NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
571542 |
2miu   |
19694 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2miu
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 1886
_Distance_constraint_stats_list.Viol_count 5301
_Distance_constraint_stats_list.Viol_total 6480.058
_Distance_constraint_stats_list.Viol_max 0.268
_Distance_constraint_stats_list.Viol_rms 0.0285
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0086
_Distance_constraint_stats_list.Viol_average_violations_only 0.0611
_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 2 THR 2.664 0.121 11 0 "[ . 1 . 2]"
1 3 GLU 5.242 0.231 11 0 "[ . 1 . 2]"
1 4 ARG 7.699 0.145 5 0 "[ . 1 . 2]"
1 5 PHE 13.475 0.110 5 0 "[ . 1 . 2]"
1 6 ASP 5.297 0.111 11 0 "[ . 1 . 2]"
1 7 CYS 20.522 0.139 13 0 "[ . 1 . 2]"
1 8 HIS 18.757 0.224 4 0 "[ . 1 . 2]"
1 9 HIS 11.216 0.230 3 0 "[ . 1 . 2]"
1 10 CYS 2.190 0.089 15 0 "[ . 1 . 2]"
1 11 ASN 7.731 0.206 16 0 "[ . 1 . 2]"
1 12 GLU 3.278 0.132 17 0 "[ . 1 . 2]"
1 13 SER 0.153 0.027 1 0 "[ . 1 . 2]"
1 14 LEU 25.228 0.261 13 0 "[ . 1 . 2]"
1 15 PHE 18.965 0.261 13 0 "[ . 1 . 2]"
1 16 GLY 1.423 0.050 13 0 "[ . 1 . 2]"
1 17 LYS 4.277 0.177 6 0 "[ . 1 . 2]"
1 18 LYS 2.458 0.177 6 0 "[ . 1 . 2]"
1 19 TYR 4.963 0.121 18 0 "[ . 1 . 2]"
1 20 ILE 2.876 0.113 3 0 "[ . 1 . 2]"
1 21 LEU 3.361 0.190 1 0 "[ . 1 . 2]"
1 22 ARG 10.658 0.268 2 0 "[ . 1 . 2]"
1 23 GLU 0.222 0.031 19 0 "[ . 1 . 2]"
1 24 GLU 0.362 0.134 12 0 "[ . 1 . 2]"
1 25 SER 5.445 0.188 1 0 "[ . 1 . 2]"
1 26 PRO 8.766 0.224 4 0 "[ . 1 . 2]"
1 27 TYR 24.844 0.261 2 0 "[ . 1 . 2]"
1 28 CYS 15.212 0.241 3 0 "[ . 1 . 2]"
1 29 VAL 3.019 0.107 4 0 "[ . 1 . 2]"
1 30 VAL 2.658 0.108 4 0 "[ . 1 . 2]"
1 31 CYS 7.674 0.121 2 0 "[ . 1 . 2]"
1 32 PHE 10.575 0.241 3 0 "[ . 1 . 2]"
1 33 GLU 12.397 0.226 3 0 "[ . 1 . 2]"
1 34 THR 6.946 0.226 3 0 "[ . 1 . 2]"
1 35 LEU 13.622 0.148 16 0 "[ . 1 . 2]"
1 36 PHE 8.596 0.176 7 0 "[ . 1 . 2]"
1 37 ALA 1.302 0.081 1 0 "[ . 1 . 2]"
1 38 ASN 3.218 0.113 18 0 "[ . 1 . 2]"
1 39 THR 2.354 0.126 20 0 "[ . 1 . 2]"
1 40 CYS 8.014 0.143 11 0 "[ . 1 . 2]"
1 41 GLU 9.474 0.126 20 0 "[ . 1 . 2]"
1 42 GLU 7.100 0.165 19 0 "[ . 1 . 2]"
1 43 CYS 0.022 0.015 5 0 "[ . 1 . 2]"
1 44 GLY 0.121 0.024 7 0 "[ . 1 . 2]"
1 45 LYS 0.267 0.037 11 0 "[ . 1 . 2]"
1 46 PRO 6.427 0.225 5 0 "[ . 1 . 2]"
1 47 ILE 4.588 0.137 7 0 "[ . 1 . 2]"
1 48 GLY 0.619 0.067 6 0 "[ . 1 . 2]"
1 49 CYS 1.046 0.145 19 0 "[ . 1 . 2]"
1 50 ASP 0.108 0.026 19 0 "[ . 1 . 2]"
1 51 CYS 0.286 0.067 2 0 "[ . 1 . 2]"
1 52 LYS 0.993 0.235 18 0 "[ . 1 . 2]"
1 53 ASP 0.377 0.109 19 0 "[ . 1 . 2]"
1 54 LEU 4.065 0.211 20 0 "[ . 1 . 2]"
1 55 SER 0.130 0.022 2 0 "[ . 1 . 2]"
1 56 TYR 3.583 0.122 12 0 "[ . 1 . 2]"
1 57 LYS 4.506 0.160 17 0 "[ . 1 . 2]"
1 58 ASP 0.103 0.021 18 0 "[ . 1 . 2]"
1 59 ARG 8.122 0.264 18 0 "[ . 1 . 2]"
1 60 HIS 4.937 0.137 7 0 "[ . 1 . 2]"
1 61 TRP 12.676 0.211 20 0 "[ . 1 . 2]"
1 62 HIS 0.606 0.056 20 0 "[ . 1 . 2]"
1 63 GLU 1.767 0.105 10 0 "[ . 1 . 2]"
1 64 ALA 0.057 0.014 3 0 "[ . 1 . 2]"
1 65 CYS 5.001 0.165 19 0 "[ . 1 . 2]"
1 66 PHE 13.035 0.215 11 0 "[ . 1 . 2]"
1 67 HIS 3.787 0.095 8 0 "[ . 1 . 2]"
1 68 CYS 8.813 0.124 2 0 "[ . 1 . 2]"
1 69 SER 0.929 0.068 18 0 "[ . 1 . 2]"
1 70 GLN 7.203 0.187 7 0 "[ . 1 . 2]"
1 71 CYS 5.417 0.187 7 0 "[ . 1 . 2]"
1 72 ARG 8.600 0.242 18 0 "[ . 1 . 2]"
1 73 ASN 10.134 0.193 2 0 "[ . 1 . 2]"
1 74 SER 4.030 0.093 16 0 "[ . 1 . 2]"
1 75 LEU 6.231 0.189 10 0 "[ . 1 . 2]"
1 76 VAL 3.448 0.215 11 0 "[ . 1 . 2]"
1 77 ASP 0.268 0.051 8 0 "[ . 1 . 2]"
1 78 LYS 4.978 0.189 10 0 "[ . 1 . 2]"
1 79 PRO 3.941 0.076 5 0 "[ . 1 . 2]"
1 80 PHE 12.704 0.211 8 0 "[ . 1 . 2]"
1 81 ALA 0.001 0.001 11 0 "[ . 1 . 2]"
1 82 ALA 3.884 0.211 8 0 "[ . 1 . 2]"
1 83 LYS 0.928 0.036 6 0 "[ . 1 . 2]"
1 84 GLU 1.885 0.071 7 0 "[ . 1 . 2]"
1 85 ASP 4.272 0.145 9 0 "[ . 1 . 2]"
1 86 GLN 8.010 0.157 5 0 "[ . 1 . 2]"
1 87 LEU 14.020 0.144 8 0 "[ . 1 . 2]"
1 88 LEU 3.890 0.106 3 0 "[ . 1 . 2]"
1 89 CYS 5.788 0.160 19 0 "[ . 1 . 2]"
1 90 THR 5.665 0.109 19 0 "[ . 1 . 2]"
1 91 ASP 5.875 0.160 19 0 "[ . 1 . 2]"
1 92 CYS 1.203 0.095 16 0 "[ . 1 . 2]"
1 93 TYR 8.508 0.123 9 0 "[ . 1 . 2]"
1 94 SER 7.277 0.123 9 0 "[ . 1 . 2]"
1 95 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLU 2.020 0.095 11 0 "[ . 1 . 2]"
1 97 TYR 2.149 0.168 12 0 "[ . 1 . 2]"
1 98 SER 1.655 0.168 12 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 2 THR H 1 2 THR HA 2.500 . 2.900 2.902 2.820 2.975 0.075 18 0 "[ . 1 . 2]" 1
2 1 2 THR H 1 2 THR HB 2.500 . 2.900 2.633 2.452 2.966 0.066 10 0 "[ . 1 . 2]" 1
3 1 2 THR H 1 2 THR MG 2.500 . 3.000 1.957 1.737 2.191 0.063 10 0 "[ . 1 . 2]" 1
4 1 2 THR H 1 3 GLU H 2.500 . 2.800 2.557 2.222 2.841 0.041 10 0 "[ . 1 . 2]" 1
5 1 2 THR HA 1 2 THR HB 2.500 . 2.900 2.486 2.310 2.526 . 0 0 "[ . 1 . 2]" 1
6 1 2 THR HA 1 2 THR MG 3.000 . 3.700 3.192 3.140 3.203 . 0 0 "[ . 1 . 2]" 1
7 1 2 THR HA 1 3 GLU H 3.000 . 3.500 3.554 3.498 3.574 0.074 12 0 "[ . 1 . 2]" 1
8 1 2 THR HB 1 3 GLU H 3.000 . 3.800 3.813 3.742 3.921 0.121 10 0 "[ . 1 . 2]" 1
9 1 2 THR MG 1 3 GLU H 2.500 . 3.000 1.814 1.679 2.071 0.121 11 0 "[ . 1 . 2]" 1
10 1 3 GLU H 1 3 GLU HB2 2.500 . 3.500 3.620 3.591 3.731 0.231 11 0 "[ . 1 . 2]" 1
11 1 3 GLU H 1 3 GLU HB3 2.500 . 2.900 2.501 2.337 2.905 0.005 11 0 "[ . 1 . 2]" 1
12 1 3 GLU H 1 3 GLU QG 2.500 . 3.400 2.197 1.914 2.553 . 0 0 "[ . 1 . 2]" 1
13 1 3 GLU HA 1 3 GLU HB2 2.500 . 2.700 2.409 2.381 2.419 . 0 0 "[ . 1 . 2]" 1
14 1 3 GLU HA 1 3 GLU HB3 2.500 . 2.800 2.528 2.511 2.547 . 0 0 "[ . 1 . 2]" 1
15 1 3 GLU HA 1 3 GLU QG 3.000 . 3.800 3.311 3.307 3.319 . 0 0 "[ . 1 . 2]" 1
16 1 3 GLU HA 1 4 ARG H 2.500 . 2.800 2.538 2.464 2.644 . 0 0 "[ . 1 . 2]" 1
17 1 3 GLU HA 1 4 ARG HB2 4.000 . 5.000 4.796 4.733 4.912 . 0 0 "[ . 1 . 2]" 1
18 1 3 GLU HA 1 4 ARG QG 3.000 . 4.000 3.346 3.312 3.396 . 0 0 "[ . 1 . 2]" 1
19 1 3 GLU HB2 1 4 ARG H 2.500 . 2.800 2.264 2.127 2.385 . 0 0 "[ . 1 . 2]" 1
20 1 3 GLU HB3 1 4 ARG H 3.000 . 3.700 3.728 3.640 3.806 0.106 5 0 "[ . 1 . 2]" 1
21 1 3 GLU QG 1 4 ARG H 3.000 . 3.600 2.990 2.760 3.091 . 0 0 "[ . 1 . 2]" 1
22 1 3 GLU QG 1 4 ARG HA 4.000 . 4.500 3.970 3.933 3.989 . 0 0 "[ . 1 . 2]" 1
23 1 3 GLU QG 1 5 PHE HB2 4.000 . 4.800 4.059 3.748 4.331 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU QG 1 5 PHE HD1 4.000 . 4.200 3.613 3.494 3.760 . 0 0 "[ . 1 . 2]" 1
25 1 3 GLU QG 1 5 PHE HE1 4.000 . 6.000 5.362 5.312 5.401 . 0 0 "[ . 1 . 2]" 1
26 1 4 ARG H 1 4 ARG HB2 3.000 . 3.500 2.435 2.413 2.454 . 0 0 "[ . 1 . 2]" 1
27 1 4 ARG H 1 4 ARG HB3 2.500 . 3.500 3.634 3.625 3.645 0.145 5 0 "[ . 1 . 2]" 1
28 1 4 ARG H 1 4 ARG HD2 4.000 . 5.000 4.688 4.531 4.892 . 0 0 "[ . 1 . 2]" 1
29 1 4 ARG H 1 4 ARG HD3 4.000 . 4.500 4.160 4.018 4.263 . 0 0 "[ . 1 . 2]" 1
30 1 4 ARG H 1 4 ARG HG2 2.500 . 2.800 2.427 2.379 2.502 . 0 0 "[ . 1 . 2]" 1
31 1 4 ARG H 1 4 ARG HG3 3.000 . 3.700 3.614 3.550 3.691 . 0 0 "[ . 1 . 2]" 1
32 1 4 ARG HA 1 4 ARG HB2 3.000 . 4.000 3.028 3.025 3.031 . 0 0 "[ . 1 . 2]" 1
33 1 4 ARG HA 1 4 ARG HB3 2.500 . 2.800 2.472 2.464 2.485 . 0 0 "[ . 1 . 2]" 1
34 1 4 ARG HA 1 4 ARG HD2 3.000 . 4.200 2.775 2.435 3.161 . 0 0 "[ . 1 . 2]" 1
35 1 4 ARG HA 1 4 ARG HD3 2.500 . 2.800 2.493 2.320 2.716 . 0 0 "[ . 1 . 2]" 1
36 1 4 ARG HA 1 4 ARG HG2 2.500 . 2.800 2.845 2.763 2.892 0.092 15 0 "[ . 1 . 2]" 1
37 1 4 ARG HA 1 4 ARG HG3 3.000 . 4.000 3.739 3.713 3.757 . 0 0 "[ . 1 . 2]" 1
38 1 4 ARG HA 1 5 PHE H 2.500 . 2.700 2.243 2.212 2.271 . 0 0 "[ . 1 . 2]" 1
39 1 4 ARG HA 1 5 PHE HB2 4.000 . 4.200 4.190 4.143 4.229 0.029 6 0 "[ . 1 . 2]" 1
40 1 4 ARG HA 1 5 PHE HB3 4.000 . 5.000 4.928 4.870 4.978 . 0 0 "[ . 1 . 2]" 1
41 1 4 ARG HB2 1 4 ARG HD2 3.000 . 4.000 3.565 3.559 3.574 . 0 0 "[ . 1 . 2]" 1
42 1 4 ARG HB2 1 4 ARG HD3 3.000 . 4.200 3.986 3.881 4.095 . 0 0 "[ . 1 . 2]" 1
43 1 4 ARG HB2 1 5 PHE H 3.000 . 4.000 4.029 3.982 4.062 0.062 12 0 "[ . 1 . 2]" 1
44 1 4 ARG HB2 1 6 ASP H 4.000 . 4.200 3.983 3.865 4.117 . 0 0 "[ . 1 . 2]" 1
45 1 4 ARG HB3 1 4 ARG HD2 2.500 . 2.800 2.283 2.274 2.297 . 0 0 "[ . 1 . 2]" 1
46 1 4 ARG HB3 1 4 ARG HD3 3.000 . 4.000 3.270 3.015 3.480 . 0 0 "[ . 1 . 2]" 1
47 1 4 ARG HB3 1 5 PHE H 3.000 . 3.200 3.054 2.983 3.115 . 0 0 "[ . 1 . 2]" 1
48 1 4 ARG HB3 1 6 ASP H 3.000 . 3.500 3.586 3.557 3.611 0.111 11 0 "[ . 1 . 2]" 1
49 1 4 ARG HD2 1 5 PHE H 3.000 . 4.100 3.921 3.669 4.160 0.060 2 0 "[ . 1 . 2]" 1
50 1 4 ARG HD3 1 5 PHE H 3.000 . 4.800 4.339 3.971 4.656 . 0 0 "[ . 1 . 2]" 1
51 1 4 ARG HG2 1 5 PHE H 4.000 . 5.000 4.901 4.814 4.943 . 0 0 "[ . 1 . 2]" 1
52 1 4 ARG HG3 1 5 PHE H 4.000 . 5.300 5.327 5.295 5.362 0.062 5 0 "[ . 1 . 2]" 1
53 1 5 PHE H 1 5 PHE HB2 2.500 . 2.700 2.706 2.621 2.766 0.066 5 0 "[ . 1 . 2]" 1
54 1 5 PHE H 1 5 PHE HB3 2.500 . 2.800 2.858 2.836 2.889 0.089 1 0 "[ . 1 . 2]" 1
55 1 5 PHE H 1 5 PHE HD1 4.000 . 4.600 4.617 4.548 4.664 0.064 2 0 "[ . 1 . 2]" 1
56 1 5 PHE H 1 5 PHE HD2 4.000 . 5.000 5.066 5.045 5.083 0.083 1 0 "[ . 1 . 2]" 1
57 1 5 PHE H 1 6 ASP H 3.000 . 3.500 3.378 3.313 3.451 . 0 0 "[ . 1 . 2]" 1
58 1 5 PHE HA 1 5 PHE HB2 2.500 . 2.800 2.646 2.640 2.653 . 0 0 "[ . 1 . 2]" 1
59 1 5 PHE HA 1 5 PHE HB3 3.000 . 3.200 3.013 3.010 3.016 . 0 0 "[ . 1 . 2]" 1
60 1 5 PHE HA 1 5 PHE HD1 2.500 . 2.800 2.589 2.541 2.704 . 0 0 "[ . 1 . 2]" 1
61 1 5 PHE HA 1 5 PHE HD2 4.000 . 4.200 4.042 3.961 4.079 . 0 0 "[ . 1 . 2]" 1
62 1 5 PHE HA 1 6 ASP H 2.500 . 2.800 2.527 2.513 2.535 . 0 0 "[ . 1 . 2]" 1
63 1 5 PHE HA 1 14 LEU MD2 3.000 . 4.200 3.441 3.418 3.460 . 0 0 "[ . 1 . 2]" 1
64 1 5 PHE HA 1 26 PRO HG2 4.000 . 4.300 4.322 4.223 4.369 0.069 9 0 "[ . 1 . 2]" 1
65 1 5 PHE HA 1 26 PRO HG3 3.000 . 4.000 3.797 3.655 3.869 . 0 0 "[ . 1 . 2]" 1
66 1 5 PHE HB2 1 5 PHE HD1 2.500 . 2.800 2.564 2.524 2.584 . 0 0 "[ . 1 . 2]" 1
67 1 5 PHE HB2 1 5 PHE HD2 3.000 . 3.500 3.575 3.562 3.608 0.108 7 0 "[ . 1 . 2]" 1
68 1 5 PHE HB2 1 5 PHE HE1 4.000 . 4.700 4.757 4.737 4.767 0.067 20 0 "[ . 1 . 2]" 1
69 1 5 PHE HB2 1 6 ASP H 4.000 . 4.600 4.654 4.650 4.658 0.058 3 0 "[ . 1 . 2]" 1
70 1 5 PHE HB3 1 5 PHE HD1 3.000 . 3.800 3.728 3.718 3.734 . 0 0 "[ . 1 . 2]" 1
71 1 5 PHE HB3 1 5 PHE HD2 2.500 . 2.700 2.362 2.355 2.380 . 0 0 "[ . 1 . 2]" 1
72 1 5 PHE HB3 1 5 PHE HE2 4.000 . 4.700 4.674 4.669 4.683 . 0 0 "[ . 1 . 2]" 1
73 1 5 PHE HB3 1 6 ASP H 4.000 . 4.300 4.361 4.357 4.364 0.064 15 0 "[ . 1 . 2]" 1
74 1 5 PHE HD1 1 6 ASP H 4.000 . 5.300 5.107 5.051 5.224 . 0 0 "[ . 1 . 2]" 1
75 1 5 PHE HD2 1 14 LEU H 3.000 . 3.300 3.259 3.228 3.287 . 0 0 "[ . 1 . 2]" 1
76 1 5 PHE HD2 1 14 LEU HB2 2.500 . 2.900 2.839 2.810 2.873 . 0 0 "[ . 1 . 2]" 1
77 1 5 PHE HD2 1 14 LEU HB3 3.000 . 4.500 4.550 4.523 4.580 0.080 7 0 "[ . 1 . 2]" 1
78 1 5 PHE HD2 1 14 LEU MD2 3.000 . 4.000 2.825 2.807 2.847 . 0 0 "[ . 1 . 2]" 1
79 1 5 PHE HE2 1 14 LEU HB2 2.500 . 2.700 2.290 2.277 2.300 . 0 0 "[ . 1 . 2]" 1
80 1 5 PHE HE2 1 14 LEU HB3 3.000 . 3.300 3.302 3.290 3.315 0.015 4 0 "[ . 1 . 2]" 1
81 1 5 PHE HE2 1 14 LEU MD2 4.000 . 4.500 3.585 3.551 3.604 . 0 0 "[ . 1 . 2]" 1
82 1 5 PHE HE2 1 19 TYR QB 4.000 . 5.000 4.217 4.191 4.244 . 0 0 "[ . 1 . 2]" 1
83 1 5 PHE HZ 1 14 LEU HB2 4.000 . 4.300 4.288 4.268 4.317 0.017 7 0 "[ . 1 . 2]" 1
84 1 5 PHE HZ 1 14 LEU HB3 4.000 . 4.700 4.791 4.762 4.810 0.110 5 0 "[ . 1 . 2]" 1
85 1 5 PHE HZ 1 14 LEU HG 4.000 . 4.300 4.039 3.995 4.098 . 0 0 "[ . 1 . 2]" 1
86 1 5 PHE HZ 1 18 LYS HA 4.000 . 4.300 4.109 3.954 4.220 . 0 0 "[ . 1 . 2]" 1
87 1 5 PHE HZ 1 19 TYR QB 4.000 . 4.500 3.863 3.837 3.929 . 0 0 "[ . 1 . 2]" 1
88 1 6 ASP H 1 6 ASP HA 2.500 . 3.000 2.989 2.983 2.994 . 0 0 "[ . 1 . 2]" 1
89 1 6 ASP H 1 6 ASP QB 3.000 . 3.500 2.892 2.821 3.233 . 0 0 "[ . 1 . 2]" 1
90 1 6 ASP H 1 7 CYS H 4.000 . 4.500 4.428 4.409 4.441 . 0 0 "[ . 1 . 2]" 1
91 1 6 ASP H 1 14 LEU MD2 4.000 . 4.500 3.268 3.217 3.294 . 0 0 "[ . 1 . 2]" 1
92 1 6 ASP H 1 26 PRO HG2 3.000 . 3.800 3.178 3.009 3.248 . 0 0 "[ . 1 . 2]" 1
93 1 6 ASP H 1 26 PRO HG3 3.000 . 3.800 3.786 3.615 3.872 0.072 6 0 "[ . 1 . 2]" 1
94 1 6 ASP HA 1 6 ASP QB 2.500 . 2.800 2.276 2.186 2.303 . 0 0 "[ . 1 . 2]" 1
95 1 6 ASP HA 1 7 CYS H 2.500 . 2.800 2.273 2.259 2.318 . 0 0 "[ . 1 . 2]" 1
96 1 6 ASP HA 1 7 CYS HA 4.000 . 4.500 4.337 4.327 4.350 . 0 0 "[ . 1 . 2]" 1
97 1 6 ASP HA 1 7 CYS HB2 4.000 . 4.800 4.767 4.745 4.785 . 0 0 "[ . 1 . 2]" 1
98 1 6 ASP HA 1 7 CYS HB3 4.000 . 4.800 4.592 4.554 4.642 . 0 0 "[ . 1 . 2]" 1
99 1 6 ASP HA 1 12 GLU H 4.000 . 5.000 5.012 4.954 5.055 0.055 1 0 "[ . 1 . 2]" 1
100 1 6 ASP HA 1 14 LEU H 2.500 . 2.800 2.693 2.626 2.732 . 0 0 "[ . 1 . 2]" 1
101 1 6 ASP HA 1 14 LEU HA 4.000 . 5.000 4.725 4.693 4.768 . 0 0 "[ . 1 . 2]" 1
102 1 6 ASP HA 1 14 LEU HB2 4.000 . 4.800 4.750 4.647 4.802 0.002 18 0 "[ . 1 . 2]" 1
103 1 6 ASP HA 1 14 LEU HB3 4.000 . 5.800 5.829 5.751 5.875 0.075 18 0 "[ . 1 . 2]" 1
104 1 6 ASP HA 1 14 LEU MD1 4.000 . 5.200 4.144 4.128 4.173 . 0 0 "[ . 1 . 2]" 1
105 1 6 ASP HA 1 14 LEU MD2 2.500 . 2.700 2.139 2.087 2.173 . 0 0 "[ . 1 . 2]" 1
106 1 6 ASP HA 1 14 LEU HG 4.000 . 5.000 4.908 4.816 4.961 . 0 0 "[ . 1 . 2]" 1
107 1 6 ASP QB 1 7 CYS H 3.000 . 3.300 2.781 2.740 2.824 . 0 0 "[ . 1 . 2]" 1
108 1 6 ASP QB 1 7 CYS HB2 4.000 . 6.000 5.140 5.105 5.179 . 0 0 "[ . 1 . 2]" 1
109 1 6 ASP QB 1 7 CYS HB3 4.000 . 4.800 4.306 4.243 4.363 . 0 0 "[ . 1 . 2]" 1
110 1 6 ASP QB 1 11 ASN HA 3.000 . 3.500 2.773 2.623 2.934 . 0 0 "[ . 1 . 2]" 1
111 1 6 ASP QB 1 11 ASN HB2 4.000 . 4.800 4.225 3.905 4.486 . 0 0 "[ . 1 . 2]" 1
112 1 7 CYS H 1 7 CYS HB2 2.500 . 2.800 2.715 2.700 2.726 . 0 0 "[ . 1 . 2]" 1
113 1 7 CYS H 1 7 CYS HB3 2.500 . 2.700 2.327 2.300 2.354 . 0 0 "[ . 1 . 2]" 1
114 1 7 CYS H 1 11 ASN H 3.000 . 4.300 4.262 3.970 4.356 0.056 7 0 "[ . 1 . 2]" 1
115 1 7 CYS H 1 11 ASN HA 3.000 . 3.800 3.795 3.738 3.849 0.049 7 0 "[ . 1 . 2]" 1
116 1 7 CYS H 1 12 GLU H 3.000 . 3.300 3.251 3.149 3.306 0.006 4 0 "[ . 1 . 2]" 1
117 1 7 CYS H 1 12 GLU HA 4.000 . 5.200 4.648 4.612 4.693 . 0 0 "[ . 1 . 2]" 1
118 1 7 CYS H 1 14 LEU H 3.000 . 4.000 3.765 3.731 3.790 . 0 0 "[ . 1 . 2]" 1
119 1 7 CYS H 1 14 LEU HA 4.000 . 4.300 4.332 4.314 4.342 0.042 17 0 "[ . 1 . 2]" 1
120 1 7 CYS H 1 14 LEU MD1 4.000 . 4.500 3.303 3.280 3.337 . 0 0 "[ . 1 . 2]" 1
121 1 7 CYS H 1 14 LEU MD2 3.000 . 3.300 2.291 2.254 2.315 . 0 0 "[ . 1 . 2]" 1
122 1 7 CYS HA 1 7 CYS HB2 2.500 . 2.700 2.361 2.357 2.366 . 0 0 "[ . 1 . 2]" 1
123 1 7 CYS HA 1 7 CYS HB3 2.500 . 3.000 3.009 3.004 3.013 0.013 17 0 "[ . 1 . 2]" 1
124 1 7 CYS HA 1 8 HIS H 2.500 . 2.700 2.227 2.213 2.245 . 0 0 "[ . 1 . 2]" 1
125 1 7 CYS HA 1 8 HIS HB2 4.000 . 4.500 4.537 4.511 4.565 0.065 19 0 "[ . 1 . 2]" 1
126 1 7 CYS HA 1 8 HIS HB3 4.000 . 5.000 4.739 4.641 4.810 . 0 0 "[ . 1 . 2]" 1
127 1 7 CYS HA 1 14 LEU H 4.000 . 5.500 5.610 5.588 5.626 0.126 12 0 "[ . 1 . 2]" 1
128 1 7 CYS HA 1 14 LEU MD1 3.000 . 4.000 3.156 3.138 3.169 . 0 0 "[ . 1 . 2]" 1
129 1 7 CYS HA 1 14 LEU MD2 3.000 . 3.800 3.038 3.024 3.048 . 0 0 "[ . 1 . 2]" 1
130 1 7 CYS HA 1 14 LEU HG 4.000 . 5.000 4.979 4.954 5.001 0.001 2 0 "[ . 1 . 2]" 1
131 1 7 CYS HA 1 26 PRO HA 4.000 . 5.000 4.649 4.628 4.676 . 0 0 "[ . 1 . 2]" 1
132 1 7 CYS HA 1 26 PRO HB2 2.500 . 2.900 2.720 2.694 2.747 . 0 0 "[ . 1 . 2]" 1
133 1 7 CYS HA 1 26 PRO HB3 4.000 . 4.500 4.428 4.391 4.462 . 0 0 "[ . 1 . 2]" 1
134 1 7 CYS HA 1 26 PRO HG2 3.000 . 4.000 3.986 3.963 4.019 0.019 4 0 "[ . 1 . 2]" 1
135 1 7 CYS HA 1 26 PRO HG3 4.000 . 5.200 5.268 5.253 5.282 0.082 5 0 "[ . 1 . 2]" 1
136 1 7 CYS HA 1 27 TYR HA 2.500 . 2.800 2.839 2.823 2.861 0.061 2 0 "[ . 1 . 2]" 1
137 1 7 CYS HA 1 28 CYS H 3.000 . 3.500 3.528 3.501 3.575 0.075 3 0 "[ . 1 . 2]" 1
138 1 7 CYS HA 1 28 CYS HA 4.000 . 4.600 4.544 4.482 4.573 . 0 0 "[ . 1 . 2]" 1
139 1 7 CYS HA 1 28 CYS HB2 4.000 . 6.000 6.005 5.985 6.017 0.017 8 0 "[ . 1 . 2]" 1
140 1 7 CYS HA 1 28 CYS HB3 4.000 . 4.500 4.497 4.490 4.505 0.005 4 0 "[ . 1 . 2]" 1
141 1 7 CYS HB2 1 8 HIS H 4.000 . 4.400 4.410 4.394 4.425 0.025 3 0 "[ . 1 . 2]" 1
142 1 7 CYS HB2 1 9 HIS H 4.000 . 4.300 4.360 4.337 4.386 0.086 7 0 "[ . 1 . 2]" 1
143 1 7 CYS HB2 1 10 CYS H 3.000 . 4.200 4.091 4.059 4.113 . 0 0 "[ . 1 . 2]" 1
144 1 7 CYS HB2 1 11 ASN H 4.000 . 4.500 4.477 4.142 4.549 0.049 7 0 "[ . 1 . 2]" 1
145 1 7 CYS HB2 1 11 ASN HA 4.000 . 5.300 5.332 5.308 5.356 0.056 7 0 "[ . 1 . 2]" 1
146 1 7 CYS HB2 1 12 GLU H 3.000 . 4.000 3.927 3.839 3.974 . 0 0 "[ . 1 . 2]" 1
147 1 7 CYS HB2 1 12 GLU HG2 3.000 . 3.300 3.248 3.210 3.292 . 0 0 "[ . 1 . 2]" 1
148 1 7 CYS HB2 1 12 GLU HG3 3.000 . 4.000 4.011 3.985 4.023 0.023 17 0 "[ . 1 . 2]" 1
149 1 7 CYS HB2 1 14 LEU HA 3.000 . 4.200 4.211 4.185 4.237 0.037 6 0 "[ . 1 . 2]" 1
150 1 7 CYS HB2 1 14 LEU MD1 3.000 . 3.500 2.441 2.420 2.465 . 0 0 "[ . 1 . 2]" 1
151 1 7 CYS HB2 1 14 LEU MD2 4.000 . 4.300 3.269 3.229 3.286 . 0 0 "[ . 1 . 2]" 1
152 1 7 CYS HB2 1 27 TYR HA 3.000 . 3.500 3.518 3.496 3.555 0.055 7 0 "[ . 1 . 2]" 1
153 1 7 CYS HB2 1 28 CYS H 2.500 . 2.700 2.482 2.443 2.561 . 0 0 "[ . 1 . 2]" 1
154 1 7 CYS HB2 1 28 CYS HA 3.000 . 3.300 3.264 3.198 3.301 0.001 17 0 "[ . 1 . 2]" 1
155 1 7 CYS HB2 1 28 CYS HB2 3.000 . 4.000 3.916 3.896 3.925 . 0 0 "[ . 1 . 2]" 1
156 1 7 CYS HB2 1 28 CYS HB3 2.500 . 2.700 2.250 2.243 2.258 . 0 0 "[ . 1 . 2]" 1
157 1 7 CYS HB3 1 8 HIS H 4.000 . 4.500 4.500 4.495 4.507 0.007 4 0 "[ . 1 . 2]" 1
158 1 7 CYS HB3 1 9 HIS H 3.000 . 4.000 3.981 3.931 4.033 0.033 3 0 "[ . 1 . 2]" 1
159 1 7 CYS HB3 1 10 CYS H 2.500 . 3.100 3.163 3.134 3.189 0.089 15 0 "[ . 1 . 2]" 1
160 1 7 CYS HB3 1 10 CYS HB2 2.500 . 2.900 2.838 2.761 2.907 0.007 1 0 "[ . 1 . 2]" 1
161 1 7 CYS HB3 1 11 ASN H 3.000 . 3.200 2.954 2.574 3.039 . 0 0 "[ . 1 . 2]" 1
162 1 7 CYS HB3 1 11 ASN HA 3.000 . 3.800 3.845 3.830 3.861 0.061 14 0 "[ . 1 . 2]" 1
163 1 7 CYS HB3 1 12 GLU H 2.500 . 2.700 2.261 2.173 2.304 . 0 0 "[ . 1 . 2]" 1
164 1 7 CYS HB3 1 12 GLU HG2 2.500 . 2.800 2.300 2.289 2.322 . 0 0 "[ . 1 . 2]" 1
165 1 7 CYS HB3 1 12 GLU HG3 3.000 . 3.500 3.621 3.598 3.632 0.132 17 0 "[ . 1 . 2]" 1
166 1 7 CYS HB3 1 14 LEU MD1 4.000 . 4.800 3.757 3.730 3.776 . 0 0 "[ . 1 . 2]" 1
167 1 7 CYS HB3 1 14 LEU MD2 4.000 . 5.000 3.891 3.865 3.927 . 0 0 "[ . 1 . 2]" 1
168 1 7 CYS HB3 1 27 TYR HA 4.000 . 4.300 4.428 4.413 4.439 0.139 13 0 "[ . 1 . 2]" 1
169 1 7 CYS HB3 1 28 CYS H 3.000 . 3.600 3.659 3.634 3.707 0.107 7 0 "[ . 1 . 2]" 1
170 1 7 CYS HB3 1 28 CYS HA 4.000 . 5.000 4.947 4.883 4.983 . 0 0 "[ . 1 . 2]" 1
171 1 7 CYS HB3 1 28 CYS HB2 4.000 . 5.000 5.054 5.033 5.078 0.078 5 0 "[ . 1 . 2]" 1
172 1 7 CYS HB3 1 28 CYS HB3 3.000 . 3.300 3.310 3.284 3.331 0.031 5 0 "[ . 1 . 2]" 1
173 1 8 HIS H 1 8 HIS HB2 2.500 . 2.800 2.325 2.284 2.364 . 0 0 "[ . 1 . 2]" 1
174 1 8 HIS H 1 8 HIS HB3 2.500 . 3.000 2.763 2.697 2.808 . 0 0 "[ . 1 . 2]" 1
175 1 8 HIS H 1 14 LEU MD2 4.000 . 5.500 4.369 4.344 4.385 . 0 0 "[ . 1 . 2]" 1
176 1 8 HIS H 1 25 SER HB3 4.000 . 4.500 4.403 4.360 4.434 . 0 0 "[ . 1 . 2]" 1
177 1 8 HIS H 1 26 PRO HB2 2.500 . 3.000 2.986 2.931 3.027 0.027 12 0 "[ . 1 . 2]" 1
178 1 8 HIS H 1 26 PRO HD2 3.000 . 3.600 3.547 3.522 3.574 . 0 0 "[ . 1 . 2]" 1
179 1 8 HIS H 1 26 PRO HG2 2.500 . 3.000 2.934 2.910 2.963 . 0 0 "[ . 1 . 2]" 1
180 1 8 HIS H 1 26 PRO HG3 3.000 . 4.500 4.527 4.501 4.547 0.047 15 0 "[ . 1 . 2]" 1
181 1 8 HIS H 1 27 TYR HA 3.000 . 3.300 3.417 3.404 3.433 0.133 10 0 "[ . 1 . 2]" 1
182 1 8 HIS H 1 27 TYR HD1 3.000 . 3.200 3.164 3.117 3.249 0.049 7 0 "[ . 1 . 2]" 1
183 1 8 HIS H 1 27 TYR HE1 4.000 . 4.500 4.568 4.537 4.611 0.111 5 0 "[ . 1 . 2]" 1
184 1 8 HIS HA 1 9 HIS H 3.000 . 3.500 3.479 3.465 3.488 . 0 0 "[ . 1 . 2]" 1
185 1 8 HIS HB2 1 9 HIS H 3.000 . 4.000 4.048 4.000 4.086 0.086 18 0 "[ . 1 . 2]" 1
186 1 8 HIS HB2 1 9 HIS HA 4.000 . 5.500 5.648 5.622 5.667 0.167 18 0 "[ . 1 . 2]" 1
187 1 8 HIS HB2 1 25 SER HA 3.000 . 3.600 3.756 3.733 3.788 0.188 1 0 "[ . 1 . 2]" 1
188 1 8 HIS HB2 1 25 SER HB2 3.000 . 3.500 3.238 2.987 3.401 . 0 0 "[ . 1 . 2]" 1
189 1 8 HIS HB2 1 25 SER HB3 2.500 . 3.000 2.308 2.263 2.322 . 0 0 "[ . 1 . 2]" 1
190 1 8 HIS HB2 1 26 PRO HD2 2.500 . 2.700 2.261 2.252 2.271 . 0 0 "[ . 1 . 2]" 1
191 1 8 HIS HB2 1 26 PRO HD3 3.000 . 4.000 3.989 3.975 3.999 . 0 0 "[ . 1 . 2]" 1
192 1 8 HIS HB2 1 27 TYR HA 4.000 . 5.000 5.064 5.038 5.085 0.085 19 0 "[ . 1 . 2]" 1
193 1 8 HIS HB2 1 27 TYR HD1 3.000 . 4.000 3.801 3.770 3.821 . 0 0 "[ . 1 . 2]" 1
