.270 120.270 118.564 1.706 18952
1646 1 19 . 1 1 14 14 ARG H H 14 8.060 8.060 7.961 0.099 18952
1647 1 19 . 1 1 18 18 ILE N N 18 122.100 122.100 120.352 1.748 18952
1648 1 19 . 1 1 18 18 ILE H H 18 7.720 7.720 8.376 -0.656 18952
1649 1 19 . 1 1 19 19 GLU N N 19 124.800 124.800 121.907 2.893 18952
1650 1 19 . 1 1 19 19 GLU H H 19 8.250 8.250 8.451 -0.201 18952
1651 1 19 . 1 1 20 20 MET N N 20 122.700 122.700 119.348 3.352 18952
1652 1 19 . 1 1 20 20 MET H H 20 8.480 8.480 8.282 0.198 18952
1653 1 19 . 1 1 22 22 GLN N N 22 121.600 121.600 120.111 1.489 18952
1654 1 19 . 1 1 22 22 GLN H H 22 8.710 8.710 8.612 0.098 18952
1655 1 19 . 1 1 23 23 GLN N N 23 119.000 119.000 118.646 0.354 18952
1656 1 19 . 1 1 23 23 GLN H H 23 8.620 8.620 8.281 0.339 18952
1657 1 19 . 1 1 24 24 ALA N N 24 122.400 122.400 120.372 2.028 18952
1658 1 19 . 1 1 24 24 ALA H H 24 7.840 7.840 7.434 0.406 18952
1659 1 19 . 1 1 26 26 GLN N N 26 118.340 118.340 119.199 -0.859 18952
1660 1 19 . 1 1 26 26 GLN H H 26 8.780 8.780 8.646 0.134 18952
1661 1 19 . 1 1 27 27 ASN N N 27 117.920 117.920 117.513 0.407 18952
1662 1 19 . 1 1 27 27 ASN H H 27 8.000 8.000 8.417 -0.417 18952
1663 1 19 . 1 1 28 28 LEU N N 28 121.400 121.400 120.823 0.577 18952
1664 1 19 . 1 1 28 28 LEU H H 28 8.210 8.210 7.277 0.933 18952
1665 1 19 . 1 1 29 29 GLN N N 29 117.930 117.930 118.929 -0.999 18952
1666 1 19 . 1 1 29 29 GLN H H 29 8.130 8.130 8.344 -0.214 18952
1667 1 19 . 1 1 30 30 ASN N N 30 117.040 117.040 119.703 -2.663 18952
1668 1 19 . 1 1 30 30 ASN H H 30 8.100 8.100 8.246 -0.146 18952
1669 1 19 . 1 1 31 31 LEU N N 31 121.200 121.200 121.332 -0.132 18952
1670 1 19 . 1 1 31 31 LEU H H 31 8.060 8.060 7.608 0.452 18952
1671 1 19 . 1 1 32 32 PHE N N 32 118.310 118.310 118.562 -0.252 18952
1672 1 19 . 1 1 32 32 PHE H H 32 8.450 8.450 7.567 0.883 18952
1673 1 19 . 1 1 33 33 ILE N N 33 119.700 119.700 120.013 -0.313 18952
1674 1 19 . 1 1 33 33 ILE H H 33 8.420 8.420 8.942 -0.522 18952
1675 1 19 . 1 1 34 34 ASN N N 34 117.580 117.580 118.288 -0.708 18952
1676 1 19 . 1 1 34 34 ASN H H 34 8.030 8.030 8.197 -0.167 18952
1677 1 19 . 1 1 35 35 PHE N N 35 119.400 119.400 121.325 -1.925 18952
1678 1 19 . 1 1 35 35 PHE H H 35 8.570 8.570 8.610 -0.040 18952
1679 1 19 . 1 1 36 36 CYS N N 36 116.680 116.680 118.454 -1.774 18952
1680 1 19 . 1 1 36 36 CYS H H 36 8.160 8.160 8.505 -0.345 18952
1681 1 19 . 1 1 37 37 LEU N N 37 118.190 118.190 120.718 -2.528 18952
1682 1 19 . 1 1 37 37 LEU H H 37 8.170 8.170 8.155 0.015 18952
1683 1 19 . 1 1 38 38 ILE N N 38 119.700 119.700 118.503 1.197 18952
1684 1 19 . 1 1 38 38 ILE H H 38 8.390 8.390 8.028 0.362 18952
1685 1 19 . 1 1 39 39 LEU N N 39 119.400 119.400 118.995 0.405 18952
1686 1 19 . 1 1 39 39 LEU H H 39 7.990 7.990 7.945 0.045 18952
1687 1 19 . 1 1 40 40 ILE N N 40 119.250 119.250 119.535 -0.285 18952
1688 1 19 . 1 1 40 40 ILE H H 40 8.140 8.140 8.192 -0.052 18952
1689 1 19 . 1 1 41 41 CYS N N 41 117.800 117.800 118.539 -0.739 18952
