NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
477638 |
2kun   |
16743 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kun
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 2045
_Distance_constraint_stats_list.Viol_count 2614
_Distance_constraint_stats_list.Viol_total 3466.213
_Distance_constraint_stats_list.Viol_max 0.821
_Distance_constraint_stats_list.Viol_rms 0.0291
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0663
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 5.170 0.356 13 0 "[ . 1 . 2]"
1 2 GLN 5.170 0.356 13 0 "[ . 1 . 2]"
1 5 GLY 0.317 0.109 3 0 "[ . 1 . 2]"
1 6 THR 0.317 0.109 3 0 "[ . 1 . 2]"
1 7 HIS 0.218 0.169 15 0 "[ . 1 . 2]"
1 8 SER 0.169 0.169 15 0 "[ . 1 . 2]"
1 9 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 TRP 0.051 0.048 4 0 "[ . 1 . 2]"
1 11 ASN 0.024 0.020 14 0 "[ . 1 . 2]"
1 12 LYS 0.795 0.338 7 0 "[ . 1 . 2]"
1 13 PRO 0.775 0.338 7 0 "[ . 1 . 2]"
1 14 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LYS 0.624 0.197 4 0 "[ . 1 . 2]"
1 16 PRO 0.635 0.197 4 0 "[ . 1 . 2]"
1 17 LYS 0.451 0.358 13 0 "[ . 1 . 2]"
1 18 THR 0.284 0.150 19 0 "[ . 1 . 2]"
1 19 ASN 0.219 0.150 19 0 "[ . 1 . 2]"
1 20 MET 0.056 0.024 15 0 "[ . 1 . 2]"
1 21 LYS 0.581 0.090 17 0 "[ . 1 . 2]"
1 22 HIS 0.371 0.094 1 0 "[ . 1 . 2]"
1 23 MET 0.139 0.094 1 0 "[ . 1 . 2]"
1 24 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 ALA 0.029 0.025 3 0 "[ . 1 . 2]"
1 27 ALA 0.029 0.025 3 0 "[ . 1 . 2]"
1 28 ALA 0.056 0.041 8 0 "[ . 1 . 2]"
1 29 ALA 0.056 0.041 8 0 "[ . 1 . 2]"
1 30 GLY 0.598 0.343 12 0 "[ . 1 . 2]"
1 31 ALA 0.509 0.093 13 0 "[ . 1 . 2]"
1 32 VAL 0.728 0.343 12 0 "[ . 1 . 2]"
1 33 VAL 0.543 0.178 12 0 "[ . 1 . 2]"
1 34 GLY 0.064 0.056 12 0 "[ . 1 . 2]"
1 35 GLY 3.574 0.696 15 1 "[ . 1 + 2]"
1 36 LEU 5.800 0.696 15 1 "[ . 1 + 2]"
1 37 GLY 0.772 0.296 19 0 "[ . 1 . 2]"
1 38 GLY 0.269 0.178 12 0 "[ . 1 . 2]"
1 39 TYR 1.741 0.578 12 1 "[ . 1 + . 2]"
1 40 MET 1.105 0.180 12 0 "[ . 1 . 2]"
1 41 LEU 1.274 0.209 12 0 "[ . 1 . 2]"
1 42 GLY 1.488 0.258 13 0 "[ . 1 . 2]"
1 43 SER 4.643 0.243 7 0 "[ . 1 . 2]"
1 44 ALA 7.983 0.245 4 0 "[ . 1 . 2]"
1 45 MET 9.684 0.693 16 4 "[ * .*- 1 .+ 2]"
1 46 SER 15.399 0.419 4 0 "[ . 1 . 2]"
1 47 ARG 10.802 0.419 4 0 "[ . 1 . 2]"
1 48 PRO 5.165 0.712 4 1 "[ +. 1 . 2]"
1 49 ILE 0.307 0.037 11 0 "[ . 1 . 2]"
1 50 ILE 7.490 0.297 4 0 "[ . 1 . 2]"
1 51 HIS 5.293 0.201 6 0 "[ . 1 . 2]"
1 52 PHE 1.395 0.297 4 0 "[ . 1 . 2]"
1 53 GLY 0.573 0.053 17 0 "[ . 1 . 2]"
1 54 SER 5.695 0.821 1 7 "[+ .* *1 * -* *2]"
1 55 ASP 5.042 0.821 1 7 "[+ .* *1 * -* *2]"
1 56 TYR 2.552 0.159 4 0 "[ . 1 . 2]"
1 57 GLU 2.577 0.197 4 0 "[ . 1 . 2]"
1 58 ASP 1.580 0.245 4 0 "[ . 1 . 2]"
1 59 ARG 1.521 0.159 4 0 "[ . 1 . 2]"
1 60 TYR 2.631 0.280 4 0 "[ . 1 . 2]"
1 61 TYR 2.410 0.180 4 0 "[ . 1 . 2]"
1 62 ARG 0.730 0.276 4 0 "[ . 1 . 2]"
1 63 GLU 3.956 0.280 4 0 "[ . 1 . 2]"
1 64 ASN 5.777 0.236 4 0 "[ . 1 . 2]"
1 65 MET 2.890 0.188 4 0 "[ . 1 . 2]"
1 66 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ARG 1.188 0.193 2 0 "[ . 1 . 2]"
1 68 TYR 3.865 0.206 17 0 "[ . 1 . 2]"
1 69 PRO 1.344 0.276 12 0 "[ . 1 . 2]"
1 70 ASN 3.940 0.712 4 1 "[ +. 1 . 2]"
1 71 GLN 3.046 0.243 7 0 "[ . 1 . 2]"
1 72 VAL 4.377 0.258 13 0 "[ . 1 . 2]"
1 73 TYR 2.691 0.310 12 0 "[ . 1 . 2]"
1 74 TYR 0.562 0.209 12 0 "[ . 1 . 2]"
1 75 ARG 0.888 0.578 12 1 "[ . 1 + . 2]"
1 76 PRO 0.154 0.042 17 0 "[ . 1 . 2]"
1 77 MET 0.015 0.011 3 0 "[ . 1 . 2]"
1 78 ASP 0.809 0.221 12 0 "[ . 1 . 2]"
1 79 GLU 0.598 0.221 12 0 "[ . 1 . 2]"
1 82 ASN 0.235 0.045 15 0 "[ . 1 . 2]"
1 83 GLN 0.096 0.045 15 0 "[ . 1 . 2]"
1 84 ASN 1.961 0.336 12 0 "[ . 1 . 2]"
1 85 ASN 0.389 0.114 4 0 "[ . 1 . 2]"
1 86 PHE 2.502 0.336 12 0 "[ . 1 . 2]"
1 87 VAL 3.110 0.148 4 0 "[ . 1 . 2]"
1 88 HIS 10.661 0.565 4 2 "[ +. 1 - . 2]"
1 89 ASP 0.865 0.130 12 0 "[ . 1 . 2]"
1 90 CYS 0.008 0.005 1 0 "[ . 1 . 2]"
1 91 VAL 1.432 0.198 4 0 "[ . 1 . 2]"
1 92 ASN 1.686 0.297 3 0 "[ . 1 . 2]"
1 93 ILE 6.264 0.310 12 0 "[ . 1 . 2]"
1 94 THR 1.257 0.176 12 0 "[ . 1 . 2]"
1 95 ILE 5.419 0.206 17 0 "[ . 1 . 2]"
1 96 LYS 3.193 0.159 12 0 "[ . 1 . 2]"
1 97 GLN 0.873 0.085 11 0 "[ . 1 . 2]"
1 98 HIS 1.066 0.126 4 0 "[ . 1 . 2]"
1 99 THR 0.895 0.141 4 0 "[ . 1 . 2]"
1 100 VAL 0.551 0.077 20 0 "[ . 1 . 2]"
1 101 THR 0.039 0.019 11 0 "[ . 1 . 2]"
1 102 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 THR 0.362 0.029 19 0 "[ . 1 . 2]"
1 104 THR 0.015 0.014 2 0 "[ . 1 . 2]"
1 105 LYS 2.034 0.194 11 0 "[ . 1 . 2]"
1 106 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLU 0.320 0.032 9 0 "[ . 1 . 2]"
1 108 ASN 0.315 0.052 11 0 "[ . 1 . 2]"
1 109 PHE 0.847 0.204 12 0 "[ . 1 . 2]"
1 110 THR 2.900 0.336 12 0 "[ . 1 . 2]"
1 111 GLU 0.377 0.079 4 0 "[ . 1 . 2]"
1 112 THR 1.566 0.124 4 0 "[ . 1 . 2]"
1 113 ASP 0.929 0.122 4 0 "[ . 1 . 2]"
1 114 VAL 3.047 0.336 12 0 "[ . 1 . 2]"
1 115 LYS 1.498 0.124 4 0 "[ . 1 . 2]"
1 116 MET 4.052 0.276 4 0 "[ . 1 . 2]"
