NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
412838 |
2bun   |
6692 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2bun
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1869
_Distance_constraint_stats_list.Viol_count 4802
_Distance_constraint_stats_list.Viol_total 8410.313
_Distance_constraint_stats_list.Viol_max 0.538
_Distance_constraint_stats_list.Viol_rms 0.0401
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0112
_Distance_constraint_stats_list.Viol_average_violations_only 0.0876
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 LEU 0.990 0.091 17 0 "[ . 1 . 2]"
1 2 GLU 7.918 0.167 5 0 "[ . 1 . 2]"
1 3 ALA 1.718 0.100 3 0 "[ . 1 . 2]"
1 4 ASP 0.858 0.117 4 0 "[ . 1 . 2]"
1 5 VAL 6.954 0.294 15 0 "[ . 1 . 2]"
1 6 THR 3.550 0.240 11 0 "[ . 1 . 2]"
1 7 MET 2.416 0.240 11 0 "[ . 1 . 2]"
1 8 THR 3.452 0.189 13 0 "[ . 1 . 2]"
1 9 GLY 0.025 0.010 6 0 "[ . 1 . 2]"
1 10 SER 0.951 0.217 13 0 "[ . 1 . 2]"
1 11 ASP 13.800 0.288 10 0 "[ . 1 . 2]"
1 12 LEU 24.579 0.296 4 0 "[ . 1 . 2]"
1 13 VAL 21.118 0.208 8 0 "[ . 1 . 2]"
1 14 SER 2.953 0.186 17 0 "[ . 1 . 2]"
1 15 CYS 0.468 0.166 19 0 "[ . 1 . 2]"
1 16 CYS 10.620 0.411 1 0 "[ . 1 . 2]"
1 17 TYR 36.538 0.538 1 8 "[+-**. ** 1 * *2]"
1 18 ARG 3.893 0.160 3 0 "[ . 1 . 2]"
1 19 SER 2.211 0.226 15 0 "[ . 1 . 2]"
1 20 LEU 5.169 0.179 18 0 "[ . 1 . 2]"
1 21 ALA 1.980 0.139 19 0 "[ . 1 . 2]"
1 22 ALA 12.053 0.360 3 0 "[ . 1 . 2]"
1 23 PRO 6.330 0.187 20 0 "[ . 1 . 2]"
1 24 ASP 4.951 0.155 6 0 "[ . 1 . 2]"
1 25 LEU 9.213 0.274 1 0 "[ . 1 . 2]"
1 26 THR 10.001 0.279 1 0 "[ . 1 . 2]"
1 27 LEU 9.009 0.221 9 0 "[ . 1 . 2]"
1 28 ARG 6.088 0.279 1 0 "[ . 1 . 2]"
1 29 ASP 0.742 0.107 13 0 "[ . 1 . 2]"
1 30 LEU 11.830 0.269 20 0 "[ . 1 . 2]"
1 31 LEU 13.790 0.269 20 0 "[ . 1 . 2]"
1 32 ASP 5.380 0.207 14 0 "[ . 1 . 2]"
1 33 ILE 4.970 0.179 15 0 "[ . 1 . 2]"
1 34 VAL 3.229 0.210 20 0 "[ . 1 . 2]"
1 35 GLU 0.577 0.089 18 0 "[ . 1 . 2]"
1 36 THR 0.602 0.103 16 0 "[ . 1 . 2]"
1 37 SER 0.026 0.026 16 0 "[ . 1 . 2]"
1 38 GLN 5.561 0.222 10 0 "[ . 1 . 2]"
1 39 ALA 3.808 0.211 18 0 "[ . 1 . 2]"
1 40 HIS 3.921 0.177 15 0 "[ . 1 . 2]"
1 41 ASN 0.012 0.011 6 0 "[ . 1 . 2]"
1 42 ALA 1.199 0.067 11 0 "[ . 1 . 2]"
1 43 ARG 6.758 0.138 7 0 "[ . 1 . 2]"
1 44 ALA 7.217 0.177 15 0 "[ . 1 . 2]"
1 45 GLN 8.075 0.200 14 0 "[ . 1 . 2]"
1 46 LEU 7.255 0.200 7 0 "[ . 1 . 2]"
1 47 THR 9.306 0.282 7 0 "[ . 1 . 2]"
1 48 GLY 2.522 0.217 9 0 "[ . 1 . 2]"
1 49 ALA 4.664 0.212 9 0 "[ . 1 . 2]"
1 50 LEU 1.626 0.132 8 0 "[ . 1 . 2]"
1 51 PHE 0.266 0.070 2 0 "[ . 1 . 2]"
1 52 TYR 3.403 0.152 1 0 "[ . 1 . 2]"
1 53 SER 0.739 0.202 14 0 "[ . 1 . 2]"
1 54 GLN 0.942 0.202 14 0 "[ . 1 . 2]"
1 55 GLY 0.342 0.056 6 0 "[ . 1 . 2]"
1 56 VAL 1.502 0.096 8 0 "[ . 1 . 2]"
1 57 PHE 11.621 0.308 11 0 "[ . 1 . 2]"
1 58 PHE 1.668 0.152 1 0 "[ . 1 . 2]"
1 59 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 TRP 9.917 0.217 2 0 "[ . 1 . 2]"
1 61 LEU 2.456 0.121 3 0 "[ . 1 . 2]"
1 62 GLU 1.128 0.078 12 0 "[ . 1 . 2]"
1 63 GLY 4.092 0.223 19 0 "[ . 1 . 2]"
1 64 HIS 12.272 0.291 1 0 "[ . 1 . 2]"
1 65 PRO 1.333 0.183 15 0 "[ . 1 . 2]"
1 66 ALA 11.867 0.193 8 0 "[ . 1 . 2]"
1 67 ALA 12.351 0.275 3 0 "[ . 1 . 2]"
1 68 VAL 13.188 0.275 3 0 "[ . 1 . 2]"
1 69 ALA 13.222 0.226 8 0 "[ . 1 . 2]"
1 70 GLU 3.733 0.119 18 0 "[ . 1 . 2]"
1 71 VAL 2.189 0.135 18 0 "[ . 1 . 2]"
1 72 MET 19.045 0.270 18 0 "[ . 1 . 2]"
1 73 SER 3.023 0.140 1 0 "[ . 1 . 2]"
1 74 HIS 1.898 0.119 18 0 "[ . 1 . 2]"
1 75 ILE 3.118 0.148 16 0 "[ . 1 . 2]"
1 76 GLN 13.793 0.350 5 0 "[ . 1 . 2]"
1 77 ARG 3.087 0.140 1 0 "[ . 1 . 2]"
1 78 ASP 8.139 0.276 18 0 "[ . 1 . 2]"
1 79 ARG 6.266 0.276 18 0 "[ . 1 . 2]"
1 80 ARG 2.628 0.160 17 0 "[ . 1 . 2]"
1 81 HIS 9.961 0.360 3 0 "[ . 1 . 2]"
1 82 SER 20.121 0.328 15 0 "[ . 1 . 2]"
1 83 ASN 13.516 0.285 12 0 "[ . 1 . 2]"
1 84 VAL 20.943 0.350 5 0 "[ . 1 . 2]"
1 85 GLU 7.149 0.283 16 0 "[ . 1 . 2]"
1 86 ILE 22.669 0.390 16 0 "[ . 1 . 2]"
1 87 LEU 14.882 0.538 1 8 "[+-**. ** 1 * *2]"
1 88 ALA 7.283 0.308 17 0 "[ . 1 . 2]"
1 89 GLU 3.670 0.120 5 0 "[ . 1 . 2]"
1 90 GLU 1.068 0.077 6 0 "[ . 1 . 2]"
1 91 SER 0.745 0.046 13 0 "[ . 1 . 2]"
1 92 ILE 16.486 0.208 8 0 "[ . 1 . 2]"
1 93 ALA 12.330 0.367 1 0 "[ . 1 . 2]"
1 94 LYS 34.161 0.367 1 0 "[ . 1 . 2]"
1 95 ARG 6.304 0.340 9 0 "[ . 1 . 2]"
1 96 ARG 2.051 0.170 1 0 "[ . 1 . 2]"
1 97 PHE 3.941 0.200 19 0 "[ . 1 . 2]"
1 98 ALA 4.182 0.250 7 0 "[ . 1 . 2]"
1 99 GLY 0.784 0.071 19 0 "[ . 1 . 2]"
1 100 TRP 13.753 0.282 7 0 "[ . 1 . 2]"
1 101 HIS 5.162 0.217 9 0 "[ . 1 . 2]"
1 102 MET 3.641 0.127 18 0 "[ . 1 . 2]"
1 103 GLN 0.224 0.072 18 0 "[ . 1 . 2]"
1 104 LEU 0.454 0.132 8 0 "[ . 1 . 2]"
1 105 SER 0.007 0.007 1 0 "[ . 1 . 2]"
1 107 SER 0.370 0.069 14 0 "[ . 1 . 2]"
1 108 GLU 0.691 0.071 14 0 "[ . 1 . 2]"
1 109 ALA 1.064 0.107 18 0 "[ . 1 . 2]"
1 110 ASP 0.830 0.107 18 0 "[ . 1 . 2]"
1 111 MET 0.764 0.076 18 0 "[ . 1 . 2]"
1 112 ARG 2.172 0.170 9 0 "[ . 1 . 2]"
1 113 SER 0.050 0.040 14 0 "[ . 1 . 2]"
1 114 LEU 0.938 0.097 20 0 "[ . 1 . 2]"
1 115 GLY 0.106 0.035 3 0 "[ . 1 . 2]"
1 116 LEU 2.035 0.170 9 0 "[ . 1 . 2]"
1 117 ALA 3.734 0.428 16 0 "[ . 1 . 2]"
1 118 GLU 1.569 0.428 16 0 "[ . 1 . 2]"
1 119 SER 0.359 0.099 1 0 "[ . 1 . 2]"
1 120 ARG 1.215 0.127 10 0 "[ . 1 . 2]"
1 121 GLN 1.409 0.167 16 0 "[ . 1 . 2]"
2 1 FAD 2.849 0.143 13 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 LEU HA 1 1 LEU QB 2.000 . 2.500 2.423 2.349 2.522 0.022 15 0 "[ . 1 . 2]" 1
2 1 1 LEU HA 1 1 LEU MD1 1.900 . 2.300 2.164 2.034 2.380 0.080 13 0 "[ . 1 . 2]" 1
3 1 1 LEU HA 1 2 GLU H 2.000 . 2.500 2.297 2.108 2.526 0.026 18 0 "[ . 1 . 2]" 1
4 1 1 LEU QB 1 1 LEU MD1 2.000 . 2.500 2.333 2.242 2.418 . 0 0 "[ . 1 . 2]" 1
5 1 1 LEU QB 1 1 LEU MD2 1.800 . 2.200 2.139 2.059 2.235 0.035 1 0 "[ . 1 . 2]" 1
6 1 1 LEU QB 1 2 GLU H 2.600 . 3.500 3.174 2.036 3.591 0.091 17 0 "[ . 1 . 2]" 1
7 1 1 LEU MD2 1 1 LEU HG 1.900 . 2.300 2.122 2.109 2.131 . 0 0 "[ . 1 . 2]" 1
8 1 2 GLU H 1 2 GLU HA 2.200 . 2.800 2.860 2.810 2.906 0.106 6 0 "[ . 1 . 2]" 1
9 1 2 GLU H 1 2 GLU HB2 2.400 . 3.100 2.715 2.393 3.157 0.057 8 0 "[ . 1 . 2]" 1
10 1 2 GLU H 1 2 GLU HB3 2.300 . 3.000 2.470 2.381 2.560 . 0 0 "[ . 1 . 2]" 1
11 1 2 GLU HA 1 2 GLU HB2 2.000 . 2.500 2.512 2.493 2.530 0.030 14 0 "[ . 1 . 2]" 1
12 1 2 GLU HA 1 2 GLU HB3 2.200 . 2.800 2.952 2.936 2.967 0.167 5 0 "[ . 1 . 2]" 1
13 1 2 GLU HA 1 2 GLU HG2 3.200 2.600 3.800 3.697 3.614 3.754 . 0 0 "[ . 1 . 2]" 1
14 1 2 GLU HA 1 3 ALA H 1.800 . 2.200 2.238 2.186 2.300 0.100 3 0 "[ . 1 . 2]" 1
15 1 2 GLU HB2 1 2 GLU HG2 1.600 . 2.200 2.275 2.267 2.289 0.089 19 0 "[ . 1 . 2]" 1
16 1 2 GLU HB2 1 3 ALA H 2.900 . 4.000 3.908 3.800 3.999 . 0 0 "[ . 1 . 2]" 1
17 1 2 GLU HB3 1 2 GLU HG2 1.800 . 2.700 2.454 2.410 2.495 . 0 0 "[ . 1 . 2]" 1
18 1 2 GLU HB3 1 3 ALA H 2.700 . 3.600 3.605 3.377 3.667 0.067 8 0 "[ . 1 . 2]" 1
19 1 2 GLU HG2 1 3 ALA H 3.200 . 4.500 3.812 3.578 3.985 . 0 0 "[ . 1 . 2]" 1
20 1 3 ALA H 1 3 ALA HA 2.400 . 3.100 2.849 2.758 2.943 . 0 0 "[ . 1 . 2]" 1
21 1 3 ALA H 1 3 ALA MB 1.900 . 2.300 2.272 2.235 2.347 0.047 4 0 "[ . 1 . 2]" 1
22 1 3 ALA HA 1 3 ALA MB 1.800 . 2.200 2.126 2.107 2.147 . 0 0 "[ . 1 . 2]" 1
23 1 3 ALA HA 1 4 ASP H 1.800 . 2.200 2.141 1.980 2.240 0.040 2 0 "[ . 1 . 2]" 1
24 1 3 ALA MB 1 4 ASP H 2.300 . 2.900 2.865 2.603 2.957 0.057 5 0 "[ . 1 . 2]" 1
25 1 3 ALA MB 1 4 ASP HA 2.400 . 6.000 4.335 3.986 4.466 . 0 0 "[ . 1 . 2]" 1
26 1 4 ASP H 1 4 ASP HB2 2.200 . 2.800 2.639 2.423 2.917 0.117 4 0 "[ . 1 . 2]" 1
27 1 4 ASP H 1 4 ASP HB3 2.000 . 2.500 2.480 2.314 2.539 0.039 18 0 "[ . 1 . 2]" 1
28 1 4 ASP H 1 5 VAL H 2.400 . 6.000 4.367 2.926 4.627 . 0 0 "[ . 1 . 2]" 1
29 1 4 ASP HA 1 4 ASP HB2 2.200 . 2.800 2.484 2.382 2.604 . 0 0 "[ . 1 . 2]" 1
30 1 4 ASP HA 1 4 ASP HB3 2.400 . 3.100 3.026 3.005 3.041 . 0 0 "[ . 1 . 2]" 1
31 1 4 ASP HA 1 5 VAL MG1 2.900 . 3.900 3.746 3.441 3.973 0.073 16 0 "[ . 1 . 2]" 1
32 1 4 ASP HB2 1 5 VAL H 3.800 . 5.600 4.017 3.420 4.311 . 0 0 "[ . 1 . 2]" 1
33 1 4 ASP HB3 1 5 VAL H 2.600 . 6.000 3.669 1.862 4.235 . 0 0 "[ . 1 . 2]" 1
34 1 5 VAL H 1 5 VAL HA 2.000 . 2.500 2.685 2.643 2.794 0.294 15 0 "[ . 1 . 2]" 1
35 1 5 VAL H 1 5 VAL HB 3.100 . 4.300 3.600 3.538 3.793 . 0 0 "[ . 1 . 2]" 1
36 1 5 VAL H 1 5 VAL MG2 1.800 . 2.200 1.953 1.848 2.211 0.011 11 0 "[ . 1 . 2]" 1
37 1 5 VAL H 1 6 THR H 2.200 . 2.800 2.645 1.798 2.812 0.012 7 0 "[ . 1 . 2]" 1
38 1 5 VAL HA 1 5 VAL HB 2.000 . 2.500 2.505 2.468 2.532 0.032 13 0 "[ . 1 . 2]" 1
39 1 5 VAL HA 1 5 VAL MG1 2.200 . 2.800 2.276 2.244 2.328 . 0 0 "[ . 1 . 2]" 1
40 1 5 VAL HA 1 5 VAL MG2 2.300 . 3.000 3.138 3.121 3.151 0.151 16 0 "[ . 1 . 2]" 1
41 1 5 VAL HA 1 6 THR H 3.100 2.700 3.500 3.353 2.960 3.501 0.001 7 0 "[ . 1 . 2]" 1
42 1 5 VAL HA 1 6 THR MG 3.300 . 4.700 4.092 3.615 4.484 . 0 0 "[ . 1 . 2]" 1
43 1 5 VAL HB 1 5 VAL MG1 1.900 . 2.300 2.132 2.121 2.146 . 0 0 "[ . 1 . 2]" 1
44 1 5 VAL HB 1 5 VAL MG2 1.900 . 2.300 2.117 2.106 2.123 . 0 0 "[ . 1 . 2]" 1
45 1 5 VAL HB 1 6 THR H 2.600 . 4.600 4.072 3.734 4.343 . 0 0 "[ . 1 . 2]" 1
46 1 5 VAL MG2 1 6 THR H 2.400 . 3.100 2.659 2.180 3.169 0.069 15 0 "[ . 1 . 2]" 1
47 1 6 THR H 1 6 THR HA 2.100 . 2.700 2.247 2.183 2.639 . 0 0 "[ . 1 . 2]" 1
48 1 6 THR H 1 6 THR MG 2.200 . 2.800 2.616 1.878 2.822 0.022 15 0 "[ . 1 . 2]" 1
49 1 6 THR HA 1 6 THR HB 1.800 . 2.200 2.344 2.289 2.381 0.181 3 0 "[ . 1 . 2]" 1
50 1 6 THR HA 1 6 THR MG 2.300 . 2.900 2.382 2.254 3.111 0.211 5 0 "[ . 1 . 2]" 1
51 1 6 THR HA 1 7 MET H 2.300 . 3.000 2.606 2.113 3.240 0.240 11 0 "[ . 1 . 2]" 1
52 1 6 THR HB 1 6 THR MG 1.900 . 2.300 2.127 2.105 2.137 . 0 0 "[ . 1 . 2]" 1
53 1 6 THR MG 1 7 MET H 3.300 . 4.700 3.755 3.431 4.388 . 0 0 "[ . 1 . 2]" 1
54 1 7 MET H 1 7 MET HB3 2.600 . 3.500 3.477 2.615 3.677 0.177 11 0 "[ . 1 . 2]" 1
55 1 7 MET H 1 7 MET HG2 3.100 . 4.300 3.748 2.594 4.288 . 0 0 "[ . 1 . 2]" 1
56 1 7 MET H 1 7 MET HG3 3.000 . 4.100 2.983 1.954 3.976 . 0 0 "[ . 1 . 2]" 1
57 1 7 MET HA 1 7 MET HB2 2.400 . 3.100 2.932 2.429 3.026 . 0 0 "[ . 1 . 2]" 1
58 1 7 MET HA 1 7 MET HB3 2.200 . 2.800 2.503 2.344 2.591 . 0 0 "[ . 1 . 2]" 1
59 1 7 MET HA 1 7 MET ME 3.200 . 4.500 4.250 3.762 4.723 0.223 19 0 "[ . 1 . 2]" 1
60 1 7 MET HA 1 7 MET HG2 3.200 . 4.500 3.167 2.361 4.254 . 0 0 "[ . 1 . 2]" 1
61 1 7 MET HA 1 7 MET HG3 2.700 . 3.600 2.926 2.425 3.679 0.079 12 0 "[ . 1 . 2]" 1
62 1 7 MET HB2 1 7 MET HG2 2.400 . 3.200 2.766 2.414 3.019 . 0 0 "[ . 1 . 2]" 1
63 1 7 MET HB2 1 7 MET HG3 2.300 . 2.900 2.669 2.380 2.972 0.072 14 0 "[ . 1 . 2]" 1
64 1 7 MET HB3 1 7 MET HG3 2.800 . 3.800 2.436 2.020 2.827 . 0 0 "[ . 1 . 2]" 1
65 1 7 MET HB3 1 7 MET HG2 2.200 . 2.800 2.415 2.271 2.515 . 0 0 "[ . 1 . 2]" 1
66 1 7 MET HB3 1 7 MET HG3 2.400 . 3.100 2.765 2.434 3.018 . 0 0 "[ . 1 . 2]" 1
67 1 7 MET HB3 1 8 THR H 3.100 . 4.300 3.679 2.222 4.322 0.022 2 0 "[ . 1 . 2]" 1
68 1 8 THR H 1 8 THR HA 2.500 . 3.300 2.719 2.172 2.947 . 0 0 "[ . 1 . 2]" 1
69 1 8 THR H 1 8 THR MG 2.500 . 3.300 2.650 2.356 2.990 . 0 0 "[ . 1 . 2]" 1
70 1 8 THR HA 1 8 THR HB 1.800 . 2.200 2.370 2.331 2.389 0.189 13 0 "[ . 1 . 2]" 1
71 1 8 THR HA 1 8 THR MG 1.900 . 2.400 2.271 2.216 2.394 . 0 0 "[ . 1 . 2]" 1
72 1 8 THR HA 1 9 GLY H 2.600 . 3.500 2.988 2.030 3.510 0.010 6 0 "[ . 1 . 2]" 1
73 1 8 THR HB 1 8 THR MG 1.800 . 2.200 2.134 2.116 2.146 . 0 0 "[ . 1 . 2]" 1
74 1 8 THR HB 1 9 GLY H 3.200 . 4.500 3.257 1.935 4.273 . 0 0 "[ . 1 . 2]" 1
75 1 8 THR MG 1 9 GLY H 4.100 . 6.000 3.858 3.424 4.319 . 0 0 "[ . 1 . 2]" 1
76 1 8 THR MG 1 9 GLY QA 2.300 . 6.000 4.974 4.801 5.225 . 0 0 "[ . 1 . 2]" 1
77 1 9 GLY H 1 9 GLY QA 2.600 . 3.400 2.347 2.180 2.475 . 0 0 "[ . 1 . 2]" 1
78 1 9 GLY QA 1 10 SER H 2.600 . 3.500 2.199 2.067 2.513 . 0 0 "[ . 1 . 2]" 1
79 1 10 SER H 1 10 SER HB2 3.100 . 4.300 3.081 2.487 3.927 . 0 0 "[ . 1 . 2]" 1
80 1 10 SER H 1 10 SER HB3 3.100 . 4.300 3.417 2.540 3.963 . 0 0 "[ . 1 . 2]" 1
81 1 10 SER H 1 11 ASP H 2.800 . 3.800 2.709 1.762 4.017 0.217 13 0 "[ . 1 . 2]" 1
82 1 10 SER HA 1 10 SER HB2 2.400 . 3.100 2.780 2.474 3.036 . 0 0 "[ . 1 . 2]" 1
83 1 10 SER HA 1 10 SER HB3 2.500 . 3.300 2.520 2.297 3.046 . 0 0 "[ . 1 . 2]" 1
84 1 10 SER HB2 1 11 ASP H 2.900 . 3.900 3.086 2.071 3.642 . 0 0 "[ . 1 . 2]" 1
85 1 10 SER HB3 1 11 ASP H 2.900 . 4.000 3.243 1.897 4.095 0.095 19 0 "[ . 1 . 2]" 1
86 1 11 ASP H 1 11 ASP HA 2.700 . 3.600 2.836 2.796 2.862 . 0 0 "[ . 1 . 2]" 1
87 1 11 ASP H 1 11 ASP HB2 2.500 . 3.300 3.468 3.331 3.510 0.210 5 0 "[ . 1 . 2]" 1
88 1 11 ASP H 1 11 ASP HB3 2.500 . 3.300 3.140 2.896 3.446 0.146 14 0 "[ . 1 . 2]" 1
89 1 11 ASP H 1 12 LEU H 2.200 . 2.800 2.898 2.690 2.971 0.171 20 0 "[ . 1 . 2]" 1
90 1 11 ASP H 1 12 LEU HB2 4.200 . 6.000 4.666 4.261 4.981 . 0 0 "[ . 1 . 2]" 1
91 1 11 ASP H 1 12 LEU HB3 4.300 . 6.000 5.676 5.121 5.995 . 0 0 "[ . 1 . 2]" 1
92 1 11 ASP H 1 12 LEU MD1 3.500 . 5.000 3.573 2.608 4.075 . 0 0 "[ . 1 . 2]" 1
93 1 11 ASP H 1 12 LEU HG 4.100 . 6.000 5.175 4.525 5.673 . 0 0 "[ . 1 . 2]" 1
94 1 11 ASP H 1 64 HIS HD2 3.300 . 4.600 4.578 3.955 4.702 0.102 19 0 "[ . 1 . 2]" 1
95 1 11 ASP HA 1 11 ASP HB2 2.300 . 2.900 2.459 2.376 2.652 . 0 0 "[ . 1 . 2]" 1
96 1 11 ASP HA 1 11 ASP HB3 2.300 . 2.900 2.431 2.277 2.952 0.052 15 0 "[ . 1 . 2]" 1
97 1 11 ASP HA 1 12 LEU H 1.900 . 2.300 2.499 2.226 2.588 0.288 10 0 "[ . 1 . 2]" 1
98 1 11 ASP HA 1 12 LEU MD1 3.600 . 5.200 4.414 4.169 4.665 . 0 0 "[ . 1 . 2]" 1
99 1 11 ASP HB2 1 12 LEU H 3.200 . 4.400 4.183 4.105 4.546 0.146 15 0 "[ . 1 . 2]" 1
100 1 11 ASP HB2 1 64 HIS HD2 2.500 . 3.300 1.939 1.790 3.387 0.087 15 0 "[ . 1 . 2]" 1
101 1 11 ASP HB2 1 65 PRO QG 3.000 . 4.100 3.529 3.096 4.283 0.183 15 0 "[ . 1 . 2]" 1
102 1 11 ASP HB3 1 12 LEU H 3.300 . 4.700 4.520 4.140 4.590 . 0 0 "[ . 1 . 2]" 1
103 1 11 ASP HB3 1 64 HIS HD2 2.500 . 3.300 3.321 1.901 3.431 0.131 13 0 "[ . 1 . 2]" 1
104 1 12 LEU H 1 12 LEU HA 2.200 . 2.800 2.896 2.881 2.912 0.112 20 0 "[ . 1 . 2]" 1
105 1 12 LEU H 1 12 LEU HB2 2.100 . 2.600 2.615 2.542 2.648 0.048 10 0 "[ . 1 . 2]" 1
106 1 12 LEU H 1 12 LEU HB3 2.900 . 4.000 3.722 3.680 3.747 . 0 0 "[ . 1 . 2]" 1
107 1 12 LEU H 1 12 LEU MD1 2.800 . 3.800 3.423 3.082 3.568 . 0 0 "[ . 1 . 2]" 1
108 1 12 LEU H 1 12 LEU MD2 2.400 . 3.100 2.352 2.165 2.517 . 0 0 "[ . 1 . 2]" 1
109 1 12 LEU H 1 12 LEU HG 3.000 . 4.100 4.331 4.258 4.396 0.296 4 0 "[ . 1 . 2]" 1
110 1 12 LEU H 1 13 VAL H 3.600 . 5.200 4.309 4.272 4.357 . 0 0 "[ . 1 . 2]" 1
111 1 12 LEU H 1 13 VAL MG1 3.800 . 6.000 6.105 6.035 6.167 0.167 15 0 "[ . 1 . 2]" 1
112 1 12 LEU H 1 13 VAL MG2 3.100 . 4.300 3.986 3.827 4.159 . 0 0 "[ . 1 . 2]" 1
113 1 12 LEU H 1 65 PRO QG 3.600 . 5.200 4.953 4.583 5.218 0.018 6 0 "[ . 1 . 2]" 1
114 1 12 LEU H 1 91 SER HA 3.600 . 5.300 5.215 4.926 5.343 0.043 5 0 "[ . 1 . 2]" 1
115 1 12 LEU H 1 92 ILE H 2.900 . 4.000 4.030 3.992 4.081 0.081 10 0 "[ . 1 . 2]" 1
116 1 12 LEU H 1 92 ILE HG13 3.500 . 5.000 4.122 3.856 4.370 . 0 0 "[ . 1 . 2]" 1
117 1 12 LEU H 1 93 ALA MB 4.100 . 6.000 5.413 4.897 6.007 0.007 3 0 "[ . 1 . 2]" 1
118 1 12 LEU HA 1 12 LEU HB2 2.600 . 3.500 2.985 2.961 3.002 . 0 0 "[ . 1 . 2]" 1
119 1 12 LEU HA 1 12 LEU HB3 2.400 . 3.100 2.404 2.364 2.426 . 0 0 "[ . 1 . 2]" 1
120 1 12 LEU HA 1 12 LEU MD1 1.900 . 2.300 2.269 2.209 2.324 0.024 20 0 "[ . 1 . 2]" 1
121 1 12 LEU HA 1 12 LEU HG 2.900 . 4.000 3.702 3.663 3.760 . 0 0 "[ . 1 . 2]" 1
122 1 12 LEU HA 1 13 VAL H 2.100 . 2.600 2.155 2.096 2.209 . 0 0 "[ . 1 . 2]" 1
123 1 12 LEU HA 1 13 VAL HA 2.900 . 4.000 4.169 4.159 4.178 0.178 6 0 "[ . 1 . 2]" 1
124 1 12 LEU HA 1 13 VAL MG1 4.000 . 6.000 4.984 4.938 5.046 . 0 0 "[ . 1 . 2]" 1
125 1 12 LEU HA 1 63 GLY H 3.800 . 5.600 4.067 3.889 4.285 . 0 0 "[ . 1 . 2]" 1
126 1 12 LEU HA 1 64 HIS H 4.100 . 6.000 4.210 4.078 4.330 . 0 0 "[ . 1 . 2]" 1
127 1 12 LEU HA 1 64 HIS HA 1.900 . 2.300 2.228 2.111 2.328 0.028 2 0 "[ . 1 . 2]" 1
128 1 12 LEU HA 1 65 PRO HD2 2.800 . 3.800 3.093 2.717 3.344 . 0 0 "[ . 1 . 2]" 1
129 1 12 LEU HA 1 65 PRO HD3 3.000 . 4.100 2.747 2.512 2.972 . 0 0 "[ . 1 . 2]" 1
130 1 12 LEU HA 1 92 ILE H 3.300 . 4.700 4.514 4.458 4.583 . 0 0 "[ . 1 . 2]" 1
131 1 12 LEU HB2 1 12 LEU MD1 2.700 . 3.600 3.209 3.187 3.224 . 0 0 "[ . 1 . 2]" 1
132 1 12 LEU HB2 1 12 LEU MD2 1.900 . 2.400 2.187 2.117 2.230 . 0 0 "[ . 1 . 2]" 1
133 1 12 LEU HB2 1 12 LEU HG 2.400 . 3.100 2.485 2.418 2.577 . 0 0 "[ . 1 . 2]" 1
134 1 12 LEU HB2 1 13 VAL H 3.500 . 5.000 3.517 3.391 3.646 . 0 0 "[ . 1 . 2]" 1
135 1 12 LEU HB2 1 63 GLY H 5.000 . 6.000 5.134 4.907 5.378 . 0 0 "[ . 1 . 2]" 1
136 1 12 LEU HB2 1 92 ILE H 3.100 . 4.300 3.619 3.457 3.799 . 0 0 "[ . 1 . 2]" 1
137 1 12 LEU HB2 1 92 ILE HG12 3.000 . 4.100 3.692 3.228 3.835 . 0 0 "[ . 1 . 2]" 1
138 1 12 LEU HB3 1 12 LEU MD1 2.200 . 2.800 2.590 2.538 2.666 . 0 0 "[ . 1 . 2]" 1
139 1 12 LEU HB3 1 12 LEU MD2 2.600 . 3.500 3.116 3.058 3.150 . 0 0 "[ . 1 . 2]" 1
140 1 12 LEU HB3 1 12 LEU HG 2.200 . 2.800 2.225 2.190 2.277 . 0 0 "[ . 1 . 2]" 1
141 1 12 LEU HB3 1 13 VAL H 2.200 . 2.800 2.402 2.198 2.612 . 0 0 "[ . 1 . 2]" 1
142 1 12 LEU HB3 1 63 GLY H 3.800 . 5.600 3.459 3.215 3.703 . 0 0 "[ . 1 . 2]" 1
143 1 12 LEU MD1 1 12 LEU HG 1.800 . 2.200 2.082 2.065 2.111 . 0 0 "[ . 1 . 2]" 1
144 1 12 LEU MD1 1 13 VAL H 3.300 . 4.600 3.604 3.432 3.817 . 0 0 "[ . 1 . 2]" 1
145 1 12 LEU MD1 1 63 GLY HA2 3.600 . 5.200 4.106 3.713 4.567 . 0 0 "[ . 1 . 2]" 1
146 1 12 LEU MD1 1 63 GLY HA3 2.600 . 3.400 2.854 2.436 3.330 . 0 0 "[ . 1 . 2]" 1
147 1 12 LEU MD1 1 64 HIS H 2.600 . 3.500 3.022 2.672 3.415 . 0 0 "[ . 1 . 2]" 1
148 1 12 LEU MD1 1 64 HIS HA 2.500 . 3.300 2.579 2.368 2.910 . 0 0 "[ . 1 . 2]" 1
149 1 12 LEU MD1 1 64 HIS HD2 3.000 . 4.100 3.722 3.424 4.038 . 0 0 "[ . 1 . 2]" 1
150 1 12 LEU MD2 1 12 LEU HG 1.700 . 2.200 2.055 2.026 2.086 . 0 0 "[ . 1 . 2]" 1
151 1 12 LEU MD2 1 13 VAL H 4.100 . 6.000 4.713 4.586 4.823 . 0 0 "[ . 1 . 2]" 1
152 1 12 LEU MD2 1 92 ILE H 3.800 . 5.600 5.011 4.721 5.190 . 0 0 "[ . 1 . 2]" 1
153 1 12 LEU MD2 1 92 ILE MD 2.900 . 4.000 4.114 4.047 4.180 0.180 20 0 "[ . 1 . 2]" 1
154 1 12 LEU MD2 1 93 ALA HA 2.300 . 3.000 2.511 2.197 2.770 . 0 0 "[ . 1 . 2]" 1
155 1 12 LEU MD2 1 94 LYS H 2.900 . 3.900 3.675 3.308 3.854 . 0 0 "[ . 1 . 2]" 1
156 1 12 LEU MD2 1 94 LYS HB2 2.900 . 4.000 2.829 2.384 3.099 . 0 0 "[ . 1 . 2]" 1
157 1 12 LEU MD2 1 94 LYS HB3 2.200 . 2.800 2.851 2.816 2.900 0.100 19 0 "[ . 1 . 2]" 1
158 1 12 LEU MD2 1 94 LYS QD 3.100 . 4.300 3.848 3.548 4.028 . 0 0 "[ . 1 . 2]" 1
159 1 12 LEU HG 1 13 VAL H 4.100 . 6.000 4.513 4.295 4.674 . 0 0 "[ . 1 . 2]" 1
160 1 12 LEU HG 1 94 LYS QD 2.400 . 3.100 3.168 2.874 3.235 0.135 17 0 "[ . 1 . 2]" 1
161 1 13 VAL H 1 13 VAL HA 2.400 . 3.100 2.753 2.742 2.764 . 0 0 "[ . 1 . 2]" 1
162 1 13 VAL H 1 13 VAL HB 2.500 . 3.300 2.719 2.692 2.763 . 0 0 "[ . 1 . 2]" 1
163 1 13 VAL H 1 13 VAL MG1 2.600 . 3.500 3.607 3.576 3.638 0.138 19 0 "[ . 1 . 2]" 1
164 1 13 VAL H 1 13 VAL MG2 2.800 . 3.800 3.332 3.276 3.381 . 0 0 "[ . 1 . 2]" 1
165 1 13 VAL H 1 62 GLU HA 3.800 . 5.600 4.088 3.887 4.309 . 0 0 "[ . 1 . 2]" 1
166 1 13 VAL H 1 63 GLY H 2.500 . 3.300 2.573 2.439 2.790 . 0 0 "[ . 1 . 2]" 1
167 1 13 VAL H 1 63 GLY HA2 3.900 . 5.800 4.547 4.478 4.642 . 0 0 "[ . 1 . 2]" 1
168 1 13 VAL H 1 63 GLY HA3 3.700 . 5.400 4.357 4.254 4.535 . 0 0 "[ . 1 . 2]" 1
169 1 13 VAL H 1 64 HIS H 4.200 . 6.000 4.841 4.771 4.905 . 0 0 "[ . 1 . 2]" 1
170 1 13 VAL H 1 64 HIS HA 3.300 . 4.700 3.638 3.463 3.834 . 0 0 "[ . 1 . 2]" 1
171 1 13 VAL H 1 68 VAL MG2 2.600 . 3.500 3.382 3.218 3.475 . 0 0 "[ . 1 . 2]" 1
172 1 13 VAL H 1 92 ILE HA 3.700 . 6.000 6.183 6.156 6.208 0.208 8 0 "[ . 1 . 2]" 1
173 1 13 VAL HA 1 13 VAL HB 2.400 . 3.100 3.003 2.978 3.019 . 0 0 "[ . 1 . 2]" 1
174 1 13 VAL HA 1 13 VAL MG1 2.500 . 3.300 2.469 2.437 2.502 . 0 0 "[ . 1 . 2]" 1
175 1 13 VAL HA 1 13 VAL MG2 2.000 . 2.500 2.339 2.309 2.370 . 0 0 "[ . 1 . 2]" 1
176 1 13 VAL HA 1 14 SER H 2.100 . 2.600 2.340 2.295 2.390 . 0 0 "[ . 1 . 2]" 1
177 1 13 VAL HA 1 90 GLU QG 3.700 . 5.400 4.633 4.395 5.025 . 0 0 "[ . 1 . 2]" 1
178 1 13 VAL HA 1 91 SER HA 1.600 . 2.200 2.072 1.911 2.233 0.033 17 0 "[ . 1 . 2]" 1
179 1 13 VAL HA 1 91 SER QB 3.700 . 5.400 3.986 3.747 4.153 . 0 0 "[ . 1 . 2]" 1
180 1 13 VAL HA 1 92 ILE H 2.200 . 2.800 1.888 1.844 1.959 . 0 0 "[ . 1 . 2]" 1