1690 1 19 . 1 1 41 41 CYS H H 41 7.980 7.980 8.103 -0.123 18952
1691 1 19 . 1 1 42 42 LEU N N 42 117.900 117.900 120.053 -2.153 18952
1692 1 19 . 1 1 42 42 LEU H H 42 8.290 8.290 8.094 0.196 18952
1693 1 19 . 1 1 43 43 LEU N N 43 119.700 119.700 120.066 -0.366 18952
1694 1 19 . 1 1 43 43 LEU H H 43 8.390 8.390 8.006 0.384 18952
1695 1 19 . 1 1 44 44 LEU N N 44 117.800 117.800 120.578 -2.778 18952
1696 1 19 . 1 1 44 44 LEU H H 44 8.180 8.180 8.325 -0.145 18952
1697 1 19 . 1 1 45 45 ILE N N 45 117.690 117.690 120.177 -2.487 18952
1698 1 19 . 1 1 45 45 ILE H H 45 8.170 8.170 7.713 0.457 18952
1699 1 19 . 1 1 46 46 CYS N N 46 117.020 117.020 118.316 -1.296 18952
1700 1 19 . 1 1 46 46 CYS H H 46 8.150 8.150 7.619 0.531 18952
1701 1 19 . 1 1 47 47 ILE N N 47 117.300 117.300 120.858 -3.558 18952
1702 1 19 . 1 1 47 47 ILE H H 47 8.230 8.230 7.760 0.470 18952
1703 1 19 . 1 1 48 48 ILE N N 48 117.690 117.690 120.035 -2.345 18952
1704 1 19 . 1 1 48 48 ILE H H 48 8.200 8.200 8.090 0.110 18952
1705 1 19 . 1 1 49 49 VAL N N 49 115.700 115.700 120.719 -5.019 18952
1706 1 19 . 1 1 49 49 VAL H H 49 8.340 8.340 8.363 -0.023 18952
1707 1 19 . 1 1 50 50 MET N N 50 115.500 115.500 118.993 -3.493 18952
1708 1 19 . 1 1 50 50 MET H H 50 7.920 7.920 7.665 0.255 18952
1709 1 19 . 1 1 51 51 LEU N N 51 118.100 118.100 118.569 -0.469 18952
1710 1 19 . 1 1 51 51 LEU H H 51 7.880 7.880 7.712 0.168 18952
1711 1 20 . 1 1 2 2 GLU N N 2 121.800 121.800 121.335 0.465 18952
1712 1 20 . 1 1 2 2 GLU H H 2 9.240 9.240 8.734 0.506 18952
1713 1 20 . 1 1 3 3 LYS N N 3 120.200 120.200 120.092 0.108 18952
1714 1 20 . 1 1 3 3 LYS H H 3 8.270 8.270 8.361 -0.091 18952
1715 1 20 . 1 1 4 4 VAL N N 4 117.600 117.600 120.447 -2.847 18952
1716 1 20 . 1 1 4 4 VAL H H 4 7.750 7.750 7.933 -0.183 18952
1717 1 20 . 1 1 5 5 GLN N N 5 120.800 120.800 119.127 1.673 18952
1718 1 20 . 1 1 5 5 GLN H H 5 8.190 8.190 8.552 -0.362 18952
1719 1 20 . 1 1 6 6 TYR N N 6 119.300 119.300 122.355 -3.055 18952
1720 1 20 . 1 1 6 6 TYR H H 6 8.020 8.020 8.506 -0.486 18952
1721 1 20 . 1 1 7 7 LEU N N 7 120.400 120.400 119.753 0.647 18952
1722 1 20 . 1 1 7 7 LEU H H 7 8.110 8.110 8.460 -0.350 18952
1723 1 20 . 1 1 8 8 THR N N 8 111.200 111.200 116.035 -4.835 18952
1724 1 20 . 1 1 8 8 THR H H 8 7.890 7.890 8.405 -0.515 18952
1725 1 20 . 1 1 9 9 ARG N N 9 120.700 120.700 121.803 -1.103 18952
1726 1 20 . 1 1 9 9 ARG H H 9 8.220 8.220 8.479 -0.259 18952
1727 1 20 . 1 1 10 10 SER N N 10 114.500 114.500 115.303 -0.803 18952
1728 1 20 . 1 1 10 10 SER H H 10 7.990 7.990 8.256 -0.266 18952
1729 1 20 . 1 1 11 11 ALA N N 11 124.000 124.000 124.935 -0.935 18952
1730 1 20 . 1 1 11 11 ALA H H 11 8.060 8.060 8.042 0.018 18952
1731 1 20 . 1 1 12 12 ILE N N 12 115.900 115.900 119.192 -3.292 18952
1732 1 20 . 1 1 12 12 ILE H H 12 7.780 7.780 8.030 -0.250 18952
1733 1 20 . 1 1 13 13 ARG N N 13 121.100 121.100 120.139 0.961 18952
1734 1 20 . 1 1 13 13 ARG H H 13 7.910 7.910 8.361 -0.451 18952