1 117 MET 0.820 0.141 4 0 "[ . 1 . 2]"
1 118 GLU 0.243 0.062 4 0 "[ . 1 . 2]"
1 119 ARG 5.413 0.354 4 0 "[ . 1 . 2]"
1 120 VAL 5.797 0.236 4 0 "[ . 1 . 2]"
1 121 VAL 4.091 0.354 4 0 "[ . 1 . 2]"
1 122 GLU 0.279 0.086 12 0 "[ . 1 . 2]"
1 123 PRO 1.454 0.100 12 0 "[ . 1 . 2]"
1 124 MET 4.958 0.216 4 0 "[ . 1 . 2]"
1 125 CYS 8.805 0.565 4 2 "[ +. 1 - . 2]"
1 126 ILE 0.513 0.054 4 0 "[ . 1 . 2]"
1 127 THR 1.703 0.276 20 0 "[ . 1 . 2]"
1 128 GLN 1.119 0.243 6 0 "[ . 1 . 2]"
1 129 TYR 1.265 0.159 15 0 "[ . 1 . 2]"
1 130 GLU 0.894 0.151 4 0 "[ . 1 . 2]"
1 131 ARG 6.546 0.693 16 4 "[ * .*- 1 .+ 2]"
1 132 GLU 2.053 0.455 13 0 "[ . 1 . 2]"
1 133 SER 0.255 0.061 4 0 "[ . 1 . 2]"
1 134 GLN 5.997 0.311 7 0 "[ . 1 . 2]"
1 135 ALA 0.310 0.159 15 0 "[ . 1 . 2]"
1 136 TYR 0.120 0.029 10 0 "[ . 1 . 2]"
1 137 TYR 6.022 0.439 17 0 "[ . 1 . 2]"
1 138 GLN 6.484 0.439 17 0 "[ . 1 . 2]"
1 139 ARG 9.463 0.371 4 0 "[ . 1 . 2]"
1 140 GLY 5.944 0.371 4 0 "[ . 1 . 2]"
1 141 SER 0.073 0.030 6 0 "[ . 1 . 2]"
1 142 SER 0.195 0.039 13 0 "[ . 1 . 2]"
1 143 HIS 6.323 0.283 4 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 GLN HB3 4.500 . 5.000 5.182 3.924 5.356 0.356 13 0 "[ . 1 . 2]" 1
2 1 1 GLY QA 1 2 GLN QG 4.500 . 5.000 3.724 3.334 5.045 0.045 16 0 "[ . 1 . 2]" 1
3 1 5 GLY QA 1 6 THR HA 4.500 . 5.000 4.071 3.960 4.495 . 0 0 "[ . 1 . 2]" 1
4 1 5 GLY QA 1 6 THR HB 4.500 . 5.000 4.486 3.964 4.984 . 0 0 "[ . 1 . 2]" 1
5 1 5 GLY QA 1 6 THR MG 4.500 . 5.000 4.481 3.348 5.109 0.109 3 0 "[ . 1 . 2]" 1
6 1 7 HIS H 1 7 HIS HD2 4.500 . 5.000 3.929 2.553 5.043 0.043 2 0 "[ . 1 . 2]" 1
7 1 7 HIS HA 1 7 HIS HD2 4.500 . 5.000 4.009 2.391 4.739 . 0 0 "[ . 1 . 2]" 1
8 1 7 HIS QB 1 7 HIS HD2 3.500 . 3.800 2.807 2.652 3.293 . 0 0 "[ . 1 . 2]" 1
9 1 7 HIS QB 1 8 SER HA 4.500 . 5.000 4.388 3.897 4.729 . 0 0 "[ . 1 . 2]" 1
10 1 7 HIS QB 1 8 SER QB 4.500 . 5.000 4.514 3.873 5.169 0.169 15 0 "[ . 1 . 2]" 1
11 1 9 GLN H 1 9 GLN QB 3.500 . 3.800 2.631 1.958 3.346 . 0 0 "[ . 1 . 2]" 1
12 1 9 GLN H 1 9 GLN HG2 5.200 . 5.700 3.900 2.205 5.242 . 0 0 "[ . 1 . 2]" 1
13 1 9 GLN H 1 9 GLN QG 4.500 . 5.000 3.361 2.159 4.404 . 0 0 "[ . 1 . 2]" 1
14 1 9 GLN H 1 9 GLN HG3 5.200 . 5.700 3.949 2.488 5.193 . 0 0 "[ . 1 . 2]" 1
15 1 9 GLN HA 1 9 GLN QG 3.500 . 3.800 2.688 2.331 3.494 . 0 0 "[ . 1 . 2]" 1
16 1 9 GLN HA 1 10 TRP H 3.500 . 3.800 2.610 2.112 3.615 . 0 0 "[ . 1 . 2]" 1
17 1 9 GLN QB 1 10 TRP H 4.500 . 5.000 3.216 2.268 4.033 . 0 0 "[ . 1 . 2]" 1
18 1 9 GLN HG2 1 10 TRP H 5.200 . 5.700 4.358 2.758 5.201 . 0 0 "[ . 1 . 2]" 1
19 1 9 GLN HG3 1 10 TRP H 5.200 . 5.700 4.485 2.949 5.381 . 0 0 "[ . 1 . 2]" 1
20 1 10 TRP H 1 10 TRP HB2 3.500 . 3.800 2.669 2.059 3.640 . 0 0 "[ . 1 . 2]" 1
21 1 10 TRP H 1 10 TRP HD1 4.500 . 5.000 3.320 2.721 3.998 . 0 0 "[ . 1 . 2]" 1
22 1 10 TRP HA 1 10 TRP HD1 4.500 . 5.000 4.455 4.045 4.630 . 0 0 "[ . 1 . 2]" 1
23 1 10 TRP HA 1 10 TRP HE3 3.500 . 3.800 2.554 2.328 2.865 . 0 0 "[ . 1 . 2]" 1
24 1 10 TRP HA 1 10 TRP HZ3 4.500 . 5.000 4.770 4.525 5.048 0.048 4 0 "[ . 1 . 2]" 1
25 1 10 TRP HB3 1 10 TRP HZ3 5.200 . 5.700 5.242 5.124 5.341 . 0 0 "[ . 1 . 2]" 1
26 1 10 TRP HB3 1 11 ASN H 4.500 . 5.000 3.524 1.797 4.556 0.003 6 0 "[ . 1 . 2]" 1
27 1 11 ASN H 1 11 ASN QB 3.500 . 3.800 2.717 2.223 3.425 . 0 0 "[ . 1 . 2]" 1
28 1 11 ASN HA 1 12 LYS H 3.500 . 3.800 2.553 2.161 3.501 . 0 0 "[ . 1 . 2]" 1
29 1 11 ASN QB 1 12 LYS H 4.500 . 5.000 3.209 1.780 4.036 0.020 14 0 "[ . 1 . 2]" 1
30 1 12 LYS H 1 12 LYS QG 4.500 . 5.000 2.754 2.089 3.402 . 0 0 "[ . 1 . 2]" 1
31 1 12 LYS HA 1 12 LYS HD2 4.500 . 5.000 4.009 2.947 4.800 . 0 0 "[ . 1 . 2]" 1
32 1 12 LYS HA 1 12 LYS QD 4.500 . 5.000 3.273 2.108 4.272 . 0 0 "[ . 1 . 2]" 1
33 1 12 LYS HA 1 12 LYS HD3 4.500 . 5.000 3.550 2.146 4.791 . 0 0 "[ . 1 . 2]" 1
34 1 12 LYS HA 1 12 LYS QG 3.500 . 3.800 2.680 2.346 3.397 . 0 0 "[ . 1 . 2]" 1
35 1 12 LYS HA 1 13 PRO HD2 3.500 . 3.800 2.727 2.217 3.160 . 0 0 "[ . 1 . 2]" 1
36 1 12 LYS HA 1 13 PRO HD3 3.500 . 3.800 2.349 1.997 2.705 . 0 0 "[ . 1 . 2]" 1
37 1 12 LYS HB2 1 13 PRO HA 5.200 . 5.700 5.247 5.089 5.395 . 0 0 "[ . 1 . 2]" 1
38 1 12 LYS HB2 1 13 PRO HD3 4.500 . 5.000 4.790 3.879 5.338 0.338 7 0 "[ . 1 . 2]" 1
39 1 12 LYS HB3 1 12 LYS QD 2.500 . 2.800 2.397 2.309 2.487 . 0 0 "[ . 1 . 2]" 1
40 1 12 LYS HB3 1 12 LYS QE 4.500 . 5.000 3.809 2.185 4.211 . 0 0 "[ . 1 . 2]" 1
41 1 12 LYS HB3 1 13 PRO HD3 4.500 . 5.000 3.809 3.233 4.765 . 0 0 "[ . 1 . 2]" 1
42 1 13 PRO HA 1 14 SER H 3.500 . 3.800 2.280 2.136 2.433 . 0 0 "[ . 1 . 2]" 1
43 1 13 PRO QB 1 14 SER H 4.500 . 5.000 2.937 2.555 3.387 . 0 0 "[ . 1 . 2]" 1
44 1 14 SER HA 1 14 SER QB 2.500 . 2.800 2.326 2.163 2.467 . 0 0 "[ . 1 . 2]" 1
45 1 14 SER HA 1 15 LYS H 3.500 . 3.800 2.648 2.203 3.414 . 0 0 "[ . 1 . 2]" 1
46 1 14 SER QB 1 15 LYS H 4.500 . 5.000 3.170 2.042 4.057 . 0 0 "[ . 1 . 2]" 1
47 1 15 LYS H 1 15 LYS HG2 5.200 . 5.700 3.994 2.225 5.168 . 0 0 "[ . 1 . 2]" 1