181 1 13 VAL HA 1 92 ILE HG13 3.300 . 4.700 3.278 3.090 3.637 . 0 0 "[ . 1 . 2]" 1
182 1 13 VAL HA 1 92 ILE MG 3.300 . 4.700 3.327 2.978 3.569 . 0 0 "[ . 1 . 2]" 1
183 1 13 VAL HB 1 13 VAL MG1 2.100 . 2.600 2.056 2.040 2.070 . 0 0 "[ . 1 . 2]" 1
184 1 13 VAL HB 1 13 VAL MG2 1.700 . 2.200 2.135 2.125 2.145 . 0 0 "[ . 1 . 2]" 1
185 1 13 VAL HB 1 14 SER H 2.800 . 3.800 3.939 3.906 3.986 0.186 17 0 "[ . 1 . 2]" 1
186 1 13 VAL HB 1 65 PRO HA 2.900 . 4.000 2.254 2.028 2.409 . 0 0 "[ . 1 . 2]" 1
187 1 13 VAL HB 1 68 VAL MG2 2.700 . 3.600 2.336 2.200 2.505 . 0 0 "[ . 1 . 2]" 1
188 1 13 VAL HB 1 91 SER HA 3.900 . 5.800 4.307 4.200 4.421 . 0 0 "[ . 1 . 2]" 1
189 1 13 VAL HB 1 92 ILE H 4.000 . 6.000 4.675 4.624 4.746 . 0 0 "[ . 1 . 2]" 1
190 1 13 VAL MG1 1 13 VAL MG2 1.700 . 2.200 1.999 1.962 2.023 . 0 0 "[ . 1 . 2]" 1
191 1 13 VAL MG1 1 14 SER H 2.800 . 3.700 2.043 1.941 2.119 . 0 0 "[ . 1 . 2]" 1
192 1 13 VAL MG1 1 63 GLY H 3.200 . 4.500 4.336 4.159 4.520 0.020 3 0 "[ . 1 . 2]" 1
193 1 13 VAL MG1 1 65 PRO HA 2.400 . 3.100 2.969 2.819 3.049 . 0 0 "[ . 1 . 2]" 1
194 1 13 VAL MG1 1 65 PRO HB2 3.400 . 4.800 4.780 4.508 4.833 0.033 15 0 "[ . 1 . 2]" 1
195 1 13 VAL MG1 1 65 PRO HB3 2.800 . 3.800 3.412 3.100 3.508 . 0 0 "[ . 1 . 2]" 1
196 1 13 VAL MG1 1 65 PRO HD2 4.400 . 6.000 5.324 5.160 5.479 . 0 0 "[ . 1 . 2]" 1
197 1 13 VAL MG1 1 65 PRO QG 3.200 . 4.500 4.426 4.167 4.556 0.056 1 0 "[ . 1 . 2]" 1
198 1 13 VAL MG1 1 68 VAL HB 2.700 . 3.600 3.521 3.324 3.625 0.025 11 0 "[ . 1 . 2]" 1
199 1 13 VAL MG1 1 68 VAL MG1 2.000 . 2.500 2.604 2.541 2.647 0.147 6 0 "[ . 1 . 2]" 1
200 1 13 VAL MG1 1 68 VAL MG2 2.000 . 2.500 2.553 2.536 2.590 0.090 10 0 "[ . 1 . 2]" 1
201 1 13 VAL MG1 1 90 GLU H 3.300 . 4.600 3.187 2.972 3.456 . 0 0 "[ . 1 . 2]" 1
202 1 13 VAL MG1 1 91 SER HA 3.600 . 5.200 2.989 2.815 3.262 . 0 0 "[ . 1 . 2]" 1
203 1 13 VAL MG1 1 91 SER QB 2.600 . 6.000 4.331 3.992 4.684 . 0 0 "[ . 1 . 2]" 1
204 1 13 VAL MG1 1 92 ILE H 2.800 . 3.800 3.973 3.940 3.999 0.199 18 0 "[ . 1 . 2]" 1
205 1 13 VAL MG2 1 14 SER H 3.200 . 4.500 3.638 3.562 3.761 . 0 0 "[ . 1 . 2]" 1
206 1 13 VAL MG2 1 64 HIS HA 3.600 . 5.200 4.318 4.128 4.408 . 0 0 "[ . 1 . 2]" 1
207 1 13 VAL MG2 1 65 PRO HA 2.600 . 3.400 2.810 2.534 2.963 . 0 0 "[ . 1 . 2]" 1
208 1 13 VAL MG2 1 65 PRO HB2 3.400 . 4.800 3.653 3.551 3.747 . 0 0 "[ . 1 . 2]" 1
209 1 13 VAL MG2 1 65 PRO HB3 2.600 . 3.400 2.110 2.006 2.228 . 0 0 "[ . 1 . 2]" 1
210 1 13 VAL MG2 1 65 PRO HD2 4.000 . 6.000 3.483 3.418 3.551 . 0 0 "[ . 1 . 2]" 1
211 1 13 VAL MG2 1 65 PRO HD3 3.000 . 4.100 2.028 1.960 2.094 . 0 0 "[ . 1 . 2]" 1
212 1 13 VAL MG2 1 65 PRO QG 2.200 . 2.800 2.494 2.299 2.644 . 0 0 "[ . 1 . 2]" 1
213 1 13 VAL MG2 1 68 VAL MG1 1.600 . 6.000 4.729 4.650 4.831 . 0 0 "[ . 1 . 2]" 1
214 1 13 VAL MG2 1 90 GLU H 3.600 . 5.200 4.930 4.651 5.208 0.008 8 0 "[ . 1 . 2]" 1
215 1 13 VAL MG2 1 91 SER H 3.100 . 4.300 3.916 3.679 4.142 . 0 0 "[ . 1 . 2]" 1
216 1 13 VAL MG2 1 91 SER HA 1.900 . 2.300 1.962 1.866 2.040 . 0 0 "[ . 1 . 2]" 1
217 1 13 VAL MG2 1 91 SER QB 2.700 . 3.600 2.848 2.498 3.220 . 0 0 "[ . 1 . 2]" 1
218 1 13 VAL MG2 1 92 ILE H 3.300 . 4.600 3.156 3.071 3.265 . 0 0 "[ . 1 . 2]" 1
219 1 14 SER H 1 14 SER HA 2.900 . 4.000 2.924 2.893 2.955 . 0 0 "[ . 1 . 2]" 1
220 1 14 SER H 1 14 SER HB2 3.100 . 4.300 3.153 2.592 3.874 . 0 0 "[ . 1 . 2]" 1
221 1 14 SER H 1 14 SER HB3 3.200 . 4.500 3.332 2.697 3.809 . 0 0 "[ . 1 . 2]" 1
222 1 14 SER H 1 15 CYS H 4.200 . 6.000 4.063 3.970 4.266 . 0 0 "[ . 1 . 2]" 1
223 1 14 SER H 1 90 GLU H 2.800 . 3.800 3.051 2.868 3.215 . 0 0 "[ . 1 . 2]" 1
224 1 14 SER H 1 90 GLU QG 3.300 . 4.700 3.140 2.863 3.604 . 0 0 "[ . 1 . 2]" 1
225 1 14 SER H 1 91 SER HA 3.300 . 4.700 3.473 3.331 3.742 . 0 0 "[ . 1 . 2]" 1
226 1 14 SER H 1 91 SER QB 4.300 . 6.000 5.287 5.116 5.534 . 0 0 "[ . 1 . 2]" 1
227 1 14 SER H 1 92 ILE H 3.700 . 5.400 3.677 3.568 3.824 . 0 0 "[ . 1 . 2]" 1
228 1 14 SER H 1 92 ILE HG13 4.000 . 6.000 4.493 4.338 4.884 . 0 0 "[ . 1 . 2]" 1
229 1 14 SER H 1 92 ILE MG 3.000 . 4.100 2.920 2.603 3.195 . 0 0 "[ . 1 . 2]" 1
230 1 14 SER HA 1 14 SER HB2 2.900 . 4.000 2.704 2.463 3.027 . 0 0 "[ . 1 . 2]" 1
231 1 14 SER HA 1 15 CYS H 2.500 . 3.300 2.107 2.050 2.168 . 0 0 "[ . 1 . 2]" 1
232 1 14 SER HA 1 15 CYS HB2 4.000 . 6.000 4.752 4.465 5.697 . 0 0 "[ . 1 . 2]" 1
233 1 14 SER HA 1 61 LEU H 3.600 . 5.200 3.938 3.763 4.220 . 0 0 "[ . 1 . 2]" 1
234 1 14 SER HA 1 62 GLU HA 2.100 . 2.700 2.591 2.247 2.744 0.044 2 0 "[ . 1 . 2]" 1
235 1 14 SER HA 1 63 GLY H 3.500 . 5.000 3.506 3.271 3.701 . 0 0 "[ . 1 . 2]" 1
236 1 14 SER HB2 1 15 CYS H 4.300 . 6.000 4.095 3.223 4.441 . 0 0 "[ . 1 . 2]" 1
237 1 14 SER HB2 1 90 GLU H 3.900 . 5.800 4.469 3.421 5.255 . 0 0 "[ . 1 . 2]" 1
238 1 14 SER HB2 1 92 ILE MG 3.100 . 4.300 2.766 2.163 3.938 . 0 0 "[ . 1 . 2]" 1
239 1 14 SER HB3 1 15 CYS H 4.300 . 6.000 3.966 3.438 4.323 . 0 0 "[ . 1 . 2]" 1
240 1 15 CYS H 1 15 CYS HB2 3.100 . 4.300 2.689 2.399 3.699 . 0 0 "[ . 1 . 2]" 1
241 1 15 CYS H 1 15 CYS HB3 3.600 . 5.200 3.450 2.679 3.645 . 0 0 "[ . 1 . 2]" 1
242 1 15 CYS H 1 61 LEU H 2.900 . 4.000 3.160 2.832 3.458 . 0 0 "[ . 1 . 2]" 1
243 1 15 CYS H 1 61 LEU HB2 4.000 . 6.000 5.228 4.774 5.655 . 0 0 "[ . 1 . 2]" 1
244 1 15 CYS H 1 61 LEU HB3 4.500 . 6.000 5.584 5.399 5.911 . 0 0 "[ . 1 . 2]" 1
245 1 15 CYS H 1 61 LEU MD1 4.500 . 6.000 4.175 2.470 4.677 . 0 0 "[ . 1 . 2]" 1
246 1 15 CYS H 1 62 GLU HA 3.600 . 5.200 4.324 3.863 4.539 . 0 0 "[ . 1 . 2]" 1
247 1 15 CYS HA 1 15 CYS HB2 2.400 . 3.100 2.921 2.449 3.040 . 0 0 "[ . 1 . 2]" 1
248 1 15 CYS HA 1 15 CYS HB3 2.700 . 3.600 2.497 2.469 2.524 . 0 0 "[ . 1 . 2]" 1
249 1 15 CYS HA 1 16 CYS H 2.300 . 3.000 2.153 2.106 2.229 . 0 0 "[ . 1 . 2]" 1
250 1 15 CYS HA 1 89 GLU H 3.400 . 4.900 4.704 4.587 4.831 . 0 0 "[ . 1 . 2]" 1
251 1 15 CYS HA 1 89 GLU HA 1.800 . 2.200 2.134 2.007 2.209 0.009 2 0 "[ . 1 . 2]" 1
252 1 15 CYS HA 1 89 GLU HB3 3.400 . 4.800 3.717 3.384 4.052 . 0 0 "[ . 1 . 2]" 1
253 1 15 CYS HA 1 89 GLU HG2 2.900 . 3.900 2.870 2.402 3.619 . 0 0 "[ . 1 . 2]" 1
254 1 15 CYS HA 1 90 GLU H 3.200 . 4.500 3.384 3.065 3.593 . 0 0 "[ . 1 . 2]" 1
255 1 15 CYS HB2 1 16 CYS H 3.900 . 5.800 4.088 3.363 4.337 . 0 0 "[ . 1 . 2]" 1
256 1 15 CYS HB2 1 68 VAL MG1 2.500 . 3.300 2.720 2.332 3.466 0.166 19 0 "[ . 1 . 2]" 1
257 1 15 CYS HB2 1 89 GLU HG2 3.500 . 5.000 3.846 2.546 4.850 . 0 0 "[ . 1 . 2]" 1
258 1 15 CYS HB3 1 16 CYS H 3.800 . 5.600 3.590 3.221 4.365 . 0 0 "[ . 1 . 2]" 1
259 1 15 CYS HB3 1 61 LEU H 4.500 . 6.000 5.124 4.758 5.425 . 0 0 "[ . 1 . 2]" 1
260 1 15 CYS HB3 1 61 LEU MD1 3.900 . 5.800 5.063 3.672 5.818 0.018 18 0 "[ . 1 . 2]" 1
261 1 15 CYS HB3 1 68 VAL MG1 3.300 . 4.600 3.406 2.049 3.842 . 0 0 "[ . 1 . 2]" 1
262 1 16 CYS H 1 16 CYS HA 2.500 . 3.300 2.945 2.919 2.955 . 0 0 "[ . 1 . 2]" 1
263 1 16 CYS H 1 16 CYS QB 3.000 . 4.100 2.514 2.299 2.601 . 0 0 "[ . 1 . 2]" 1
264 1 16 CYS H 1 86 ILE HB 3.800 . 5.600 5.617 5.481 5.691 0.091 14 0 "[ . 1 . 2]" 1
265 1 16 CYS H 1 86 ILE MG 3.200 . 4.500 3.027 2.836 3.197 . 0 0 "[ . 1 . 2]" 1
266 1 16 CYS H 1 88 ALA H 2.700 . 3.600 3.667 3.602 3.725 0.125 9 0 "[ . 1 . 2]" 1
267 1 16 CYS H 1 88 ALA MB 2.800 . 3.800 2.890 2.720 3.199 . 0 0 "[ . 1 . 2]" 1
268 1 16 CYS H 1 89 GLU HA 3.000 . 4.100 3.289 3.017 3.473 . 0 0 "[ . 1 . 2]" 1
269 1 16 CYS H 1 89 GLU HB3 3.900 . 5.800 5.342 4.985 5.567 . 0 0 "[ . 1 . 2]" 1
270 1 16 CYS H 1 89 GLU HG2 3.300 . 4.700 4.114 3.687 4.681 . 0 0 "[ . 1 . 2]" 1
271 1 16 CYS H 1 89 GLU HG3 3.300 . 4.700 4.514 4.242 4.712 0.012 13 0 "[ . 1 . 2]" 1
272 1 16 CYS HA 1 17 TYR H 2.300 . 3.000 2.272 2.193 2.363 . 0 0 "[ . 1 . 2]" 1
273 1 16 CYS HA 1 17 TYR HB2 3.600 . 5.300 5.630 5.517 5.711 0.411 1 0 "[ . 1 . 2]" 1
274 1 16 CYS HA 1 60 TRP HA 2.100 . 2.700 2.636 2.490 2.742 0.042 19 0 "[ . 1 . 2]" 1
275 1 16 CYS HA 1 60 TRP HE1 4.700 . 6.000 6.098 6.051 6.167 0.167 4 0 "[ . 1 . 2]" 1
276 1 16 CYS HA 1 61 LEU H 3.200 . 4.500 3.727 3.594 3.916 . 0 0 "[ . 1 . 2]" 1
277 1 16 CYS QB 1 17 TYR H 4.400 . 6.000 3.587 3.126 4.007 . 0 0 "[ . 1 . 2]" 1
278 1 16 CYS QB 1 88 ALA H 3.200 . 4.400 4.176 3.918 4.387 . 0 0 "[ . 1 . 2]" 1
279 1 16 CYS QB 1 88 ALA MB 3.100 . 4.300 2.048 1.901 2.313 . 0 0 "[ . 1 . 2]" 1
280 1 17 TYR H 1 17 TYR HB3 4.300 . 6.000 2.933 2.831 3.116 . 0 0 "[ . 1 . 2]" 1
281 1 17 TYR H 1 17 TYR QD 3.200 . 4.500 3.268 3.030 3.488 . 0 0 "[ . 1 . 2]" 1
282 1 17 TYR H 1 58 PHE QB 4.400 . 6.000 5.995 5.726 6.098 0.098 9 0 "[ . 1 . 2]" 1
283 1 17 TYR H 1 60 TRP HA 3.100 . 4.300 2.961 2.835 3.203 . 0 0 "[ . 1 . 2]" 1
284 1 17 TYR H 1 61 LEU MD2 4.000 . 6.000 4.783 4.153 5.954 . 0 0 "[ . 1 . 2]" 1
285 1 17 TYR HA 1 17 TYR HB2 2.500 . 3.300 2.291 2.242 2.331 . 0 0 "[ . 1 . 2]" 1
286 1 17 TYR HA 1 17 TYR HB3 2.500 . 3.300 2.460 2.386 2.515 . 0 0 "[ . 1 . 2]" 1
287 1 17 TYR HA 1 17 TYR QD 3.100 . 4.300 3.739 3.692 3.782 . 0 0 "[ . 1 . 2]" 1
288 1 17 TYR HA 1 18 ARG H 2.500 . 3.300 2.255 2.046 2.370 . 0 0 "[ . 1 . 2]" 1
289 1 17 TYR HA 1 84 VAL QG 3.800 . 5.600 4.766 4.598 5.059 . 0 0 "[ . 1 . 2]" 1
290 1 17 TYR HA 1 86 ILE H 4.000 . 6.000 4.489 4.293 4.805 . 0 0 "[ . 1 . 2]" 1
291 1 17 TYR HA 1 86 ILE HA 2.400 . 3.100 2.206 2.013 2.728 . 0 0 "[ . 1 . 2]" 1
292 1 17 TYR HA 1 86 ILE HB 3.500 . 5.100 4.939 4.770 5.132 0.032 16 0 "[ . 1 . 2]" 1
293 1 17 TYR HA 1 86 ILE MD 2.500 . 6.000 3.921 3.720 4.364 . 0 0 "[ . 1 . 2]" 1
294 1 17 TYR HA 1 86 ILE MG 3.700 . 5.400 3.675 3.463 3.991 . 0 0 "[ . 1 . 2]" 1
295 1 17 TYR HA 1 87 LEU H 3.100 . 4.300 4.792 4.728 4.838 0.538 1 8 "[+-**. ** 1 * *2]" 1
296 1 17 TYR HA 1 88 ALA H 3.400 . 4.900 3.788 3.617 4.018 . 0 0 "[ . 1 . 2]" 1
297 1 17 TYR HB2 1 17 TYR QD 2.300 . 3.000 2.548 2.331 2.684 . 0 0 "[ . 1 . 2]" 1
298 1 17 TYR HB2 1 18 ARG H 3.800 . 5.600 2.486 2.047 2.777 . 0 0 "[ . 1 . 2]" 1
299 1 17 TYR HB2 1 60 TRP HA 2.700 . 6.000 6.108 6.050 6.160 0.160 14 0 "[ . 1 . 2]" 1
300 1 17 TYR HB2 1 86 ILE H 3.900 . 5.800 3.104 2.928 3.445 . 0 0 "[ . 1 . 2]" 1
301 1 17 TYR HB2 1 86 ILE HA 2.600 . 3.500 1.905 1.880 1.941 . 0 0 "[ . 1 . 2]" 1
302 1 17 TYR HB2 1 86 ILE MD 2.900 . 3.900 2.281 2.007 2.802 . 0 0 "[ . 1 . 2]" 1
303 1 17 TYR HB2 1 86 ILE MG 2.800 . 3.800 3.550 3.426 3.746 . 0 0 "[ . 1 . 2]" 1
304 1 17 TYR HB3 1 17 TYR QD 2.300 . 3.000 2.235 2.082 2.370 . 0 0 "[ . 1 . 2]" 1
305 1 17 TYR HB3 1 18 ARG H 2.900 . 4.000 3.811 3.488 3.926 . 0 0 "[ . 1 . 2]" 1
306 1 17 TYR HB3 1 60 TRP HA 2.700 . 6.000 4.763 4.643 4.855 . 0 0 "[ . 1 . 2]" 1
307 1 17 TYR HB3 1 86 ILE H 3.700 . 5.500 4.006 3.822 4.319 . 0 0 "[ . 1 . 2]" 1
308 1 17 TYR HB3 1 86 ILE HA 3.400 . 4.800 1.826 1.733 1.944 0.267 18 0 "[ . 1 . 2]" 1
309 1 17 TYR HB3 1 86 ILE MD 3.100 . 4.300 2.307 2.061 2.865 . 0 0 "[ . 1 . 2]" 1
310 1 17 TYR HB3 1 88 ALA H 3.300 . 4.600 4.749 4.588 4.908 0.308 17 0 "[ . 1 . 2]" 1
311 1 17 TYR QD 1 18 ARG H 3.400 . 4.800 3.019 2.617 3.692 . 0 0 "[ . 1 . 2]" 1
312 1 17 TYR QD 1 18 ARG HA 3.000 . 4.100 3.289 2.834 3.974 . 0 0 "[ . 1 . 2]" 1
313 1 17 TYR QD 1 18 ARG QD 3.800 . 5.600 5.184 4.407 5.760 0.160 3 0 "[ . 1 . 2]" 1
314 1 17 TYR QD 1 19 SER H 3.400 . 4.900 3.649 3.021 4.097 . 0 0 "[ . 1 . 2]" 1
315 1 17 TYR QD 1 61 LEU MD2 2.900 . 4.000 3.359 2.803 4.074 0.074 3 0 "[ . 1 . 2]" 1
316 1 17 TYR QD 1 72 MET ME 2.700 . 3.600 2.543 2.040 2.797 . 0 0 "[ . 1 . 2]" 1
317 1 17 TYR QD 1 76 GLN HE21 2.600 . 6.000 5.339 4.716 5.599 . 0 0 "[ . 1 . 2]" 1
318 1 17 TYR QD 1 84 VAL HA 3.100 . 4.300 3.165 2.751 3.670 . 0 0 "[ . 1 . 2]" 1
319 1 17 TYR QD 1 84 VAL QG 2.300 . 3.000 2.398 2.034 2.652 . 0 0 "[ . 1 . 2]" 1
320 1 17 TYR QD 1 85 GLU H 3.600 . 5.200 3.769 3.415 4.227 . 0 0 "[ . 1 . 2]" 1
321 1 17 TYR QD 1 86 ILE MD 3.200 . 4.500 2.739 2.297 3.497 . 0 0 "[ . 1 . 2]" 1
322 1 17 TYR QE 1 57 PHE HZ 3.200 . 6.000 6.169 6.076 6.308 0.308 11 0 "[ . 1 . 2]" 1
323 1 17 TYR QE 1 60 TRP HA 3.300 . 4.600 4.533 4.234 4.701 0.101 1 0 "[ . 1 . 2]" 1
324 1 17 TYR QE 1 72 MET ME 2.500 . 3.300 3.140 2.332 3.345 0.045 10 0 "[ . 1 . 2]" 1
325 1 17 TYR QE 1 75 ILE MD 2.300 . 2.900 2.341 1.927 2.903 0.003 3 0 "[ . 1 . 2]" 1
326 1 17 TYR QE 1 75 ILE MG 2.500 . 3.300 3.002 2.092 3.415 0.115 16 0 "[ . 1 . 2]" 1
327 1 17 TYR QE 1 81 HIS HE1 2.700 . 3.600 3.502 2.896 3.656 0.056 4 0 "[ . 1 . 2]" 1
328 1 17 TYR QE 1 84 VAL H 4.500 . 6.000 5.057 4.410 5.531 . 0 0 "[ . 1 . 2]" 1
329 1 17 TYR QE 1 84 VAL QG 3.700 . 5.400 2.620 2.248 2.738 . 0 0 "[ . 1 . 2]" 1
330 1 17 TYR QE 1 86 ILE H 3.200 . 6.000 6.255 6.186 6.390 0.390 16 0 "[ . 1 . 2]" 1
331 1 17 TYR HH 1 75 ILE MD 2.900 . 4.000 2.923 2.347 3.878 . 0 0 "[ . 1 . 2]" 1
332 1 18 ARG H 1 18 ARG HB2 3.300 . 4.700 3.423 2.693 3.973 . 0 0 "[ . 1 . 2]" 1
333 1 18 ARG H 1 18 ARG HB3 3.700 . 5.400 2.676 2.126 3.034 . 0 0 "[ . 1 . 2]" 1
334 1 18 ARG H 1 18 ARG QD 3.600 . 5.200 3.642 2.164 4.615 . 0 0 "[ . 1 . 2]" 1
335 1 18 ARG H 1 18 ARG QG 3.300 . 4.600 3.495 2.164 4.218 . 0 0 "[ . 1 . 2]" 1
336 1 18 ARG H 1 84 VAL QG 4.200 . 6.000 4.281 3.980 4.731 . 0 0 "[ . 1 . 2]" 1
337 1 18 ARG H 1 85 GLU H 3.300 . 4.700 3.558 3.219 3.828 . 0 0 "[ . 1 . 2]" 1
338 1 18 ARG H 1 86 ILE HA 3.900 . 5.800 3.455 3.215 3.686 . 0 0 "[ . 1 . 2]" 1
339 1 18 ARG H 1 86 ILE HB 4.100 . 6.000 5.985 5.711 6.099 0.099 7 0 "[ . 1 . 2]" 1
340 1 18 ARG H 1 87 LEU H 4.100 . 6.000 5.502 5.122 5.675 . 0 0 "[ . 1 . 2]" 1
341 1 18 ARG H 1 88 ALA H 2.900 . 6.000 5.427 4.848 5.753 . 0 0 "[ . 1 . 2]" 1
342 1 18 ARG HA 1 18 ARG HB3 3.000 . 4.100 2.790 2.501 3.036 . 0 0 "[ . 1 . 2]" 1
343 1 18 ARG HA 1 18 ARG QG 3.500 . 5.000 3.018 2.521 3.416 . 0 0 "[ . 1 . 2]" 1
344 1 18 ARG HA 1 19 SER H 2.300 . 3.000 2.238 2.112 2.361 . 0 0 "[ . 1 . 2]" 1
345 1 18 ARG HA 1 19 SER HB2 3.900 . 5.800 4.710 4.458 5.763 . 0 0 "[ . 1 . 2]" 1
346 1 18 ARG HA 1 58 PHE HA 2.400 . 3.100 2.522 2.113 3.130 0.030 18 0 "[ . 1 . 2]" 1
347 1 18 ARG HA 1 58 PHE QB 3.600 . 5.200 3.926 3.616 4.222 . 0 0 "[ . 1 . 2]" 1
348 1 18 ARG HB2 1 18 ARG QD 3.500 . 5.000 3.020 2.140 3.588 . 0 0 "[ . 1 . 2]" 1
349 1 18 ARG HB2 1 18 ARG HE 3.700 . 5.400 4.435 3.847 5.094 . 0 0 "[ . 1 . 2]" 1
350 1 18 ARG HB2 1 19 SER H 3.700 . 5.400 3.433 2.509 4.457 . 0 0 "[ . 1 . 2]" 1
351 1 18 ARG HB3 1 18 ARG QD 3.300 . 4.700 2.531 2.044 3.025 . 0 0 "[ . 1 . 2]" 1
352 1 18 ARG HB3 1 19 SER HA 3.600 . 5.200 5.027 4.501 5.340 0.140 7 0 "[ . 1 . 2]" 1
353 1 18 ARG HB3 1 85 GLU HB2 3.500 . 5.000 4.180 2.843 5.006 0.006 20 0 "[ . 1 . 2]" 1
354 1 18 ARG HE 1 18 ARG QG 3.300 . 4.600 2.628 2.181 3.201 . 0 0 "[ . 1 . 2]" 1
355 1 18 ARG HE 1 20 LEU MD2 3.800 . 5.600 2.883 2.061 3.481 . 0 0 "[ . 1 . 2]" 1
356 1 18 ARG HE 1 84 VAL H 4.700 . 6.000 6.017 5.430 6.113 0.113 5 0 "[ . 1 . 2]" 1
357 1 18 ARG HE 1 85 GLU HB2 4.100 . 6.000 2.739 1.966 4.944 0.034 4 0 "[ . 1 . 2]" 1
358 1 18 ARG HE 1 85 GLU HB3 4.200 . 6.000 3.891 3.057 5.126 . 0 0 "[ . 1 . 2]" 1
359 1 18 ARG QG 1 19 SER H 3.800 . 5.600 3.195 2.620 3.739 . 0 0 "[ . 1 . 2]" 1
360 1 19 SER H 1 19 SER HA 2.900 . 3.900 2.867 2.810 2.933 . 0 0 "[ . 1 . 2]" 1
361 1 19 SER H 1 19 SER HB2 3.700 . 5.400 3.017 2.554 3.852 . 0 0 "[ . 1 . 2]" 1
362 1 19 SER H 1 19 SER HB3 3.500 . 5.000 3.624 2.462 3.927 . 0 0 "[ . 1 . 2]" 1
363 1 19 SER H 1 20 LEU MD1 3.500 . 5.000 4.658 4.185 5.022 0.022 16 0 "[ . 1 . 2]" 1
364 1 19 SER H 1 56 VAL HA 4.200 . 6.000 4.830 4.371 5.179 . 0 0 "[ . 1 . 2]" 1
365 1 19 SER H 1 57 PHE H 3.000 . 4.100 3.182 2.863 3.556 . 0 0 "[ . 1 . 2]" 1
366 1 19 SER H 1 57 PHE QB 3.600 . 5.200 2.642 2.239 3.370 . 0 0 "[ . 1 . 2]" 1
367 1 19 SER H 1 57 PHE QD 3.900 . 5.800 4.604 4.170 4.998 . 0 0 "[ . 1 . 2]" 1
368 1 19 SER H 1 58 PHE HA 3.300 . 4.700 3.460 2.985 3.792 . 0 0 "[ . 1 . 2]" 1
369 1 19 SER HA 1 19 SER HB2 2.300 . 3.000 2.881 2.466 3.038 0.038 4 0 "[ . 1 . 2]" 1
370 1 19 SER HA 1 19 SER HB3 2.100 . 2.700 2.528 2.318 2.926 0.226 15 0 "[ . 1 . 2]" 1
371 1 19 SER HA 1 20 LEU H 2.400 . 3.100 2.365 2.136 2.490 . 0 0 "[ . 1 . 2]" 1
372 1 19 SER HA 1 83 ASN HB3 3.900 . 5.800 4.659 1.963 5.781 0.037 20 0 "[ . 1 . 2]" 1
373 1 19 SER HA 1 84 VAL H 3.300 . 4.700 3.105 2.690 3.473 . 0 0 "[ . 1 . 2]" 1
374 1 19 SER HA 1 84 VAL HA 3.600 . 5.200 2.941 2.453 3.297 . 0 0 "[ . 1 . 2]" 1
375 1 19 SER HA 1 84 VAL HB 3.900 . 5.800 4.559 4.153 4.909 . 0 0 "[ . 1 . 2]" 1
376 1 19 SER HA 1 84 VAL QG 3.700 . 5.400 4.325 3.895 4.648 . 0 0 "[ . 1 . 2]" 1
377 1 19 SER HA 1 85 GLU H 3.400 . 4.800 3.044 2.648 3.437 . 0 0 "[ . 1 . 2]" 1
378 1 19 SER HB2 1 20 LEU H 3.100 . 4.300 3.497 2.358 4.113 . 0 0 "[ . 1 . 2]" 1
379 1 19 SER HB2 1 84 VAL QG 3.800 . 5.600 4.045 2.242 4.515 . 0 0 "[ . 1 . 2]" 1
380 1 19 SER HB3 1 20 LEU H 3.000 . 4.100 2.827 2.061 3.739 . 0 0 "[ . 1 . 2]" 1
381 1 19 SER HB3 1 57 PHE QB 3.400 . 4.900 3.029 1.883 3.910 0.017 1 0 "[ . 1 . 2]" 1
382 1 19 SER HB3 1 84 VAL QG 4.000 . 6.000 3.909 2.858 4.404 . 0 0 "[ . 1 . 2]" 1
383 1 20 LEU H 1 20 LEU HA 3.000 . 4.100 2.944 2.890 2.988 . 0 0 "[ . 1 . 2]" 1
384 1 20 LEU H 1 20 LEU QB 2.600 . 3.500 2.494 2.231 2.732 . 0 0 "[ . 1 . 2]" 1
385 1 20 LEU H 1 20 LEU MD2 3.300 . 4.700 2.573 2.384 2.801 . 0 0 "[ . 1 . 2]" 1
386 1 20 LEU H 1 20 LEU HG 3.600 . 5.200 4.399 4.132 4.616 . 0 0 "[ . 1 . 2]" 1
387 1 20 LEU H 1 21 ALA H 3.200 . 4.500 3.430 2.791 4.424 . 0 0 "[ . 1 . 2]" 1
388 1 20 LEU H 1 81 HIS HB3 4.100 . 6.000 5.860 4.803 6.094 0.094 4 0 "[ . 1 . 2]" 1
389 1 20 LEU H 1 82 SER H 3.100 . 4.300 3.533 3.125 3.913 . 0 0 "[ . 1 . 2]" 1
390 1 20 LEU H 1 83 ASN HB2 3.100 . 4.300 3.578 2.346 4.325 0.025 10 0 "[ . 1 . 2]" 1
391 1 20 LEU H 1 83 ASN HB3 3.900 . 5.800 4.914 2.101 5.825 0.025 8 0 "[ . 1 . 2]" 1
392 1 20 LEU H 1 84 VAL H 3.700 . 5.400 3.586 3.077 3.802 . 0 0 "[ . 1 . 2]" 1
393 1 20 LEU H 1 84 VAL QG 4.000 . 6.000 5.327 4.806 5.571 . 0 0 "[ . 1 . 2]" 1
394 1 20 LEU H 1 85 GLU H 3.500 . 5.000 5.060 4.709 5.179 0.179 18 0 "[ . 1 . 2]" 1
395 1 20 LEU HA 1 20 LEU QB 2.800 . 3.700 2.435 2.366 2.491 . 0 0 "[ . 1 . 2]" 1
396 1 20 LEU HA 1 20 LEU MD1 2.900 . 3.900 2.081 1.963 2.162 . 0 0 "[ . 1 . 2]" 1
397 1 20 LEU HA 1 20 LEU MD2 2.900 . 4.000 2.904 2.709 3.199 . 0 0 "[ . 1 . 2]" 1
398 1 20 LEU HA 1 20 LEU HG 3.100 . 4.300 3.789 3.707 3.839 . 0 0 "[ . 1 . 2]" 1
399 1 20 LEU HA 1 21 ALA H 2.100 . 2.700 2.504 2.178 2.721 0.021 16 0 "[ . 1 . 2]" 1
400 1 20 LEU HA 1 56 VAL HA 2.300 . 3.000 2.422 2.101 2.716 . 0 0 "[ . 1 . 2]" 1
401 1 20 LEU HA 1 57 PHE H 3.100 . 4.300 2.754 2.284 3.372 . 0 0 "[ . 1 . 2]" 1
402 1 20 LEU HA 1 82 SER H 3.600 . 5.200 5.175 4.663 5.372 0.172 9 0 "[ . 1 . 2]" 1
403 1 20 LEU QB 1 21 ALA H 3.100 . 4.300 3.644 2.229 3.904 . 0 0 "[ . 1 . 2]" 1
404 1 20 LEU QB 1 82 SER H 3.500 . 5.100 4.528 3.533 5.014 . 0 0 "[ . 1 . 2]" 1
405 1 20 LEU QB 1 83 ASN HD21 3.600 . 5.300 3.913 2.859 5.171 . 0 0 "[ . 1 . 2]" 1
406 1 20 LEU QB 1 83 ASN HD22 3.700 . 5.400 4.119 2.744 5.513 0.113 16 0 "[ . 1 . 2]" 1
407 1 20 LEU MD1 1 21 ALA H 3.800 . 5.600 4.136 3.344 4.437 . 0 0 "[ . 1 . 2]" 1
408 1 20 LEU MD1 1 57 PHE H 3.500 . 5.000 3.506 3.127 4.313 . 0 0 "[ . 1 . 2]" 1
409 1 20 LEU MD2 1 56 VAL HB 3.200 . 4.500 4.545 4.503 4.596 0.096 8 0 "[ . 1 . 2]" 1
410 1 20 LEU MD2 1 83 ASN HB2 2.700 . 3.600 3.191 2.305 3.649 0.049 10 0 "[ . 1 . 2]" 1
411 1 20 LEU MD2 1 83 ASN HD21 3.200 . 4.500 3.009 1.892 4.628 0.128 18 0 "[ . 1 . 2]" 1
412 1 20 LEU MD2 1 83 ASN HD22 3.200 . 4.500 3.516 2.353 4.524 0.024 8 0 "[ . 1 . 2]" 1
413 1 20 LEU MD2 1 85 GLU HB3 2.600 . 6.000 5.732 5.133 6.040 0.040 15 0 "[ . 1 . 2]" 1
414 1 21 ALA H 1 21 ALA HA 2.900 . 3.900 2.579 2.396 2.935 . 0 0 "[ . 1 . 2]" 1
415 1 21 ALA H 1 21 ALA MB 2.400 . 3.100 2.380 2.231 2.536 . 0 0 "[ . 1 . 2]" 1
416 1 21 ALA H 1 52 TYR QE 4.200 . 6.000 5.234 4.084 5.708 . 0 0 "[ . 1 . 2]" 1
417 1 21 ALA H 1 55 GLY HA3 4.100 . 6.000 5.019 3.595 5.720 . 0 0 "[ . 1 . 2]" 1
418 1 21 ALA H 1 56 VAL H 4.100 . 6.000 5.639 4.936 6.040 0.040 9 0 "[ . 1 . 2]" 1
419 1 21 ALA H 1 56 VAL HA 2.900 . 3.900 3.559 3.012 3.937 0.037 19 0 "[ . 1 . 2]" 1
420 1 21 ALA H 1 57 PHE H 3.500 . 5.100 3.086 2.580 4.198 . 0 0 "[ . 1 . 2]" 1
421 1 21 ALA H 1 57 PHE QE 4.300 . 6.000 4.585 3.401 5.174 . 0 0 "[ . 1 . 2]" 1
422 1 21 ALA HA 1 21 ALA MB 2.400 . 3.100 2.109 2.088 2.145 . 0 0 "[ . 1 . 2]" 1
423 1 21 ALA HA 1 22 ALA H 2.200 . 2.800 2.224 2.096 2.445 . 0 0 "[ . 1 . 2]" 1