1735 1 20 . 1 1 14 14 ARG N N 14 120.270 120.270 119.103 1.167 18952
1736 1 20 . 1 1 14 14 ARG H H 14 8.060 8.060 7.950 0.110 18952
1737 1 20 . 1 1 18 18 ILE N N 18 122.100 122.100 125.001 -2.901 18952
1738 1 20 . 1 1 18 18 ILE H H 18 7.720 7.720 8.152 -0.432 18952
1739 1 20 . 1 1 19 19 GLU N N 19 124.800 124.800 127.110 -2.310 18952
1740 1 20 . 1 1 19 19 GLU H H 19 8.250 8.250 8.554 -0.304 18952
1741 1 20 . 1 1 20 20 MET N N 20 122.700 122.700 121.352 1.348 18952
1742 1 20 . 1 1 20 20 MET H H 20 8.480 8.480 7.607 0.873 18952
1743 1 20 . 1 1 22 22 GLN N N 22 121.600 121.600 122.257 -0.657 18952
1744 1 20 . 1 1 22 22 GLN H H 22 8.710 8.710 8.539 0.171 18952
1745 1 20 . 1 1 23 23 GLN N N 23 119.000 119.000 115.851 3.149 18952
1746 1 20 . 1 1 23 23 GLN H H 23 8.620 8.620 7.961 0.659 18952
1747 1 20 . 1 1 24 24 ALA N N 24 122.400 122.400 120.962 1.438 18952
1748 1 20 . 1 1 24 24 ALA H H 24 7.840 7.840 8.382 -0.542 18952
1749 1 20 . 1 1 26 26 GLN N N 26 118.340 118.340 119.595 -1.255 18952
1750 1 20 . 1 1 26 26 GLN H H 26 8.780 8.780 8.645 0.135 18952
1751 1 20 . 1 1 27 27 ASN N N 27 117.920 117.920 118.250 -0.330 18952
1752 1 20 . 1 1 27 27 ASN H H 27 8.000 8.000 8.607 -0.607 18952
1753 1 20 . 1 1 28 28 LEU N N 28 121.400 121.400 119.272 2.128 18952
1754 1 20 . 1 1 28 28 LEU H H 28 8.210 8.210 8.038 0.172 18952
1755 1 20 . 1 1 29 29 GLN N N 29 117.930 117.930 119.259 -1.329 18952
1756 1 20 . 1 1 29 29 GLN H H 29 8.130 8.130 8.442 -0.312 18952
1757 1 20 . 1 1 30 30 ASN N N 30 117.040 117.040 119.188 -2.148 18952
1758 1 20 . 1 1 30 30 ASN H H 30 8.100 8.100 8.357 -0.257 18952
1759 1 20 . 1 1 31 31 LEU N N 31 121.200 121.200 121.062 0.138 18952
1760 1 20 . 1 1 31 31 LEU H H 31 8.060 8.060 7.780 0.280 18952
1761 1 20 . 1 1 32 32 PHE N N 32 118.310 118.310 117.731 0.579 18952
1762 1 20 . 1 1 32 32 PHE H H 32 8.450 8.450 8.014 0.436 18952
1763 1 20 . 1 1 33 33 ILE N N 33 119.700 119.700 119.667 0.033 18952
1764 1 20 . 1 1 33 33 ILE H H 33 8.420 8.420 8.701 -0.281 18952
1765 1 20 . 1 1 34 34 ASN N N 34 117.580 117.580 118.214 -0.634 18952
1766 1 20 . 1 1 34 34 ASN H H 34 8.030 8.030 7.993 0.037 18952
1767 1 20 . 1 1 35 35 PHE N N 35 119.400 119.400 121.504 -2.104 18952
1768 1 20 . 1 1 35 35 PHE H H 35 8.570 8.570 7.732 0.838 18952
1769 1 20 . 1 1 36 36 CYS N N 36 116.680 116.680 118.854 -2.174 18952
1770 1 20 . 1 1 36 36 CYS H H 36 8.160 8.160 7.858 0.302 18952
1771 1 20 . 1 1 37 37 LEU N N 37 118.190 118.190 121.161 -2.971 18952
1772 1 20 . 1 1 37 37 LEU H H 37 8.170 8.170 8.626 -0.456 18952
1773 1 20 . 1 1 38 38 ILE N N 38 119.700 119.700 119.042 0.658 18952
1774 1 20 . 1 1 38 38 ILE H H 38 8.390 8.390 8.445 -0.055 18952
1775 1 20 . 1 1 39 39 LEU N N 39 119.400 119.400 120.053 -0.653 18952
1776 1 20 . 1 1 39 39 LEU H H 39 7.990 7.990 7.479 0.511 18952
1777 1 20 . 1 1 40 40 ILE N N 40 119.250 119.250 118.948 0.302 18952
1778 1 20 . 1 1 40 40 ILE H H 40 8.140 8.140 8.296 -0.156 18952
1779 1 20 . 1 1 41 41 CYS N N 41 117.800 117.800 118.721 -0.921 18952