48 1 15 LYS H 1 15 LYS QG 4.500 . 5.000 3.304 2.202 4.378 . 0 0 "[ . 1 . 2]" 1
49 1 15 LYS H 1 15 LYS HG3 5.200 . 5.700 3.757 2.362 4.813 . 0 0 "[ . 1 . 2]" 1
50 1 15 LYS HA 1 15 LYS HD2 5.200 . 5.700 4.335 2.292 5.597 . 0 0 "[ . 1 . 2]" 1
51 1 15 LYS HA 1 15 LYS HD3 5.200 . 5.700 4.186 2.062 4.856 . 0 0 "[ . 1 . 2]" 1
52 1 15 LYS HA 1 15 LYS HE2 5.200 . 5.700 4.406 2.400 5.317 . 0 0 "[ . 1 . 2]" 1
53 1 15 LYS HA 1 15 LYS QE 4.500 . 5.000 3.945 2.379 4.551 . 0 0 "[ . 1 . 2]" 1
54 1 15 LYS HA 1 15 LYS HE3 5.200 . 5.700 4.597 3.581 5.480 . 0 0 "[ . 1 . 2]" 1
55 1 15 LYS HA 1 15 LYS QG 3.500 . 3.800 2.551 2.305 3.406 . 0 0 "[ . 1 . 2]" 1
56 1 15 LYS HA 1 16 PRO HA 4.500 . 5.000 4.476 4.272 4.674 . 0 0 "[ . 1 . 2]" 1
57 1 15 LYS HA 1 16 PRO HD2 3.500 . 3.800 2.494 2.112 2.973 . 0 0 "[ . 1 . 2]" 1
58 1 15 LYS HA 1 16 PRO HD3 3.500 . 3.800 2.524 1.993 3.085 . 0 0 "[ . 1 . 2]" 1
59 1 15 LYS HA 1 16 PRO HG2 5.200 . 5.700 4.528 4.230 4.725 . 0 0 "[ . 1 . 2]" 1
60 1 15 LYS HA 1 16 PRO QG 4.500 . 5.000 4.038 3.795 4.233 . 0 0 "[ . 1 . 2]" 1
61 1 15 LYS HA 1 16 PRO HG3 5.200 . 5.700 4.573 4.048 4.808 . 0 0 "[ . 1 . 2]" 1
62 1 15 LYS QB 1 15 LYS QD 2.500 . 2.800 2.340 2.125 2.820 0.020 3 0 "[ . 1 . 2]" 1
63 1 15 LYS QB 1 15 LYS QE 3.500 . 3.800 2.613 2.006 3.712 . 0 0 "[ . 1 . 2]" 1
64 1 15 LYS QB 1 16 PRO QD 3.500 . 3.800 3.155 2.292 3.912 0.112 18 0 "[ . 1 . 2]" 1
65 1 15 LYS HB2 1 15 LYS HE2 4.500 . 5.000 3.701 2.099 4.809 . 0 0 "[ . 1 . 2]" 1
66 1 15 LYS HB2 1 15 LYS HE3 4.500 . 5.000 3.844 2.053 4.795 . 0 0 "[ . 1 . 2]" 1
67 1 15 LYS HB3 1 15 LYS HE2 4.500 . 5.000 3.484 2.091 4.875 . 0 0 "[ . 1 . 2]" 1
68 1 15 LYS HB3 1 15 LYS HE3 4.500 . 5.000 3.726 2.288 4.776 . 0 0 "[ . 1 . 2]" 1
69 1 15 LYS QE 1 16 PRO QD 4.500 . 5.000 4.400 2.767 5.197 0.197 4 0 "[ . 1 . 2]" 1
70 1 15 LYS QG 1 16 PRO QD 4.500 . 5.000 3.416 2.104 4.515 . 0 0 "[ . 1 . 2]" 1
71 1 16 PRO HA 1 17 LYS H 2.500 . 2.800 2.337 2.113 2.492 . 0 0 "[ . 1 . 2]" 1
72 1 16 PRO HA 1 17 LYS QD 5.200 . 5.700 5.072 2.974 5.718 0.018 3 0 "[ . 1 . 2]" 1
73 1 17 LYS H 1 17 LYS HB3 3.500 . 3.800 3.475 2.805 4.158 0.358 13 0 "[ . 1 . 2]" 1
74 1 17 LYS H 1 18 THR H 4.500 . 5.000 3.594 1.998 4.672 . 0 0 "[ . 1 . 2]" 1
75 1 17 LYS HA 1 17 LYS HD2 4.500 . 5.000 3.115 2.107 4.910 . 0 0 "[ . 1 . 2]" 1
76 1 17 LYS HA 1 17 LYS QD 4.500 . 5.000 2.761 2.075 4.273 . 0 0 "[ . 1 . 2]" 1
77 1 17 LYS HA 1 17 LYS HD3 4.500 . 5.000 3.545 2.269 4.776 . 0 0 "[ . 1 . 2]" 1
78 1 17 LYS HA 1 17 LYS HE2 5.200 . 5.700 4.676 3.036 5.459 . 0 0 "[ . 1 . 2]" 1
79 1 17 LYS HA 1 17 LYS HE3 5.200 . 5.700 4.594 3.901 5.491 . 0 0 "[ . 1 . 2]" 1
80 1 17 LYS HA 1 17 LYS QG 3.500 . 3.800 2.713 2.338 3.037 . 0 0 "[ . 1 . 2]" 1
81 1 17 LYS HA 1 18 THR H 3.500 . 3.800 2.709 2.192 3.609 . 0 0 "[ . 1 . 2]" 1
82 1 17 LYS HB2 1 17 LYS QD 3.500 . 3.800 2.717 2.239 3.565 . 0 0 "[ . 1 . 2]" 1
83 1 17 LYS HB2 1 17 LYS HE2 5.200 . 5.700 4.217 2.937 4.872 . 0 0 "[ . 1 . 2]" 1
84 1 17 LYS HB2 1 17 LYS QE 4.500 . 5.000 3.811 2.206 4.272 . 0 0 "[ . 1 . 2]" 1
85 1 17 LYS HB2 1 17 LYS HE3 5.200 . 5.700 4.494 2.266 5.118 . 0 0 "[ . 1 . 2]" 1
86 1 17 LYS HB2 1 18 THR H 4.500 . 5.000 3.984 1.907 4.660 . 0 0 "[ . 1 . 2]" 1
87 1 17 LYS HB3 1 17 LYS QD 3.500 . 3.800 2.919 2.310 3.380 . 0 0 "[ . 1 . 2]" 1
88 1 17 LYS HB3 1 17 LYS QE 4.500 . 5.000 3.682 2.147 4.301 . 0 0 "[ . 1 . 2]" 1
89 1 17 LYS HB3 1 18 THR H 4.500 . 5.000 3.515 2.193 4.484 . 0 0 "[ . 1 . 2]" 1
90 1 18 THR H 1 18 THR HB 3.500 . 3.800 3.368 2.573 3.863 0.063 12 0 "[ . 1 . 2]" 1
91 1 18 THR H 1 18 THR MG 4.500 . 5.000 3.222 2.392 4.019 . 0 0 "[ . 1 . 2]" 1
92 1 18 THR HA 1 18 THR MG 3.500 . 3.800 2.286 2.179 2.364 . 0 0 "[ . 1 . 2]" 1
93 1 18 THR HA 1 19 ASN H 3.500 . 3.800 2.614 2.104 3.599 . 0 0 "[ . 1 . 2]" 1
94 1 18 THR HB 1 19 ASN HA 4.500 . 5.000 4.517 4.115 4.855 . 0 0 "[ . 1 . 2]" 1
95 1 18 THR MG 1 19 ASN QB 5.200 . 5.700 5.056 4.334 5.850 0.150 19 0 "[ . 1 . 2]" 1
96 1 19 ASN H 1 19 ASN QB 3.500 . 3.800 2.712 2.283 3.419 . 0 0 "[ . 1 . 2]" 1
97 1 19 ASN H 1 19 ASN QD 4.500 . 5.000 4.166 1.947 4.913 . 0 0 "[ . 1 . 2]" 1
98 1 19 ASN H 1 20 MET QB 4.500 . 5.000 4.441 3.728 5.024 0.024 15 0 "[ . 1 . 2]" 1
99 1 19 ASN HA 1 19 ASN HD22 5.200 . 5.700 4.609 3.826 5.237 . 0 0 "[ . 1 . 2]" 1
100 1 19 ASN QB 1 20 MET QB 5.200 . 5.700 4.631 3.501 5.371 . 0 0 "[ . 1 . 2]" 1
101 1 20 MET H 1 20 MET QB 3.500 . 3.800 2.704 2.353 3.204 . 0 0 "[ . 1 . 2]" 1
102 1 20 MET H 1 20 MET HG2 5.200 . 5.700 4.174 2.052 5.230 . 0 0 "[ . 1 . 2]" 1
103 1 20 MET H 1 20 MET QG 4.500 . 5.000 3.623 2.026 4.358 . 0 0 "[ . 1 . 2]" 1
104 1 20 MET H 1 20 MET HG3 5.200 . 5.700 4.171 2.474 5.132 . 0 0 "[ . 1 . 2]" 1
105 1 20 MET H 1 21 LYS HA 4.500 . 5.000 4.686 4.020 5.018 0.018 1 0 "[ . 1 . 2]" 1
106 1 20 MET HA 1 20 MET ME 5.200 . 5.700 4.208 3.328 4.717 . 0 0 "[ . 1 . 2]" 1
107 1 20 MET HA 1 20 MET QG 3.500 . 3.800 2.553 2.261 3.378 . 0 0 "[ . 1 . 2]" 1
108 1 20 MET HA 1 21 LYS H 3.500 . 3.800 2.749 2.146 3.626 . 0 0 "[ . 1 . 2]" 1