424 1 21 ALA HA 1 57 PHE QD 3.100 . 4.300 2.441 2.101 2.907 . 0 0 "[ . 1 . 2]" 1
425 1 21 ALA HA 1 57 PHE QE 2.800 . 3.800 3.014 2.144 3.574 . 0 0 "[ . 1 . 2]" 1
426 1 21 ALA HA 1 81 HIS H 2.900 . 6.000 5.079 4.841 5.404 . 0 0 "[ . 1 . 2]" 1
427 1 21 ALA HA 1 81 HIS HA 2.500 . 3.300 2.432 2.093 2.723 . 0 0 "[ . 1 . 2]" 1
428 1 21 ALA HA 1 82 SER H 3.100 . 4.300 2.589 2.194 3.035 . 0 0 "[ . 1 . 2]" 1
429 1 21 ALA MB 1 22 ALA H 2.900 . 3.900 3.232 2.910 3.421 . 0 0 "[ . 1 . 2]" 1
430 1 21 ALA MB 1 52 TYR QD 3.500 . 5.000 3.642 3.454 3.929 . 0 0 "[ . 1 . 2]" 1
431 1 21 ALA MB 1 52 TYR QE 2.200 . 2.800 2.532 2.191 2.816 0.016 20 0 "[ . 1 . 2]" 1
432 1 21 ALA MB 1 55 GLY HA3 4.000 . 6.000 3.082 2.399 3.884 . 0 0 "[ . 1 . 2]" 1
433 1 21 ALA MB 1 56 VAL H 3.800 . 5.600 4.856 4.028 5.495 . 0 0 "[ . 1 . 2]" 1
434 1 21 ALA MB 1 57 PHE QB 2.800 . 3.800 2.955 1.901 3.839 0.039 1 0 "[ . 1 . 2]" 1
435 1 21 ALA MB 1 57 PHE QD 2.900 . 3.900 2.465 2.188 2.966 . 0 0 "[ . 1 . 2]" 1
436 1 21 ALA MB 1 57 PHE QE 2.700 . 3.600 2.919 2.388 3.275 . 0 0 "[ . 1 . 2]" 1
437 1 21 ALA MB 1 57 PHE HZ 3.000 . 4.100 4.073 3.537 4.239 0.139 19 0 "[ . 1 . 2]" 1
438 1 21 ALA MB 1 81 HIS H 2.900 . 6.000 5.909 5.611 6.076 0.076 1 0 "[ . 1 . 2]" 1
439 1 21 ALA MB 1 82 SER H 3.100 . 4.300 4.150 3.868 4.358 0.058 8 0 "[ . 1 . 2]" 1
440 1 22 ALA H 1 22 ALA HA 2.400 . 3.100 2.691 2.569 2.791 . 0 0 "[ . 1 . 2]" 1
441 1 22 ALA H 1 22 ALA MB 2.100 . 2.700 2.058 1.952 2.163 . 0 0 "[ . 1 . 2]" 1
442 1 22 ALA H 1 23 PRO HG2 4.600 . 6.000 6.146 6.084 6.187 0.187 20 0 "[ . 1 . 2]" 1
443 1 22 ALA H 1 24 ASP H 3.300 . 4.700 4.763 4.639 4.855 0.155 6 0 "[ . 1 . 2]" 1
444 1 22 ALA H 1 25 LEU MD1 3.400 . 4.800 2.451 2.165 2.768 . 0 0 "[ . 1 . 2]" 1
445 1 22 ALA H 1 57 PHE QD 4.100 . 6.000 4.463 3.942 4.934 . 0 0 "[ . 1 . 2]" 1
446 1 22 ALA H 1 57 PHE QE 3.500 . 5.000 4.248 3.863 4.654 . 0 0 "[ . 1 . 2]" 1
447 1 22 ALA H 1 81 HIS H 3.000 . 4.200 4.368 4.247 4.560 0.360 3 0 "[ . 1 . 2]" 1
448 1 22 ALA H 1 81 HIS HA 2.500 . 3.300 2.553 1.779 3.107 . 0 0 "[ . 1 . 2]" 1
449 1 22 ALA H 1 81 HIS HB2 3.700 . 5.400 4.709 3.745 5.404 0.004 7 0 "[ . 1 . 2]" 1
450 1 22 ALA H 1 81 HIS HB3 3.700 . 5.400 4.723 3.997 5.220 . 0 0 "[ . 1 . 2]" 1
451 1 22 ALA H 1 82 SER H 3.300 . 4.600 2.820 1.983 3.960 0.017 1 0 "[ . 1 . 2]" 1
452 1 22 ALA HA 1 22 ALA MB 1.900 . 2.400 2.102 2.076 2.123 . 0 0 "[ . 1 . 2]" 1
453 1 22 ALA HA 1 23 PRO HB2 4.400 . 6.000 5.525 5.419 5.648 . 0 0 "[ . 1 . 2]" 1
454 1 22 ALA HA 1 23 PRO HD2 2.300 . 2.900 1.949 1.871 2.049 . 0 0 "[ . 1 . 2]" 1
455 1 22 ALA HA 1 23 PRO HG2 4.000 . 6.000 3.933 3.830 4.063 . 0 0 "[ . 1 . 2]" 1
456 1 22 ALA HA 1 23 PRO HG3 4.300 . 6.000 4.367 4.257 4.484 . 0 0 "[ . 1 . 2]" 1
457 1 22 ALA HA 1 24 ASP H 3.000 . 4.100 3.654 3.390 3.899 . 0 0 "[ . 1 . 2]" 1
458 1 22 ALA HA 1 82 SER HB3 3.000 . 4.100 4.130 3.709 4.297 0.197 4 0 "[ . 1 . 2]" 1
459 1 22 ALA MB 1 23 PRO HA 3.300 . 4.600 4.577 4.459 4.657 0.057 11 0 "[ . 1 . 2]" 1
460 1 22 ALA MB 1 23 PRO HD2 2.700 . 3.600 2.712 2.318 3.226 . 0 0 "[ . 1 . 2]" 1
461 1 22 ALA MB 1 23 PRO HD3 3.500 . 5.000 3.907 3.693 4.201 . 0 0 "[ . 1 . 2]" 1
462 1 22 ALA MB 1 23 PRO HG2 3.300 . 4.700 3.624 3.161 4.063 . 0 0 "[ . 1 . 2]" 1
463 1 22 ALA MB 1 23 PRO HG3 3.800 . 5.600 4.688 4.275 5.150 . 0 0 "[ . 1 . 2]" 1
464 1 22 ALA MB 1 24 ASP H 2.400 . 3.100 2.523 2.300 2.720 . 0 0 "[ . 1 . 2]" 1
465 1 22 ALA MB 1 25 LEU H 2.800 . 3.800 3.377 2.844 3.745 . 0 0 "[ . 1 . 2]" 1
466 1 22 ALA MB 1 25 LEU HB2 3.000 . 4.100 4.045 3.687 4.150 0.050 9 0 "[ . 1 . 2]" 1
467 1 22 ALA MB 1 25 LEU MD1 2.900 . 3.900 2.934 2.274 3.442 . 0 0 "[ . 1 . 2]" 1
468 1 22 ALA MB 1 25 LEU HG 2.400 . 3.100 2.165 1.803 2.728 . 0 0 "[ . 1 . 2]" 1
469 1 22 ALA MB 1 57 PHE QE 3.600 . 5.200 5.250 5.073 5.356 0.156 18 0 "[ . 1 . 2]" 1
470 1 22 ALA MB 1 81 HIS H 3.100 . 4.300 3.921 3.336 4.395 0.095 3 0 "[ . 1 . 2]" 1
471 1 22 ALA MB 1 81 HIS HA 3.000 . 4.100 3.510 2.809 3.976 . 0 0 "[ . 1 . 2]" 1
472 1 22 ALA MB 1 82 SER HB3 3.000 . 4.100 4.148 3.949 4.219 0.119 3 0 "[ . 1 . 2]" 1
473 1 23 PRO HA 1 23 PRO HB3 2.100 . 2.600 2.307 2.261 2.343 . 0 0 "[ . 1 . 2]" 1
474 1 23 PRO HA 1 23 PRO HG2 3.200 . 4.500 3.644 3.600 3.683 . 0 0 "[ . 1 . 2]" 1
475 1 23 PRO HA 1 24 ASP H 2.400 . 3.100 3.222 3.178 3.251 0.151 12 0 "[ . 1 . 2]" 1
476 1 23 PRO HA 1 25 LEU H 3.100 . 4.300 3.578 3.333 3.843 . 0 0 "[ . 1 . 2]" 1
477 1 23 PRO HB2 1 23 PRO HD2 3.500 . 5.100 4.107 4.087 4.130 . 0 0 "[ . 1 . 2]" 1
478 1 23 PRO HB2 1 23 PRO HG2 2.100 . 2.600 2.416 2.405 2.431 . 0 0 "[ . 1 . 2]" 1
479 1 23 PRO HB2 1 23 PRO HG3 2.500 . 3.300 2.642 2.635 2.654 . 0 0 "[ . 1 . 2]" 1
480 1 23 PRO HB2 1 24 ASP H 3.100 . 4.300 3.686 3.443 3.833 . 0 0 "[ . 1 . 2]" 1
481 1 23 PRO HB3 1 23 PRO HD2 3.400 . 4.800 3.729 3.699 3.760 . 0 0 "[ . 1 . 2]" 1
482 1 23 PRO HB3 1 23 PRO HG2 2.500 . 3.300 3.015 3.009 3.024 . 0 0 "[ . 1 . 2]" 1
483 1 23 PRO HB3 1 24 ASP H 3.100 . 4.300 4.272 4.045 4.340 0.040 11 0 "[ . 1 . 2]" 1
484 1 23 PRO HD2 1 23 PRO HG3 2.800 . 3.800 2.533 2.514 2.547 . 0 0 "[ . 1 . 2]" 1
485 1 23 PRO QG 1 25 LEU HG 2.100 . 6.000 5.854 5.591 6.096 0.096 13 0 "[ . 1 . 2]" 1
486 1 23 PRO HG2 1 24 ASP H 2.800 . 3.800 2.624 2.164 2.837 . 0 0 "[ . 1 . 2]" 1
487 1 23 PRO HG2 1 25 LEU H 2.400 . 6.000 4.815 4.503 5.031 . 0 0 "[ . 1 . 2]" 1
488 1 23 PRO HG3 1 24 ASP H 3.300 . 4.600 4.234 3.821 4.410 . 0 0 "[ . 1 . 2]" 1
489 1 24 ASP H 1 24 ASP HA 2.300 . 2.900 2.924 2.865 2.949 0.049 11 0 "[ . 1 . 2]" 1
490 1 24 ASP H 1 24 ASP HB2 2.800 . 3.800 3.208 2.331 3.815 0.015 3 0 "[ . 1 . 2]" 1
491 1 24 ASP H 1 24 ASP HB3 2.600 . 3.500 2.985 2.350 3.608 0.108 18 0 "[ . 1 . 2]" 1
492 1 24 ASP H 1 25 LEU H 2.300 . 2.900 2.334 2.158 2.499 . 0 0 "[ . 1 . 2]" 1
493 1 24 ASP H 1 25 LEU HA 3.800 . 5.600 4.644 4.364 4.998 . 0 0 "[ . 1 . 2]" 1
494 1 24 ASP H 1 25 LEU HB2 3.700 . 5.400 4.354 3.933 4.616 . 0 0 "[ . 1 . 2]" 1
495 1 24 ASP HA 1 24 ASP HB2 2.400 . 3.100 2.571 2.397 3.029 . 0 0 "[ . 1 . 2]" 1
496 1 24 ASP HA 1 24 ASP HB3 2.500 . 3.300 2.637 2.391 3.038 . 0 0 "[ . 1 . 2]" 1
497 1 24 ASP HA 1 25 LEU H 2.800 . 3.800 3.166 2.938 3.426 . 0 0 "[ . 1 . 2]" 1
498 1 24 ASP HB2 1 25 LEU H 3.900 . 5.800 4.153 3.193 4.463 . 0 0 "[ . 1 . 2]" 1
499 1 24 ASP HB3 1 25 LEU H 3.600 . 5.200 4.075 2.943 4.513 . 0 0 "[ . 1 . 2]" 1
500 1 25 LEU H 1 25 LEU HA 2.500 . 3.300 2.835 2.766 2.896 . 0 0 "[ . 1 . 2]" 1
501 1 25 LEU H 1 25 LEU HB2 2.400 . 3.100 2.319 2.103 2.498 . 0 0 "[ . 1 . 2]" 1
502 1 25 LEU H 1 25 LEU HB3 2.700 . 3.600 3.543 3.410 3.621 0.021 15 0 "[ . 1 . 2]" 1
503 1 25 LEU H 1 25 LEU MD1 3.400 . 4.800 3.702 3.450 3.859 . 0 0 "[ . 1 . 2]" 1
504 1 25 LEU H 1 25 LEU HG 2.600 . 3.500 2.671 2.142 3.122 . 0 0 "[ . 1 . 2]" 1
505 1 25 LEU H 1 26 THR H 3.400 . 4.800 4.512 4.438 4.595 . 0 0 "[ . 1 . 2]" 1
506 1 25 LEU H 1 26 THR MG 3.900 . 5.800 5.519 5.066 5.841 0.041 18 0 "[ . 1 . 2]" 1
507 1 25 LEU HA 1 25 LEU HB2 3.000 . 4.100 2.965 2.882 3.013 . 0 0 "[ . 1 . 2]" 1
508 1 25 LEU HA 1 25 LEU MD1 3.600 . 5.200 3.760 3.684 3.908 . 0 0 "[ . 1 . 2]" 1
509 1 25 LEU HA 1 25 LEU HG 2.800 . 3.800 2.925 2.527 3.232 . 0 0 "[ . 1 . 2]" 1
510 1 25 LEU HA 1 26 THR H 2.700 . 3.600 2.177 1.977 2.439 . 0 0 "[ . 1 . 2]" 1
511 1 25 LEU HA 1 26 THR MG 3.500 . 5.000 4.183 3.832 4.722 . 0 0 "[ . 1 . 2]" 1
512 1 25 LEU HB3 1 25 LEU HG 2.700 . 3.600 2.999 2.981 3.014 . 0 0 "[ . 1 . 2]" 1
513 1 25 LEU MD1 1 25 LEU HG 2.100 . 2.600 2.116 2.100 2.146 . 0 0 "[ . 1 . 2]" 1
514 1 25 LEU MD1 1 26 THR MG 2.000 . 6.000 6.154 6.078 6.263 0.263 13 0 "[ . 1 . 2]" 1
515 1 25 LEU MD1 1 30 LEU H 3.600 . 5.200 5.199 5.001 5.281 0.081 10 0 "[ . 1 . 2]" 1
516 1 25 LEU MD1 1 30 LEU MD1 2.100 . 2.700 2.596 2.197 2.787 0.087 7 0 "[ . 1 . 2]" 1
517 1 25 LEU MD1 1 33 ILE MD 2.700 . 6.000 3.551 2.891 4.090 . 0 0 "[ . 1 . 2]" 1
518 1 25 LEU MD1 1 33 ILE MG 2.200 . 6.000 5.651 5.184 6.046 0.046 6 0 "[ . 1 . 2]" 1
519 1 25 LEU MD1 1 52 TYR QE 3.200 . 6.000 3.435 2.623 4.568 . 0 0 "[ . 1 . 2]" 1
520 1 25 LEU MD1 1 80 ARG QB 2.500 . 3.300 3.250 2.224 3.460 0.160 17 0 "[ . 1 . 2]" 1
521 1 25 LEU MD1 1 81 HIS HA 3.100 . 4.300 2.633 1.952 3.697 . 0 0 "[ . 1 . 2]" 1
522 1 25 LEU MD1 1 82 SER HB2 3.300 . 4.700 4.862 4.745 4.974 0.274 1 0 "[ . 1 . 2]" 1
523 1 25 LEU HG 1 26 THR H 3.700 . 5.400 4.609 4.047 4.938 . 0 0 "[ . 1 . 2]" 1
524 1 26 THR H 1 26 THR HB 4.000 . 6.000 3.289 3.053 3.598 . 0 0 "[ . 1 . 2]" 1
525 1 26 THR H 1 26 THR MG 3.100 . 4.300 3.168 2.686 3.697 . 0 0 "[ . 1 . 2]" 1
526 1 26 THR H 1 27 LEU H 4.100 . 6.000 4.334 4.158 4.457 . 0 0 "[ . 1 . 2]" 1
527 1 26 THR H 1 29 ASP H 3.900 . 5.800 3.840 3.207 4.388 . 0 0 "[ . 1 . 2]" 1
528 1 26 THR H 1 29 ASP HB2 3.700 . 5.400 2.784 1.987 4.461 0.013 2 0 "[ . 1 . 2]" 1
529 1 26 THR H 1 29 ASP HB3 4.100 . 6.000 3.519 2.184 4.834 . 0 0 "[ . 1 . 2]" 1
530 1 26 THR HA 1 26 THR HB 1.900 . 2.400 2.551 2.449 2.669 0.269 13 0 "[ . 1 . 2]" 1
531 1 26 THR HA 1 26 THR MG 2.100 . 2.600 2.071 1.967 2.289 . 0 0 "[ . 1 . 2]" 1
532 1 26 THR HA 1 27 LEU H 2.800 . 3.800 2.153 2.021 2.432 . 0 0 "[ . 1 . 2]" 1
533 1 26 THR HA 1 28 ARG H 3.100 . 4.300 3.974 3.766 4.362 0.062 13 0 "[ . 1 . 2]" 1
534 1 26 THR HA 1 29 ASP H 3.200 . 4.500 4.366 4.162 4.508 0.008 6 0 "[ . 1 . 2]" 1
535 1 26 THR HB 1 26 THR MG 1.900 . 2.400 2.060 2.031 2.104 . 0 0 "[ . 1 . 2]" 1
536 1 26 THR HB 1 27 LEU H 3.000 . 4.200 2.902 2.032 3.397 . 0 0 "[ . 1 . 2]" 1
537 1 26 THR HB 1 28 ARG H 2.800 . 3.800 2.483 2.006 2.821 . 0 0 "[ . 1 . 2]" 1
538 1 26 THR HB 1 29 ASP H 2.900 . 4.000 2.619 2.222 3.080 . 0 0 "[ . 1 . 2]" 1
539 1 26 THR HB 1 29 ASP HB3 3.500 . 5.000 4.762 3.640 5.107 0.107 13 0 "[ . 1 . 2]" 1
540 1 26 THR MG 1 27 LEU H 3.400 . 4.800 3.080 2.228 3.393 . 0 0 "[ . 1 . 2]" 1
541 1 26 THR MG 1 28 ARG H 2.600 . 3.400 3.572 3.414 3.679 0.279 1 0 "[ . 1 . 2]" 1
542 1 27 LEU H 1 27 LEU MD1 4.400 . 6.000 4.056 3.949 4.121 . 0 0 "[ . 1 . 2]" 1
543 1 27 LEU H 1 28 ARG H 3.000 . 4.100 2.737 2.540 2.917 . 0 0 "[ . 1 . 2]" 1
544 1 27 LEU H 1 29 ASP H 3.700 . 5.400 4.054 3.845 4.296 . 0 0 "[ . 1 . 2]" 1
545 1 27 LEU HA 1 27 LEU MD1 2.600 . 3.400 2.135 2.093 2.168 . 0 0 "[ . 1 . 2]" 1
546 1 27 LEU HA 1 28 ARG H 3.300 . 4.700 3.559 3.520 3.596 . 0 0 "[ . 1 . 2]" 1
547 1 27 LEU HA 1 31 LEU H 2.900 . 3.900 4.012 3.971 4.053 0.153 3 0 "[ . 1 . 2]" 1
548 1 27 LEU HB2 1 30 LEU H 3.700 . 5.400 5.437 5.402 5.477 0.077 2 0 "[ . 1 . 2]" 1
549 1 27 LEU HB3 1 30 LEU H 3.400 . 4.800 4.995 4.957 5.021 0.221 9 0 "[ . 1 . 2]" 1
550 1 27 LEU MD1 1 28 ARG H 3.600 . 5.200 4.565 4.469 4.671 . 0 0 "[ . 1 . 2]" 1
551 1 27 LEU MD1 1 30 LEU H 3.600 . 5.300 4.274 4.044 4.431 . 0 0 "[ . 1 . 2]" 1
552 1 27 LEU MD1 1 30 LEU MD2 2.500 . 3.300 3.145 2.971 3.307 0.007 6 0 "[ . 1 . 2]" 1
553 1 27 LEU MD1 1 31 LEU H 3.600 . 5.200 4.062 3.915 4.325 . 0 0 "[ . 1 . 2]" 1
554 1 27 LEU MD1 1 31 LEU HG 2.600 . 3.400 3.480 3.376 3.526 0.126 15 0 "[ . 1 . 2]" 1
555 1 27 LEU MD2 1 28 ARG H 3.000 . 4.100 4.117 4.002 4.157 0.057 19 0 "[ . 1 . 2]" 1
556 1 27 LEU MD2 1 28 ARG HA 2.300 . 6.000 4.438 4.255 4.607 . 0 0 "[ . 1 . 2]" 1
557 1 27 LEU MD2 1 28 ARG QD 2.500 . 6.000 5.020 4.370 5.588 . 0 0 "[ . 1 . 2]" 1
558 1 27 LEU HG 1 28 ARG H 3.300 . 4.700 3.816 3.711 3.947 . 0 0 "[ . 1 . 2]" 1
559 1 27 LEU HG 1 28 ARG HA 2.400 . 6.000 3.502 3.319 3.669 . 0 0 "[ . 1 . 2]" 1
560 1 27 LEU HG 1 30 LEU H 2.600 . 6.000 4.870 4.753 5.052 . 0 0 "[ . 1 . 2]" 1
561 1 28 ARG H 1 28 ARG HA 2.600 . 3.400 2.824 2.778 2.851 . 0 0 "[ . 1 . 2]" 1
562 1 28 ARG H 1 28 ARG QB 2.300 . 3.000 2.357 2.268 2.424 . 0 0 "[ . 1 . 2]" 1
563 1 28 ARG H 1 29 ASP H 2.600 . 3.400 2.546 2.352 2.694 . 0 0 "[ . 1 . 2]" 1
564 1 28 ARG HA 1 28 ARG QB 2.500 . 3.300 2.373 2.315 2.503 . 0 0 "[ . 1 . 2]" 1
565 1 28 ARG HA 1 28 ARG QD 2.800 . 3.800 2.013 1.870 2.562 . 0 0 "[ . 1 . 2]" 1
566 1 28 ARG HA 1 29 ASP H 3.200 . 4.500 3.415 3.202 3.477 . 0 0 "[ . 1 . 2]" 1
567 1 28 ARG HA 1 31 LEU HB2 3.300 . 4.600 2.307 1.998 3.023 0.002 18 0 "[ . 1 . 2]" 1
568 1 28 ARG HA 1 31 LEU HB3 3.800 . 5.600 3.886 3.645 4.628 . 0 0 "[ . 1 . 2]" 1
569 1 28 ARG HA 1 31 LEU HG 2.900 . 4.000 3.569 2.718 3.998 . 0 0 "[ . 1 . 2]" 1
570 1 28 ARG HA 1 32 ASP H 2.800 . 6.000 3.807 3.237 4.069 . 0 0 "[ . 1 . 2]" 1
571 1 28 ARG QB 1 29 ASP H 2.500 . 3.300 2.977 2.807 3.360 0.060 18 0 "[ . 1 . 2]" 1
572 1 28 ARG QD 1 29 ASP HA 3.100 . 6.000 5.075 4.246 5.436 . 0 0 "[ . 1 . 2]" 1
573 1 28 ARG QD 1 31 LEU HG 2.900 . 3.900 3.937 3.867 3.999 0.099 18 0 "[ . 1 . 2]" 1
574 1 28 ARG QG 1 29 ASP H 3.400 . 4.800 3.978 3.634 4.691 . 0 0 "[ . 1 . 2]" 1
575 1 28 ARG QG 1 32 ASP H 2.900 . 4.000 4.059 3.951 4.166 0.166 18 0 "[ . 1 . 2]" 1
576 1 29 ASP H 1 29 ASP HA 2.600 . 3.400 2.829 2.791 2.886 . 0 0 "[ . 1 . 2]" 1
577 1 29 ASP H 1 29 ASP HB2 2.600 . 3.400 2.365 2.173 2.632 . 0 0 "[ . 1 . 2]" 1
578 1 29 ASP H 1 29 ASP HB3 2.900 . 3.900 3.223 2.558 3.601 . 0 0 "[ . 1 . 2]" 1
579 1 29 ASP H 1 30 LEU H 2.200 . 2.800 2.593 2.366 2.760 . 0 0 "[ . 1 . 2]" 1
580 1 29 ASP H 1 31 LEU H 3.800 . 5.600 3.970 3.745 4.120 . 0 0 "[ . 1 . 2]" 1
581 1 29 ASP HA 1 29 ASP HB2 3.000 . 4.100 2.827 2.522 3.029 . 0 0 "[ . 1 . 2]" 1
582 1 29 ASP HA 1 30 LEU H 3.600 . 5.300 3.578 3.502 3.628 . 0 0 "[ . 1 . 2]" 1
583 1 29 ASP HA 1 32 ASP H 3.200 . 4.500 3.246 2.915 3.670 . 0 0 "[ . 1 . 2]" 1
584 1 29 ASP HA 1 32 ASP HB2 3.500 . 5.000 2.978 2.032 3.912 . 0 0 "[ . 1 . 2]" 1
585 1 29 ASP HA 1 32 ASP HB3 3.500 . 5.000 2.966 2.242 4.305 . 0 0 "[ . 1 . 2]" 1
586 1 29 ASP HA 1 33 ILE H 3.200 . 4.500 3.830 3.600 4.061 . 0 0 "[ . 1 . 2]" 1
587 1 29 ASP HA 1 33 ILE HA 3.400 . 6.000 5.976 5.709 6.053 0.053 6 0 "[ . 1 . 2]" 1
588 1 29 ASP HB2 1 30 LEU H 3.400 . 4.900 3.379 2.828 4.199 . 0 0 "[ . 1 . 2]" 1
589 1 29 ASP HB3 1 30 LEU H 3.400 . 4.800 3.356 2.560 3.994 . 0 0 "[ . 1 . 2]" 1
590 1 29 ASP HB3 1 32 ASP H 3.200 . 6.000 5.244 5.023 5.453 . 0 0 "[ . 1 . 2]" 1
591 1 30 LEU H 1 30 LEU HA 2.800 . 3.700 2.916 2.891 2.950 . 0 0 "[ . 1 . 2]" 1
592 1 30 LEU H 1 30 LEU HB2 3.200 . 4.500 2.565 2.517 2.620 . 0 0 "[ . 1 . 2]" 1
593 1 30 LEU H 1 30 LEU MD1 3.800 . 5.600 3.614 3.473 3.820 . 0 0 "[ . 1 . 2]" 1
594 1 30 LEU H 1 31 LEU H 3.100 . 4.300 2.375 2.244 2.531 . 0 0 "[ . 1 . 2]" 1
595 1 30 LEU HA 1 30 LEU HB3 3.000 . 4.100 2.538 2.495 2.588 . 0 0 "[ . 1 . 2]" 1
596 1 30 LEU HA 1 30 LEU MD1 2.800 . 3.800 2.118 2.041 2.202 . 0 0 "[ . 1 . 2]" 1
597 1 30 LEU HA 1 31 LEU H 3.200 . 4.400 3.388 3.359 3.422 . 0 0 "[ . 1 . 2]" 1
598 1 30 LEU HA 1 31 LEU MD1 2.100 . 6.000 5.936 5.669 6.199 0.199 20 0 "[ . 1 . 2]" 1
599 1 30 LEU HA 1 33 ILE H 2.900 . 4.000 3.272 3.150 3.416 . 0 0 "[ . 1 . 2]" 1
600 1 30 LEU HA 1 33 ILE HB 3.200 . 4.500 2.363 2.124 2.982 . 0 0 "[ . 1 . 2]" 1
601 1 30 LEU HA 1 33 ILE MD 2.500 . 3.300 1.859 1.768 1.996 . 0 0 "[ . 1 . 2]" 1
602 1 30 LEU HA 1 33 ILE MG 3.100 . 4.300 3.649 3.415 4.060 . 0 0 "[ . 1 . 2]" 1
603 1 30 LEU HA 1 34 VAL H 3.200 . 4.500 4.010 3.762 4.518 0.018 6 0 "[ . 1 . 2]" 1
604 1 30 LEU HB2 1 30 LEU MD1 3.100 . 4.300 3.208 3.194 3.230 . 0 0 "[ . 1 . 2]" 1
605 1 30 LEU HB2 1 30 LEU MD2 3.100 . 4.300 2.172 2.127 2.203 . 0 0 "[ . 1 . 2]" 1
606 1 30 LEU HB2 1 31 LEU QD 3.200 . 4.500 2.264 2.064 2.341 . 0 0 "[ . 1 . 2]" 1
607 1 30 LEU HB3 1 30 LEU MD1 3.200 . 4.500 2.443 2.376 2.508 . 0 0 "[ . 1 . 2]" 1
608 1 30 LEU HB3 1 30 LEU MD2 2.700 . 3.600 3.110 3.078 3.127 . 0 0 "[ . 1 . 2]" 1
609 1 30 LEU MD1 1 33 ILE H 3.900 . 5.800 4.854 4.725 4.982 . 0 0 "[ . 1 . 2]" 1
610 1 30 LEU MD1 1 33 ILE MD 2.600 . 3.400 2.005 1.891 2.218 . 0 0 "[ . 1 . 2]" 1
611 1 30 LEU MD1 1 34 VAL MG1 3.100 . 6.000 5.270 4.204 5.897 . 0 0 "[ . 1 . 2]" 1
612 1 30 LEU MD1 1 57 PHE QE 2.600 . 3.400 3.080 2.787 3.416 0.016 18 0 "[ . 1 . 2]" 1
613 1 30 LEU MD1 1 57 PHE HZ 2.600 . 3.400 2.381 1.961 3.061 . 0 0 "[ . 1 . 2]" 1
614 1 30 LEU MD1 1 102 MET ME 2.800 . 6.000 2.779 2.103 3.755 . 0 0 "[ . 1 . 2]" 1
615 1 30 LEU MD2 1 31 LEU MD2 2.500 . 3.300 3.503 3.445 3.569 0.269 20 0 "[ . 1 . 2]" 1
616 1 30 LEU MD2 1 33 ILE MD 2.400 . 3.100 3.195 3.153 3.279 0.179 15 0 "[ . 1 . 2]" 1
617 1 31 LEU H 1 31 LEU HB2 3.000 . 4.100 2.335 2.264 2.811 . 0 0 "[ . 1 . 2]" 1
618 1 31 LEU H 1 31 LEU HB3 3.900 . 5.800 3.566 3.538 3.641 . 0 0 "[ . 1 . 2]" 1
619 1 31 LEU H 1 31 LEU MD2 3.200 . 4.500 2.042 1.974 2.166 . 0 0 "[ . 1 . 2]" 1
620 1 31 LEU H 1 31 LEU HG 2.900 . 3.900 3.701 2.206 3.891 . 0 0 "[ . 1 . 2]" 1
621 1 31 LEU HA 1 31 LEU HB2 3.000 . 4.100 3.002 2.989 3.014 . 0 0 "[ . 1 . 2]" 1
622 1 31 LEU HA 1 31 LEU HB3 2.500 . 3.300 2.582 2.319 2.617 . 0 0 "[ . 1 . 2]" 1
623 1 31 LEU HA 1 31 LEU MD1 2.800 . 3.800 2.288 2.130 3.779 . 0 0 "[ . 1 . 2]" 1
624 1 31 LEU HA 1 32 ASP H 3.400 . 4.800 3.397 3.294 3.459 . 0 0 "[ . 1 . 2]" 1
625 1 31 LEU HA 1 34 VAL H 3.200 . 4.500 3.402 2.869 3.668 . 0 0 "[ . 1 . 2]" 1
626 1 31 LEU HA 1 34 VAL HB 2.900 . 3.900 3.941 3.696 4.110 0.210 20 0 "[ . 1 . 2]" 1
627 1 31 LEU HB2 1 31 LEU MD2 3.200 . 4.500 2.565 2.467 3.178 . 0 0 "[ . 1 . 2]" 1
628 1 31 LEU HB2 1 32 ASP H 2.800 . 3.800 2.902 2.643 3.174 . 0 0 "[ . 1 . 2]" 1
629 1 31 LEU HB3 1 31 LEU MD1 2.500 . 3.300 2.262 2.182 2.313 . 0 0 "[ . 1 . 2]" 1
630 1 31 LEU HB3 1 31 LEU MD2 3.000 . 4.100 3.166 2.672 3.218 . 0 0 "[ . 1 . 2]" 1
631 1 31 LEU HB3 1 32 ASP H 3.600 . 5.200 3.628 3.361 4.211 . 0 0 "[ . 1 . 2]" 1
632 1 31 LEU MD2 1 32 ASP H 2.800 . 3.800 3.978 3.942 4.007 0.207 14 0 "[ . 1 . 2]" 1
633 1 31 LEU HG 1 32 ASP H 3.700 . 5.500 5.100 4.074 5.411 . 0 0 "[ . 1 . 2]" 1
634 1 32 ASP H 1 32 ASP HA 2.900 . 3.900 2.889 2.817 2.930 . 0 0 "[ . 1 . 2]" 1
635 1 32 ASP H 1 32 ASP HB3 3.000 . 4.200 2.936 2.426 3.724 . 0 0 "[ . 1 . 2]" 1
636 1 32 ASP H 1 33 ILE H 2.800 . 3.800 2.573 2.386 2.755 . 0 0 "[ . 1 . 2]" 1
637 1 32 ASP H 1 34 VAL H 3.800 . 5.600 4.253 4.021 4.497 . 0 0 "[ . 1 . 2]" 1
638 1 32 ASP HA 1 32 ASP HB3 2.900 . 3.900 2.918 2.571 3.041 . 0 0 "[ . 1 . 2]" 1
639 1 32 ASP HA 1 33 ILE H 3.500 . 5.000 3.518 3.475 3.552 . 0 0 "[ . 1 . 2]" 1
640 1 32 ASP HA 1 35 GLU H 3.700 . 5.400 3.536 3.240 3.790 . 0 0 "[ . 1 . 2]" 1
641 1 32 ASP HA 1 35 GLU HA 3.900 . 5.800 5.519 4.977 5.737 . 0 0 "[ . 1 . 2]" 1
642 1 32 ASP HA 1 35 GLU HB2 2.800 . 3.800 2.872 2.563 3.068 . 0 0 "[ . 1 . 2]" 1
643 1 32 ASP HA 1 35 GLU HB3 3.200 . 4.500 4.226 2.214 4.558 0.058 10 0 "[ . 1 . 2]" 1
644 1 32 ASP HA 1 36 THR H 4.000 . 6.000 3.954 3.569 4.184 . 0 0 "[ . 1 . 2]" 1
645 1 32 ASP HB2 1 33 ILE H 3.400 . 4.800 3.516 2.501 3.981 . 0 0 "[ . 1 . 2]" 1
646 1 32 ASP HB2 1 36 THR H 3.400 . 6.000 5.907 5.500 6.058 0.058 15 0 "[ . 1 . 2]" 1
647 1 32 ASP HB3 1 33 ILE H 3.100 . 4.300 2.777 2.348 3.544 . 0 0 "[ . 1 . 2]" 1
648 1 33 ILE H 1 33 ILE HA 2.800 . 3.800 2.750 2.699 2.804 . 0 0 "[ . 1 . 2]" 1
649 1 33 ILE H 1 33 ILE HB 2.600 . 3.400 2.431 2.312 2.703 . 0 0 "[ . 1 . 2]" 1
650 1 33 ILE H 1 33 ILE MD 3.400 . 4.900 3.384 3.226 3.569 . 0 0 "[ . 1 . 2]" 1
651 1 33 ILE H 1 33 ILE HG12 2.900 . 3.900 3.757 3.369 3.942 0.042 17 0 "[ . 1 . 2]" 1
652 1 33 ILE H 1 33 ILE HG13 3.200 . 4.500 2.423 2.045 2.731 . 0 0 "[ . 1 . 2]" 1
653 1 33 ILE H 1 33 ILE MG 3.100 . 4.300 3.764 3.712 3.841 . 0 0 "[ . 1 . 2]" 1
654 1 33 ILE H 1 34 VAL H 2.700 . 3.600 2.936 2.828 3.035 . 0 0 "[ . 1 . 2]" 1
655 1 33 ILE H 1 34 VAL MG1 3.200 . 4.500 4.053 3.954 4.373 . 0 0 "[ . 1 . 2]" 1
656 1 33 ILE HA 1 33 ILE MD 4.100 . 6.000 3.848 3.783 3.934 . 0 0 "[ . 1 . 2]" 1
657 1 33 ILE HA 1 33 ILE MG 3.000 . 4.100 2.597 2.431 2.695 . 0 0 "[ . 1 . 2]" 1
658 1 33 ILE HA 1 34 VAL H 3.600 . 5.200 3.553 3.522 3.592 . 0 0 "[ . 1 . 2]" 1
659 1 33 ILE HA 1 36 THR H 3.900 . 5.800 3.809 3.557 4.086 . 0 0 "[ . 1 . 2]" 1
660 1 33 ILE HA 1 36 THR HB 3.300 . 4.600 3.460 2.588 4.659 0.059 1 0 "[ . 1 . 2]" 1
661 1 33 ILE HA 1 36 THR MG 3.300 . 4.700 3.867 1.947 4.803 0.103 16 0 "[ . 1 . 2]" 1
662 1 33 ILE HB 1 33 ILE MD 2.700 . 3.600 2.329 2.263 2.384 . 0 0 "[ . 1 . 2]" 1
663 1 33 ILE HB 1 33 ILE HG13 3.000 . 4.100 2.628 2.505 2.761 . 0 0 "[ . 1 . 2]" 1
664 1 33 ILE HB 1 34 VAL H 3.000 . 4.100 2.393 2.132 2.503 . 0 0 "[ . 1 . 2]" 1
665 1 33 ILE HB 1 34 VAL MG1 3.200 . 6.000 3.958 3.318 4.279 . 0 0 "[ . 1 . 2]" 1
666 1 33 ILE MD 1 33 ILE HG12 2.400 . 3.100 2.103 2.065 2.117 . 0 0 "[ . 1 . 2]" 1
667 1 33 ILE MD 1 33 ILE MG 2.200 . 2.800 2.062 1.948 2.190 . 0 0 "[ . 1 . 2]" 1