194 1 8 HIS HB2 1 27 TYR HE1 3.000 . 4.000 4.050 4.029 4.093 0.093 1 0 "[ . 1 . 2]" 1
195 1 8 HIS HB3 1 9 HIS H 3.000 . 3.400 3.074 3.038 3.142 . 0 0 "[ . 1 . 2]" 1
196 1 8 HIS HB3 1 9 HIS HA 4.000 . 4.500 4.317 4.249 4.385 . 0 0 "[ . 1 . 2]" 1
197 1 8 HIS HB3 1 25 SER HA 3.000 . 4.500 4.486 4.467 4.519 0.019 1 0 "[ . 1 . 2]" 1
198 1 8 HIS HB3 1 25 SER HB2 2.500 . 3.000 2.604 2.346 2.782 . 0 0 "[ . 1 . 2]" 1
199 1 8 HIS HB3 1 25 SER HB3 2.500 . 2.700 2.607 2.556 2.672 . 0 0 "[ . 1 . 2]" 1
200 1 8 HIS HB3 1 26 PRO HD2 3.000 . 3.500 3.694 3.656 3.724 0.224 4 0 "[ . 1 . 2]" 1
201 1 8 HIS HB3 1 26 PRO HD3 4.000 . 5.500 5.236 5.191 5.266 . 0 0 "[ . 1 . 2]" 1
202 1 8 HIS HB3 1 27 TYR HA 4.000 . 4.500 4.344 4.224 4.424 . 0 0 "[ . 1 . 2]" 1
203 1 8 HIS HB3 1 27 TYR HD1 2.500 . 2.900 2.621 2.497 2.746 . 0 0 "[ . 1 . 2]" 1
204 1 8 HIS HB3 1 27 TYR HE1 2.500 . 2.800 2.327 2.303 2.391 . 0 0 "[ . 1 . 2]" 1
205 1 9 HIS H 1 9 HIS HB2 2.500 . 3.000 2.856 2.831 2.897 . 0 0 "[ . 1 . 2]" 1
206 1 9 HIS H 1 9 HIS HB3 2.500 . 2.700 2.441 2.395 2.469 . 0 0 "[ . 1 . 2]" 1
207 1 9 HIS H 1 10 CYS H 2.500 . 2.900 2.744 2.701 2.789 . 0 0 "[ . 1 . 2]" 1
208 1 9 HIS H 1 11 ASN H 3.000 . 3.500 3.209 3.124 3.344 . 0 0 "[ . 1 . 2]" 1
209 1 9 HIS H 1 27 TYR HA 3.000 . 3.300 3.054 2.955 3.115 . 0 0 "[ . 1 . 2]" 1
210 1 9 HIS H 1 27 TYR HD1 2.500 . 2.700 2.668 2.548 2.842 0.142 7 0 "[ . 1 . 2]" 1
211 1 9 HIS H 1 27 TYR HE1 3.000 . 3.500 3.427 3.355 3.506 0.006 1 0 "[ . 1 . 2]" 1
212 1 9 HIS HA 1 9 HIS HB2 2.500 . 2.700 2.416 2.399 2.428 . 0 0 "[ . 1 . 2]" 1
213 1 9 HIS HA 1 9 HIS HB3 2.500 . 3.200 3.026 3.022 3.029 . 0 0 "[ . 1 . 2]" 1
214 1 9 HIS HA 1 10 CYS H 3.000 . 3.800 3.620 3.614 3.625 . 0 0 "[ . 1 . 2]" 1
215 1 9 HIS HB2 1 9 HIS HD2 3.000 . 3.300 3.092 3.057 3.153 . 0 0 "[ . 1 . 2]" 1
216 1 9 HIS HB2 1 10 CYS H 3.000 . 3.800 3.748 3.718 3.796 . 0 0 "[ . 1 . 2]" 1
217 1 9 HIS HB2 1 27 TYR HD1 3.000 . 3.500 3.324 3.230 3.432 . 0 0 "[ . 1 . 2]" 1
218 1 9 HIS HB2 1 27 TYR HD2 4.000 . 5.000 4.746 4.393 4.917 . 0 0 "[ . 1 . 2]" 1
219 1 9 HIS HB2 1 27 TYR HE1 2.500 . 3.000 2.763 2.711 2.847 . 0 0 "[ . 1 . 2]" 1
220 1 9 HIS HB2 1 27 TYR HE2 4.000 . 4.800 4.363 3.929 4.593 . 0 0 "[ . 1 . 2]" 1
221 1 9 HIS HB2 1 31 CYS HB2 4.000 . 5.300 5.151 5.099 5.247 . 0 0 "[ . 1 . 2]" 1
222 1 9 HIS HB2 1 31 CYS HB3 4.000 . 5.300 4.426 4.342 4.504 . 0 0 "[ . 1 . 2]" 1
223 1 9 HIS HB2 1 35 LEU MD1 4.000 . 5.500 4.062 3.929 4.171 . 0 0 "[ . 1 . 2]" 1
224 1 9 HIS HB3 1 9 HIS HD2 3.000 . 3.300 3.126 3.094 3.158 . 0 0 "[ . 1 . 2]" 1
225 1 9 HIS HB3 1 10 CYS H 2.500 . 2.700 2.262 2.217 2.336 . 0 0 "[ . 1 . 2]" 1
226 1 9 HIS HB3 1 11 ASN H 4.000 . 4.500 4.245 4.199 4.347 . 0 0 "[ . 1 . 2]" 1
227 1 9 HIS HB3 1 27 TYR HD1 3.000 . 3.500 3.616 3.534 3.730 0.230 3 0 "[ . 1 . 2]" 1
228 1 9 HIS HB3 1 27 TYR HE1 3.000 . 4.000 4.088 4.046 4.143 0.143 7 0 "[ . 1 . 2]" 1
229 1 9 HIS HB3 1 31 CYS HB2 3.000 . 4.500 4.144 4.096 4.224 . 0 0 "[ . 1 . 2]" 1
230 1 9 HIS HB3 1 31 CYS HB3 4.000 . 4.500 3.966 3.874 4.021 . 0 0 "[ . 1 . 2]" 1
231 1 9 HIS HB3 1 35 LEU MD1 4.000 . 5.600 4.353 4.182 4.478 . 0 0 "[ . 1 . 2]" 1
232 1 9 HIS HD2 1 31 CYS HB2 4.000 . 4.500 4.493 4.325 4.584 0.084 19 0 "[ . 1 . 2]" 1
233 1 9 HIS HD2 1 31 CYS HB3 3.000 . 3.500 3.351 3.105 3.507 0.007 19 0 "[ . 1 . 2]" 1
234 1 9 HIS HD2 1 35 LEU MD1 3.000 . 3.500 2.405 2.286 2.488 . 0 0 "[ . 1 . 2]" 1
235 1 9 HIS HD2 1 35 LEU MD2 3.000 . 4.000 2.659 2.493 2.834 . 0 0 "[ . 1 . 2]" 1
236 1 9 HIS HD2 1 35 LEU HG 3.000 . 3.800 3.837 3.804 3.866 0.066 14 0 "[ . 1 . 2]" 1
237 1 10 CYS H 1 10 CYS HA 3.000 . 3.200 2.938 2.926 2.950 . 0 0 "[ . 1 . 2]" 1
238 1 10 CYS H 1 10 CYS HB2 2.500 . 3.000 2.682 2.656 2.708 . 0 0 "[ . 1 . 2]" 1
239 1 10 CYS H 1 10 CYS HB3 3.000 . 3.700 3.663 3.652 3.674 . 0 0 "[ . 1 . 2]" 1
240 1 10 CYS H 1 11 ASN H 2.500 . 2.700 2.401 2.362 2.449 . 0 0 "[ . 1 . 2]" 1
241 1 10 CYS H 1 12 GLU H 3.000 . 4.000 3.858 3.791 3.958 . 0 0 "[ . 1 . 2]" 1
242 1 10 CYS HA 1 10 CYS HB2 3.000 . 3.300 3.021 3.018 3.026 . 0 0 "[ . 1 . 2]" 1
243 1 10 CYS HA 1 10 CYS HB3 2.500 . 2.700 2.389 2.376 2.403 . 0 0 "[ . 1 . 2]" 1
244 1 10 CYS HA 1 11 ASN H 3.000 . 3.500 3.337 3.307 3.464 . 0 0 "[ . 1 . 2]" 1
245 1 10 CYS HA 1 11 ASN HB3 4.000 . 4.500 4.278 4.072 4.478 . 0 0 "[ . 1 . 2]" 1
246 1 10 CYS HB2 1 11 ASN H 3.000 . 3.300 3.274 2.859 3.353 0.053 8 0 "[ . 1 . 2]" 1
247 1 10 CYS HB2 1 12 GLU H 2.500 . 2.800 2.479 2.390 2.604 . 0 0 "[ . 1 . 2]" 1
248 1 10 CYS HB2 1 12 GLU HB3 3.000 . 3.300 3.203 3.094 3.326 0.026 15 0 "[ . 1 . 2]" 1
249 1 10 CYS HB2 1 12 GLU HG2 2.500 . 2.700 2.293 2.280 2.307 . 0 0 "[ . 1 . 2]" 1
250 1 10 CYS HB2 1 12 GLU HG3 3.000 . 4.200 3.949 3.930 3.996 . 0 0 "[ . 1 . 2]" 1
251 1 10 CYS HB2 1 28 CYS HB3 4.000 . 4.300 4.233 4.145 4.306 0.006 15 0 "[ . 1 . 2]" 1
252 1 10 CYS HB3 1 11 ASN H 4.000 . 4.300 4.251 3.998 4.307 0.007 8 0 "[ . 1 . 2]" 1
253 1 10 CYS HB3 1 12 GLU H 3.000 . 4.000 3.647 3.561 3.773 . 0 0 "[ . 1 . 2]" 1
254 1 10 CYS HB3 1 12 GLU HB3 3.000 . 3.500 3.351 3.280 3.448 . 0 0 "[ . 1 . 2]" 1
255 1 10 CYS HB3 1 12 GLU HG2 3.000 . 3.700 3.651 3.566 3.710 0.010 11 0 "[ . 1 . 2]" 1
256 1 11 ASN H 1 11 ASN HB2 3.000 . 4.000 3.553 3.127 3.966 . 0 0 "[ . 1 . 2]" 1
257 1 11 ASN H 1 11 ASN HB3 3.000 . 3.300 3.272 3.023 3.479 0.179 11 0 "[ . 1 . 2]" 1
258 1 11 ASN H 1 12 GLU H 2.500 . 3.000 2.707 2.425 2.780 . 0 0 "[ . 1 . 2]" 1
259 1 11 ASN HA 1 11 ASN HB2 2.500 . 2.700 2.363 2.283 2.421 . 0 0 "[ . 1 . 2]" 1
260 1 11 ASN HA 1 11 ASN HB3 2.500 . 2.800 2.830 2.593 3.006 0.206 16 0 "[ . 1 . 2]" 1
261 1 11 ASN HA 1 12 GLU H 3.000 . 3.200 3.063 2.991 3.096 . 0 0 "[ . 1 . 2]" 1
262 1 11 ASN HB2 1 11 ASN HD21 2.500 . 2.800 2.506 2.251 2.842 0.042 16 0 "[ . 1 . 2]" 1
263 1 11 ASN HB2 1 11 ASN HD22 3.000 . 3.600 3.608 3.510 3.737 0.137 18 0 "[ . 1 . 2]" 1
264 1 11 ASN HB2 1 12 GLU H 4.000 . 5.000 4.599 4.561 4.686 . 0 0 "[ . 1 . 2]" 1
265 1 11 ASN HB3 1 11 ASN HD21 3.000 . 3.600 3.289 2.454 3.600 0.000 1 0 "[ . 1 . 2]" 1
266 1 11 ASN HB3 1 11 ASN HD22 3.000 . 4.200 3.967 3.583 4.113 . 0 0 "[ . 1 . 2]" 1
267 1 12 GLU H 1 12 GLU HB2 3.000 . 4.000 3.714 3.699 3.746 . 0 0 "[ . 1 . 2]" 1
268 1 12 GLU H 1 12 GLU HB3 2.500 . 3.000 2.733 2.691 2.803 . 0 0 "[ . 1 . 2]" 1
269 1 12 GLU H 1 12 GLU HG2 2.500 . 2.800 2.057 1.986 2.100 . 0 0 "[ . 1 . 2]" 1
270 1 12 GLU H 1 12 GLU HG3 3.000 . 3.500 3.443 3.377 3.483 . 0 0 "[ . 1 . 2]" 1
271 1 12 GLU H 1 13 SER H 4.000 . 5.000 4.546 4.511 4.561 . 0 0 "[ . 1 . 2]" 1
272 1 12 GLU HA 1 12 GLU HB2 2.500 . 2.700 2.407 2.401 2.420 . 0 0 "[ . 1 . 2]" 1
273 1 12 GLU HA 1 12 GLU HB3 2.500 . 2.800 2.541 2.529 2.549 . 0 0 "[ . 1 . 2]" 1
274 1 12 GLU HA 1 12 GLU HG2 3.000 . 3.800 3.680 3.672 3.689 . 0 0 "[ . 1 . 2]" 1
275 1 12 GLU HA 1 12 GLU HG3 3.000 . 3.800 3.751 3.746 3.759 . 0 0 "[ . 1 . 2]" 1
276 1 12 GLU HA 1 13 SER H 2.500 . 2.800 2.230 2.216 2.244 . 0 0 "[ . 1 . 2]" 1
277 1 12 GLU HB2 1 13 SER H 3.000 . 3.300 3.236 3.168 3.291 . 0 0 "[ . 1 . 2]" 1
278 1 12 GLU HB3 1 13 SER H 3.000 . 4.300 4.299 4.266 4.327 0.027 1 0 "[ . 1 . 2]" 1
279 1 12 GLU HG2 1 13 SER H 4.000 . 5.000 4.729 4.702 4.751 . 0 0 "[ . 1 . 2]" 1
280 1 12 GLU HG2 1 28 CYS HB3 3.000 . 3.500 3.354 3.266 3.423 . 0 0 "[ . 1 . 2]" 1
281 1 12 GLU HG3 1 13 SER H 4.000 . 4.200 4.044 3.989 4.077 . 0 0 "[ . 1 . 2]" 1
282 1 12 GLU HG3 1 28 CYS HB3 3.000 . 3.700 3.623 3.543 3.707 0.007 17 0 "[ . 1 . 2]" 1
283 1 13 SER H 1 13 SER QB 3.000 . 3.500 2.396 2.226 2.728 . 0 0 "[ . 1 . 2]" 1
284 1 13 SER HA 1 14 LEU H 2.500 . 2.800 2.255 2.243 2.264 . 0 0 "[ . 1 . 2]" 1
285 1 13 SER HA 1 14 LEU MD2 3.000 . 3.800 3.019 3.000 3.031 . 0 0 "[ . 1 . 2]" 1
286 1 13 SER QB 1 14 LEU H 3.000 . 4.000 3.369 3.121 3.702 . 0 0 "[ . 1 . 2]" 1
287 1 14 LEU H 1 14 LEU HB2 2.500 . 2.800 2.454 2.442 2.465 . 0 0 "[ . 1 . 2]" 1
288 1 14 LEU H 1 14 LEU HB3 3.000 . 3.800 3.626 3.620 3.634 . 0 0 "[ . 1 . 2]" 1
289 1 14 LEU H 1 14 LEU MD1 3.000 . 4.200 3.455 3.445 3.465 . 0 0 "[ . 1 . 2]" 1
290 1 14 LEU H 1 14 LEU MD2 2.500 . 2.800 1.672 1.665 1.676 0.135 10 0 "[ . 1 . 2]" 1
291 1 14 LEU H 1 14 LEU HG 3.000 . 3.800 3.733 3.724 3.743 . 0 0 "[ . 1 . 2]" 1
292 1 14 LEU HA 1 14 LEU HB2 2.500 . 3.100 3.021 3.020 3.023 . 0 0 "[ . 1 . 2]" 1
293 1 14 LEU HA 1 14 LEU HB3 2.500 . 2.700 2.541 2.535 2.546 . 0 0 "[ . 1 . 2]" 1
294 1 14 LEU HA 1 14 LEU MD1 2.500 . 2.700 2.092 2.089 2.094 . 0 0 "[ . 1 . 2]" 1
295 1 14 LEU HA 1 14 LEU MD2 3.000 . 3.700 2.688 2.676 2.698 . 0 0 "[ . 1 . 2]" 1
296 1 14 LEU HA 1 15 PHE H 2.500 . 2.800 2.174 2.158 2.199 . 0 0 "[ . 1 . 2]" 1
297 1 14 LEU HA 1 15 PHE HD1 2.500 . 3.000 3.028 3.011 3.050 0.050 5 0 "[ . 1 . 2]" 1
298 1 14 LEU HA 1 15 PHE HE1 3.000 . 4.500 4.492 4.459 4.513 0.013 14 0 "[ . 1 . 2]" 1
299 1 14 LEU HA 1 28 CYS HA 3.000 . 4.000 4.064 4.040 4.080 0.080 19 0 "[ . 1 . 2]" 1
300 1 14 LEU HA 1 28 CYS HB2 3.000 . 4.300 4.371 4.360 4.390 0.090 4 0 "[ . 1 . 2]" 1
301 1 14 LEU HA 1 28 CYS HB3 3.000 . 4.000 3.984 3.963 4.007 0.007 1 0 "[ . 1 . 2]" 1
302 1 14 LEU HB2 1 14 LEU MD1 3.000 . 3.500 3.191 3.189 3.192 . 0 0 "[ . 1 . 2]" 1
303 1 14 LEU HB2 1 14 LEU MD2 2.500 . 2.800 2.285 2.282 2.288 . 0 0 "[ . 1 . 2]" 1
304 1 14 LEU HB2 1 15 PHE H 4.000 . 4.200 4.190 4.166 4.202 0.002 13 0 "[ . 1 . 2]" 1
305 1 14 LEU HB2 1 17 LYS H 3.000 . 4.500 4.623 4.602 4.662 0.162 6 0 "[ . 1 . 2]" 1
306 1 14 LEU HB2 1 19 TYR HD1 4.000 . 5.300 5.084 4.989 5.124 . 0 0 "[ . 1 . 2]" 1
307 1 14 LEU HB3 1 14 LEU MD1 2.500 . 2.800 2.274 2.271 2.276 . 0 0 "[ . 1 . 2]" 1
308 1 14 LEU HB3 1 14 LEU MD2 3.000 . 3.500 3.183 3.182 3.184 . 0 0 "[ . 1 . 2]" 1
309 1 14 LEU HB3 1 15 PHE H 3.000 . 3.300 3.217 3.171 3.243 . 0 0 "[ . 1 . 2]" 1
310 1 14 LEU HB3 1 15 PHE HD1 4.000 . 4.300 4.459 4.443 4.474 0.174 6 0 "[ . 1 . 2]" 1
311 1 14 LEU HB3 1 17 LYS H 3.000 . 3.800 3.636 3.608 3.700 . 0 0 "[ . 1 . 2]" 1
312 1 14 LEU HB3 1 19 TYR HA 4.000 . 5.000 4.985 4.948 5.002 0.002 13 0 "[ . 1 . 2]" 1
313 1 14 LEU HB3 1 19 TYR HD1 4.000 . 5.000 4.768 4.695 4.812 . 0 0 "[ . 1 . 2]" 1
314 1 14 LEU HB3 1 28 CYS HA 4.000 . 5.000 4.710 4.681 4.742 . 0 0 "[ . 1 . 2]" 1
315 1 14 LEU MD1 1 15 PHE H 4.000 . 4.300 3.310 3.289 3.320 . 0 0 "[ . 1 . 2]" 1
316 1 14 LEU MD1 1 15 PHE HD1 4.000 . 4.500 3.620 3.610 3.632 . 0 0 "[ . 1 . 2]" 1
317 1 14 LEU MD1 1 15 PHE HE1 4.000 . 4.500 3.676 3.650 3.695 . 0 0 "[ . 1 . 2]" 1
318 1 14 LEU MD1 1 19 TYR HA 3.000 . 4.500 3.547 3.514 3.604 . 0 0 "[ . 1 . 2]" 1
319 1 14 LEU MD1 1 19 TYR QB 3.000 . 3.400 2.195 2.161 2.220 . 0 0 "[ . 1 . 2]" 1
320 1 14 LEU MD1 1 26 PRO HB2 4.000 . 4.600 3.587 3.566 3.616 . 0 0 "[ . 1 . 2]" 1
321 1 14 LEU MD1 1 26 PRO HB3 4.000 . 5.300 4.228 4.211 4.237 . 0 0 "[ . 1 . 2]" 1
322 1 14 LEU MD1 1 27 TYR HA 4.000 . 5.300 4.162 4.132 4.209 . 0 0 "[ . 1 . 2]" 1
323 1 14 LEU MD1 1 28 CYS H 4.000 . 4.600 3.549 3.511 3.607 . 0 0 "[ . 1 . 2]" 1
324 1 14 LEU MD1 1 28 CYS HA 2.500 . 2.800 2.043 2.034 2.053 . 0 0 "[ . 1 . 2]" 1
325 1 14 LEU MD1 1 28 CYS HB2 3.000 . 4.200 3.365 3.348 3.387 . 0 0 "[ . 1 . 2]" 1
326 1 14 LEU MD1 1 28 CYS HB3 3.000 . 3.800 2.843 2.817 2.876 . 0 0 "[ . 1 . 2]" 1
327 1 14 LEU MD1 1 29 VAL H 3.000 . 4.300 3.259 3.230 3.294 . 0 0 "[ . 1 . 2]" 1
328 1 14 LEU MD2 1 26 PRO HB2 3.000 . 3.800 2.642 2.625 2.676 . 0 0 "[ . 1 . 2]" 1
329 1 14 LEU MD2 1 26 PRO HB3 4.000 . 4.500 3.452 3.437 3.466 . 0 0 "[ . 1 . 2]" 1
330 1 14 LEU MD2 1 26 PRO HG2 4.000 . 5.200 3.985 3.957 4.030 . 0 0 "[ . 1 . 2]" 1
331 1 14 LEU MD2 1 26 PRO HG3 4.000 . 5.500 4.333 4.308 4.361 . 0 0 "[ . 1 . 2]" 1
332 1 14 LEU HG 1 15 PHE H 4.000 . 5.000 5.246 5.216 5.261 0.261 13 0 "[ . 1 . 2]" 1
333 1 14 LEU HG 1 19 TYR QB 2.500 . 3.000 2.165 2.153 2.171 . 0 0 "[ . 1 . 2]" 1
334 1 14 LEU HG 1 19 TYR HD1 3.000 . 4.200 3.969 3.880 4.004 . 0 0 "[ . 1 . 2]" 1
335 1 14 LEU HG 1 19 TYR HD2 3.000 . 4.000 4.096 4.046 4.121 0.121 18 0 "[ . 1 . 2]" 1
336 1 14 LEU HG 1 26 PRO HB3 4.000 . 4.300 4.310 4.291 4.331 0.031 4 0 "[ . 1 . 2]" 1
337 1 15 PHE H 1 15 PHE HA 2.500 . 3.000 2.896 2.894 2.900 . 0 0 "[ . 1 . 2]" 1
338 1 15 PHE H 1 15 PHE HB2 3.000 . 3.500 3.585 3.581 3.588 0.088 14 0 "[ . 1 . 2]" 1
339 1 15 PHE H 1 15 PHE HB3 2.500 . 3.000 2.662 2.642 2.693 . 0 0 "[ . 1 . 2]" 1
340 1 15 PHE H 1 15 PHE HD1 2.500 . 3.000 1.640 1.624 1.666 0.176 13 0 "[ . 1 . 2]" 1
341 1 15 PHE HA 1 15 PHE HB2 2.500 . 2.800 2.480 2.473 2.490 . 0 0 "[ . 1 . 2]" 1
342 1 15 PHE HA 1 15 PHE HB3 2.500 . 2.800 2.417 2.402 2.424 . 0 0 "[ . 1 . 2]" 1
343 1 15 PHE HA 1 15 PHE HD1 3.000 . 4.000 4.000 3.987 4.006 0.006 13 0 "[ . 1 . 2]" 1
344 1 15 PHE HA 1 15 PHE HD2 3.000 . 4.300 4.338 4.336 4.340 0.040 1 0 "[ . 1 . 2]" 1
345 1 15 PHE HA 1 16 GLY H 2.500 . 2.800 2.248 2.239 2.252 . 0 0 "[ . 1 . 2]" 1
346 1 15 PHE HA 1 16 GLY HA2 4.000 . 4.500 4.507 4.498 4.513 0.013 13 0 "[ . 1 . 2]" 1
347 1 15 PHE HA 1 16 GLY HA3 4.000 . 4.300 4.278 4.274 4.282 . 0 0 "[ . 1 . 2]" 1
348 1 15 PHE HB2 1 15 PHE HD1 3.000 . 3.800 3.771 3.768 3.776 . 0 0 "[ . 1 . 2]" 1
349 1 15 PHE HB2 1 15 PHE HD2 2.500 . 2.700 2.354 2.352 2.355 . 0 0 "[ . 1 . 2]" 1
350 1 15 PHE HB2 1 16 GLY H 3.000 . 4.000 3.910 3.899 3.916 . 0 0 "[ . 1 . 2]" 1
351 1 15 PHE HB2 1 16 GLY HA2 4.000 . 5.500 5.509 5.490 5.516 0.016 13 0 "[ . 1 . 2]" 1
352 1 15 PHE HB2 1 16 GLY HA3 4.000 . 4.500 4.466 4.445 4.475 . 0 0 "[ . 1 . 2]" 1
353 1 15 PHE HB3 1 15 PHE HD1 2.500 . 2.800 2.604 2.596 2.610 . 0 0 "[ . 1 . 2]" 1
354 1 15 PHE HB3 1 15 PHE HD2 3.000 . 3.500 3.590 3.588 3.595 0.095 5 0 "[ . 1 . 2]" 1
355 1 15 PHE HB3 1 16 GLY H 3.000 . 4.500 4.505 4.485 4.514 0.014 13 0 "[ . 1 . 2]" 1
356 1 15 PHE HD1 1 28 CYS HA 4.000 . 4.500 4.501 4.476 4.513 0.013 5 0 "[ . 1 . 2]" 1
357 1 15 PHE HD1 1 28 CYS HB2 3.000 . 3.300 3.301 3.275 3.320 0.020 6 0 "[ . 1 . 2]" 1
358 1 15 PHE HD1 1 28 CYS HB3 3.000 . 4.000 4.033 4.017 4.056 0.056 3 0 "[ . 1 . 2]" 1
359 1 15 PHE HD2 1 16 GLY HA3 3.000 . 4.500 4.520 4.507 4.538 0.038 6 0 "[ . 1 . 2]" 1
360 1 15 PHE HD2 1 17 LYS HB2 3.000 . 3.700 3.746 3.733 3.759 0.059 5 0 "[ . 1 . 2]" 1
361 1 15 PHE HD2 1 17 LYS HB3 3.000 . 4.000 3.941 3.878 4.003 0.003 16 0 "[ . 1 . 2]" 1
362 1 15 PHE HE1 1 28 CYS HA 3.000 . 3.500 3.508 3.492 3.525 0.025 1 0 "[ . 1 . 2]" 1
363 1 15 PHE HE1 1 28 CYS HB2 2.500 . 2.800 2.337 2.332 2.342 . 0 0 "[ . 1 . 2]" 1
364 1 15 PHE HE1 1 28 CYS HB3 3.000 . 4.000 3.884 3.874 3.895 . 0 0 "[ . 1 . 2]" 1
365 1 15 PHE HE1 1 29 VAL H 2.500 . 2.800 2.462 2.432 2.495 . 0 0 "[ . 1 . 2]" 1
366 1 15 PHE HE1 1 29 VAL MG2 3.000 . 3.500 2.490 2.471 2.509 . 0 0 "[ . 1 . 2]" 1
367 1 15 PHE HE1 1 30 VAL H 3.000 . 4.000 3.194 3.123 3.326 . 0 0 "[ . 1 . 2]" 1
368 1 15 PHE HE2 1 17 LYS HB3 3.000 . 4.200 3.408 3.352 3.485 . 0 0 "[ . 1 . 2]" 1
369 1 16 GLY H 1 16 GLY HA2 2.500 . 2.800 2.353 2.349 2.356 . 0 0 "[ . 1 . 2]" 1
370 1 16 GLY H 1 16 GLY HA3 2.500 . 3.000 2.717 2.715 2.718 . 0 0 "[ . 1 . 2]" 1
371 1 16 GLY H 1 17 LYS H 3.000 . 4.000 3.169 3.147 3.209 . 0 0 "[ . 1 . 2]" 1
372 1 16 GLY HA2 1 17 LYS H 3.000 . 3.500 3.287 3.259 3.326 . 0 0 "[ . 1 . 2]" 1
373 1 16 GLY HA3 1 17 LYS H 3.000 . 3.500 3.457 3.444 3.468 . 0 0 "[ . 1 . 2]" 1
374 1 16 GLY HA3 1 17 LYS HB2 3.000 . 4.500 4.524 4.459 4.550 0.050 13 0 "[ . 1 . 2]" 1
375 1 16 GLY HA3 1 17 LYS HB3 4.000 . 5.500 5.252 5.211 5.304 . 0 0 "[ . 1 . 2]" 1
376 1 17 LYS H 1 17 LYS HB2 3.000 . 3.300 3.190 3.155 3.207 . 0 0 "[ . 1 . 2]" 1
377 1 17 LYS H 1 17 LYS HB3 2.500 . 2.900 2.697 2.662 2.759 . 0 0 "[ . 1 . 2]" 1
378 1 17 LYS H 1 17 LYS HG2 4.000 . 5.000 4.502 4.460 4.598 . 0 0 "[ . 1 . 2]" 1
379 1 17 LYS H 1 17 LYS HG3 4.000 . 5.000 4.658 4.640 4.663 . 0 0 "[ . 1 . 2]" 1
380 1 17 LYS HA 1 18 LYS H 2.500 . 3.000 2.285 2.270 2.371 . 0 0 "[ . 1 . 2]" 1
381 1 17 LYS HB2 1 18 LYS H 3.000 . 4.000 3.805 3.784 3.890 . 0 0 "[ . 1 . 2]" 1
382 1 17 LYS HB3 1 18 LYS H 3.000 . 4.000 3.711 3.610 3.764 . 0 0 "[ . 1 . 2]" 1
383 1 17 LYS HB3 1 29 VAL MG2 3.000 . 4.500 3.157 3.059 3.323 . 0 0 "[ . 1 . 2]" 1
384 1 17 LYS HG2 1 18 LYS H 2.500 . 3.000 2.431 2.354 2.516 . 0 0 "[ . 1 . 2]" 1
385 1 17 LYS HG2 1 18 LYS HA 4.000 . 4.300 4.312 4.258 4.477 0.177 6 0 "[ . 1 . 2]" 1
386 1 17 LYS HG3 1 18 LYS H 2.500 . 2.900 1.860 1.805 1.924 . 0 0 "[ . 1 . 2]" 1
387 1 17 LYS HG3 1 18 LYS HA 4.000 . 5.500 4.568 4.542 4.641 . 0 0 "[ . 1 . 2]" 1
388 1 18 LYS H 1 18 LYS QB 2.500 . 3.400 2.361 2.033 2.674 . 0 0 "[ . 1 . 2]" 1
389 1 18 LYS H 1 18 LYS QD 4.000 . 5.000 3.438 1.755 4.503 0.045 5 0 "[ . 1 . 2]" 1
390 1 18 LYS H 1 18 LYS HG2 3.000 . 4.200 3.131 1.798 4.325 0.125 20 0 "[ . 1 . 2]" 1
391 1 18 LYS H 1 18 LYS HG3 3.000 . 4.300 3.229 2.416 4.472 0.172 17 0 "[ . 1 . 2]" 1
392 1 18 LYS HA 1 18 LYS QB 2.500 . 2.800 2.358 2.152 2.519 . 0 0 "[ . 1 . 2]" 1
393 1 18 LYS HA 1 18 LYS HG2 3.000 . 3.500 3.095 2.322 3.653 0.153 2 0 "[ . 1 . 2]" 1
394 1 18 LYS HA 1 18 LYS HG3 3.000 . 4.000 3.171 2.315 4.144 0.144 6 0 "[ . 1 . 2]" 1
395 1 18 LYS HA 1 19 TYR H 2.500 . 2.800 2.516 2.497 2.532 . 0 0 "[ . 1 . 2]" 1
396 1 18 LYS HA 1 19 TYR HD1 2.500 . 2.900 2.696 2.645 2.739 . 0 0 "[ . 1 . 2]" 1
397 1 18 LYS QB 1 18 LYS QE 4.000 . 5.000 3.083 2.082 3.838 . 0 0 "[ . 1 . 2]" 1
398 1 18 LYS QB 1 19 TYR H 3.000 . 4.000 2.426 2.303 3.262 . 0 0 "[ . 1 . 2]" 1
399 1 18 LYS QD 1 19 TYR H 4.000 . 6.000 4.237 2.622 5.108 . 0 0 "[ . 1 . 2]" 1
400 1 18 LYS QE 1 18 LYS HG2 3.000 . 3.800 2.842 2.290 3.446 . 0 0 "[ . 1 . 2]" 1
401 1 18 LYS QE 1 18 LYS HG3 3.000 . 3.700 2.667 2.235 3.308 . 0 0 "[ . 1 . 2]" 1
402 1 18 LYS HG2 1 19 TYR H 4.000 . 4.800 3.981 1.875 4.778 . 0 0 "[ . 1 . 2]" 1
403 1 18 LYS HG3 1 19 TYR H 4.000 . 4.500 3.980 1.843 4.620 0.120 11 0 "[ . 1 . 2]" 1
404 1 19 TYR H 1 19 TYR QB 3.000 . 4.000 3.052 2.998 3.080 . 0 0 "[ . 1 . 2]" 1
405 1 19 TYR H 1 19 TYR HD1 2.500 . 2.800 2.083 1.981 2.159 . 0 0 "[ . 1 . 2]" 1
406 1 19 TYR H 1 19 TYR HE1 3.000 . 4.000 3.839 3.745 3.879 . 0 0 "[ . 1 . 2]" 1
407 1 19 TYR HA 1 19 TYR HD1 3.000 . 4.000 3.969 3.964 3.978 . 0 0 "[ . 1 . 2]" 1
408 1 19 TYR HA 1 19 TYR HD2 4.000 . 4.300 4.331 4.316 4.342 0.042 6 0 "[ . 1 . 2]" 1
409 1 19 TYR HA 1 20 ILE H 2.500 . 2.900 2.336 2.316 2.361 . 0 0 "[ . 1 . 2]" 1
410 1 19 TYR HA 1 20 ILE HB 4.000 . 4.600 4.600 4.530 4.630 0.030 14 0 "[ . 1 . 2]" 1
411 1 19 TYR HA 1 20 ILE MD 4.000 . 5.300 4.285 4.214 4.325 . 0 0 "[ . 1 . 2]" 1
412 1 19 TYR HA 1 20 ILE HG12 4.000 . 5.000 5.064 5.039 5.113 0.113 3 0 "[ . 1 . 2]" 1
413 1 19 TYR HA 1 20 ILE HG13 3.000 . 3.500 3.367 3.332 3.416 . 0 0 "[ . 1 . 2]" 1
414 1 19 TYR HA 1 28 CYS HA 4.000 . 4.600 4.476 4.391 4.626 0.026 6 0 "[ . 1 . 2]" 1
415 1 19 TYR HA 1 29 VAL H 3.000 . 4.500 4.092 4.049 4.179 . 0 0 "[ . 1 . 2]" 1
416 1 19 TYR HA 1 29 VAL HA 4.000 . 4.800 4.473 4.389 4.537 . 0 0 "[ . 1 . 2]" 1
417 1 19 TYR HA 1 29 VAL MG2 3.000 . 4.000 2.958 2.871 2.992 . 0 0 "[ . 1 . 2]" 1
418 1 19 TYR QB 1 19 TYR HD1 3.000 . 4.000 2.561 2.544 2.569 . 0 0 "[ . 1 . 2]" 1
419 1 19 TYR QB 1 19 TYR HD2 3.000 . 4.000 2.316 2.313 2.325 . 0 0 "[ . 1 . 2]" 1
420 1 19 TYR QB 1 20 ILE H 3.000 . 4.000 2.582 2.477 2.637 . 0 0 "[ . 1 . 2]" 1
421 1 19 TYR QB 1 26 PRO HB2 4.000 . 5.500 4.079 4.040 4.163 . 0 0 "[ . 1 . 2]" 1
422 1 19 TYR QB 1 26 PRO HB3 4.000 . 5.000 3.769 3.745 3.821 . 0 0 "[ . 1 . 2]" 1
423 1 19 TYR QB 1 27 TYR H 4.000 . 5.000 3.645 3.561 3.778 . 0 0 "[ . 1 . 2]" 1
424 1 19 TYR QB 1 28 CYS HA 4.000 . 5.000 3.799 3.766 3.841 . 0 0 "[ . 1 . 2]" 1
425 1 19 TYR HD2 1 20 ILE H 3.000 . 4.000 3.615 3.510 3.678 . 0 0 "[ . 1 . 2]" 1
426 1 19 TYR HD2 1 20 ILE HA 4.000 . 4.600 4.472 4.411 4.516 . 0 0 "[ . 1 . 2]" 1
427 1 19 TYR HD2 1 21 LEU HA 4.000 . 4.300 3.933 3.772 4.012 . 0 0 "[ . 1 . 2]" 1
428 1 19 TYR HD2 1 21 LEU MD1 3.000 . 4.000 2.855 2.739 2.989 . 0 0 "[ . 1 . 2]" 1
429 1 19 TYR HD2 1 21 LEU MD2 3.000 . 3.700 2.570 2.499 2.613 . 0 0 "[ . 1 . 2]" 1
430 1 19 TYR HD2 1 26 PRO HA 3.000 . 3.200 2.507 2.414 2.603 . 0 0 "[ . 1 . 2]" 1
431 1 19 TYR HD2 1 26 PRO HB2 3.000 . 3.500 3.513 3.490 3.547 0.047 2 0 "[ . 1 . 2]" 1
432 1 19 TYR HD2 1 26 PRO HB3 2.500 . 2.900 2.320 2.312 2.326 . 0 0 "[ . 1 . 2]" 1
433 1 19 TYR HD2 1 26 PRO HG3 4.000 . 4.500 4.497 4.480 4.510 0.010 15 0 "[ . 1 . 2]" 1
434 1 19 TYR HD2 1 27 TYR H 3.000 . 3.600 3.447 3.337 3.557 . 0 0 "[ . 1 . 2]" 1
435 1 19 TYR HE2 1 21 LEU MD1 2.500 . 2.900 2.089 2.067 2.138 . 0 0 "[ . 1 . 2]" 1