109 1 20 MET QB 1 20 MET ME 3.500 . 3.800 2.609 2.181 3.723 . 0 0 "[ . 1 . 2]" 1
110 1 21 LYS H 1 21 LYS QB 3.500 . 3.800 2.598 2.000 3.365 . 0 0 "[ . 1 . 2]" 1
111 1 21 LYS H 1 21 LYS HG2 5.200 . 5.700 4.038 2.487 5.083 . 0 0 "[ . 1 . 2]" 1
112 1 21 LYS H 1 21 LYS QG 4.500 . 5.000 3.622 1.960 4.305 . 0 0 "[ . 1 . 2]" 1
113 1 21 LYS H 1 21 LYS HG3 5.200 . 5.700 4.354 1.981 5.247 . 0 0 "[ . 1 . 2]" 1
114 1 21 LYS HA 1 21 LYS QB 2.500 . 2.800 2.417 2.130 2.558 . 0 0 "[ . 1 . 2]" 1
115 1 21 LYS HA 1 21 LYS QD 3.500 . 3.800 2.655 2.113 3.890 0.090 17 0 "[ . 1 . 2]" 1
116 1 21 LYS HA 1 21 LYS HE2 5.200 . 5.700 4.820 4.483 5.751 0.051 5 0 "[ . 1 . 2]" 1
117 1 21 LYS HA 1 21 LYS QE 4.500 . 5.000 4.084 3.213 4.830 . 0 0 "[ . 1 . 2]" 1
118 1 21 LYS HA 1 21 LYS HE3 5.200 . 5.700 4.516 3.287 5.717 0.017 19 0 "[ . 1 . 2]" 1
119 1 21 LYS HA 1 21 LYS QG 3.500 . 3.800 2.750 2.281 3.487 . 0 0 "[ . 1 . 2]" 1
120 1 21 LYS QB 1 21 LYS QD 2.500 . 2.800 2.386 2.131 2.864 0.064 8 0 "[ . 1 . 2]" 1
121 1 21 LYS QB 1 21 LYS QE 3.500 . 3.800 3.330 2.185 3.843 0.043 15 0 "[ . 1 . 2]" 1
122 1 21 LYS QD 1 22 HIS H 4.500 . 5.000 3.631 2.076 5.006 0.006 17 0 "[ . 1 . 2]" 1
123 1 21 LYS QE 1 22 HIS H 4.500 . 5.000 4.361 3.306 5.057 0.057 12 0 "[ . 1 . 2]" 1
124 1 21 LYS HE2 1 22 HIS H 5.200 . 5.700 5.247 4.533 5.747 0.047 12 0 "[ . 1 . 2]" 1
125 1 21 LYS HE3 1 22 HIS H 5.200 . 5.700 4.840 3.358 5.728 0.028 15 0 "[ . 1 . 2]" 1
126 1 22 HIS H 1 22 HIS QB 3.500 . 3.800 2.690 2.232 3.468 . 0 0 "[ . 1 . 2]" 1
127 1 22 HIS HA 1 22 HIS QB 2.500 . 2.800 2.414 2.180 2.516 . 0 0 "[ . 1 . 2]" 1
128 1 22 HIS HA 1 22 HIS HD2 4.500 . 5.000 3.590 2.252 4.794 . 0 0 "[ . 1 . 2]" 1
129 1 22 HIS HA 1 23 MET QG 4.500 . 5.000 4.051 3.537 4.883 . 0 0 "[ . 1 . 2]" 1
130 1 22 HIS QB 1 23 MET HA 4.500 . 5.000 4.285 3.878 4.709 . 0 0 "[ . 1 . 2]" 1
131 1 22 HIS QB 1 23 MET QG 4.500 . 5.000 4.399 2.696 5.094 0.094 1 0 "[ . 1 . 2]" 1
132 1 23 MET HA 1 23 MET QB 2.500 . 2.800 2.304 2.162 2.409 . 0 0 "[ . 1 . 2]" 1
133 1 23 MET HA 1 23 MET ME 5.200 . 5.700 4.381 2.988 5.485 . 0 0 "[ . 1 . 2]" 1
134 1 23 MET HA 1 23 MET QG 3.500 . 3.800 2.862 2.386 3.499 . 0 0 "[ . 1 . 2]" 1
135 1 23 MET HA 1 24 ALA H 3.500 . 3.800 2.686 2.188 3.562 . 0 0 "[ . 1 . 2]" 1
136 1 23 MET QB 1 23 MET ME 3.500 . 3.800 2.570 2.155 3.604 . 0 0 "[ . 1 . 2]" 1
137 1 23 MET QB 1 24 ALA H 4.500 . 5.000 3.033 2.099 3.939 . 0 0 "[ . 1 . 2]" 1
138 1 24 ALA HA 1 25 GLY H 3.500 . 3.800 2.804 2.119 3.613 . 0 0 "[ . 1 . 2]" 1
139 1 24 ALA HA 1 25 GLY HA2 5.200 . 5.700 4.728 4.410 5.231 . 0 0 "[ . 1 . 2]" 1
140 1 24 ALA MB 1 25 GLY H 4.500 . 5.000 2.768 2.187 3.759 . 0 0 "[ . 1 . 2]" 1
141 1 26 ALA HA 1 27 ALA H 2.500 . 2.800 2.420 2.171 2.825 0.025 3 0 "[ . 1 . 2]" 1
142 1 26 ALA MB 1 27 ALA H 3.500 . 3.800 2.745 1.883 3.793 . 0 0 "[ . 1 . 2]" 1
143 1 27 ALA HA 1 28 ALA H 3.500 . 3.800 2.656 2.174 3.570 . 0 0 "[ . 1 . 2]" 1
144 1 27 ALA MB 1 28 ALA H 3.500 . 3.800 2.669 1.927 3.667 . 0 0 "[ . 1 . 2]" 1
145 1 28 ALA HA 1 29 ALA H 2.500 . 2.800 2.427 2.149 2.841 0.041 8 0 "[ . 1 . 2]" 1
146 1 28 ALA MB 1 29 ALA H 3.500 . 3.800 3.053 2.439 3.769 . 0 0 "[ . 1 . 2]" 1
147 1 29 ALA HA 1 30 GLY H 3.500 . 3.800 2.663 2.078 3.587 . 0 0 "[ . 1 . 2]" 1
148 1 29 ALA HA 1 30 GLY HA3 5.200 . 5.700 4.525 4.344 4.916 . 0 0 "[ . 1 . 2]" 1
149 1 29 ALA MB 1 30 GLY H 3.500 . 3.800 2.810 1.982 3.633 . 0 0 "[ . 1 . 2]" 1
150 1 30 GLY H 1 31 ALA H 3.500 . 3.800 2.912 2.199 3.752 . 0 0 "[ . 1 . 2]" 1
151 1 30 GLY HA2 1 31 ALA H 2.500 . 2.800 2.603 2.123 2.859 0.059 6 0 "[ . 1 . 2]" 1
152 1 30 GLY HA2 1 31 ALA HA 4.500 . 5.000 4.577 4.329 4.708 . 0 0 "[ . 1 . 2]" 1
153 1 30 GLY HA2 1 32 VAL H 4.500 . 5.000 3.612 3.105 4.757 . 0 0 "[ . 1 . 2]" 1
154 1 30 GLY HA2 1 32 VAL MG2 3.500 . 3.800 3.393 2.596 4.143 0.343 12 0 "[ . 1 . 2]" 1
155 1 30 GLY HA3 1 31 ALA HA 5.200 . 5.700 4.687 4.473 5.355 . 0 0 "[ . 1 . 2]" 1
156 1 30 GLY HA3 1 32 VAL H 5.200 . 5.700 4.238 3.463 4.975 . 0 0 "[ . 1 . 2]" 1
157 1 31 ALA H 1 31 ALA MB 2.500 . 2.800 2.366 2.210 2.893 0.093 13 0 "[ . 1 . 2]" 1
158 1 31 ALA H 1 32 VAL HB 5.200 . 5.700 5.343 4.382 5.725 0.025 16 0 "[ . 1 . 2]" 1
159 1 31 ALA H 1 32 VAL MG2 4.500 . 5.000 3.408 2.505 3.925 . 0 0 "[ . 1 . 2]" 1
160 1 31 ALA HA 1 32 VAL H 3.500 . 3.800 3.066 2.707 3.583 . 0 0 "[ . 1 . 2]" 1
161 1 31 ALA HA 1 32 VAL HB 5.200 . 5.700 5.399 4.721 5.709 0.009 2 0 "[ . 1 . 2]" 1
162 1 31 ALA HA 1 32 VAL MG2 4.500 . 5.000 4.381 3.870 4.699 . 0 0 "[ . 1 . 2]" 1
163 1 31 ALA HA 1 33 VAL H 4.500 . 5.000 4.192 3.604 4.617 . 0 0 "[ . 1 . 2]" 1
164 1 31 ALA HA 1 33 VAL HB 5.200 . 5.700 4.636 3.822 5.711 0.011 10 0 "[ . 1 . 2]" 1
165 1 31 ALA HA 1 33 VAL MG2 5.200 . 5.700 3.665 2.716 5.747 0.047 18 0 "[ . 1 . 2]" 1
166 1 31 ALA MB 1 32 VAL H 3.500 . 3.800 3.421 2.145 3.778 . 0 0 "[ . 1 . 2]" 1
167 1 31 ALA MB 1 32 VAL MG2 4.500 . 5.000 3.948 3.471 4.306 . 0 0 "[ . 1 . 2]" 1