668 1 33 ILE MD 1 34 VAL H 3.100 . 4.300 4.319 4.074 4.386 0.086 20 0 "[ . 1 . 2]" 1
669 1 33 ILE MD 1 57 PHE QE 2.900 . 6.000 3.756 3.018 4.574 . 0 0 "[ . 1 . 2]" 1
670 1 33 ILE MD 1 57 PHE HZ 2.700 . 6.000 2.969 2.072 3.951 . 0 0 "[ . 1 . 2]" 1
671 1 33 ILE MD 1 80 ARG HE 3.900 . 5.800 4.152 2.639 5.167 . 0 0 "[ . 1 . 2]" 1
672 1 33 ILE MD 2 1 FAD H9 3.000 . 6.000 3.838 3.072 4.414 . 0 0 "[ . 1 . 2]" 1
673 1 33 ILE HG12 1 33 ILE MG 3.000 . 4.100 2.241 2.117 2.344 . 0 0 "[ . 1 . 2]" 1
674 1 33 ILE HG13 1 33 ILE MG 3.300 . 4.700 3.185 3.131 3.202 . 0 0 "[ . 1 . 2]" 1
675 1 33 ILE HG13 2 1 FAD H9 3.200 . 4.500 4.568 4.480 4.643 0.143 17 0 "[ . 1 . 2]" 1
676 1 33 ILE MG 1 34 VAL H 3.000 . 4.100 2.843 2.614 3.200 . 0 0 "[ . 1 . 2]" 1
677 1 33 ILE MG 1 34 VAL HA 3.300 . 4.600 2.940 2.759 3.210 . 0 0 "[ . 1 . 2]" 1
678 1 33 ILE MG 1 34 VAL MG1 3.400 . 4.900 4.139 3.167 4.429 . 0 0 "[ . 1 . 2]" 1
679 1 33 ILE MG 1 37 SER H 3.200 . 4.400 4.045 3.786 4.350 . 0 0 "[ . 1 . 2]" 1
680 1 33 ILE MG 1 102 MET ME 2.500 . 6.000 3.417 2.726 4.550 . 0 0 "[ . 1 . 2]" 1
681 1 33 ILE MG 2 1 FAD H9 3.000 . 6.000 3.288 2.694 3.793 . 0 0 "[ . 1 . 2]" 1
682 1 34 VAL H 1 34 VAL HB 2.600 . 3.400 2.692 2.503 3.545 0.145 20 0 "[ . 1 . 2]" 1
683 1 34 VAL H 1 34 VAL MG1 3.000 . 4.100 2.082 1.929 2.337 . 0 0 "[ . 1 . 2]" 1
684 1 34 VAL H 1 35 GLU H 3.200 . 4.500 2.856 2.663 2.957 . 0 0 "[ . 1 . 2]" 1
685 1 34 VAL H 1 37 SER H 3.700 . 5.400 4.757 4.614 4.915 . 0 0 "[ . 1 . 2]" 1
686 1 34 VAL HA 1 34 VAL MG1 2.900 . 3.900 3.181 2.431 3.246 . 0 0 "[ . 1 . 2]" 1
687 1 34 VAL HA 1 35 GLU H 3.800 . 5.600 3.516 3.344 3.562 . 0 0 "[ . 1 . 2]" 1
688 1 34 VAL HB 1 35 GLU H 3.100 . 4.300 4.031 3.858 4.297 . 0 0 "[ . 1 . 2]" 1
689 1 34 VAL MG1 1 35 GLU H 3.300 . 4.700 2.286 1.995 3.805 . 0 0 "[ . 1 . 2]" 1
690 1 34 VAL MG1 1 38 GLN HE21 3.500 . 6.000 4.948 4.155 6.029 0.029 20 0 "[ . 1 . 2]" 1
691 1 34 VAL MG1 1 38 GLN QG 2.600 . 6.000 5.067 3.980 5.941 . 0 0 "[ . 1 . 2]" 1
692 1 34 VAL MG1 1 102 MET ME 2.800 . 3.800 3.754 2.011 3.927 0.127 18 0 "[ . 1 . 2]" 1
693 1 35 GLU H 1 35 GLU HB2 2.700 . 3.600 2.386 2.047 2.623 . 0 0 "[ . 1 . 2]" 1
694 1 35 GLU H 1 35 GLU HB3 3.500 . 5.000 3.447 2.301 3.636 . 0 0 "[ . 1 . 2]" 1
695 1 35 GLU H 1 35 GLU HG2 3.600 . 5.300 3.088 2.059 4.504 . 0 0 "[ . 1 . 2]" 1
696 1 35 GLU H 1 35 GLU HG3 3.000 . 4.100 3.201 2.203 4.189 0.089 18 0 "[ . 1 . 2]" 1
697 1 35 GLU H 1 36 THR H 3.300 . 4.600 2.733 2.461 2.886 . 0 0 "[ . 1 . 2]" 1
698 1 35 GLU H 1 37 SER H 3.700 . 5.400 4.061 3.761 4.310 . 0 0 "[ . 1 . 2]" 1
699 1 35 GLU HA 1 35 GLU HB2 2.600 . 3.500 2.950 2.445 3.028 . 0 0 "[ . 1 . 2]" 1
700 1 35 GLU HA 1 35 GLU HB3 2.500 . 3.300 2.586 2.454 3.018 . 0 0 "[ . 1 . 2]" 1
701 1 35 GLU HB2 1 36 THR H 3.000 . 4.100 2.667 2.099 3.674 . 0 0 "[ . 1 . 2]" 1
702 1 35 GLU HB3 1 36 THR H 3.000 . 4.100 3.318 2.140 3.851 . 0 0 "[ . 1 . 2]" 1
703 1 35 GLU HG2 1 36 THR H 4.300 . 6.000 4.610 3.984 5.146 . 0 0 "[ . 1 . 2]" 1
704 1 35 GLU HG3 1 36 THR H 4.000 . 6.000 4.555 3.193 5.128 . 0 0 "[ . 1 . 2]" 1
705 1 36 THR H 1 36 THR HA 2.900 . 3.900 2.823 2.736 2.894 . 0 0 "[ . 1 . 2]" 1
706 1 36 THR H 1 36 THR HB 2.700 . 3.600 2.553 2.281 2.724 . 0 0 "[ . 1 . 2]" 1
707 1 36 THR H 1 36 THR MG 3.300 . 4.600 3.332 2.095 3.770 . 0 0 "[ . 1 . 2]" 1
708 1 36 THR H 1 37 SER H 2.900 . 4.000 2.629 2.369 2.826 . 0 0 "[ . 1 . 2]" 1
709 1 36 THR HA 1 36 THR MG 2.600 . 3.500 2.590 2.215 3.248 . 0 0 "[ . 1 . 2]" 1
710 1 36 THR HA 1 37 SER H 3.300 . 4.700 3.524 3.439 3.577 . 0 0 "[ . 1 . 2]" 1
711 1 36 THR HA 1 39 ALA MB 2.500 . 3.300 2.953 2.494 3.335 0.035 12 0 "[ . 1 . 2]" 1
712 1 36 THR HB 1 36 THR MG 1.900 . 2.400 2.143 2.113 2.163 . 0 0 "[ . 1 . 2]" 1
713 1 36 THR HB 1 37 SER H 3.400 . 4.800 3.076 2.465 4.249 . 0 0 "[ . 1 . 2]" 1
714 1 36 THR HB 1 37 SER HA 4.100 . 6.000 4.065 3.525 5.165 . 0 0 "[ . 1 . 2]" 1
715 1 36 THR MG 1 37 SER H 2.800 . 3.800 3.328 2.369 3.826 0.026 16 0 "[ . 1 . 2]" 1
716 1 36 THR MG 1 39 ALA MB 2.200 . 6.000 4.120 3.307 5.324 . 0 0 "[ . 1 . 2]" 1
717 1 37 SER H 1 37 SER QB 2.900 . 4.000 2.340 2.164 2.730 . 0 0 "[ . 1 . 2]" 1
718 1 37 SER H 1 38 GLN H 3.100 . 4.300 2.820 2.534 3.033 . 0 0 "[ . 1 . 2]" 1
719 1 37 SER HA 1 38 GLN H 3.800 . 5.600 2.480 2.173 3.069 . 0 0 "[ . 1 . 2]" 1
720 1 37 SER HA 1 40 HIS H 3.400 . 4.800 3.742 3.308 4.035 . 0 0 "[ . 1 . 2]" 1
721 1 37 SER HA 1 40 HIS HB3 3.200 . 4.500 3.455 2.827 4.022 . 0 0 "[ . 1 . 2]" 1
722 1 37 SER HA 1 41 ASN H 3.300 . 4.700 3.957 3.701 4.226 . 0 0 "[ . 1 . 2]" 1
723 1 38 GLN H 1 38 GLN HB2 3.500 . 5.100 2.704 2.389 3.625 . 0 0 "[ . 1 . 2]" 1
724 1 38 GLN H 1 38 GLN HB3 3.100 . 4.300 3.366 2.354 3.767 . 0 0 "[ . 1 . 2]" 1
725 1 38 GLN H 1 39 ALA H 3.500 . 5.100 2.694 2.600 2.842 . 0 0 "[ . 1 . 2]" 1
726 1 38 GLN H 1 39 ALA MB 4.600 . 6.000 4.267 4.135 4.488 . 0 0 "[ . 1 . 2]" 1
727 1 38 GLN HA 1 38 GLN HB2 2.700 . 3.600 2.869 2.372 3.027 . 0 0 "[ . 1 . 2]" 1
728 1 38 GLN HA 1 38 GLN QG 3.500 . 5.000 2.584 2.349 3.443 . 0 0 "[ . 1 . 2]" 1
729 1 38 GLN HA 1 39 ALA H 3.800 . 5.600 3.480 3.438 3.537 . 0 0 "[ . 1 . 2]" 1
730 1 38 GLN HA 1 41 ASN H 3.300 . 4.700 3.537 3.046 3.736 . 0 0 "[ . 1 . 2]" 1
731 1 38 GLN HA 1 42 ALA H 3.400 . 4.900 3.550 3.192 3.808 . 0 0 "[ . 1 . 2]" 1
732 1 38 GLN HB2 1 39 ALA H 3.700 . 5.400 2.703 2.242 3.946 . 0 0 "[ . 1 . 2]" 1
733 1 38 GLN HB3 1 39 ALA H 2.900 . 4.000 3.527 3.155 3.966 . 0 0 "[ . 1 . 2]" 1
734 1 38 GLN HE21 1 38 GLN QG 3.200 . 4.500 2.661 2.081 2.843 . 0 0 "[ . 1 . 2]" 1
735 1 38 GLN HE21 1 39 ALA H 3.200 . 4.500 3.713 3.172 4.528 0.028 14 0 "[ . 1 . 2]" 1
736 1 38 GLN HE21 1 39 ALA MB 2.900 . 4.000 4.143 4.046 4.211 0.211 18 0 "[ . 1 . 2]" 1
737 1 38 GLN HE22 1 39 ALA H 4.200 . 6.000 5.275 4.346 5.778 . 0 0 "[ . 1 . 2]" 1
738 1 38 GLN HE22 1 100 TRP HZ3 3.000 . 4.100 4.232 4.119 4.322 0.222 10 0 "[ . 1 . 2]" 1
739 1 38 GLN QG 1 41 ASN H 2.500 . 6.000 5.334 4.991 5.667 . 0 0 "[ . 1 . 2]" 1
740 1 39 ALA H 1 39 ALA HA 2.800 . 3.800 2.802 2.769 2.853 . 0 0 "[ . 1 . 2]" 1
741 1 39 ALA H 1 39 ALA MB 2.300 . 2.900 2.136 2.077 2.225 . 0 0 "[ . 1 . 2]" 1
742 1 39 ALA H 1 40 HIS H 3.000 . 4.100 2.677 2.484 2.868 . 0 0 "[ . 1 . 2]" 1
743 1 39 ALA H 1 41 ASN H 4.000 . 6.000 4.015 3.770 4.191 . 0 0 "[ . 1 . 2]" 1
744 1 39 ALA HA 1 39 ALA MB 1.900 . 2.300 2.114 2.094 2.132 . 0 0 "[ . 1 . 2]" 1
745 1 39 ALA HA 1 42 ALA H 3.200 . 4.500 3.835 3.401 4.277 . 0 0 "[ . 1 . 2]" 1
746 1 39 ALA HA 1 42 ALA MB 2.500 . 3.300 3.054 2.751 3.358 0.058 12 0 "[ . 1 . 2]" 1
747 1 39 ALA HA 1 43 ARG H 3.000 . 4.200 4.235 4.114 4.279 0.079 13 0 "[ . 1 . 2]" 1
748 1 39 ALA MB 1 40 HIS H 2.600 . 3.500 2.666 2.473 2.962 . 0 0 "[ . 1 . 2]" 1
749 1 39 ALA MB 1 40 HIS HA 3.300 . 4.600 4.007 3.912 4.117 . 0 0 "[ . 1 . 2]" 1
750 1 39 ALA MB 1 40 HIS HB3 2.700 . 6.000 4.694 4.494 4.896 . 0 0 "[ . 1 . 2]" 1
751 1 39 ALA MB 1 43 ARG H 2.600 . 6.000 5.027 4.786 5.140 . 0 0 "[ . 1 . 2]" 1
752 1 40 HIS H 1 40 HIS HA 2.900 . 4.000 2.904 2.853 2.932 . 0 0 "[ . 1 . 2]" 1
753 1 40 HIS H 1 40 HIS HB2 2.900 . 3.900 2.629 2.416 2.822 . 0 0 "[ . 1 . 2]" 1
754 1 40 HIS H 1 40 HIS HB3 2.900 . 4.000 2.549 2.377 2.653 . 0 0 "[ . 1 . 2]" 1
755 1 40 HIS H 1 40 HIS HD2 4.300 . 6.000 5.186 5.048 5.383 . 0 0 "[ . 1 . 2]" 1
756 1 40 HIS H 1 41 ASN H 2.800 . 3.800 2.389 2.225 2.619 . 0 0 "[ . 1 . 2]" 1
757 1 40 HIS H 1 41 ASN QB 4.200 . 6.000 4.399 4.122 4.626 . 0 0 "[ . 1 . 2]" 1
758 1 40 HIS HA 1 40 HIS HB3 2.800 . 3.800 2.968 2.927 3.004 . 0 0 "[ . 1 . 2]" 1
759 1 40 HIS HA 1 40 HIS HD2 3.500 . 5.100 3.055 2.508 4.438 . 0 0 "[ . 1 . 2]" 1
760 1 40 HIS HA 1 41 ASN H 3.400 . 4.900 3.529 3.471 3.581 . 0 0 "[ . 1 . 2]" 1
761 1 40 HIS HA 1 43 ARG H 2.600 . 3.500 3.501 3.269 3.587 0.087 9 0 "[ . 1 . 2]" 1
762 1 40 HIS HA 1 43 ARG QB 2.700 . 3.600 2.647 2.399 2.990 . 0 0 "[ . 1 . 2]" 1
763 1 40 HIS HA 1 43 ARG QG 3.200 . 4.500 4.320 3.755 4.613 0.113 15 0 "[ . 1 . 2]" 1
764 1 40 HIS HB2 1 40 HIS HD2 3.000 . 4.100 3.565 3.066 3.973 . 0 0 "[ . 1 . 2]" 1
765 1 40 HIS HB2 1 41 ASN H 3.400 . 4.800 3.843 3.666 4.004 . 0 0 "[ . 1 . 2]" 1
766 1 40 HIS HB2 1 42 ALA H 3.100 . 6.000 5.952 5.725 6.029 0.029 5 0 "[ . 1 . 2]" 1
767 1 40 HIS HB3 1 40 HIS HD2 2.900 . 4.000 3.637 2.693 4.009 0.009 18 0 "[ . 1 . 2]" 1
768 1 40 HIS HB3 1 41 ASN H 3.000 . 4.100 2.562 2.398 2.800 . 0 0 "[ . 1 . 2]" 1
769 1 40 HIS HB3 1 42 ALA H 3.300 . 6.000 5.039 4.792 5.248 . 0 0 "[ . 1 . 2]" 1
770 1 40 HIS HB3 1 44 ALA H 3.500 . 5.100 5.197 5.145 5.241 0.141 18 0 "[ . 1 . 2]" 1
771 1 40 HIS HD2 1 43 ARG QD 2.300 . 6.000 4.822 2.604 6.032 0.032 13 0 "[ . 1 . 2]" 1
772 1 40 HIS HD2 1 44 ALA MB 2.600 . 3.500 3.156 2.052 3.551 0.051 5 0 "[ . 1 . 2]" 1
773 1 40 HIS HD2 1 71 VAL MG2 2.000 . 6.000 4.509 2.242 5.945 . 0 0 "[ . 1 . 2]" 1
774 1 40 HIS HE1 1 44 ALA MB 3.400 . 4.800 4.342 3.068 4.977 0.177 15 0 "[ . 1 . 2]" 1
775 1 41 ASN H 1 41 ASN HA 3.000 . 4.100 2.807 2.780 2.847 . 0 0 "[ . 1 . 2]" 1
776 1 41 ASN H 1 42 ALA H 2.900 . 3.900 2.683 2.580 2.789 . 0 0 "[ . 1 . 2]" 1
777 1 41 ASN H 1 42 ALA MB 4.000 . 6.000 4.320 4.214 4.406 . 0 0 "[ . 1 . 2]" 1
778 1 41 ASN H 1 43 ARG H 3.200 . 4.500 4.031 3.869 4.200 . 0 0 "[ . 1 . 2]" 1
779 1 41 ASN HA 1 41 ASN QB 3.300 . 4.700 2.413 2.191 2.486 . 0 0 "[ . 1 . 2]" 1
780 1 41 ASN HA 1 44 ALA H 2.700 . 3.600 3.227 2.910 3.611 0.011 6 0 "[ . 1 . 2]" 1
781 1 41 ASN HA 1 44 ALA MB 2.500 . 3.300 2.816 2.462 3.301 0.001 6 0 "[ . 1 . 2]" 1
782 1 41 ASN QB 1 42 ALA H 3.500 . 5.000 2.768 2.475 3.669 . 0 0 "[ . 1 . 2]" 1
783 1 41 ASN QB 1 46 LEU H 3.100 . 4.300 3.597 3.264 3.965 . 0 0 "[ . 1 . 2]" 1
784 1 42 ALA H 1 42 ALA HA 2.500 . 3.300 2.805 2.782 2.844 . 0 0 "[ . 1 . 2]" 1
785 1 42 ALA H 1 42 ALA MB 2.200 . 2.800 2.221 2.203 2.242 . 0 0 "[ . 1 . 2]" 1
786 1 42 ALA H 1 43 ARG H 2.400 . 3.100 2.619 2.492 2.715 . 0 0 "[ . 1 . 2]" 1
787 1 42 ALA H 1 43 ARG QB 4.100 . 6.000 4.302 4.154 4.440 . 0 0 "[ . 1 . 2]" 1
788 1 42 ALA H 1 44 ALA H 3.400 . 4.900 4.189 4.056 4.356 . 0 0 "[ . 1 . 2]" 1
789 1 42 ALA HA 1 43 ARG H 2.700 . 3.600 3.501 3.459 3.539 . 0 0 "[ . 1 . 2]" 1
790 1 42 ALA HA 1 45 GLN H 3.000 . 4.100 3.621 3.436 3.838 . 0 0 "[ . 1 . 2]" 1
791 1 42 ALA HA 1 46 LEU H 3.300 . 4.600 4.108 3.700 4.536 . 0 0 "[ . 1 . 2]" 1
792 1 42 ALA MB 1 43 ARG H 2.200 . 2.800 2.418 2.300 2.597 . 0 0 "[ . 1 . 2]" 1
793 1 42 ALA MB 1 43 ARG HA 2.900 . 3.900 3.779 3.723 3.837 . 0 0 "[ . 1 . 2]" 1
794 1 42 ALA MB 1 43 ARG QB 2.700 . 3.600 3.647 3.619 3.667 0.067 11 0 "[ . 1 . 2]" 1
795 1 43 ARG H 1 43 ARG HA 2.200 . 2.800 2.816 2.785 2.850 0.050 8 0 "[ . 1 . 2]" 1
796 1 43 ARG H 1 43 ARG QB 2.000 . 2.500 2.179 2.124 2.231 . 0 0 "[ . 1 . 2]" 1
797 1 43 ARG H 1 43 ARG QD 3.600 . 5.200 4.447 4.131 4.822 . 0 0 "[ . 1 . 2]" 1
798 1 43 ARG H 1 44 ALA H 2.200 . 2.800 2.677 2.538 2.804 0.004 6 0 "[ . 1 . 2]" 1
799 1 43 ARG H 1 44 ALA HA 4.100 . 6.000 5.165 5.062 5.272 . 0 0 "[ . 1 . 2]" 1
800 1 43 ARG H 1 44 ALA MB 3.600 . 5.200 4.453 4.354 4.573 . 0 0 "[ . 1 . 2]" 1
801 1 43 ARG H 1 45 GLN H 3.300 . 4.700 3.805 3.707 3.917 . 0 0 "[ . 1 . 2]" 1
802 1 43 ARG HA 1 43 ARG QB 2.000 . 2.500 2.413 2.370 2.467 . 0 0 "[ . 1 . 2]" 1
803 1 43 ARG HA 1 43 ARG QD 3.000 . 4.100 3.382 2.052 4.152 0.052 20 0 "[ . 1 . 2]" 1
804 1 43 ARG HA 1 43 ARG QG 2.300 . 2.900 2.528 2.336 2.928 0.028 16 0 "[ . 1 . 2]" 1
805 1 43 ARG HA 1 44 ALA H 3.000 . 4.100 3.558 3.528 3.584 . 0 0 "[ . 1 . 2]" 1
806 1 43 ARG HA 1 44 ALA MB 3.900 . 5.800 4.981 4.907 5.017 . 0 0 "[ . 1 . 2]" 1
807 1 43 ARG HA 1 45 GLN H 2.900 . 4.000 3.899 3.819 3.968 . 0 0 "[ . 1 . 2]" 1
808 1 43 ARG HA 1 45 GLN QG 3.100 . 4.300 4.299 4.199 4.403 0.103 8 0 "[ . 1 . 2]" 1
809 1 43 ARG HA 1 46 LEU H 2.600 . 6.000 6.066 6.004 6.138 0.138 7 0 "[ . 1 . 2]" 1
810 1 43 ARG QB 1 43 ARG QD 2.300 . 2.900 2.387 2.102 2.796 . 0 0 "[ . 1 . 2]" 1
811 1 43 ARG QB 1 44 ALA H 2.700 . 3.600 2.240 2.078 2.372 . 0 0 "[ . 1 . 2]" 1
812 1 43 ARG QB 1 44 ALA MB 3.200 . 4.400 3.388 3.285 3.498 . 0 0 "[ . 1 . 2]" 1
813 1 43 ARG HB3 1 44 ALA HA 2.800 . 3.800 3.889 3.846 3.935 0.135 12 0 "[ . 1 . 2]" 1
814 1 43 ARG HB3 1 44 ALA MB 2.700 . 3.600 3.452 3.343 3.566 . 0 0 "[ . 1 . 2]" 1
815 1 43 ARG HB3 1 45 GLN H 3.200 . 4.500 4.458 4.313 4.536 0.036 1 0 "[ . 1 . 2]" 1
816 1 43 ARG QG 1 44 ALA H 3.200 . 4.500 3.732 3.413 4.369 . 0 0 "[ . 1 . 2]" 1
817 1 44 ALA H 1 44 ALA HA 2.500 . 3.300 2.804 2.774 2.837 . 0 0 "[ . 1 . 2]" 1
818 1 44 ALA H 1 44 ALA MB 2.200 . 2.800 2.286 2.245 2.329 . 0 0 "[ . 1 . 2]" 1
819 1 44 ALA H 1 45 GLN H 2.400 . 3.100 2.609 2.566 2.668 . 0 0 "[ . 1 . 2]" 1
820 1 44 ALA H 1 45 GLN HA 4.000 . 6.000 4.863 4.793 4.933 . 0 0 "[ . 1 . 2]" 1
821 1 44 ALA H 1 45 GLN QG 4.000 . 6.000 4.545 4.418 4.667 . 0 0 "[ . 1 . 2]" 1
822 1 44 ALA H 1 46 LEU H 3.800 . 5.600 3.783 3.672 3.900 . 0 0 "[ . 1 . 2]" 1
823 1 44 ALA H 1 46 LEU MD2 3.700 . 5.400 4.642 4.297 5.095 . 0 0 "[ . 1 . 2]" 1
824 1 44 ALA HA 1 44 ALA MB 2.000 . 2.500 2.098 2.078 2.121 . 0 0 "[ . 1 . 2]" 1
825 1 44 ALA HA 1 45 GLN H 2.600 . 3.400 3.282 3.225 3.342 . 0 0 "[ . 1 . 2]" 1
826 1 44 ALA HA 1 45 GLN HE21 3.400 . 4.800 2.501 2.346 3.128 . 0 0 "[ . 1 . 2]" 1
827 1 44 ALA HA 1 45 GLN QG 3.000 . 4.100 3.752 3.374 4.018 . 0 0 "[ . 1 . 2]" 1
828 1 44 ALA HA 1 46 LEU H 3.700 . 5.400 4.613 4.438 4.906 . 0 0 "[ . 1 . 2]" 1
829 1 44 ALA HA 1 46 LEU QD 3.500 . 5.000 3.677 3.536 3.799 . 0 0 "[ . 1 . 2]" 1
830 1 44 ALA HA 1 67 ALA MB 3.100 . 4.300 4.158 3.656 4.385 0.085 8 0 "[ . 1 . 2]" 1
831 1 44 ALA MB 1 45 GLN H 2.800 . 3.800 3.308 3.222 3.381 . 0 0 "[ . 1 . 2]" 1
832 1 44 ALA MB 1 45 GLN HA 3.500 . 5.000 4.878 4.770 4.958 . 0 0 "[ . 1 . 2]" 1
833 1 44 ALA MB 1 45 GLN HE22 3.200 . 4.500 4.605 4.565 4.648 0.148 9 0 "[ . 1 . 2]" 1
834 1 44 ALA MB 1 45 GLN QG 2.500 . 6.000 4.495 4.243 4.670 . 0 0 "[ . 1 . 2]" 1
835 1 44 ALA MB 1 46 LEU QB 2.700 . 3.600 2.913 2.472 3.285 . 0 0 "[ . 1 . 2]" 1
836 1 44 ALA MB 1 46 LEU MD2 2.200 . 2.800 2.515 2.178 2.836 0.036 10 0 "[ . 1 . 2]" 1
837 1 44 ALA MB 1 67 ALA MB 2.200 . 2.800 2.204 1.879 2.439 . 0 0 "[ . 1 . 2]" 1
838 1 45 GLN H 1 45 GLN HA 2.000 . 2.500 2.270 2.238 2.298 . 0 0 "[ . 1 . 2]" 1
839 1 45 GLN H 1 45 GLN HB2 3.000 . 4.100 3.589 3.537 3.703 . 0 0 "[ . 1 . 2]" 1
840 1 45 GLN H 1 45 GLN HB3 3.400 . 4.800 4.138 4.113 4.178 . 0 0 "[ . 1 . 2]" 1
841 1 45 GLN H 1 45 GLN QG 2.400 . 3.100 2.541 2.484 2.597 . 0 0 "[ . 1 . 2]" 1
842 1 45 GLN H 1 46 LEU H 2.500 . 3.300 2.320 2.269 2.376 . 0 0 "[ . 1 . 2]" 1
843 1 45 GLN H 1 46 LEU MD2 3.700 . 5.400 5.150 4.965 5.407 0.007 10 0 "[ . 1 . 2]" 1
844 1 45 GLN HA 1 45 GLN HB2 3.000 . 4.100 3.010 2.997 3.023 . 0 0 "[ . 1 . 2]" 1
845 1 45 GLN HA 1 45 GLN HB3 2.500 . 3.300 2.507 2.452 2.534 . 0 0 "[ . 1 . 2]" 1
846 1 45 GLN HA 1 45 GLN HE21 3.600 . 5.300 4.229 4.038 4.662 . 0 0 "[ . 1 . 2]" 1
847 1 45 GLN HA 1 45 GLN QG 2.400 . 3.100 2.332 2.220 2.485 . 0 0 "[ . 1 . 2]" 1
848 1 45 GLN HA 1 46 LEU H 2.600 . 3.400 2.798 2.598 2.940 . 0 0 "[ . 1 . 2]" 1
849 1 45 GLN HA 1 46 LEU MD1 3.600 . 5.200 4.301 4.113 4.457 . 0 0 "[ . 1 . 2]" 1
850 1 45 GLN HB2 1 45 GLN HE21 3.700 . 5.400 2.969 2.660 3.913 . 0 0 "[ . 1 . 2]" 1
851 1 45 GLN HB2 1 45 GLN HE22 3.800 . 5.600 3.584 3.473 4.041 . 0 0 "[ . 1 . 2]" 1
852 1 45 GLN HB2 1 45 GLN QG 1.800 . 2.200 2.369 2.329 2.400 0.200 14 0 "[ . 1 . 2]" 1
853 1 45 GLN HB2 1 46 LEU H 3.700 . 5.400 3.931 3.766 4.123 . 0 0 "[ . 1 . 2]" 1
854 1 45 GLN HB3 1 45 GLN HE21 4.000 . 6.000 4.175 4.002 4.570 . 0 0 "[ . 1 . 2]" 1
855 1 45 GLN HB3 1 45 GLN HE22 4.200 . 6.000 4.847 4.690 5.109 . 0 0 "[ . 1 . 2]" 1
856 1 45 GLN HB3 1 45 GLN QG 1.600 . 2.200 2.164 2.126 2.205 0.005 8 0 "[ . 1 . 2]" 1
857 1 45 GLN HB3 1 46 LEU H 4.100 . 6.000 4.386 4.339 4.446 . 0 0 "[ . 1 . 2]" 1
858 1 45 GLN HE21 1 45 GLN QG 2.700 . 3.600 2.103 2.055 2.161 . 0 0 "[ . 1 . 2]" 1
859 1 45 GLN HE22 1 45 GLN QG 3.200 . 4.500 3.265 3.217 3.283 . 0 0 "[ . 1 . 2]" 1
860 1 45 GLN QG 1 46 LEU H 2.900 . 4.000 4.106 4.069 4.140 0.140 3 0 "[ . 1 . 2]" 1
861 1 46 LEU H 1 46 LEU QB 3.200 . 4.500 2.135 2.074 2.235 . 0 0 "[ . 1 . 2]" 1
862 1 46 LEU H 1 46 LEU MD1 3.300 . 4.700 2.571 2.470 2.663 . 0 0 "[ . 1 . 2]" 1
863 1 46 LEU H 1 46 LEU MD2 3.100 . 4.300 3.849 3.724 4.013 . 0 0 "[ . 1 . 2]" 1
864 1 46 LEU H 1 46 LEU HG 2.900 . 4.000 4.159 4.123 4.200 0.200 7 0 "[ . 1 . 2]" 1
865 1 46 LEU H 1 47 THR H 3.900 . 5.800 4.484 4.405 4.572 . 0 0 "[ . 1 . 2]" 1
866 1 46 LEU HA 1 46 LEU MD1 2.500 . 3.300 2.297 2.198 2.466 . 0 0 "[ . 1 . 2]" 1
867 1 46 LEU HA 1 46 LEU MD2 3.300 . 4.700 3.778 3.725 3.827 . 0 0 "[ . 1 . 2]" 1
868 1 46 LEU HA 1 46 LEU HG 3.100 . 4.300 2.517 2.406 2.622 . 0 0 "[ . 1 . 2]" 1
869 1 46 LEU HA 1 47 THR H 2.300 . 2.900 2.135 2.051 2.265 . 0 0 "[ . 1 . 2]" 1
870 1 46 LEU HA 1 61 LEU MD1 2.900 . 6.000 4.858 4.283 5.526 . 0 0 "[ . 1 . 2]" 1
871 1 46 LEU MD1 1 47 THR H 3.500 . 5.000 4.142 4.041 4.278 . 0 0 "[ . 1 . 2]" 1
872 1 46 LEU MD1 1 63 GLY HA2 2.600 . 3.500 2.163 1.989 2.366 . 0 0 "[ . 1 . 2]" 1
873 1 46 LEU MD1 1 63 GLY HA3 3.300 . 4.700 2.672 2.508 2.915 . 0 0 "[ . 1 . 2]" 1
874 1 46 LEU MD1 1 64 HIS H 3.200 . 4.500 2.629 2.332 2.878 . 0 0 "[ . 1 . 2]" 1
875 1 46 LEU MD1 1 67 ALA H 3.800 . 5.600 4.245 4.126 4.420 . 0 0 "[ . 1 . 2]" 1
876 1 46 LEU MD1 1 67 ALA MB 2.000 . 2.500 1.873 1.797 1.972 . 0 0 "[ . 1 . 2]" 1
877 1 46 LEU MD1 1 68 VAL H 3.000 . 4.100 3.629 3.266 3.846 . 0 0 "[ . 1 . 2]" 1
878 1 46 LEU MD1 1 69 ALA H 2.500 . 6.000 5.757 5.305 5.972 . 0 0 "[ . 1 . 2]" 1
879 1 46 LEU MD2 1 47 THR H 4.100 . 6.000 4.758 4.228 4.969 . 0 0 "[ . 1 . 2]" 1
880 1 46 LEU MD2 1 63 GLY HA2 2.500 . 3.300 3.309 3.206 3.368 0.068 9 0 "[ . 1 . 2]" 1
881 1 46 LEU MD2 1 67 ALA MB 2.300 . 3.000 2.632 2.271 3.086 0.086 1 0 "[ . 1 . 2]" 1
882 1 46 LEU HG 1 47 THR H 3.700 . 5.400 3.757 3.240 3.966 . 0 0 "[ . 1 . 2]" 1
883 1 47 THR H 1 47 THR HA 2.900 . 3.900 2.910 2.882 2.962 . 0 0 "[ . 1 . 2]" 1
884 1 47 THR H 1 47 THR MG 2.900 . 4.000 2.582 2.414 2.890 . 0 0 "[ . 1 . 2]" 1
885 1 47 THR H 1 62 GLU H 3.200 . 4.500 3.032 2.864 3.278 . 0 0 "[ . 1 . 2]" 1
886 1 47 THR H 1 62 GLU HB3 4.200 . 6.000 4.179 3.993 5.309 . 0 0 "[ . 1 . 2]" 1
887 1 47 THR H 1 62 GLU QG 3.400 . 4.900 4.109 2.718 4.368 . 0 0 "[ . 1 . 2]" 1
888 1 47 THR H 1 63 GLY HA2 3.900 . 5.800 4.327 4.063 4.470 . 0 0 "[ . 1 . 2]" 1
889 1 47 THR H 1 63 GLY HA3 3.800 . 5.600 3.823 3.659 3.954 . 0 0 "[ . 1 . 2]" 1
890 1 47 THR H 1 98 ALA HA 2.800 . 6.000 5.975 5.276 6.080 0.080 18 0 "[ . 1 . 2]" 1
891 1 47 THR HA 1 47 THR HB 2.800 . 3.800 2.499 2.472 2.523 . 0 0 "[ . 1 . 2]" 1
892 1 47 THR HA 1 47 THR MG 1.900 . 2.400 2.174 2.056 2.232 . 0 0 "[ . 1 . 2]" 1
893 1 47 THR HA 1 48 GLY H 2.600 . 3.400 2.441 2.319 2.547 . 0 0 "[ . 1 . 2]" 1
894 1 47 THR HA 1 97 PHE H 4.500 . 6.000 6.012 5.639 6.152 0.152 19 0 "[ . 1 . 2]" 1
895 1 47 THR HA 1 98 ALA H 3.700 . 5.400 5.389 5.197 5.650 0.250 7 0 "[ . 1 . 2]" 1
896 1 47 THR HA 1 99 GLY H 3.100 . 4.300 4.173 3.934 4.371 0.071 19 0 "[ . 1 . 2]" 1
897 1 47 THR HA 1 100 TRP H 3.000 . 4.100 3.212 3.045 3.786 . 0 0 "[ . 1 . 2]" 1
898 1 47 THR HB 1 47 THR MG 3.100 . 4.300 2.107 2.095 2.121 . 0 0 "[ . 1 . 2]" 1
899 1 47 THR MG 1 48 GLY H 4.000 . 6.000 3.795 3.639 3.893 . 0 0 "[ . 1 . 2]" 1
900 1 47 THR MG 1 63 GLY HA3 3.300 . 4.700 4.842 4.782 4.923 0.223 19 0 "[ . 1 . 2]" 1
901 1 47 THR MG 1 98 ALA H 3.900 . 5.800 3.581 3.189 4.029 . 0 0 "[ . 1 . 2]" 1
902 1 47 THR MG 1 98 ALA HA 3.000 . 4.100 2.192 1.835 2.578 0.065 14 0 "[ . 1 . 2]" 1
903 1 47 THR MG 1 98 ALA MB 3.400 . 4.800 3.533 3.044 3.759 . 0 0 "[ . 1 . 2]" 1
904 1 47 THR MG 1 99 GLY H 2.800 . 3.800 3.422 3.049 3.823 0.023 7 0 "[ . 1 . 2]" 1
905 1 47 THR MG 1 99 GLY HA2 3.600 . 5.200 3.951 3.695 4.845 . 0 0 "[ . 1 . 2]" 1
906 1 47 THR MG 1 99 GLY HA3 2.800 . 3.800 2.517 2.221 3.664 . 0 0 "[ . 1 . 2]" 1
907 1 47 THR MG 1 100 TRP H 2.800 . 3.800 3.994 3.932 4.082 0.282 7 0 "[ . 1 . 2]" 1
908 1 48 GLY H 1 97 PHE HB2 3.800 . 5.600 3.333 3.024 3.516 . 0 0 "[ . 1 . 2]" 1
909 1 48 GLY H 1 97 PHE HB3 3.800 . 5.600 3.482 2.946 3.774 . 0 0 "[ . 1 . 2]" 1
910 1 48 GLY H 1 97 PHE QD 3.800 . 5.600 4.812 3.948 5.128 . 0 0 "[ . 1 . 2]" 1
911 1 48 GLY H 1 99 GLY H 4.200 . 6.000 3.655 3.315 3.882 . 0 0 "[ . 1 . 2]" 1