436 1 19 TYR HE2 1 21 LEU MD2 2.500 . 3.000 2.211 2.077 2.312 . 0 0 "[ . 1 . 2]" 1
437 1 19 TYR HE2 1 21 LEU HG 3.000 . 4.000 3.769 3.737 3.800 . 0 0 "[ . 1 . 2]" 1
438 1 19 TYR HE2 1 26 PRO HB2 4.000 . 5.000 4.639 4.514 4.702 . 0 0 "[ . 1 . 2]" 1
439 1 19 TYR HE2 1 26 PRO HB3 3.000 . 3.200 2.881 2.752 2.946 . 0 0 "[ . 1 . 2]" 1
440 1 19 TYR HE2 1 26 PRO HG3 3.000 . 4.000 3.952 3.800 4.006 0.006 17 0 "[ . 1 . 2]" 1
441 1 20 ILE H 1 20 ILE HB 2.500 . 2.800 2.506 2.449 2.545 . 0 0 "[ . 1 . 2]" 1
442 1 20 ILE H 1 20 ILE MD 3.000 . 4.200 3.379 3.331 3.415 . 0 0 "[ . 1 . 2]" 1
443 1 20 ILE H 1 20 ILE HG12 3.000 . 4.000 4.004 3.976 4.024 0.024 3 0 "[ . 1 . 2]" 1
444 1 20 ILE H 1 20 ILE HG13 2.500 . 3.000 2.625 2.586 2.668 . 0 0 "[ . 1 . 2]" 1
445 1 20 ILE H 1 20 ILE MG 3.000 . 4.500 3.806 3.780 3.823 . 0 0 "[ . 1 . 2]" 1
446 1 20 ILE H 1 21 LEU MD2 4.000 . 5.500 4.129 4.086 4.207 . 0 0 "[ . 1 . 2]" 1
447 1 20 ILE H 1 27 TYR H 3.000 . 4.000 3.449 3.361 3.539 . 0 0 "[ . 1 . 2]" 1
448 1 20 ILE H 1 28 CYS HA 4.000 . 4.800 4.676 4.620 4.716 . 0 0 "[ . 1 . 2]" 1
449 1 20 ILE H 1 29 VAL HA 4.000 . 4.300 4.331 4.205 4.370 0.070 8 0 "[ . 1 . 2]" 1
450 1 20 ILE HA 1 20 ILE MD 4.000 . 4.700 3.896 3.874 3.914 . 0 0 "[ . 1 . 2]" 1
451 1 20 ILE HA 1 20 ILE HG12 2.500 . 3.000 2.795 2.747 2.851 . 0 0 "[ . 1 . 2]" 1
452 1 20 ILE HA 1 20 ILE HG13 2.500 . 3.000 2.793 2.747 2.815 . 0 0 "[ . 1 . 2]" 1
453 1 20 ILE HA 1 20 ILE MG 2.500 . 3.200 2.308 2.287 2.346 . 0 0 "[ . 1 . 2]" 1
454 1 20 ILE HA 1 21 LEU H 2.500 . 3.000 2.255 2.237 2.265 . 0 0 "[ . 1 . 2]" 1
455 1 20 ILE HA 1 21 LEU HB2 4.000 . 4.800 4.682 4.672 4.702 . 0 0 "[ . 1 . 2]" 1
456 1 20 ILE HA 1 21 LEU MD2 3.000 . 3.800 2.867 2.805 2.975 . 0 0 "[ . 1 . 2]" 1
457 1 20 ILE HB 1 20 ILE MD 3.000 . 4.000 2.248 2.216 2.269 . 0 0 "[ . 1 . 2]" 1
458 1 20 ILE HB 1 21 LEU H 4.000 . 4.300 4.064 4.016 4.142 . 0 0 "[ . 1 . 2]" 1
459 1 20 ILE HB 1 27 TYR H 4.000 . 4.300 4.019 3.828 4.117 . 0 0 "[ . 1 . 2]" 1
460 1 20 ILE HB 1 27 TYR QB 4.000 . 5.000 3.514 3.319 3.621 . 0 0 "[ . 1 . 2]" 1
461 1 20 ILE HB 1 32 PHE HB2 3.000 . 3.500 3.188 3.099 3.304 . 0 0 "[ . 1 . 2]" 1
462 1 20 ILE HB 1 32 PHE HB3 4.000 . 4.300 4.267 3.987 4.349 0.049 17 0 "[ . 1 . 2]" 1
463 1 20 ILE HB 1 32 PHE HD2 3.000 . 3.500 3.306 3.107 3.536 0.036 6 0 "[ . 1 . 2]" 1
464 1 20 ILE MD 1 29 VAL HA 3.000 . 3.500 2.629 2.571 2.693 . 0 0 "[ . 1 . 2]" 1
465 1 20 ILE MD 1 29 VAL MG1 4.000 . 4.700 2.955 2.872 3.002 . 0 0 "[ . 1 . 2]" 1
466 1 20 ILE MD 1 32 PHE H 4.000 . 5.500 4.154 4.015 4.273 . 0 0 "[ . 1 . 2]" 1
467 1 20 ILE MD 1 32 PHE HB2 3.000 . 3.500 2.613 2.445 2.804 . 0 0 "[ . 1 . 2]" 1
468 1 20 ILE MD 1 32 PHE HB3 3.000 . 3.500 2.555 2.468 2.682 . 0 0 "[ . 1 . 2]" 1
469 1 20 ILE MD 1 32 PHE HD1 4.000 . 5.000 3.551 3.352 3.702 . 0 0 "[ . 1 . 2]" 1
470 1 20 ILE MD 1 32 PHE HE1 4.000 . 5.800 4.366 4.217 4.574 . 0 0 "[ . 1 . 2]" 1
471 1 20 ILE HG12 1 21 LEU H 4.000 . 4.800 4.535 4.498 4.583 . 0 0 "[ . 1 . 2]" 1
472 1 20 ILE HG13 1 21 LEU H 4.000 . 5.000 4.898 4.872 4.911 . 0 0 "[ . 1 . 2]" 1
473 1 20 ILE MG 1 21 LEU H 2.500 . 3.000 2.441 2.405 2.500 . 0 0 "[ . 1 . 2]" 1
474 1 20 ILE MG 1 21 LEU HB2 4.000 . 5.200 4.112 4.075 4.132 . 0 0 "[ . 1 . 2]" 1
475 1 20 ILE MG 1 22 ARG H 4.000 . 5.300 3.909 3.625 4.052 . 0 0 "[ . 1 . 2]" 1
476 1 20 ILE MG 1 22 ARG HA 4.000 . 5.200 3.746 3.411 3.940 . 0 0 "[ . 1 . 2]" 1
477 1 20 ILE MG 1 22 ARG HB2 4.000 . 4.500 3.267 2.822 3.453 . 0 0 "[ . 1 . 2]" 1
478 1 20 ILE MG 1 22 ARG HD3 4.000 . 5.300 4.167 3.763 4.329 . 0 0 "[ . 1 . 2]" 1
479 1 20 ILE MG 1 32 PHE HB2 4.000 . 4.600 3.691 3.525 3.764 . 0 0 "[ . 1 . 2]" 1
480 1 20 ILE MG 1 32 PHE HD2 3.000 . 3.300 2.543 2.398 2.654 . 0 0 "[ . 1 . 2]" 1
481 1 20 ILE MG 1 32 PHE HE2 3.000 . 3.800 2.853 2.674 3.062 . 0 0 "[ . 1 . 2]" 1
482 1 21 LEU H 1 21 LEU HB2 2.500 . 2.700 2.473 2.459 2.480 . 0 0 "[ . 1 . 2]" 1
483 1 21 LEU H 1 21 LEU HB3 3.000 . 3.800 3.688 3.679 3.694 . 0 0 "[ . 1 . 2]" 1
484 1 21 LEU H 1 21 LEU MD1 4.000 . 4.500 3.804 3.778 3.841 . 0 0 "[ . 1 . 2]" 1
485 1 21 LEU H 1 21 LEU MD2 2.500 . 3.000 1.905 1.877 1.919 . 0 0 "[ . 1 . 2]" 1
486 1 21 LEU H 1 21 LEU HG 3.000 . 4.000 3.950 3.923 3.968 . 0 0 "[ . 1 . 2]" 1
487 1 21 LEU HA 1 21 LEU HB2 2.500 . 3.100 3.036 3.034 3.037 . 0 0 "[ . 1 . 2]" 1
488 1 21 LEU HA 1 21 LEU HB3 2.500 . 2.800 2.508 2.501 2.518 . 0 0 "[ . 1 . 2]" 1
489 1 21 LEU HA 1 21 LEU MD1 2.500 . 3.200 2.164 2.152 2.175 . 0 0 "[ . 1 . 2]" 1
490 1 21 LEU HA 1 21 LEU MD2 3.000 . 3.500 2.630 2.545 2.684 . 0 0 "[ . 1 . 2]" 1
491 1 21 LEU HA 1 21 LEU HG 3.000 . 4.000 3.729 3.714 3.740 . 0 0 "[ . 1 . 2]" 1
492 1 21 LEU HA 1 22 ARG H 2.500 . 2.900 2.156 2.124 2.173 . 0 0 "[ . 1 . 2]" 1
493 1 21 LEU HA 1 24 GLU HA 4.000 . 5.000 4.955 4.893 5.022 0.022 7 0 "[ . 1 . 2]" 1
494 1 21 LEU HA 1 25 SER H 3.000 . 4.000 3.488 3.382 3.642 . 0 0 "[ . 1 . 2]" 1
495 1 21 LEU HA 1 26 PRO HA 2.500 . 3.000 2.519 2.338 2.662 . 0 0 "[ . 1 . 2]" 1
496 1 21 LEU HA 1 27 TYR H 3.000 . 3.600 3.474 3.396 3.539 . 0 0 "[ . 1 . 2]" 1
497 1 21 LEU HB2 1 21 LEU MD1 3.000 . 3.800 3.205 3.201 3.207 . 0 0 "[ . 1 . 2]" 1
498 1 21 LEU HB2 1 21 LEU MD2 2.500 . 3.000 2.377 2.360 2.396 . 0 0 "[ . 1 . 2]" 1
499 1 21 LEU HB2 1 22 ARG H 4.000 . 4.500 4.372 4.356 4.393 . 0 0 "[ . 1 . 2]" 1
500 1 21 LEU HB3 1 21 LEU MD1 2.500 . 3.000 2.232 2.218 2.243 . 0 0 "[ . 1 . 2]" 1
501 1 21 LEU HB3 1 21 LEU MD2 3.000 . 3.800 3.212 3.205 3.215 . 0 0 "[ . 1 . 2]" 1
502 1 21 LEU HB3 1 22 ARG H 3.000 . 3.500 3.609 3.564 3.690 0.190 1 0 "[ . 1 . 2]" 1
503 1 21 LEU HB3 1 24 GLU HA 3.000 . 3.500 2.930 2.876 3.010 . 0 0 "[ . 1 . 2]" 1
504 1 21 LEU HB3 1 25 SER HA 3.000 . 4.500 4.505 4.331 4.601 0.101 11 0 "[ . 1 . 2]" 1
505 1 21 LEU MD1 1 22 ARG H 4.000 . 4.500 3.681 3.670 3.701 . 0 0 "[ . 1 . 2]" 1
506 1 21 LEU MD1 1 24 GLU HA 4.000 . 5.000 3.880 3.759 3.998 . 0 0 "[ . 1 . 2]" 1
507 1 21 LEU MD1 1 25 SER H 4.000 . 4.800 3.438 3.319 3.605 . 0 0 "[ . 1 . 2]" 1
508 1 21 LEU MD1 1 26 PRO HA 3.000 . 3.300 2.236 2.206 2.271 . 0 0 "[ . 1 . 2]" 1
509 1 21 LEU MD1 1 26 PRO HB3 3.000 . 3.700 2.823 2.735 2.911 . 0 0 "[ . 1 . 2]" 1
510 1 21 LEU MD1 1 26 PRO HD3 3.000 . 3.500 2.508 2.341 2.594 . 0 0 "[ . 1 . 2]" 1
511 1 21 LEU MD1 1 26 PRO HG3 3.000 . 4.200 3.349 3.175 3.455 . 0 0 "[ . 1 . 2]" 1
512 1 21 LEU MD2 1 26 PRO HA 4.000 . 5.000 3.249 3.141 3.333 . 0 0 "[ . 1 . 2]" 1
513 1 21 LEU MD2 1 26 PRO HB3 4.000 . 5.000 3.886 3.716 3.970 . 0 0 "[ . 1 . 2]" 1
514 1 22 ARG H 1 22 ARG HB2 2.500 . 3.000 2.867 2.769 3.031 0.031 6 0 "[ . 1 . 2]" 1
515 1 22 ARG H 1 22 ARG HB3 2.500 . 3.000 2.623 2.405 2.751 . 0 0 "[ . 1 . 2]" 1
516 1 22 ARG H 1 22 ARG HG2 4.000 . 4.800 4.798 4.702 4.848 0.048 12 0 "[ . 1 . 2]" 1
517 1 22 ARG H 1 25 SER H 3.000 . 4.000 2.694 2.565 2.931 . 0 0 "[ . 1 . 2]" 1
518 1 22 ARG H 1 27 TYR HD2 4.000 . 5.500 4.966 4.760 5.278 . 0 0 "[ . 1 . 2]" 1
519 1 22 ARG HA 1 22 ARG HB2 2.500 . 2.800 2.539 2.427 2.602 . 0 0 "[ . 1 . 2]" 1
520 1 22 ARG HA 1 22 ARG HB3 3.000 . 3.200 3.017 3.010 3.027 . 0 0 "[ . 1 . 2]" 1
521 1 22 ARG HA 1 22 ARG HD2 2.500 . 3.300 2.172 2.000 2.270 . 0 0 "[ . 1 . 2]" 1
522 1 22 ARG HA 1 22 ARG HD3 3.000 . 3.500 3.432 2.821 3.718 0.218 12 0 "[ . 1 . 2]" 1
523 1 22 ARG HA 1 22 ARG HG2 3.000 . 3.800 3.705 3.653 3.778 . 0 0 "[ . 1 . 2]" 1
524 1 22 ARG HA 1 22 ARG HG3 2.500 . 3.000 2.843 2.637 3.268 0.268 2 0 "[ . 1 . 2]" 1
525 1 22 ARG HA 1 23 GLU H 2.500 . 2.800 2.252 2.243 2.267 . 0 0 "[ . 1 . 2]" 1
526 1 22 ARG HA 1 23 GLU HA 3.000 . 4.500 4.493 4.481 4.504 0.004 15 0 "[ . 1 . 2]" 1
527 1 22 ARG HA 1 23 GLU QG 4.000 . 5.000 4.235 4.138 4.415 . 0 0 "[ . 1 . 2]" 1
528 1 22 ARG HA 1 24 GLU H 3.000 . 3.500 3.460 3.381 3.634 0.134 12 0 "[ . 1 . 2]" 1
529 1 22 ARG HB2 1 22 ARG HD2 3.000 . 4.000 2.706 2.376 3.173 . 0 0 "[ . 1 . 2]" 1
530 1 22 ARG HB2 1 22 ARG HD3 3.000 . 4.000 2.740 2.319 3.019 . 0 0 "[ . 1 . 2]" 1
531 1 22 ARG HB2 1 27 TYR HD2 3.000 . 3.500 3.005 2.822 3.324 . 0 0 "[ . 1 . 2]" 1
532 1 22 ARG HB2 1 27 TYR HE2 3.000 . 4.500 4.133 3.873 4.509 0.009 1 0 "[ . 1 . 2]" 1
533 1 22 ARG HB2 1 32 PHE HD2 3.000 . 3.500 3.009 2.322 3.313 . 0 0 "[ . 1 . 2]" 1
534 1 22 ARG HB2 1 32 PHE HE2 4.000 . 4.500 4.367 3.842 4.546 0.046 15 0 "[ . 1 . 2]" 1
535 1 22 ARG HB3 1 22 ARG HD2 3.000 . 4.000 3.673 3.572 3.854 . 0 0 "[ . 1 . 2]" 1
536 1 22 ARG HB3 1 22 ARG HD3 3.000 . 4.000 3.810 3.573 3.978 . 0 0 "[ . 1 . 2]" 1
537 1 22 ARG HB3 1 27 TYR HD2 3.000 . 3.500 2.925 2.823 3.074 . 0 0 "[ . 1 . 2]" 1
538 1 22 ARG HB3 1 27 TYR HE2 3.000 . 3.500 3.250 2.896 3.761 0.261 2 0 "[ . 1 . 2]" 1
539 1 22 ARG HD2 1 32 PHE HD2 3.000 . 4.000 3.699 3.093 4.138 0.138 2 0 "[ . 1 . 2]" 1
540 1 22 ARG HD2 1 32 PHE HE2 3.000 . 4.500 3.365 2.859 3.921 . 0 0 "[ . 1 . 2]" 1
541 1 22 ARG HD2 1 36 PHE HE2 3.000 . 4.000 3.839 3.681 4.053 0.053 6 0 "[ . 1 . 2]" 1
542 1 22 ARG HD3 1 27 TYR HD2 3.000 . 4.300 4.079 3.742 4.303 0.003 2 0 "[ . 1 . 2]" 1
543 1 22 ARG HD3 1 27 TYR HE2 4.000 . 4.800 4.495 4.341 4.660 . 0 0 "[ . 1 . 2]" 1
544 1 22 ARG HD3 1 32 PHE HD2 3.000 . 3.500 2.930 2.505 3.305 . 0 0 "[ . 1 . 2]" 1
545 1 22 ARG HD3 1 32 PHE HE2 3.000 . 3.500 3.023 2.657 3.455 . 0 0 "[ . 1 . 2]" 1
546 1 22 ARG HD3 1 36 PHE HE2 3.000 . 3.500 2.354 2.313 2.534 . 0 0 "[ . 1 . 2]" 1
547 1 22 ARG HD3 1 36 PHE HZ 3.000 . 3.800 2.564 2.301 3.072 . 0 0 "[ . 1 . 2]" 1
548 1 22 ARG HG2 1 23 GLU QG 4.000 . 5.000 3.597 3.464 3.778 . 0 0 "[ . 1 . 2]" 1
549 1 22 ARG HG2 1 27 TYR HE2 2.500 . 3.000 2.351 2.306 2.428 . 0 0 "[ . 1 . 2]" 1
550 1 22 ARG HG2 1 32 PHE HD2 3.000 . 4.800 4.242 3.574 4.591 . 0 0 "[ . 1 . 2]" 1
551 1 22 ARG HG2 1 32 PHE HE2 4.000 . 5.300 5.201 4.812 5.361 0.061 18 0 "[ . 1 . 2]" 1
552 1 22 ARG HG3 1 23 GLU QG 3.000 . 3.700 2.334 2.297 2.401 . 0 0 "[ . 1 . 2]" 1
553 1 22 ARG HG3 1 27 TYR HD2 4.000 . 5.000 4.210 3.609 4.503 . 0 0 "[ . 1 . 2]" 1
554 1 22 ARG HG3 1 27 TYR HE2 3.000 . 3.500 3.397 2.846 3.670 0.170 9 0 "[ . 1 . 2]" 1
555 1 23 GLU H 1 23 GLU HA 2.500 . 2.800 2.358 2.353 2.361 . 0 0 "[ . 1 . 2]" 1
556 1 23 GLU H 1 23 GLU HB2 3.000 . 4.000 3.448 3.392 3.487 . 0 0 "[ . 1 . 2]" 1
557 1 23 GLU H 1 23 GLU HB3 3.000 . 4.200 4.100 4.089 4.126 . 0 0 "[ . 1 . 2]" 1
558 1 23 GLU H 1 23 GLU QG 3.000 . 4.000 2.688 2.595 2.877 . 0 0 "[ . 1 . 2]" 1
559 1 23 GLU HA 1 23 GLU QG 3.000 . 4.000 2.475 2.258 2.719 . 0 0 "[ . 1 . 2]" 1
560 1 23 GLU HA 1 24 GLU H 3.000 . 3.300 2.869 2.734 2.915 . 0 0 "[ . 1 . 2]" 1
561 1 23 GLU HA 1 24 GLU QG 3.000 . 4.500 3.192 3.062 3.962 . 0 0 "[ . 1 . 2]" 1
562 1 23 GLU HB2 1 24 GLU H 3.000 . 4.500 4.145 4.088 4.278 . 0 0 "[ . 1 . 2]" 1
563 1 23 GLU HB2 1 25 SER H 3.000 . 4.000 3.942 3.711 4.031 0.031 19 0 "[ . 1 . 2]" 1
564 1 23 GLU HB3 1 24 GLU H 3.000 . 4.500 4.426 4.403 4.440 . 0 0 "[ . 1 . 2]" 1
565 1 23 GLU HB3 1 25 SER H 4.000 . 5.000 4.855 4.549 4.999 . 0 0 "[ . 1 . 2]" 1
566 1 24 GLU H 1 24 GLU QB 3.000 . 4.000 3.402 2.984 3.468 . 0 0 "[ . 1 . 2]" 1
567 1 24 GLU H 1 24 GLU QG 3.000 . 4.200 2.805 2.589 3.394 . 0 0 "[ . 1 . 2]" 1
568 1 24 GLU H 1 25 SER H 3.000 . 4.500 2.682 2.601 2.885 . 0 0 "[ . 1 . 2]" 1
569 1 24 GLU HA 1 24 GLU QG 3.000 . 4.400 2.793 2.489 3.361 . 0 0 "[ . 1 . 2]" 1
570 1 24 GLU HA 1 25 SER H 3.000 . 3.500 2.878 2.794 2.928 . 0 0 "[ . 1 . 2]" 1
571 1 25 SER H 1 25 SER HB2 3.000 . 3.500 3.102 3.071 3.139 . 0 0 "[ . 1 . 2]" 1
572 1 25 SER H 1 25 SER HB3 3.000 . 4.000 3.979 3.964 3.985 . 0 0 "[ . 1 . 2]" 1
573 1 25 SER HA 1 25 SER HB2 3.000 . 3.300 3.004 2.999 3.007 . 0 0 "[ . 1 . 2]" 1
574 1 25 SER HA 1 25 SER HB3 2.500 . 2.800 2.339 2.328 2.347 . 0 0 "[ . 1 . 2]" 1
575 1 25 SER HA 1 26 PRO HD2 2.500 . 2.800 2.328 2.319 2.339 . 0 0 "[ . 1 . 2]" 1
576 1 25 SER HA 1 26 PRO HD3 2.500 . 2.800 2.245 2.237 2.262 . 0 0 "[ . 1 . 2]" 1
577 1 25 SER HA 1 26 PRO HG2 4.000 . 4.500 4.501 4.492 4.510 0.010 5 0 "[ . 1 . 2]" 1
578 1 25 SER HA 1 26 PRO HG3 4.000 . 4.500 4.439 4.431 4.455 . 0 0 "[ . 1 . 2]" 1
579 1 25 SER HB2 1 27 TYR HD1 3.000 . 4.200 3.640 3.403 3.817 . 0 0 "[ . 1 . 2]" 1
580 1 25 SER HB2 1 27 TYR HE1 3.000 . 3.300 3.012 2.792 3.200 . 0 0 "[ . 1 . 2]" 1
581 1 25 SER HB3 1 26 PRO HD2 2.500 . 3.000 2.629 2.524 2.689 . 0 0 "[ . 1 . 2]" 1
582 1 25 SER HB3 1 26 PRO HD3 3.000 . 4.300 3.846 3.771 3.890 . 0 0 "[ . 1 . 2]" 1
583 1 25 SER HB3 1 26 PRO HG2 4.000 . 5.000 4.690 4.582 4.746 . 0 0 "[ . 1 . 2]" 1
584 1 25 SER HB3 1 27 TYR HD1 4.000 . 4.600 4.556 4.515 4.595 . 0 0 "[ . 1 . 2]" 1
585 1 25 SER HB3 1 27 TYR HE1 3.000 . 4.000 4.048 4.009 4.135 0.135 1 0 "[ . 1 . 2]" 1
586 1 26 PRO HA 1 26 PRO HD3 3.000 . 3.800 3.614 3.588 3.630 . 0 0 "[ . 1 . 2]" 1
587 1 26 PRO HA 1 26 PRO HG3 3.000 . 4.000 3.846 3.830 3.858 . 0 0 "[ . 1 . 2]" 1
588 1 26 PRO HA 1 27 TYR H 2.500 . 2.800 2.183 2.169 2.205 . 0 0 "[ . 1 . 2]" 1
589 1 26 PRO HA 1 27 TYR QB 4.000 . 5.500 4.256 4.224 4.273 . 0 0 "[ . 1 . 2]" 1
590 1 26 PRO HA 1 27 TYR HD1 4.000 . 5.000 4.598 4.393 4.714 . 0 0 "[ . 1 . 2]" 1
591 1 26 PRO HB2 1 26 PRO HD2 3.000 . 3.800 3.871 3.860 3.879 0.079 1 0 "[ . 1 . 2]" 1
592 1 26 PRO HB2 1 26 PRO HD3 4.000 . 5.000 4.073 4.066 4.078 . 0 0 "[ . 1 . 2]" 1
593 1 26 PRO HB2 1 27 TYR H 3.000 . 3.800 3.714 3.692 3.747 . 0 0 "[ . 1 . 2]" 1
594 1 26 PRO HB2 1 27 TYR HA 4.000 . 4.500 4.369 4.356 4.388 . 0 0 "[ . 1 . 2]" 1
595 1 26 PRO HB3 1 26 PRO HD2 4.000 . 5.000 4.063 4.060 4.069 . 0 0 "[ . 1 . 2]" 1
596 1 26 PRO HB3 1 26 PRO HD3 3.000 . 4.000 3.466 3.451 3.484 . 0 0 "[ . 1 . 2]" 1
597 1 26 PRO HB3 1 27 TYR H 3.000 . 4.000 3.918 3.896 3.944 . 0 0 "[ . 1 . 2]" 1
598 1 27 TYR H 1 27 TYR QB 3.000 . 4.000 2.420 2.386 2.443 . 0 0 "[ . 1 . 2]" 1
599 1 27 TYR H 1 27 TYR HD1 3.000 . 3.800 3.715 3.544 3.815 0.015 8 0 "[ . 1 . 2]" 1
600 1 27 TYR H 1 27 TYR HD2 4.000 . 5.000 5.137 5.065 5.253 0.253 3 0 "[ . 1 . 2]" 1
601 1 27 TYR HA 1 27 TYR HD1 3.000 . 3.300 2.114 2.059 2.209 . 0 0 "[ . 1 . 2]" 1
602 1 27 TYR HA 1 27 TYR HE1 4.000 . 4.500 4.441 4.431 4.450 . 0 0 "[ . 1 . 2]" 1
603 1 27 TYR HA 1 28 CYS H 2.500 . 2.900 2.291 2.275 2.316 . 0 0 "[ . 1 . 2]" 1
604 1 27 TYR HA 1 28 CYS HA 4.000 . 4.500 4.392 4.385 4.402 . 0 0 "[ . 1 . 2]" 1
605 1 27 TYR HA 1 28 CYS HB3 4.000 . 4.600 4.719 4.698 4.748 0.148 1 0 "[ . 1 . 2]" 1
606 1 27 TYR HA 1 31 CYS HB2 3.000 . 4.000 3.851 3.774 3.940 . 0 0 "[ . 1 . 2]" 1
607 1 27 TYR QB 1 27 TYR HD1 3.000 . 3.300 3.140 3.075 3.169 . 0 0 "[ . 1 . 2]" 1
608 1 27 TYR QB 1 27 TYR HD2 2.500 . 2.800 2.352 2.316 2.371 . 0 0 "[ . 1 . 2]" 1
609 1 27 TYR QB 1 27 TYR HE2 4.000 2.800 5.000 4.278 4.256 4.291 . 0 0 "[ . 1 . 2]" 1
610 1 27 TYR QB 1 28 CYS H 3.000 . 4.000 3.032 2.982 3.086 . 0 0 "[ . 1 . 2]" 1
611 1 27 TYR QB 1 32 PHE H 3.000 . 4.000 2.829 2.622 2.907 . 0 0 "[ . 1 . 2]" 1
612 1 27 TYR HD1 1 28 CYS H 4.000 . 4.300 4.280 4.177 4.436 0.136 7 0 "[ . 1 . 2]" 1
613 1 27 TYR HD2 1 31 CYS HB2 3.000 . 4.300 4.055 3.631 4.313 0.013 19 0 "[ . 1 . 2]" 1
614 1 27 TYR HD2 1 31 CYS HB3 3.000 . 3.500 2.890 2.458 3.193 . 0 0 "[ . 1 . 2]" 1
615 1 27 TYR HD2 1 32 PHE HA 3.000 . 4.000 3.438 3.114 3.602 . 0 0 "[ . 1 . 2]" 1
616 1 27 TYR HD2 1 35 LEU MD1 3.000 . 3.500 2.569 2.379 2.718 . 0 0 "[ . 1 . 2]" 1
617 1 27 TYR HE2 1 31 CYS HB3 4.000 . 5.000 4.401 4.018 4.646 . 0 0 "[ . 1 . 2]" 1
618 1 27 TYR HE2 1 35 LEU MD1 3.000 . 3.800 2.512 2.215 2.714 . 0 0 "[ . 1 . 2]" 1
619 1 28 CYS H 1 28 CYS HA 2.500 . 2.900 2.885 2.876 2.900 . 0 0 "[ . 1 . 2]" 1
620 1 28 CYS H 1 28 CYS HB2 3.000 . 3.800 3.654 3.647 3.670 . 0 0 "[ . 1 . 2]" 1
621 1 28 CYS H 1 28 CYS HB3 2.500 . 2.900 2.649 2.625 2.686 . 0 0 "[ . 1 . 2]" 1
622 1 28 CYS H 1 31 CYS HB2 2.500 . 3.000 2.749 2.724 2.778 . 0 0 "[ . 1 . 2]" 1
623 1 28 CYS H 1 31 CYS HB3 3.000 . 4.100 4.102 4.038 4.151 0.051 15 0 "[ . 1 . 2]" 1
624 1 28 CYS H 1 32 PHE H 4.000 . 4.500 4.697 4.645 4.741 0.241 3 0 "[ . 1 . 2]" 1
625 1 28 CYS HA 1 28 CYS HB2 2.500 . 2.900 2.465 2.460 2.471 . 0 0 "[ . 1 . 2]" 1
626 1 28 CYS HA 1 28 CYS HB3 2.500 . 2.900 2.473 2.467 2.476 . 0 0 "[ . 1 . 2]" 1
627 1 28 CYS HA 1 29 VAL H 2.500 . 2.700 2.318 2.309 2.331 . 0 0 "[ . 1 . 2]" 1
628 1 28 CYS HA 1 29 VAL HA 4.000 . 4.500 4.377 4.368 4.382 . 0 0 "[ . 1 . 2]" 1
629 1 28 CYS HA 1 29 VAL MG2 4.000 . 4.800 3.575 3.566 3.589 . 0 0 "[ . 1 . 2]" 1
630 1 28 CYS HA 1 30 VAL H 4.000 . 4.800 4.518 4.452 4.670 . 0 0 "[ . 1 . 2]" 1
631 1 28 CYS HA 1 31 CYS H 4.000 . 5.000 4.724 4.686 4.779 . 0 0 "[ . 1 . 2]" 1
632 1 28 CYS HB2 1 29 VAL H 2.500 . 3.000 2.873 2.851 2.898 . 0 0 "[ . 1 . 2]" 1
633 1 28 CYS HB2 1 29 VAL MG2 4.000 . 5.000 3.925 3.916 3.931 . 0 0 "[ . 1 . 2]" 1
634 1 28 CYS HB2 1 30 VAL H 3.000 . 3.600 3.303 3.222 3.496 . 0 0 "[ . 1 . 2]" 1
635 1 28 CYS HB2 1 30 VAL MG2 4.000 . 4.600 3.200 3.048 3.448 . 0 0 "[ . 1 . 2]" 1
636 1 28 CYS HB2 1 31 CYS H 3.000 . 4.000 3.832 3.788 3.880 . 0 0 "[ . 1 . 2]" 1
637 1 28 CYS HB3 1 29 VAL H 3.000 . 4.000 4.047 4.038 4.065 0.065 2 0 "[ . 1 . 2]" 1
638 1 28 CYS HB3 1 30 VAL H 4.000 . 5.300 4.871 4.793 5.064 . 0 0 "[ . 1 . 2]" 1
639 1 28 CYS HB3 1 31 CYS H 4.000 . 4.700 4.428 4.375 4.518 . 0 0 "[ . 1 . 2]" 1
640 1 29 VAL H 1 29 VAL HA 2.500 . 2.900 2.755 2.747 2.761 . 0 0 "[ . 1 . 2]" 1
641 1 29 VAL H 1 29 VAL HB 2.500 . 2.900 2.831 2.816 2.854 . 0 0 "[ . 1 . 2]" 1
642 1 29 VAL H 1 29 VAL MG1 3.000 . 4.200 3.696 3.693 3.698 . 0 0 "[ . 1 . 2]" 1
643 1 29 VAL H 1 29 VAL MG2 2.500 . 2.700 1.754 1.743 1.759 0.057 6 0 "[ . 1 . 2]" 1
644 1 29 VAL H 1 30 VAL H 3.000 . 3.200 3.022 2.978 3.127 . 0 0 "[ . 1 . 2]" 1
645 1 29 VAL HA 1 29 VAL HB 2.500 . 3.100 3.024 3.022 3.026 . 0 0 "[ . 1 . 2]" 1
646 1 29 VAL HA 1 29 VAL MG1 2.500 . 3.000 2.264 2.236 2.289 . 0 0 "[ . 1 . 2]" 1
647 1 29 VAL HA 1 29 VAL MG2 2.500 . 3.000 2.434 2.425 2.444 . 0 0 "[ . 1 . 2]" 1
648 1 29 VAL HA 1 32 PHE H 3.000 . 4.000 3.947 3.874 4.020 0.020 6 0 "[ . 1 . 2]" 1
649 1 29 VAL HA 1 32 PHE HB2 3.000 . 4.000 3.935 3.804 4.107 0.107 4 0 "[ . 1 . 2]" 1
650 1 29 VAL HA 1 32 PHE HB3 3.000 . 3.600 3.410 3.256 3.632 0.032 6 0 "[ . 1 . 2]" 1
651 1 29 VAL HB 1 30 VAL H 2.500 . 2.700 2.192 2.116 2.225 . 0 0 "[ . 1 . 2]" 1
652 1 29 VAL HB 1 30 VAL MG2 3.000 . 4.200 3.014 2.967 3.045 . 0 0 "[ . 1 . 2]" 1
653 1 29 VAL MG1 1 30 VAL H 3.000 . 4.000 3.437 3.368 3.474 . 0 0 "[ . 1 . 2]" 1
654 1 29 VAL MG1 1 33 GLU H 4.000 . 5.500 4.035 3.923 4.192 . 0 0 "[ . 1 . 2]" 1
655 1 29 VAL MG1 1 33 GLU HG2 4.000 . 5.200 3.110 2.823 3.654 . 0 0 "[ . 1 . 2]" 1
656 1 29 VAL MG1 1 33 GLU HG3 4.000 . 5.000 2.725 2.563 3.109 . 0 0 "[ . 1 . 2]" 1
657 1 29 VAL MG2 1 30 VAL H 3.000 . 4.100 3.431 3.419 3.448 . 0 0 "[ . 1 . 2]" 1
658 1 30 VAL H 1 30 VAL HA 2.500 . 2.900 2.765 2.756 2.771 . 0 0 "[ . 1 . 2]" 1
659 1 30 VAL H 1 30 VAL HB 2.500 . 3.000 2.813 2.804 2.825 . 0 0 "[ . 1 . 2]" 1
660 1 30 VAL H 1 30 VAL MG1 3.000 . 4.200 3.697 3.693 3.699 . 0 0 "[ . 1 . 2]" 1
661 1 30 VAL H 1 30 VAL MG2 2.500 . 3.000 1.757 1.752 1.762 0.048 7 0 "[ . 1 . 2]" 1
662 1 30 VAL H 1 31 CYS H 2.500 . 3.300 3.067 3.052 3.092 . 0 0 "[ . 1 . 2]" 1
663 1 30 VAL H 1 31 CYS HB2 4.000 . 5.000 4.916 4.897 4.952 . 0 0 "[ . 1 . 2]" 1
664 1 30 VAL H 1 32 PHE H 4.000 . 5.000 4.900 4.846 4.981 . 0 0 "[ . 1 . 2]" 1
665 1 30 VAL HA 1 30 VAL HB 2.500 . 3.200 3.020 3.019 3.021 . 0 0 "[ . 1 . 2]" 1
666 1 30 VAL HA 1 30 VAL MG1 2.500 . 2.800 2.258 2.231 2.290 . 0 0 "[ . 1 . 2]" 1
667 1 30 VAL HA 1 30 VAL MG2 2.500 . 3.000 2.440 2.429 2.448 . 0 0 "[ . 1 . 2]" 1
668 1 30 VAL HA 1 31 CYS H 3.000 . 3.800 3.605 3.599 3.608 . 0 0 "[ . 1 . 2]" 1
669 1 30 VAL HA 1 32 PHE H 4.000 . 5.600 5.010 4.979 5.066 . 0 0 "[ . 1 . 2]" 1
670 1 30 VAL HA 1 33 GLU H 3.000 . 3.500 3.566 3.543 3.608 0.108 4 0 "[ . 1 . 2]" 1
671 1 30 VAL HA 1 33 GLU HB2 3.000 . 4.500 2.713 2.546 3.073 . 0 0 "[ . 1 . 2]" 1
672 1 30 VAL HA 1 33 GLU HG2 4.000 . 5.000 4.226 4.019 4.699 . 0 0 "[ . 1 . 2]" 1
673 1 30 VAL HA 1 33 GLU HG3 3.000 . 4.500 3.504 2.906 3.789 . 0 0 "[ . 1 . 2]" 1
674 1 30 VAL HA 1 34 THR H 3.000 . 4.000 3.369 3.193 3.511 . 0 0 "[ . 1 . 2]" 1
675 1 30 VAL HB 1 31 CYS H 2.500 . 2.700 2.278 2.251 2.314 . 0 0 "[ . 1 . 2]" 1
676 1 30 VAL HB 1 31 CYS HA 3.000 . 4.000 4.024 4.011 4.031 0.031 20 0 "[ . 1 . 2]" 1
677 1 30 VAL MG1 1 31 CYS H 3.000 . 4.200 3.494 3.473 3.505 . 0 0 "[ . 1 . 2]" 1
678 1 30 VAL MG1 1 34 THR HB 3.000 . 4.300 2.405 2.270 2.534 . 0 0 "[ . 1 . 2]" 1
679 1 30 VAL MG2 1 31 CYS H 3.000 . 4.200 3.512 3.491 3.540 . 0 0 "[ . 1 . 2]" 1