1780 1 20 . 1 1 41 41 CYS H H 41 7.980 7.980 8.476 -0.496 18952
1781 1 20 . 1 1 42 42 LEU N N 42 117.900 117.900 120.093 -2.193 18952
1782 1 20 . 1 1 42 42 LEU H H 42 8.290 8.290 8.046 0.244 18952
1783 1 20 . 1 1 43 43 LEU N N 43 119.700 119.700 119.865 -0.165 18952
1784 1 20 . 1 1 43 43 LEU H H 43 8.390 8.390 8.053 0.337 18952
1785 1 20 . 1 1 44 44 LEU N N 44 117.800 117.800 120.556 -2.756 18952
1786 1 20 . 1 1 44 44 LEU H H 44 8.180 8.180 8.182 -0.002 18952
1787 1 20 . 1 1 45 45 ILE N N 45 117.690 117.690 120.464 -2.774 18952
1788 1 20 . 1 1 45 45 ILE H H 45 8.170 8.170 7.759 0.411 18952
1789 1 20 . 1 1 46 46 CYS N N 46 117.020 117.020 118.344 -1.324 18952
1790 1 20 . 1 1 46 46 CYS H H 46 8.150 8.150 7.572 0.578 18952
1791 1 20 . 1 1 47 47 ILE N N 47 117.300 117.300 121.101 -3.801 18952
1792 1 20 . 1 1 47 47 ILE H H 47 8.230 8.230 7.700 0.530 18952
1793 1 20 . 1 1 48 48 ILE N N 48 117.690 117.690 120.387 -2.697 18952
1794 1 20 . 1 1 48 48 ILE H H 48 8.200 8.200 8.301 -0.101 18952
1795 1 20 . 1 1 49 49 VAL N N 49 115.700 115.700 120.390 -4.690 18952
1796 1 20 . 1 1 49 49 VAL H H 49 8.340 8.340 8.309 0.031 18952
1797 1 20 . 1 1 50 50 MET N N 50 115.500 115.500 117.396 -1.896 18952
1798 1 20 . 1 1 50 50 MET H H 50 7.920 7.920 8.228 -0.308 18952
1799 1 20 . 1 1 51 51 LEU N N 51 118.100 118.100 119.813 -1.713 18952
1800 1 20 . 1 1 51 51 LEU H H 51 7.880 7.880 7.778 0.102 18952
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 45 2.081 1.000 1.846 18952
2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18952
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18952
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18952
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18952
6 1 1 "Average Difference" HN 45 0.347 -0.011 0.351 18952
7 1 2 "Average Difference" N 45 1.991 0.991 1.746 18952
8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18952
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18952
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18952
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18952
12 1 2 "Average Difference" HN 45 0.413 -0.096 0.406 18952
13 1 3 "Average Difference" N 45 2.263 0.639 2.196 18952
14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18952
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18952
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18952
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18952
18 1 3 "Average Difference" HN 45 0.394 -0.082 0.389 18952
19 1 4 "Average Difference" N 45 1.957 1.009 1.695 18952
20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18952
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18952
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18952
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18952
24 1 4 "Average Difference" HN 45 0.350 -0.060 0.349 18952
25 1 5 "Average Difference" N 45 2.071 0.746 1.954 18952
26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18952