912 1 48 GLY H 1 100 TRP HA 3.300 . 4.700 1.914 1.864 2.141 0.036 5 0 "[ . 1 . 2]" 1
913 1 48 GLY H 1 100 TRP HB2 4.300 . 6.000 3.133 2.774 4.057 . 0 0 "[ . 1 . 2]" 1
914 1 48 GLY H 1 101 HIS H 4.100 . 6.000 3.844 3.665 4.021 . 0 0 "[ . 1 . 2]" 1
915 1 48 GLY QA 1 49 ALA H 3.300 . 4.300 2.141 2.085 2.171 . 0 0 "[ . 1 . 2]" 1
916 1 48 GLY QA 1 101 HIS HB2 3.500 . 5.000 5.109 5.063 5.217 0.217 9 0 "[ . 1 . 2]" 1
917 1 49 ALA H 1 49 ALA MB 3.300 . 4.600 2.900 2.819 2.939 . 0 0 "[ . 1 . 2]" 1
918 1 49 ALA H 1 60 TRP QB 3.600 . 5.200 5.253 5.132 5.324 0.124 9 0 "[ . 1 . 2]" 1
919 1 49 ALA H 1 60 TRP HE3 3.100 . 4.300 3.907 3.762 4.285 . 0 0 "[ . 1 . 2]" 1
920 1 49 ALA H 1 61 LEU HA 4.000 . 6.000 3.780 3.521 4.218 . 0 0 "[ . 1 . 2]" 1
921 1 49 ALA H 1 97 PHE QD 4.100 . 6.000 5.523 5.245 5.709 . 0 0 "[ . 1 . 2]" 1
922 1 49 ALA H 1 100 TRP HB3 3.900 . 5.800 5.968 5.893 6.012 0.212 9 0 "[ . 1 . 2]" 1
923 1 49 ALA HA 1 49 ALA MB 2.400 . 3.100 2.151 2.142 2.160 . 0 0 "[ . 1 . 2]" 1
924 1 49 ALA HA 1 50 LEU H 3.000 . 4.100 2.379 2.069 2.635 . 0 0 "[ . 1 . 2]" 1
925 1 49 ALA HA 1 101 HIS H 2.900 . 4.000 1.874 1.783 1.946 0.017 14 0 "[ . 1 . 2]" 1
926 1 49 ALA MB 1 50 LEU H 3.600 . 5.200 2.487 2.161 2.914 . 0 0 "[ . 1 . 2]" 1
927 1 49 ALA MB 1 50 LEU QB 3.900 . 5.800 4.385 4.069 4.665 . 0 0 "[ . 1 . 2]" 1
928 1 49 ALA MB 1 51 PHE QD 3.200 . 4.500 4.204 3.531 4.523 0.023 14 0 "[ . 1 . 2]" 1
929 1 49 ALA MB 1 51 PHE QE 3.000 . 4.100 3.294 2.589 3.719 . 0 0 "[ . 1 . 2]" 1
930 1 49 ALA MB 1 51 PHE HZ 3.800 . 5.600 3.847 3.243 4.478 . 0 0 "[ . 1 . 2]" 1
931 1 49 ALA MB 1 58 PHE QD 3.000 . 6.000 5.332 4.941 5.656 . 0 0 "[ . 1 . 2]" 1
932 1 49 ALA MB 1 60 TRP HE3 3.000 . 4.100 3.715 3.552 3.886 . 0 0 "[ . 1 . 2]" 1
933 1 49 ALA MB 1 97 PHE QD 3.100 . 4.300 2.852 2.400 3.602 . 0 0 "[ . 1 . 2]" 1
934 1 49 ALA MB 1 97 PHE QE 2.500 . 3.300 3.086 2.721 3.326 0.026 7 0 "[ . 1 . 2]" 1
935 1 49 ALA MB 1 97 PHE HZ 3.400 . 4.800 3.945 3.066 4.615 . 0 0 "[ . 1 . 2]" 1
936 1 49 ALA MB 1 101 HIS H 2.900 . 3.900 3.038 2.798 3.211 . 0 0 "[ . 1 . 2]" 1
937 1 50 LEU H 1 50 LEU QB 3.700 . 5.400 2.903 2.306 3.283 . 0 0 "[ . 1 . 2]" 1
938 1 50 LEU H 1 50 LEU HG 3.500 . 5.000 3.533 2.712 4.948 . 0 0 "[ . 1 . 2]" 1
939 1 50 LEU H 1 101 HIS H 3.900 . 5.800 4.050 3.605 4.406 . 0 0 "[ . 1 . 2]" 1
940 1 50 LEU H 1 102 MET HA 3.600 . 5.200 3.085 2.336 3.861 . 0 0 "[ . 1 . 2]" 1
941 1 50 LEU HA 1 50 LEU HG 3.600 . 5.300 3.694 2.694 3.959 . 0 0 "[ . 1 . 2]" 1
942 1 50 LEU HA 1 51 PHE H 2.500 . 3.300 2.173 2.090 2.305 . 0 0 "[ . 1 . 2]" 1
943 1 50 LEU HA 1 51 PHE QD 2.900 . 3.900 3.701 3.344 3.960 0.060 4 0 "[ . 1 . 2]" 1
944 1 50 LEU HA 1 59 GLN HA 3.100 . 4.300 2.408 2.214 2.543 . 0 0 "[ . 1 . 2]" 1
945 1 50 LEU HA 1 60 TRP QB 2.700 . 6.000 5.644 5.048 6.099 0.099 4 0 "[ . 1 . 2]" 1
946 1 50 LEU QB 1 51 PHE H 4.200 . 6.000 3.032 2.462 3.827 . 0 0 "[ . 1 . 2]" 1
947 1 50 LEU MD1 1 52 TYR QD 2.700 . 3.600 3.470 3.069 3.694 0.094 20 0 "[ . 1 . 2]" 1
948 1 50 LEU MD1 1 102 MET ME 2.100 . 2.700 2.152 1.747 2.594 . 0 0 "[ . 1 . 2]" 1
949 1 50 LEU MD1 1 104 LEU H 3.100 . 4.300 3.610 2.512 4.432 0.132 8 0 "[ . 1 . 2]" 1
950 1 50 LEU HG 1 51 PHE H 4.000 . 6.000 4.388 2.815 4.894 . 0 0 "[ . 1 . 2]" 1
951 1 50 LEU HG 1 102 MET ME 2.900 . 3.900 3.565 2.052 4.019 0.119 8 0 "[ . 1 . 2]" 1
952 1 50 LEU HG 1 104 LEU H 3.000 . 6.000 5.220 4.212 6.080 0.080 20 0 "[ . 1 . 2]" 1
953 1 51 PHE H 1 51 PHE HA 2.900 . 4.000 2.917 2.900 2.934 . 0 0 "[ . 1 . 2]" 1
954 1 51 PHE H 1 51 PHE QB 3.600 . 6.000 2.586 2.444 2.707 . 0 0 "[ . 1 . 2]" 1
955 1 51 PHE H 1 51 PHE QD 3.000 . 4.100 3.086 2.837 3.436 . 0 0 "[ . 1 . 2]" 1
956 1 51 PHE H 1 58 PHE H 3.500 . 6.000 3.257 3.109 3.632 . 0 0 "[ . 1 . 2]" 1
957 1 51 PHE H 1 58 PHE QB 3.900 . 5.800 3.116 2.858 3.655 . 0 0 "[ . 1 . 2]" 1
958 1 51 PHE HA 1 51 PHE QD 3.200 . 4.500 2.783 2.359 3.031 . 0 0 "[ . 1 . 2]" 1
959 1 51 PHE QB 1 51 PHE QD 2.700 . 6.000 2.133 2.103 2.219 . 0 0 "[ . 1 . 2]" 1
960 1 51 PHE QD 1 58 PHE QB 3.100 . 4.300 3.323 2.719 3.929 . 0 0 "[ . 1 . 2]" 1
961 1 51 PHE QD 1 58 PHE QD 2.800 . 3.800 2.192 1.958 2.958 . 0 0 "[ . 1 . 2]" 1
962 1 51 PHE QD 1 60 TRP HZ3 3.300 . 4.700 3.015 2.539 3.696 . 0 0 "[ . 1 . 2]" 1
963 1 51 PHE QE 1 60 TRP HZ3 2.100 . 2.700 2.351 1.874 2.770 0.070 2 0 "[ . 1 . 2]" 1
964 1 52 TYR HA 1 52 TYR HB2 2.700 . 3.600 2.484 2.408 2.526 . 0 0 "[ . 1 . 2]" 1
965 1 52 TYR HA 1 52 TYR QD 2.800 . 3.800 2.974 2.269 3.318 . 0 0 "[ . 1 . 2]" 1
966 1 52 TYR HA 1 53 SER H 2.500 . 3.300 2.209 2.143 2.318 . 0 0 "[ . 1 . 2]" 1
967 1 52 TYR HA 1 53 SER QB 4.000 . 6.000 4.441 4.056 4.613 . 0 0 "[ . 1 . 2]" 1
968 1 52 TYR HA 1 57 PHE HA 2.500 . 3.300 2.542 2.251 2.777 . 0 0 "[ . 1 . 2]" 1
969 1 52 TYR HA 1 57 PHE QD 2.800 . 3.800 3.404 2.705 3.843 0.043 2 0 "[ . 1 . 2]" 1
970 1 52 TYR HA 1 58 PHE HA 2.900 . 6.000 6.007 5.610 6.152 0.152 1 0 "[ . 1 . 2]" 1
971 1 52 TYR HB2 1 52 TYR QD 2.400 . 3.100 2.350 2.212 2.775 . 0 0 "[ . 1 . 2]" 1
972 1 52 TYR HB2 1 57 PHE QE 2.900 . 4.000 3.099 2.670 3.383 . 0 0 "[ . 1 . 2]" 1
973 1 52 TYR HB2 1 102 MET ME 2.800 . 3.800 3.727 3.474 3.895 0.095 15 0 "[ . 1 . 2]" 1
974 1 52 TYR HB3 1 52 TYR QD 2.500 . 3.300 2.721 2.300 2.797 . 0 0 "[ . 1 . 2]" 1
975 1 52 TYR HB3 1 53 SER H 4.400 . 6.000 4.400 4.269 4.532 . 0 0 "[ . 1 . 2]" 1
976 1 52 TYR HB3 1 57 PHE QD 3.300 . 4.700 4.572 4.126 4.784 0.084 11 0 "[ . 1 . 2]" 1
977 1 52 TYR HB3 1 57 PHE QE 3.300 . 4.700 4.540 3.799 4.736 0.036 5 0 "[ . 1 . 2]" 1
978 1 52 TYR HB3 1 102 MET ME 2.900 . 4.000 3.940 3.465 4.064 0.064 6 0 "[ . 1 . 2]" 1
979 1 52 TYR QD 1 53 SER H 3.400 . 4.900 2.927 1.888 3.640 0.012 14 0 "[ . 1 . 2]" 1
980 1 52 TYR QD 1 57 PHE QD 2.900 . 3.900 3.414 2.831 3.927 0.027 7 0 "[ . 1 . 2]" 1
981 1 52 TYR QD 1 57 PHE QE 2.800 . 3.800 2.667 2.342 3.508 . 0 0 "[ . 1 . 2]" 1
982 1 52 TYR QD 1 57 PHE HZ 3.000 . 4.100 3.573 2.995 4.182 0.082 14 0 "[ . 1 . 2]" 1
983 1 52 TYR QD 1 102 MET ME 2.600 . 3.400 3.285 2.455 3.522 0.122 1 0 "[ . 1 . 2]" 1
984 1 52 TYR QE 1 55 GLY H 3.200 . 4.500 3.495 1.900 4.513 0.013 20 0 "[ . 1 . 2]" 1
985 1 52 TYR QE 1 55 GLY HA3 3.300 . 4.700 2.987 2.164 4.216 . 0 0 "[ . 1 . 2]" 1
986 1 52 TYR QE 1 56 VAL H 3.800 . 5.600 4.745 3.612 5.438 . 0 0 "[ . 1 . 2]" 1
987 1 52 TYR QE 1 57 PHE QE 3.800 . 5.600 3.767 3.219 4.412 . 0 0 "[ . 1 . 2]" 1
988 1 53 SER H 1 53 SER QB 3.300 . 4.700 2.857 2.395 3.292 . 0 0 "[ . 1 . 2]" 1
989 1 53 SER H 1 54 GLN H 4.000 . 6.000 4.001 3.735 4.266 . 0 0 "[ . 1 . 2]" 1
990 1 53 SER H 1 54 GLN HB3 3.900 . 5.800 5.431 4.833 6.002 0.202 14 0 "[ . 1 . 2]" 1
991 1 53 SER H 1 56 VAL H 3.200 . 4.500 3.619 3.015 4.258 . 0 0 "[ . 1 . 2]" 1
992 1 53 SER HA 1 54 GLN H 2.600 . 3.500 2.177 2.065 2.346 . 0 0 "[ . 1 . 2]" 1
993 1 53 SER QB 1 54 GLN H 4.300 . 6.000 3.433 2.779 4.008 . 0 0 "[ . 1 . 2]" 1
994 1 54 GLN H 1 54 GLN HA 2.600 . 3.400 2.262 2.188 2.793 . 0 0 "[ . 1 . 2]" 1
995 1 54 GLN H 1 54 GLN HB2 3.500 . 5.100 3.244 2.486 3.956 . 0 0 "[ . 1 . 2]" 1
996 1 54 GLN H 1 54 GLN HB3 3.900 . 5.800 3.618 2.271 4.115 . 0 0 "[ . 1 . 2]" 1
997 1 54 GLN H 1 54 GLN QG 3.600 . 5.200 3.999 2.714 4.535 . 0 0 "[ . 1 . 2]" 1
998 1 54 GLN H 1 55 GLY H 3.500 . 5.000 3.361 2.541 4.198 . 0 0 "[ . 1 . 2]" 1
999 1 54 GLN H 1 56 VAL H 4.200 . 6.000 4.729 4.238 5.274 . 0 0 "[ . 1 . 2]" 1
1000 1 54 GLN HA 1 54 GLN HB2 2.900 . 3.900 2.568 2.379 3.019 . 0 0 "[ . 1 . 2]" 1
1001 1 54 GLN HA 1 54 GLN QG 3.100 . 4.300 2.737 2.416 3.390 . 0 0 "[ . 1 . 2]" 1
1002 1 54 GLN HA 1 55 GLY H 2.800 . 3.800 3.249 2.071 3.558 . 0 0 "[ . 1 . 2]" 1
1003 1 54 GLN HA 1 56 VAL H 4.200 . 6.000 4.879 4.330 5.401 . 0 0 "[ . 1 . 2]" 1
1004 1 54 GLN HB2 1 54 GLN HE21 3.700 . 5.400 3.589 1.920 4.512 0.080 10 0 "[ . 1 . 2]" 1
1005 1 54 GLN HB2 1 54 GLN HE22 4.100 . 6.000 4.306 3.510 5.359 . 0 0 "[ . 1 . 2]" 1
1006 1 54 GLN HB2 1 54 GLN QG 2.500 . 3.300 2.332 2.151 2.436 . 0 0 "[ . 1 . 2]" 1
1007 1 54 GLN HB2 1 55 GLY H 4.300 . 6.000 3.890 3.485 4.624 . 0 0 "[ . 1 . 2]" 1
1008 1 54 GLN HB3 1 54 GLN HE21 4.100 . 6.000 3.730 1.954 4.538 0.046 6 0 "[ . 1 . 2]" 1
1009 1 54 GLN HB3 1 54 GLN HE22 4.200 . 6.000 4.567 3.561 5.333 . 0 0 "[ . 1 . 2]" 1
1010 1 54 GLN HB3 1 54 GLN QG 2.500 . 3.300 2.276 2.160 2.386 . 0 0 "[ . 1 . 2]" 1
1011 1 54 GLN HB3 1 55 GLY H 3.700 . 5.400 3.141 1.978 4.501 0.022 7 0 "[ . 1 . 2]" 1
1012 1 54 GLN HE21 1 54 GLN QG 2.700 . 3.600 2.300 2.129 2.828 . 0 0 "[ . 1 . 2]" 1
1013 1 54 GLN HE22 1 54 GLN QG 3.400 . 4.800 3.284 3.183 3.486 . 0 0 "[ . 1 . 2]" 1
1014 1 54 GLN QG 1 55 GLY H 4.400 . 6.000 3.627 2.682 4.634 . 0 0 "[ . 1 . 2]" 1
1015 1 55 GLY H 1 55 GLY HA2 2.900 . 4.000 2.765 2.494 2.951 . 0 0 "[ . 1 . 2]" 1
1016 1 55 GLY H 1 55 GLY HA3 3.000 . 4.100 2.689 2.293 2.949 . 0 0 "[ . 1 . 2]" 1
1017 1 55 GLY H 1 56 VAL H 3.100 . 4.300 2.208 1.844 3.522 0.056 6 0 "[ . 1 . 2]" 1
1018 1 55 GLY H 1 56 VAL MG1 4.200 . 6.000 3.909 2.978 5.154 . 0 0 "[ . 1 . 2]" 1
1019 1 55 GLY HA2 1 56 VAL H 3.600 . 5.200 3.054 2.291 3.461 . 0 0 "[ . 1 . 2]" 1
1020 1 55 GLY HA3 1 56 VAL H 3.300 . 4.700 3.438 3.019 3.559 . 0 0 "[ . 1 . 2]" 1
1021 1 56 VAL H 1 56 VAL HA 3.000 . 4.200 2.870 2.798 2.908 . 0 0 "[ . 1 . 2]" 1
1022 1 56 VAL H 1 56 VAL HB 3.500 . 5.000 3.512 2.638 3.857 . 0 0 "[ . 1 . 2]" 1
1023 1 56 VAL H 1 56 VAL MG1 2.600 . 3.500 2.370 1.957 2.982 . 0 0 "[ . 1 . 2]" 1
1024 1 56 VAL HA 1 56 VAL MG1 2.600 . 3.400 2.615 2.353 3.246 . 0 0 "[ . 1 . 2]" 1
1025 1 56 VAL HA 1 57 PHE H 2.400 . 3.100 2.045 1.937 2.194 . 0 0 "[ . 1 . 2]" 1
1026 1 57 PHE H 1 57 PHE QB 2.900 . 4.000 2.033 1.917 2.152 . 0 0 "[ . 1 . 2]" 1
1027 1 57 PHE H 1 57 PHE QD 3.700 . 5.400 3.812 3.472 4.088 . 0 0 "[ . 1 . 2]" 1
1028 1 57 PHE H 1 82 SER HB2 4.000 . 6.000 6.165 6.030 6.286 0.286 7 0 "[ . 1 . 2]" 1
1029 1 57 PHE HA 1 57 PHE QD 2.300 . 3.000 2.206 2.009 2.394 . 0 0 "[ . 1 . 2]" 1
1030 1 57 PHE HA 1 58 PHE H 2.400 . 6.000 2.284 2.195 2.391 . 0 0 "[ . 1 . 2]" 1
1031 1 57 PHE QB 1 57 PHE QD 2.400 . 3.100 2.120 2.061 2.205 . 0 0 "[ . 1 . 2]" 1
1032 1 57 PHE QB 1 82 SER HB2 3.700 . 5.400 5.247 4.758 5.500 0.100 20 0 "[ . 1 . 2]" 1
1033 1 57 PHE QD 1 58 PHE H 3.300 . 6.000 3.069 2.583 3.515 . 0 0 "[ . 1 . 2]" 1
1034 1 57 PHE QD 1 81 HIS HB2 3.100 . 4.300 2.821 2.299 4.055 . 0 0 "[ . 1 . 2]" 1
1035 1 57 PHE QD 1 81 HIS HB3 2.700 . 3.600 2.862 2.296 3.396 . 0 0 "[ . 1 . 2]" 1
1036 1 57 PHE QD 1 82 SER H 3.400 . 4.800 3.503 3.032 4.179 . 0 0 "[ . 1 . 2]" 1
1037 1 57 PHE QD 1 102 MET ME 2.500 . 6.000 4.732 4.240 4.913 . 0 0 "[ . 1 . 2]" 1
1038 1 57 PHE QE 1 81 HIS H 3.700 . 5.400 4.679 4.090 5.402 0.002 14 0 "[ . 1 . 2]" 1
1039 1 57 PHE QE 1 81 HIS HA 3.900 . 5.800 2.681 1.993 3.313 0.007 18 0 "[ . 1 . 2]" 1
1040 1 57 PHE QE 1 81 HIS HB2 3.200 . 4.500 3.391 2.661 4.338 . 0 0 "[ . 1 . 2]" 1
1041 1 57 PHE QE 1 81 HIS HB3 2.800 . 3.700 2.243 1.902 2.920 . 0 0 "[ . 1 . 2]" 1
1042 1 57 PHE QE 1 81 HIS HD2 2.700 . 6.000 5.674 5.265 5.991 . 0 0 "[ . 1 . 2]" 1
1043 1 57 PHE QE 1 82 SER H 3.100 . 4.300 4.288 4.061 4.406 0.106 14 0 "[ . 1 . 2]" 1
1044 1 57 PHE QE 1 102 MET ME 2.300 . 3.000 2.997 2.537 3.118 0.118 18 0 "[ . 1 . 2]" 1
1045 1 58 PHE H 1 58 PHE HA 2.800 . 6.000 2.910 2.857 2.943 . 0 0 "[ . 1 . 2]" 1
1046 1 58 PHE HA 1 58 PHE QB 2.400 . 3.100 2.374 2.335 2.405 . 0 0 "[ . 1 . 2]" 1
1047 1 58 PHE HA 1 58 PHE QD 3.300 . 4.600 2.814 2.604 2.976 . 0 0 "[ . 1 . 2]" 1
1048 1 58 PHE HA 1 59 GLN H 2.600 . 6.000 2.148 2.102 2.194 . 0 0 "[ . 1 . 2]" 1
1049 1 58 PHE QB 1 58 PHE QD 2.300 . 3.000 2.134 2.112 2.145 . 0 0 "[ . 1 . 2]" 1
1050 1 58 PHE QB 1 58 PHE QE 3.900 . 5.800 3.936 3.904 3.955 . 0 0 "[ . 1 . 2]" 1
1051 1 58 PHE QE 1 60 TRP HE1 3.900 . 5.800 5.648 5.242 5.913 0.113 4 0 "[ . 1 . 2]" 1
1052 1 59 GLN HA 1 60 TRP H 2.700 . 6.000 2.248 2.174 2.300 . 0 0 "[ . 1 . 2]" 1
1053 1 60 TRP H 1 60 TRP HE3 3.300 . 6.000 2.103 1.920 2.328 . 0 0 "[ . 1 . 2]" 1
1054 1 60 TRP HA 1 60 TRP HD1 4.000 . 6.000 4.443 4.283 4.533 . 0 0 "[ . 1 . 2]" 1
1055 1 60 TRP HA 1 60 TRP HE3 3.500 . 5.000 4.235 4.114 4.381 . 0 0 "[ . 1 . 2]" 1
1056 1 60 TRP HA 1 61 LEU H 2.200 . 2.800 2.439 2.315 2.525 . 0 0 "[ . 1 . 2]" 1
1057 1 60 TRP HA 1 61 LEU MD2 3.000 . 4.100 2.796 2.298 4.110 0.010 10 0 "[ . 1 . 2]" 1
1058 1 60 TRP QB 1 60 TRP HE3 3.100 . 4.300 2.934 2.713 3.037 . 0 0 "[ . 1 . 2]" 1
1059 1 60 TRP QB 1 61 LEU H 4.400 . 6.000 2.528 2.375 2.744 . 0 0 "[ . 1 . 2]" 1
1060 1 60 TRP HE1 1 62 GLU HB3 4.000 . 6.000 5.846 4.590 6.053 0.053 6 0 "[ . 1 . 2]" 1
1061 1 60 TRP HE1 1 62 GLU QG 3.600 . 5.200 3.306 2.626 4.580 . 0 0 "[ . 1 . 2]" 1
1062 1 60 TRP HE1 1 97 PHE QD 3.900 . 5.800 4.326 3.432 4.668 . 0 0 "[ . 1 . 2]" 1
1063 1 60 TRP HZ2 1 97 PHE QD 2.500 . 3.300 2.976 2.492 3.345 0.045 19 0 "[ . 1 . 2]" 1
1064 1 60 TRP HZ2 1 97 PHE HZ 2.800 . 3.800 3.639 2.835 3.841 0.041 6 0 "[ . 1 . 2]" 1
1065 1 60 TRP HZ3 1 101 HIS H 3.200 . 6.000 6.148 6.075 6.217 0.217 2 0 "[ . 1 . 2]" 1
1066 1 61 LEU H 1 61 LEU HB2 4.300 . 6.000 3.863 3.706 3.938 . 0 0 "[ . 1 . 2]" 1
1067 1 61 LEU H 1 61 LEU HB3 4.000 . 6.000 3.415 3.307 3.714 . 0 0 "[ . 1 . 2]" 1
1068 1 61 LEU H 1 61 LEU MD1 5.400 . 6.000 4.022 2.686 4.290 . 0 0 "[ . 1 . 2]" 1
1069 1 61 LEU HA 1 61 LEU HB2 2.600 . 3.400 2.470 2.401 2.652 . 0 0 "[ . 1 . 2]" 1
1070 1 61 LEU HA 1 61 LEU HB3 2.400 . 3.100 2.387 2.278 2.449 . 0 0 "[ . 1 . 2]" 1
1071 1 61 LEU HA 1 61 LEU MD1 4.100 . 6.000 4.019 3.756 4.107 . 0 0 "[ . 1 . 2]" 1
1072 1 61 LEU HA 1 61 LEU MD2 2.900 . 4.000 3.638 3.482 3.999 . 0 0 "[ . 1 . 2]" 1
1073 1 61 LEU HA 1 61 LEU HG 2.700 . 3.600 3.656 3.465 3.707 0.107 1 0 "[ . 1 . 2]" 1
1074 1 61 LEU HA 1 62 GLU H 2.500 . 3.300 2.147 2.099 2.209 . 0 0 "[ . 1 . 2]" 1
1075 1 61 LEU HB2 1 61 LEU MD1 1.800 . 2.200 1.923 1.891 1.953 . 0 0 "[ . 1 . 2]" 1
1076 1 61 LEU HB2 1 61 LEU MD2 3.400 . 4.900 3.109 2.651 3.201 . 0 0 "[ . 1 . 2]" 1
1077 1 61 LEU HB2 1 61 LEU MD2 2.100 . 2.700 2.098 2.026 2.113 . 0 0 "[ . 1 . 2]" 1
1078 1 61 LEU HB3 1 61 LEU MD2 2.500 . 3.300 2.260 2.162 2.322 . 0 0 "[ . 1 . 2]" 1
1079 1 61 LEU HB3 1 62 GLU H 5.000 . 6.000 3.869 3.591 4.009 . 0 0 "[ . 1 . 2]" 1
1080 1 61 LEU HB3 1 68 VAL MG1 4.100 . 6.000 4.673 4.369 5.397 . 0 0 "[ . 1 . 2]" 1
1081 1 61 LEU HB3 1 68 VAL MG2 4.200 . 6.000 6.047 5.986 6.121 0.121 3 0 "[ . 1 . 2]" 1
1082 1 61 LEU MD2 1 61 LEU HG 2.100 . 2.700 2.135 2.100 2.144 . 0 0 "[ . 1 . 2]" 1
1083 1 61 LEU MD2 1 75 ILE MD 2.700 . 3.600 3.114 2.512 3.557 . 0 0 "[ . 1 . 2]" 1
1084 1 61 LEU HG 1 62 GLU H 4.200 . 6.000 4.313 3.867 5.013 . 0 0 "[ . 1 . 2]" 1
1085 1 62 GLU H 1 62 GLU HA 2.900 . 3.900 2.940 2.911 2.956 . 0 0 "[ . 1 . 2]" 1
1086 1 62 GLU H 1 62 GLU QG 3.400 . 4.900 2.397 2.120 2.560 . 0 0 "[ . 1 . 2]" 1
1087 1 62 GLU HA 1 62 GLU HB2 2.400 . 3.100 2.996 2.582 3.034 . 0 0 "[ . 1 . 2]" 1
1088 1 62 GLU HA 1 62 GLU HB3 2.500 . 3.300 2.373 2.346 2.415 . 0 0 "[ . 1 . 2]" 1
1089 1 62 GLU HA 1 63 GLY H 2.300 . 2.900 2.251 2.151 2.298 . 0 0 "[ . 1 . 2]" 1
1090 1 62 GLU HA 1 68 VAL MG2 3.200 . 4.400 4.380 4.140 4.478 0.078 12 0 "[ . 1 . 2]" 1
1091 1 62 GLU HB2 1 92 ILE HG12 3.300 . 4.600 4.496 4.332 4.614 0.014 3 0 "[ . 1 . 2]" 1
1092 1 62 GLU HB2 1 63 GLY H 3.600 . 5.200 4.058 3.396 4.130 . 0 0 "[ . 1 . 2]" 1
1093 1 62 GLU HB3 1 63 GLY H 3.500 . 5.000 3.500 3.364 4.111 . 0 0 "[ . 1 . 2]" 1
1094 1 62 GLU HB3 1 92 ILE MD 2.500 . 3.300 1.979 1.866 2.290 . 0 0 "[ . 1 . 2]" 1
1095 1 63 GLY H 1 63 GLY HA2 2.800 . 3.800 2.734 2.698 2.754 . 0 0 "[ . 1 . 2]" 1
1096 1 63 GLY H 1 63 GLY HA3 3.000 . 4.100 2.835 2.809 2.859 . 0 0 "[ . 1 . 2]" 1
1097 1 63 GLY H 1 64 HIS H 4.100 . 6.000 4.364 4.329 4.421 . 0 0 "[ . 1 . 2]" 1
1098 1 63 GLY H 1 68 VAL MG2 2.500 . 3.300 2.965 2.869 3.079 . 0 0 "[ . 1 . 2]" 1
1099 1 63 GLY HA2 1 64 HIS H 2.500 . 3.300 2.676 2.622 2.751 . 0 0 "[ . 1 . 2]" 1
1100 1 63 GLY HA2 1 68 VAL MG2 2.400 . 3.100 2.596 2.429 2.871 . 0 0 "[ . 1 . 2]" 1
1101 1 63 GLY HA3 1 64 HIS H 2.600 . 3.400 2.583 2.538 2.651 . 0 0 "[ . 1 . 2]" 1
1102 1 63 GLY HA3 1 92 ILE HG13 2.900 . 6.000 6.040 6.016 6.074 0.074 6 0 "[ . 1 . 2]" 1
1103 1 64 HIS H 1 64 HIS HA 2.600 . 3.500 2.858 2.841 2.873 . 0 0 "[ . 1 . 2]" 1
1104 1 64 HIS H 1 64 HIS HB2 2.400 . 3.100 2.787 2.725 2.862 . 0 0 "[ . 1 . 2]" 1
1105 1 64 HIS H 1 64 HIS HB3 2.400 . 3.100 2.428 2.379 2.498 . 0 0 "[ . 1 . 2]" 1
1106 1 64 HIS H 1 67 ALA H 3.500 . 5.000 4.590 4.491 4.756 . 0 0 "[ . 1 . 2]" 1
1107 1 64 HIS H 1 67 ALA MB 2.700 . 3.600 3.063 2.919 3.217 . 0 0 "[ . 1 . 2]" 1
1108 1 64 HIS H 1 68 VAL MG2 3.000 . 4.100 3.657 3.559 3.844 . 0 0 "[ . 1 . 2]" 1
1109 1 64 HIS HA 1 64 HIS HB2 2.000 . 2.500 2.418 2.386 2.442 . 0 0 "[ . 1 . 2]" 1
1110 1 64 HIS HA 1 64 HIS HB3 2.300 . 3.000 3.049 3.039 3.058 0.058 9 0 "[ . 1 . 2]" 1
1111 1 64 HIS HA 1 64 HIS HD2 2.400 . 3.100 3.134 3.110 3.162 0.062 17 0 "[ . 1 . 2]" 1
1112 1 64 HIS HA 1 65 PRO HD2 2.100 . 2.700 1.996 1.897 2.060 . 0 0 "[ . 1 . 2]" 1
1113 1 64 HIS HA 1 65 PRO HD3 2.200 . 2.800 2.718 2.665 2.789 . 0 0 "[ . 1 . 2]" 1
1114 1 64 HIS HA 1 65 PRO QG 3.300 . 4.700 3.823 3.688 3.884 . 0 0 "[ . 1 . 2]" 1
1115 1 64 HIS HA 1 67 ALA H 3.400 . 4.900 4.898 4.817 4.940 0.040 19 0 "[ . 1 . 2]" 1
1116 1 64 HIS HA 1 67 ALA MB 3.500 . 5.000 4.481 4.342 4.611 . 0 0 "[ . 1 . 2]" 1
1117 1 64 HIS HB2 1 64 HIS HD2 2.700 . 3.600 2.564 2.507 2.622 . 0 0 "[ . 1 . 2]" 1
1118 1 64 HIS HB2 1 67 ALA H 3.900 . 5.800 5.101 5.018 5.148 . 0 0 "[ . 1 . 2]" 1
1119 1 64 HIS HB2 1 67 ALA MB 3.200 . 4.500 4.286 4.111 4.457 . 0 0 "[ . 1 . 2]" 1
1120 1 64 HIS HB3 1 64 HIS HD2 2.600 . 3.400 3.665 3.628 3.691 0.291 1 0 "[ . 1 . 2]" 1
1121 1 64 HIS HB3 1 67 ALA H 2.700 . 3.600 3.611 3.514 3.644 0.044 20 0 "[ . 1 . 2]" 1
1122 1 64 HIS HB3 1 67 ALA MB 2.400 . 3.100 2.884 2.702 3.068 . 0 0 "[ . 1 . 2]" 1
1123 1 64 HIS HD2 1 65 PRO HD3 3.800 . 5.600 4.433 4.295 4.656 . 0 0 "[ . 1 . 2]" 1
1124 1 64 HIS HD2 1 65 PRO QG 3.800 . 5.600 3.667 3.377 3.901 . 0 0 "[ . 1 . 2]" 1
1125 1 64 HIS HD2 1 66 ALA MB 1.800 . 6.000 5.745 5.593 5.824 . 0 0 "[ . 1 . 2]" 1
1126 1 64 HIS HE1 1 65 PRO QG 2.800 . 3.800 3.793 3.532 3.855 0.055 1 0 "[ . 1 . 2]" 1
1127 1 64 HIS HE1 1 66 ALA MB 2.000 . 2.500 2.588 2.552 2.621 0.121 4 0 "[ . 1 . 2]" 1
1128 1 65 PRO HA 1 65 PRO HB2 2.500 . 3.300 2.878 2.862 2.905 . 0 0 "[ . 1 . 2]" 1
1129 1 65 PRO HA 1 65 PRO HB3 2.100 . 2.700 2.240 2.230 2.252 . 0 0 "[ . 1 . 2]" 1
1130 1 65 PRO HA 1 65 PRO HD2 3.700 . 5.400 3.904 3.860 3.933 . 0 0 "[ . 1 . 2]" 1
1131 1 65 PRO HA 1 65 PRO QG 3.000 . 4.100 3.363 3.317 3.395 . 0 0 "[ . 1 . 2]" 1
1132 1 65 PRO HA 1 67 ALA H 3.600 . 5.200 4.424 4.364 4.533 . 0 0 "[ . 1 . 2]" 1
1133 1 65 PRO HA 1 68 VAL H 3.300 . 4.600 3.778 3.700 3.908 . 0 0 "[ . 1 . 2]" 1
1134 1 65 PRO HA 1 68 VAL HB 2.600 . 3.500 3.135 2.920 3.321 . 0 0 "[ . 1 . 2]" 1
1135 1 65 PRO HA 1 68 VAL MG1 3.400 . 4.800 3.992 3.838 4.163 . 0 0 "[ . 1 . 2]" 1
1136 1 65 PRO HA 1 68 VAL MG2 2.400 . 3.100 2.231 2.145 2.343 . 0 0 "[ . 1 . 2]" 1
1137 1 65 PRO HA 1 69 ALA H 3.000 . 4.100 4.123 4.049 4.157 0.057 15 0 "[ . 1 . 2]" 1
1138 1 65 PRO HA 1 69 ALA MB 2.200 . 6.000 4.567 4.467 4.712 . 0 0 "[ . 1 . 2]" 1
1139 1 65 PRO HB2 1 65 PRO HD2 3.500 . 5.000 3.983 3.925 4.028 . 0 0 "[ . 1 . 2]" 1
1140 1 65 PRO HB2 1 65 PRO QG 2.100 . 2.700 2.184 2.165 2.246 . 0 0 "[ . 1 . 2]" 1
1141 1 65 PRO HB2 1 66 ALA MB 3.500 . 5.000 3.582 3.412 3.684 . 0 0 "[ . 1 . 2]" 1
1142 1 65 PRO HB2 1 68 VAL MG2 3.800 . 5.600 4.400 4.322 4.525 . 0 0 "[ . 1 . 2]" 1
1143 1 65 PRO HB3 1 65 PRO HD2 3.900 . 5.800 3.990 3.957 4.029 . 0 0 "[ . 1 . 2]" 1
1144 1 65 PRO HB3 1 66 ALA MB 3.800 . 5.600 5.026 4.849 5.125 . 0 0 "[ . 1 . 2]" 1
1145 1 65 PRO HB3 1 68 VAL MG1 4.000 . 6.000 5.647 5.404 5.854 . 0 0 "[ . 1 . 2]" 1
1146 1 65 PRO HD2 1 65 PRO QG 2.300 . 2.900 2.162 2.109 2.180 . 0 0 "[ . 1 . 2]" 1
1147 1 65 PRO HD3 1 65 PRO QG 2.400 . 3.100 2.256 2.236 2.268 . 0 0 "[ . 1 . 2]" 1
1148 1 66 ALA H 1 66 ALA MB 3.700 . 5.400 2.275 2.207 2.312 . 0 0 "[ . 1 . 2]" 1
1149 1 66 ALA H 1 67 ALA H 2.700 . 3.600 2.578 2.451 2.658 . 0 0 "[ . 1 . 2]" 1
1150 1 66 ALA HA 1 66 ALA MB 1.700 . 2.200 2.091 2.080 2.107 . 0 0 "[ . 1 . 2]" 1
1151 1 66 ALA HA 1 67 ALA H 2.900 . 4.000 3.361 3.321 3.393 . 0 0 "[ . 1 . 2]" 1
1152 1 66 ALA HA 1 67 ALA MB 3.300 . 4.600 4.763 4.730 4.793 0.193 8 0 "[ . 1 . 2]" 1