168 1 32 VAL H 1 32 VAL HB 3.500 . 3.800 2.883 2.556 3.811 0.011 13 0 "[ . 1 . 2]" 1
169 1 32 VAL H 1 32 VAL MG2 2.500 . 2.800 2.308 1.958 2.746 . 0 0 "[ . 1 . 2]" 1
170 1 32 VAL H 1 33 VAL H 3.500 . 3.800 3.535 2.692 3.850 0.050 11 0 "[ . 1 . 2]" 1
171 1 32 VAL HA 1 32 VAL MG1 3.500 . 3.800 2.338 2.254 2.391 . 0 0 "[ . 1 . 2]" 1
172 1 32 VAL HA 1 32 VAL MG2 2.500 . 2.800 2.509 2.438 2.659 . 0 0 "[ . 1 . 2]" 1
173 1 32 VAL HA 1 33 VAL H 2.500 . 2.800 2.473 2.243 2.829 0.029 10 0 "[ . 1 . 2]" 1
174 1 33 VAL H 1 33 VAL HB 3.500 . 3.800 2.717 2.393 2.993 . 0 0 "[ . 1 . 2]" 1
175 1 33 VAL H 1 33 VAL MG2 3.500 . 3.800 2.973 2.328 3.853 0.053 11 0 "[ . 1 . 2]" 1
176 1 33 VAL H 1 34 GLY H 4.500 . 5.000 4.270 3.483 4.619 . 0 0 "[ . 1 . 2]" 1
177 1 33 VAL HA 1 33 VAL MG1 3.500 . 3.800 2.578 2.342 3.282 . 0 0 "[ . 1 . 2]" 1
178 1 33 VAL HA 1 33 VAL MG2 2.500 . 2.800 2.430 2.346 2.490 . 0 0 "[ . 1 . 2]" 1
179 1 33 VAL HA 1 34 GLY H 2.500 . 2.800 2.226 2.145 2.372 . 0 0 "[ . 1 . 2]" 1
180 1 33 VAL HB 1 34 GLY H 4.500 . 5.000 4.263 3.883 4.610 . 0 0 "[ . 1 . 2]" 1
181 1 33 VAL MG1 1 35 GLY H 4.500 . 5.000 3.524 1.964 5.178 0.178 12 0 "[ . 1 . 2]" 1
182 1 33 VAL MG2 1 34 GLY H 4.500 . 5.000 3.961 2.585 4.378 . 0 0 "[ . 1 . 2]" 1
183 1 34 GLY H 1 35 GLY H 3.500 . 3.800 2.721 2.114 3.856 0.056 12 0 "[ . 1 . 2]" 1
184 1 34 GLY HA2 1 35 GLY H 3.500 . 3.800 3.147 2.120 3.598 . 0 0 "[ . 1 . 2]" 1
185 1 35 GLY HA2 1 36 LEU H 2.500 . 2.800 2.652 2.452 2.999 0.199 12 0 "[ . 1 . 2]" 1
186 1 35 GLY HA2 1 36 LEU HA 5.200 . 5.700 4.372 4.248 4.552 . 0 0 "[ . 1 . 2]" 1
187 1 35 GLY HA2 1 36 LEU HB2 5.200 . 5.700 4.371 3.956 4.835 . 0 0 "[ . 1 . 2]" 1
188 1 35 GLY HA2 1 36 LEU HB3 5.200 . 5.700 5.617 5.011 5.934 0.234 12 0 "[ . 1 . 2]" 1
189 1 35 GLY HA2 1 36 LEU MD1 5.200 . 5.700 5.084 3.376 5.828 0.128 2 0 "[ . 1 . 2]" 1
190 1 35 GLY HA2 1 36 LEU MD2 5.200 . 5.700 3.611 2.687 5.032 . 0 0 "[ . 1 . 2]" 1
191 1 35 GLY HA3 1 36 LEU HA 4.500 . 5.000 4.473 4.321 4.629 . 0 0 "[ . 1 . 2]" 1
192 1 35 GLY HA3 1 36 LEU HB2 5.200 . 5.700 4.518 3.626 4.754 . 0 0 "[ . 1 . 2]" 1
193 1 35 GLY HA3 1 36 LEU HB3 5.200 . 5.700 5.598 4.952 5.810 0.110 19 0 "[ . 1 . 2]" 1
194 1 35 GLY HA3 1 36 LEU MD1 5.200 . 5.700 5.527 4.326 5.982 0.282 4 0 "[ . 1 . 2]" 1
195 1 35 GLY HA3 1 36 LEU MD2 4.500 . 5.000 4.393 3.713 5.696 0.696 15 1 "[ . 1 + 2]" 1
196 1 36 LEU H 1 36 LEU HB2 2.500 . 2.800 2.305 1.975 2.849 0.049 2 0 "[ . 1 . 2]" 1
197 1 36 LEU H 1 36 LEU MD1 4.500 . 5.000 4.044 3.180 4.381 . 0 0 "[ . 1 . 2]" 1
198 1 36 LEU H 1 37 GLY H 3.500 . 3.800 2.704 2.015 3.816 0.016 11 0 "[ . 1 . 2]" 1
199 1 36 LEU H 1 73 TYR QE 4.500 . 5.000 4.194 3.672 5.008 0.008 19 0 "[ . 1 . 2]" 1
200 1 36 LEU HA 1 36 LEU MD1 3.500 . 3.800 2.101 1.964 2.304 . 0 0 "[ . 1 . 2]" 1
201 1 36 LEU HA 1 36 LEU MD2 3.500 . 3.800 2.734 2.258 3.546 . 0 0 "[ . 1 . 2]" 1
202 1 36 LEU HA 1 36 LEU HG 3.500 . 3.800 3.683 3.595 3.775 . 0 0 "[ . 1 . 2]" 1
203 1 36 LEU HA 1 37 GLY H 3.500 . 3.800 3.116 2.225 3.568 . 0 0 "[ . 1 . 2]" 1
204 1 36 LEU HA 1 37 GLY HA2 4.500 . 5.000 4.936 4.464 5.296 0.296 19 0 "[ . 1 . 2]" 1
205 1 36 LEU HA 1 38 GLY H 5.200 . 5.700 5.036 3.726 5.878 0.178 12 0 "[ . 1 . 2]" 1
206 1 36 LEU HA 1 39 TYR QD 4.500 . 5.000 4.365 3.091 4.695 . 0 0 "[ . 1 . 2]" 1
207 1 36 LEU HA 1 93 ILE MD 5.200 . 5.700 5.305 4.652 5.766 0.066 2 0 "[ . 1 . 2]" 1
208 1 36 LEU HA 1 93 ILE MG 5.200 . 5.700 4.918 4.664 5.224 . 0 0 "[ . 1 . 2]" 1
209 1 36 LEU HB2 1 37 GLY H 4.500 . 5.000 3.960 2.881 4.514 . 0 0 "[ . 1 . 2]" 1
210 1 36 LEU HB2 1 39 TYR H 4.500 . 5.000 4.545 4.196 5.026 0.026 15 0 "[ . 1 . 2]" 1
211 1 36 LEU HB2 1 73 TYR QE 4.500 . 5.000 2.562 2.122 2.936 . 0 0 "[ . 1 . 2]" 1
212 1 36 LEU HB3 1 36 LEU HG 2.500 . 2.800 2.329 2.203 2.457 . 0 0 "[ . 1 . 2]" 1
213 1 36 LEU HB3 1 37 GLY HA2 5.200 . 5.700 5.401 4.917 5.653 . 0 0 "[ . 1 . 2]" 1
214 1 36 LEU HB3 1 39 TYR HB2 4.500 . 5.000 2.565 2.197 2.903 . 0 0 "[ . 1 . 2]" 1
215 1 36 LEU HB3 1 39 TYR QD 3.500 . 3.800 2.419 2.236 2.653 . 0 0 "[ . 1 . 2]" 1
216 1 36 LEU HB3 1 39 TYR QE 4.500 . 5.000 3.743 3.413 4.274 . 0 0 "[ . 1 . 2]" 1
217 1 36 LEU MD1 1 37 GLY H 4.500 . 5.000 4.596 3.991 4.909 . 0 0 "[ . 1 . 2]" 1
218 1 36 LEU MD1 1 39 TYR HB2 4.500 . 5.000 4.586 4.234 4.994 . 0 0 "[ . 1 . 2]" 1
219 1 36 LEU MD1 1 73 TYR QE 4.500 . 5.000 4.492 4.318 4.731 . 0 0 "[ . 1 . 2]" 1
220 1 36 LEU MD1 1 93 ILE MG 4.500 . 5.000 2.477 2.095 3.094 . 0 0 "[ . 1 . 2]" 1
221 1 36 LEU MD1 1 96 LYS HA 4.500 . 5.000 5.003 4.823 5.079 0.079 11 0 "[ . 1 . 2]" 1
222 1 36 LEU MD1 1 96 LYS HB3 4.500 . 5.000 3.011 2.704 3.159 . 0 0 "[ . 1 . 2]" 1
223 1 36 LEU MD1 1 97 GLN HB2 4.500 . 5.000 4.532 3.921 5.044 0.044 18 0 "[ . 1 . 2]" 1
224 1 36 LEU MD2 1 39 TYR HB2 4.500 . 5.000 4.290 3.911 4.649 . 0 0 "[ . 1 . 2]" 1
225 1 36 LEU MD2 1 73 TYR QD 4.500 . 5.000 4.164 3.588 4.649 . 0 0 "[ . 1 . 2]" 1
226 1 36 LEU MD2 1 73 TYR QE 4.500 . 5.000 2.644 2.199 3.205 . 0 0 "[ . 1 . 2]" 1