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18952
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18952
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18952
30 1 5 "Average Difference" HN 45 0.420 -0.134 0.402 18952
31 1 6 "Average Difference" N 45 2.218 0.974 2.015 18952
32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18952
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18952
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18952
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18952
36 1 6 "Average Difference" HN 45 0.347 -0.061 0.346 18952
37 1 7 "Average Difference" N 45 2.097 1.123 1.791 18952
38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18952
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18952
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18952
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18952
42 1 7 "Average Difference" HN 45 0.361 -0.000 0.365 18952
43 1 8 "Average Difference" N 45 2.369 1.036 2.154 18952
44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18952
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18952
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18952
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18952
48 1 8 "Average Difference" HN 45 0.379 -0.027 0.382 18952
49 1 9 "Average Difference" N 45 2.081 0.851 1.920 18952
50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18952
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18952
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18952
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18952
54 1 9 "Average Difference" HN 45 0.367 -0.069 0.365 18952
55 1 10 "Average Difference" N 45 1.986 0.974 1.750 18952
56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18952
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18952
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18952
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18952
60 1 10 "Average Difference" HN 45 0.363 -0.040 0.365 18952
61 1 11 "Average Difference" N 45 2.060 0.935 1.856 18952
62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 18952
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18952
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18952
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18952
66 1 11 "Average Difference" HN 45 0.343 -0.037 0.345 18952
67 1 12 "Average Difference" N 45 2.041 1.001 1.798 18952
68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 18952
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18952
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18952
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18952
72 1 12 "Average Difference" HN 45 0.387 -0.045 0.389 18952
73 1 13 "Average Difference" N 45 2.225 0.700 2.136 18952
74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 18952
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18952
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18952