1153 1 66 ALA HA 1 68 VAL H 3.600 . 5.200 4.050 3.867 4.141 . 0 0 "[ . 1 . 2]" 1
1154 1 66 ALA HA 1 68 VAL QG 3.100 . 4.300 4.330 4.300 4.375 0.075 12 0 "[ . 1 . 2]" 1
1155 1 66 ALA HA 1 69 ALA H 2.700 . 3.600 2.902 2.726 2.959 . 0 0 "[ . 1 . 2]" 1
1156 1 66 ALA HA 1 69 ALA MB 1.700 . 2.200 2.253 2.223 2.282 0.082 19 0 "[ . 1 . 2]" 1
1157 1 66 ALA HA 1 70 GLU H 3.300 . 4.700 3.625 3.435 3.790 . 0 0 "[ . 1 . 2]" 1
1158 1 66 ALA MB 1 67 ALA H 2.200 . 2.800 2.849 2.833 2.877 0.077 4 0 "[ . 1 . 2]" 1
1159 1 66 ALA MB 1 67 ALA HA 2.800 . 3.800 3.888 3.871 3.902 0.102 10 0 "[ . 1 . 2]" 1
1160 1 66 ALA MB 1 68 VAL H 3.500 . 5.000 4.479 4.372 4.534 . 0 0 "[ . 1 . 2]" 1
1161 1 66 ALA MB 1 69 ALA H 3.400 . 4.800 4.264 4.169 4.309 . 0 0 "[ . 1 . 2]" 1
1162 1 66 ALA MB 1 69 ALA MB 2.500 . 3.300 3.421 3.367 3.478 0.178 4 0 "[ . 1 . 2]" 1
1163 1 67 ALA H 1 67 ALA HA 2.400 . 3.100 2.819 2.802 2.835 . 0 0 "[ . 1 . 2]" 1
1164 1 67 ALA H 1 67 ALA MB 2.000 . 2.500 2.133 2.109 2.147 . 0 0 "[ . 1 . 2]" 1
1165 1 67 ALA H 1 68 VAL H 2.300 . 2.900 2.328 2.228 2.390 . 0 0 "[ . 1 . 2]" 1
1166 1 67 ALA H 1 68 VAL HA 3.800 . 5.600 5.044 4.928 5.104 . 0 0 "[ . 1 . 2]" 1
1167 1 67 ALA H 1 68 VAL HB 3.500 . 5.100 4.827 4.524 4.939 . 0 0 "[ . 1 . 2]" 1
1168 1 67 ALA H 1 68 VAL MG1 4.300 . 6.000 5.476 5.401 5.543 . 0 0 "[ . 1 . 2]" 1
1169 1 67 ALA H 1 68 VAL MG2 3.200 . 4.500 3.200 3.093 3.262 . 0 0 "[ . 1 . 2]" 1
1170 1 67 ALA H 1 69 ALA H 3.200 . 4.500 3.759 3.644 3.880 . 0 0 "[ . 1 . 2]" 1
1171 1 67 ALA H 1 69 ALA MB 3.800 . 5.600 4.621 4.516 4.717 . 0 0 "[ . 1 . 2]" 1
1172 1 67 ALA H 1 70 GLU H 3.900 . 5.800 4.445 4.363 4.540 . 0 0 "[ . 1 . 2]" 1
1173 1 67 ALA HA 1 67 ALA MB 1.900 . 2.300 2.129 2.118 2.141 . 0 0 "[ . 1 . 2]" 1
1174 1 67 ALA HA 1 68 VAL H 3.000 . 4.100 3.441 3.410 3.457 . 0 0 "[ . 1 . 2]" 1
1175 1 67 ALA HA 1 68 VAL MG1 3.100 . 6.000 6.041 6.019 6.071 0.071 19 0 "[ . 1 . 2]" 1
1176 1 67 ALA HA 1 69 ALA H 3.300 . 4.700 4.370 4.248 4.494 . 0 0 "[ . 1 . 2]" 1
1177 1 67 ALA HA 1 70 GLU H 2.700 . 3.600 3.387 3.295 3.472 . 0 0 "[ . 1 . 2]" 1
1178 1 67 ALA HA 1 70 GLU HB2 2.700 . 3.600 3.244 2.870 3.605 0.005 13 0 "[ . 1 . 2]" 1
1179 1 67 ALA HA 1 70 GLU HB3 2.400 . 6.000 2.819 2.477 3.400 . 0 0 "[ . 1 . 2]" 1
1180 1 67 ALA HA 1 71 VAL H 3.700 . 5.400 4.096 3.882 4.335 . 0 0 "[ . 1 . 2]" 1
1181 1 67 ALA MB 1 68 VAL H 2.200 . 2.800 2.140 2.006 2.256 . 0 0 "[ . 1 . 2]" 1
1182 1 67 ALA MB 1 68 VAL HA 3.100 . 4.300 3.648 3.571 3.699 . 0 0 "[ . 1 . 2]" 1
1183 1 67 ALA MB 1 68 VAL MG1 3.000 . 4.200 4.420 4.382 4.475 0.275 3 0 "[ . 1 . 2]" 1
1184 1 67 ALA MB 1 68 VAL MG2 2.600 . 3.500 2.818 2.747 2.895 . 0 0 "[ . 1 . 2]" 1
1185 1 67 ALA MB 1 70 GLU H 3.500 . 5.000 4.432 4.358 4.517 . 0 0 "[ . 1 . 2]" 1
1186 1 67 ALA MB 1 71 VAL H 3.100 . 6.000 4.512 4.331 4.694 . 0 0 "[ . 1 . 2]" 1
1187 1 68 VAL H 1 68 VAL HA 2.500 . 3.300 2.825 2.795 2.857 . 0 0 "[ . 1 . 2]" 1
1188 1 68 VAL H 1 68 VAL HB 2.500 . 3.300 2.880 2.699 2.944 . 0 0 "[ . 1 . 2]" 1
1189 1 68 VAL H 1 68 VAL MG1 3.500 . 5.000 3.603 3.575 3.626 . 0 0 "[ . 1 . 2]" 1
1190 1 68 VAL H 1 68 VAL MG2 2.100 . 2.600 1.720 1.702 1.739 . 0 0 "[ . 1 . 2]" 1
1191 1 68 VAL H 1 69 ALA H 2.300 . 2.900 2.568 2.467 2.654 . 0 0 "[ . 1 . 2]" 1
1192 1 68 VAL H 1 69 ALA HA 4.000 . 6.000 5.151 5.072 5.216 . 0 0 "[ . 1 . 2]" 1
1193 1 68 VAL H 1 69 ALA MB 3.500 . 5.000 4.266 4.179 4.334 . 0 0 "[ . 1 . 2]" 1
1194 1 68 VAL HA 1 68 VAL HB 2.900 . 3.900 2.990 2.971 3.017 . 0 0 "[ . 1 . 2]" 1
1195 1 68 VAL HA 1 68 VAL MG1 2.200 . 2.800 2.172 2.148 2.220 . 0 0 "[ . 1 . 2]" 1
1196 1 68 VAL HA 1 68 VAL MG2 2.300 . 3.000 2.676 2.512 2.759 . 0 0 "[ . 1 . 2]" 1
1197 1 68 VAL HA 1 69 ALA H 3.000 . 4.100 3.513 3.498 3.536 . 0 0 "[ . 1 . 2]" 1
1198 1 68 VAL HA 1 71 VAL H 3.600 . 5.200 3.663 3.519 3.828 . 0 0 "[ . 1 . 2]" 1
1199 1 68 VAL HA 1 71 VAL HB 3.000 . 4.100 2.687 2.402 4.102 0.002 18 0 "[ . 1 . 2]" 1
1200 1 68 VAL HA 1 71 VAL MG1 2.600 . 3.500 3.401 2.347 3.623 0.123 4 0 "[ . 1 . 2]" 1
1201 1 68 VAL HA 1 72 MET H 3.500 . 5.100 4.030 3.937 4.159 . 0 0 "[ . 1 . 2]" 1
1202 1 68 VAL HB 1 68 VAL MG1 2.100 . 2.600 2.081 2.070 2.097 . 0 0 "[ . 1 . 2]" 1
1203 1 68 VAL HB 1 68 VAL MG2 2.000 . 2.500 2.074 2.054 2.092 . 0 0 "[ . 1 . 2]" 1
1204 1 68 VAL HB 1 69 ALA H 2.300 . 2.900 2.441 2.279 2.560 . 0 0 "[ . 1 . 2]" 1
1205 1 68 VAL HB 1 69 ALA MB 3.000 . 4.100 3.599 3.517 3.684 . 0 0 "[ . 1 . 2]" 1
1206 1 68 VAL MG1 1 69 ALA H 3.200 . 4.500 3.743 3.526 3.830 . 0 0 "[ . 1 . 2]" 1
1207 1 68 VAL MG1 1 69 ALA HA 3.000 . 4.100 4.027 3.675 4.135 0.035 6 0 "[ . 1 . 2]" 1
1208 1 68 VAL MG1 1 69 ALA MB 3.300 . 4.700 4.397 4.137 4.512 . 0 0 "[ . 1 . 2]" 1
1209 1 68 VAL MG1 1 72 MET ME 2.700 . 3.600 3.460 3.140 3.632 0.032 14 0 "[ . 1 . 2]" 1
1210 1 68 VAL MG1 1 72 MET HG2 2.600 . 3.400 2.946 2.756 3.115 . 0 0 "[ . 1 . 2]" 1
1211 1 68 VAL MG1 1 72 MET HG3 2.800 . 3.800 3.496 3.205 3.702 . 0 0 "[ . 1 . 2]" 1
1212 1 68 VAL MG2 1 69 ALA H 3.200 . 4.500 3.149 3.074 3.294 . 0 0 "[ . 1 . 2]" 1
1213 1 68 VAL MG2 1 69 ALA HA 3.500 . 5.000 5.035 4.995 5.092 0.092 3 0 "[ . 1 . 2]" 1
1214 1 68 VAL MG2 1 69 ALA MB 2.300 . 6.000 4.311 4.214 4.485 . 0 0 "[ . 1 . 2]" 1
1215 1 69 ALA H 1 69 ALA HA 2.300 . 3.000 2.800 2.771 2.827 . 0 0 "[ . 1 . 2]" 1
1216 1 69 ALA H 1 69 ALA MB 2.000 . 2.500 2.232 2.204 2.268 . 0 0 "[ . 1 . 2]" 1
1217 1 69 ALA H 1 70 GLU H 2.500 . 3.300 2.645 2.567 2.708 . 0 0 "[ . 1 . 2]" 1
1218 1 69 ALA HA 1 69 ALA MB 1.800 . 2.200 2.032 2.016 2.061 . 0 0 "[ . 1 . 2]" 1
1219 1 69 ALA HA 1 70 GLU H 3.100 . 4.300 3.507 3.419 3.550 . 0 0 "[ . 1 . 2]" 1
1220 1 69 ALA HA 1 72 MET H 3.000 . 4.100 2.726 2.644 2.792 . 0 0 "[ . 1 . 2]" 1
1221 1 69 ALA HA 1 72 MET HB2 2.500 . 3.300 2.035 1.979 2.199 . 0 0 "[ . 1 . 2]" 1
1222 1 69 ALA HA 1 72 MET HB3 3.600 . 5.200 3.545 3.458 3.618 . 0 0 "[ . 1 . 2]" 1
1223 1 69 ALA HA 1 72 MET HG3 3.100 . 4.300 2.286 2.110 2.405 . 0 0 "[ . 1 . 2]" 1
1224 1 69 ALA MB 1 70 GLU H 2.000 . 2.500 2.576 2.559 2.598 0.098 9 0 "[ . 1 . 2]" 1
1225 1 69 ALA MB 1 70 GLU HA 3.400 . 4.800 3.906 3.824 3.985 . 0 0 "[ . 1 . 2]" 1
1226 1 69 ALA MB 1 70 GLU HB2 4.000 . 6.000 4.229 3.935 4.423 . 0 0 "[ . 1 . 2]" 1
1227 1 69 ALA MB 1 72 MET H 2.900 . 4.000 4.078 4.060 4.098 0.098 20 0 "[ . 1 . 2]" 1
1228 1 69 ALA MB 1 72 MET HB3 3.000 . 4.200 4.397 4.333 4.426 0.226 8 0 "[ . 1 . 2]" 1
1229 1 69 ALA MB 1 73 SER H 2.800 . 3.800 3.869 3.812 3.936 0.136 19 0 "[ . 1 . 2]" 1
1230 1 70 GLU H 1 70 GLU HA 2.300 . 3.000 2.843 2.824 2.872 . 0 0 "[ . 1 . 2]" 1
1231 1 70 GLU H 1 70 GLU HB2 2.100 . 2.700 2.474 2.219 2.651 . 0 0 "[ . 1 . 2]" 1
1232 1 70 GLU H 1 70 GLU HB3 2.400 . 3.100 2.593 2.400 2.828 . 0 0 "[ . 1 . 2]" 1
1233 1 70 GLU H 1 70 GLU HG2 3.800 . 5.600 4.450 4.242 4.538 . 0 0 "[ . 1 . 2]" 1
1234 1 70 GLU H 1 70 GLU HG3 3.700 . 5.400 4.521 4.395 4.666 . 0 0 "[ . 1 . 2]" 1
1235 1 70 GLU H 1 71 VAL H 2.500 . 3.300 2.601 2.469 2.767 . 0 0 "[ . 1 . 2]" 1
1236 1 70 GLU H 1 72 MET H 3.700 . 5.400 4.045 3.874 4.112 . 0 0 "[ . 1 . 2]" 1
1237 1 70 GLU H 1 74 HIS H 3.300 . 6.000 6.027 5.963 6.085 0.085 3 0 "[ . 1 . 2]" 1
1238 1 70 GLU HA 1 70 GLU HB2 2.100 . 2.600 2.535 2.442 2.639 0.039 12 0 "[ . 1 . 2]" 1
1239 1 70 GLU HA 1 70 GLU HG2 2.400 . 3.100 2.768 2.498 3.126 0.026 2 0 "[ . 1 . 2]" 1
1240 1 70 GLU HA 1 73 SER H 2.400 . 6.000 3.511 3.252 3.759 . 0 0 "[ . 1 . 2]" 1
1241 1 70 GLU HA 1 73 SER QB 2.600 . 3.500 2.922 2.431 3.602 0.102 18 0 "[ . 1 . 2]" 1
1242 1 70 GLU HA 1 74 HIS H 3.000 . 4.100 4.163 4.115 4.219 0.119 18 0 "[ . 1 . 2]" 1
1243 1 70 GLU HB2 1 71 VAL H 3.500 . 5.000 3.682 3.326 3.977 . 0 0 "[ . 1 . 2]" 1
1244 1 70 GLU HB3 1 73 SER H 2.600 . 6.000 5.650 5.430 5.811 . 0 0 "[ . 1 . 2]" 1
1245 1 70 GLU HG3 1 71 VAL H 3.800 . 5.600 4.796 4.534 5.186 . 0 0 "[ . 1 . 2]" 1
1246 1 71 VAL H 1 71 VAL HA 2.800 . 3.800 2.776 2.755 2.820 . 0 0 "[ . 1 . 2]" 1
1247 1 71 VAL H 1 71 VAL HB 2.200 . 2.800 2.332 2.263 2.549 . 0 0 "[ . 1 . 2]" 1
1248 1 71 VAL H 1 71 VAL MG1 3.100 . 4.300 3.495 2.403 3.685 . 0 0 "[ . 1 . 2]" 1
1249 1 71 VAL H 1 71 VAL MG2 2.700 . 3.600 2.499 2.208 3.735 0.135 18 0 "[ . 1 . 2]" 1
1250 1 71 VAL H 1 72 MET H 2.900 . 3.900 2.875 2.582 3.018 . 0 0 "[ . 1 . 2]" 1
1251 1 71 VAL H 1 72 MET HB2 3.300 . 6.000 4.884 4.704 5.013 . 0 0 "[ . 1 . 2]" 1
1252 1 71 VAL H 1 73 SER H 3.600 . 5.200 4.309 4.194 4.474 . 0 0 "[ . 1 . 2]" 1
1253 1 71 VAL HA 1 72 MET H 3.500 . 5.000 3.667 3.626 3.704 . 0 0 "[ . 1 . 2]" 1
1254 1 71 VAL HA 1 74 HIS H 3.000 . 4.100 3.514 3.179 3.774 . 0 0 "[ . 1 . 2]" 1
1255 1 71 VAL HA 1 75 ILE H 3.700 . 5.400 4.069 3.685 4.441 . 0 0 "[ . 1 . 2]" 1
1256 1 71 VAL HB 1 71 VAL MG1 1.800 . 2.200 2.097 2.084 2.109 . 0 0 "[ . 1 . 2]" 1
1257 1 71 VAL HB 1 71 VAL MG2 2.000 . 2.500 2.112 2.081 2.124 . 0 0 "[ . 1 . 2]" 1
1258 1 71 VAL MG1 1 72 MET H 2.400 . 3.100 2.870 2.298 3.012 . 0 0 "[ . 1 . 2]" 1
1259 1 71 VAL MG1 1 72 MET HB2 3.600 . 5.200 4.873 4.384 5.011 . 0 0 "[ . 1 . 2]" 1
1260 1 71 VAL MG1 1 72 MET HB3 3.600 . 5.200 5.180 4.827 5.262 0.062 13 0 "[ . 1 . 2]" 1
1261 1 71 VAL MG1 1 75 ILE MD 2.100 . 2.600 1.931 1.789 2.197 . 0 0 "[ . 1 . 2]" 1
1262 1 71 VAL MG2 1 72 MET H 4.300 . 6.000 4.026 3.919 4.181 . 0 0 "[ . 1 . 2]" 1
1263 1 71 VAL MG2 1 75 ILE H 3.200 . 6.000 5.269 3.431 5.820 . 0 0 "[ . 1 . 2]" 1
1264 1 71 VAL MG2 1 75 ILE MD 3.100 . 4.300 3.689 1.890 4.134 0.010 3 0 "[ . 1 . 2]" 1
1265 1 72 MET H 1 72 MET HA 2.800 . 3.800 2.701 2.681 2.727 . 0 0 "[ . 1 . 2]" 1
1266 1 72 MET H 1 72 MET HB2 2.500 . 3.300 2.542 2.481 2.666 . 0 0 "[ . 1 . 2]" 1
1267 1 72 MET H 1 72 MET ME 3.400 . 4.900 3.031 2.871 3.173 . 0 0 "[ . 1 . 2]" 1
1268 1 72 MET H 1 72 MET HG2 2.900 . 4.000 2.013 1.942 2.103 . 0 0 "[ . 1 . 2]" 1
1269 1 72 MET H 1 72 MET HG3 3.300 . 4.700 3.367 3.296 3.426 . 0 0 "[ . 1 . 2]" 1
1270 1 72 MET H 1 73 SER H 2.500 . 3.300 2.977 2.884 3.038 . 0 0 "[ . 1 . 2]" 1
1271 1 72 MET H 1 86 ILE MG 2.900 . 6.000 6.219 6.162 6.270 0.270 18 0 "[ . 1 . 2]" 1
1272 1 72 MET HA 1 72 MET HB3 2.400 . 3.100 2.502 2.459 2.527 . 0 0 "[ . 1 . 2]" 1
1273 1 72 MET HA 1 72 MET ME 2.600 . 3.500 1.750 1.720 1.788 . 0 0 "[ . 1 . 2]" 1
1274 1 72 MET HA 1 72 MET HG2 3.100 . 4.300 2.773 2.622 2.920 . 0 0 "[ . 1 . 2]" 1
1275 1 72 MET HA 1 72 MET HG3 3.200 . 4.500 3.835 3.804 3.882 . 0 0 "[ . 1 . 2]" 1
1276 1 72 MET HA 1 73 SER H 3.200 . 4.500 3.548 3.516 3.575 . 0 0 "[ . 1 . 2]" 1
1277 1 72 MET HA 1 75 ILE H 3.200 . 4.500 3.412 3.303 3.607 . 0 0 "[ . 1 . 2]" 1
1278 1 72 MET HA 1 75 ILE HB 2.900 . 3.900 2.659 2.267 3.252 . 0 0 "[ . 1 . 2]" 1
1279 1 72 MET HA 1 75 ILE MD 2.600 . 3.400 3.356 3.051 3.470 0.070 5 0 "[ . 1 . 2]" 1
1280 1 72 MET HA 1 75 ILE MG 3.500 . 5.000 3.521 2.486 4.747 . 0 0 "[ . 1 . 2]" 1
1281 1 72 MET HA 1 76 GLN H 2.800 . 3.700 3.461 3.267 3.719 0.019 17 0 "[ . 1 . 2]" 1
1282 1 72 MET HB2 1 72 MET ME 3.000 . 4.100 3.690 3.660 3.713 . 0 0 "[ . 1 . 2]" 1
1283 1 72 MET HB2 1 72 MET HG2 2.700 . 3.600 2.506 2.472 2.540 . 0 0 "[ . 1 . 2]" 1
1284 1 72 MET HB2 1 75 ILE HB 4.200 . 6.000 5.517 5.074 6.114 0.114 16 0 "[ . 1 . 2]" 1
1285 1 72 MET HB2 1 75 ILE MD 4.100 . 6.000 5.761 5.504 5.873 . 0 0 "[ . 1 . 2]" 1
1286 1 72 MET HB2 1 76 GLN H 3.600 . 5.300 5.301 5.195 5.372 0.072 3 0 "[ . 1 . 2]" 1
1287 1 72 MET HB3 1 72 MET ME 2.300 . 2.900 3.012 2.965 3.054 0.154 2 0 "[ . 1 . 2]" 1
1288 1 72 MET HB3 1 72 MET HG3 2.800 . 3.800 2.601 2.556 2.645 . 0 0 "[ . 1 . 2]" 1
1289 1 72 MET HB3 1 73 SER QB 4.100 . 6.000 5.075 4.608 5.431 . 0 0 "[ . 1 . 2]" 1
1290 1 72 MET HB3 1 76 GLN H 3.500 . 5.000 4.422 4.226 4.629 . 0 0 "[ . 1 . 2]" 1
1291 1 72 MET HB3 1 76 GLN HG2 2.700 . 3.600 2.847 2.535 3.101 . 0 0 "[ . 1 . 2]" 1
1292 1 72 MET HB3 1 76 GLN HG3 2.400 . 3.100 3.115 3.046 3.158 0.058 8 0 "[ . 1 . 2]" 1
1293 1 72 MET ME 1 72 MET HG2 2.400 . 3.100 2.236 2.126 2.346 . 0 0 "[ . 1 . 2]" 1
1294 1 72 MET ME 1 72 MET HG3 2.500 . 3.300 3.354 3.324 3.386 0.086 17 0 "[ . 1 . 2]" 1
1295 1 72 MET ME 1 75 ILE MD 2.200 . 2.800 2.489 2.157 2.715 . 0 0 "[ . 1 . 2]" 1
1296 1 72 MET ME 1 75 ILE MG 3.100 . 4.300 2.790 1.947 3.995 . 0 0 "[ . 1 . 2]" 1
1297 1 72 MET ME 1 76 GLN HE21 2.900 . 4.000 3.038 2.003 3.736 . 0 0 "[ . 1 . 2]" 1
1298 1 72 MET ME 1 76 GLN HE22 3.300 . 4.700 3.828 2.559 4.585 . 0 0 "[ . 1 . 2]" 1
1299 1 72 MET ME 1 76 GLN HG2 2.600 . 3.500 3.040 2.832 3.201 . 0 0 "[ . 1 . 2]" 1
1300 1 72 MET ME 1 76 GLN HG3 3.000 . 4.100 4.114 3.807 4.159 0.059 6 0 "[ . 1 . 2]" 1
1301 1 72 MET ME 1 84 VAL QG 2.700 . 3.600 3.322 3.150 3.512 . 0 0 "[ . 1 . 2]" 1
1302 1 72 MET ME 1 86 ILE MD 2.000 . 2.500 2.012 1.916 2.136 . 0 0 "[ . 1 . 2]" 1
1303 1 72 MET ME 1 86 ILE HG13 2.900 . 4.000 3.546 3.283 4.010 0.010 16 0 "[ . 1 . 2]" 1
1304 1 72 MET ME 1 86 ILE MG 2.800 . 3.800 3.031 2.874 3.267 . 0 0 "[ . 1 . 2]" 1
1305 1 72 MET HG2 1 76 GLN HG2 3.400 . 4.900 5.044 4.979 5.113 0.213 2 0 "[ . 1 . 2]" 1
1306 1 72 MET HG3 1 73 SER H 4.300 . 6.000 4.652 4.557 4.758 . 0 0 "[ . 1 . 2]" 1
1307 1 73 SER H 1 74 HIS H 2.600 . 3.400 2.817 2.675 2.899 . 0 0 "[ . 1 . 2]" 1
1308 1 73 SER HA 1 73 SER QB 2.200 . 2.800 2.349 2.194 2.423 . 0 0 "[ . 1 . 2]" 1
1309 1 73 SER HA 1 76 GLN QB 2.800 . 3.800 2.967 2.629 3.205 . 0 0 "[ . 1 . 2]" 1
1310 1 73 SER HA 1 76 GLN HG2 3.500 . 5.000 4.207 3.620 4.571 . 0 0 "[ . 1 . 2]" 1
1311 1 73 SER HA 1 76 GLN HG3 3.300 . 4.600 4.526 4.098 4.650 0.050 2 0 "[ . 1 . 2]" 1
1312 1 73 SER HA 1 77 ARG H 3.200 . 4.500 4.542 4.175 4.640 0.140 1 0 "[ . 1 . 2]" 1
1313 1 73 SER QB 1 77 ARG H 3.200 . 6.000 5.712 5.446 6.039 0.039 20 0 "[ . 1 . 2]" 1
1314 1 74 HIS H 1 74 HIS HB3 2.900 . 3.900 3.550 2.569 3.746 . 0 0 "[ . 1 . 2]" 1
1315 1 74 HIS H 1 75 ILE H 2.400 . 3.100 2.619 2.468 2.753 . 0 0 "[ . 1 . 2]" 1
1316 1 74 HIS H 1 75 ILE HB 4.100 . 6.000 4.707 4.126 5.483 . 0 0 "[ . 1 . 2]" 1
1317 1 74 HIS H 1 76 GLN H 3.500 . 5.100 4.308 4.045 4.571 . 0 0 "[ . 1 . 2]" 1
1318 1 74 HIS HB3 1 75 ILE H 3.200 . 4.500 3.393 2.318 3.884 . 0 0 "[ . 1 . 2]" 1
1319 1 75 ILE H 1 75 ILE HB 3.100 . 4.300 2.368 1.975 2.994 . 0 0 "[ . 1 . 2]" 1
1320 1 75 ILE H 1 75 ILE MD 4.200 . 6.000 3.779 3.579 4.014 . 0 0 "[ . 1 . 2]" 1
1321 1 75 ILE H 1 75 ILE HG12 3.200 . 4.500 3.598 2.864 4.168 . 0 0 "[ . 1 . 2]" 1
1322 1 75 ILE H 1 75 ILE HG13 3.000 . 4.100 2.530 1.883 3.193 0.017 20 0 "[ . 1 . 2]" 1
1323 1 75 ILE H 1 75 ILE MG 3.500 . 5.000 3.598 3.380 3.848 . 0 0 "[ . 1 . 2]" 1
1324 1 75 ILE H 1 76 GLN H 2.700 . 3.600 2.657 2.301 2.976 . 0 0 "[ . 1 . 2]" 1
1325 1 75 ILE H 1 77 ARG H 3.800 . 5.600 4.001 3.744 4.330 . 0 0 "[ . 1 . 2]" 1
1326 1 75 ILE H 1 77 ARG HB2 4.100 . 6.000 5.292 4.748 5.977 . 0 0 "[ . 1 . 2]" 1
1327 1 75 ILE HA 1 75 ILE MD 4.100 . 6.000 3.790 3.679 3.968 . 0 0 "[ . 1 . 2]" 1
1328 1 75 ILE HA 1 75 ILE HG12 3.300 . 4.600 2.513 2.299 2.989 . 0 0 "[ . 1 . 2]" 1
1329 1 75 ILE HA 1 75 ILE HG13 2.900 . 4.000 2.968 2.657 3.530 . 0 0 "[ . 1 . 2]" 1
1330 1 75 ILE HA 1 75 ILE MG 2.600 . 3.500 2.545 2.126 2.880 . 0 0 "[ . 1 . 2]" 1
1331 1 75 ILE HA 1 78 ASP H 3.100 . 4.300 4.186 3.697 4.448 0.148 16 0 "[ . 1 . 2]" 1
1332 1 75 ILE HB 1 75 ILE MD 2.200 . 2.800 2.432 2.360 2.500 . 0 0 "[ . 1 . 2]" 1
1333 1 75 ILE HB 1 75 ILE HG13 3.000 . 4.100 2.383 2.302 2.452 . 0 0 "[ . 1 . 2]" 1
1334 1 75 ILE HB 1 75 ILE MG 2.000 . 2.500 2.084 2.029 2.169 . 0 0 "[ . 1 . 2]" 1
1335 1 75 ILE HB 1 76 GLN H 2.800 . 3.800 2.870 2.488 3.183 . 0 0 "[ . 1 . 2]" 1
1336 1 75 ILE HB 1 77 ARG H 3.700 . 5.400 4.943 4.763 5.123 . 0 0 "[ . 1 . 2]" 1
1337 1 75 ILE MD 1 75 ILE HG12 2.400 . 3.100 2.119 2.093 2.159 . 0 0 "[ . 1 . 2]" 1
1338 1 75 ILE MD 1 75 ILE HG13 2.400 . 3.100 2.111 2.078 2.130 . 0 0 "[ . 1 . 2]" 1
1339 1 75 ILE MD 2 1 FAD H2' 2.800 . 3.800 3.833 3.631 3.943 0.143 13 0 "[ . 1 . 2]" 1
1340 1 75 ILE MD 1 76 GLN H 3.800 . 5.600 4.732 4.424 4.843 . 0 0 "[ . 1 . 2]" 1
1341 1 75 ILE MD 1 86 ILE MG 2.600 . 6.000 5.474 5.164 5.923 . 0 0 "[ . 1 . 2]" 1
1342 1 75 ILE HG12 1 75 ILE MG 2.700 . 3.600 2.477 2.188 2.691 . 0 0 "[ . 1 . 2]" 1
1343 1 75 ILE HG13 1 75 ILE MG 3.100 . 4.300 3.168 3.078 3.231 . 0 0 "[ . 1 . 2]" 1
1344 1 75 ILE HG13 1 84 VAL QG 2.600 . 6.000 4.870 4.505 5.237 . 0 0 "[ . 1 . 2]" 1
1345 1 75 ILE MG 1 76 GLN H 3.300 . 4.700 3.122 2.435 4.195 . 0 0 "[ . 1 . 2]" 1
1346 1 75 ILE MG 1 76 GLN QB 3.800 . 5.600 4.073 3.434 5.218 . 0 0 "[ . 1 . 2]" 1
1347 1 75 ILE MG 1 77 ARG H 4.200 . 6.000 4.579 4.324 5.014 . 0 0 "[ . 1 . 2]" 1
1348 1 75 ILE MG 1 81 HIS HE1 2.600 . 3.400 1.846 1.771 2.045 0.029 13 0 "[ . 1 . 2]" 1
1349 1 76 GLN H 1 76 GLN HA 2.600 . 3.400 2.782 2.710 2.870 . 0 0 "[ . 1 . 2]" 1
1350 1 76 GLN H 1 76 GLN HB2 2.300 . 2.900 2.429 2.319 2.584 . 0 0 "[ . 1 . 2]" 1
1351 1 76 GLN H 1 76 GLN HE22 3.100 . 4.300 4.420 4.141 4.531 0.231 7 0 "[ . 1 . 2]" 1
1352 1 76 GLN H 1 76 GLN HG2 2.100 . 2.700 2.294 2.123 2.614 . 0 0 "[ . 1 . 2]" 1
1353 1 76 GLN H 1 76 GLN HG3 3.000 . 4.100 3.663 3.448 4.009 . 0 0 "[ . 1 . 2]" 1
1354 1 76 GLN H 1 77 ARG H 2.600 . 3.400 2.697 2.405 2.936 . 0 0 "[ . 1 . 2]" 1
1355 1 76 GLN H 1 78 ASP H 3.900 . 5.800 4.335 4.135 4.670 . 0 0 "[ . 1 . 2]" 1
1356 1 76 GLN HA 1 76 GLN HB2 2.900 . 3.900 3.013 2.989 3.032 . 0 0 "[ . 1 . 2]" 1
1357 1 76 GLN HA 1 76 GLN HE21 3.600 . 5.200 2.478 2.081 3.542 . 0 0 "[ . 1 . 2]" 1
1358 1 76 GLN HA 1 76 GLN HE22 4.100 . 6.000 3.025 2.715 3.457 . 0 0 "[ . 1 . 2]" 1
1359 1 76 GLN HA 1 76 GLN HG2 2.600 . 3.400 3.113 2.950 3.306 . 0 0 "[ . 1 . 2]" 1
1360 1 76 GLN HA 1 76 GLN HG3 2.900 . 3.900 3.673 3.580 3.749 . 0 0 "[ . 1 . 2]" 1
1361 1 76 GLN HA 1 77 ARG H 3.000 . 4.100 3.377 3.214 3.454 . 0 0 "[ . 1 . 2]" 1
1362 1 76 GLN HA 1 78 ASP H 3.200 . 4.500 3.244 2.743 3.815 . 0 0 "[ . 1 . 2]" 1
1363 1 76 GLN HA 1 84 VAL QG . . 2.800 2.373 2.114 2.843 0.043 1 0 "[ . 1 . 2]" 1
1364 1 76 GLN HB2 1 76 GLN HG2 2.300 . 3.000 2.490 2.370 2.551 . 0 0 "[ . 1 . 2]" 1
1365 1 76 GLN HB2 1 77 ARG H 2.700 . 3.600 3.292 3.039 3.589 . 0 0 "[ . 1 . 2]" 1
1366 1 76 GLN HB3 1 76 GLN HG2 2.700 . 3.600 3.054 3.008 3.079 . 0 0 "[ . 1 . 2]" 1
1367 1 76 GLN HE21 1 76 GLN HG2 2.400 . 3.100 2.140 1.974 2.287 . 0 0 "[ . 1 . 2]" 1
1368 1 76 GLN HE21 1 76 GLN HG3 2.800 . 3.800 3.310 2.996 3.363 . 0 0 "[ . 1 . 2]" 1
1369 1 76 GLN HE21 1 84 VAL HB 3.700 . 5.400 4.801 4.393 5.456 0.056 1 0 "[ . 1 . 2]" 1
1370 1 76 GLN HE21 1 84 VAL QG 3.500 . 3.900 2.297 1.916 2.886 . 0 0 "[ . 1 . 2]" 1
1371 1 76 GLN HE21 1 86 ILE MD 2.600 . 3.500 2.551 2.164 2.940 . 0 0 "[ . 1 . 2]" 1
1372 1 76 GLN HE21 1 86 ILE HG12 3.900 . 5.800 4.416 3.846 5.266 . 0 0 "[ . 1 . 2]" 1
1373 1 76 GLN HE21 1 86 ILE HG13 4.000 . 6.000 4.545 3.747 5.150 . 0 0 "[ . 1 . 2]" 1
1374 1 76 GLN HE21 1 86 ILE MG 4.300 . 6.000 5.389 4.736 5.546 . 0 0 "[ . 1 . 2]" 1
1375 1 76 GLN HE22 1 76 GLN HG2 3.400 . 4.800 3.363 3.255 3.435 . 0 0 "[ . 1 . 2]" 1
1376 1 76 GLN HE22 1 76 GLN HG3 3.100 . 4.300 3.842 3.703 3.946 . 0 0 "[ . 1 . 2]" 1
1377 1 76 GLN HE22 1 84 VAL HB 3.700 . 5.500 4.072 3.800 4.212 . 0 0 "[ . 1 . 2]" 1
1378 1 76 GLN HE22 1 84 VAL QG 3.500 . 4.300 1.690 1.650 1.765 0.350 5 0 "[ . 1 . 2]" 1
1379 1 76 GLN HE22 1 86 ILE H 4.300 . 6.000 3.774 3.098 4.696 . 0 0 "[ . 1 . 2]" 1
1380 1 76 GLN HE22 1 86 ILE MD 2.600 . 3.400 2.242 1.789 2.581 0.011 3 0 "[ . 1 . 2]" 1
1381 1 76 GLN HG2 1 77 ARG H 3.700 . 5.400 4.669 4.487 4.845 . 0 0 "[ . 1 . 2]" 1
1382 1 76 GLN HG2 1 84 VAL QG 3.100 . 4.300 3.708 3.517 3.964 . 0 0 "[ . 1 . 2]" 1
1383 1 76 GLN HG2 1 86 ILE MD 3.200 . 4.400 3.142 2.637 3.716 . 0 0 "[ . 1 . 2]" 1
1384 1 76 GLN HG3 1 77 ARG H 4.000 . 6.000 5.512 5.354 5.701 . 0 0 "[ . 1 . 2]" 1
1385 1 76 GLN HG3 1 84 VAL QG 3.200 . 4.500 4.198 4.029 4.295 . 0 0 "[ . 1 . 2]" 1
1386 1 76 GLN HG3 1 86 ILE MD 3.100 . 4.300 3.521 3.066 3.821 . 0 0 "[ . 1 . 2]" 1
1387 1 77 ARG H 1 77 ARG HA 2.600 . 3.400 2.896 2.792 2.945 . 0 0 "[ . 1 . 2]" 1
1388 1 77 ARG H 1 77 ARG HB3 2.700 . 3.600 3.595 3.426 3.671 0.071 1 0 "[ . 1 . 2]" 1
1389 1 77 ARG H 1 77 ARG QD 3.000 . 4.200 3.463 2.400 4.264 0.064 19 0 "[ . 1 . 2]" 1
1390 1 77 ARG H 1 77 ARG QG 2.700 . 3.600 2.803 2.011 3.670 0.070 14 0 "[ . 1 . 2]" 1
1391 1 77 ARG H 1 78 ASP H 2.300 . 3.000 2.720 2.461 3.004 0.004 13 0 "[ . 1 . 2]" 1
1392 1 77 ARG H 1 78 ASP HB2 3.900 . 5.800 4.861 3.811 5.863 0.063 4 0 "[ . 1 . 2]" 1
1393 1 77 ARG H 1 78 ASP HB3 4.100 . 6.000 5.144 4.180 5.887 . 0 0 "[ . 1 . 2]" 1