227 1 36 LEU MD2 1 93 ILE MG 4.500 . 5.000 2.843 2.230 3.310 . 0 0 "[ . 1 . 2]" 1
228 1 36 LEU MD2 1 96 LYS HB3 4.500 . 5.000 3.241 2.916 3.692 . 0 0 "[ . 1 . 2]" 1
229 1 36 LEU MD2 1 97 GLN HB2 4.500 . 5.000 2.387 2.052 2.944 . 0 0 "[ . 1 . 2]" 1
230 1 36 LEU HG 1 73 TYR QE 3.500 . 3.800 3.182 2.849 3.832 0.032 15 0 "[ . 1 . 2]" 1
231 1 36 LEU HG 1 93 ILE HG12 5.200 . 5.700 5.731 5.685 5.803 0.103 4 0 "[ . 1 . 2]" 1
232 1 36 LEU HG 1 93 ILE MG 4.500 . 5.000 1.997 1.927 2.184 . 0 0 "[ . 1 . 2]" 1
233 1 37 GLY H 1 38 GLY H 4.500 . 5.000 3.154 2.518 4.524 . 0 0 "[ . 1 . 2]" 1
234 1 37 GLY H 1 39 TYR H 4.500 . 5.000 4.560 3.789 5.006 0.006 7 0 "[ . 1 . 2]" 1
235 1 38 GLY H 1 39 TYR H 3.500 . 3.800 2.752 1.965 3.815 0.015 10 0 "[ . 1 . 2]" 1
236 1 38 GLY H 1 39 TYR HB2 4.500 . 5.000 4.139 3.261 5.002 0.002 10 0 "[ . 1 . 2]" 1
237 1 38 GLY HA2 1 39 TYR HA 4.500 . 5.000 4.466 4.408 4.509 . 0 0 "[ . 1 . 2]" 1
238 1 38 GLY HA2 1 39 TYR QD 4.500 . 5.000 4.385 4.176 4.695 . 0 0 "[ . 1 . 2]" 1
239 1 38 GLY HA3 1 39 TYR HB2 5.200 . 5.700 5.314 5.143 5.466 . 0 0 "[ . 1 . 2]" 1
240 1 38 GLY HA3 1 39 TYR QD 4.500 . 5.000 3.825 3.467 4.113 . 0 0 "[ . 1 . 2]" 1
241 1 39 TYR H 1 39 TYR HB2 3.500 . 3.800 2.584 2.439 2.679 . 0 0 "[ . 1 . 2]" 1
242 1 39 TYR H 1 40 MET H 4.500 . 5.000 4.444 4.405 4.487 . 0 0 "[ . 1 . 2]" 1
243 1 39 TYR H 1 40 MET HB3 5.200 . 5.700 5.524 5.386 5.702 0.002 14 0 "[ . 1 . 2]" 1
244 1 39 TYR HA 1 40 MET H 3.500 . 3.800 2.372 2.331 2.443 . 0 0 "[ . 1 . 2]" 1
245 1 39 TYR HA 1 40 MET HG2 4.500 . 5.000 3.948 3.785 4.106 . 0 0 "[ . 1 . 2]" 1
246 1 39 TYR HA 1 73 TYR QD 4.500 . 5.000 4.392 4.209 4.493 . 0 0 "[ . 1 . 2]" 1
247 1 39 TYR HB2 1 39 TYR QE 4.500 . 5.000 4.509 4.489 4.534 . 0 0 "[ . 1 . 2]" 1
248 1 39 TYR HB2 1 40 MET H 3.500 . 3.800 3.766 3.529 3.903 0.103 12 0 "[ . 1 . 2]" 1
249 1 39 TYR HB2 1 73 TYR QD 4.500 . 5.000 3.223 2.786 3.527 . 0 0 "[ . 1 . 2]" 1
250 1 39 TYR HB2 1 73 TYR QE 3.500 . 3.800 3.015 2.664 3.415 . 0 0 "[ . 1 . 2]" 1
251 1 39 TYR HB2 1 93 ILE MD 5.200 . 5.700 5.571 5.300 5.780 0.080 12 0 "[ . 1 . 2]" 1
252 1 39 TYR HB2 1 93 ILE MG 4.500 . 5.000 4.050 3.805 4.324 . 0 0 "[ . 1 . 2]" 1
253 1 39 TYR HB3 1 39 TYR QE 4.500 . 5.000 4.433 4.415 4.473 . 0 0 "[ . 1 . 2]" 1
254 1 39 TYR HB3 1 93 ILE MG 5.200 . 5.700 3.621 3.488 3.801 . 0 0 "[ . 1 . 2]" 1
255 1 39 TYR QD 1 40 MET H 4.500 . 5.000 3.277 2.907 3.609 . 0 0 "[ . 1 . 2]" 1
256 1 39 TYR QD 1 73 TYR HA 4.500 . 5.000 5.017 4.692 5.098 0.098 20 0 "[ . 1 . 2]" 1
257 1 39 TYR QD 1 73 TYR HB2 4.500 . 5.000 4.193 3.987 4.303 . 0 0 "[ . 1 . 2]" 1
258 1 39 TYR QD 1 73 TYR HB3 3.500 . 3.800 2.786 2.532 2.928 . 0 0 "[ . 1 . 2]" 1
259 1 39 TYR QD 1 75 ARG HG3 4.500 . 5.000 4.295 3.241 5.578 0.578 12 1 "[ . 1 + . 2]" 1
260 1 39 TYR QD 1 93 ILE HG13 4.500 . 5.000 3.863 3.510 4.192 . 0 0 "[ . 1 . 2]" 1
261 1 39 TYR QD 1 93 ILE MG 3.500 . 3.800 2.683 2.385 2.878 . 0 0 "[ . 1 . 2]" 1
262 1 39 TYR QE 1 73 TYR HB3 4.500 . 5.000 4.307 3.750 4.594 . 0 0 "[ . 1 . 2]" 1
263 1 39 TYR QE 1 75 ARG QD 3.500 . 3.800 2.563 2.005 3.438 . 0 0 "[ . 1 . 2]" 1
264 1 39 TYR QE 1 75 ARG HG2 4.500 . 5.000 2.492 1.973 2.965 . 0 0 "[ . 1 . 2]" 1
265 1 39 TYR QE 1 75 ARG HG3 3.500 . 3.800 2.719 2.045 3.807 0.007 12 0 "[ . 1 . 2]" 1
266 1 39 TYR QE 1 93 ILE HA 5.200 . 5.700 5.432 5.238 5.551 . 0 0 "[ . 1 . 2]" 1
267 1 39 TYR QE 1 93 ILE HB 4.500 . 5.000 3.881 3.376 4.058 . 0 0 "[ . 1 . 2]" 1
268 1 39 TYR QE 1 93 ILE MD 3.500 . 3.800 3.065 2.889 3.232 . 0 0 "[ . 1 . 2]" 1
269 1 39 TYR QE 1 93 ILE HG12 4.500 . 5.000 3.819 3.643 3.987 . 0 0 "[ . 1 . 2]" 1
270 1 39 TYR QE 1 93 ILE HG13 3.500 . 3.800 2.174 2.022 2.330 . 0 0 "[ . 1 . 2]" 1
271 1 39 TYR QE 1 93 ILE MG 3.500 . 3.800 2.800 2.522 3.038 . 0 0 "[ . 1 . 2]" 1
272 1 40 MET H 1 40 MET HG3 4.500 . 5.000 2.934 2.783 3.075 . 0 0 "[ . 1 . 2]" 1
273 1 40 MET H 1 41 LEU H 4.500 . 5.000 4.441 4.383 4.483 . 0 0 "[ . 1 . 2]" 1
274 1 40 MET H 1 73 TYR HB3 4.500 . 5.000 4.102 3.867 4.358 . 0 0 "[ . 1 . 2]" 1
275 1 40 MET H 1 73 TYR QE 4.500 . 5.000 4.925 4.668 5.028 0.028 11 0 "[ . 1 . 2]" 1
276 1 40 MET H 1 74 TYR H 4.500 . 5.000 3.205 2.895 3.575 . 0 0 "[ . 1 . 2]" 1
277 1 40 MET HA 1 40 MET ME 4.500 . 5.000 4.241 4.195 4.303 . 0 0 "[ . 1 . 2]" 1
278 1 40 MET HA 1 40 MET HG3 3.500 . 3.800 3.698 3.625 3.755 . 0 0 "[ . 1 . 2]" 1
279 1 40 MET HA 1 41 LEU H 3.500 . 3.800 2.446 2.369 2.496 . 0 0 "[ . 1 . 2]" 1
280 1 40 MET HA 1 41 LEU MD1 4.500 . 5.000 4.757 4.356 5.001 0.001 3 0 "[ . 1 . 2]" 1
281 1 40 MET HA 1 73 TYR QE 5.200 . 5.700 5.239 4.897 5.466 . 0 0 "[ . 1 . 2]" 1
282 1 40 MET HB2 1 40 MET ME 3.500 . 3.800 2.220 2.162 2.291 . 0 0 "[ . 1 . 2]" 1
283 1 40 MET HB2 1 41 LEU H 3.500 . 3.800 2.344 2.273 2.428 . 0 0 "[ . 1 . 2]" 1
284 1 40 MET HB3 1 40 MET ME 4.500 . 5.000 3.467 3.397 3.579 . 0 0 "[ . 1 . 2]" 1
285 1 40 MET HB3 1 41 LEU H 4.500 . 5.000 3.759 3.712 3.821 . 0 0 "[ . 1 . 2]" 1