680 1 31 CYS H 1 31 CYS HA 2.500 . 3.000 2.775 2.768 2.782 . 0 0 "[ . 1 . 2]" 1
681 1 31 CYS H 1 31 CYS HB2 2.500 . 2.700 2.285 2.277 2.299 . 0 0 "[ . 1 . 2]" 1
682 1 31 CYS H 1 31 CYS HB3 3.000 . 3.500 3.582 3.578 3.590 0.090 3 0 "[ . 1 . 2]" 1
683 1 31 CYS HA 1 31 CYS HB2 3.000 . 3.200 2.976 2.967 2.984 . 0 0 "[ . 1 . 2]" 1
684 1 31 CYS HA 1 31 CYS HB3 2.500 . 2.800 2.710 2.696 2.727 . 0 0 "[ . 1 . 2]" 1
685 1 31 CYS HA 1 34 THR H 3.000 . 4.000 4.017 3.977 4.079 0.079 4 0 "[ . 1 . 2]" 1
686 1 31 CYS HA 1 34 THR HB 3.000 . 4.000 4.001 3.938 4.045 0.045 4 0 "[ . 1 . 2]" 1
687 1 31 CYS HA 1 34 THR MG 2.500 . 3.000 2.162 2.130 2.191 . 0 0 "[ . 1 . 2]" 1
688 1 31 CYS HA 1 35 LEU H 3.000 . 3.500 3.381 3.321 3.424 . 0 0 "[ . 1 . 2]" 1
689 1 31 CYS HA 1 35 LEU MD1 3.000 . 4.200 3.193 3.097 3.272 . 0 0 "[ . 1 . 2]" 1
690 1 31 CYS HA 1 35 LEU HG 2.500 . 3.100 2.803 2.661 2.889 . 0 0 "[ . 1 . 2]" 1
691 1 31 CYS HB2 1 32 PHE H 2.500 . 2.700 2.452 2.413 2.494 . 0 0 "[ . 1 . 2]" 1
692 1 31 CYS HB2 1 32 PHE HB2 4.000 . 4.600 4.513 4.466 4.574 . 0 0 "[ . 1 . 2]" 1
693 1 31 CYS HB3 1 32 PHE H 2.500 . 2.900 2.646 2.611 2.682 . 0 0 "[ . 1 . 2]" 1
694 1 31 CYS HB3 1 32 PHE HA 3.000 . 4.000 3.851 3.811 3.885 . 0 0 "[ . 1 . 2]" 1
695 1 31 CYS HB3 1 32 PHE HB2 4.000 . 4.600 4.461 4.410 4.493 . 0 0 "[ . 1 . 2]" 1
696 1 31 CYS HB3 1 35 LEU H 3.000 . 4.700 4.805 4.789 4.815 0.115 2 0 "[ . 1 . 2]" 1
697 1 31 CYS HB3 1 35 LEU MD1 3.000 . 3.300 2.181 2.124 2.252 . 0 0 "[ . 1 . 2]" 1
698 1 31 CYS HB3 1 35 LEU HG 3.000 . 3.500 3.604 3.571 3.621 0.121 2 0 "[ . 1 . 2]" 1
699 1 32 PHE H 1 32 PHE HB2 2.500 . 2.700 2.382 2.360 2.413 . 0 0 "[ . 1 . 2]" 1
700 1 32 PHE H 1 32 PHE HB3 2.500 . 2.900 2.776 2.733 2.808 . 0 0 "[ . 1 . 2]" 1
701 1 32 PHE H 1 33 GLU H 3.000 . 3.300 3.031 2.976 3.088 . 0 0 "[ . 1 . 2]" 1
702 1 32 PHE H 1 34 THR H 4.000 . 5.000 4.944 4.924 4.979 . 0 0 "[ . 1 . 2]" 1
703 1 32 PHE HA 1 32 PHE HD1 3.000 . 3.800 3.698 3.663 3.742 . 0 0 "[ . 1 . 2]" 1
704 1 32 PHE HA 1 32 PHE HD2 3.000 . 3.300 3.256 3.187 3.284 . 0 0 "[ . 1 . 2]" 1
705 1 32 PHE HA 1 33 GLU H 3.000 . 4.000 3.589 3.574 3.605 . 0 0 "[ . 1 . 2]" 1
706 1 32 PHE HA 1 35 LEU HB2 2.500 . 3.100 3.058 2.987 3.127 0.027 4 0 "[ . 1 . 2]" 1
707 1 32 PHE HA 1 35 LEU MD1 3.000 . 3.800 2.499 2.419 2.616 . 0 0 "[ . 1 . 2]" 1
708 1 32 PHE HA 1 35 LEU HG 3.000 . 4.300 4.381 4.323 4.427 0.127 4 0 "[ . 1 . 2]" 1
709 1 32 PHE HA 1 36 PHE H 3.000 . 4.000 4.082 4.052 4.118 0.118 10 0 "[ . 1 . 2]" 1
710 1 32 PHE HA 1 36 PHE HD2 3.000 . 4.000 3.953 3.756 4.020 0.020 7 0 "[ . 1 . 2]" 1
711 1 32 PHE HA 1 36 PHE HE2 3.000 . 3.300 3.046 2.781 3.256 . 0 0 "[ . 1 . 2]" 1
712 1 32 PHE HA 1 36 PHE HZ 3.000 . 4.300 3.790 3.654 4.005 . 0 0 "[ . 1 . 2]" 1
713 1 32 PHE HB2 1 32 PHE HD1 3.000 . 3.800 3.729 3.716 3.738 . 0 0 "[ . 1 . 2]" 1
714 1 32 PHE HB2 1 32 PHE HD2 2.500 . 2.800 2.378 2.364 2.417 . 0 0 "[ . 1 . 2]" 1
715 1 32 PHE HB2 1 33 GLU H 3.000 . 4.000 3.784 3.749 3.815 . 0 0 "[ . 1 . 2]" 1
716 1 32 PHE HB3 1 32 PHE HD1 2.500 . 2.700 2.546 2.518 2.566 . 0 0 "[ . 1 . 2]" 1
717 1 32 PHE HB3 1 32 PHE HD2 3.000 . 3.600 3.614 3.599 3.644 0.044 2 0 "[ . 1 . 2]" 1
718 1 32 PHE HB3 1 33 GLU H 2.500 . 2.700 2.489 2.455 2.522 . 0 0 "[ . 1 . 2]" 1
719 1 32 PHE HD1 1 33 GLU H 3.000 . 3.300 3.349 3.310 3.383 0.083 5 0 "[ . 1 . 2]" 1
720 1 32 PHE HD1 1 33 GLU HA 3.000 . 3.300 2.871 2.828 2.930 . 0 0 "[ . 1 . 2]" 1
721 1 32 PHE HE1 1 33 GLU HA 4.000 . 5.000 4.520 4.441 4.570 . 0 0 "[ . 1 . 2]" 1
722 1 33 GLU H 1 33 GLU HB2 2.500 . 2.800 2.499 2.417 2.763 . 0 0 "[ . 1 . 2]" 1
723 1 33 GLU H 1 33 GLU HB3 3.000 . 3.500 3.598 3.583 3.619 0.119 1 0 "[ . 1 . 2]" 1
724 1 33 GLU H 1 33 GLU HG2 2.500 . 2.800 2.248 2.142 2.583 . 0 0 "[ . 1 . 2]" 1
725 1 33 GLU H 1 33 GLU HG3 3.000 . 3.300 3.129 2.063 3.399 0.099 15 0 "[ . 1 . 2]" 1
726 1 33 GLU H 1 34 THR H 3.000 . 3.300 2.900 2.857 2.934 . 0 0 "[ . 1 . 2]" 1
727 1 33 GLU HA 1 33 GLU HB2 3.000 . 3.300 3.020 3.018 3.022 . 0 0 "[ . 1 . 2]" 1
728 1 33 GLU HA 1 33 GLU HB3 2.500 . 2.700 2.456 2.356 2.489 . 0 0 "[ . 1 . 2]" 1
729 1 33 GLU HA 1 33 GLU HG2 2.500 . 2.700 2.714 2.529 2.778 0.078 19 0 "[ . 1 . 2]" 1
730 1 33 GLU HA 1 33 GLU HG3 3.000 . 3.500 3.665 3.538 3.713 0.213 19 0 "[ . 1 . 2]" 1
731 1 33 GLU HA 1 34 THR H 3.000 . 3.600 3.586 3.573 3.594 . 0 0 "[ . 1 . 2]" 1
732 1 33 GLU HA 1 36 PHE H 3.000 . 4.000 3.956 3.904 4.023 0.023 7 0 "[ . 1 . 2]" 1
733 1 33 GLU HA 1 36 PHE HB2 4.000 . 4.600 4.321 4.246 4.428 . 0 0 "[ . 1 . 2]" 1
734 1 33 GLU HA 1 37 ALA H 3.000 . 3.800 3.792 3.749 3.817 0.017 13 0 "[ . 1 . 2]" 1
735 1 33 GLU HA 1 37 ALA MB 3.000 . 4.300 3.303 3.211 3.341 . 0 0 "[ . 1 . 2]" 1
736 1 33 GLU HB2 1 34 THR H 2.500 . 2.800 2.110 2.006 2.156 . 0 0 "[ . 1 . 2]" 1
737 1 33 GLU HB2 1 34 THR HA 4.000 . 4.500 4.240 3.956 4.331 . 0 0 "[ . 1 . 2]" 1
738 1 33 GLU HB2 1 37 ALA MB 4.000 . 5.500 4.055 3.742 4.179 . 0 0 "[ . 1 . 2]" 1
739 1 33 GLU HB2 1 48 GLY HA2 4.000 . 4.500 4.329 4.128 4.558 0.058 5 0 "[ . 1 . 2]" 1
740 1 33 GLU HB2 1 48 GLY HA3 4.000 . 4.800 4.665 4.345 4.848 0.048 19 0 "[ . 1 . 2]" 1
741 1 33 GLU HB3 1 34 THR H 3.000 . 3.500 3.183 3.095 3.414 . 0 0 "[ . 1 . 2]" 1
742 1 33 GLU HB3 1 37 ALA MB 3.000 . 4.500 3.021 2.920 3.107 . 0 0 "[ . 1 . 2]" 1
743 1 33 GLU HB3 1 48 GLY HA2 2.500 . 3.100 2.729 2.530 2.974 . 0 0 "[ . 1 . 2]" 1
744 1 33 GLU HB3 1 48 GLY HA3 3.000 . 3.500 3.465 3.186 3.567 0.067 6 0 "[ . 1 . 2]" 1
745 1 33 GLU HB3 1 49 CYS H 3.000 . 3.500 3.517 3.359 3.645 0.145 19 0 "[ . 1 . 2]" 1
746 1 33 GLU HG2 1 34 THR H 3.000 . 4.200 4.268 4.213 4.426 0.226 3 0 "[ . 1 . 2]" 1
747 1 33 GLU HG3 1 34 THR H 3.000 . 4.500 4.313 3.653 4.481 . 0 0 "[ . 1 . 2]" 1
748 1 34 THR H 1 34 THR HA 2.500 . 2.900 2.788 2.783 2.799 . 0 0 "[ . 1 . 2]" 1
749 1 34 THR H 1 34 THR HB 2.500 . 2.700 2.218 2.199 2.229 . 0 0 "[ . 1 . 2]" 1
750 1 34 THR H 1 34 THR MG 3.000 . 3.500 2.749 2.706 2.786 . 0 0 "[ . 1 . 2]" 1
751 1 34 THR H 1 35 LEU H 3.000 . 3.200 2.949 2.929 2.975 . 0 0 "[ . 1 . 2]" 1
752 1 34 THR HA 1 34 THR MG 3.000 . 4.000 3.174 3.168 3.181 . 0 0 "[ . 1 . 2]" 1
753 1 34 THR HA 1 35 LEU H 3.000 . 3.500 3.565 3.560 3.574 0.074 2 0 "[ . 1 . 2]" 1
754 1 34 THR HA 1 37 ALA H 3.000 . 3.800 3.526 3.489 3.559 . 0 0 "[ . 1 . 2]" 1
755 1 34 THR HA 1 37 ALA MB 3.000 . 3.500 2.264 2.253 2.283 . 0 0 "[ . 1 . 2]" 1
756 1 34 THR HA 1 46 PRO HB2 2.500 . 3.000 2.497 2.349 2.836 . 0 0 "[ . 1 . 2]" 1
757 1 34 THR HA 1 46 PRO HB3 2.500 . 3.000 2.919 2.777 3.026 0.026 11 0 "[ . 1 . 2]" 1
758 1 34 THR HA 1 46 PRO HG2 3.000 . 3.300 3.056 2.910 3.296 . 0 0 "[ . 1 . 2]" 1
759 1 34 THR HA 1 46 PRO HG3 3.000 . 3.400 3.405 3.280 3.465 0.065 7 0 "[ . 1 . 2]" 1
760 1 34 THR HB 1 35 LEU H 3.000 . 3.500 3.634 3.623 3.648 0.148 16 0 "[ . 1 . 2]" 1
761 1 34 THR HB 1 35 LEU HG 4.000 . 5.000 4.900 4.875 4.944 . 0 0 "[ . 1 . 2]" 1
762 1 34 THR HB 1 46 PRO HG2 4.000 . 4.300 3.903 3.678 4.188 . 0 0 "[ . 1 . 2]" 1
763 1 34 THR MG 1 35 LEU H 2.500 . 2.800 1.775 1.761 1.795 0.039 5 0 "[ . 1 . 2]" 1
764 1 34 THR MG 1 35 LEU HA 3.000 . 3.800 2.937 2.922 2.957 . 0 0 "[ . 1 . 2]" 1
765 1 34 THR MG 1 35 LEU HB2 4.000 . 5.000 3.747 3.729 3.771 . 0 0 "[ . 1 . 2]" 1
766 1 34 THR MG 1 35 LEU MD1 4.000 . 5.300 3.508 3.471 3.537 . 0 0 "[ . 1 . 2]" 1
767 1 34 THR MG 1 35 LEU MD2 4.000 . 4.600 2.978 2.929 3.022 . 0 0 "[ . 1 . 2]" 1
768 1 35 LEU H 1 35 LEU HB2 2.500 . 2.700 2.493 2.480 2.519 . 0 0 "[ . 1 . 2]" 1
769 1 35 LEU H 1 35 LEU HB3 3.000 . 3.600 3.620 3.617 3.624 0.024 2 0 "[ . 1 . 2]" 1
770 1 35 LEU H 1 35 LEU MD1 3.000 . 4.000 3.325 3.312 3.349 . 0 0 "[ . 1 . 2]" 1
771 1 35 LEU H 1 35 LEU MD2 3.000 . 4.300 3.570 3.538 3.592 . 0 0 "[ . 1 . 2]" 1
772 1 35 LEU H 1 35 LEU HG 2.500 . 3.000 2.186 2.159 2.201 . 0 0 "[ . 1 . 2]" 1
773 1 35 LEU HA 1 35 LEU HB2 2.500 . 3.100 3.022 3.020 3.023 . 0 0 "[ . 1 . 2]" 1
774 1 35 LEU HA 1 35 LEU HB3 2.500 . 2.700 2.512 2.495 2.521 . 0 0 "[ . 1 . 2]" 1
775 1 35 LEU HA 1 35 LEU MD1 4.000 . 4.500 3.841 3.836 3.849 . 0 0 "[ . 1 . 2]" 1
776 1 35 LEU HA 1 35 LEU MD2 2.500 . 2.900 2.217 2.211 2.223 . 0 0 "[ . 1 . 2]" 1
777 1 35 LEU HA 1 35 LEU HG 2.500 . 2.900 2.807 2.792 2.845 . 0 0 "[ . 1 . 2]" 1
778 1 35 LEU HA 1 36 PHE H 3.000 . 3.500 3.585 3.582 3.587 0.087 7 0 "[ . 1 . 2]" 1
779 1 35 LEU HA 1 37 ALA H 4.000 . 5.500 4.372 4.320 4.431 . 0 0 "[ . 1 . 2]" 1
780 1 35 LEU HB2 1 35 LEU MD1 2.500 . 3.100 2.229 2.221 2.256 . 0 0 "[ . 1 . 2]" 1
781 1 35 LEU HB2 1 35 LEU MD2 3.000 . 3.800 3.198 3.195 3.199 . 0 0 "[ . 1 . 2]" 1
782 1 35 LEU HB2 1 36 PHE H 2.500 . 2.800 2.244 2.226 2.258 . 0 0 "[ . 1 . 2]" 1
783 1 35 LEU HB3 1 35 LEU MD1 2.500 . 3.200 2.497 2.458 2.510 . 0 0 "[ . 1 . 2]" 1
784 1 35 LEU HB3 1 35 LEU MD2 2.500 . 3.000 2.210 2.206 2.212 . 0 0 "[ . 1 . 2]" 1
785 1 35 LEU HB3 1 36 PHE H 3.000 . 3.300 3.189 3.171 3.221 . 0 0 "[ . 1 . 2]" 1
786 1 35 LEU MD1 1 36 PHE H 4.000 2.800 5.000 4.093 4.068 4.115 . 0 0 "[ . 1 . 2]" 1
787 1 35 LEU MD1 1 36 PHE HD1 4.000 . 5.500 4.505 4.464 4.544 . 0 0 "[ . 1 . 2]" 1
788 1 35 LEU MD1 1 36 PHE HE1 3.000 . 4.300 3.119 3.007 3.226 . 0 0 "[ . 1 . 2]" 1
789 1 35 LEU MD2 1 36 PHE HD1 4.000 . 5.500 4.429 4.414 4.476 . 0 0 "[ . 1 . 2]" 1
790 1 35 LEU MD2 1 36 PHE HE1 4.000 . 4.600 3.579 3.558 3.601 . 0 0 "[ . 1 . 2]" 1
791 1 35 LEU HG 1 36 PHE H 3.000 . 4.300 4.324 4.298 4.341 0.041 15 0 "[ . 1 . 2]" 1
792 1 36 PHE H 1 36 PHE HB2 3.000 . 3.300 2.820 2.803 2.838 . 0 0 "[ . 1 . 2]" 1
793 1 36 PHE H 1 36 PHE HB3 2.500 . 3.500 3.664 3.652 3.676 0.176 7 0 "[ . 1 . 2]" 1
794 1 36 PHE H 1 36 PHE HD1 3.000 . 3.300 3.094 3.044 3.145 . 0 0 "[ . 1 . 2]" 1
795 1 36 PHE H 1 36 PHE HD2 3.000 . 3.700 3.621 3.535 3.667 . 0 0 "[ . 1 . 2]" 1
796 1 36 PHE H 1 37 ALA H 2.500 . 2.900 2.446 2.415 2.462 . 0 0 "[ . 1 . 2]" 1
797 1 36 PHE H 1 37 ALA MB 4.000 . 5.200 4.138 4.122 4.149 . 0 0 "[ . 1 . 2]" 1
798 1 36 PHE HA 1 36 PHE HB2 2.500 . 3.100 3.003 3.002 3.006 . 0 0 "[ . 1 . 2]" 1
799 1 36 PHE HA 1 36 PHE HB3 2.500 . 2.700 2.322 2.320 2.325 . 0 0 "[ . 1 . 2]" 1
800 1 36 PHE HA 1 37 ALA H 3.000 . 3.500 3.337 3.309 3.353 . 0 0 "[ . 1 . 2]" 1
801 1 36 PHE HB2 1 36 PHE HD1 3.000 . 4.000 3.745 3.741 3.749 . 0 0 "[ . 1 . 2]" 1
802 1 36 PHE HB2 1 36 PHE HD2 3.000 . 3.200 2.368 2.357 2.379 . 0 0 "[ . 1 . 2]" 1
803 1 36 PHE HB2 1 36 PHE HE2 4.000 . 5.000 4.668 4.657 4.678 . 0 0 "[ . 1 . 2]" 1
804 1 36 PHE HB2 1 37 ALA H 3.000 . 3.500 3.553 3.523 3.581 0.081 1 0 "[ . 1 . 2]" 1
805 1 36 PHE HB3 1 36 PHE HD1 3.000 . 3.300 3.002 2.963 3.020 . 0 0 "[ . 1 . 2]" 1
806 1 36 PHE HB3 1 36 PHE HD2 3.000 . 3.300 3.254 3.239 3.294 . 0 0 "[ . 1 . 2]" 1
807 1 36 PHE HB3 1 36 PHE HE2 4.000 . 5.300 5.178 5.166 5.209 . 0 0 "[ . 1 . 2]" 1
808 1 36 PHE HB3 1 37 ALA H 3.000 . 4.500 4.471 4.451 4.480 . 0 0 "[ . 1 . 2]" 1
809 1 36 PHE HD2 1 37 ALA H 4.000 . 5.300 5.295 5.232 5.327 0.027 1 0 "[ . 1 . 2]" 1
810 1 37 ALA H 1 37 ALA HA 2.500 . 3.000 2.849 2.827 2.863 . 0 0 "[ . 1 . 2]" 1
811 1 37 ALA H 1 37 ALA MB 2.500 . 3.000 2.203 2.192 2.217 . 0 0 "[ . 1 . 2]" 1
812 1 37 ALA HA 1 38 ASN H 2.500 . 2.800 2.363 2.325 2.398 . 0 0 "[ . 1 . 2]" 1
813 1 37 ALA MB 1 38 ASN H 3.000 . 3.300 2.571 2.477 2.644 . 0 0 "[ . 1 . 2]" 1
814 1 37 ALA MB 1 46 PRO HA 4.000 . 4.500 3.220 3.080 3.357 . 0 0 "[ . 1 . 2]" 1
815 1 37 ALA MB 1 46 PRO HB2 3.000 . 3.300 2.269 2.159 2.369 . 0 0 "[ . 1 . 2]" 1
816 1 37 ALA MB 1 46 PRO HB3 3.000 . 3.300 2.247 2.168 2.399 . 0 0 "[ . 1 . 2]" 1
817 1 37 ALA MB 1 47 ILE H 3.000 . 3.800 2.470 2.346 2.638 . 0 0 "[ . 1 . 2]" 1
818 1 37 ALA MB 1 48 GLY HA2 3.000 . 4.000 2.757 2.666 2.869 . 0 0 "[ . 1 . 2]" 1
819 1 37 ALA MB 1 48 GLY HA3 4.000 . 5.300 4.067 3.924 4.205 . 0 0 "[ . 1 . 2]" 1
820 1 38 ASN H 1 38 ASN HB2 2.500 . 3.000 2.326 2.299 2.400 . 0 0 "[ . 1 . 2]" 1
821 1 38 ASN H 1 38 ASN HB3 3.000 . 3.500 3.590 3.580 3.613 0.113 18 0 "[ . 1 . 2]" 1
822 1 38 ASN H 1 47 ILE H 3.000 . 3.300 3.085 2.913 3.304 0.004 5 0 "[ . 1 . 2]" 1
823 1 38 ASN HA 1 38 ASN HB2 2.500 . 3.100 3.024 3.021 3.032 . 0 0 "[ . 1 . 2]" 1
824 1 38 ASN HA 1 38 ASN HB3 2.500 . 2.800 2.556 2.504 2.579 . 0 0 "[ . 1 . 2]" 1
825 1 38 ASN HA 1 39 THR H 2.500 . 3.000 2.355 2.343 2.365 . 0 0 "[ . 1 . 2]" 1
826 1 38 ASN HA 1 39 THR HA 4.000 . 5.000 4.426 4.418 4.434 . 0 0 "[ . 1 . 2]" 1
827 1 38 ASN HB2 1 38 ASN HD21 3.000 . 4.000 2.863 2.243 3.622 . 0 0 "[ . 1 . 2]" 1
828 1 38 ASN HB2 1 38 ASN HD22 3.000 . 4.300 3.786 3.510 4.126 . 0 0 "[ . 1 . 2]" 1
829 1 38 ASN HB2 1 39 THR H 3.000 . 4.000 3.960 3.871 3.988 . 0 0 "[ . 1 . 2]" 1
830 1 38 ASN HB2 1 47 ILE H 3.000 . 4.000 3.840 3.721 3.923 . 0 0 "[ . 1 . 2]" 1
831 1 38 ASN HB2 1 47 ILE HB 3.000 . 3.300 2.975 2.818 3.076 . 0 0 "[ . 1 . 2]" 1
832 1 38 ASN HB2 1 47 ILE MD 4.000 . 4.800 3.210 2.973 3.301 . 0 0 "[ . 1 . 2]" 1
833 1 38 ASN HB2 1 47 ILE HG13 4.000 . 4.300 3.877 3.633 3.969 . 0 0 "[ . 1 . 2]" 1
834 1 38 ASN HB2 1 60 HIS HB2 3.000 . 3.400 3.424 3.383 3.439 0.039 13 0 "[ . 1 . 2]" 1
835 1 38 ASN HB3 1 38 ASN HD21 3.000 . 3.300 3.020 2.498 3.330 0.030 17 0 "[ . 1 . 2]" 1
836 1 38 ASN HB3 1 38 ASN HD22 3.000 . 4.000 3.836 3.608 3.977 . 0 0 "[ . 1 . 2]" 1
837 1 38 ASN HB3 1 39 THR H 2.500 . 2.900 2.750 2.733 2.765 . 0 0 "[ . 1 . 2]" 1
838 1 38 ASN HB3 1 47 ILE HB 4.000 . 4.600 4.343 4.264 4.411 . 0 0 "[ . 1 . 2]" 1
839 1 38 ASN HB3 1 47 ILE MD 4.000 . 4.500 3.593 3.423 3.632 . 0 0 "[ . 1 . 2]" 1
840 1 38 ASN HB3 1 47 ILE HG13 4.000 . 4.300 4.343 4.308 4.381 0.081 17 0 "[ . 1 . 2]" 1
841 1 38 ASN HB3 1 60 HIS HB2 2.500 . 2.500 2.334 2.305 2.419 . 0 0 "[ . 1 . 2]" 1
842 1 38 ASN HB3 1 60 HIS HB3 3.000 . 3.000 2.955 2.873 2.997 . 0 0 "[ . 1 . 2]" 1
843 1 39 THR H 1 39 THR HB 2.500 . 2.900 2.720 2.701 2.750 . 0 0 "[ . 1 . 2]" 1
844 1 39 THR H 1 39 THR MG 4.000 . 5.000 3.816 3.809 3.827 . 0 0 "[ . 1 . 2]" 1
845 1 39 THR HA 1 39 THR MG 2.500 . 2.800 2.266 2.230 2.289 . 0 0 "[ . 1 . 2]" 1
846 1 39 THR HA 1 40 CYS H 2.500 . 2.800 2.219 2.203 2.235 . 0 0 "[ . 1 . 2]" 1
847 1 39 THR HA 1 40 CYS HB2 4.000 . 5.000 4.821 4.790 4.837 . 0 0 "[ . 1 . 2]" 1
848 1 39 THR HA 1 40 CYS HB3 4.000 . 4.600 4.483 4.457 4.508 . 0 0 "[ . 1 . 2]" 1
849 1 39 THR HA 1 46 PRO HA 2.500 . 2.800 2.418 2.346 2.473 . 0 0 "[ . 1 . 2]" 1
850 1 39 THR HA 1 46 PRO HB3 4.000 . 4.600 4.439 4.285 4.516 . 0 0 "[ . 1 . 2]" 1
851 1 39 THR HA 1 47 ILE H 3.000 . 3.500 3.459 3.380 3.507 0.007 2 0 "[ . 1 . 2]" 1
852 1 39 THR HA 1 47 ILE MD 4.000 . 5.200 4.190 4.140 4.253 . 0 0 "[ . 1 . 2]" 1
853 1 39 THR HA 1 47 ILE HG12 4.000 . 5.000 4.658 4.545 4.779 . 0 0 "[ . 1 . 2]" 1
854 1 39 THR HA 1 47 ILE HG13 3.000 . 3.500 3.265 3.211 3.328 . 0 0 "[ . 1 . 2]" 1
855 1 39 THR HB 1 40 CYS H 3.000 . 4.000 3.929 3.865 3.979 . 0 0 "[ . 1 . 2]" 1
856 1 39 THR HB 1 41 GLU HG3 3.000 . 4.600 4.717 4.705 4.726 0.126 20 0 "[ . 1 . 2]" 1
857 1 39 THR MG 1 40 CYS H 2.500 . 3.400 2.459 2.390 2.539 . 0 0 "[ . 1 . 2]" 1
858 1 39 THR MG 1 40 CYS HB3 4.000 . 5.200 4.115 4.067 4.159 . 0 0 "[ . 1 . 2]" 1
859 1 39 THR MG 1 44 GLY H 4.000 . 4.600 3.466 3.393 3.585 . 0 0 "[ . 1 . 2]" 1
860 1 39 THR MG 1 44 GLY HA2 3.000 . 3.300 2.272 2.230 2.423 . 0 0 "[ . 1 . 2]" 1
861 1 39 THR MG 1 44 GLY HA3 3.000 . 4.500 3.583 3.529 3.735 . 0 0 "[ . 1 . 2]" 1
862 1 39 THR MG 1 45 LYS HA 4.000 . 5.000 3.752 3.630 4.056 . 0 0 "[ . 1 . 2]" 1
863 1 39 THR MG 1 46 PRO HA 4.000 . 4.600 3.624 3.577 3.697 . 0 0 "[ . 1 . 2]" 1
864 1 40 CYS H 1 40 CYS HA 3.000 . 4.000 2.965 2.957 2.976 . 0 0 "[ . 1 . 2]" 1
865 1 40 CYS H 1 40 CYS HB2 3.000 . 3.200 3.000 2.969 3.040 . 0 0 "[ . 1 . 2]" 1
866 1 40 CYS H 1 40 CYS HB3 2.500 . 2.800 2.324 2.303 2.336 . 0 0 "[ . 1 . 2]" 1
867 1 40 CYS H 1 47 ILE H 4.000 . 5.000 4.332 4.176 4.403 . 0 0 "[ . 1 . 2]" 1
868 1 40 CYS H 1 47 ILE MD 4.000 . 5.000 3.456 3.408 3.535 . 0 0 "[ . 1 . 2]" 1
869 1 40 CYS HA 1 41 GLU H 2.500 . 2.900 2.162 2.154 2.174 . 0 0 "[ . 1 . 2]" 1
870 1 40 CYS HA 1 41 GLU HG2 4.000 . 5.000 5.074 5.056 5.095 0.095 8 0 "[ . 1 . 2]" 1
871 1 40 CYS HA 1 41 GLU HG3 3.000 . 3.600 3.683 3.665 3.702 0.102 10 0 "[ . 1 . 2]" 1
872 1 40 CYS HA 1 42 GLU H 3.000 . 3.500 3.447 3.434 3.463 . 0 0 "[ . 1 . 2]" 1
873 1 40 CYS HA 1 47 ILE MD 3.000 . 3.500 2.315 2.288 2.371 . 0 0 "[ . 1 . 2]" 1
874 1 40 CYS HA 1 47 ILE HG12 4.000 . 4.300 4.130 4.095 4.169 . 0 0 "[ . 1 . 2]" 1
875 1 40 CYS HA 1 47 ILE HG13 3.000 . 4.000 3.813 3.723 3.845 . 0 0 "[ . 1 . 2]" 1
876 1 40 CYS HA 1 61 TRP HA 3.000 . 3.500 2.998 2.942 3.035 . 0 0 "[ . 1 . 2]" 1
877 1 40 CYS HA 1 61 TRP HD1 3.000 . 4.000 4.098 4.048 4.143 0.143 11 0 "[ . 1 . 2]" 1
878 1 40 CYS HA 1 62 HIS H 4.000 . 4.600 4.400 4.328 4.507 . 0 0 "[ . 1 . 2]" 1
879 1 40 CYS HB2 1 41 GLU H 4.000 . 4.500 4.367 4.343 4.384 . 0 0 "[ . 1 . 2]" 1
880 1 40 CYS HB2 1 42 GLU H 3.000 . 4.200 4.258 4.234 4.280 0.080 2 0 "[ . 1 . 2]" 1
881 1 40 CYS HB2 1 43 CYS H 3.000 . 4.000 3.974 3.919 4.015 0.015 5 0 "[ . 1 . 2]" 1
882 1 40 CYS HB2 1 47 ILE MD 2.500 . 3.000 2.118 2.100 2.191 . 0 0 "[ . 1 . 2]" 1
883 1 40 CYS HB2 1 47 ILE HG12 2.500 . 2.700 2.312 2.293 2.326 . 0 0 "[ . 1 . 2]" 1
884 1 40 CYS HB2 1 47 ILE HG13 3.000 . 4.000 3.012 2.952 3.095 . 0 0 "[ . 1 . 2]" 1
885 1 40 CYS HB2 1 61 TRP HA 3.000 . 4.000 3.488 3.423 3.551 . 0 0 "[ . 1 . 2]" 1
886 1 40 CYS HB2 1 61 TRP HD1 4.000 . 5.000 4.694 4.627 4.738 . 0 0 "[ . 1 . 2]" 1
887 1 40 CYS HB2 1 62 HIS H 3.000 . 4.000 3.511 3.385 3.637 . 0 0 "[ . 1 . 2]" 1
888 1 40 CYS HB2 1 62 HIS HB2 4.000 . 5.000 4.708 4.606 4.769 . 0 0 "[ . 1 . 2]" 1
889 1 40 CYS HB2 1 62 HIS HE1 3.000 . 3.300 3.168 3.097 3.242 . 0 0 "[ . 1 . 2]" 1
890 1 40 CYS HB3 1 41 GLU H 4.000 . 4.500 4.497 4.479 4.504 0.004 14 0 "[ . 1 . 2]" 1
891 1 40 CYS HB3 1 42 GLU H 3.000 . 4.000 3.892 3.857 3.930 . 0 0 "[ . 1 . 2]" 1
892 1 40 CYS HB3 1 43 CYS H 3.000 . 3.300 2.924 2.830 3.004 . 0 0 "[ . 1 . 2]" 1
893 1 40 CYS HB3 1 44 GLY H 3.000 . 3.300 2.593 2.511 2.654 . 0 0 "[ . 1 . 2]" 1
894 1 40 CYS HB3 1 44 GLY HA2 4.000 . 4.500 4.482 4.354 4.524 0.024 7 0 "[ . 1 . 2]" 1
895 1 40 CYS HB3 1 45 LYS H 3.000 . 3.300 3.311 3.259 3.337 0.037 11 0 "[ . 1 . 2]" 1
896 1 40 CYS HB3 1 47 ILE MD 4.000 . 5.000 3.473 3.455 3.520 . 0 0 "[ . 1 . 2]" 1
897 1 40 CYS HB3 1 47 ILE HG12 3.000 . 3.200 3.266 3.249 3.291 0.091 7 0 "[ . 1 . 2]" 1
898 1 40 CYS HB3 1 47 ILE HG13 4.000 . 4.200 3.771 3.678 3.867 . 0 0 "[ . 1 . 2]" 1
899 1 40 CYS HB3 1 62 HIS HE1 3.000 . 3.300 2.952 2.849 3.046 . 0 0 "[ . 1 . 2]" 1
900 1 41 GLU H 1 41 GLU HB2 2.500 . 3.000 2.674 2.651 2.697 . 0 0 "[ . 1 . 2]" 1
901 1 41 GLU H 1 41 GLU HB3 3.000 . 4.000 3.590 3.583 3.594 . 0 0 "[ . 1 . 2]" 1
902 1 41 GLU H 1 41 GLU HG2 3.000 . 4.000 3.043 3.005 3.096 . 0 0 "[ . 1 . 2]" 1
903 1 41 GLU H 1 41 GLU HG3 3.000 . 3.300 1.761 1.755 1.773 0.045 16 0 "[ . 1 . 2]" 1
904 1 41 GLU H 1 61 TRP HA 3.000 . 4.200 3.986 3.888 4.040 . 0 0 "[ . 1 . 2]" 1
905 1 41 GLU HA 1 41 GLU HB2 3.000 . 3.300 3.028 3.027 3.029 . 0 0 "[ . 1 . 2]" 1
906 1 41 GLU HA 1 41 GLU HB3 2.500 . 2.800 2.437 2.427 2.443 . 0 0 "[ . 1 . 2]" 1
907 1 41 GLU HA 1 41 GLU HG2 3.000 . 3.200 2.550 2.518 2.581 . 0 0 "[ . 1 . 2]" 1
908 1 41 GLU HA 1 41 GLU HG3 3.000 . 3.500 3.041 3.018 3.071 . 0 0 "[ . 1 . 2]" 1
909 1 41 GLU HA 1 42 GLU H 3.000 . 4.000 3.459 3.451 3.467 . 0 0 "[ . 1 . 2]" 1
910 1 41 GLU HB2 1 42 GLU H 4.000 . 4.500 3.122 3.101 3.143 . 0 0 "[ . 1 . 2]" 1
911 1 41 GLU HB2 1 61 TRP HD1 3.000 . 4.200 3.884 3.797 3.938 . 0 0 "[ . 1 . 2]" 1
912 1 41 GLU HB2 1 61 TRP HE1 2.500 . 2.800 1.985 1.916 2.082 . 0 0 "[ . 1 . 2]" 1
913 1 41 GLU HB2 1 61 TRP HZ2 3.000 . 3.500 2.910 2.787 3.035 . 0 0 "[ . 1 . 2]" 1
914 1 41 GLU HB3 1 42 GLU H 3.000 . 4.000 4.107 4.099 4.122 0.122 19 0 "[ . 1 . 2]" 1
915 1 41 GLU HB3 1 61 TRP HE1 3.000 . 3.800 3.485 3.432 3.571 . 0 0 "[ . 1 . 2]" 1
916 1 41 GLU HB3 1 61 TRP HZ2 3.000 . 4.000 3.581 3.469 3.706 . 0 0 "[ . 1 . 2]" 1
917 1 41 GLU HG2 1 60 HIS H 4.000 . 5.000 5.053 5.038 5.063 0.063 4 0 "[ . 1 . 2]" 1
918 1 41 GLU HG3 1 42 GLU H 4.000 . 5.200 4.293 4.269 4.305 . 0 0 "[ . 1 . 2]" 1
919 1 41 GLU HG3 1 60 HIS H 3.000 . 3.800 3.738 3.707 3.763 . 0 0 "[ . 1 . 2]" 1
920 1 41 GLU HG3 1 61 TRP HE1 4.000 . 4.600 4.138 4.024 4.271 . 0 0 "[ . 1 . 2]" 1
921 1 41 GLU HG3 1 61 TRP HZ2 4.000 . 5.000 4.434 4.270 4.635 . 0 0 "[ . 1 . 2]" 1
922 1 42 GLU H 1 42 GLU HB2 3.000 . 3.300 2.509 2.490 2.521 . 0 0 "[ . 1 . 2]" 1