1394 1 77 ARG HA 1 77 ARG HB3 2.400 . 3.100 2.520 2.396 2.708 . 0 0 "[ . 1 . 2]" 1
1395 1 77 ARG HA 1 77 ARG QD 3.100 . 4.300 3.299 1.899 4.225 0.001 1 0 "[ . 1 . 2]" 1
1396 1 77 ARG HA 1 77 ARG QG 2.400 . 3.100 2.566 2.260 3.112 0.012 1 0 "[ . 1 . 2]" 1
1397 1 77 ARG HB2 1 77 ARG QD 2.700 . 3.600 2.621 2.306 3.326 . 0 0 "[ . 1 . 2]" 1
1398 1 77 ARG HB2 1 77 ARG QG 2.100 . 2.700 2.308 2.132 2.431 . 0 0 "[ . 1 . 2]" 1
1399 1 77 ARG HB2 1 78 ASP HA 2.600 . 6.000 4.817 4.347 5.419 . 0 0 "[ . 1 . 2]" 1
1400 1 77 ARG HB3 1 77 ARG QD 2.500 . 3.300 2.840 2.372 3.412 0.112 15 0 "[ . 1 . 2]" 1
1401 1 77 ARG HB3 1 77 ARG QG 1.600 . 2.200 2.232 2.148 2.282 0.082 20 0 "[ . 1 . 2]" 1
1402 1 77 ARG HB3 1 78 ASP HA 2.700 . 6.000 5.103 4.560 5.597 . 0 0 "[ . 1 . 2]" 1
1403 1 77 ARG QD 1 77 ARG QG 2.100 . 2.700 2.049 1.976 2.098 . 0 0 "[ . 1 . 2]" 1
1404 1 77 ARG QG 1 78 ASP H 3.500 . 5.000 4.535 3.903 5.026 0.026 13 0 "[ . 1 . 2]" 1
1405 1 78 ASP H 1 78 ASP HA 2.700 . 3.600 2.622 2.130 2.941 . 0 0 "[ . 1 . 2]" 1
1406 1 78 ASP H 1 78 ASP HB2 2.600 . 3.500 2.727 2.177 3.551 0.051 4 0 "[ . 1 . 2]" 1
1407 1 78 ASP H 1 78 ASP HB3 3.000 . 4.100 2.718 2.219 3.728 . 0 0 "[ . 1 . 2]" 1
1408 1 78 ASP H 1 79 ARG H 3.500 . 5.100 4.185 3.356 4.430 . 0 0 "[ . 1 . 2]" 1
1409 1 78 ASP H 1 81 HIS HD2 3.400 . 4.900 4.570 4.071 5.006 0.106 13 0 "[ . 1 . 2]" 1
1410 1 78 ASP H 1 81 HIS HE1 3.900 . 5.800 5.752 5.471 5.904 0.104 1 0 "[ . 1 . 2]" 1
1411 1 78 ASP H 1 84 VAL QG 3.600 . 5.200 3.552 3.291 4.183 . 0 0 "[ . 1 . 2]" 1
1412 1 78 ASP HA 1 78 ASP HB3 2.900 . 4.000 2.885 2.354 3.019 . 0 0 "[ . 1 . 2]" 1
1413 1 78 ASP HA 1 79 ARG QG 3.000 . 4.100 2.764 2.385 3.467 . 0 0 "[ . 1 . 2]" 1
1414 1 78 ASP HB2 1 79 ARG H 3.600 . 5.300 2.999 1.841 3.619 0.059 1 0 "[ . 1 . 2]" 1
1415 1 78 ASP HB2 1 79 ARG QG 3.100 . 4.300 4.435 3.983 4.576 0.276 18 0 "[ . 1 . 2]" 1
1416 1 78 ASP HB2 1 81 HIS H 3.700 . 5.400 4.403 2.952 5.436 0.036 2 0 "[ . 1 . 2]" 1
1417 1 78 ASP HB2 1 81 HIS HD2 2.300 . 3.000 2.501 1.910 3.228 0.228 11 0 "[ . 1 . 2]" 1
1418 1 78 ASP HB3 1 79 ARG H 3.600 . 5.200 3.126 1.888 4.181 0.112 2 0 "[ . 1 . 2]" 1
1419 1 78 ASP HB3 1 81 HIS HD2 2.600 . 3.400 3.017 1.833 3.668 0.268 18 0 "[ . 1 . 2]" 1
1420 1 79 ARG H 1 79 ARG HA 2.600 . 3.400 2.761 2.525 2.919 . 0 0 "[ . 1 . 2]" 1
1421 1 79 ARG H 1 79 ARG HB3 3.000 . 4.100 3.675 3.502 3.851 . 0 0 "[ . 1 . 2]" 1
1422 1 79 ARG H 1 80 ARG H 3.000 . 4.100 1.922 1.792 2.476 0.108 9 0 "[ . 1 . 2]" 1
1423 1 79 ARG H 1 81 HIS H 3.900 . 5.800 2.875 2.396 3.460 . 0 0 "[ . 1 . 2]" 1
1424 1 79 ARG H 1 84 VAL HB 3.100 . 6.000 6.093 6.014 6.253 0.253 13 0 "[ . 1 . 2]" 1
1425 1 79 ARG HA 1 79 ARG HB2 2.700 . 3.600 2.582 2.457 3.016 . 0 0 "[ . 1 . 2]" 1
1426 1 79 ARG HA 1 79 ARG HB3 2.400 . 3.100 2.396 2.333 2.535 . 0 0 "[ . 1 . 2]" 1
1427 1 79 ARG HA 1 79 ARG QG 2.900 . 4.000 3.268 2.406 3.395 . 0 0 "[ . 1 . 2]" 1
1428 1 79 ARG HA 1 80 ARG H 3.300 . 4.700 3.483 2.939 3.643 . 0 0 "[ . 1 . 2]" 1
1429 1 79 ARG HB2 1 79 ARG QD 2.900 . 4.000 2.681 2.322 3.154 . 0 0 "[ . 1 . 2]" 1
1430 1 79 ARG HB2 1 79 ARG QG 2.200 . 2.800 2.320 2.214 2.497 . 0 0 "[ . 1 . 2]" 1
1431 1 79 ARG HB3 1 79 ARG QD 2.800 . 3.800 2.477 2.190 3.532 . 0 0 "[ . 1 . 2]" 1
1432 1 79 ARG HB3 1 79 ARG QG 2.200 . 2.800 2.368 2.161 2.465 . 0 0 "[ . 1 . 2]" 1
1433 1 80 ARG H 1 80 ARG QB 3.600 . 5.300 2.500 2.077 3.034 . 0 0 "[ . 1 . 2]" 1
1434 1 80 ARG H 1 80 ARG HE 3.700 . 5.400 4.785 3.262 5.482 0.082 14 0 "[ . 1 . 2]" 1
1435 1 80 ARG H 1 81 HIS H 2.800 . 3.800 2.615 1.809 3.279 . 0 0 "[ . 1 . 2]" 1
1436 1 80 ARG H 1 81 HIS HD2 3.700 . 5.400 3.337 2.587 4.098 . 0 0 "[ . 1 . 2]" 1
1437 1 80 ARG HA 1 80 ARG QD 2.900 . 3.900 3.236 2.079 3.997 0.097 12 0 "[ . 1 . 2]" 1
1438 1 80 ARG HA 1 81 HIS H 2.700 . 3.600 3.222 2.817 3.487 . 0 0 "[ . 1 . 2]" 1
1439 1 80 ARG QB 1 80 ARG QD 2.100 . 2.700 2.284 2.002 2.721 0.021 20 0 "[ . 1 . 2]" 1
1440 1 80 ARG HE 2 1 FAD H9 4.100 . 6.000 5.410 3.728 6.122 0.122 5 0 "[ . 1 . 2]" 1
1441 1 81 HIS H 1 81 HIS HA 2.500 . 3.300 2.813 2.677 2.917 . 0 0 "[ . 1 . 2]" 1
1442 1 81 HIS H 1 81 HIS HB2 3.400 . 4.800 3.796 3.161 4.044 . 0 0 "[ . 1 . 2]" 1
1443 1 81 HIS H 1 81 HIS HB3 3.400 . 4.900 3.524 2.858 3.916 . 0 0 "[ . 1 . 2]" 1
1444 1 81 HIS H 1 81 HIS HD2 2.600 . 3.400 2.418 1.774 2.987 0.026 1 0 "[ . 1 . 2]" 1
1445 1 81 HIS H 1 81 HIS HE2 3.400 . 4.800 4.614 3.894 4.934 0.134 4 0 "[ . 1 . 2]" 1
1446 1 81 HIS H 1 82 SER H 3.800 . 5.600 3.999 3.468 4.379 . 0 0 "[ . 1 . 2]" 1
1447 1 81 HIS H 1 82 SER HA 3.500 . 5.000 4.393 3.842 5.023 0.023 11 0 "[ . 1 . 2]" 1
1448 1 81 HIS H 1 84 VAL QG 3.800 . 5.600 4.759 4.203 5.355 . 0 0 "[ . 1 . 2]" 1
1449 1 81 HIS HA 1 81 HIS HB2 2.800 . 3.800 2.589 2.449 2.965 . 0 0 "[ . 1 . 2]" 1
1450 1 81 HIS HA 1 81 HIS HB3 2.200 . 2.800 2.369 2.296 2.434 . 0 0 "[ . 1 . 2]" 1
1451 1 81 HIS HA 1 82 SER H 2.500 . 3.300 2.344 1.812 2.856 . 0 0 "[ . 1 . 2]" 1
1452 1 81 HIS HB2 1 82 SER H 2.700 . 3.600 2.723 1.782 3.739 0.139 9 0 "[ . 1 . 2]" 1
1453 1 81 HIS HB2 1 84 VAL H 3.200 . 4.500 3.820 2.633 4.515 0.015 11 0 "[ . 1 . 2]" 1
1454 1 81 HIS HB3 1 81 HIS HD2 3.500 . 5.000 3.870 3.725 4.004 . 0 0 "[ . 1 . 2]" 1
1455 1 81 HIS HB3 1 82 SER H 3.100 . 4.300 3.636 2.510 4.257 . 0 0 "[ . 1 . 2]" 1
1456 1 81 HIS HD2 1 84 VAL QG 2.300 . 3.000 3.005 2.934 3.089 0.089 3 0 "[ . 1 . 2]" 1
1457 1 81 HIS HE1 1 84 VAL QG 2.100 . 2.700 2.194 1.949 2.479 . 0 0 "[ . 1 . 2]" 1
1458 1 81 HIS HE2 1 84 VAL QG 3.400 . 4.900 2.233 1.877 2.996 0.023 1 0 "[ . 1 . 2]" 1
1459 1 82 SER H 1 82 SER HA 2.800 . 3.800 2.684 2.310 2.919 . 0 0 "[ . 1 . 2]" 1
1460 1 82 SER H 1 82 SER HB2 3.400 . 4.800 2.139 1.878 2.667 0.122 16 0 "[ . 1 . 2]" 1
1461 1 82 SER H 1 82 SER HB3 3.200 . 4.500 3.168 2.161 3.649 . 0 0 "[ . 1 . 2]" 1
1462 1 82 SER H 1 83 ASN H 3.600 . 5.200 3.355 2.142 4.113 . 0 0 "[ . 1 . 2]" 1
1463 1 82 SER H 1 84 VAL QG 4.300 . 6.000 5.049 4.420 5.604 . 0 0 "[ . 1 . 2]" 1
1464 1 82 SER HA 1 82 SER HB2 1.900 . 2.400 2.600 2.462 2.728 0.328 15 0 "[ . 1 . 2]" 1
1465 1 82 SER HA 1 82 SER HB3 2.400 . 3.100 2.801 2.651 2.994 . 0 0 "[ . 1 . 2]" 1
1466 1 82 SER HA 1 83 ASN H 2.400 . 3.100 2.954 1.998 3.385 0.285 12 0 "[ . 1 . 2]" 1
1467 1 82 SER HA 1 83 ASN HA 3.200 . 4.500 4.367 4.176 4.538 0.038 18 0 "[ . 1 . 2]" 1
1468 1 82 SER HA 1 84 VAL H 2.600 . 6.000 4.659 3.955 5.236 . 0 0 "[ . 1 . 2]" 1
1469 1 82 SER HB2 1 83 ASN H 3.000 . 4.100 3.733 2.924 4.185 0.085 13 0 "[ . 1 . 2]" 1
1470 1 82 SER HB2 1 84 VAL H 2.800 . 6.000 5.002 4.489 5.459 . 0 0 "[ . 1 . 2]" 1
1471 1 82 SER HB3 1 83 ASN H 2.700 . 3.600 3.193 2.199 3.792 0.192 20 0 "[ . 1 . 2]" 1
1472 1 82 SER HB3 1 83 ASN HB2 3.400 . 4.900 4.158 3.021 4.897 . 0 0 "[ . 1 . 2]" 1
1473 1 82 SER HB3 1 83 ASN HB3 4.100 . 6.000 5.294 4.214 5.857 . 0 0 "[ . 1 . 2]" 1
1474 1 82 SER HB3 1 84 VAL H 3.700 . 5.400 4.593 3.470 5.369 . 0 0 "[ . 1 . 2]" 1
1475 1 83 ASN H 1 83 ASN HA 2.200 . 2.800 2.710 2.182 2.938 0.138 19 0 "[ . 1 . 2]" 1
1476 1 83 ASN H 1 83 ASN HB2 2.900 . 3.900 3.253 2.736 3.831 . 0 0 "[ . 1 . 2]" 1
1477 1 83 ASN H 1 83 ASN HB3 3.600 . 5.200 3.942 3.226 4.190 . 0 0 "[ . 1 . 2]" 1
1478 1 83 ASN H 1 83 ASN HD21 3.600 . 5.200 4.248 3.488 5.200 0.000 3 0 "[ . 1 . 2]" 1
1479 1 83 ASN H 1 83 ASN HD22 4.900 . 6.000 4.962 4.038 6.027 0.027 20 0 "[ . 1 . 2]" 1
1480 1 83 ASN H 1 84 VAL H 2.400 . 3.100 2.213 1.654 3.124 0.046 9 0 "[ . 1 . 2]" 1
1481 1 83 ASN H 1 84 VAL HB 3.600 . 5.200 4.264 3.453 5.212 0.012 4 0 "[ . 1 . 2]" 1
1482 1 83 ASN H 1 84 VAL QG 3.200 . 4.500 3.792 3.257 4.526 0.026 4 0 "[ . 1 . 2]" 1
1483 1 83 ASN HA 1 83 ASN HB2 2.500 . 3.300 2.944 2.487 3.049 . 0 0 "[ . 1 . 2]" 1
1484 1 83 ASN HA 1 83 ASN HB3 2.400 . 3.100 2.547 2.395 3.001 . 0 0 "[ . 1 . 2]" 1
1485 1 83 ASN HA 1 83 ASN HD21 3.400 . 4.800 3.817 1.985 4.555 0.015 20 0 "[ . 1 . 2]" 1
1486 1 83 ASN HA 1 83 ASN HD22 3.700 . 5.400 4.414 3.515 4.909 . 0 0 "[ . 1 . 2]" 1
1487 1 83 ASN HA 1 84 VAL H 2.300 . 3.000 3.190 3.105 3.237 0.237 17 0 "[ . 1 . 2]" 1
1488 1 83 ASN HA 1 84 VAL HB 3.500 . 5.100 5.251 5.140 5.367 0.267 16 0 "[ . 1 . 2]" 1
1489 1 83 ASN HA 1 84 VAL QG 3.100 . 4.300 3.814 3.565 4.144 . 0 0 "[ . 1 . 2]" 1
1490 1 83 ASN HB2 1 83 ASN HD21 2.700 . 3.600 2.380 1.999 3.521 . 0 0 "[ . 1 . 2]" 1
1491 1 83 ASN HB2 1 83 ASN HD22 3.600 . 5.200 3.518 3.332 4.008 . 0 0 "[ . 1 . 2]" 1
1492 1 83 ASN HB2 1 84 VAL H 2.600 . 3.400 3.049 2.100 3.453 0.053 16 0 "[ . 1 . 2]" 1
1493 1 83 ASN HB2 1 85 GLU HG2 3.800 . 5.600 4.602 3.595 5.685 0.085 11 0 "[ . 1 . 2]" 1
1494 1 83 ASN HB3 1 83 ASN HD21 3.500 . 5.000 3.112 2.218 3.554 . 0 0 "[ . 1 . 2]" 1
1495 1 83 ASN HB3 1 83 ASN HD22 3.700 . 5.400 3.862 3.458 4.046 . 0 0 "[ . 1 . 2]" 1
1496 1 83 ASN HB3 1 84 VAL H 3.400 . 4.900 3.596 2.129 4.335 . 0 0 "[ . 1 . 2]" 1
1497 1 83 ASN HB3 1 85 GLU HG2 3.400 . 4.900 3.921 3.008 4.971 0.071 8 0 "[ . 1 . 2]" 1
1498 1 83 ASN HD21 1 84 VAL H 3.900 . 5.800 4.807 4.166 5.236 . 0 0 "[ . 1 . 2]" 1
1499 1 83 ASN HD22 1 84 VAL H 5.000 . 6.000 5.846 5.246 6.066 0.066 1 0 "[ . 1 . 2]" 1
1500 1 84 VAL H 1 84 VAL HA 2.300 . 3.000 2.205 2.109 2.304 . 0 0 "[ . 1 . 2]" 1
1501 1 84 VAL H 1 84 VAL HB 2.000 . 2.500 2.644 2.566 2.730 0.230 13 0 "[ . 1 . 2]" 1
1502 1 84 VAL H 1 84 VAL QG 2.200 . 2.800 2.831 2.755 2.912 0.112 18 0 "[ . 1 . 2]" 1
1503 1 84 VAL H 1 85 GLU H 3.100 . 4.300 3.408 3.083 3.738 . 0 0 "[ . 1 . 2]" 1
1504 1 84 VAL H 1 85 GLU HB2 3.900 . 5.800 4.335 3.708 5.303 . 0 0 "[ . 1 . 2]" 1
1505 1 84 VAL HA 1 84 VAL HB 2.900 . 3.900 2.277 2.211 2.378 . 0 0 "[ . 1 . 2]" 1
1506 1 84 VAL HA 1 84 VAL QG 2.200 . 2.800 2.294 2.217 2.402 . 0 0 "[ . 1 . 2]" 1
1507 1 84 VAL HA 1 85 GLU H 2.300 . 3.000 2.019 1.865 2.228 . 0 0 "[ . 1 . 2]" 1
1508 1 84 VAL HB 1 84 VAL QG 1.900 . 2.400 1.827 1.797 1.843 . 0 0 "[ . 1 . 2]" 1
1509 1 84 VAL HB 1 85 GLU H 4.100 . 6.000 4.238 4.042 4.502 . 0 0 "[ . 1 . 2]" 1
1510 1 84 VAL MG1 1 84 VAL MG2 1.900 . 2.300 1.983 1.934 2.045 . 0 0 "[ . 1 . 2]" 1
1511 1 84 VAL QG 1 85 GLU H 3.200 . 4.500 3.317 3.113 3.485 . 0 0 "[ . 1 . 2]" 1
1512 1 84 VAL QG 1 86 ILE H 3.200 . 4.500 3.215 2.974 3.621 . 0 0 "[ . 1 . 2]" 1
1513 1 84 VAL QG 1 86 ILE MD 2.200 . 2.800 2.064 1.922 2.385 . 0 0 "[ . 1 . 2]" 1
1514 1 84 VAL QG 1 86 ILE HG12 3.200 . 4.500 3.497 3.040 4.101 . 0 0 "[ . 1 . 2]" 1
1515 1 84 VAL QG 1 86 ILE HG13 3.600 . 5.200 4.200 3.858 4.718 . 0 0 "[ . 1 . 2]" 1
1516 1 85 GLU H 1 85 GLU HA 2.900 . 3.900 2.892 2.850 2.926 . 0 0 "[ . 1 . 2]" 1
1517 1 85 GLU H 1 85 GLU HB2 2.700 . 3.600 2.405 2.196 2.779 . 0 0 "[ . 1 . 2]" 1
1518 1 85 GLU H 1 85 GLU HB3 3.100 . 4.300 3.475 2.674 3.659 . 0 0 "[ . 1 . 2]" 1
1519 1 85 GLU H 1 85 GLU HG2 3.500 . 5.000 3.902 3.425 4.685 . 0 0 "[ . 1 . 2]" 1
1520 1 85 GLU H 1 85 GLU HG3 3.600 . 5.200 3.024 2.070 4.730 . 0 0 "[ . 1 . 2]" 1
1521 1 85 GLU H 1 86 ILE H 3.500 . 5.000 3.806 3.623 4.081 . 0 0 "[ . 1 . 2]" 1
1522 1 85 GLU H 1 86 ILE MD 2.800 . 5.500 4.442 4.240 4.656 . 0 0 "[ . 1 . 2]" 1
1523 1 85 GLU HA 1 85 GLU HB2 2.700 . 3.600 2.926 2.530 3.008 . 0 0 "[ . 1 . 2]" 1
1524 1 85 GLU HA 1 85 GLU HB3 2.800 . 3.800 2.559 2.387 2.984 . 0 0 "[ . 1 . 2]" 1
1525 1 85 GLU HA 1 85 GLU HG2 2.800 . 3.800 2.806 2.521 3.562 . 0 0 "[ . 1 . 2]" 1
1526 1 85 GLU HA 1 85 GLU HG3 2.800 . 3.800 2.819 2.253 3.530 . 0 0 "[ . 1 . 2]" 1
1527 1 85 GLU HA 1 86 ILE H 2.000 . 2.500 2.092 1.687 2.229 . 0 0 "[ . 1 . 2]" 1
1528 1 85 GLU HA 1 86 ILE HB 3.600 . 5.200 4.603 4.419 4.739 . 0 0 "[ . 1 . 2]" 1
1529 1 85 GLU HA 1 86 ILE MD 3.400 . 4.900 3.867 3.511 4.283 . 0 0 "[ . 1 . 2]" 1
1530 1 85 GLU HA 1 86 ILE HG12 3.500 . 5.000 3.494 3.072 3.733 . 0 0 "[ . 1 . 2]" 1
1531 1 85 GLU HA 1 86 ILE MG 3.800 . 5.600 5.370 5.126 5.494 . 0 0 "[ . 1 . 2]" 1
1532 1 85 GLU HB2 1 86 ILE H 3.100 . 4.300 4.331 4.212 4.377 0.077 1 0 "[ . 1 . 2]" 1
1533 1 85 GLU HB2 1 87 LEU HG 2.900 . 4.000 3.335 2.665 4.119 0.119 11 0 "[ . 1 . 2]" 1
1534 1 85 GLU HB3 1 85 GLU HG2 2.400 . 3.100 2.414 2.203 3.030 . 0 0 "[ . 1 . 2]" 1
1535 1 85 GLU HB3 1 85 GLU HG3 2.300 . 3.000 2.740 2.160 2.962 . 0 0 "[ . 1 . 2]" 1
1536 1 85 GLU HG2 1 86 ILE H 3.400 . 4.900 4.814 4.165 5.154 0.254 8 0 "[ . 1 . 2]" 1
1537 1 85 GLU HG3 1 86 ILE H 3.300 . 4.700 4.592 3.748 4.983 0.283 16 0 "[ . 1 . 2]" 1
1538 1 85 GLU HG3 1 87 LEU HG 3.200 . 4.400 4.175 1.943 4.637 0.237 12 0 "[ . 1 . 2]" 1
1539 1 86 ILE H 1 86 ILE HA 2.700 . 3.600 2.786 2.732 2.872 . 0 0 "[ . 1 . 2]" 1
1540 1 86 ILE H 1 86 ILE HB 2.300 . 2.900 2.968 2.933 3.007 0.107 14 0 "[ . 1 . 2]" 1
1541 1 86 ILE H 1 86 ILE MD 2.700 . 3.600 2.225 2.065 2.465 . 0 0 "[ . 1 . 2]" 1
1542 1 86 ILE H 1 86 ILE HG12 2.500 . 3.300 1.806 1.766 1.857 . 0 0 "[ . 1 . 2]" 1
1543 1 86 ILE H 1 86 ILE HG13 2.700 . 3.600 3.388 3.328 3.453 . 0 0 "[ . 1 . 2]" 1
1544 1 86 ILE H 1 86 ILE MG 3.100 . 4.300 3.715 3.666 3.776 . 0 0 "[ . 1 . 2]" 1
1545 1 86 ILE H 1 87 LEU HA 3.700 . 5.400 5.139 5.001 5.315 . 0 0 "[ . 1 . 2]" 1
1546 1 86 ILE HA 1 86 ILE HB 2.800 . 3.800 2.986 2.956 3.013 . 0 0 "[ . 1 . 2]" 1
1547 1 86 ILE HA 1 86 ILE MD 2.800 . 3.800 2.346 2.196 2.441 . 0 0 "[ . 1 . 2]" 1
1548 1 86 ILE HA 1 86 ILE HG12 3.000 . 4.100 3.463 3.370 3.532 . 0 0 "[ . 1 . 2]" 1
1549 1 86 ILE HA 1 86 ILE HG13 3.200 . 4.500 3.916 3.832 3.962 . 0 0 "[ . 1 . 2]" 1
1550 1 86 ILE HA 1 86 ILE MG 2.200 . 2.800 2.296 2.262 2.334 . 0 0 "[ . 1 . 2]" 1
1551 1 86 ILE HA 1 87 LEU H 2.600 . 3.500 3.359 3.311 3.429 . 0 0 "[ . 1 . 2]" 1
1552 1 86 ILE HA 1 88 ALA H 3.300 . 4.600 3.458 3.318 3.740 . 0 0 "[ . 1 . 2]" 1
1553 1 86 ILE HB 1 86 ILE MD 2.400 . 3.100 3.187 3.177 3.193 0.093 14 0 "[ . 1 . 2]" 1
1554 1 86 ILE HB 1 86 ILE HG12 2.500 . 3.300 2.399 2.382 2.426 . 0 0 "[ . 1 . 2]" 1
1555 1 86 ILE HB 1 86 ILE HG13 2.700 . 3.600 2.475 2.445 2.516 . 0 0 "[ . 1 . 2]" 1
1556 1 86 ILE HB 1 86 ILE MG 1.900 . 2.400 2.172 2.144 2.207 . 0 0 "[ . 1 . 2]" 1
1557 1 86 ILE HB 1 87 LEU HA 2.900 . 3.900 3.770 3.564 3.959 0.059 16 0 "[ . 1 . 2]" 1
1558 1 86 ILE HB 1 88 ALA H 3.100 . 4.300 3.506 3.301 3.627 . 0 0 "[ . 1 . 2]" 1
1559 1 86 ILE HB 1 88 ALA MB 3.700 . 5.400 5.417 5.311 5.470 0.070 16 0 "[ . 1 . 2]" 1
1560 1 86 ILE MD 1 86 ILE HG12 2.000 . 2.500 2.104 2.090 2.111 . 0 0 "[ . 1 . 2]" 1
1561 1 86 ILE MD 1 86 ILE HG13 2.100 . 2.700 2.102 2.095 2.108 . 0 0 "[ . 1 . 2]" 1
1562 1 86 ILE MD 1 86 ILE MG 1.900 . 2.800 1.902 1.836 1.990 . 0 0 "[ . 1 . 2]" 1
1563 1 86 ILE MD 1 87 LEU H 2.800 . 6.000 4.124 4.029 4.198 . 0 0 "[ . 1 . 2]" 1
1564 1 86 ILE MD 1 88 ALA H 3.000 . 6.000 4.981 4.840 5.165 . 0 0 "[ . 1 . 2]" 1
1565 1 86 ILE HG12 1 86 ILE MG 2.400 . 3.100 3.157 3.145 3.172 0.072 5 0 "[ . 1 . 2]" 1
1566 1 86 ILE HG12 1 87 LEU HA 2.400 . 6.000 5.546 5.374 5.733 . 0 0 "[ . 1 . 2]" 1
1567 1 86 ILE HG13 1 86 ILE MG 2.400 . 3.100 2.229 2.201 2.265 . 0 0 "[ . 1 . 2]" 1
1568 1 86 ILE HG13 1 88 ALA H 2.900 . 6.000 5.659 5.424 5.830 . 0 0 "[ . 1 . 2]" 1
1569 1 86 ILE MG 1 87 LEU H 3.100 . 4.300 3.221 3.121 3.480 . 0 0 "[ . 1 . 2]" 1
1570 1 86 ILE MG 1 88 ALA H 2.300 . 3.000 2.640 2.408 2.871 . 0 0 "[ . 1 . 2]" 1
1571 1 86 ILE MG 1 89 GLU H 3.400 . 4.800 4.393 4.109 4.584 . 0 0 "[ . 1 . 2]" 1
1572 1 86 ILE MG 1 89 GLU HB2 2.500 . 3.300 2.305 2.234 2.416 . 0 0 "[ . 1 . 2]" 1
1573 1 86 ILE MG 1 89 GLU HB3 3.000 . 4.100 4.169 4.131 4.220 0.120 5 0 "[ . 1 . 2]" 1
1574 1 86 ILE MG 1 89 GLU HG2 2.500 . 3.300 2.313 2.240 2.430 . 0 0 "[ . 1 . 2]" 1
1575 1 86 ILE MG 1 89 GLU HG3 2.200 . 2.800 2.460 2.236 2.709 . 0 0 "[ . 1 . 2]" 1
1576 1 87 LEU H 1 88 ALA H 2.300 . 3.000 3.079 3.031 3.158 0.158 14 0 "[ . 1 . 2]" 1
1577 1 87 LEU HA 1 87 LEU QB 2.600 . 3.400 2.378 2.360 2.406 . 0 0 "[ . 1 . 2]" 1
1578 1 87 LEU HA 1 87 LEU MD1 3.000 . 4.100 3.850 3.805 3.902 . 0 0 "[ . 1 . 2]" 1
1579 1 87 LEU HA 1 87 LEU HG 2.400 . 3.100 3.131 3.046 3.183 0.083 12 0 "[ . 1 . 2]" 1
1580 1 87 LEU HA 1 88 ALA H 3.000 . 4.100 3.420 3.329 3.480 . 0 0 "[ . 1 . 2]" 1
1581 1 87 LEU QB 1 88 ALA H 2.900 . 3.900 3.056 2.697 3.368 . 0 0 "[ . 1 . 2]" 1
1582 1 87 LEU MD1 1 87 LEU MD2 2.300 . 3.000 2.072 2.053 2.086 . 0 0 "[ . 1 . 2]" 1
1583 1 87 LEU MD1 1 87 LEU HG 2.000 . 2.500 2.118 2.107 2.137 . 0 0 "[ . 1 . 2]" 1
1584 1 87 LEU MD2 1 87 LEU HG 2.400 . 3.100 2.132 2.126 2.139 . 0 0 "[ . 1 . 2]" 1
1585 1 88 ALA H 1 88 ALA HA 2.500 . 3.300 2.941 2.919 2.961 . 0 0 "[ . 1 . 2]" 1
1586 1 88 ALA H 1 88 ALA MB 2.500 . 3.300 2.507 2.424 2.610 . 0 0 "[ . 1 . 2]" 1
1587 1 88 ALA H 1 89 GLU H 3.700 . 5.400 4.088 3.982 4.220 . 0 0 "[ . 1 . 2]" 1
1588 1 88 ALA H 1 89 GLU HB2 4.000 . 6.000 4.486 4.273 4.676 . 0 0 "[ . 1 . 2]" 1
1589 1 88 ALA HA 1 88 ALA MB 2.000 . 2.500 2.124 2.112 2.135 . 0 0 "[ . 1 . 2]" 1
1590 1 88 ALA HA 1 89 GLU H 1.800 . 2.200 2.119 2.096 2.148 . 0 0 "[ . 1 . 2]" 1
1591 1 88 ALA MB 1 89 GLU H 2.600 . 3.400 3.256 3.009 3.326 . 0 0 "[ . 1 . 2]" 1
1592 1 88 ALA MB 1 89 GLU HB3 3.900 . 5.800 5.715 5.627 5.801 0.001 3 0 "[ . 1 . 2]" 1
1593 1 88 ALA MB 1 90 GLU H 3.200 . 4.500 4.499 4.328 4.558 0.058 7 0 "[ . 1 . 2]" 1
1594 1 88 ALA MB 1 90 GLU QG 2.300 . 3.800 3.769 3.341 3.877 0.077 6 0 "[ . 1 . 2]" 1
1595 1 89 GLU H 1 89 GLU HA 2.500 . 3.300 2.920 2.901 2.935 . 0 0 "[ . 1 . 2]" 1
1596 1 89 GLU H 1 89 GLU HB3 2.900 . 4.000 3.810 3.738 3.890 . 0 0 "[ . 1 . 2]" 1
1597 1 89 GLU H 1 89 GLU HG2 3.300 . 4.700 4.037 3.888 4.146 . 0 0 "[ . 1 . 2]" 1
1598 1 89 GLU H 1 89 GLU HG3 2.900 . 4.000 2.965 2.769 3.148 . 0 0 "[ . 1 . 2]" 1
1599 1 89 GLU H 1 90 GLU H 3.200 . 4.500 3.992 3.916 4.097 . 0 0 "[ . 1 . 2]" 1
1600 1 89 GLU H 1 90 GLU HA 3.400 . 4.800 4.535 4.427 4.618 . 0 0 "[ . 1 . 2]" 1
1601 1 89 GLU HA 1 89 GLU HB3 2.000 . 2.500 2.397 2.366 2.434 . 0 0 "[ . 1 . 2]" 1
1602 1 89 GLU HA 1 89 GLU HG2 2.400 . 3.100 2.631 2.515 2.812 . 0 0 "[ . 1 . 2]" 1
1603 1 89 GLU HA 1 89 GLU HG3 2.500 . 3.300 3.105 3.004 3.222 . 0 0 "[ . 1 . 2]" 1
1604 1 89 GLU HA 1 90 GLU H 2.100 . 2.600 2.119 2.060 2.206 . 0 0 "[ . 1 . 2]" 1
1605 1 89 GLU HB3 1 89 GLU HG2 1.800 . 2.200 2.262 2.237 2.279 0.079 1 0 "[ . 1 . 2]" 1
1606 1 89 GLU HB3 1 89 GLU HG3 2.300 . 2.900 2.950 2.946 2.959 0.059 9 0 "[ . 1 . 2]" 1
1607 1 90 GLU H 1 90 GLU HA 2.700 . 3.600 2.931 2.915 2.944 . 0 0 "[ . 1 . 2]" 1
1608 1 90 GLU H 1 90 GLU HB2 3.000 . 4.100 3.736 3.698 3.795 . 0 0 "[ . 1 . 2]" 1
1609 1 90 GLU H 1 90 GLU HB3 2.700 . 3.600 3.254 3.142 3.406 . 0 0 "[ . 1 . 2]" 1
1610 1 90 GLU H 1 90 GLU QG 2.700 . 3.600 2.124 1.958 2.242 . 0 0 "[ . 1 . 2]" 1
1611 1 90 GLU H 1 92 ILE MG 4.000 . 6.000 4.295 4.064 4.570 . 0 0 "[ . 1 . 2]" 1
1612 1 90 GLU HA 1 90 GLU HB2 2.100 . 2.600 2.526 2.494 2.602 0.002 1 0 "[ . 1 . 2]" 1
1613 1 90 GLU HA 1 90 GLU HB3 2.300 . 3.000 2.367 2.325 2.402 . 0 0 "[ . 1 . 2]" 1
1614 1 90 GLU HA 1 90 GLU QG 2.800 . 3.800 3.337 3.303 3.360 . 0 0 "[ . 1 . 2]" 1
1615 1 90 GLU HA 1 91 SER H 2.000 . 2.500 2.209 2.128 2.268 . 0 0 "[ . 1 . 2]" 1
1616 1 90 GLU HA 1 91 SER QB 3.500 . 5.000 4.357 4.026 4.543 . 0 0 "[ . 1 . 2]" 1
1617 1 90 GLU HB2 1 90 GLU QG 2.100 . 2.700 2.335 2.259 2.389 . 0 0 "[ . 1 . 2]" 1
1618 1 90 GLU HB2 1 91 SER H 2.600 . 3.400 2.977 2.732 3.341 . 0 0 "[ . 1 . 2]" 1
1619 1 90 GLU HB2 1 92 ILE MG 2.700 . 3.600 3.462 3.163 3.639 0.039 20 0 "[ . 1 . 2]" 1
1620 1 90 GLU HB3 1 90 GLU QG 2.400 . 3.100 2.345 2.290 2.421 . 0 0 "[ . 1 . 2]" 1
1621 1 90 GLU HB3 1 91 SER H 3.100 . 4.300 3.935 3.785 4.090 . 0 0 "[ . 1 . 2]" 1
1622 1 90 GLU HB3 1 92 ILE MG 3.500 . 5.000 4.593 4.328 4.885 . 0 0 "[ . 1 . 2]" 1
1623 1 90 GLU QG 1 91 SER H 3.100 . 4.300 4.148 3.976 4.330 0.030 8 0 "[ . 1 . 2]" 1
1624 1 90 GLU QG 1 92 ILE MG 2.600 . 3.400 2.349 2.145 2.797 . 0 0 "[ . 1 . 2]" 1
1625 1 91 SER H 1 91 SER QB 2.400 . 3.100 2.449 2.248 2.736 . 0 0 "[ . 1 . 2]" 1
1626 1 91 SER H 1 92 ILE H 3.800 . 5.600 4.430 4.352 4.495 . 0 0 "[ . 1 . 2]" 1
1627 1 91 SER H 1 92 ILE MG 3.700 . 5.400 4.306 4.154 4.425 . 0 0 "[ . 1 . 2]" 1
1628 1 91 SER HA 1 91 SER QB 1.900 . 2.300 2.300 2.180 2.346 0.046 13 0 "[ . 1 . 2]" 1
1629 1 91 SER HA 1 92 ILE H 1.900 . 2.300 2.093 2.046 2.138 . 0 0 "[ . 1 . 2]" 1
1630 1 91 SER HA 1 92 ILE HG13 4.000 . 6.000 4.590 4.469 4.954 . 0 0 "[ . 1 . 2]" 1
1631 1 91 SER QB 1 92 ILE H 2.900 . 3.900 3.329 3.065 3.748 . 0 0 "[ . 1 . 2]" 1
1632 1 92 ILE H 1 92 ILE HA 2.500 . 3.300 2.964 2.940 2.985 . 0 0 "[ . 1 . 2]" 1