286 1 40 MET ME 1 40 MET HG3 2.500 . 2.800 2.402 2.314 2.481 . 0 0 "[ . 1 . 2]" 1
287 1 40 MET ME 1 41 LEU H 4.500 . 5.000 3.160 3.069 3.300 . 0 0 "[ . 1 . 2]" 1
288 1 40 MET ME 1 41 LEU HB2 4.500 . 5.000 5.016 4.928 5.112 0.112 12 0 "[ . 1 . 2]" 1
289 1 40 MET ME 1 41 LEU HB3 5.200 . 5.700 5.112 4.939 5.312 . 0 0 "[ . 1 . 2]" 1
290 1 40 MET ME 1 73 TYR HA 4.500 . 5.000 4.954 4.502 5.180 0.180 12 0 "[ . 1 . 2]" 1
291 1 40 MET ME 1 74 TYR HB2 4.500 . 5.000 2.876 2.339 3.754 . 0 0 "[ . 1 . 2]" 1
292 1 40 MET ME 1 74 TYR HB3 4.500 . 5.000 4.060 3.576 4.717 . 0 0 "[ . 1 . 2]" 1
293 1 40 MET ME 1 74 TYR QD 3.500 . 3.800 2.440 2.049 2.781 . 0 0 "[ . 1 . 2]" 1
294 1 40 MET ME 1 74 TYR QE 4.500 . 5.000 3.800 2.466 4.465 . 0 0 "[ . 1 . 2]" 1
295 1 40 MET HG3 1 41 LEU H 4.500 . 5.000 3.542 3.378 3.746 . 0 0 "[ . 1 . 2]" 1
296 1 40 MET HG3 1 41 LEU HA 4.500 . 5.000 3.908 3.776 4.049 . 0 0 "[ . 1 . 2]" 1
297 1 40 MET HG3 1 73 TYR HA 4.500 . 5.000 4.297 4.094 4.533 . 0 0 "[ . 1 . 2]" 1
298 1 40 MET HG3 1 74 TYR HB2 4.500 . 5.000 2.338 2.143 2.580 . 0 0 "[ . 1 . 2]" 1
299 1 40 MET HG3 1 74 TYR HB3 4.500 . 5.000 3.976 3.688 4.327 . 0 0 "[ . 1 . 2]" 1
300 1 41 LEU H 1 41 LEU HB2 3.500 . 3.800 2.442 2.386 2.575 . 0 0 "[ . 1 . 2]" 1
301 1 41 LEU H 1 41 LEU HB3 3.500 . 3.800 3.406 3.298 3.525 . 0 0 "[ . 1 . 2]" 1
302 1 41 LEU H 1 41 LEU MD1 4.500 . 5.000 4.118 3.930 4.228 . 0 0 "[ . 1 . 2]" 1
303 1 41 LEU H 1 41 LEU MD2 4.500 . 5.000 4.544 4.509 4.629 . 0 0 "[ . 1 . 2]" 1
304 1 41 LEU H 1 41 LEU HG 4.500 . 5.000 4.042 3.904 4.183 . 0 0 "[ . 1 . 2]" 1
305 1 41 LEU H 1 42 GLY H 4.500 . 5.000 4.447 4.407 4.498 . 0 0 "[ . 1 . 2]" 1
306 1 41 LEU HA 1 41 LEU MD1 4.500 . 5.000 3.767 3.712 3.799 . 0 0 "[ . 1 . 2]" 1
307 1 41 LEU HA 1 41 LEU MD2 3.500 . 3.800 2.459 2.338 2.546 . 0 0 "[ . 1 . 2]" 1
308 1 41 LEU HA 1 42 GLY HA3 4.500 . 5.000 4.400 4.370 4.426 . 0 0 "[ . 1 . 2]" 1
309 1 41 LEU HA 1 73 TYR HA 4.500 . 5.000 2.058 1.935 2.195 . 0 0 "[ . 1 . 2]" 1
310 1 41 LEU HA 1 73 TYR QD 5.200 . 5.700 4.107 3.980 4.291 . 0 0 "[ . 1 . 2]" 1
311 1 41 LEU HA 1 74 TYR H 4.500 . 5.000 3.784 3.457 4.176 . 0 0 "[ . 1 . 2]" 1
312 1 41 LEU HA 1 74 TYR QD 4.500 . 5.000 3.476 3.167 3.683 . 0 0 "[ . 1 . 2]" 1
313 1 41 LEU HB2 1 42 GLY H 4.500 . 5.000 4.252 4.046 4.367 . 0 0 "[ . 1 . 2]" 1
314 1 41 LEU HB2 1 73 TYR HA 4.500 . 5.000 4.696 4.570 4.896 . 0 0 "[ . 1 . 2]" 1
315 1 41 LEU HB3 1 71 GLN HB2 5.200 . 5.700 5.066 4.662 5.425 . 0 0 "[ . 1 . 2]" 1
316 1 41 LEU HB3 1 71 GLN HE21 4.500 . 5.000 3.910 3.491 4.144 . 0 0 "[ . 1 . 2]" 1
317 1 41 LEU HB3 1 73 TYR HA 5.200 . 5.700 4.617 4.426 4.768 . 0 0 "[ . 1 . 2]" 1
318 1 41 LEU HB3 1 73 TYR QE 5.200 . 5.700 5.606 5.536 5.728 0.028 4 0 "[ . 1 . 2]" 1
319 1 41 LEU MD1 1 71 GLN HB2 4.500 . 5.000 4.471 4.224 4.836 . 0 0 "[ . 1 . 2]" 1
320 1 41 LEU MD1 1 71 GLN HB3 4.500 . 5.000 4.663 4.432 4.994 . 0 0 "[ . 1 . 2]" 1
321 1 41 LEU MD1 1 71 GLN HE21 4.500 . 5.000 4.801 4.511 5.034 0.034 17 0 "[ . 1 . 2]" 1
322 1 41 LEU MD1 1 73 TYR HA 4.500 . 5.000 4.553 4.461 4.697 . 0 0 "[ . 1 . 2]" 1
323 1 41 LEU MD1 1 73 TYR HB3 5.200 . 5.700 5.715 5.657 5.751 0.051 20 0 "[ . 1 . 2]" 1
324 1 41 LEU MD1 1 73 TYR QE 3.500 . 3.800 2.757 2.594 2.999 . 0 0 "[ . 1 . 2]" 1
325 1 41 LEU MD2 1 42 GLY H 4.500 . 5.000 2.468 2.073 2.751 . 0 0 "[ . 1 . 2]" 1
326 1 41 LEU MD2 1 42 GLY HA2 4.500 . 5.000 4.788 4.464 5.029 0.029 9 0 "[ . 1 . 2]" 1
327 1 41 LEU MD2 1 71 GLN HB2 3.500 . 3.800 2.730 2.588 2.995 . 0 0 "[ . 1 . 2]" 1
328 1 41 LEU MD2 1 71 GLN HB3 4.500 . 5.000 2.548 2.267 2.879 . 0 0 "[ . 1 . 2]" 1
329 1 41 LEU MD2 1 71 GLN HE21 4.500 . 5.000 3.372 2.962 3.668 . 0 0 "[ . 1 . 2]" 1
330 1 41 LEU MD2 1 71 GLN HE22 4.500 . 5.000 3.708 3.267 4.032 . 0 0 "[ . 1 . 2]" 1
331 1 41 LEU MD2 1 72 VAL HB 5.200 . 5.700 4.902 4.812 5.028 . 0 0 "[ . 1 . 2]" 1
332 1 41 LEU MD2 1 72 VAL MG1 4.500 . 5.000 4.626 4.492 4.748 . 0 0 "[ . 1 . 2]" 1
333 1 41 LEU MD2 1 73 TYR HA 4.500 . 5.000 2.934 2.664 3.278 . 0 0 "[ . 1 . 2]" 1
334 1 41 LEU MD2 1 73 TYR HB2 5.200 . 5.700 4.611 4.451 4.785 . 0 0 "[ . 1 . 2]" 1
335 1 41 LEU MD2 1 73 TYR HB3 5.200 . 5.700 4.852 4.664 5.047 . 0 0 "[ . 1 . 2]" 1
336 1 41 LEU MD2 1 73 TYR QD 4.500 . 5.000 2.739 2.556 3.067 . 0 0 "[ . 1 . 2]" 1
337 1 41 LEU MD2 1 73 TYR QE 3.500 . 3.800 2.815 2.614 3.059 . 0 0 "[ . 1 . 2]" 1
338 1 41 LEU MD2 1 74 TYR QE 4.500 . 5.000 4.848 4.539 5.209 0.209 12 0 "[ . 1 . 2]" 1
339 1 41 LEU MD2 1 93 ILE MG 5.200 . 5.700 5.350 5.133 5.640 . 0 0 "[ . 1 . 2]" 1
340 1 41 LEU HG 1 73 TYR H 4.500 . 5.000 4.793 4.628 4.928 . 0 0 "[ . 1 . 2]" 1
341 1 41 LEU HG 1 73 TYR HB3 5.200 . 5.700 4.547 4.502 4.599 . 0 0 "[ . 1 . 2]" 1
342 1 41 LEU HG 1 73 TYR QE 5.200 . 5.700 3.322 3.220 3.450 . 0 0 "[ . 1 . 2]" 1
343 1 42 GLY H 1 43 SER H 4.500 . 5.000 4.468 4.326 4.534 . 0 0 "[ . 1 . 2]" 1
344 1 42 GLY H 1 72 VAL H 4.500 . 5.000 3.527 3.280 3.685 . 0 0 "[ . 1 . 2]" 1
345 1 42 GLY HA2 1 71 GLN HB3 5.200 . 5.700 5.521 5.397 5.626 . 0 0 "[ . 1 . 2]" 1