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18952
78 1 13 "Average Difference" HN 45 0.392 -0.045 0.394 18952
79 1 14 "Average Difference" N 45 2.737 0.776 2.654 18952
80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 18952
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18952
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18952
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18952
84 1 14 "Average Difference" HN 45 0.395 -0.023 0.399 18952
85 1 15 "Average Difference" N 45 2.025 0.927 1.821 18952
86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 18952
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18952
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18952
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18952
90 1 15 "Average Difference" HN 45 0.329 0.043 0.330 18952
91 1 16 "Average Difference" N 45 2.074 0.973 1.853 18952
92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 18952
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18952
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18952
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18952
96 1 16 "Average Difference" HN 45 0.388 -0.001 0.393 18952
97 1 17 "Average Difference" N 45 2.242 1.089 1.981 18952
98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 18952
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18952
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18952
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18952
102 1 17 "Average Difference" HN 45 0.369 -0.059 0.368 18952
103 1 18 "Average Difference" N 45 2.180 0.798 2.051 18952
104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 18952
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18952
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18952
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18952
108 1 18 "Average Difference" HN 45 0.373 -0.062 0.372 18952
109 1 19 "Average Difference" N 45 2.094 0.712 1.992 18952
110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 18952
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18952
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18952
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18952
114 1 19 "Average Difference" HN 45 0.339 -0.040 0.340 18952
115 1 20 "Average Difference" N 45 2.073 1.033 1.818 18952
116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 18952
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18952
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18952
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18952
120 1 20 "Average Difference" HN 45 0.389 0.005 0.393 18952
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 18952
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 GLU N N 2 115.710 115.710 115.918 -0.208 18952
2 1 . 1 1 2 2 GLU H H 2 8.778 8.778 8.389 0.389 18952
3 1 . 1 1 3 3 LYS N N 3 114.190 114.190 113.598 0.592 18952
4 1 . 1 1 3 3 LYS H H 3 7.856 7.856 7.953 -0.097 18952
5 1 . 1 1 4 4 VAL N N 4 117.810 117.810 120.451 -2.641 18952