1633 1 92 ILE H 1 92 ILE HB 3.100 . 4.300 3.761 3.713 3.813 . 0 0 "[ . 1 . 2]" 1
1634 1 92 ILE H 1 92 ILE MD 3.200 . 4.500 3.869 3.811 3.970 . 0 0 "[ . 1 . 2]" 1
1635 1 92 ILE H 1 92 ILE HG12 2.400 . 3.100 2.438 2.263 2.561 . 0 0 "[ . 1 . 2]" 1
1636 1 92 ILE H 1 92 ILE HG13 2.300 . 2.900 2.618 2.508 2.914 0.014 6 0 "[ . 1 . 2]" 1
1637 1 92 ILE H 1 92 ILE MG 2.600 . 3.500 2.933 2.736 3.105 . 0 0 "[ . 1 . 2]" 1
1638 1 92 ILE H 1 93 ALA H 4.200 . 6.000 4.491 4.449 4.538 . 0 0 "[ . 1 . 2]" 1
1639 1 92 ILE H 1 93 ALA MB 4.200 . 6.000 5.548 5.462 5.622 . 0 0 "[ . 1 . 2]" 1
1640 1 92 ILE H 1 94 LYS H 4.100 . 6.000 4.674 4.551 4.975 . 0 0 "[ . 1 . 2]" 1
1641 1 92 ILE HA 1 92 ILE HB 1.700 . 2.200 2.347 2.320 2.364 0.164 8 0 "[ . 1 . 2]" 1
1642 1 92 ILE HA 1 92 ILE MD 3.000 . 4.100 4.080 4.018 4.111 0.011 4 0 "[ . 1 . 2]" 1
1643 1 92 ILE HA 1 92 ILE HG12 2.800 . 3.800 3.759 3.726 3.804 0.004 20 0 "[ . 1 . 2]" 1
1644 1 92 ILE HA 1 92 ILE HG13 2.800 . 3.800 3.578 3.526 3.632 . 0 0 "[ . 1 . 2]" 1
1645 1 92 ILE HA 1 92 ILE MG 1.800 . 2.200 2.224 2.196 2.246 0.046 6 0 "[ . 1 . 2]" 1
1646 1 92 ILE HA 1 93 ALA H 2.500 . 3.300 2.375 2.278 2.490 . 0 0 "[ . 1 . 2]" 1
1647 1 92 ILE HA 1 93 ALA MB 2.900 . 3.900 3.949 3.920 3.982 0.082 12 0 "[ . 1 . 2]" 1
1648 1 92 ILE HA 1 94 LYS H 2.900 . 4.000 3.661 3.496 3.927 . 0 0 "[ . 1 . 2]" 1
1649 1 92 ILE HB 1 92 ILE MD 2.200 . 2.800 2.369 2.250 2.419 . 0 0 "[ . 1 . 2]" 1
1650 1 92 ILE HB 1 92 ILE HG12 2.500 . 3.300 2.999 2.983 3.013 . 0 0 "[ . 1 . 2]" 1
1651 1 92 ILE HB 1 92 ILE HG13 2.600 . 3.500 2.577 2.527 2.637 . 0 0 "[ . 1 . 2]" 1
1652 1 92 ILE HB 1 92 ILE MG 2.200 . 2.800 2.140 2.126 2.151 . 0 0 "[ . 1 . 2]" 1
1653 1 92 ILE HB 1 93 ALA H 2.700 . 3.600 1.954 1.796 2.100 0.004 20 0 "[ . 1 . 2]" 1
1654 1 92 ILE HB 1 94 LYS H 2.200 . 2.800 1.953 1.821 2.296 . 0 0 "[ . 1 . 2]" 1
1655 1 92 ILE MD 1 92 ILE HG12 2.100 . 2.600 2.069 2.052 2.094 . 0 0 "[ . 1 . 2]" 1
1656 1 92 ILE MD 1 92 ILE HG13 2.200 . 2.800 2.053 2.007 2.079 . 0 0 "[ . 1 . 2]" 1
1657 1 92 ILE MD 1 92 ILE MG 2.200 . 2.800 2.154 2.052 2.257 . 0 0 "[ . 1 . 2]" 1
1658 1 92 ILE MD 1 94 LYS H 2.600 . 3.500 2.326 1.961 2.552 . 0 0 "[ . 1 . 2]" 1
1659 1 92 ILE MD 1 94 LYS HA 2.500 . 3.300 1.814 1.753 2.060 . 0 0 "[ . 1 . 2]" 1
1660 1 92 ILE MD 1 94 LYS HB2 3.000 . 4.100 2.198 1.994 2.694 . 0 0 "[ . 1 . 2]" 1
1661 1 92 ILE MD 1 94 LYS HB3 3.600 . 5.200 3.488 3.341 3.829 . 0 0 "[ . 1 . 2]" 1
1662 1 92 ILE MD 1 95 ARG H 2.800 . 3.800 3.828 3.279 3.896 0.096 20 0 "[ . 1 . 2]" 1
1663 1 92 ILE HG12 1 92 ILE MG 2.300 . 3.000 2.278 2.233 2.317 . 0 0 "[ . 1 . 2]" 1
1664 1 92 ILE HG13 1 92 ILE MG 3.000 . 4.100 3.188 3.159 3.206 . 0 0 "[ . 1 . 2]" 1
1665 1 92 ILE HG13 1 94 LYS H 2.700 . 3.600 2.736 2.370 3.059 . 0 0 "[ . 1 . 2]" 1
1666 1 92 ILE HG13 1 94 LYS HG3 3.200 . 4.500 4.079 3.702 4.353 . 0 0 "[ . 1 . 2]" 1
1667 1 92 ILE MG 1 93 ALA H 4.200 . 6.000 3.328 3.151 3.496 . 0 0 "[ . 1 . 2]" 1
1668 1 92 ILE MG 1 93 ALA MB 3.400 . 4.800 4.695 4.497 4.833 0.033 6 0 "[ . 1 . 2]" 1
1669 1 92 ILE MG 1 94 LYS H 2.300 . 6.000 3.694 3.601 3.919 . 0 0 "[ . 1 . 2]" 1
1670 1 92 ILE MG 1 96 ARG HG3 2.700 . 6.000 5.030 4.238 6.014 0.014 1 0 "[ . 1 . 2]" 1
1671 1 93 ALA H 1 93 ALA HA 2.900 . 3.900 2.909 2.878 2.921 . 0 0 "[ . 1 . 2]" 1
1672 1 93 ALA H 1 93 ALA MB 2.400 . 3.100 2.308 2.264 2.356 . 0 0 "[ . 1 . 2]" 1
1673 1 93 ALA H 1 94 LYS H 2.300 . 3.000 1.959 1.870 2.099 . 0 0 "[ . 1 . 2]" 1
1674 1 93 ALA HA 1 93 ALA MB 1.900 . 2.300 2.114 2.101 2.131 . 0 0 "[ . 1 . 2]" 1
1675 1 93 ALA HA 1 94 LYS H 2.100 . 2.700 2.976 2.898 3.067 0.367 1 0 "[ . 1 . 2]" 1
1676 1 93 ALA MB 1 94 LYS H 2.300 . 3.000 3.006 2.677 3.102 0.102 13 0 "[ . 1 . 2]" 1
1677 1 93 ALA MB 1 94 LYS HB2 2.200 . 6.000 4.619 4.475 4.716 . 0 0 "[ . 1 . 2]" 1
1678 1 93 ALA MB 1 94 LYS HB3 2.200 . 6.000 4.426 4.301 4.690 . 0 0 "[ . 1 . 2]" 1
1679 1 93 ALA MB 1 94 LYS HB3 2.500 . 6.000 4.271 4.112 4.508 . 0 0 "[ . 1 . 2]" 1
1680 1 93 ALA MB 1 94 LYS QE 2.000 . 6.000 6.169 6.076 6.331 0.331 3 0 "[ . 1 . 2]" 1
1681 1 93 ALA MB 1 95 ARG QB 3.000 . 4.100 4.173 3.917 4.238 0.138 10 0 "[ . 1 . 2]" 1
1682 1 94 LYS H 1 94 LYS HA 2.400 . 3.100 2.274 2.225 2.305 . 0 0 "[ . 1 . 2]" 1
1683 1 94 LYS H 1 94 LYS HB2 2.300 . 3.000 2.642 2.583 2.757 . 0 0 "[ . 1 . 2]" 1
1684 1 94 LYS H 1 94 LYS HB3 2.500 . 3.300 3.398 3.324 3.465 0.165 1 0 "[ . 1 . 2]" 1
1685 1 94 LYS H 1 94 LYS QE 4.200 . 6.000 5.192 4.915 5.602 . 0 0 "[ . 1 . 2]" 1
1686 1 94 LYS H 1 94 LYS HG2 2.900 . 4.000 4.211 4.130 4.279 0.279 4 0 "[ . 1 . 2]" 1
1687 1 94 LYS H 1 94 LYS HG3 3.100 . 4.300 4.275 4.052 4.432 0.132 3 0 "[ . 1 . 2]" 1
1688 1 94 LYS H 1 95 ARG H 3.200 . 4.500 4.450 3.717 4.515 0.015 10 0 "[ . 1 . 2]" 1
1689 1 94 LYS HA 1 94 LYS HB2 2.100 . 2.700 2.461 2.416 2.564 . 0 0 "[ . 1 . 2]" 1
1690 1 94 LYS HA 1 94 LYS HB3 2.100 . 2.700 2.913 2.729 2.938 0.238 19 0 "[ . 1 . 2]" 1
1691 1 94 LYS HA 1 94 LYS QD 3.200 . 4.500 3.710 3.508 3.895 . 0 0 "[ . 1 . 2]" 1
1692 1 94 LYS HA 1 94 LYS QE 3.500 . 5.000 4.297 3.939 4.433 . 0 0 "[ . 1 . 2]" 1
1693 1 94 LYS HA 1 94 LYS HG2 2.400 . 3.100 2.228 2.158 2.294 . 0 0 "[ . 1 . 2]" 1
1694 1 94 LYS HA 1 94 LYS HG3 2.700 . 3.600 3.038 2.772 3.220 . 0 0 "[ . 1 . 2]" 1
1695 1 94 LYS HA 1 95 ARG H 2.100 . 2.600 2.557 1.702 2.685 0.085 4 0 "[ . 1 . 2]" 1
1696 1 94 LYS HB2 1 94 LYS QD 2.400 . 3.100 3.075 2.875 3.162 0.062 9 0 "[ . 1 . 2]" 1
1697 1 94 LYS HB2 1 94 LYS QE 2.900 . 3.900 2.900 2.521 3.965 0.065 3 0 "[ . 1 . 2]" 1
1698 1 94 LYS HB2 1 94 LYS HG2 2.300 . 2.900 2.734 2.623 2.836 . 0 0 "[ . 1 . 2]" 1
1699 1 94 LYS HB2 1 94 LYS HG3 2.100 . 2.700 1.976 1.922 2.047 . 0 0 "[ . 1 . 2]" 1
1700 1 94 LYS HB2 1 95 ARG H 3.200 . 4.500 3.606 3.481 3.907 . 0 0 "[ . 1 . 2]" 1
1701 1 94 LYS HB3 1 94 LYS QE 2.900 . 3.900 2.789 2.461 3.554 . 0 0 "[ . 1 . 2]" 1
1702 1 94 LYS HB3 1 94 LYS HG2 2.300 . 3.000 2.837 2.756 2.898 . 0 0 "[ . 1 . 2]" 1
1703 1 94 LYS HB3 1 94 LYS HG3 2.000 . 2.500 2.671 2.616 2.732 0.232 4 0 "[ . 1 . 2]" 1
1704 1 94 LYS HB3 1 95 ARG H 2.300 . 3.000 2.831 2.518 3.340 0.340 9 0 "[ . 1 . 2]" 1
1705 1 94 LYS QD 1 94 LYS QE 1.800 . 2.200 1.975 1.950 1.994 . 0 0 "[ . 1 . 2]" 1
1706 1 94 LYS QD 1 94 LYS HG2 1.900 . 2.300 2.215 2.160 2.410 0.110 3 0 "[ . 1 . 2]" 1
1707 1 94 LYS QD 1 94 LYS HG3 1.900 . 2.400 2.450 2.239 2.480 0.080 19 0 "[ . 1 . 2]" 1
1708 1 94 LYS QD 1 95 ARG H 3.200 . 4.500 2.337 1.943 3.339 . 0 0 "[ . 1 . 2]" 1
1709 1 94 LYS QE 1 94 LYS HG2 2.100 . 2.600 2.835 2.136 2.937 0.337 17 0 "[ . 1 . 2]" 1
1710 1 94 LYS QE 1 94 LYS HG3 2.000 . 2.500 1.903 1.813 2.522 0.022 3 0 "[ . 1 . 2]" 1
1711 1 94 LYS HG2 1 95 ARG H 2.400 . 3.100 1.873 1.685 2.390 0.015 3 0 "[ . 1 . 2]" 1
1712 1 94 LYS HG2 1 96 ARG QD 3.300 . 6.000 4.692 3.538 5.269 . 0 0 "[ . 1 . 2]" 1
1713 1 94 LYS HG3 1 95 ARG H 3.400 . 4.800 3.316 3.158 3.932 . 0 0 "[ . 1 . 2]" 1
1714 1 95 ARG H 1 95 ARG HA 2.700 . 3.600 2.308 2.214 2.758 . 0 0 "[ . 1 . 2]" 1
1715 1 95 ARG H 1 95 ARG QB 3.700 . 5.400 3.225 3.066 3.442 . 0 0 "[ . 1 . 2]" 1
1716 1 95 ARG H 1 96 ARG H 3.800 . 5.600 2.256 1.849 2.676 0.151 9 0 "[ . 1 . 2]" 1
1717 1 95 ARG HA 1 96 ARG H 3.000 . 4.100 2.850 2.223 3.266 . 0 0 "[ . 1 . 2]" 1
1718 1 95 ARG HA 1 96 ARG HG3 3.300 . 4.600 4.687 4.511 4.770 0.170 1 0 "[ . 1 . 2]" 1
1719 1 95 ARG HA 1 97 PHE H 3.100 . 4.300 4.275 3.656 4.396 0.096 5 0 "[ . 1 . 2]" 1
1720 1 96 ARG H 1 96 ARG HB2 3.400 . 4.800 2.471 2.371 2.829 . 0 0 "[ . 1 . 2]" 1
1721 1 96 ARG H 1 96 ARG HB3 3.900 . 5.800 3.599 3.498 3.867 . 0 0 "[ . 1 . 2]" 1
1722 1 96 ARG H 1 96 ARG HG2 3.900 . 5.800 3.606 3.124 4.191 . 0 0 "[ . 1 . 2]" 1
1723 1 96 ARG H 1 97 PHE H 3.500 . 5.000 2.476 2.174 3.139 . 0 0 "[ . 1 . 2]" 1
1724 1 96 ARG H 1 97 PHE QD 4.100 . 6.000 4.445 4.153 4.814 . 0 0 "[ . 1 . 2]" 1
1725 1 96 ARG HA 1 96 ARG HB2 2.900 . 4.000 3.009 2.990 3.038 . 0 0 "[ . 1 . 2]" 1
1726 1 96 ARG HA 1 96 ARG HB3 2.500 . 3.300 2.438 2.406 2.465 . 0 0 "[ . 1 . 2]" 1
1727 1 96 ARG HA 1 96 ARG HG2 2.900 . 3.900 2.606 2.456 2.730 . 0 0 "[ . 1 . 2]" 1
1728 1 96 ARG HA 1 96 ARG HG3 3.200 . 4.400 2.980 2.801 3.265 . 0 0 "[ . 1 . 2]" 1
1729 1 96 ARG HA 1 97 PHE H 3.500 . 5.100 3.604 3.555 3.634 . 0 0 "[ . 1 . 2]" 1
1730 1 96 ARG HB2 1 96 ARG HG2 2.900 . 4.000 3.003 2.993 3.017 . 0 0 "[ . 1 . 2]" 1
1731 1 96 ARG HB2 1 96 ARG HG3 2.800 . 3.800 2.460 2.384 2.591 . 0 0 "[ . 1 . 2]" 1
1732 1 96 ARG HB2 1 97 PHE H 3.600 . 5.300 2.356 2.000 2.657 . 0 0 "[ . 1 . 2]" 1
1733 1 96 ARG HB3 1 96 ARG HG2 2.300 . 3.000 2.394 2.327 2.452 . 0 0 "[ . 1 . 2]" 1
1734 1 96 ARG HB3 1 96 ARG HG3 2.900 . 4.000 2.985 2.970 3.016 . 0 0 "[ . 1 . 2]" 1
1735 1 96 ARG HB3 1 97 PHE H 3.500 . 5.000 3.499 3.224 3.699 . 0 0 "[ . 1 . 2]" 1
1736 1 97 PHE H 1 97 PHE HB2 3.700 . 5.400 2.532 2.389 2.658 . 0 0 "[ . 1 . 2]" 1
1737 1 97 PHE H 1 97 PHE HB3 4.100 . 6.000 3.704 3.595 3.771 . 0 0 "[ . 1 . 2]" 1
1738 1 97 PHE H 1 97 PHE QD 3.200 . 4.500 2.808 2.606 2.969 . 0 0 "[ . 1 . 2]" 1
1739 1 97 PHE H 1 98 ALA H 3.700 . 5.500 2.609 1.877 4.452 0.023 9 0 "[ . 1 . 2]" 1
1740 1 97 PHE HA 1 97 PHE QD 2.800 . 3.800 3.049 2.984 3.164 . 0 0 "[ . 1 . 2]" 1
1741 1 97 PHE HA 1 98 ALA H 2.300 . 3.000 2.906 2.191 3.200 0.200 19 0 "[ . 1 . 2]" 1
1742 1 97 PHE HA 1 98 ALA MB 3.300 . 4.600 3.948 3.800 4.202 . 0 0 "[ . 1 . 2]" 1
1743 1 97 PHE HB2 1 97 PHE QD 2.400 . 3.100 2.546 2.430 2.598 . 0 0 "[ . 1 . 2]" 1
1744 1 97 PHE HB2 1 98 ALA H 3.200 . 4.400 3.559 3.155 4.404 0.004 7 0 "[ . 1 . 2]" 1
1745 1 97 PHE HB2 1 99 GLY H 3.300 . 4.700 3.852 3.578 4.716 0.016 14 0 "[ . 1 . 2]" 1
1746 1 97 PHE HB3 1 97 PHE QD 2.500 . 3.300 2.285 2.259 2.336 . 0 0 "[ . 1 . 2]" 1
1747 1 97 PHE HB3 1 98 ALA H 3.800 . 5.600 3.637 2.401 4.290 . 0 0 "[ . 1 . 2]" 1
1748 1 97 PHE HB3 1 99 GLY H 3.600 . 5.200 2.988 2.302 3.806 . 0 0 "[ . 1 . 2]" 1
1749 1 97 PHE QD 1 98 ALA H 3.600 . 5.200 4.348 3.616 4.856 . 0 0 "[ . 1 . 2]" 1
1750 1 97 PHE QD 1 99 GLY H 3.900 . 5.800 4.620 3.490 5.025 . 0 0 "[ . 1 . 2]" 1
1751 1 98 ALA H 1 98 ALA MB 2.500 . 3.300 2.740 2.185 2.940 . 0 0 "[ . 1 . 2]" 1
1752 1 98 ALA H 1 99 GLY H 3.000 . 4.100 2.848 1.879 3.193 0.021 6 0 "[ . 1 . 2]" 1
1753 1 98 ALA HA 1 98 ALA MB 2.200 . 2.800 2.127 2.107 2.145 . 0 0 "[ . 1 . 2]" 1
1754 1 98 ALA HA 1 99 GLY H 2.500 . 3.300 3.321 3.265 3.364 0.064 5 0 "[ . 1 . 2]" 1
1755 1 98 ALA MB 1 99 GLY H 2.800 . 3.800 3.098 2.962 3.250 . 0 0 "[ . 1 . 2]" 1
1756 1 99 GLY H 1 99 GLY HA2 2.700 . 3.600 2.630 2.510 2.670 . 0 0 "[ . 1 . 2]" 1
1757 1 99 GLY H 1 99 GLY HA3 2.900 . 4.000 2.899 2.863 2.922 . 0 0 "[ . 1 . 2]" 1
1758 1 99 GLY H 1 100 TRP H 3.500 . 5.100 4.300 3.932 4.405 . 0 0 "[ . 1 . 2]" 1
1759 1 99 GLY HA2 1 100 TRP H 2.800 . 3.800 2.902 2.732 3.249 . 0 0 "[ . 1 . 2]" 1
1760 1 99 GLY HA3 1 100 TRP H 2.400 . 3.100 2.417 2.089 2.575 . 0 0 "[ . 1 . 2]" 1
1761 1 100 TRP H 1 100 TRP HA 3.000 . 4.100 2.876 2.787 2.908 . 0 0 "[ . 1 . 2]" 1
1762 1 100 TRP H 1 100 TRP HB2 3.000 . 4.100 2.987 2.831 3.717 . 0 0 "[ . 1 . 2]" 1
1763 1 100 TRP H 1 100 TRP HB3 3.000 . 4.100 2.367 2.227 2.550 . 0 0 "[ . 1 . 2]" 1
1764 1 100 TRP H 1 100 TRP HZ3 4.200 . 6.000 6.067 4.454 6.224 0.224 9 0 "[ . 1 . 2]" 1
1765 1 100 TRP H 1 101 HIS H 4.600 . 6.000 4.596 4.521 4.754 . 0 0 "[ . 1 . 2]" 1
1766 1 100 TRP HA 1 100 TRP HB3 2.800 . 3.800 2.992 2.597 3.037 . 0 0 "[ . 1 . 2]" 1
1767 1 100 TRP HA 1 101 HIS H 2.600 . 3.400 2.232 2.085 2.363 . 0 0 "[ . 1 . 2]" 1
1768 1 100 TRP HB2 1 100 TRP HE3 3.000 . 4.100 4.099 4.052 4.176 0.076 19 0 "[ . 1 . 2]" 1
1769 1 100 TRP HB2 1 101 HIS H 4.200 . 6.000 3.916 2.994 4.197 . 0 0 "[ . 1 . 2]" 1
1770 1 100 TRP HB3 1 101 HIS H 4.200 . 6.000 4.191 4.075 4.420 . 0 0 "[ . 1 . 2]" 1
1771 1 101 HIS H 1 101 HIS HB2 3.700 . 5.400 2.391 2.225 2.519 . 0 0 "[ . 1 . 2]" 1
1772 1 102 MET HA 1 103 GLN H 3.100 . 4.300 2.215 2.086 2.504 . 0 0 "[ . 1 . 2]" 1
1773 1 102 MET ME 1 103 GLN H 3.300 . 4.600 4.070 3.268 4.672 0.072 18 0 "[ . 1 . 2]" 1
1774 1 103 GLN HA 1 104 LEU H 3.000 . 4.100 3.421 2.078 3.578 . 0 0 "[ . 1 . 2]" 1
1775 1 104 LEU HA 1 105 SER H 3.700 . 5.400 2.607 1.993 3.591 0.007 1 0 "[ . 1 . 2]" 1
1776 1 107 SER HB2 1 108 GLU HG3 3.600 . 5.200 4.675 3.302 5.269 0.069 14 0 "[ . 1 . 2]" 1
1777 1 108 GLU H 1 108 GLU QB 3.400 . 4.900 2.845 2.398 3.505 . 0 0 "[ . 1 . 2]" 1
1778 1 108 GLU H 1 108 GLU HG3 4.300 . 6.000 2.686 1.942 4.578 0.058 16 0 "[ . 1 . 2]" 1
1779 1 108 GLU HA 1 108 GLU HG2 3.400 . 4.800 3.504 2.482 4.325 . 0 0 "[ . 1 . 2]" 1
1780 1 108 GLU QB 1 109 ALA H 3.200 . 4.500 3.010 1.829 4.007 0.071 14 0 "[ . 1 . 2]" 1
1781 1 108 GLU QB 1 111 MET H 2.900 . 3.900 3.302 2.501 3.971 0.071 14 0 "[ . 1 . 2]" 1
1782 1 109 ALA H 1 109 ALA HA 2.800 . 3.800 2.463 2.170 2.921 . 0 0 "[ . 1 . 2]" 1
1783 1 109 ALA H 1 109 ALA MB 2.600 . 3.500 2.696 2.219 2.982 . 0 0 "[ . 1 . 2]" 1
1784 1 109 ALA H 1 110 ASP H 3.100 . 4.300 2.642 2.015 3.520 . 0 0 "[ . 1 . 2]" 1
1785 1 109 ALA HA 1 110 ASP H 2.500 . 3.300 3.014 1.936 3.407 0.107 18 0 "[ . 1 . 2]" 1
1786 1 109 ALA HA 1 111 MET H 3.400 . 4.900 4.335 3.754 4.952 0.052 2 0 "[ . 1 . 2]" 1
1787 1 109 ALA HA 1 112 ARG H 3.200 . 4.500 3.965 3.107 4.592 0.092 1 0 "[ . 1 . 2]" 1
1788 1 109 ALA HA 1 112 ARG QB 3.500 . 5.000 4.700 3.279 5.102 0.102 7 0 "[ . 1 . 2]" 1
1789 1 109 ALA MB 1 110 ASP H 2.700 . 3.600 3.295 2.521 3.614 0.014 17 0 "[ . 1 . 2]" 1
1790 1 110 ASP H 1 110 ASP HA 2.500 . 3.300 2.874 2.203 2.963 . 0 0 "[ . 1 . 2]" 1
1791 1 110 ASP H 1 110 ASP HB2 2.900 . 3.900 3.045 2.448 3.729 . 0 0 "[ . 1 . 2]" 1
1792 1 110 ASP H 1 110 ASP HB3 3.000 . 4.100 2.754 2.358 3.701 . 0 0 "[ . 1 . 2]" 1
1793 1 110 ASP H 1 111 MET H 2.600 . 3.400 2.301 1.777 3.342 0.023 3 0 "[ . 1 . 2]" 1
1794 1 110 ASP H 1 112 ARG H 3.500 . 5.000 3.532 2.521 4.402 . 0 0 "[ . 1 . 2]" 1
1795 1 110 ASP HB2 1 111 MET H 3.700 . 5.400 3.747 2.517 4.152 . 0 0 "[ . 1 . 2]" 1
1796 1 110 ASP HB2 1 112 ARG QD 2.100 . 6.000 5.795 4.907 6.060 0.060 5 0 "[ . 1 . 2]" 1
1797 1 110 ASP HB3 1 111 MET H 3.700 . 5.400 2.927 2.022 4.090 . 0 0 "[ . 1 . 2]" 1
1798 1 110 ASP HB3 1 111 MET HA 3.700 . 5.500 4.649 4.205 5.576 0.076 18 0 "[ . 1 . 2]" 1
1799 1 111 MET H 1 111 MET HA 3.000 . 4.100 2.876 2.779 2.945 . 0 0 "[ . 1 . 2]" 1
1800 1 111 MET H 1 111 MET QB 3.100 . 4.300 2.468 2.218 2.911 . 0 0 "[ . 1 . 2]" 1
1801 1 111 MET H 1 112 ARG H 2.900 . 4.000 2.379 2.006 2.709 . 0 0 "[ . 1 . 2]" 1
1802 1 111 MET H 1 113 SER H 3.700 . 5.400 4.794 4.031 5.440 0.040 14 0 "[ . 1 . 2]" 1
1803 1 111 MET HA 1 113 SER H 3.400 . 4.800 4.007 3.382 4.602 . 0 0 "[ . 1 . 2]" 1
1804 1 111 MET QB 1 112 ARG H 3.300 . 4.700 2.562 2.095 3.785 . 0 0 "[ . 1 . 2]" 1
1805 1 111 MET QB 1 114 LEU H 3.100 . 4.300 4.022 3.060 4.373 0.073 2 0 "[ . 1 . 2]" 1
1806 1 112 ARG H 1 112 ARG HA 2.700 . 3.600 2.246 2.127 2.728 . 0 0 "[ . 1 . 2]" 1
1807 1 112 ARG H 1 112 ARG QB 2.500 . 3.300 3.224 2.511 3.404 0.104 10 0 "[ . 1 . 2]" 1
1808 1 112 ARG H 1 114 LEU HG 3.400 . 4.800 4.019 3.102 4.877 0.077 18 0 "[ . 1 . 2]" 1
1809 1 112 ARG HA 1 113 SER H 3.200 . 4.500 3.284 2.654 3.554 . 0 0 "[ . 1 . 2]" 1
1810 1 112 ARG HA 1 115 GLY H 3.400 . 4.800 4.279 3.296 4.830 0.030 14 0 "[ . 1 . 2]" 1
1811 1 112 ARG HA 1 116 LEU H 3.100 . 4.300 3.765 2.890 4.362 0.062 10 0 "[ . 1 . 2]" 1
1812 1 112 ARG QB 1 113 SER H 3.100 . 4.300 3.205 2.260 4.039 . 0 0 "[ . 1 . 2]" 1
1813 1 112 ARG QD 1 116 LEU MD2 2.200 . 2.800 2.610 2.056 2.970 0.170 9 0 "[ . 1 . 2]" 1
1814 1 113 SER H 1 113 SER HA 2.800 . 3.800 2.815 2.684 2.909 . 0 0 "[ . 1 . 2]" 1
1815 1 113 SER H 1 113 SER QB 3.000 . 4.100 2.466 2.179 2.901 . 0 0 "[ . 1 . 2]" 1
1816 1 113 SER H 1 114 LEU H 3.000 . 4.100 2.695 2.192 3.127 . 0 0 "[ . 1 . 2]" 1
1817 1 113 SER H 1 114 LEU HG 3.800 . 5.600 3.928 3.392 4.583 . 0 0 "[ . 1 . 2]" 1
1818 1 113 SER H 1 115 GLY H 3.900 . 5.800 4.518 3.668 5.055 . 0 0 "[ . 1 . 2]" 1
1819 1 113 SER HA 1 113 SER QB 2.600 . 3.400 2.288 2.154 2.414 . 0 0 "[ . 1 . 2]" 1
1820 1 113 SER HA 1 114 LEU H 3.000 . 4.100 3.286 2.971 3.492 . 0 0 "[ . 1 . 2]" 1
1821 1 113 SER HA 1 115 GLY H 3.500 . 5.000 3.629 3.148 4.964 . 0 0 "[ . 1 . 2]" 1
1822 1 113 SER QB 1 114 LEU H 3.400 . 4.800 3.444 2.601 3.849 . 0 0 "[ . 1 . 2]" 1
1823 1 113 SER QB 1 114 LEU QB 3.800 . 5.600 4.927 4.285 5.447 . 0 0 "[ . 1 . 2]" 1
1824 1 114 LEU H 1 114 LEU HA 2.600 . 3.500 2.861 2.734 2.949 . 0 0 "[ . 1 . 2]" 1
1825 1 114 LEU H 1 114 LEU HG 2.200 . 2.800 2.254 1.826 2.701 . 0 0 "[ . 1 . 2]" 1
1826 1 114 LEU H 1 115 GLY H 2.600 . 3.500 2.540 1.897 2.903 . 0 0 "[ . 1 . 2]" 1
1827 1 114 LEU H 1 116 LEU H 3.400 . 4.900 3.623 2.779 4.150 . 0 0 "[ . 1 . 2]" 1
1828 1 114 LEU HA 1 114 LEU HG 2.800 . 3.800 3.398 3.062 3.810 0.010 11 0 "[ . 1 . 2]" 1
1829 1 114 LEU HA 1 115 GLY H 2.800 . 3.800 3.349 3.100 3.555 . 0 0 "[ . 1 . 2]" 1
1830 1 114 LEU QB 1 116 LEU H 3.400 . 4.900 4.138 3.091 4.983 0.083 4 0 "[ . 1 . 2]" 1
1831 1 114 LEU QB 1 117 ALA H 2.100 . 6.000 5.662 4.814 6.097 0.097 20 0 "[ . 1 . 2]" 1
1832 1 114 LEU HB2 1 116 LEU H 2.200 . 6.000 4.349 3.146 5.479 . 0 0 "[ . 1 . 2]" 1
1833 1 114 LEU HG 1 115 GLY H 3.400 . 4.800 4.139 2.656 4.835 0.035 3 0 "[ . 1 . 2]" 1
1834 1 115 GLY H 1 115 GLY HA2 2.600 . 3.400 2.833 2.295 2.970 . 0 0 "[ . 1 . 2]" 1
1835 1 115 GLY H 1 115 GLY HA3 2.500 . 3.300 2.673 2.335 2.957 . 0 0 "[ . 1 . 2]" 1
1836 1 115 GLY H 1 116 LEU H 2.300 . 3.000 2.062 1.716 2.542 . 0 0 "[ . 1 . 2]" 1
1837 1 115 GLY H 1 117 ALA H 3.700 . 5.400 3.416 2.807 4.470 . 0 0 "[ . 1 . 2]" 1
1838 1 115 GLY HA2 1 116 LEU H 3.000 . 4.100 3.127 2.714 3.539 . 0 0 "[ . 1 . 2]" 1
1839 1 115 GLY HA3 1 116 LEU H 3.000 . 4.200 3.253 2.543 3.540 . 0 0 "[ . 1 . 2]" 1
1840 1 116 LEU H 1 116 LEU HA 2.500 . 3.300 2.885 2.806 2.944 . 0 0 "[ . 1 . 2]" 1
1841 1 116 LEU H 1 116 LEU HG 3.900 . 5.800 4.381 3.799 4.584 . 0 0 "[ . 1 . 2]" 1
1842 1 116 LEU H 1 117 ALA H 2.500 . 3.300 2.445 2.052 2.840 . 0 0 "[ . 1 . 2]" 1
1843 1 116 LEU HB3 1 117 ALA HA 2.900 . 4.000 4.064 4.011 4.099 0.099 19 0 "[ . 1 . 2]" 1
1844 1 117 ALA H 1 117 ALA HA 2.200 . 2.800 2.775 2.162 2.859 0.059 9 0 "[ . 1 . 2]" 1
1845 1 117 ALA H 1 117 ALA MB 2.100 . 2.600 2.362 2.245 2.689 0.089 10 0 "[ . 1 . 2]" 1
1846 1 117 ALA H 1 118 GLU H 2.800 . 3.800 3.640 2.718 3.903 0.103 14 0 "[ . 1 . 2]" 1
1847 1 117 ALA HA 1 118 GLU H 2.100 . 2.600 2.299 2.042 3.028 0.428 16 0 "[ . 1 . 2]" 1
1848 1 117 ALA MB 1 118 GLU H 2.700 . 3.600 3.451 1.740 3.632 0.060 16 0 "[ . 1 . 2]" 1
1849 1 118 GLU H 1 118 GLU HB2 2.600 . 3.400 2.829 2.101 3.380 . 0 0 "[ . 1 . 2]" 1
1850 1 118 GLU H 1 118 GLU HB3 2.400 . 3.100 2.697 2.404 3.335 0.235 13 0 "[ . 1 . 2]" 1
1851 1 118 GLU H 1 118 GLU QG 3.100 . 4.300 4.005 2.434 4.306 0.006 5 0 "[ . 1 . 2]" 1
1852 1 118 GLU HB2 1 119 SER H 3.900 . 5.800 4.029 3.401 4.514 . 0 0 "[ . 1 . 2]" 1
1853 1 119 SER H 1 119 SER QB 2.800 . 3.800 2.719 2.250 3.404 . 0 0 "[ . 1 . 2]" 1
1854 1 119 SER HA 1 120 ARG H 2.500 . 3.300 2.237 2.049 2.668 . 0 0 "[ . 1 . 2]" 1
1855 1 119 SER HA 1 120 ARG QD 2.500 . 3.300 3.132 2.649 3.399 0.099 1 0 "[ . 1 . 2]" 1
1856 1 119 SER QB 1 120 ARG H 3.500 . 5.000 3.234 1.981 3.933 0.019 16 0 "[ . 1 . 2]" 1
1857 1 120 ARG H 1 120 ARG HB2 3.500 . 5.000 3.657 2.575 4.020 . 0 0 "[ . 1 . 2]" 1
1858 1 120 ARG H 1 120 ARG HB3 3.100 . 4.300 3.166 2.540 3.740 . 0 0 "[ . 1 . 2]" 1
1859 1 120 ARG H 1 120 ARG QG 3.400 . 4.900 3.041 2.377 3.439 . 0 0 "[ . 1 . 2]" 1
1860 1 120 ARG H 1 121 GLN H 2.900 . 3.900 2.940 2.089 4.027 0.127 10 0 "[ . 1 . 2]" 1
1861 1 120 ARG HB3 1 121 GLN H 3.300 . 4.700 4.209 3.531 4.550 . 0 0 "[ . 1 . 2]" 1
1862 1 120 ARG QD 1 121 GLN H 2.800 . 6.000 3.931 2.556 5.075 . 0 0 "[ . 1 . 2]" 1
1863 1 120 ARG HG2 1 121 GLN H 3.100 . 4.300 3.811 2.796 4.370 0.070 18 0 "[ . 1 . 2]" 1
1864 1 121 GLN H 1 121 GLN HA 2.400 . 3.100 2.764 2.194 2.957 . 0 0 "[ . 1 . 2]" 1
1865 1 121 GLN H 1 121 GLN HB2 2.800 . 3.800 3.306 2.785 3.874 0.074 11 0 "[ . 1 . 2]" 1
1866 1 121 GLN H 1 121 GLN HB3 2.500 . 3.300 2.922 2.491 3.467 0.167 16 0 "[ . 1 . 2]" 1
1867 1 121 GLN HA 1 121 GLN HB2 2.500 . 3.300 2.486 2.389 2.580 . 0 0 "[ . 1 . 2]" 1
1868 1 121 GLN HA 1 121 GLN HB3 2.700 . 3.600 2.789 2.310 3.041 . 0 0 "[ . 1 . 2]" 1
1869 2 1 FAD H2' 2 1 FAD H9 3.400 . 4.800 3.328 1.966 4.433 0.034 11 0 "[ . 1 . 2]" 1
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