923 1 42 GLU H 1 42 GLU HB3 3.000 . 3.300 2.798 2.784 2.817 . 0 0 "[ . 1 . 2]" 1
924 1 42 GLU H 1 43 CYS H 3.000 . 3.500 2.590 2.496 2.643 . 0 0 "[ . 1 . 2]" 1
925 1 42 GLU H 1 44 GLY H 3.000 . 4.000 3.633 3.589 3.705 . 0 0 "[ . 1 . 2]" 1
926 1 42 GLU H 1 61 TRP HD1 3.000 . 3.500 3.001 2.918 3.073 . 0 0 "[ . 1 . 2]" 1
927 1 42 GLU H 1 61 TRP HE1 3.000 . 3.500 3.122 2.993 3.212 . 0 0 "[ . 1 . 2]" 1
928 1 42 GLU H 1 65 CYS HB3 4.000 . 4.600 4.266 4.231 4.304 . 0 0 "[ . 1 . 2]" 1
929 1 42 GLU HA 1 42 GLU HG2 2.500 . 3.000 2.350 2.334 2.394 . 0 0 "[ . 1 . 2]" 1
930 1 42 GLU HA 1 42 GLU HG3 3.000 . 3.600 3.601 3.596 3.610 0.010 7 0 "[ . 1 . 2]" 1
931 1 42 GLU HB2 1 43 CYS H 3.000 . 3.600 3.480 3.428 3.580 . 0 0 "[ . 1 . 2]" 1
932 1 42 GLU HB2 1 61 TRP HD1 3.000 . 3.200 2.614 2.585 2.639 . 0 0 "[ . 1 . 2]" 1
933 1 42 GLU HB2 1 61 TRP HE1 3.000 . 3.500 2.981 2.837 3.094 . 0 0 "[ . 1 . 2]" 1
934 1 42 GLU HB2 1 62 HIS H 4.000 . 5.000 4.732 4.683 4.788 . 0 0 "[ . 1 . 2]" 1
935 1 42 GLU HB2 1 65 CYS HA 3.000 . 4.500 4.636 4.610 4.665 0.165 19 0 "[ . 1 . 2]" 1
936 1 42 GLU HB2 1 65 CYS HB2 3.000 . 4.000 3.705 3.641 3.741 . 0 0 "[ . 1 . 2]" 1
937 1 42 GLU HB2 1 65 CYS HB3 2.500 . 3.000 2.307 2.297 2.317 . 0 0 "[ . 1 . 2]" 1
938 1 42 GLU HB3 1 43 CYS H 3.000 . 3.200 2.206 2.109 2.385 . 0 0 "[ . 1 . 2]" 1
939 1 42 GLU HB3 1 61 TRP HD1 3.000 . 3.700 3.564 3.506 3.638 . 0 0 "[ . 1 . 2]" 1
940 1 42 GLU HB3 1 61 TRP HE1 4.000 . 4.700 4.561 4.420 4.680 . 0 0 "[ . 1 . 2]" 1
941 1 42 GLU HB3 1 62 HIS H 4.000 . 5.000 4.525 4.470 4.567 . 0 0 "[ . 1 . 2]" 1
942 1 42 GLU HB3 1 65 CYS HA 3.000 . 4.500 4.401 4.327 4.447 . 0 0 "[ . 1 . 2]" 1
943 1 42 GLU HB3 1 65 CYS HB2 3.000 . 4.000 3.571 3.509 3.629 . 0 0 "[ . 1 . 2]" 1
944 1 42 GLU HB3 1 65 CYS HB3 2.500 . 3.100 2.447 2.347 2.506 . 0 0 "[ . 1 . 2]" 1
945 1 42 GLU HG2 1 61 TRP HD1 4.000 . 5.000 5.010 4.944 5.040 0.040 8 0 "[ . 1 . 2]" 1
946 1 42 GLU HG2 1 65 CYS HB3 3.000 . 4.000 3.729 3.665 3.770 . 0 0 "[ . 1 . 2]" 1
947 1 42 GLU HG2 1 67 HIS HE1 3.000 . 4.000 3.767 3.395 4.022 0.022 7 0 "[ . 1 . 2]" 1
948 1 42 GLU HG3 1 61 TRP HD1 4.000 . 4.600 4.633 4.619 4.652 0.052 1 0 "[ . 1 . 2]" 1
949 1 42 GLU HG3 1 65 CYS HA 3.000 . 3.300 3.257 3.217 3.287 . 0 0 "[ . 1 . 2]" 1
950 1 42 GLU HG3 1 65 CYS HB2 3.000 . 4.300 4.124 4.051 4.164 . 0 0 "[ . 1 . 2]" 1
951 1 42 GLU HG3 1 65 CYS HB3 2.500 . 2.800 2.430 2.358 2.473 . 0 0 "[ . 1 . 2]" 1
952 1 43 CYS H 1 43 CYS HA 2.500 . 3.000 2.920 2.907 2.949 . 0 0 "[ . 1 . 2]" 1
953 1 43 CYS H 1 43 CYS HB2 2.500 . 2.900 2.548 2.519 2.586 . 0 0 "[ . 1 . 2]" 1
954 1 43 CYS H 1 43 CYS HB3 3.000 . 4.000 3.642 3.630 3.656 . 0 0 "[ . 1 . 2]" 1
955 1 43 CYS H 1 44 GLY H 3.000 . 3.200 2.498 2.404 2.546 . 0 0 "[ . 1 . 2]" 1
956 1 43 CYS H 1 61 TRP HD1 4.000 . 5.000 4.620 4.560 4.698 . 0 0 "[ . 1 . 2]" 1
957 1 43 CYS HA 1 43 CYS HB2 2.500 . 3.300 3.034 3.032 3.035 . 0 0 "[ . 1 . 2]" 1
958 1 43 CYS HA 1 43 CYS HB3 2.500 . 2.900 2.446 2.431 2.458 . 0 0 "[ . 1 . 2]" 1
959 1 43 CYS HA 1 44 GLY H 3.000 . 4.000 3.554 3.547 3.560 . 0 0 "[ . 1 . 2]" 1
960 1 43 CYS HB2 1 44 GLY H 2.500 . 2.800 2.510 2.494 2.593 . 0 0 "[ . 1 . 2]" 1
961 1 43 CYS HB2 1 45 LYS H 2.500 . 2.900 2.360 2.276 2.444 . 0 0 "[ . 1 . 2]" 1
962 1 43 CYS HB3 1 44 GLY H 3.000 . 3.800 3.671 3.646 3.713 . 0 0 "[ . 1 . 2]" 1
963 1 43 CYS HB3 1 45 LYS H 3.000 . 3.500 2.859 2.739 2.915 . 0 0 "[ . 1 . 2]" 1
964 1 43 CYS HB3 1 45 LYS QD 4.000 . 5.000 3.281 2.328 4.554 . 0 0 "[ . 1 . 2]" 1
965 1 44 GLY H 1 45 LYS H 3.000 . 3.500 2.436 2.386 2.468 . 0 0 "[ . 1 . 2]" 1
966 1 44 GLY HA2 1 45 LYS H 3.000 . 3.500 3.357 3.310 3.376 . 0 0 "[ . 1 . 2]" 1
967 1 44 GLY HA3 1 45 LYS H 3.000 . 3.500 3.209 3.188 3.229 . 0 0 "[ . 1 . 2]" 1
968 1 45 LYS H 1 45 LYS QD 4.000 . 5.600 3.572 2.185 4.587 . 0 0 "[ . 1 . 2]" 1
969 1 45 LYS H 1 46 PRO HD2 4.000 . 5.000 4.953 4.932 4.989 . 0 0 "[ . 1 . 2]" 1
970 1 45 LYS H 1 46 PRO HD3 4.000 . 5.000 4.975 4.880 4.994 . 0 0 "[ . 1 . 2]" 1
971 1 45 LYS H 1 62 HIS HE1 4.000 . 5.000 4.335 4.232 4.445 . 0 0 "[ . 1 . 2]" 1
972 1 45 LYS HA 1 46 PRO HD2 2.500 . 2.700 2.492 2.332 2.604 . 0 0 "[ . 1 . 2]" 1
973 1 45 LYS HA 1 46 PRO HD3 2.500 . 2.700 2.238 2.199 2.293 . 0 0 "[ . 1 . 2]" 1
974 1 46 PRO HA 1 46 PRO HD2 3.000 . 4.000 4.043 4.029 4.050 0.050 5 0 "[ . 1 . 2]" 1
975 1 46 PRO HA 1 47 ILE H 3.000 . 3.200 2.278 2.258 2.305 . 0 0 "[ . 1 . 2]" 1
976 1 46 PRO HA 1 47 ILE HB 4.000 . 5.000 4.855 4.728 4.901 . 0 0 "[ . 1 . 2]" 1
977 1 46 PRO HA 1 47 ILE HG13 3.000 . 3.600 3.538 3.460 3.594 . 0 0 "[ . 1 . 2]" 1
978 1 46 PRO HB2 1 46 PRO HD2 3.000 . 3.500 3.700 3.674 3.725 0.225 5 0 "[ . 1 . 2]" 1
979 1 46 PRO HB2 1 47 ILE H 3.000 . 3.500 3.493 3.389 3.534 0.034 3 0 "[ . 1 . 2]" 1
980 1 46 PRO HB2 1 48 GLY H 4.000 . 6.200 4.477 4.382 4.629 . 0 0 "[ . 1 . 2]" 1
981 1 46 PRO HB3 1 46 PRO HD3 3.000 . 3.600 3.649 3.621 3.678 0.078 3 0 "[ . 1 . 2]" 1
982 1 46 PRO HB3 1 47 ILE H 3.000 . 4.000 3.580 3.525 3.646 . 0 0 "[ . 1 . 2]" 1
983 1 47 ILE H 1 47 ILE HB 2.500 . 2.700 2.637 2.523 2.693 . 0 0 "[ . 1 . 2]" 1
984 1 47 ILE H 1 47 ILE MD 3.000 . 4.500 3.753 3.701 3.810 . 0 0 "[ . 1 . 2]" 1
985 1 47 ILE H 1 47 ILE HG12 3.000 . 3.500 3.450 3.331 3.520 0.020 7 0 "[ . 1 . 2]" 1
986 1 47 ILE H 1 47 ILE HG13 2.500 . 2.700 2.262 2.163 2.357 . 0 0 "[ . 1 . 2]" 1
987 1 47 ILE HA 1 47 ILE HG12 2.500 . 2.900 2.597 2.474 2.649 . 0 0 "[ . 1 . 2]" 1
988 1 47 ILE HA 1 47 ILE HG13 3.000 . 3.300 3.188 3.117 3.257 . 0 0 "[ . 1 . 2]" 1
989 1 47 ILE HA 1 47 ILE MG 3.000 . 3.200 2.280 2.234 2.401 . 0 0 "[ . 1 . 2]" 1
990 1 47 ILE HA 1 48 GLY H 2.500 . 2.900 2.217 2.209 2.228 . 0 0 "[ . 1 . 2]" 1
991 1 47 ILE HA 1 48 GLY HA3 3.000 . 4.500 4.495 4.481 4.509 0.009 6 0 "[ . 1 . 2]" 1
992 1 47 ILE HB 1 47 ILE MD 3.000 . 3.200 2.313 2.276 2.365 . 0 0 "[ . 1 . 2]" 1
993 1 47 ILE HB 1 53 ASP HB2 3.000 . 4.000 3.873 3.489 4.013 0.013 15 0 "[ . 1 . 2]" 1
994 1 47 ILE HB 1 60 HIS HB2 4.000 . 5.000 5.041 5.013 5.084 0.084 7 0 "[ . 1 . 2]" 1
995 1 47 ILE HB 1 60 HIS HB3 4.000 . 4.500 4.070 4.018 4.171 . 0 0 "[ . 1 . 2]" 1
996 1 47 ILE MD 1 60 HIS HA 4.000 . 5.200 3.956 3.899 3.989 . 0 0 "[ . 1 . 2]" 1
997 1 47 ILE MD 1 60 HIS HB2 3.000 . 4.200 2.919 2.841 2.963 . 0 0 "[ . 1 . 2]" 1
998 1 47 ILE MD 1 60 HIS HB3 3.000 . 3.500 2.187 2.175 2.202 . 0 0 "[ . 1 . 2]" 1
999 1 47 ILE MD 1 61 TRP H 3.000 . 4.200 3.057 2.975 3.094 . 0 0 "[ . 1 . 2]" 1
1000 1 47 ILE MD 1 61 TRP HA 3.000 . 4.300 2.860 2.827 2.889 . 0 0 "[ . 1 . 2]" 1
1001 1 47 ILE MD 1 62 HIS H 3.000 . 4.500 3.200 3.132 3.280 . 0 0 "[ . 1 . 2]" 1
1002 1 47 ILE MD 1 62 HIS HA 3.000 . 4.500 3.346 3.220 3.439 . 0 0 "[ . 1 . 2]" 1
1003 1 47 ILE MD 1 62 HIS HD2 4.000 . 5.000 3.822 3.734 3.900 . 0 0 "[ . 1 . 2]" 1
1004 1 47 ILE HG12 1 60 HIS HB3 4.000 . 5.000 5.068 5.031 5.137 0.137 7 0 "[ . 1 . 2]" 1
1005 1 47 ILE MG 1 48 GLY H 3.000 . 4.000 3.237 3.189 3.280 . 0 0 "[ . 1 . 2]" 1
1006 1 47 ILE MG 1 51 CYS HB2 4.000 . 4.500 3.090 2.752 3.673 . 0 0 "[ . 1 . 2]" 1
1007 1 47 ILE MG 1 51 CYS HB3 4.000 . 5.000 3.896 2.371 4.176 . 0 0 "[ . 1 . 2]" 1
1008 1 47 ILE MG 1 53 ASP H 4.000 . 5.800 4.069 3.786 4.227 . 0 0 "[ . 1 . 2]" 1
1009 1 47 ILE MG 1 53 ASP HB2 3.000 . 4.000 2.968 2.055 3.211 . 0 0 "[ . 1 . 2]" 1
1010 1 47 ILE MG 1 53 ASP HB3 3.000 . 4.000 2.569 2.313 3.407 . 0 0 "[ . 1 . 2]" 1
1011 1 47 ILE MG 1 54 LEU H 4.000 . 5.000 3.826 3.606 3.973 . 0 0 "[ . 1 . 2]" 1
1012 1 47 ILE MG 1 62 HIS HA 3.000 . 4.000 3.387 3.306 3.447 . 0 0 "[ . 1 . 2]" 1
1013 1 47 ILE MG 1 62 HIS HD2 3.000 . 3.500 2.405 2.296 2.474 . 0 0 "[ . 1 . 2]" 1
1014 1 48 GLY HA2 1 49 CYS H 3.000 . 3.200 2.351 2.206 2.539 . 0 0 "[ . 1 . 2]" 1
1015 1 48 GLY HA2 1 49 CYS QB 4.000 . 5.500 4.333 4.173 4.613 . 0 0 "[ . 1 . 2]" 1
1016 1 48 GLY HA3 1 49 CYS H 3.000 . 3.200 2.893 2.650 3.172 . 0 0 "[ . 1 . 2]" 1
1017 1 48 GLY HA3 1 49 CYS QB 4.000 . 5.500 4.823 4.708 5.002 . 0 0 "[ . 1 . 2]" 1
1018 1 48 GLY HA3 1 50 ASP QB 4.000 . 5.000 4.047 3.813 4.483 . 0 0 "[ . 1 . 2]" 1
1019 1 49 CYS H 1 49 CYS QB 3.000 . 4.000 2.326 2.256 2.501 . 0 0 "[ . 1 . 2]" 1
1020 1 49 CYS H 1 50 ASP H 4.000 . 5.000 2.546 2.331 2.703 . 0 0 "[ . 1 . 2]" 1
1021 1 49 CYS HA 1 50 ASP H 3.000 . 3.500 3.428 3.354 3.511 0.011 2 0 "[ . 1 . 2]" 1
1022 1 49 CYS HA 1 51 CYS H 3.000 . 3.500 3.182 3.020 3.533 0.033 15 0 "[ . 1 . 2]" 1
1023 1 49 CYS HA 1 53 ASP H 4.000 . 5.000 4.871 4.459 5.109 0.109 19 0 "[ . 1 . 2]" 1
1024 1 49 CYS QB 1 50 ASP H 3.000 . 4.000 3.219 2.818 3.691 . 0 0 "[ . 1 . 2]" 1
1025 1 49 CYS QB 1 51 CYS H 4.000 . 5.500 4.334 4.128 4.618 . 0 0 "[ . 1 . 2]" 1
1026 1 50 ASP H 1 50 ASP QB 3.000 . 4.000 2.383 2.281 2.662 . 0 0 "[ . 1 . 2]" 1
1027 1 50 ASP H 1 51 CYS H 2.500 . 3.000 2.873 2.542 3.026 0.026 19 0 "[ . 1 . 2]" 1
1028 1 50 ASP HA 1 51 CYS H 3.000 . 4.000 3.111 2.952 3.429 . 0 0 "[ . 1 . 2]" 1
1029 1 50 ASP QB 1 51 CYS H 4.000 . 5.000 3.663 3.061 4.019 . 0 0 "[ . 1 . 2]" 1
1030 1 51 CYS H 1 51 CYS HB2 3.000 . 3.500 2.833 2.489 2.986 . 0 0 "[ . 1 . 2]" 1
1031 1 51 CYS H 1 51 CYS HB3 3.000 . 4.000 3.845 2.680 3.987 . 0 0 "[ . 1 . 2]" 1
1032 1 51 CYS H 1 52 LYS H 3.000 . 4.500 4.426 4.344 4.567 0.067 2 0 "[ . 1 . 2]" 1
1033 1 51 CYS HA 1 52 LYS H 3.000 . 3.500 2.518 2.292 2.629 . 0 0 "[ . 1 . 2]" 1
1034 1 51 CYS HB2 1 52 LYS H 3.000 . 4.200 3.472 3.087 3.984 . 0 0 "[ . 1 . 2]" 1
1035 1 51 CYS HB3 1 52 LYS H 3.000 . 4.400 2.402 2.072 3.488 . 0 0 "[ . 1 . 2]" 1
1036 1 52 LYS H 1 52 LYS QB 3.000 . 4.500 2.543 2.057 2.931 . 0 0 "[ . 1 . 2]" 1
1037 1 52 LYS H 1 52 LYS HG2 3.000 . 4.600 2.593 1.782 4.676 0.076 20 0 "[ . 1 . 2]" 1
1038 1 52 LYS H 1 52 LYS HG3 3.000 . 4.500 3.499 1.863 4.478 . 0 0 "[ . 1 . 2]" 1
1039 1 52 LYS HA 1 52 LYS HG2 3.000 . 4.500 3.341 2.773 3.711 . 0 0 "[ . 1 . 2]" 1
1040 1 52 LYS HA 1 52 LYS HG3 3.000 . 4.000 3.542 2.279 4.235 0.235 18 0 "[ . 1 . 2]" 1
1041 1 52 LYS HA 1 53 ASP H 2.500 . 3.200 2.242 2.187 2.276 . 0 0 "[ . 1 . 2]" 1
1042 1 52 LYS QB 1 53 ASP H 3.000 . 4.500 3.707 3.490 4.006 . 0 0 "[ . 1 . 2]" 1
1043 1 52 LYS QB 1 63 GLU H 3.000 . 4.500 2.974 2.181 3.568 . 0 0 "[ . 1 . 2]" 1
1044 1 52 LYS QB 1 63 GLU QB 3.000 . 4.000 2.275 2.055 2.701 . 0 0 "[ . 1 . 2]" 1
1045 1 52 LYS QB 1 63 GLU QG 4.000 . 5.200 3.370 2.309 4.051 . 0 0 "[ . 1 . 2]" 1
1046 1 52 LYS QE 1 52 LYS HG2 3.000 . 4.000 2.625 2.233 3.452 . 0 0 "[ . 1 . 2]" 1
1047 1 52 LYS QE 1 52 LYS HG3 3.000 . 4.000 2.823 2.290 3.526 . 0 0 "[ . 1 . 2]" 1
1048 1 52 LYS HG3 1 63 GLU QB 3.000 . 4.000 3.054 2.137 3.764 . 0 0 "[ . 1 . 2]" 1
1049 1 53 ASP H 1 53 ASP HB2 3.000 . 4.000 3.570 2.660 3.724 . 0 0 "[ . 1 . 2]" 1
1050 1 53 ASP H 1 53 ASP HB3 3.000 . 3.700 2.796 2.460 2.971 . 0 0 "[ . 1 . 2]" 1
1051 1 53 ASP HA 1 63 GLU H 4.000 . 5.000 4.009 3.583 4.263 . 0 0 "[ . 1 . 2]" 1
1052 1 53 ASP HB2 1 54 LEU H 3.000 . 4.500 3.926 3.715 4.522 0.022 16 0 "[ . 1 . 2]" 1
1053 1 53 ASP HB3 1 54 LEU H 4.000 . 5.000 4.495 4.284 4.604 . 0 0 "[ . 1 . 2]" 1
1054 1 54 LEU H 1 54 LEU HB2 3.000 . 3.500 2.240 2.142 2.380 . 0 0 "[ . 1 . 2]" 1
1055 1 54 LEU H 1 54 LEU HB3 3.000 . 3.500 2.885 2.818 2.948 . 0 0 "[ . 1 . 2]" 1
1056 1 54 LEU H 1 54 LEU MD1 4.000 . 5.500 4.446 4.424 4.466 . 0 0 "[ . 1 . 2]" 1
1057 1 54 LEU H 1 54 LEU MD2 4.000 . 5.000 4.139 4.109 4.175 . 0 0 "[ . 1 . 2]" 1
1058 1 54 LEU H 1 54 LEU HG 3.000 . 4.500 4.322 4.176 4.467 . 0 0 "[ . 1 . 2]" 1
1059 1 54 LEU H 1 62 HIS HA 3.000 . 3.300 2.928 2.799 2.998 . 0 0 "[ . 1 . 2]" 1
1060 1 54 LEU HA 1 54 LEU MD1 3.000 . 4.400 3.740 3.725 3.754 . 0 0 "[ . 1 . 2]" 1
1061 1 54 LEU HA 1 54 LEU MD2 3.000 . 3.500 2.013 2.003 2.024 . 0 0 "[ . 1 . 2]" 1
1062 1 54 LEU HA 1 54 LEU HG 3.000 . 3.800 3.115 3.050 3.181 . 0 0 "[ . 1 . 2]" 1
1063 1 54 LEU HA 1 55 SER H 2.500 . 2.900 2.228 2.215 2.243 . 0 0 "[ . 1 . 2]" 1
1064 1 54 LEU HA 1 63 GLU QG 4.000 . 5.500 4.111 3.216 4.538 . 0 0 "[ . 1 . 2]" 1
1065 1 54 LEU HB2 1 54 LEU MD1 3.000 . 3.800 2.817 2.775 2.849 . 0 0 "[ . 1 . 2]" 1
1066 1 54 LEU HB2 1 54 LEU MD2 3.000 . 3.800 3.153 3.132 3.170 . 0 0 "[ . 1 . 2]" 1
1067 1 54 LEU HB2 1 55 SER H 4.000 . 5.000 4.535 4.518 4.558 . 0 0 "[ . 1 . 2]" 1
1068 1 54 LEU HB2 1 61 TRP H 4.000 . 4.500 4.061 4.018 4.105 . 0 0 "[ . 1 . 2]" 1
1069 1 54 LEU HB2 1 61 TRP HA 4.000 . 5.500 5.250 5.169 5.300 . 0 0 "[ . 1 . 2]" 1
1070 1 54 LEU HB2 1 61 TRP HB2 4.000 . 4.500 3.991 3.874 4.046 . 0 0 "[ . 1 . 2]" 1
1071 1 54 LEU HB2 1 61 TRP HB3 3.000 . 4.000 3.920 3.805 3.985 . 0 0 "[ . 1 . 2]" 1
1072 1 54 LEU HB2 1 63 GLU H 3.000 . 3.200 2.770 2.663 2.846 . 0 0 "[ . 1 . 2]" 1
1073 1 54 LEU HB2 1 63 GLU HA 3.000 . 3.200 2.369 2.308 2.570 . 0 0 "[ . 1 . 2]" 1
1074 1 54 LEU HB2 1 66 PHE HD2 4.000 . 5.000 4.859 4.699 4.970 . 0 0 "[ . 1 . 2]" 1
1075 1 54 LEU HB3 1 54 LEU MD1 3.000 . 3.800 2.159 2.153 2.164 . 0 0 "[ . 1 . 2]" 1
1076 1 54 LEU HB3 1 54 LEU MD2 3.000 . 3.800 2.897 2.851 2.939 . 0 0 "[ . 1 . 2]" 1
1077 1 54 LEU HB3 1 55 SER H 4.000 . 5.000 4.003 3.950 4.080 . 0 0 "[ . 1 . 2]" 1
1078 1 54 LEU HB3 1 60 HIS HA 4.000 . 5.000 4.599 4.561 4.668 . 0 0 "[ . 1 . 2]" 1
1079 1 54 LEU HB3 1 61 TRP H 3.000 . 3.500 3.014 2.960 3.070 . 0 0 "[ . 1 . 2]" 1
1080 1 54 LEU HB3 1 61 TRP HA 4.000 . 5.000 4.430 4.390 4.476 . 0 0 "[ . 1 . 2]" 1
1081 1 54 LEU HB3 1 61 TRP HB2 3.000 . 3.100 2.476 2.416 2.508 . 0 0 "[ . 1 . 2]" 1
1082 1 54 LEU HB3 1 61 TRP HB3 3.000 . 3.300 3.041 2.994 3.106 . 0 0 "[ . 1 . 2]" 1
1083 1 54 LEU HB3 1 66 PHE HD2 3.000 . 4.000 3.547 3.437 3.638 . 0 0 "[ . 1 . 2]" 1
1084 1 54 LEU MD1 1 55 SER H 4.000 . 5.000 4.151 4.104 4.192 . 0 0 "[ . 1 . 2]" 1
1085 1 54 LEU MD1 1 56 TYR HB2 3.000 . 4.000 3.119 2.986 3.169 . 0 0 "[ . 1 . 2]" 1
1086 1 54 LEU MD1 1 61 TRP HB2 3.000 . 4.000 2.880 2.809 2.953 . 0 0 "[ . 1 . 2]" 1
1087 1 54 LEU MD1 1 61 TRP HB3 4.000 . 4.200 3.232 3.165 3.281 . 0 0 "[ . 1 . 2]" 1
1088 1 54 LEU MD1 1 61 TRP HE3 4.000 . 5.000 3.603 3.530 3.682 . 0 0 "[ . 1 . 2]" 1
1089 1 54 LEU MD1 1 63 GLU H 4.000 . 5.800 4.760 4.669 4.799 . 0 0 "[ . 1 . 2]" 1
1090 1 54 LEU MD1 1 63 GLU HA 3.000 . 4.000 2.872 2.758 2.988 . 0 0 "[ . 1 . 2]" 1
1091 1 54 LEU MD1 1 63 GLU QG 4.000 . 5.000 3.597 3.434 3.719 . 0 0 "[ . 1 . 2]" 1
1092 1 54 LEU MD1 1 66 PHE H 4.000 . 5.200 3.823 3.747 3.880 . 0 0 "[ . 1 . 2]" 1
1093 1 54 LEU MD1 1 66 PHE HB2 3.000 . 3.500 2.234 2.222 2.251 . 0 0 "[ . 1 . 2]" 1
1094 1 54 LEU MD1 1 66 PHE HB3 3.000 . 4.000 2.508 2.456 2.583 . 0 0 "[ . 1 . 2]" 1
1095 1 54 LEU MD1 1 66 PHE HD2 2.500 . 3.000 2.232 2.191 2.318 . 0 0 "[ . 1 . 2]" 1
1096 1 54 LEU MD1 1 76 VAL HA 3.000 . 4.500 2.642 2.442 2.760 . 0 0 "[ . 1 . 2]" 1
1097 1 54 LEU MD1 1 76 VAL MG1 4.000 . 4.500 2.426 2.267 2.581 . 0 0 "[ . 1 . 2]" 1
1098 1 54 LEU MD1 1 76 VAL MG2 3.000 . 3.700 2.059 2.035 2.101 . 0 0 "[ . 1 . 2]" 1
1099 1 54 LEU MD1 1 77 ASP H 4.000 . 5.300 3.459 3.230 3.541 . 0 0 "[ . 1 . 2]" 1
1100 1 54 LEU MD2 1 55 SER H 3.000 . 3.500 2.005 1.951 2.072 . 0 0 "[ . 1 . 2]" 1
1101 1 54 LEU MD2 1 56 TYR HB2 3.000 . 4.500 3.366 3.245 3.454 . 0 0 "[ . 1 . 2]" 1
1102 1 54 LEU MD2 1 63 GLU HA 3.000 . 4.700 4.069 4.019 4.160 . 0 0 "[ . 1 . 2]" 1
1103 1 54 LEU MD2 1 63 GLU QG 4.000 . 5.000 3.352 3.046 3.566 . 0 0 "[ . 1 . 2]" 1
1104 1 54 LEU MD2 1 76 VAL HA 4.000 . 5.500 3.806 3.662 3.969 . 0 0 "[ . 1 . 2]" 1
1105 1 54 LEU MD2 1 76 VAL MG1 4.000 . 4.500 2.217 2.199 2.285 . 0 0 "[ . 1 . 2]" 1
1106 1 54 LEU HG 1 55 SER H 4.000 . 5.000 4.620 4.546 4.703 . 0 0 "[ . 1 . 2]" 1
1107 1 54 LEU HG 1 61 TRP HB3 4.000 . 5.000 5.169 5.131 5.211 0.211 20 0 "[ . 1 . 2]" 1
1108 1 54 LEU HG 1 63 GLU H 4.000 . 5.000 4.314 4.248 4.360 . 0 0 "[ . 1 . 2]" 1
1109 1 54 LEU HG 1 63 GLU HA 3.000 . 3.500 2.401 2.343 2.493 . 0 0 "[ . 1 . 2]" 1
1110 1 54 LEU HG 1 63 GLU QG 3.000 . 4.000 2.324 2.251 2.471 . 0 0 "[ . 1 . 2]" 1
1111 1 54 LEU HG 1 66 PHE H 4.000 . 5.800 5.555 5.523 5.626 . 0 0 "[ . 1 . 2]" 1
1112 1 54 LEU HG 1 66 PHE HB2 4.000 . 4.500 4.457 4.407 4.517 0.017 11 0 "[ . 1 . 2]" 1
1113 1 54 LEU HG 1 66 PHE HB3 4.000 . 5.000 4.562 4.506 4.633 . 0 0 "[ . 1 . 2]" 1
1114 1 54 LEU HG 1 66 PHE HD2 4.000 . 5.000 4.965 4.883 5.022 0.022 15 0 "[ . 1 . 2]" 1
1115 1 54 LEU HG 1 76 VAL HB 4.000 . 5.000 5.021 4.938 5.072 0.072 19 0 "[ . 1 . 2]" 1
1116 1 54 LEU HG 1 76 VAL MG1 3.000 . 4.000 2.746 2.697 2.775 . 0 0 "[ . 1 . 2]" 1
1117 1 55 SER H 1 55 SER QB 3.000 . 4.000 2.783 2.338 3.006 . 0 0 "[ . 1 . 2]" 1
1118 1 55 SER HA 1 56 TYR H 2.500 . 2.900 2.197 2.174 2.205 . 0 0 "[ . 1 . 2]" 1
1119 1 55 SER HA 1 56 TYR HB2 4.000 . 4.500 4.324 4.265 4.384 . 0 0 "[ . 1 . 2]" 1
1120 1 55 SER HA 1 56 TYR HB3 4.000 . 5.200 4.993 4.915 5.091 . 0 0 "[ . 1 . 2]" 1
1121 1 55 SER HA 1 60 HIS HA 2.500 . 2.800 2.377 2.319 2.503 . 0 0 "[ . 1 . 2]" 1
1122 1 55 SER HA 1 60 HIS HD2 3.000 . 4.000 3.668 3.138 4.011 0.011 9 0 "[ . 1 . 2]" 1
1123 1 55 SER HA 1 61 TRP H 3.000 . 3.700 3.688 3.618 3.722 0.022 2 0 "[ . 1 . 2]" 1
1124 1 55 SER HA 1 61 TRP HE3 4.000 . 5.000 4.812 4.721 4.904 . 0 0 "[ . 1 . 2]" 1
1125 1 55 SER QB 1 56 TYR H 3.000 . 4.000 3.375 3.259 3.757 . 0 0 "[ . 1 . 2]" 1
1126 1 55 SER QB 1 60 HIS HA 4.000 . 4.500 3.855 3.731 3.976 . 0 0 "[ . 1 . 2]" 1
1127 1 55 SER QB 1 60 HIS HD2 4.000 . 4.300 3.147 2.745 3.588 . 0 0 "[ . 1 . 2]" 1
1128 1 56 TYR H 1 56 TYR HB2 3.000 . 3.300 3.075 3.045 3.109 . 0 0 "[ . 1 . 2]" 1
1129 1 56 TYR H 1 56 TYR HB3 3.000 . 3.300 3.135 3.022 3.253 . 0 0 "[ . 1 . 2]" 1
1130 1 56 TYR H 1 59 ARG H 3.000 . 4.000 2.971 2.896 3.094 . 0 0 "[ . 1 . 2]" 1
1131 1 56 TYR H 1 59 ARG HB2 3.000 . 4.000 3.537 3.431 3.656 . 0 0 "[ . 1 . 2]" 1
1132 1 56 TYR H 1 60 HIS HA 3.000 . 3.500 3.438 3.356 3.529 0.029 8 0 "[ . 1 . 2]" 1
1133 1 56 TYR H 1 61 TRP HE3 3.000 . 3.800 3.837 3.779 3.873 0.073 17 0 "[ . 1 . 2]" 1
1134 1 56 TYR H 1 61 TRP HZ3 4.000 . 4.500 4.517 4.490 4.560 0.060 20 0 "[ . 1 . 2]" 1
1135 1 56 TYR HA 1 56 TYR HD1 3.000 . 3.300 3.369 3.239 3.422 0.122 12 0 "[ . 1 . 2]" 1
1136 1 56 TYR HA 1 57 LYS H 2.500 . 2.800 2.218 2.184 2.269 . 0 0 "[ . 1 . 2]" 1
1137 1 56 TYR HB2 1 56 TYR HD1 3.000 . 3.800 3.728 3.714 3.740 . 0 0 "[ . 1 . 2]" 1
1138 1 56 TYR HB2 1 56 TYR HD2 2.500 . 2.800 2.367 2.358 2.385 . 0 0 "[ . 1 . 2]" 1
1139 1 56 TYR HB2 1 61 TRP HE3 3.000 . 4.000 3.657 3.548 3.776 . 0 0 "[ . 1 . 2]" 1
1140 1 56 TYR HB2 1 61 TRP HZ3 3.000 . 4.400 4.434 4.356 4.512 0.112 8 0 "[ . 1 . 2]" 1
1141 1 56 TYR HB2 1 66 PHE HE2 3.000 . 3.500 3.351 3.229 3.497 . 0 0 "[ . 1 . 2]" 1
1142 1 56 TYR HB3 1 56 TYR HD1 2.500 . 2.800 2.579 2.541 2.631 . 0 0 "[ . 1 . 2]" 1
1143 1 56 TYR HB3 1 56 TYR HD2 3.000 . 3.600 3.587 3.556 3.615 0.015 13 0 "[ . 1 . 2]" 1
1144 1 56 TYR HB3 1 59 ARG HB2 4.000 . 5.000 3.819 3.642 4.079 . 0 0 "[ . 1 . 2]" 1
1145 1 56 TYR HB3 1 61 TRP HE3 3.000 . 3.500 3.147 3.012 3.420 . 0 0 "[ . 1 . 2]" 1
1146 1 56 TYR HB3 1 61 TRP HZ3 4.000 . 4.500 2.945 2.834 3.131 . 0 0 "[ . 1 . 2]" 1
1147 1 56 TYR HB3 1 66 PHE HD2 4.000 . 5.000 4.433 4.231 4.592 . 0 0 "[ . 1 . 2]" 1
1148 1 56 TYR HB3 1 66 PHE HE2 2.500 . 3.000 2.699 2.472 2.835 . 0 0 "[ . 1 . 2]" 1
1149 1 56 TYR HB3 1 66 PHE HZ 4.000 . 4.500 4.308 4.102 4.482 . 0 0 "[ . 1 . 2]" 1
1150 1 56 TYR HB3 1 80 PHE HZ 4.000 . 5.000 4.002 3.607 4.256 . 0 0 "[ . 1 . 2]" 1
1151 1 56 TYR HD1 1 57 LYS H 3.000 . 3.500 2.866 2.515 3.221 . 0 0 "[ . 1 . 2]" 1
1152 1 56 TYR HD1 1 57 LYS HB2 3.000 . 3.500 2.297 2.276 2.318 . 0 0 "[ . 1 . 2]" 1
1153 1 56 TYR HD1 1 57 LYS HB3 3.000 . 3.500 3.066 2.759 3.443 . 0 0 "[ . 1 . 2]" 1
1154 1 56 TYR HD2 1 77 ASP HA 3.000 . 4.000 3.911 3.521 4.051 0.051 8 0 "[ . 1 . 2]" 1
1155 1 57 LYS H 1 57 LYS HB2 3.000 . 3.500 3.026 2.977 3.100 . 0 0 "[ . 1 . 2]" 1
1156 1 57 LYS H 1 57 LYS HB3 3.000 . 3.500 3.625 3.577 3.660 0.160 17 0 "[ . 1 . 2]" 1
1157 1 57 LYS H 1 57 LYS HG2 4.000 . 5.000 4.887 4.784 4.920 . 0 0 "[ . 1 . 2]" 1
1158 1 57 LYS H 1 57 LYS HG3 3.000 . 4.400 4.379 4.328 4.420 0.020 16 0 "[ . 1 . 2]" 1
1159 1 57 LYS H 1 58 ASP H 3.000 . 4.500 3.006 2.908 3.153 . 0 0 "[ . 1 . 2]" 1
1160 1 57 LYS HA 1 57 LYS HG2 2.500 . 3.000 3.009 2.859 3.073 0.073 20 0 "[ . 1 . 2]" 1
1161 1 57 LYS HA 1 57 LYS HG3 3.000 . 3.300 2.359 2.331 2.492 . 0 0 "[ . 1 . 2]" 1
1162 1 57 LYS HA 1 58 ASP H 3.000 . 3.300 2.621 2.513 2.753 . 0 0 "[ . 1 . 2]" 1
1163 1 57 LYS HA 1 58 ASP HB3 4.000 . 5.000 4.399 4.335 4.469 . 0 0 "[ . 1 . 2]" 1
1164 1 57 LYS HB2 1 58 ASP H 4.000 . 5.000 4.654 4.631 4.665 . 0 0 "[ . 1 . 2]" 1