6 1 . 1 1 4 4 VAL H H 4 7.825 7.825 7.879 -0.054 18952
7 1 . 1 1 5 5 GLN N N 5 120.770 120.770 119.141 1.629 18952
8 1 . 1 1 5 5 GLN H H 5 8.194 8.194 8.502 -0.308 18952
9 1 . 1 1 6 6 TYR N N 6 119.215 119.215 122.249 -3.034 18952
10 1 . 1 1 6 6 TYR H H 6 8.006 8.006 8.344 -0.338 18952
11 1 . 1 1 7 7 LEU N N 7 120.420 120.420 119.766 0.654 18952
12 1 . 1 1 7 7 LEU H H 7 8.114 8.114 8.456 -0.342 18952
13 1 . 1 1 8 8 THR N N 8 111.605 111.605 116.329 -4.724 18952
14 1 . 1 1 8 8 THR H H 8 7.896 7.896 8.307 -0.410 18952
15 1 . 1 1 9 9 ARG N N 9 120.685 120.685 121.552 -0.867 18952
16 1 . 1 1 9 9 ARG H H 9 8.214 8.214 8.266 -0.052 18952
17 1 . 1 1 10 10 SER N N 10 114.335 114.335 115.264 -0.929 18952
18 1 . 1 1 10 10 SER H H 10 7.985 7.985 8.176 -0.191 18952
19 1 . 1 1 11 11 ALA N N 11 123.835 123.835 124.635 -0.800 18952
20 1 . 1 1 11 11 ALA H H 11 8.068 8.068 8.069 -0.001 18952
21 1 . 1 1 12 12 ILE N N 12 115.830 115.830 118.407 -2.577 18952
22 1 . 1 1 12 12 ILE H H 12 7.790 7.790 7.951 -0.160 18952
23 1 . 1 1 13 13 ARG N N 13 121.245 121.245 119.461 1.784 18952
24 1 . 1 1 13 13 ARG H H 13 7.917 7.917 8.056 -0.139 18952
25 1 . 1 1 14 14 ARG N N 14 120.051 120.051 118.504 1.548 18952
26 1 . 1 1 14 14 ARG H H 14 8.046 8.046 7.938 0.108 18952
27 1 . 1 1 13 13 ARG N N 13 6.055 6.055 5.994 0.061 18952
28 1 . 1 1 13 13 ARG H H 13 0.396 0.396 0.408 -0.013 18952
29 1 . 1 1 14 14 ARG N N 14 6.013 6.013 5.930 0.084 18952
30 1 . 1 1 14 14 ARG H H 14 0.403 0.403 0.399 0.004 18952
31 1 . 1 1 18 18 ILE N N 18 115.995 115.995 116.141 -0.146 18952
32 1 . 1 1 18 18 ILE H H 18 7.334 7.334 7.668 -0.334 18952
33 1 . 1 1 19 19 GLU N N 19 118.560 118.560 119.157 -0.597 18952
34 1 . 1 1 19 19 GLU H H 19 7.838 7.838 8.037 -0.199 18952
35 1 . 1 1 20 20 MET N N 20 122.670 122.670 121.196 1.474 18952
36 1 . 1 1 20 20 MET H H 20 8.442 8.442 8.275 0.167 18952
37 1 . 1 1 19 19 GLU N N 19 6.240 6.240 6.280 -0.041 18952
38 1 . 1 1 19 19 GLU H H 19 0.412 0.412 0.421 -0.008 18952
39 1 . 1 1 22 22 GLN N N 22 121.655 121.655 119.376 2.279 18952
40 1 . 1 1 22 22 GLN H H 22 8.699 8.699 8.505 0.194 18952
41 1 . 1 1 23 23 GLN N N 23 113.050 113.050 112.402 0.648 18952
42 1 . 1 1 23 23 GLN H H 23 8.189 8.189 7.654 0.535 18952
43 1 . 1 1 24 24 ALA N N 24 122.360 122.360 121.913 0.447 18952
44 1 . 1 1 24 24 ALA H H 24 7.884 7.884 7.889 -0.006 18952
45 1 . 1 1 23 23 GLN N N 23 5.950 5.950 5.887 0.063 18952
46 1 . 1 1 23 23 GLN H H 23 0.431 0.431 0.415 0.016 18952
47 1 . 1 1 26 26 GLN N N 26 118.543 118.543 119.517 -0.974 18952
48 1 . 1 1 26 26 GLN H H 26 8.733 8.733 8.518 0.215 18952
49 1 . 1 1 27 27 ASN N N 27 112.024 112.024 111.805 0.219 18952
50 1 . 1 1 27 27 ASN H H 27 7.600 7.600 7.773 -0.173 18952
51 1 . 1 1 28 28 LEU N N 28 121.247 121.247 120.189 1.058 18952
52 1 . 1 1 28 28 LEU H H 28 8.239 8.239 7.910 0.329 18952
53 1 . 1 1 29 29 GLN N N 29 117.930 117.930 118.710 -0.780 18952
54 1 . 1 1 29 29 GLN H H 29 8.123 8.123 7.952 0.172 18952