1165 1 57 LYS HB3 1 58 ASP H 4.000 . 5.000 4.346 4.264 4.395 . 0 0 "[ . 1 . 2]" 1
1166 1 57 LYS HB3 1 59 ARG H 3.000 . 3.500 3.504 3.322 3.571 0.071 2 0 "[ . 1 . 2]" 1
1167 1 57 LYS HB3 1 80 PHE HZ 4.000 . 5.000 5.037 4.952 5.081 0.081 3 0 "[ . 1 . 2]" 1
1168 1 57 LYS HG2 1 58 ASP H 4.000 . 5.000 4.533 4.294 4.705 . 0 0 "[ . 1 . 2]" 1
1169 1 57 LYS HG2 1 58 ASP HB3 3.000 . 4.000 3.703 3.547 3.908 . 0 0 "[ . 1 . 2]" 1
1170 1 57 LYS HG3 1 58 ASP H 4.000 . 5.000 4.668 4.473 4.865 . 0 0 "[ . 1 . 2]" 1
1171 1 57 LYS HG3 1 58 ASP HB3 4.000 . 5.000 4.806 4.583 5.010 0.010 13 0 "[ . 1 . 2]" 1
1172 1 58 ASP H 1 58 ASP HB2 3.000 . 3.300 3.055 2.972 3.100 . 0 0 "[ . 1 . 2]" 1
1173 1 58 ASP H 1 58 ASP HB3 3.000 . 3.600 3.583 3.518 3.621 0.021 18 0 "[ . 1 . 2]" 1
1174 1 58 ASP H 1 59 ARG H 2.500 . 3.500 2.886 2.798 2.968 . 0 0 "[ . 1 . 2]" 1
1175 1 58 ASP HB2 1 59 ARG H 4.000 . 5.000 4.489 4.468 4.525 . 0 0 "[ . 1 . 2]" 1
1176 1 58 ASP HB3 1 59 ARG H 3.000 . 3.800 3.798 3.788 3.810 0.010 3 0 "[ . 1 . 2]" 1
1177 1 59 ARG H 1 59 ARG HB2 2.500 . 2.800 2.504 2.444 2.531 . 0 0 "[ . 1 . 2]" 1
1178 1 59 ARG H 1 59 ARG HB3 3.000 . 4.000 3.717 3.679 3.734 . 0 0 "[ . 1 . 2]" 1
1179 1 59 ARG H 1 59 ARG HD2 4.000 . 4.000 4.031 4.009 4.094 0.094 20 0 "[ . 1 . 2]" 1
1180 1 59 ARG H 1 59 ARG HD3 4.000 . 5.000 5.012 4.952 5.033 0.033 1 0 "[ . 1 . 2]" 1
1181 1 59 ARG H 1 59 ARG HG2 3.000 . 4.000 4.135 4.095 4.171 0.171 11 0 "[ . 1 . 2]" 1
1182 1 59 ARG H 1 59 ARG HG3 2.500 . 3.000 2.904 2.856 2.946 . 0 0 "[ . 1 . 2]" 1
1183 1 59 ARG HA 1 59 ARG HD2 4.000 . 5.000 4.555 4.544 4.567 . 0 0 "[ . 1 . 2]" 1
1184 1 59 ARG HA 1 59 ARG HD3 4.000 . 5.000 4.445 4.386 4.467 . 0 0 "[ . 1 . 2]" 1
1185 1 59 ARG HA 1 59 ARG HG2 3.000 . 3.200 2.564 2.509 2.588 . 0 0 "[ . 1 . 2]" 1
1186 1 59 ARG HA 1 59 ARG HG3 3.000 . 3.200 2.772 2.744 2.805 . 0 0 "[ . 1 . 2]" 1
1187 1 59 ARG HA 1 60 HIS H 2.500 . 2.900 2.457 2.446 2.468 . 0 0 "[ . 1 . 2]" 1
1188 1 59 ARG HB2 1 59 ARG HD2 2.500 . 3.000 2.365 2.341 2.433 . 0 0 "[ . 1 . 2]" 1
1189 1 59 ARG HB2 1 59 ARG HD3 3.000 . 3.500 2.891 2.812 2.934 . 0 0 "[ . 1 . 2]" 1
1190 1 59 ARG HB2 1 60 HIS H 3.000 . 4.000 3.654 3.625 3.694 . 0 0 "[ . 1 . 2]" 1
1191 1 59 ARG HB2 1 60 HIS HA 4.000 . 5.000 4.822 4.779 4.894 . 0 0 "[ . 1 . 2]" 1
1192 1 59 ARG HB2 1 61 TRP HZ3 2.500 . 2.900 2.522 2.432 2.622 . 0 0 "[ . 1 . 2]" 1
1193 1 59 ARG HB3 1 59 ARG HD2 3.000 . 3.300 3.192 3.162 3.220 . 0 0 "[ . 1 . 2]" 1
1194 1 59 ARG HB3 1 59 ARG HD3 2.500 . 3.000 2.633 2.522 2.679 . 0 0 "[ . 1 . 2]" 1
1195 1 59 ARG HB3 1 60 HIS H 2.500 . 2.900 2.422 2.412 2.433 . 0 0 "[ . 1 . 2]" 1
1196 1 59 ARG HB3 1 61 TRP HZ3 3.000 . 3.300 3.316 3.266 3.386 0.086 8 0 "[ . 1 . 2]" 1
1197 1 59 ARG HD2 1 60 HIS H 4.000 . 5.500 5.555 5.538 5.581 0.081 8 0 "[ . 1 . 2]" 1
1198 1 59 ARG HD2 1 61 TRP HE3 4.000 . 5.300 5.063 4.906 5.128 . 0 0 "[ . 1 . 2]" 1
1199 1 59 ARG HD2 1 61 TRP HH2 3.000 . 4.000 3.015 2.813 3.159 . 0 0 "[ . 1 . 2]" 1
1200 1 59 ARG HD2 1 61 TRP HZ3 2.500 . 2.900 2.868 2.708 2.937 0.037 2 0 "[ . 1 . 2]" 1
1201 1 59 ARG HD3 1 60 HIS H 4.000 . 5.000 4.966 4.834 5.021 0.021 17 0 "[ . 1 . 2]" 1
1202 1 59 ARG HD3 1 61 TRP HE3 4.000 . 5.200 5.084 4.938 5.148 . 0 0 "[ . 1 . 2]" 1
1203 1 59 ARG HD3 1 61 TRP HH2 2.500 . 2.900 2.320 2.300 2.330 . 0 0 "[ . 1 . 2]" 1
1204 1 59 ARG HD3 1 61 TRP HZ3 3.000 . 3.200 3.246 3.167 3.295 0.095 13 0 "[ . 1 . 2]" 1
1205 1 59 ARG HE 1 59 ARG HG2 2.500 . 3.300 2.790 2.490 3.564 0.264 18 0 "[ . 1 . 2]" 1
1206 1 59 ARG HE 1 59 ARG HG3 2.500 . 3.300 2.741 2.589 3.144 . 0 0 "[ . 1 . 2]" 1
1207 1 59 ARG HG2 1 60 HIS H 4.000 . 4.300 3.941 3.853 4.006 . 0 0 "[ . 1 . 2]" 1
1208 1 59 ARG HG2 1 61 TRP HZ3 4.000 . 5.000 4.846 4.793 4.916 . 0 0 "[ . 1 . 2]" 1
1209 1 59 ARG HG3 1 60 HIS H 4.000 . 5.000 4.696 4.669 4.730 . 0 0 "[ . 1 . 2]" 1
1210 1 59 ARG HG3 1 61 TRP HZ3 4.000 . 5.000 4.638 4.546 4.747 . 0 0 "[ . 1 . 2]" 1
1211 1 60 HIS H 1 60 HIS HB2 2.500 . 3.000 2.604 2.567 2.661 . 0 0 "[ . 1 . 2]" 1
1212 1 60 HIS H 1 60 HIS HB3 3.000 . 4.000 3.782 3.759 3.816 . 0 0 "[ . 1 . 2]" 1
1213 1 60 HIS HA 1 60 HIS HD2 3.000 . 3.500 3.230 2.891 3.470 . 0 0 "[ . 1 . 2]" 1
1214 1 60 HIS HA 1 61 TRP H 2.500 . 2.900 2.284 2.262 2.300 . 0 0 "[ . 1 . 2]" 1
1215 1 60 HIS HB2 1 61 TRP H 3.000 . 4.000 3.932 3.873 3.960 . 0 0 "[ . 1 . 2]" 1
1216 1 60 HIS HB3 1 60 HIS HD2 2.500 . 3.500 2.855 2.792 2.968 . 0 0 "[ . 1 . 2]" 1
1217 1 60 HIS HB3 1 61 TRP H 3.000 . 3.300 2.815 2.769 2.891 . 0 0 "[ . 1 . 2]" 1
1218 1 61 TRP H 1 61 TRP HB2 2.500 . 2.900 2.822 2.801 2.837 . 0 0 "[ . 1 . 2]" 1
1219 1 61 TRP H 1 61 TRP HB3 3.000 . 4.000 3.778 3.761 3.795 . 0 0 "[ . 1 . 2]" 1
1220 1 61 TRP H 1 61 TRP HE3 4.000 . 4.500 4.391 4.365 4.435 . 0 0 "[ . 1 . 2]" 1
1221 1 61 TRP HA 1 61 TRP HD1 3.000 . 3.200 2.513 2.489 2.543 . 0 0 "[ . 1 . 2]" 1
1222 1 61 TRP HA 1 61 TRP HE1 4.000 . 5.000 4.541 4.526 4.558 . 0 0 "[ . 1 . 2]" 1
1223 1 61 TRP HA 1 61 TRP HE3 4.000 . 5.000 4.758 4.737 4.777 . 0 0 "[ . 1 . 2]" 1
1224 1 61 TRP HA 1 62 HIS H 2.500 . 3.200 2.323 2.310 2.344 . 0 0 "[ . 1 . 2]" 1
1225 1 61 TRP HB2 1 61 TRP HD1 3.000 . 4.000 3.880 3.877 3.883 . 0 0 "[ . 1 . 2]" 1
1226 1 61 TRP HB2 1 61 TRP HE3 2.500 . 2.900 2.462 2.446 2.472 . 0 0 "[ . 1 . 2]" 1
1227 1 61 TRP HB2 1 62 HIS H 4.000 . 4.300 4.222 4.171 4.240 . 0 0 "[ . 1 . 2]" 1
1228 1 61 TRP HB2 1 66 PHE HB2 3.000 . 3.400 3.439 3.406 3.464 0.064 1 0 "[ . 1 . 2]" 1
1229 1 61 TRP HB2 1 66 PHE HB3 4.000 . 5.000 5.050 5.026 5.071 0.071 9 0 "[ . 1 . 2]" 1
1230 1 61 TRP HB2 1 66 PHE HD2 2.500 . 2.900 2.374 2.331 2.446 . 0 0 "[ . 1 . 2]" 1
1231 1 61 TRP HB3 1 61 TRP HD1 2.500 . 2.900 2.925 2.913 2.943 0.043 8 0 "[ . 1 . 2]" 1
1232 1 61 TRP HB3 1 61 TRP HE3 3.000 . 4.000 3.887 3.860 3.902 . 0 0 "[ . 1 . 2]" 1
1233 1 61 TRP HB3 1 62 HIS H 2.500 . 3.000 3.027 2.943 3.056 0.056 20 0 "[ . 1 . 2]" 1
1234 1 61 TRP HB3 1 65 CYS HB2 3.000 . 3.600 3.424 3.395 3.452 . 0 0 "[ . 1 . 2]" 1
1235 1 61 TRP HB3 1 65 CYS HB3 4.000 3.800 4.500 4.336 4.288 4.392 . 0 0 "[ . 1 . 2]" 1
1236 1 61 TRP HB3 1 66 PHE HB2 2.500 . 2.900 2.484 2.448 2.514 . 0 0 "[ . 1 . 2]" 1
1237 1 61 TRP HB3 1 66 PHE HD2 2.500 . 2.900 2.750 2.687 2.843 . 0 0 "[ . 1 . 2]" 1
1238 1 61 TRP HD1 1 62 HIS H 3.000 . 3.500 3.098 3.051 3.139 . 0 0 "[ . 1 . 2]" 1
1239 1 61 TRP HD1 1 65 CYS HB2 3.000 . 3.300 3.068 2.988 3.143 . 0 0 "[ . 1 . 2]" 1
1240 1 61 TRP HD1 1 65 CYS HB3 2.500 . 3.000 2.918 2.825 3.009 0.009 4 0 "[ . 1 . 2]" 1
1241 1 61 TRP HE1 1 87 LEU MD1 4.000 . 5.000 4.135 4.010 4.200 . 0 0 "[ . 1 . 2]" 1
1242 1 62 HIS H 1 62 HIS QB 3.000 . 4.000 2.342 2.325 2.358 . 0 0 "[ . 1 . 2]" 1
1243 1 62 HIS H 1 65 CYS H 3.000 . 4.000 3.613 3.551 3.635 . 0 0 "[ . 1 . 2]" 1
1244 1 62 HIS H 1 65 CYS HB2 2.500 . 2.900 2.230 2.156 2.280 . 0 0 "[ . 1 . 2]" 1
1245 1 62 HIS H 1 65 CYS HB3 3.000 . 4.000 3.635 3.573 3.700 . 0 0 "[ . 1 . 2]" 1
1246 1 62 HIS HA 1 62 HIS HD2 3.000 . 3.200 2.737 2.699 2.761 . 0 0 "[ . 1 . 2]" 1
1247 1 62 HIS HA 1 63 GLU H 2.500 . 2.900 2.267 2.244 2.299 . 0 0 "[ . 1 . 2]" 1
1248 1 62 HIS QB 1 63 GLU H 4.000 . 4.500 3.260 3.209 3.314 . 0 0 "[ . 1 . 2]" 1
1249 1 62 HIS QB 1 64 ALA H 3.000 . 3.500 2.481 2.438 2.545 . 0 0 "[ . 1 . 2]" 1
1250 1 62 HIS QB 1 64 ALA MB 4.000 . 5.000 2.973 2.848 3.044 . 0 0 "[ . 1 . 2]" 1
1251 1 62 HIS QB 1 65 CYS H 3.000 . 4.000 2.323 2.294 2.362 . 0 0 "[ . 1 . 2]" 1
1252 1 62 HIS QB 1 65 CYS HA 4.000 . 5.200 4.028 4.015 4.049 . 0 0 "[ . 1 . 2]" 1
1253 1 62 HIS QB 1 65 CYS HB2 3.000 . 3.500 2.291 2.285 2.298 . 0 0 "[ . 1 . 2]" 1
1254 1 63 GLU H 1 63 GLU QB 3.000 . 4.000 2.239 2.142 2.460 . 0 0 "[ . 1 . 2]" 1
1255 1 63 GLU H 1 63 GLU QG 3.000 . 4.500 3.438 2.231 3.897 . 0 0 "[ . 1 . 2]" 1
1256 1 63 GLU H 1 64 ALA H 4.000 . 5.000 2.920 2.875 2.959 . 0 0 "[ . 1 . 2]" 1
1257 1 63 GLU HA 1 63 GLU QG 2.500 . 3.200 2.280 2.225 2.317 . 0 0 "[ . 1 . 2]" 1
1258 1 63 GLU HA 1 64 ALA H 3.000 . 3.500 3.494 3.461 3.514 0.014 3 0 "[ . 1 . 2]" 1
1259 1 63 GLU HA 1 65 CYS H 3.000 . 4.200 4.285 4.254 4.305 0.105 10 0 "[ . 1 . 2]" 1
1260 1 63 GLU HA 1 66 PHE H 4.000 . 4.300 3.964 3.882 4.017 . 0 0 "[ . 1 . 2]" 1
1261 1 63 GLU HA 1 66 PHE HB2 4.000 . 4.300 3.904 3.757 3.975 . 0 0 "[ . 1 . 2]" 1
1262 1 63 GLU HA 1 66 PHE HB3 4.000 . 4.300 4.065 3.951 4.179 . 0 0 "[ . 1 . 2]" 1
1263 1 63 GLU HA 1 66 PHE HD2 4.000 . 5.500 5.400 5.226 5.497 . 0 0 "[ . 1 . 2]" 1
1264 1 63 GLU HA 1 76 VAL MG1 4.000 . 5.000 4.059 4.019 4.100 . 0 0 "[ . 1 . 2]" 1
1265 1 63 GLU HA 1 76 VAL MG2 3.000 . 4.000 2.926 2.779 3.018 . 0 0 "[ . 1 . 2]" 1
1266 1 63 GLU QB 1 64 ALA H 3.000 . 4.000 2.944 2.887 3.017 . 0 0 "[ . 1 . 2]" 1
1267 1 63 GLU QB 1 64 ALA HA 4.000 . 5.000 4.093 3.995 4.225 . 0 0 "[ . 1 . 2]" 1
1268 1 63 GLU QG 1 76 VAL MG1 4.000 . 5.000 2.689 2.418 3.157 . 0 0 "[ . 1 . 2]" 1
1269 1 63 GLU QG 1 76 VAL MG2 4.000 . 5.000 2.428 2.094 3.281 . 0 0 "[ . 1 . 2]" 1
1270 1 64 ALA H 1 64 ALA HA 3.000 . 3.500 2.960 2.956 2.964 . 0 0 "[ . 1 . 2]" 1
1271 1 64 ALA H 1 64 ALA MB 2.500 . 3.400 2.309 2.258 2.323 . 0 0 "[ . 1 . 2]" 1
1272 1 64 ALA H 1 65 CYS H 3.000 . 3.500 2.359 2.314 2.388 . 0 0 "[ . 1 . 2]" 1
1273 1 64 ALA HA 1 65 CYS H 3.000 . 4.000 3.493 3.485 3.503 . 0 0 "[ . 1 . 2]" 1
1274 1 64 ALA HA 1 66 PHE H 4.000 . 5.200 4.266 4.242 4.292 . 0 0 "[ . 1 . 2]" 1
1275 1 64 ALA MB 1 65 CYS H 3.000 . 4.000 2.923 2.867 2.952 . 0 0 "[ . 1 . 2]" 1
1276 1 64 ALA MB 1 65 CYS HA 4.000 . 5.000 3.910 3.890 3.926 . 0 0 "[ . 1 . 2]" 1
1277 1 65 CYS H 1 65 CYS HA 3.000 . 3.300 2.931 2.928 2.935 . 0 0 "[ . 1 . 2]" 1
1278 1 65 CYS H 1 65 CYS HB2 2.500 . 2.900 2.310 2.302 2.320 . 0 0 "[ . 1 . 2]" 1
1279 1 65 CYS H 1 65 CYS HB3 3.000 . 3.700 3.596 3.592 3.603 . 0 0 "[ . 1 . 2]" 1
1280 1 65 CYS H 1 66 PHE H 2.500 . 2.900 2.452 2.427 2.477 . 0 0 "[ . 1 . 2]" 1
1281 1 65 CYS HA 1 65 CYS HB2 3.000 . 3.300 3.010 3.007 3.012 . 0 0 "[ . 1 . 2]" 1
1282 1 65 CYS HA 1 65 CYS HB3 2.500 . 2.900 2.582 2.575 2.588 . 0 0 "[ . 1 . 2]" 1
1283 1 65 CYS HA 1 66 PHE H 3.000 . 4.000 3.504 3.498 3.510 . 0 0 "[ . 1 . 2]" 1
1284 1 65 CYS HB2 1 66 PHE H 2.500 . 2.900 2.927 2.893 2.952 0.052 19 0 "[ . 1 . 2]" 1
1285 1 65 CYS HB2 1 66 PHE HB2 4.000 . 4.500 4.360 4.328 4.395 . 0 0 "[ . 1 . 2]" 1
1286 1 65 CYS HB3 1 66 PHE H 3.000 . 4.000 3.662 3.639 3.690 . 0 0 "[ . 1 . 2]" 1
1287 1 65 CYS HB3 1 66 PHE HA 4.000 . 4.500 4.271 4.253 4.287 . 0 0 "[ . 1 . 2]" 1
1288 1 66 PHE H 1 66 PHE HB2 2.500 . 3.000 2.239 2.230 2.252 . 0 0 "[ . 1 . 2]" 1
1289 1 66 PHE H 1 66 PHE HB3 3.000 . 3.200 2.828 2.805 2.847 . 0 0 "[ . 1 . 2]" 1
1290 1 66 PHE H 1 66 PHE HD2 3.000 . 4.400 4.445 4.432 4.462 0.062 8 0 "[ . 1 . 2]" 1
1291 1 66 PHE H 1 76 VAL MG2 4.000 . 6.000 4.328 4.285 4.376 . 0 0 "[ . 1 . 2]" 1
1292 1 66 PHE HA 1 66 PHE HB2 2.500 . 2.800 2.652 2.639 2.660 . 0 0 "[ . 1 . 2]" 1
1293 1 66 PHE HA 1 66 PHE HB3 2.500 . 3.000 3.009 3.007 3.011 0.011 8 0 "[ . 1 . 2]" 1
1294 1 66 PHE HA 1 66 PHE HD1 2.500 . 3.000 3.021 2.992 3.054 0.054 6 0 "[ . 1 . 2]" 1
1295 1 66 PHE HA 1 66 PHE HD2 3.000 . 4.000 3.763 3.743 3.786 . 0 0 "[ . 1 . 2]" 1
1296 1 66 PHE HA 1 67 HIS H 2.500 . 3.000 2.247 2.240 2.256 . 0 0 "[ . 1 . 2]" 1
1297 1 66 PHE HA 1 87 LEU MD1 3.000 . 4.000 2.965 2.890 3.080 . 0 0 "[ . 1 . 2]" 1
1298 1 66 PHE HB2 1 66 PHE HD1 3.000 . 3.700 3.753 3.748 3.757 0.057 8 0 "[ . 1 . 2]" 1
1299 1 66 PHE HB2 1 66 PHE HD2 2.500 . 2.800 2.326 2.322 2.330 . 0 0 "[ . 1 . 2]" 1
1300 1 66 PHE HB2 1 67 HIS H 4.000 . 5.000 4.645 4.632 4.656 . 0 0 "[ . 1 . 2]" 1
1301 1 66 PHE HB2 1 76 VAL MG2 4.000 . 4.500 3.552 3.505 3.601 . 0 0 "[ . 1 . 2]" 1
1302 1 66 PHE HB3 1 66 PHE HD1 3.000 . 3.300 2.765 2.752 2.783 . 0 0 "[ . 1 . 2]" 1
1303 1 66 PHE HB3 1 66 PHE HD2 3.000 . 3.500 3.444 3.434 3.452 . 0 0 "[ . 1 . 2]" 1
1304 1 66 PHE HB3 1 67 HIS H 3.000 . 4.200 4.287 4.277 4.295 0.095 8 0 "[ . 1 . 2]" 1
1305 1 66 PHE HB3 1 74 SER HA 4.000 . 5.500 4.678 4.570 4.761 . 0 0 "[ . 1 . 2]" 1
1306 1 66 PHE HB3 1 76 VAL HA 3.000 . 4.500 4.103 4.027 4.175 . 0 0 "[ . 1 . 2]" 1
1307 1 66 PHE HB3 1 76 VAL MG2 3.000 . 4.000 2.544 2.476 2.614 . 0 0 "[ . 1 . 2]" 1
1308 1 66 PHE HD1 1 67 HIS H 3.000 . 4.000 3.267 3.209 3.320 . 0 0 "[ . 1 . 2]" 1
1309 1 66 PHE HD1 1 75 LEU H 3.000 . 4.000 3.180 3.100 3.232 . 0 0 "[ . 1 . 2]" 1
1310 1 66 PHE HD1 1 75 LEU HA 4.000 . 5.000 4.733 4.677 4.776 . 0 0 "[ . 1 . 2]" 1
1311 1 66 PHE HD1 1 75 LEU HB2 2.500 . 2.800 2.297 2.286 2.305 . 0 0 "[ . 1 . 2]" 1
1312 1 66 PHE HD1 1 75 LEU HB3 3.000 . 4.000 4.019 3.990 4.039 0.039 13 0 "[ . 1 . 2]" 1
1313 1 66 PHE HD1 1 75 LEU MD1 4.000 . 4.500 3.128 2.927 3.338 . 0 0 "[ . 1 . 2]" 1
1314 1 66 PHE HD1 1 76 VAL HA 4.000 . 4.500 4.645 4.578 4.715 0.215 11 0 "[ . 1 . 2]" 1
1315 1 66 PHE HD1 1 76 VAL MG2 4.000 . 5.500 4.053 3.976 4.154 . 0 0 "[ . 1 . 2]" 1
1316 1 66 PHE HD1 1 87 LEU HB2 4.000 . 4.500 4.616 4.596 4.644 0.144 8 0 "[ . 1 . 2]" 1
1317 1 66 PHE HD1 1 87 LEU HB3 4.000 . 4.500 4.272 4.246 4.328 . 0 0 "[ . 1 . 2]" 1
1318 1 66 PHE HD1 1 87 LEU MD1 3.000 . 4.200 2.958 2.912 3.015 . 0 0 "[ . 1 . 2]" 1
1319 1 66 PHE HD1 1 87 LEU MD2 4.000 . 5.300 4.136 4.106 4.175 . 0 0 "[ . 1 . 2]" 1
1320 1 66 PHE HD2 1 76 VAL MG2 4.000 . 5.500 4.465 4.419 4.531 . 0 0 "[ . 1 . 2]" 1
1321 1 66 PHE HD2 1 87 LEU MD1 4.000 . 5.300 3.946 3.832 4.026 . 0 0 "[ . 1 . 2]" 1
1322 1 66 PHE HE1 1 87 LEU MD1 3.000 . 3.500 2.697 2.672 2.717 . 0 0 "[ . 1 . 2]" 1
1323 1 66 PHE HE1 1 87 LEU MD2 3.000 . 3.500 2.277 2.271 2.281 . 0 0 "[ . 1 . 2]" 1
1324 1 66 PHE HE2 1 87 LEU MD1 4.000 . 4.500 3.469 3.363 3.556 . 0 0 "[ . 1 . 2]" 1
1325 1 66 PHE HZ 1 87 LEU HB3 4.000 . 4.800 4.834 4.803 4.862 0.062 15 0 "[ . 1 . 2]" 1
1326 1 66 PHE HZ 1 87 LEU MD1 4.000 . 4.100 2.945 2.873 3.017 . 0 0 "[ . 1 . 2]" 1
1327 1 66 PHE HZ 1 87 LEU MD2 3.000 . 3.500 2.367 2.316 2.422 . 0 0 "[ . 1 . 2]" 1
1328 1 66 PHE HZ 1 87 LEU HG 4.000 . 5.000 4.958 4.904 5.015 0.015 11 0 "[ . 1 . 2]" 1
1329 1 67 HIS H 1 67 HIS HB2 3.000 . 4.000 3.904 3.883 3.929 . 0 0 "[ . 1 . 2]" 1
1330 1 67 HIS H 1 67 HIS HB3 3.000 . 3.500 3.515 3.496 3.536 0.036 19 0 "[ . 1 . 2]" 1
1331 1 67 HIS H 1 75 LEU MD1 4.000 . 5.500 4.003 3.932 4.069 . 0 0 "[ . 1 . 2]" 1
1332 1 67 HIS HA 1 68 CYS H 2.500 . 2.900 2.533 2.500 2.545 . 0 0 "[ . 1 . 2]" 1
1333 1 67 HIS HA 1 72 ARG HA 4.000 . 5.000 4.940 4.800 4.982 . 0 0 "[ . 1 . 2]" 1
1334 1 67 HIS HA 1 74 SER HA 2.500 . 2.900 2.473 2.411 2.559 . 0 0 "[ . 1 . 2]" 1
1335 1 67 HIS HA 1 75 LEU H 2.500 . 2.800 1.785 1.771 1.802 0.029 11 0 "[ . 1 . 2]" 1
1336 1 67 HIS HA 1 75 LEU HA 4.000 . 5.000 4.656 4.622 4.690 . 0 0 "[ . 1 . 2]" 1
1337 1 67 HIS HA 1 75 LEU MD1 3.000 . 4.000 3.078 2.919 3.230 . 0 0 "[ . 1 . 2]" 1
1338 1 67 HIS HB2 1 68 CYS H 2.500 . 2.900 2.242 2.216 2.315 . 0 0 "[ . 1 . 2]" 1
1339 1 67 HIS HB2 1 72 ARG HA 3.000 . 4.000 2.605 2.483 2.656 . 0 0 "[ . 1 . 2]" 1
1340 1 67 HIS HB2 1 72 ARG HB2 4.000 . 5.200 4.914 3.885 5.226 0.026 7 0 "[ . 1 . 2]" 1
1341 1 67 HIS HB2 1 72 ARG HB3 4.000 . 5.000 4.322 4.071 4.939 . 0 0 "[ . 1 . 2]" 1
1342 1 67 HIS HB2 1 73 ASN H 4.000 . 5.000 3.786 3.685 3.852 . 0 0 "[ . 1 . 2]" 1
1343 1 67 HIS HB2 1 74 SER HA 2.500 . 3.300 3.345 3.311 3.392 0.092 3 0 "[ . 1 . 2]" 1
1344 1 67 HIS HB2 1 75 LEU H 4.000 . 4.300 4.049 4.003 4.099 . 0 0 "[ . 1 . 2]" 1
1345 1 67 HIS HB2 1 75 LEU HG 4.000 . 4.500 4.385 4.287 4.471 . 0 0 "[ . 1 . 2]" 1
1346 1 67 HIS HB3 1 68 CYS H 3.000 . 4.000 3.585 3.567 3.634 . 0 0 "[ . 1 . 2]" 1
1347 1 67 HIS HB3 1 72 ARG HA 3.000 . 4.200 4.215 4.105 4.259 0.059 1 0 "[ . 1 . 2]" 1
1348 1 67 HIS HB3 1 73 ASN H 4.000 . 5.800 5.220 5.113 5.335 . 0 0 "[ . 1 . 2]" 1
1349 1 67 HIS HB3 1 74 SER HA 2.500 . 2.900 2.351 2.324 2.446 . 0 0 "[ . 1 . 2]" 1
1350 1 67 HIS HB3 1 75 LEU H 3.000 . 3.800 3.624 3.557 3.725 . 0 0 "[ . 1 . 2]" 1
1351 1 67 HIS HB3 1 75 LEU HG 4.000 . 5.000 4.706 4.575 4.878 . 0 0 "[ . 1 . 2]" 1
1352 1 68 CYS H 1 68 CYS HA 3.000 . 3.300 2.938 2.922 2.946 . 0 0 "[ . 1 . 2]" 1
1353 1 68 CYS H 1 68 CYS HB2 3.000 . 3.200 2.907 2.850 2.934 . 0 0 "[ . 1 . 2]" 1
1354 1 68 CYS H 1 68 CYS HB3 2.500 . 2.700 2.345 2.330 2.361 . 0 0 "[ . 1 . 2]" 1
1355 1 68 CYS H 1 72 ARG HA 2.500 . 3.200 3.237 3.219 3.252 0.052 16 0 "[ . 1 . 2]" 1
1356 1 68 CYS H 1 73 ASN H 2.500 . 3.000 2.905 2.832 2.955 . 0 0 "[ . 1 . 2]" 1
1357 1 68 CYS H 1 73 ASN HB2 3.000 . 3.500 3.538 3.479 3.598 0.098 11 0 "[ . 1 . 2]" 1
1358 1 68 CYS H 1 73 ASN HB3 4.000 . 4.600 4.571 4.501 4.623 0.023 15 0 "[ . 1 . 2]" 1
1359 1 68 CYS H 1 75 LEU MD1 3.000 . 4.000 2.999 2.834 3.067 . 0 0 "[ . 1 . 2]" 1
1360 1 68 CYS H 1 75 LEU MD2 4.000 . 5.000 3.806 3.604 3.981 . 0 0 "[ . 1 . 2]" 1
1361 1 68 CYS H 1 75 LEU HG 3.000 . 3.500 2.953 2.869 3.022 . 0 0 "[ . 1 . 2]" 1
1362 1 68 CYS HA 1 68 CYS HB2 2.500 . 2.700 2.397 2.389 2.403 . 0 0 "[ . 1 . 2]" 1
1363 1 68 CYS HA 1 68 CYS HB3 3.000 . 3.300 3.030 3.027 3.033 . 0 0 "[ . 1 . 2]" 1
1364 1 68 CYS HA 1 69 SER H 2.500 . 2.700 2.285 2.279 2.293 . 0 0 "[ . 1 . 2]" 1
1365 1 68 CYS HA 1 70 GLN H 3.000 . 4.000 3.972 3.945 3.989 . 0 0 "[ . 1 . 2]" 1
1366 1 68 CYS HA 1 75 LEU MD1 3.000 . 4.000 2.401 2.283 2.519 . 0 0 "[ . 1 . 2]" 1
1367 1 68 CYS HA 1 75 LEU MD2 4.000 . 5.500 4.301 4.134 4.485 . 0 0 "[ . 1 . 2]" 1
1368 1 68 CYS HA 1 75 LEU HG 3.000 . 4.500 4.223 4.132 4.341 . 0 0 "[ . 1 . 2]" 1
1369 1 68 CYS HA 1 87 LEU H 4.000 . 4.500 4.353 4.330 4.387 . 0 0 "[ . 1 . 2]" 1
1370 1 68 CYS HA 1 87 LEU HB2 3.000 . 3.600 3.706 3.689 3.724 0.124 2 0 "[ . 1 . 2]" 1
1371 1 68 CYS HA 1 87 LEU HB3 3.000 . 3.600 3.649 3.626 3.673 0.073 12 0 "[ . 1 . 2]" 1
1372 1 68 CYS HA 1 88 LEU HA 2.500 . 2.900 2.767 2.681 2.827 . 0 0 "[ . 1 . 2]" 1
1373 1 68 CYS HA 1 89 CYS H 4.000 . 5.000 4.471 4.402 4.518 . 0 0 "[ . 1 . 2]" 1
1374 1 68 CYS HB2 1 69 SER H 3.000 . 4.000 3.983 3.972 3.995 . 0 0 "[ . 1 . 2]" 1
1375 1 68 CYS HB2 1 70 GLN H 3.000 . 4.300 4.303 4.289 4.312 0.012 4 0 "[ . 1 . 2]" 1
1376 1 68 CYS HB2 1 71 CYS HB2 3.000 . 4.000 3.673 3.545 3.764 . 0 0 "[ . 1 . 2]" 1
1377 1 68 CYS HB2 1 72 ARG HA 4.000 . 5.200 5.270 5.204 5.304 0.104 17 0 "[ . 1 . 2]" 1
1378 1 68 CYS HB2 1 73 ASN H 3.000 . 4.200 3.854 3.810 3.927 . 0 0 "[ . 1 . 2]" 1
1379 1 68 CYS HB2 1 75 LEU MD1 3.000 . 3.300 2.230 2.214 2.243 . 0 0 "[ . 1 . 2]" 1
1380 1 68 CYS HB2 1 75 LEU MD2 3.000 . 4.000 2.758 2.572 2.959 . 0 0 "[ . 1 . 2]" 1
1381 1 68 CYS HB2 1 75 LEU HG 3.000 . 3.600 3.569 3.478 3.634 0.034 3 0 "[ . 1 . 2]" 1
1382 1 68 CYS HB2 1 88 LEU HA 3.000 . 3.300 3.324 3.303 3.336 0.036 1 0 "[ . 1 . 2]" 1
1383 1 68 CYS HB2 1 89 CYS H 3.000 . 3.500 3.489 3.447 3.518 0.018 1 0 "[ . 1 . 2]" 1
1384 1 68 CYS HB2 1 89 CYS HA 3.000 . 4.200 4.287 4.260 4.305 0.105 19 0 "[ . 1 . 2]" 1
1385 1 68 CYS HB3 1 69 SER H 4.000 . 4.300 4.113 4.099 4.122 . 0 0 "[ . 1 . 2]" 1
1386 1 68 CYS HB3 1 70 GLN H 3.000 . 4.000 3.769 3.726 3.800 . 0 0 "[ . 1 . 2]" 1
1387 1 68 CYS HB3 1 71 CYS H 2.500 . 2.900 2.790 2.744 2.834 . 0 0 "[ . 1 . 2]" 1
1388 1 68 CYS HB3 1 71 CYS HB2 2.500 . 2.800 2.549 2.452 2.635 . 0 0 "[ . 1 . 2]" 1
1389 1 68 CYS HB3 1 72 ARG H 2.500 . 3.000 2.819 2.611 2.956 . 0 0 "[ . 1 . 2]" 1
1390 1 68 CYS HB3 1 72 ARG HA 3.000 . 3.800 3.772 3.723 3.800 0.000 17 0 "[ . 1 . 2]" 1
1391 1 68 CYS HB3 1 73 ASN H 2.500 . 2.900 2.320 2.269 2.430 . 0 0 "[ . 1 . 2]" 1
1392 1 68 CYS HB3 1 75 LEU MD1 3.000 . 4.500 3.515 3.454 3.584 . 0 0 "[ . 1 . 2]" 1
1393 1 68 CYS HB3 1 75 LEU MD2 4.000 . 5.000 3.728 3.525 3.911 . 0 0 "[ . 1 . 2]" 1
1394 1 68 CYS HB3 1 75 LEU HG 3.000 . 4.200 4.210 4.150 4.249 0.049 3 0 "[ . 1 . 2]" 1
1395 1 69 SER H 1 69 SER HB2 2.500 . 2.700 2.396 2.366 2.409 . 0 0 "[ . 1 . 2]" 1
1396 1 69 SER H 1 69 SER HB3 3.000 . 3.300 2.728 2.711 2.759 . 0 0 "[ . 1 . 2]" 1
1397 1 69 SER H 1 70 GLN H 2.500 . 2.900 2.583 2.570 2.601 . 0 0 "[ . 1 . 2]" 1
1398 1 69 SER H 1 70 GLN HG2 4.000 . 4.300 3.895 3.864 3.927 . 0 0 "[ . 1 . 2]" 1
1399 1 69 SER H 1 70 GLN HG3 4.000 . 5.500 5.338 5.305 5.359 . 0 0 "[ . 1 . 2]" 1
1400 1 69 SER H 1 87 LEU H 3.000 . 4.000 3.704 3.663 3.732 . 0 0 "[ . 1 . 2]" 1
1401 1 69 SER H 1 87 LEU HB2 4.000 . 4.600 4.496 4.428 4.527 . 0 0 "[ . 1 . 2]" 1
1402 1 69 SER H 1 88 LEU HA 3.000 . 3.200 2.763 2.693 2.815 . 0 0 "[ . 1 . 2]" 1
1403 1 69 SER H 1 88 LEU MD2 3.000 . 3.600 2.543 2.502 2.597 . 0 0 "[ . 1 . 2]" 1
1404 1 69 SER H 1 88 LEU HG 3.000 . 3.400 3.167 3.050 3.253 . 0 0 "[ . 1 . 2]" 1