55 1 . 1 1 30 30 ASN N N 30 117.258 117.258 119.103 -1.845 18952
56 1 . 1 1 30 30 ASN H H 30 8.105 8.105 7.946 0.160 18952
57 1 . 1 1 31 31 LEU N N 31 121.037 121.037 121.142 -0.105 18952
58 1 . 1 1 31 31 LEU H H 31 8.064 8.064 7.666 0.398 18952
59 1 . 1 1 32 32 PHE N N 32 118.246 118.246 118.165 0.082 18952
60 1 . 1 1 32 32 PHE H H 32 8.432 8.432 7.494 0.938 18952
61 1 . 1 1 33 33 ILE N N 33 119.775 119.775 119.866 -0.091 18952
62 1 . 1 1 33 33 ILE H H 33 8.402 8.402 8.672 -0.270 18952
63 1 . 1 1 34 34 ASN N N 34 117.616 117.616 118.326 -0.710 18952
64 1 . 1 1 34 34 ASN H H 34 8.051 8.051 8.169 -0.118 18952
65 1 . 1 1 35 35 PHE N N 35 119.415 119.415 121.489 -2.074 18952
66 1 . 1 1 35 35 PHE H H 35 8.562 8.562 8.191 0.371 18952
67 1 . 1 1 36 36 CYS N N 36 116.725 116.725 118.494 -1.769 18952
68 1 . 1 1 36 36 CYS H H 36 8.153 8.153 8.062 0.092 18952
69 1 . 1 1 37 37 LEU N N 37 118.251 118.251 121.216 -2.966 18952
70 1 . 1 1 37 37 LEU H H 37 8.190 8.190 8.256 -0.066 18952
71 1 . 1 1 38 38 ILE N N 38 119.549 119.549 119.336 0.213 18952
72 1 . 1 1 38 38 ILE H H 38 8.378 8.378 8.418 -0.039 18952
73 1 . 1 1 39 39 LEU N N 39 119.340 119.340 120.084 -0.745 18952
74 1 . 1 1 39 39 LEU H H 39 7.999 7.999 7.803 0.196 18952
75 1 . 1 1 40 40 ILE N N 40 119.272 119.272 119.420 -0.147 18952
76 1 . 1 1 40 40 ILE H H 40 8.152 8.152 8.120 0.032 18952
77 1 . 1 1 41 41 CYS N N 41 117.880 117.880 118.978 -1.098 18952
78 1 . 1 1 41 41 CYS H H 41 7.981 7.981 8.367 -0.386 18952
79 1 . 1 1 42 42 LEU N N 42 117.968 117.968 119.926 -1.958 18952
80 1 . 1 1 42 42 LEU H H 42 8.282 8.282 8.220 0.063 18952
81 1 . 1 1 43 43 LEU N N 43 119.605 119.605 120.117 -0.512 18952
82 1 . 1 1 43 43 LEU H H 43 8.369 8.369 8.044 0.326 18952
83 1 . 1 1 44 44 LEU N N 44 117.805 117.805 120.402 -2.597 18952
84 1 . 1 1 44 44 LEU H H 44 8.186 8.186 8.321 -0.135 18952
85 1 . 1 1 45 45 ILE N N 45 117.791 117.791 119.930 -2.139 18952
86 1 . 1 1 45 45 ILE H H 45 8.181 8.181 7.772 0.409 18952
87 1 . 1 1 46 46 CYS N N 46 117.059 117.059 118.585 -1.526 18952
88 1 . 1 1 46 46 CYS H H 46 8.152 8.152 7.705 0.447 18952
89 1 . 1 1 47 47 ILE N N 47 117.319 117.319 121.284 -3.965 18952
90 1 . 1 1 47 47 ILE H H 47 8.227 8.227 8.054 0.173 18952
91 1 . 1 1 48 48 ILE N N 48 117.657 117.657 120.230 -2.573 18952
92 1 . 1 1 48 48 ILE H H 48 8.197 8.197 8.130 0.067 18952
93 1 . 1 1 49 49 VAL N N 49 115.780 115.780 120.397 -4.617 18952
94 1 . 1 1 49 49 VAL H H 49 8.335 8.335 8.149 0.185 18952
95 1 . 1 1 50 50 MET N N 50 115.609 115.609 117.975 -2.365 18952
96 1 . 1 1 50 50 MET H H 50 7.934 7.934 8.176 -0.242 18952
97 1 . 1 1 51 51 LEU N N 51 117.980 117.980 119.642 -1.662 18952
98 1 . 1 1 51 51 LEU H H 51 7.903 7.903 7.892 0.011 18952
99 1 . 1 1 50 50 MET N N 50 5.775 5.775 5.903 -0.128 18952
100 1 . 1 1 50 50 MET H H 50 0.396 0.396 0.403 -0.007 18952
101 1 . 1 1 51 51 LEU N N 51 5.905 5.905 5.974 -0.069 18952
102 1 . 1 1 51 51 LEU H H 51 0.394 0.394 0.402 -0.008 18952
stop_
save_