1405 1 69 SER HA 1 70 GLN H 3.000 . 3.600 3.494 3.485 3.500 . 0 0 "[ . 1 . 2]" 1
1406 1 69 SER HB2 1 70 GLN H 3.000 . 4.000 3.973 3.948 3.992 . 0 0 "[ . 1 . 2]" 1
1407 1 69 SER HB2 1 70 GLN HG2 4.000 . 5.000 4.382 4.333 4.404 . 0 0 "[ . 1 . 2]" 1
1408 1 69 SER HB2 1 86 GLN QB 3.000 . 3.500 2.411 2.347 2.499 . 0 0 "[ . 1 . 2]" 1
1409 1 69 SER HB2 1 86 GLN HG3 4.000 . 4.500 4.234 4.131 4.357 . 0 0 "[ . 1 . 2]" 1
1410 1 69 SER HB2 1 87 LEU H 3.000 . 3.500 3.085 3.036 3.126 . 0 0 "[ . 1 . 2]" 1
1411 1 69 SER HB2 1 88 LEU MD1 4.000 . 5.300 4.281 4.172 4.335 . 0 0 "[ . 1 . 2]" 1
1412 1 69 SER HB2 1 88 LEU MD2 3.000 . 4.000 3.209 3.199 3.222 . 0 0 "[ . 1 . 2]" 1
1413 1 69 SER HB2 1 88 LEU HG 3.000 . 3.500 3.433 3.310 3.499 . 0 0 "[ . 1 . 2]" 1
1414 1 69 SER HB3 1 70 GLN H 3.000 . 3.300 3.029 3.004 3.051 . 0 0 "[ . 1 . 2]" 1
1415 1 69 SER HB3 1 70 GLN HE21 4.000 . 5.000 2.593 2.447 2.667 . 0 0 "[ . 1 . 2]" 1
1416 1 69 SER HB3 1 70 GLN HG2 3.000 . 4.300 2.770 2.746 2.791 . 0 0 "[ . 1 . 2]" 1
1417 1 69 SER HB3 1 86 GLN QB 4.000 . 4.500 3.578 3.521 3.642 . 0 0 "[ . 1 . 2]" 1
1418 1 69 SER HB3 1 86 GLN HG3 4.000 . 5.000 4.826 4.704 4.960 . 0 0 "[ . 1 . 2]" 1
1419 1 69 SER HB3 1 87 LEU H 4.000 . 4.600 4.646 4.627 4.668 0.068 18 0 "[ . 1 . 2]" 1
1420 1 69 SER HB3 1 88 LEU MD2 3.000 . 3.500 2.248 2.227 2.318 . 0 0 "[ . 1 . 2]" 1
1421 1 70 GLN H 1 70 GLN HB2 2.500 . 3.000 2.629 2.622 2.641 . 0 0 "[ . 1 . 2]" 1
1422 1 70 GLN H 1 70 GLN HB3 3.000 . 3.800 3.710 3.708 3.712 . 0 0 "[ . 1 . 2]" 1
1423 1 70 GLN H 1 70 GLN HG2 2.500 . 2.800 2.238 2.211 2.255 . 0 0 "[ . 1 . 2]" 1
1424 1 70 GLN H 1 70 GLN HG3 3.000 . 3.800 3.550 3.541 3.557 . 0 0 "[ . 1 . 2]" 1
1425 1 70 GLN H 1 71 CYS H 2.500 . 2.800 2.371 2.361 2.385 . 0 0 "[ . 1 . 2]" 1
1426 1 70 GLN H 1 72 ARG H 3.000 . 4.000 3.337 3.313 3.382 . 0 0 "[ . 1 . 2]" 1
1427 1 70 GLN H 1 88 LEU HA 3.000 . 4.000 3.895 3.872 3.929 . 0 0 "[ . 1 . 2]" 1
1428 1 70 GLN H 1 88 LEU MD2 3.000 . 4.000 2.487 2.446 2.522 . 0 0 "[ . 1 . 2]" 1
1429 1 70 GLN H 1 88 LEU HG 4.000 . 5.000 4.633 4.542 4.686 . 0 0 "[ . 1 . 2]" 1
1430 1 70 GLN HA 1 70 GLN HG2 3.000 . 3.300 2.981 2.964 3.007 . 0 0 "[ . 1 . 2]" 1
1431 1 70 GLN HA 1 70 GLN HG3 3.000 . 4.000 3.832 3.827 3.836 . 0 0 "[ . 1 . 2]" 1
1432 1 70 GLN HA 1 71 CYS H 3.000 . 3.500 3.569 3.567 3.572 0.072 14 0 "[ . 1 . 2]" 1
1433 1 70 GLN HB2 1 71 CYS H 2.500 . 2.800 2.350 2.346 2.361 . 0 0 "[ . 1 . 2]" 1
1434 1 70 GLN HB2 1 72 ARG H 4.000 . 5.000 4.525 4.516 4.543 . 0 0 "[ . 1 . 2]" 1
1435 1 70 GLN HB2 1 88 LEU MD2 4.000 . 4.700 3.351 3.320 3.368 . 0 0 "[ . 1 . 2]" 1
1436 1 70 GLN HB2 1 92 CYS QB 3.000 . 4.000 3.228 3.156 3.308 . 0 0 "[ . 1 . 2]" 1
1437 1 70 GLN HB3 1 70 GLN HE21 4.000 . 5.000 4.198 4.178 4.228 . 0 0 "[ . 1 . 2]" 1
1438 1 70 GLN HB3 1 70 GLN HE22 4.000 . 5.000 4.384 4.374 4.398 . 0 0 "[ . 1 . 2]" 1
1439 1 70 GLN HB3 1 71 CYS H 3.000 . 3.600 3.602 3.592 3.613 0.013 18 0 "[ . 1 . 2]" 1
1440 1 70 GLN HB3 1 88 LEU MD2 4.000 . 5.500 4.207 4.195 4.219 . 0 0 "[ . 1 . 2]" 1
1441 1 70 GLN HE21 1 70 GLN HG2 3.000 . 4.000 2.218 2.215 2.221 . 0 0 "[ . 1 . 2]" 1
1442 1 70 GLN HE21 1 70 GLN HG3 3.000 . 3.300 3.293 3.265 3.309 0.009 18 0 "[ . 1 . 2]" 1
1443 1 70 GLN HE21 1 88 LEU MD2 4.000 . 5.000 2.832 2.796 2.896 . 0 0 "[ . 1 . 2]" 1
1444 1 70 GLN HE22 1 70 GLN HG3 3.000 . 4.000 3.953 3.940 3.960 . 0 0 "[ . 1 . 2]" 1
1445 1 70 GLN HG2 1 71 CYS H 3.000 . 3.800 3.975 3.955 3.987 0.187 7 0 "[ . 1 . 2]" 1
1446 1 70 GLN HG2 1 88 LEU MD2 3.000 . 3.200 2.017 2.015 2.020 . 0 0 "[ . 1 . 2]" 1
1447 1 70 GLN HG2 1 88 LEU HG 4.000 . 4.500 4.426 4.404 4.448 . 0 0 "[ . 1 . 2]" 1
1448 1 70 GLN HG3 1 71 CYS H 4.000 . 4.500 4.513 4.506 4.524 0.024 5 0 "[ . 1 . 2]" 1
1449 1 70 GLN HG3 1 88 LEU MD2 3.000 . 3.500 2.412 2.387 2.442 . 0 0 "[ . 1 . 2]" 1
1450 1 70 GLN HG3 1 88 LEU HG 4.000 . 5.200 5.294 5.281 5.306 0.106 3 0 "[ . 1 . 2]" 1
1451 1 70 GLN HG3 1 92 CYS QB 3.000 . 4.000 2.508 2.441 2.627 . 0 0 "[ . 1 . 2]" 1
1452 1 71 CYS H 1 71 CYS HB2 2.500 . 2.800 2.778 2.743 2.801 0.001 4 0 "[ . 1 . 2]" 1
1453 1 71 CYS H 1 71 CYS HB3 3.000 . 3.700 3.682 3.673 3.688 . 0 0 "[ . 1 . 2]" 1
1454 1 71 CYS H 1 72 ARG H 3.000 . 3.300 2.434 2.376 2.493 . 0 0 "[ . 1 . 2]" 1
1455 1 71 CYS H 1 88 LEU MD2 4.000 . 5.500 4.095 4.048 4.115 . 0 0 "[ . 1 . 2]" 1
1456 1 71 CYS H 1 92 CYS QB 4.000 . 5.500 4.734 4.686 4.792 . 0 0 "[ . 1 . 2]" 1
1457 1 71 CYS HA 1 71 CYS HB2 2.500 . 3.100 3.015 3.010 3.019 . 0 0 "[ . 1 . 2]" 1
1458 1 71 CYS HA 1 71 CYS HB3 2.500 . 2.700 2.345 2.332 2.354 . 0 0 "[ . 1 . 2]" 1
1459 1 71 CYS HA 1 72 ARG H 3.000 . 3.500 3.343 3.283 3.417 . 0 0 "[ . 1 . 2]" 1
1460 1 71 CYS HB2 1 72 ARG H 3.000 . 3.500 3.462 3.222 3.566 0.066 8 0 "[ . 1 . 2]" 1
1461 1 71 CYS HB2 1 73 ASN H 2.500 . 3.000 2.330 2.276 2.445 . 0 0 "[ . 1 . 2]" 1
1462 1 71 CYS HB3 1 72 ARG H 3.000 . 4.500 4.397 4.264 4.446 . 0 0 "[ . 1 . 2]" 1
1463 1 71 CYS HB3 1 73 ASN H 3.000 . 3.500 3.483 3.427 3.558 0.058 8 0 "[ . 1 . 2]" 1
1464 1 72 ARG H 1 72 ARG HB2 3.000 . 4.500 3.526 2.875 4.063 . 0 0 "[ . 1 . 2]" 1
1465 1 72 ARG H 1 72 ARG HB3 3.000 . 3.800 3.835 2.962 4.042 0.242 18 0 "[ . 1 . 2]" 1
1466 1 72 ARG H 1 72 ARG QD 4.000 . 5.200 4.228 2.127 4.799 . 0 0 "[ . 1 . 2]" 1
1467 1 72 ARG H 1 72 ARG HG2 4.000 . 5.000 3.370 2.563 4.945 . 0 0 "[ . 1 . 2]" 1
1468 1 72 ARG H 1 72 ARG HG3 4.000 . 5.000 3.312 2.459 4.947 . 0 0 "[ . 1 . 2]" 1
1469 1 72 ARG H 1 73 ASN H 3.000 . 3.300 2.803 2.661 2.935 . 0 0 "[ . 1 . 2]" 1
1470 1 72 ARG HA 1 72 ARG QD 4.000 . 5.200 3.784 2.162 4.476 . 0 0 "[ . 1 . 2]" 1
1471 1 72 ARG HA 1 72 ARG HG2 3.000 . 4.000 2.877 2.338 3.805 . 0 0 "[ . 1 . 2]" 1
1472 1 72 ARG HA 1 72 ARG HG3 3.000 . 3.800 3.186 2.278 3.856 0.056 19 0 "[ . 1 . 2]" 1
1473 1 72 ARG HA 1 73 ASN H 3.000 . 3.300 3.092 3.018 3.104 . 0 0 "[ . 1 . 2]" 1
1474 1 72 ARG HA 1 73 ASN HB2 4.000 . 5.000 5.170 5.131 5.193 0.193 2 0 "[ . 1 . 2]" 1
1475 1 72 ARG HB2 1 72 ARG QD 3.000 . 4.000 2.582 2.225 3.339 . 0 0 "[ . 1 . 2]" 1
1476 1 72 ARG HB3 1 72 ARG QD 3.000 . 4.000 2.592 2.275 3.244 . 0 0 "[ . 1 . 2]" 1
1477 1 73 ASN H 1 73 ASN HB2 3.000 . 3.300 2.272 2.226 2.325 . 0 0 "[ . 1 . 2]" 1
1478 1 73 ASN H 1 73 ASN HB3 3.000 . 3.800 3.568 3.547 3.590 . 0 0 "[ . 1 . 2]" 1
1479 1 73 ASN HA 1 74 SER H 3.000 . 3.500 2.353 2.337 2.363 . 0 0 "[ . 1 . 2]" 1
1480 1 73 ASN HB2 1 73 ASN HD21 3.000 . 3.500 3.495 3.389 3.589 0.089 5 0 "[ . 1 . 2]" 1
1481 1 73 ASN HB2 1 73 ASN HD22 3.000 . 4.000 4.061 4.012 4.104 0.104 5 0 "[ . 1 . 2]" 1
1482 1 73 ASN HB2 1 74 SER H 3.000 . 4.000 4.053 4.028 4.071 0.071 3 0 "[ . 1 . 2]" 1
1483 1 73 ASN HB2 1 75 LEU H 4.000 . 5.000 4.917 4.802 5.009 0.009 19 0 "[ . 1 . 2]" 1
1484 1 73 ASN HB2 1 75 LEU MD2 3.000 . 3.800 3.032 2.956 3.077 . 0 0 "[ . 1 . 2]" 1
1485 1 73 ASN HB3 1 73 ASN HD21 2.500 . 2.700 2.485 2.237 2.797 0.097 6 0 "[ . 1 . 2]" 1
1486 1 73 ASN HB3 1 73 ASN HD22 3.000 . 4.000 3.598 3.500 3.725 . 0 0 "[ . 1 . 2]" 1
1487 1 73 ASN HB3 1 74 SER H 2.500 . 2.800 2.850 2.827 2.881 0.081 2 0 "[ . 1 . 2]" 1
1488 1 73 ASN HB3 1 75 LEU H 3.000 . 4.800 4.683 4.599 4.792 . 0 0 "[ . 1 . 2]" 1
1489 1 73 ASN HB3 1 75 LEU MD2 4.000 . 4.300 3.290 3.201 3.381 . 0 0 "[ . 1 . 2]" 1
1490 1 73 ASN HD21 1 74 SER H 4.000 . 4.500 3.608 3.361 3.877 . 0 0 "[ . 1 . 2]" 1
1491 1 73 ASN HD22 1 74 SER H 4.000 . 5.000 5.054 5.009 5.093 0.093 16 0 "[ . 1 . 2]" 1
1492 1 74 SER H 1 74 SER HB2 2.500 . 3.000 2.551 2.386 2.667 . 0 0 "[ . 1 . 2]" 1
1493 1 74 SER H 1 74 SER HB3 3.000 . 4.000 3.663 3.636 3.678 . 0 0 "[ . 1 . 2]" 1
1494 1 74 SER HA 1 75 LEU H 2.500 . 3.000 2.286 2.282 2.290 . 0 0 "[ . 1 . 2]" 1
1495 1 74 SER HA 1 75 LEU HG 3.000 . 4.000 3.795 3.752 3.843 . 0 0 "[ . 1 . 2]" 1
1496 1 74 SER HB3 1 75 LEU H 3.000 . 4.000 3.972 3.943 3.995 . 0 0 "[ . 1 . 2]" 1
1497 1 75 LEU H 1 75 LEU MD1 3.000 . 3.800 3.225 3.171 3.273 . 0 0 "[ . 1 . 2]" 1
1498 1 75 LEU H 1 75 LEU MD2 3.000 . 4.000 3.389 3.327 3.460 . 0 0 "[ . 1 . 2]" 1
1499 1 75 LEU H 1 75 LEU HG 2.500 . 2.800 1.920 1.865 1.980 . 0 0 "[ . 1 . 2]" 1
1500 1 75 LEU HA 1 75 LEU HB2 3.000 . 3.300 3.011 3.005 3.019 . 0 0 "[ . 1 . 2]" 1
1501 1 75 LEU HA 1 75 LEU HB3 2.500 . 2.700 2.363 2.348 2.382 . 0 0 "[ . 1 . 2]" 1
1502 1 75 LEU HA 1 75 LEU MD1 4.000 . 4.500 3.983 3.964 3.994 . 0 0 "[ . 1 . 2]" 1
1503 1 75 LEU HA 1 75 LEU MD2 2.500 . 3.200 2.336 2.293 2.382 . 0 0 "[ . 1 . 2]" 1
1504 1 75 LEU HA 1 75 LEU HG 3.000 . 3.300 3.066 3.009 3.110 . 0 0 "[ . 1 . 2]" 1
1505 1 75 LEU HA 1 76 VAL H 2.500 . 3.000 2.185 2.180 2.195 . 0 0 "[ . 1 . 2]" 1
1506 1 75 LEU HA 1 76 VAL HA 4.000 . 4.500 4.456 4.453 4.464 . 0 0 "[ . 1 . 2]" 1
1507 1 75 LEU HA 1 76 VAL HB 4.000 . 5.000 4.599 4.558 4.632 . 0 0 "[ . 1 . 2]" 1
1508 1 75 LEU HA 1 78 LYS H 4.000 . 4.500 4.361 4.343 4.395 . 0 0 "[ . 1 . 2]" 1
1509 1 75 LEU HA 1 78 LYS HB2 2.500 . 3.000 2.731 2.648 2.794 . 0 0 "[ . 1 . 2]" 1
1510 1 75 LEU HA 1 78 LYS HB3 3.000 . 3.600 3.693 3.643 3.734 0.134 4 0 "[ . 1 . 2]" 1
1511 1 75 LEU HA 1 78 LYS QD 3.000 . 4.000 2.998 2.693 3.385 . 0 0 "[ . 1 . 2]" 1
1512 1 75 LEU HA 1 78 LYS HG2 4.000 . 5.500 5.171 4.948 5.324 . 0 0 "[ . 1 . 2]" 1
1513 1 75 LEU HA 1 78 LYS HG3 4.000 . 5.000 4.688 3.946 4.846 . 0 0 "[ . 1 . 2]" 1
1514 1 75 LEU HA 1 80 PHE HB3 4.000 . 5.000 4.957 4.871 5.041 0.041 5 0 "[ . 1 . 2]" 1
1515 1 75 LEU HA 1 80 PHE HD2 4.000 . 5.300 5.190 5.049 5.270 . 0 0 "[ . 1 . 2]" 1
1516 1 75 LEU HB2 1 75 LEU MD1 2.500 . 3.000 2.202 2.163 2.245 . 0 0 "[ . 1 . 2]" 1
1517 1 75 LEU HB2 1 75 LEU MD2 3.000 . 3.500 3.147 3.140 3.154 . 0 0 "[ . 1 . 2]" 1
1518 1 75 LEU HB2 1 80 PHE HD2 3.000 . 3.800 3.730 3.595 3.831 0.031 15 0 "[ . 1 . 2]" 1
1519 1 75 LEU HB3 1 75 LEU MD1 3.000 . 3.200 2.590 2.541 2.630 . 0 0 "[ . 1 . 2]" 1
1520 1 75 LEU HB3 1 75 LEU MD2 2.500 . 3.000 2.226 2.209 2.257 . 0 0 "[ . 1 . 2]" 1
1521 1 75 LEU HB3 1 78 LYS H 3.000 . 4.000 4.156 4.127 4.189 0.189 10 0 "[ . 1 . 2]" 1
1522 1 75 LEU HB3 1 80 PHE HD2 3.000 . 3.500 3.217 3.081 3.297 . 0 0 "[ . 1 . 2]" 1
1523 1 75 LEU MD1 1 80 PHE HB2 3.000 . 3.500 2.370 2.306 2.435 . 0 0 "[ . 1 . 2]" 1
1524 1 75 LEU MD1 1 80 PHE HB3 3.000 . 3.300 2.270 2.260 2.276 . 0 0 "[ . 1 . 2]" 1
1525 1 75 LEU MD1 1 80 PHE HD2 4.000 . 5.300 4.034 3.904 4.093 . 0 0 "[ . 1 . 2]" 1
1526 1 75 LEU MD1 1 81 ALA H 4.000 . 5.200 3.970 3.856 4.089 . 0 0 "[ . 1 . 2]" 1
1527 1 75 LEU MD1 1 87 LEU HB2 4.000 . 4.800 3.486 3.412 3.588 . 0 0 "[ . 1 . 2]" 1
1528 1 75 LEU MD1 1 87 LEU HB3 3.000 . 3.500 2.567 2.438 2.713 . 0 0 "[ . 1 . 2]" 1
1529 1 75 LEU MD1 1 88 LEU HA 4.000 . 5.000 3.509 3.468 3.554 . 0 0 "[ . 1 . 2]" 1
1530 1 75 LEU MD1 1 89 CYS H 4.000 . 5.000 4.011 3.892 4.102 . 0 0 "[ . 1 . 2]" 1
1531 1 75 LEU MD1 1 89 CYS HA 3.000 . 4.500 3.320 3.248 3.392 . 0 0 "[ . 1 . 2]" 1
1532 1 75 LEU MD2 1 78 LYS HB2 4.000 . 5.000 3.639 3.367 3.755 . 0 0 "[ . 1 . 2]" 1
1533 1 75 LEU MD2 1 78 LYS HB3 4.000 . 4.500 3.396 3.192 3.515 . 0 0 "[ . 1 . 2]" 1
1534 1 75 LEU MD2 1 78 LYS QE 4.000 . 5.000 2.856 2.274 3.574 . 0 0 "[ . 1 . 2]" 1
1535 1 75 LEU MD2 1 80 PHE HA 4.000 . 5.000 3.727 3.650 3.845 . 0 0 "[ . 1 . 2]" 1
1536 1 75 LEU MD2 1 80 PHE HB2 4.000 . 5.000 4.042 4.010 4.090 . 0 0 "[ . 1 . 2]" 1
1537 1 75 LEU MD2 1 80 PHE HB3 3.000 . 4.000 3.104 3.056 3.156 . 0 0 "[ . 1 . 2]" 1
1538 1 75 LEU MD2 1 80 PHE HD2 4.000 . 5.800 4.538 4.358 4.630 . 0 0 "[ . 1 . 2]" 1
1539 1 75 LEU MD2 1 89 CYS HA 3.000 . 4.200 3.211 3.139 3.307 . 0 0 "[ . 1 . 2]" 1
1540 1 75 LEU MD2 1 89 CYS HB3 3.000 . 4.500 3.676 3.581 3.734 . 0 0 "[ . 1 . 2]" 1
1541 1 76 VAL H 1 76 VAL HB 2.500 . 2.900 2.737 2.706 2.760 . 0 0 "[ . 1 . 2]" 1
1542 1 76 VAL H 1 76 VAL MG1 3.000 . 4.500 3.848 3.825 3.862 . 0 0 "[ . 1 . 2]" 1
1543 1 76 VAL H 1 76 VAL MG2 3.000 . 4.500 3.142 3.110 3.170 . 0 0 "[ . 1 . 2]" 1
1544 1 76 VAL H 1 77 ASP H 4.000 . 4.500 4.236 4.220 4.264 . 0 0 "[ . 1 . 2]" 1
1545 1 76 VAL HA 1 76 VAL MG1 3.000 . 3.600 2.406 2.386 2.446 . 0 0 "[ . 1 . 2]" 1
1546 1 76 VAL HA 1 76 VAL MG2 2.500 . 3.200 2.261 2.235 2.336 . 0 0 "[ . 1 . 2]" 1
1547 1 76 VAL HA 1 77 ASP H 2.500 . 2.800 2.230 2.219 2.242 . 0 0 "[ . 1 . 2]" 1
1548 1 76 VAL HA 1 78 LYS H 3.000 . 3.500 3.247 3.216 3.272 . 0 0 "[ . 1 . 2]" 1
1549 1 76 VAL HB 1 77 ASP H 4.000 . 4.500 4.290 4.240 4.334 . 0 0 "[ . 1 . 2]" 1
1550 1 76 VAL MG1 1 77 ASP H 3.000 . 4.000 2.633 2.559 2.684 . 0 0 "[ . 1 . 2]" 1
1551 1 76 VAL MG1 1 77 ASP HA 4.000 . 5.500 4.047 4.024 4.067 . 0 0 "[ . 1 . 2]" 1
1552 1 76 VAL MG1 1 77 ASP HB3 3.000 . 3.800 2.785 2.659 2.842 . 0 0 "[ . 1 . 2]" 1
1553 1 76 VAL MG2 1 77 ASP H 4.000 . 5.000 3.945 3.905 3.969 . 0 0 "[ . 1 . 2]" 1
1554 1 77 ASP H 1 77 ASP HB2 3.000 . 4.000 3.374 3.165 3.959 . 0 0 "[ . 1 . 2]" 1
1555 1 77 ASP H 1 77 ASP HB3 3.000 . 3.500 3.376 3.004 3.517 0.017 7 0 "[ . 1 . 2]" 1
1556 1 77 ASP H 1 78 LYS H 2.500 . 2.900 2.703 2.674 2.761 . 0 0 "[ . 1 . 2]" 1
1557 1 78 LYS H 1 78 LYS HB2 3.000 . 4.500 2.319 2.303 2.336 . 0 0 "[ . 1 . 2]" 1
1558 1 78 LYS H 1 78 LYS HB3 3.000 . 4.500 3.550 3.530 3.575 . 0 0 "[ . 1 . 2]" 1
1559 1 78 LYS H 1 78 LYS HG2 4.000 . 5.500 4.394 4.101 4.485 . 0 0 "[ . 1 . 2]" 1
1560 1 78 LYS H 1 78 LYS HG3 4.000 . 5.500 3.412 3.249 3.459 . 0 0 "[ . 1 . 2]" 1
1561 1 78 LYS HA 1 78 LYS HG2 3.000 . 4.500 2.481 2.292 2.633 . 0 0 "[ . 1 . 2]" 1
1562 1 78 LYS HA 1 78 LYS HG3 3.000 . 4.500 2.623 2.498 2.973 . 0 0 "[ . 1 . 2]" 1
1563 1 78 LYS HA 1 79 PRO HD2 2.500 . 3.300 2.528 2.518 2.545 . 0 0 "[ . 1 . 2]" 1
1564 1 78 LYS HA 1 79 PRO HD3 2.500 . 2.700 2.265 2.257 2.272 . 0 0 "[ . 1 . 2]" 1
1565 1 78 LYS HA 1 79 PRO HG2 4.000 . 5.000 4.649 4.642 4.661 . 0 0 "[ . 1 . 2]" 1
1566 1 78 LYS HA 1 79 PRO HG3 4.000 . 5.000 4.501 4.496 4.507 . 0 0 "[ . 1 . 2]" 1
1567 1 78 LYS HB2 1 79 PRO HD2 3.000 . 4.000 3.865 3.851 3.886 . 0 0 "[ . 1 . 2]" 1
1568 1 78 LYS HB2 1 79 PRO HD3 4.000 . 5.000 4.757 4.748 4.764 . 0 0 "[ . 1 . 2]" 1
1569 1 78 LYS HB3 1 79 PRO HD2 3.000 . 3.200 2.332 2.316 2.341 . 0 0 "[ . 1 . 2]" 1
1570 1 78 LYS HB3 1 79 PRO HD3 3.000 . 4.000 3.657 3.626 3.668 . 0 0 "[ . 1 . 2]" 1
1571 1 78 LYS HG2 1 79 PRO HD2 3.000 . 3.300 2.734 2.668 3.029 . 0 0 "[ . 1 . 2]" 1
1572 1 78 LYS HG2 1 79 PRO HD3 3.000 . 4.000 3.580 3.458 3.751 . 0 0 "[ . 1 . 2]" 1
1573 1 78 LYS HG3 1 79 PRO HD2 4.000 . 5.000 4.047 3.924 4.390 . 0 0 "[ . 1 . 2]" 1
1574 1 78 LYS HG3 1 79 PRO HD3 4.000 . 5.000 4.550 4.399 4.970 . 0 0 "[ . 1 . 2]" 1
1575 1 79 PRO HA 1 79 PRO HG2 3.000 . 4.000 4.056 4.049 4.059 0.059 8 0 "[ . 1 . 2]" 1
1576 1 79 PRO HA 1 79 PRO HG3 3.000 . 4.000 3.846 3.824 3.905 . 0 0 "[ . 1 . 2]" 1
1577 1 79 PRO HA 1 80 PHE H 2.500 . 2.900 2.247 2.237 2.271 . 0 0 "[ . 1 . 2]" 1
1578 1 79 PRO HA 1 80 PHE HD2 3.000 . 4.000 4.022 4.002 4.049 0.049 8 0 "[ . 1 . 2]" 1
1579 1 79 PRO HB2 1 79 PRO HD2 3.000 . 4.000 3.880 3.866 3.907 . 0 0 "[ . 1 . 2]" 1
1580 1 79 PRO HB2 1 79 PRO HD3 3.000 . 4.000 4.074 4.069 4.076 0.076 5 0 "[ . 1 . 2]" 1
1581 1 79 PRO HB2 1 80 PHE H 3.000 . 3.500 3.546 3.514 3.569 0.069 6 0 "[ . 1 . 2]" 1
1582 1 79 PRO HB2 1 90 THR MG 3.000 . 4.000 2.394 2.124 2.570 . 0 0 "[ . 1 . 2]" 1
1583 1 79 PRO HB3 1 79 PRO HD3 3.000 . 4.000 3.463 3.422 3.484 . 0 0 "[ . 1 . 2]" 1
1584 1 79 PRO HB3 1 80 PHE H 3.000 . 4.000 3.801 3.773 3.893 . 0 0 "[ . 1 . 2]" 1
1585 1 79 PRO HB3 1 90 THR MG 4.000 . 4.700 3.688 3.323 3.801 . 0 0 "[ . 1 . 2]" 1
1586 1 79 PRO HG2 1 90 THR MG 3.000 . 4.000 3.271 3.168 3.360 . 0 0 "[ . 1 . 2]" 1
1587 1 80 PHE H 1 80 PHE HB2 4.000 . 5.000 3.967 3.942 3.976 . 0 0 "[ . 1 . 2]" 1
1588 1 80 PHE H 1 80 PHE HB3 3.000 . 4.000 3.456 3.436 3.471 . 0 0 "[ . 1 . 2]" 1
1589 1 80 PHE H 1 80 PHE HD2 3.000 . 4.000 3.456 3.433 3.477 . 0 0 "[ . 1 . 2]" 1
1590 1 80 PHE HA 1 81 ALA H 2.500 . 2.900 2.300 2.280 2.332 . 0 0 "[ . 1 . 2]" 1
1591 1 80 PHE HA 1 81 ALA MB 4.000 . 5.000 4.007 3.998 4.019 . 0 0 "[ . 1 . 2]" 1
1592 1 80 PHE HA 1 90 THR H 2.500 . 3.100 3.069 3.003 3.126 0.026 4 0 "[ . 1 . 2]" 1
1593 1 80 PHE HB2 1 80 PHE HD1 3.000 . 3.300 2.568 2.556 2.586 . 0 0 "[ . 1 . 2]" 1
1594 1 80 PHE HB2 1 80 PHE HD2 3.000 . 4.000 3.597 3.587 3.605 . 0 0 "[ . 1 . 2]" 1
1595 1 80 PHE HB2 1 81 ALA H 3.000 . 3.500 2.758 2.671 2.834 . 0 0 "[ . 1 . 2]" 1
1596 1 80 PHE HB2 1 82 ALA H 4.000 . 5.000 5.190 5.174 5.211 0.211 8 0 "[ . 1 . 2]" 1
1597 1 80 PHE HB2 1 87 LEU HB2 4.000 . 5.600 4.972 4.933 5.028 . 0 0 "[ . 1 . 2]" 1
1598 1 80 PHE HB2 1 87 LEU HB3 3.000 . 3.300 3.212 3.174 3.268 . 0 0 "[ . 1 . 2]" 1
1599 1 80 PHE HB2 1 87 LEU MD2 3.000 . 3.400 2.695 2.665 2.731 . 0 0 "[ . 1 . 2]" 1
1600 1 80 PHE HB2 1 87 LEU HG 4.000 . 5.200 5.308 5.280 5.337 0.137 8 0 "[ . 1 . 2]" 1
1601 1 80 PHE HB3 1 80 PHE HD1 3.000 . 4.000 3.752 3.748 3.758 . 0 0 "[ . 1 . 2]" 1
1602 1 80 PHE HB3 1 80 PHE HD2 2.500 . 3.200 2.365 2.354 2.374 . 0 0 "[ . 1 . 2]" 1
1603 1 80 PHE HB3 1 81 ALA H 3.000 . 4.000 3.944 3.873 4.001 0.001 11 0 "[ . 1 . 2]" 1
1604 1 80 PHE HB3 1 87 LEU MD2 4.000 . 5.000 3.791 3.751 3.825 . 0 0 "[ . 1 . 2]" 1
1605 1 80 PHE HB3 1 90 THR H 4.000 . 5.200 5.285 5.242 5.309 0.109 19 0 "[ . 1 . 2]" 1
1606 1 80 PHE HD1 1 81 ALA H 4.000 . 5.000 3.552 3.504 3.581 . 0 0 "[ . 1 . 2]" 1
1607 1 80 PHE HD1 1 81 ALA HA 3.000 . 4.000 3.617 3.588 3.643 . 0 0 "[ . 1 . 2]" 1
1608 1 80 PHE HD1 1 82 ALA H 3.000 . 3.500 3.128 3.097 3.151 . 0 0 "[ . 1 . 2]" 1
1609 1 80 PHE HD1 1 82 ALA HA 3.000 . 4.000 3.181 3.112 3.210 . 0 0 "[ . 1 . 2]" 1
1610 1 80 PHE HD1 1 82 ALA MB 4.000 . 4.800 3.078 3.055 3.094 . 0 0 "[ . 1 . 2]" 1
1611 1 80 PHE HD1 1 87 LEU HB2 4.000 . 5.800 5.787 5.762 5.809 0.009 4 0 "[ . 1 . 2]" 1
1612 1 80 PHE HD1 1 87 LEU HB3 4.000 . 5.000 4.298 4.266 4.332 . 0 0 "[ . 1 . 2]" 1
1613 1 80 PHE HD1 1 87 LEU MD2 2.500 . 3.000 2.162 2.154 2.171 . 0 0 "[ . 1 . 2]" 1
1614 1 80 PHE HD1 1 87 LEU HG 3.000 . 4.700 4.828 4.814 4.842 0.142 13 0 "[ . 1 . 2]" 1
1615 1 80 PHE HE1 1 82 ALA MB 3.000 . 4.500 2.271 2.247 2.283 . 0 0 "[ . 1 . 2]" 1
1616 1 80 PHE HE1 1 87 LEU MD2 3.000 . 4.000 2.875 2.814 2.931 . 0 0 "[ . 1 . 2]" 1
1617 1 81 ALA H 1 81 ALA MB 2.500 . 3.000 2.352 2.345 2.356 . 0 0 "[ . 1 . 2]" 1
1618 1 81 ALA HA 1 82 ALA H 2.500 . 2.900 2.182 2.178 2.190 . 0 0 "[ . 1 . 2]" 1
1619 1 81 ALA HA 1 82 ALA HA 4.000 . 5.000 4.461 4.458 4.464 . 0 0 "[ . 1 . 2]" 1
1620 1 81 ALA HA 1 82 ALA MB 4.000 . 5.500 4.043 4.020 4.057 . 0 0 "[ . 1 . 2]" 1
1621 1 81 ALA MB 1 82 ALA H 3.000 . 4.000 3.349 3.338 3.358 . 0 0 "[ . 1 . 2]" 1
1622 1 81 ALA MB 1 83 LYS HB2 4.000 . 5.300 4.206 4.183 4.229 . 0 0 "[ . 1 . 2]" 1
1623 1 81 ALA MB 1 88 LEU QB 4.000 . 5.000 2.443 2.405 2.468 . 0 0 "[ . 1 . 2]" 1
1624 1 81 ALA MB 1 88 LEU MD1 4.000 . 5.500 3.504 3.476 3.529 . 0 0 "[ . 1 . 2]" 1
1625 1 81 ALA MB 1 90 THR HA 4.000 . 4.500 2.812 2.746 2.916 . 0 0 "[ . 1 . 2]" 1
1626 1 81 ALA MB 1 93 TYR HB2 2.500 . 2.800 2.049 2.043 2.061 . 0 0 "[ . 1 . 2]" 1
1627 1 81 ALA MB 1 93 TYR HB3 3.000 . 3.500 2.546 2.516 2.590 . 0 0 "[ . 1 . 2]" 1
1628 1 81 ALA MB 1 93 TYR HD1 3.000 . 4.000 2.552 2.481 2.708 . 0 0 "[ . 1 . 2]" 1
1629 1 81 ALA MB 1 93 TYR HD2 3.000 . 3.500 2.950 2.923 2.990 . 0 0 "[ . 1 . 2]" 1
1630 1 81 ALA MB 1 93 TYR HE1 4.000 . 4.500 3.510 3.437 3.661 . 0 0 "[ . 1 . 2]" 1
1631 1 82 ALA H 1 82 ALA HA 2.500 . 3.000 2.919 2.918 2.921 . 0 0 "[ . 1 . 2]" 1
1632 1 82 ALA H 1 82 ALA MB 2.500 . 2.900 2.214 2.168 2.260 . 0 0 "[ . 1 . 2]" 1
1633 1 82 ALA H 1 87 LEU MD2 4.000 . 5.500 3.805 3.773 3.852 . 0 0 "[ . 1 . 2]" 1
1634 1 82 ALA HA 1 83 LYS H 2.500 . 2.700 2.195 2.180 2.205 . 0 0 "[ . 1 . 2]" 1
1635 1 82 ALA HA 1 83 LYS HB2 4.000 . 5.000 4.882 4.851 4.904 . 0 0 "[ . 1 . 2]" 1
1636 1 82 ALA HA 1 83 LYS HB3 4.000 . 4.800 4.583 4.565 4.604 . 0 0 "[ . 1 . 2]" 1
1637 1 82 ALA HA 1 87 LEU HA 2.500 . 3.000 2.961 2.892 3.043 0.043 2 0 "[ . 1 . 2]" 1
1638 1 82 ALA HA 1 87 LEU MD1 4.000 . 5.200 4.383 4.356 4.407 . 0 0 "[ . 1 . 2]" 1
1639 1 82 ALA HA 1 87 LEU MD2 3.000 . 3.300 2.104 2.079 2.140 . 0 0 "[ . 1 . 2]" 1
1640 1 82 ALA HA 1 87 LEU HG 3.000 . 3.500 3.332 3.296 3.373 . 0 0 "[ . 1 . 2]" 1
1641 1 82 ALA HA 1 88 LEU H 3.000 . 4.200 4.119 4.054 4.188 . 0 0 "[ . 1 . 2]" 1
1642 1 82 ALA MB 1 83 LYS H 3.000 . 4.200 3.454 3.433 3.481 . 0 0 "[ . 1 . 2]" 1
1643 1 82 ALA MB 1 87 LEU MD2 4.000 . 5.000 2.624 2.490 2.735 . 0 0 "[ . 1 . 2]" 1
1644 1 83 LYS H 1 83 LYS HB2 3.000 . 3.300 2.923 2.907 2.937 . 0 0 "[ . 1 . 2]" 1
1645 1 83 LYS H 1 83 LYS HB3 2.500 . 2.700 2.402 2.397 2.413 . 0 0 "[ . 1 . 2]" 1
1646 1 83 LYS H 1 83 LYS QD 4.000 . 5.000 4.558 4.546 4.570 . 0 0 "[ . 1 . 2]" 1
1647 1 83 LYS H 1 83 LYS HG2 4.000 . 5.000 4.337 4.323 4.357 . 0 0 "[ . 1 . 2]" 1
1648 1 83 LYS H 1 83 LYS HG3 4.000 . 5.000 4.529 4.522 4.536 . 0 0 "[ . 1 . 2]" 1
1649 1 83 LYS H 1 86 GLN H 3.000 . 3.800 3.771 3.743 3.795 . 0 0 "[ . 1 . 2]" 1
1650 1 83 LYS H 1 87 LEU MD2 4.000 . 4.500 3.395 3.341 3.438 . 0 0 "[ . 1 . 2]" 1
1651 1 83 LYS H 1 87 LEU HG 3.000 . 4.000 3.639 3.604 3.668 . 0 0 "[ . 1 . 2]" 1
1652 1 83 LYS H 1 88 LEU H 3.000 . 4.000 4.015 3.976 4.036 0.036 6 0 "[ . 1 . 2]" 1
1653 1 83 LYS H 1 88 LEU MD1 4.000 . 5.800 4.429 4.368 4.509 . 0 0 "[ . 1 . 2]" 1
1654 1 83 LYS HA 1 83 LYS QD 4.000 . 5.500 3.754 3.726 3.782 . 0 0 "[ . 1 . 2]" 1
1655 1 83 LYS HA 1 83 LYS HG2 3.000 . 3.500 3.428 3.407 3.448 . 0 0 "[ . 1 . 2]" 1
1656 1 83 LYS HA 1 83 LYS HG3 2.500 . 2.800 2.488 2.472 2.498 . 0 0 "[ . 1 . 2]" 1
1657 1 83 LYS HA 1 84 GLU H 2.500 . 3.000 2.408 2.402 2.414 . 0 0 "[ . 1 . 2]" 1
1658 1 83 LYS HA 1 84 GLU HA 4.000 . 4.500 4.341 4.339 4.345 . 0 0 "[ . 1 . 2]" 1
1659 1 83 LYS HB2 1 83 LYS QE 3.000 . 4.500 4.041 3.960 4.102 . 0 0 "[ . 1 . 2]" 1
1660 1 83 LYS HB2 1 84 GLU H 3.000 . 4.000 3.810 3.796 3.823 . 0 0 "[ . 1 . 2]" 1
1661 1 83 LYS HB2 1 86 GLN H 4.000 . 4.300 4.144 4.132 4.158 . 0 0 "[ . 1 . 2]" 1
1662 1 83 LYS HB2 1 86 GLN QB 3.000 . 4.500 3.507 3.483 3.523 . 0 0 "[ . 1 . 2]" 1
1663 1 83 LYS HB2 1 88 LEU MD1 3.000 . 4.000 2.684 2.595 2.791 . 0 0 "[ . 1 . 2]" 1
1664 1 83 LYS HB2 1 93 TYR HD1 3.000 . 4.000 3.596 3.524 3.700 . 0 0 "[ . 1 . 2]" 1
1665 1 83 LYS HB2 1 93 TYR HE1 3.000 . 3.200 2.722 2.561 2.884 . 0 0 "[ . 1 . 2]" 1
1666 1 83 LYS HB3 1 83 LYS QD 3.000 . 3.500 2.577 2.533 2.612 . 0 0 "[ . 1 . 2]" 1
1667 1 83 LYS HB3 1 83 LYS QE 4.000 . 5.000 4.077 3.878 4.296 . 0 0 "[ . 1 . 2]" 1
1668 1 83 LYS HB3 1 84 GLU H 3.000 . 4.000 3.768 3.758 3.782 . 0 0 "[ . 1 . 2]" 1
1669 1 83 LYS HB3 1 86 GLN H 2.500 . 3.000 2.500 2.483 2.524 . 0 0 "[ . 1 . 2]" 1
1670 1 83 LYS HB3 1 86 GLN HA 3.000 . 4.200 4.196 4.185 4.207 0.007 13 0 "[ . 1 . 2]" 1
1671 1 83 LYS HB3 1 86 GLN QB 3.000 . 4.000 2.299 2.291 2.305 . 0 0 "[ . 1 . 2]" 1
1672 1 83 LYS HB3 1 86 GLN HG2 3.000 . 4.000 3.968 3.862 4.025 0.025 3 0 "[ . 1 . 2]" 1
1673 1 83 LYS HB3 1 86 GLN HG3 4.000 . 4.500 4.420 4.341 4.460 . 0 0 "[ . 1 . 2]" 1
1674 1 83 LYS HB3 1 87 LEU HG 4.000 . 5.000 4.987 4.916 5.025 0.025 14 0 "[ . 1 . 2]" 1
1675 1 83 LYS HB3 1 88 LEU MD1 4.000 . 4.800 3.374 3.305 3.456 . 0 0 "[ . 1 . 2]" 1
1676 1 83 LYS HB3 1 93 TYR HE1 4.000 . 5.000 4.477 4.317 4.638 . 0 0 "[ . 1 . 2]" 1
1677 1 83 LYS QD 1 84 GLU H 4.000 . 5.500 3.932 3.917 3.953 . 0 0 "[ . 1 . 2]" 1
1678 1 83 LYS QD 1 86 GLN QB 4.000 . 5.000 2.439 2.345 2.528 . 0 0 "[ . 1 . 2]" 1
1679 1 83 LYS QD 1 86 GLN HG3 4.000 . 5.800 3.341 3.247 3.471 . 0 0 "[ . 1 . 2]" 1
1680 1 83 LYS QD 1 88 LEU MD1 3.000 . 4.000 2.545 2.488 2.618 . 0 0 "[ . 1 . 2]" 1
1681 1 83 LYS QD 1 93 TYR HD1 4.000 . 4.500 4.029 3.930 4.083 . 0 0 "[ . 1 . 2]" 1
1682 1 83 LYS QD 1 93 TYR HE1 4.000 . 5.000 3.107 3.017 3.207 . 0 0 "[ . 1 . 2]" 1
1683 1 83 LYS QE 1 88 LEU MD1 4.000 . 6.000 4.007 3.860 4.311 . 0 0 "[ . 1 . 2]" 1
1684 1 83 LYS HG2 1 84 GLU H 2.500 . 3.000 2.515 2.485 2.544 . 0 0 "[ . 1 . 2]" 1
1685 1 83 LYS HG2 1 85 ASP H 3.000 . 4.300 2.385 2.356 2.413 . 0 0 "[ . 1 . 2]" 1
1686 1 83 LYS HG2 1 86 GLN H 2.500 . 3.000 2.492 2.459 2.516 . 0 0 "[ . 1 . 2]" 1
1687 1 83 LYS HG2 1 86 GLN QB 3.000 . 4.000 3.178 3.161 3.199 . 0 0 "[ . 1 . 2]" 1
1688 1 83 LYS HG2 1 86 GLN HG2 3.000 . 3.500 3.377 3.240 3.481 . 0 0 "[ . 1 . 2]" 1
1689 1 83 LYS HG2 1 86 GLN HG3 3.000 . 4.300 4.130 4.035 4.194 . 0 0 "[ . 1 . 2]" 1
1690 1 83 LYS HG3 1 84 GLU H 2.500 . 2.700 1.835 1.812 1.873 . 0 0 "[ . 1 . 2]" 1
1691 1 83 LYS HG3 1 85 ASP H 4.000 . 5.000 3.771 3.743 3.817 . 0 0 "[ . 1 . 2]" 1
1692 1 83 LYS HG3 1 86 GLN H 3.000 . 4.000 4.018 4.007 4.030 0.030 2 0 "[ . 1 . 2]" 1
1693 1 83 LYS HG3 1 86 GLN HG2 4.000 . 5.500 5.110 4.959 5.215 . 0 0 "[ . 1 . 2]" 1
1694 1 84 GLU H 1 84 GLU HB2 2.500 . 2.800 2.525 2.498 2.547 . 0 0 "[ . 1 . 2]" 1
1695 1 84 GLU H 1 84 GLU HB3 3.000 . 3.600 3.638 3.635 3.640 0.040 5 0 "[ . 1 . 2]" 1
1696 1 84 GLU H 1 84 GLU QG 3.000 . 4.000 2.340 2.096 3.170 . 0 0 "[ . 1 . 2]" 1
1697 1 84 GLU H 1 85 ASP H 3.000 . 3.500 3.303 3.291 3.314 . 0 0 "[ . 1 . 2]" 1
1698 1 84 GLU HA 1 84 GLU QG 2.500 . 3.200 2.371 2.266 2.656 . 0 0 "[ . 1 . 2]" 1
1699 1 84 GLU HA 1 85 ASP H 3.000 . 4.000 3.614 3.612 3.617 . 0 0 "[ . 1 . 2]" 1
1700 1 84 GLU HB2 1 85 ASP H 2.500 . 3.000 2.387 2.355 2.432 . 0 0 "[ . 1 . 2]" 1
1701 1 84 GLU HB2 1 85 ASP HA 4.000 . 5.200 4.882 4.856 4.919 . 0 0 "[ . 1 . 2]" 1
1702 1 84 GLU HB2 1 85 ASP HB2 3.000 . 4.000 3.903 3.861 3.949 . 0 0 "[ . 1 . 2]" 1
1703 1 84 GLU HB2 1 86 GLN H 4.000 . 4.300 4.203 4.179 4.243 . 0 0 "[ . 1 . 2]" 1
1704 1 84 GLU HB3 1 85 ASP H 3.000 . 3.300 3.130 3.102 3.155 . 0 0 "[ . 1 . 2]" 1
1705 1 84 GLU HB3 1 85 ASP HA 4.000 . 5.000 4.540 4.521 4.558 . 0 0 "[ . 1 . 2]" 1
1706 1 84 GLU HB3 1 85 ASP HB2 3.000 . 4.200 4.078 4.025 4.124 . 0 0 "[ . 1 . 2]" 1
1707 1 84 GLU HB3 1 86 GLN H 4.000 . 5.000 5.057 5.038 5.071 0.071 7 0 "[ . 1 . 2]" 1
1708 1 85 ASP H 1 85 ASP HB2 2.500 . 2.800 2.439 2.432 2.443 . 0 0 "[ . 1 . 2]" 1
1709 1 85 ASP H 1 85 ASP HB3 3.000 . 3.500 3.636 3.621 3.645 0.145 9 0 "[ . 1 . 2]" 1
1710 1 85 ASP H 1 86 GLN H 2.500 . 2.700 2.070 2.055 2.090 . 0 0 "[ . 1 . 2]" 1
1711 1 85 ASP H 1 86 GLN HG2 2.500 . 3.100 3.101 3.032 3.145 0.045 10 0 "[ . 1 . 2]" 1
1712 1 85 ASP H 1 86 GLN HG3 4.000 . 4.800 4.629 4.565 4.670 . 0 0 "[ . 1 . 2]" 1
1713 1 85 ASP HA 1 85 ASP HB2 3.000 . 3.200 3.007 3.002 3.010 . 0 0 "[ . 1 . 2]" 1
1714 1 85 ASP HA 1 85 ASP HB3 2.500 . 2.800 2.650 2.636 2.669 . 0 0 "[ . 1 . 2]" 1
1715 1 85 ASP HA 1 86 GLN H 3.000 . 3.800 3.311 3.297 3.321 . 0 0 "[ . 1 . 2]" 1
1716 1 85 ASP HB2 1 86 GLN H 3.000 . 3.800 3.663 3.637 3.706 . 0 0 "[ . 1 . 2]" 1
1717 1 85 ASP HB2 1 86 GLN HG2 3.000 . 3.800 3.102 3.051 3.159 . 0 0 "[ . 1 . 2]" 1
1718 1 85 ASP HB3 1 86 GLN H 3.000 . 4.200 4.122 4.113 4.130 . 0 0 "[ . 1 . 2]" 1
1719 1 85 ASP HB3 1 86 GLN HG2 3.000 . 3.600 3.527 3.465 3.604 0.004 14 0 "[ . 1 . 2]" 1
1720 1 85 ASP HB3 1 86 GLN HG3 4.000 . 5.000 5.062 5.053 5.074 0.074 6 0 "[ . 1 . 2]" 1
1721 1 86 GLN H 1 86 GLN QB 2.500 . 3.400 2.734 2.722 2.752 . 0 0 "[ . 1 . 2]" 1
1722 1 86 GLN H 1 86 GLN HG2 3.000 . 4.000 2.571 2.518 2.607 . 0 0 "[ . 1 . 2]" 1
1723 1 86 GLN H 1 86 GLN HG3 3.000 . 3.800 3.933 3.889 3.957 0.157 5 0 "[ . 1 . 2]" 1
1724 1 86 GLN H 1 87 LEU H 4.000 . 5.000 4.493 4.487 4.496 . 0 0 "[ . 1 . 2]" 1
1725 1 86 GLN HA 1 86 GLN HG2 3.000 . 4.000 3.110 3.046 3.192 . 0 0 "[ . 1 . 2]" 1
1726 1 86 GLN HA 1 86 GLN HG3 3.000 . 4.000 3.823 3.808 3.850 . 0 0 "[ . 1 . 2]" 1
1727 1 86 GLN HA 1 87 LEU H 2.500 . 2.900 2.415 2.409 2.420 . 0 0 "[ . 1 . 2]" 1
1728 1 86 GLN QB 1 87 LEU H 3.000 . 4.000 2.292 2.278 2.313 . 0 0 "[ . 1 . 2]" 1
1729 1 86 GLN HE21 1 86 GLN HG2 3.000 . 3.300 2.670 2.254 3.332 0.032 8 0 "[ . 1 . 2]" 1
1730 1 86 GLN HE21 1 86 GLN HG3 3.000 . 3.600 2.950 2.239 3.443 . 0 0 "[ . 1 . 2]" 1
1731 1 86 GLN HE22 1 86 GLN HG2 3.000 . 4.000 3.691 3.517 3.982 . 0 0 "[ . 1 . 2]" 1
1732 1 86 GLN HE22 1 86 GLN HG3 4.000 . 5.000 3.806 3.504 4.031 . 0 0 "[ . 1 . 2]" 1
1733 1 86 GLN HG2 1 87 LEU H 4.000 . 5.000 4.807 4.774 4.845 . 0 0 "[ . 1 . 2]" 1
1734 1 86 GLN HG3 1 87 LEU H 3.000 . 4.700 4.802 4.784 4.827 0.127 9 0 "[ . 1 . 2]" 1
1735 1 86 GLN HG3 1 88 LEU MD1 4.000 . 5.500 4.481 4.459 4.497 . 0 0 "[ . 1 . 2]" 1
1736 1 87 LEU H 1 87 LEU HB2 3.000 . 3.300 2.588 2.575 2.604 . 0 0 "[ . 1 . 2]" 1
1737 1 87 LEU H 1 87 LEU HB3 3.000 . 3.800 3.726 3.717 3.735 . 0 0 "[ . 1 . 2]" 1
1738 1 87 LEU H 1 87 LEU MD1 4.000 . 5.000 3.944 3.916 3.969 . 0 0 "[ . 1 . 2]" 1
1739 1 87 LEU H 1 87 LEU MD2 4.000 . 5.000 4.391 4.382 4.396 . 0 0 "[ . 1 . 2]" 1
1740 1 87 LEU H 1 87 LEU HG 3.000 . 3.500 3.468 3.451 3.487 . 0 0 "[ . 1 . 2]" 1
1741 1 87 LEU H 1 88 LEU MD1 4.000 . 5.800 4.681 4.650 4.716 . 0 0 "[ . 1 . 2]" 1
1742 1 87 LEU HA 1 87 LEU MD1 4.000 . 4.800 3.801 3.797 3.805 . 0 0 "[ . 1 . 2]" 1
1743 1 87 LEU HA 1 87 LEU MD2 3.000 . 3.300 2.237 2.229 2.252 . 0 0 "[ . 1 . 2]" 1
1744 1 87 LEU HA 1 87 LEU HG 3.000 . 3.300 2.504 2.486 2.517 . 0 0 "[ . 1 . 2]" 1
1745 1 87 LEU HA 1 88 LEU H 2.500 . 2.900 2.221 2.214 2.230 . 0 0 "[ . 1 . 2]" 1
1746 1 87 LEU HB2 1 87 LEU MD1 3.000 . 3.300 2.262 2.256 2.266 . 0 0 "[ . 1 . 2]" 1
1747 1 87 LEU HB2 1 87 LEU MD2 3.000 . 4.000 3.176 3.168 3.181 . 0 0 "[ . 1 . 2]" 1
1748 1 87 LEU HB2 1 88 LEU H 4.000 . 4.500 4.281 4.263 4.297 . 0 0 "[ . 1 . 2]" 1
1749 1 87 LEU HB2 1 88 LEU HA 4.000 . 5.200 5.016 4.999 5.030 . 0 0 "[ . 1 . 2]" 1
1750 1 87 LEU HB3 1 87 LEU MD1 3.000 . 3.300 2.593 2.582 2.611 . 0 0 "[ . 1 . 2]" 1
1751 1 87 LEU HB3 1 87 LEU MD2 2.500 . 3.200 2.256 2.248 2.261 . 0 0 "[ . 1 . 2]" 1
1752 1 87 LEU HB3 1 88 LEU H 3.000 . 3.300 3.232 3.208 3.260 . 0 0 "[ . 1 . 2]" 1
1753 1 87 LEU MD2 1 88 LEU H 4.000 . 4.800 3.132 3.108 3.170 . 0 0 "[ . 1 . 2]" 1
1754 1 87 LEU HG 1 88 LEU H 4.000 . 4.600 4.591 4.579 4.603 0.003 13 0 "[ . 1 . 2]" 1
1755 1 88 LEU H 1 88 LEU QB 3.000 . 3.800 2.548 2.538 2.560 . 0 0 "[ . 1 . 2]" 1
1756 1 88 LEU H 1 88 LEU MD1 4.000 . 4.600 3.726 3.712 3.739 . 0 0 "[ . 1 . 2]" 1
1757 1 88 LEU H 1 88 LEU MD2 4.000 . 5.200 4.316 4.295 4.356 . 0 0 "[ . 1 . 2]" 1
1758 1 88 LEU H 1 93 TYR HB2 4.000 . 5.000 4.372 4.332 4.442 . 0 0 "[ . 1 . 2]" 1
1759 1 88 LEU H 1 93 TYR HD1 4.000 . 5.000 4.451 4.334 4.631 . 0 0 "[ . 1 . 2]" 1
1760 1 88 LEU HA 1 88 LEU MD1 3.000 . 4.500 3.841 3.837 3.846 . 0 0 "[ . 1 . 2]" 1
1761 1 88 LEU HA 1 88 LEU MD2 3.000 . 3.300 2.304 2.287 2.354 . 0 0 "[ . 1 . 2]" 1
1762 1 88 LEU HA 1 88 LEU HG 3.000 . 3.200 2.616 2.595 2.635 . 0 0 "[ . 1 . 2]" 1
1763 1 88 LEU HA 1 89 CYS H 2.500 . 2.900 2.455 2.438 2.467 . 0 0 "[ . 1 . 2]" 1
1764 1 88 LEU HA 1 93 TYR H 4.000 . 5.000 5.058 5.030 5.099 0.099 16 0 "[ . 1 . 2]" 1
1765 1 88 LEU HA 1 93 TYR HD1 4.000 . 5.500 5.429 5.333 5.521 0.021 13 0 "[ . 1 . 2]" 1
1766 1 88 LEU QB 1 88 LEU MD1 3.000 . 3.300 2.131 2.127 2.134 . 0 0 "[ . 1 . 2]" 1
1767 1 88 LEU QB 1 88 LEU MD2 3.000 . 4.000 2.168 2.163 2.170 . 0 0 "[ . 1 . 2]" 1
1768 1 88 LEU QB 1 89 CYS H 3.000 . 4.000 2.428 2.415 2.450 . 0 0 "[ . 1 . 2]" 1
1769 1 88 LEU QB 1 92 CYS QB 3.000 . 4.000 2.285 2.279 2.296 . 0 0 "[ . 1 . 2]" 1
1770 1 88 LEU QB 1 93 TYR H 4.000 . 5.000 2.805 2.780 2.837 . 0 0 "[ . 1 . 2]" 1
1771 1 88 LEU QB 1 93 TYR HA 3.000 . 4.200 3.020 2.969 3.089 . 0 0 "[ . 1 . 2]" 1
1772 1 88 LEU QB 1 93 TYR HB2 3.000 . 3.800 2.367 2.330 2.409 . 0 0 "[ . 1 . 2]" 1
1773 1 88 LEU QB 1 93 TYR HB3 4.000 . 5.000 3.880 3.846 3.923 . 0 0 "[ . 1 . 2]" 1
1774 1 88 LEU QB 1 93 TYR HD1 4.000 . 5.000 2.411 2.319 2.514 . 0 0 "[ . 1 . 2]" 1
1775 1 88 LEU MD1 1 93 TYR HA 3.000 . 4.500 2.657 2.589 2.759 . 0 0 "[ . 1 . 2]" 1
1776 1 88 LEU MD1 1 93 TYR HD1 3.000 . 4.200 2.140 2.081 2.182 . 0 0 "[ . 1 . 2]" 1
1777 1 88 LEU MD1 1 93 TYR HE1 4.000 . 5.500 3.320 3.229 3.380 . 0 0 "[ . 1 . 2]" 1
1778 1 88 LEU MD1 1 96 GLU QG 3.000 . 4.500 3.074 2.753 3.223 . 0 0 "[ . 1 . 2]" 1
1779 1 88 LEU MD2 1 89 CYS H 3.000 . 4.500 3.266 3.245 3.285 . 0 0 "[ . 1 . 2]" 1
1780 1 88 LEU MD2 1 92 CYS QB 3.000 . 4.000 2.401 2.330 2.448 . 0 0 "[ . 1 . 2]" 1
1781 1 88 LEU MD2 1 93 TYR H 4.000 . 5.500 4.174 4.129 4.207 . 0 0 "[ . 1 . 2]" 1
1782 1 88 LEU MD2 1 93 TYR HA 4.000 . 5.000 3.941 3.877 3.978 . 0 0 "[ . 1 . 2]" 1
1783 1 88 LEU MD2 1 93 TYR HD1 4.000 . 5.200 4.289 4.208 4.342 . 0 0 "[ . 1 . 2]" 1
1784 1 88 LEU HG 1 93 TYR HD1 4.000 . 5.000 4.270 4.171 4.364 . 0 0 "[ . 1 . 2]" 1
1785 1 89 CYS H 1 89 CYS HB2 2.500 . 2.900 2.689 2.673 2.701 . 0 0 "[ . 1 . 2]" 1
1786 1 89 CYS H 1 89 CYS HB3 3.000 . 3.600 3.669 3.666 3.673 0.073 3 0 "[ . 1 . 2]" 1
1787 1 89 CYS H 1 93 TYR H 3.000 . 3.600 3.463 3.415 3.524 . 0 0 "[ . 1 . 2]" 1
1788 1 89 CYS HA 1 89 CYS HB2 2.500 . 3.100 3.029 3.028 3.030 . 0 0 "[ . 1 . 2]" 1
1789 1 89 CYS HA 1 89 CYS HB3 2.500 . 2.900 2.385 2.380 2.390 . 0 0 "[ . 1 . 2]" 1
1790 1 89 CYS HA 1 90 THR H 2.500 . 2.900 2.263 2.256 2.271 . 0 0 "[ . 1 . 2]" 1
1791 1 89 CYS HA 1 90 THR HA 4.000 . 5.000 4.408 4.399 4.415 . 0 0 "[ . 1 . 2]" 1
1792 1 89 CYS HA 1 91 ASP H 3.000 . 3.500 3.631 3.610 3.660 0.160 19 0 "[ . 1 . 2]" 1
1793 1 89 CYS HB2 1 90 THR H 3.000 . 4.000 3.916 3.892 3.938 . 0 0 "[ . 1 . 2]" 1
1794 1 89 CYS HB2 1 91 ASP H 3.000 . 3.300 2.583 2.545 2.621 . 0 0 "[ . 1 . 2]" 1
1795 1 89 CYS HB2 1 93 TYR H 3.000 . 4.000 3.904 3.859 3.951 . 0 0 "[ . 1 . 2]" 1
1796 1 89 CYS HB3 1 90 THR H 3.000 . 3.300 3.175 3.151 3.198 . 0 0 "[ . 1 . 2]" 1
1797 1 89 CYS HB3 1 91 ASP H 3.000 . 3.300 2.781 2.734 2.827 . 0 0 "[ . 1 . 2]" 1
1798 1 90 THR H 1 90 THR HB 3.000 . 3.500 3.009 2.655 3.540 0.040 4 0 "[ . 1 . 2]" 1
1799 1 90 THR H 1 90 THR MG 2.500 . 3.400 1.788 1.719 1.897 0.081 5 0 "[ . 1 . 2]" 1
1800 1 90 THR H 1 91 ASP H 3.000 . 3.500 2.782 2.744 2.802 . 0 0 "[ . 1 . 2]" 1
1801 1 90 THR HA 1 90 THR MG 3.000 . 4.000 3.029 2.617 3.198 . 0 0 "[ . 1 . 2]" 1
1802 1 90 THR HA 1 91 ASP H 3.000 . 3.500 3.401 3.391 3.409 . 0 0 "[ . 1 . 2]" 1
1803 1 90 THR HA 1 93 TYR H 3.000 . 3.500 3.566 3.538 3.586 0.086 13 0 "[ . 1 . 2]" 1
1804 1 90 THR HA 1 93 TYR HB2 2.500 . 3.200 3.257 3.230 3.287 0.087 10 0 "[ . 1 . 2]" 1
1805 1 90 THR HA 1 93 TYR HB3 3.000 . 3.300 2.436 2.387 2.467 . 0 0 "[ . 1 . 2]" 1
1806 1 90 THR HA 1 93 TYR HD2 4.000 . 5.000 3.952 3.894 4.016 . 0 0 "[ . 1 . 2]" 1
1807 1 90 THR HA 1 94 SER H 3.000 . 3.500 3.451 3.368 3.498 . 0 0 "[ . 1 . 2]" 1
1808 1 90 THR HB 1 91 ASP H 3.000 . 4.300 4.337 4.253 4.371 0.071 20 0 "[ . 1 . 2]" 1
1809 1 90 THR MG 1 91 ASP H 3.000 . 4.600 2.764 2.464 3.591 . 0 0 "[ . 1 . 2]" 1
1810 1 91 ASP H 1 91 ASP HA 3.000 . 3.500 2.946 2.940 2.951 . 0 0 "[ . 1 . 2]" 1
1811 1 91 ASP H 1 91 ASP HB2 2.500 . 2.900 2.468 2.307 2.666 . 0 0 "[ . 1 . 2]" 1
1812 1 91 ASP H 1 91 ASP HB3 3.000 . 4.000 3.638 3.594 3.666 . 0 0 "[ . 1 . 2]" 1
1813 1 91 ASP H 1 92 CYS H 2.500 . 2.900 2.418 2.370 2.463 . 0 0 "[ . 1 . 2]" 1
1814 1 91 ASP H 1 93 TYR H 3.000 . 4.000 3.639 3.584 3.738 . 0 0 "[ . 1 . 2]" 1
1815 1 91 ASP HA 1 91 ASP HB2 2.500 . 2.900 3.023 3.016 3.028 0.128 14 0 "[ . 1 . 2]" 1
1816 1 91 ASP HA 1 91 ASP HB3 3.000 . 3.500 2.483 2.383 2.578 . 0 0 "[ . 1 . 2]" 1
1817 1 91 ASP HA 1 92 CYS H 3.000 . 4.000 3.569 3.553 3.574 . 0 0 "[ . 1 . 2]" 1
1818 1 91 ASP HA 1 93 TYR H 4.000 . 5.000 4.636 4.567 4.758 . 0 0 "[ . 1 . 2]" 1
1819 1 91 ASP HA 1 94 SER H 4.000 . 5.000 3.895 3.795 4.026 . 0 0 "[ . 1 . 2]" 1
1820 1 91 ASP HA 1 95 ASN H 4.000 . 5.000 4.728 4.527 4.826 . 0 0 "[ . 1 . 2]" 1
1821 1 91 ASP HB2 1 92 CYS H 2.500 . 2.900 2.449 2.334 2.580 . 0 0 "[ . 1 . 2]" 1
1822 1 91 ASP HB3 1 92 CYS H 3.000 . 3.800 3.530 3.341 3.688 . 0 0 "[ . 1 . 2]" 1
1823 1 92 CYS H 1 92 CYS QB 3.000 . 3.700 2.708 2.660 2.754 . 0 0 "[ . 1 . 2]" 1
1824 1 92 CYS HA 1 92 CYS QB 2.500 . 2.900 2.276 2.261 2.290 . 0 0 "[ . 1 . 2]" 1
1825 1 92 CYS HA 1 93 TYR H 3.000 . 4.000 3.548 3.531 3.558 . 0 0 "[ . 1 . 2]" 1
1826 1 92 CYS HA 1 94 SER H 3.000 . 4.500 4.560 4.533 4.595 0.095 16 0 "[ . 1 . 2]" 1
1827 1 92 CYS HA 1 95 ASN H 3.000 . 4.000 3.335 3.250 3.395 . 0 0 "[ . 1 . 2]" 1
1828 1 92 CYS HA 1 95 ASN QB 3.000 . 3.500 2.478 2.225 2.739 . 0 0 "[ . 1 . 2]" 1
1829 1 92 CYS QB 1 93 TYR H 3.000 . 4.000 2.591 2.497 2.690 . 0 0 "[ . 1 . 2]" 1
1830 1 92 CYS QB 1 93 TYR HA 4.000 . 4.500 3.837 3.819 3.854 . 0 0 "[ . 1 . 2]" 1
1831 1 92 CYS QB 1 95 ASN QB 4.000 . 5.500 3.756 3.611 3.905 . 0 0 "[ . 1 . 2]" 1
1832 1 93 TYR H 1 93 TYR HB2 3.000 . 3.500 2.378 2.357 2.409 . 0 0 "[ . 1 . 2]" 1
1833 1 93 TYR H 1 93 TYR HB3 2.500 . 2.900 2.695 2.684 2.715 . 0 0 "[ . 1 . 2]" 1
1834 1 93 TYR H 1 93 TYR HD1 3.000 . 4.500 4.410 4.378 4.433 . 0 0 "[ . 1 . 2]" 1
1835 1 93 TYR H 1 94 SER H 3.000 . 3.500 2.787 2.751 2.843 . 0 0 "[ . 1 . 2]" 1
1836 1 93 TYR HA 1 93 TYR HD1 2.500 . 2.700 2.499 2.365 2.553 . 0 0 "[ . 1 . 2]" 1
1837 1 93 TYR HA 1 93 TYR HE1 4.000 . 5.000 4.536 4.437 4.567 . 0 0 "[ . 1 . 2]" 1
1838 1 93 TYR HA 1 94 SER H 3.000 . 3.500 3.552 3.547 3.559 0.059 16 0 "[ . 1 . 2]" 1
1839 1 93 TYR HA 1 96 GLU QG 2.500 . 3.200 2.511 2.291 2.684 . 0 0 "[ . 1 . 2]" 1
1840 1 93 TYR HA 1 97 TYR H 4.000 . 5.000 3.685 3.481 4.221 . 0 0 "[ . 1 . 2]" 1
1841 1 93 TYR HB2 1 93 TYR HD1 2.500 . 2.700 2.628 2.611 2.663 . 0 0 "[ . 1 . 2]" 1
1842 1 93 TYR HB2 1 93 TYR HE1 4.000 . 5.000 4.817 4.807 4.834 . 0 0 "[ . 1 . 2]" 1
1843 1 93 TYR HB2 1 94 SER H 3.000 . 3.500 3.610 3.592 3.623 0.123 9 0 "[ . 1 . 2]" 1
1844 1 93 TYR HB3 1 93 TYR HD2 3.000 . 3.300 2.342 2.340 2.346 . 0 0 "[ . 1 . 2]" 1
1845 1 93 TYR HB3 1 93 TYR HE2 4.000 . 5.000 4.657 4.655 4.660 . 0 0 "[ . 1 . 2]" 1
1846 1 93 TYR HB3 1 94 SER H 4.000 . 5.000 2.307 2.276 2.331 . 0 0 "[ . 1 . 2]" 1
1847 1 93 TYR HB3 1 95 ASN H 4.000 . 5.000 4.545 4.491 4.680 . 0 0 "[ . 1 . 2]" 1
1848 1 93 TYR HD2 1 94 SER H 3.000 . 3.800 3.638 3.599 3.662 . 0 0 "[ . 1 . 2]" 1
1849 1 93 TYR HD2 1 94 SER HA 3.000 . 3.600 3.599 3.528 3.640 0.040 13 0 "[ . 1 . 2]" 1
1850 1 93 TYR HE1 1 96 GLU QG 4.000 . 5.800 5.011 4.685 5.256 . 0 0 "[ . 1 . 2]" 1
1851 1 93 TYR HE2 1 94 SER HA 4.000 . 5.000 5.072 5.058 5.089 0.089 12 0 "[ . 1 . 2]" 1
1852 1 93 TYR HE2 1 97 TYR HB2 3.000 . 4.000 3.084 2.720 3.439 . 0 0 "[ . 1 . 2]" 1
1853 1 93 TYR HE2 1 97 TYR HB3 4.000 . 5.000 3.854 3.553 4.378 . 0 0 "[ . 1 . 2]" 1
1854 1 94 SER H 1 94 SER QB 2.500 . 3.400 2.373 2.200 2.595 . 0 0 "[ . 1 . 2]" 1
1855 1 94 SER H 1 96 GLU H 3.000 . 4.300 4.334 4.170 4.380 0.080 6 0 "[ . 1 . 2]" 1
1856 1 94 SER HA 1 95 ASN H 3.000 . 4.000 3.455 3.427 3.522 . 0 0 "[ . 1 . 2]" 1
1857 1 94 SER HA 1 97 TYR QD 3.000 . 3.300 3.306 3.236 3.340 0.040 16 0 "[ . 1 . 2]" 1
1858 1 94 SER HA 1 98 SER H 3.000 . 4.000 3.441 3.214 3.790 . 0 0 "[ . 1 . 2]" 1
1859 1 94 SER QB 1 95 ASN H 3.000 . 4.000 3.121 2.750 3.656 . 0 0 "[ . 1 . 2]" 1
1860 1 95 ASN H 1 95 ASN HA 2.500 . 3.400 2.905 2.875 2.922 . 0 0 "[ . 1 . 2]" 1
1861 1 95 ASN H 1 95 ASN QB 2.500 . 3.400 2.294 2.238 2.469 . 0 0 "[ . 1 . 2]" 1
1862 1 95 ASN HA 1 96 GLU H 3.000 . 4.000 3.524 3.466 3.544 . 0 0 "[ . 1 . 2]" 1
1863 1 95 ASN QB 1 96 GLU H 3.000 . 4.000 2.740 2.564 2.965 . 0 0 "[ . 1 . 2]" 1
1864 1 95 ASN QB 1 96 GLU HA 4.000 . 5.000 4.197 4.085 4.259 . 0 0 "[ . 1 . 2]" 1
1865 1 95 ASN QB 1 96 GLU QG 3.000 . 4.500 3.163 2.814 3.590 . 0 0 "[ . 1 . 2]" 1
1866 1 96 GLU H 1 96 GLU HA 3.000 . 4.000 2.991 2.964 3.011 . 0 0 "[ . 1 . 2]" 1
1867 1 96 GLU H 1 96 GLU QB 2.500 . 3.400 2.936 2.674 3.056 . 0 0 "[ . 1 . 2]" 1
1868 1 96 GLU H 1 96 GLU QG 2.500 . 3.400 1.860 1.705 2.012 0.095 11 0 "[ . 1 . 2]" 1
1869 1 96 GLU H 1 97 TYR HB3 3.000 . 4.200 4.209 3.928 4.271 0.071 13 0 "[ . 1 . 2]" 1
1870 1 96 GLU HA 1 96 GLU QB 2.500 . 3.400 2.206 2.188 2.282 . 0 0 "[ . 1 . 2]" 1
1871 1 96 GLU HA 1 96 GLU QG 3.000 . 4.000 3.244 2.593 3.418 . 0 0 "[ . 1 . 2]" 1
1872 1 96 GLU HA 1 97 TYR H 3.000 . 4.000 3.540 3.436 3.566 . 0 0 "[ . 1 . 2]" 1
1873 1 96 GLU HA 1 98 SER H 3.000 . 4.000 3.968 3.670 4.045 0.045 16 0 "[ . 1 . 2]" 1
1874 1 96 GLU QB 1 97 TYR H 3.000 . 4.000 3.140 2.522 3.638 . 0 0 "[ . 1 . 2]" 1
1875 1 96 GLU QG 1 97 TYR H 3.000 . 4.000 2.321 1.799 3.514 0.001 1 0 "[ . 1 . 2]" 1
1876 1 96 GLU QG 1 98 SER H 4.000 . 5.500 4.515 4.193 4.978 . 0 0 "[ . 1 . 2]" 1
1877 1 97 TYR H 1 97 TYR HB2 2.500 . 3.300 2.650 2.583 2.780 . 0 0 "[ . 1 . 2]" 1
1878 1 97 TYR H 1 97 TYR HB3 2.500 . 3.300 2.448 2.305 2.529 . 0 0 "[ . 1 . 2]" 1
1879 1 97 TYR HA 1 98 SER H 3.000 . 4.000 3.500 3.389 3.543 . 0 0 "[ . 1 . 2]" 1
1880 1 97 TYR HB2 1 97 TYR QD 3.000 . 3.300 2.482 2.353 2.537 . 0 0 "[ . 1 . 2]" 1
1881 1 97 TYR HB2 1 98 SER H 3.000 . 4.000 4.058 3.997 4.168 0.168 12 0 "[ . 1 . 2]" 1
1882 1 97 TYR HB3 1 97 TYR QD 3.000 . 3.300 2.365 2.330 2.504 . 0 0 "[ . 1 . 2]" 1
1883 1 97 TYR HB3 1 98 SER H 4.000 . 5.000 2.840 2.704 3.118 . 0 0 "[ . 1 . 2]" 1
1884 1 97 TYR QD 1 98 SER HA 3.000 . 3.500 3.460 3.251 3.587 0.087 3 0 "[ . 1 . 2]" 1
1885 1 98 SER H 1 98 SER HA 2.500 . 3.400 2.777 2.352 2.935 . 0 0 "[ . 1 . 2]" 1
1886 1 98 SER H 1 98 SER QB 2.500 . 3.400 2.454 2.155 3.122 . 0 0 "[ . 1 . 2]" 1
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