346 1 42 GLY HA2 1 72 VAL H 5.200 . 5.700 5.724 5.500 5.958 0.258 13 0 "[ . 1 . 2]" 1
347 1 42 GLY HA2 1 74 TYR QE 3.500 . 3.800 3.439 2.382 3.837 0.037 4 0 "[ . 1 . 2]" 1
348 1 42 GLY HA3 1 74 TYR QD 4.500 . 5.000 3.264 2.510 4.294 . 0 0 "[ . 1 . 2]" 1
349 1 42 GLY HA3 1 74 TYR QE 4.500 . 5.000 1.996 1.918 2.385 . 0 0 "[ . 1 . 2]" 1
350 1 43 SER H 1 44 ALA H 4.500 . 5.000 4.573 4.543 4.615 . 0 0 "[ . 1 . 2]" 1
351 1 43 SER H 1 44 ALA MB 5.200 . 5.700 5.829 5.782 5.906 0.206 12 0 "[ . 1 . 2]" 1
352 1 43 SER H 1 45 MET ME 4.500 . 5.000 4.596 4.184 5.008 0.008 15 0 "[ . 1 . 2]" 1
353 1 43 SER H 1 74 TYR QE 4.500 . 5.000 4.075 3.681 4.514 . 0 0 "[ . 1 . 2]" 1
354 1 43 SER HA 1 44 ALA H 2.500 . 2.800 2.360 2.278 2.417 . 0 0 "[ . 1 . 2]" 1
355 1 43 SER HA 1 71 GLN HE21 4.500 . 5.000 2.659 2.593 2.730 . 0 0 "[ . 1 . 2]" 1
356 1 43 SER HA 1 71 GLN HE22 4.500 . 5.000 3.754 3.401 3.933 . 0 0 "[ . 1 . 2]" 1
357 1 43 SER HA 1 71 GLN HG3 4.500 . 5.000 5.057 4.414 5.243 0.243 7 0 "[ . 1 . 2]" 1
358 1 43 SER HB2 1 44 ALA H 4.500 . 5.000 3.173 2.339 3.620 . 0 0 "[ . 1 . 2]" 1
359 1 43 SER HB3 1 71 GLN HE21 4.500 . 5.000 5.010 4.963 5.025 0.025 17 0 "[ . 1 . 2]" 1
360 1 44 ALA H 1 45 MET ME 4.500 . 5.000 5.027 4.970 5.166 0.166 12 0 "[ . 1 . 2]" 1
361 1 44 ALA H 1 71 GLN HB3 4.500 . 5.000 5.009 4.951 5.176 0.176 4 0 "[ . 1 . 2]" 1
362 1 44 ALA H 1 71 GLN HE21 4.500 . 5.000 3.898 3.712 4.438 . 0 0 "[ . 1 . 2]" 1
363 1 44 ALA HA 1 45 MET H 3.500 . 3.800 2.249 2.149 2.272 . 0 0 "[ . 1 . 2]" 1
364 1 44 ALA HA 1 45 MET ME 3.500 . 3.800 3.700 3.120 3.883 0.083 7 0 "[ . 1 . 2]" 1
365 1 44 ALA MB 1 45 MET H 3.500 . 3.800 2.405 2.280 2.463 . 0 0 "[ . 1 . 2]" 1
366 1 44 ALA MB 1 45 MET HA 4.500 . 5.000 3.824 3.706 3.952 . 0 0 "[ . 1 . 2]" 1
367 1 44 ALA MB 1 45 MET HB2 4.500 . 5.000 4.578 4.514 4.629 . 0 0 "[ . 1 . 2]" 1
368 1 44 ALA MB 1 45 MET ME 4.500 . 5.000 4.544 4.146 4.657 . 0 0 "[ . 1 . 2]" 1
369 1 44 ALA MB 1 46 SER H 4.500 . 5.000 5.144 5.090 5.245 0.245 4 0 "[ . 1 . 2]" 1
370 1 44 ALA MB 1 70 ASN HB3 4.500 . 5.000 4.456 4.168 4.758 . 0 0 "[ . 1 . 2]" 1
371 1 44 ALA MB 1 70 ASN HD21 4.500 . 5.000 3.849 1.851 5.033 0.033 18 0 "[ . 1 . 2]" 1
372 1 44 ALA MB 1 70 ASN HD22 4.500 . 5.000 3.771 2.851 4.645 . 0 0 "[ . 1 . 2]" 1
373 1 44 ALA MB 1 71 GLN HB3 4.500 . 5.000 4.641 4.408 4.967 . 0 0 "[ . 1 . 2]" 1
374 1 44 ALA MB 1 124 MET HG2 5.200 . 5.700 5.748 5.435 5.862 0.162 20 0 "[ . 1 . 2]" 1
375 1 45 MET H 1 45 MET HB2 3.500 . 3.800 2.547 2.453 2.622 . 0 0 "[ . 1 . 2]" 1
376 1 45 MET H 1 45 MET HB3 3.500 . 3.800 3.402 3.214 3.669 . 0 0 "[ . 1 . 2]" 1
377 1 45 MET H 1 46 SER H 4.500 . 5.000 4.370 4.342 4.475 . 0 0 "[ . 1 . 2]" 1
378 1 45 MET HA 1 45 MET ME 3.500 . 3.800 3.644 3.325 4.008 0.208 4 0 "[ . 1 . 2]" 1
379 1 45 MET HA 1 46 SER HB2 5.200 . 5.700 4.593 4.480 4.821 . 0 0 "[ . 1 . 2]" 1
380 1 45 MET HA 1 46 SER HB3 4.500 . 5.000 4.948 4.846 5.025 0.025 4 0 "[ . 1 . 2]" 1
381 1 45 MET HA 1 47 ARG H 4.500 . 5.000 5.122 5.047 5.318 0.318 4 0 "[ . 1 . 2]" 1
382 1 45 MET HB2 1 45 MET ME 3.500 . 3.800 2.339 2.119 3.737 . 0 0 "[ . 1 . 2]" 1
383 1 45 MET HB2 1 46 SER H 3.500 . 3.800 3.799 3.472 3.843 0.043 17 0 "[ . 1 . 2]" 1
384 1 45 MET HB3 1 46 SER H 3.500 . 3.800 2.489 2.154 2.685 . 0 0 "[ . 1 . 2]" 1
385 1 45 MET HB3 1 46 SER HB2 4.500 . 5.000 4.894 4.626 5.109 0.109 17 0 "[ . 1 . 2]" 1
386 1 45 MET HB3 1 47 ARG H 4.500 . 5.000 4.866 4.680 5.153 0.153 4 0 "[ . 1 . 2]" 1
387 1 45 MET ME 1 45 MET HG2 3.500 . 3.800 2.655 2.454 3.420 . 0 0 "[ . 1 . 2]" 1
388 1 45 MET ME 1 45 MET HG3 3.500 . 3.800 3.233 2.282 3.479 . 0 0 "[ . 1 . 2]" 1
389 1 45 MET ME 1 127 THR H 4.500 . 5.000 4.894 4.516 5.043 0.043 20 0 "[ . 1 . 2]" 1
390 1 45 MET ME 1 127 THR HB 3.500 . 3.800 2.900 2.345 3.681 . 0 0 "[ . 1 . 2]" 1
391 1 45 MET ME 1 127 THR MG 3.500 . 3.800 3.614 2.999 4.076 0.276 20 0 "[ . 1 . 2]" 1
392 1 45 MET ME 1 128 GLN HA 4.500 . 5.000 4.125 3.445 4.639 . 0 0 "[ . 1 . 2]" 1
393 1 45 MET ME 1 128 GLN HG2 3.500 . 3.800 3.344 2.519 3.874 0.074 6 0 "[ . 1 . 2]" 1
394 1 45 MET ME 1 131 ARG HD2 4.500 . 5.000 3.753 3.215 5.048 0.048 15 0 "[ . 1 . 2]" 1
395 1 45 MET ME 1 131 ARG HD3 3.500 . 3.800 3.751 3.317 3.878 0.078 7 0 "[ . 1 . 2]" 1
396 1 45 MET ME 1 131 ARG HG3 5.200 . 5.700 5.011 4.671 5.258 . 0 0 "[ . 1 . 2]" 1
397 1 45 MET HG2 1 46 SER H 5.200 . 5.700 3.833 2.960 4.434 . 0 0 "[ . 1 . 2]" 1
398 1 45 MET HG2 1 127 THR MG 4.500 . 5.000 2.364 1.982 3.455 . 0 0 "[ . 1 . 2]" 1
399 1 45 MET HG3 1 46 SER H 5.200 . 5.700 2.888 2.216 4.196 . 0 0 "[ . 1 . 2]" 1
400 1 45 MET HG3 1 127 THR HB 4.500 . 5.000 4.518 3.898 5.213 0.213 16 0 "[ . 1 . 2]" 1
401 1 45 MET HG3 1 127 THR MG 4.500 . 5.000 3.340 2.822 4.508 . 0 0 "[ . 1 . 2]" 1
402 1 45 MET HG3 1 131 ARG HD2 4.500 . 5.000 4.085 2.830 5.036 0.036 7 0 "[ . 1 . 2]" 1
403 1 45 MET HG3 1 131 ARG HG3 5.200 . 5.700 5.686 5.088 6.393 0.693 16 4 "[ * .*- 1 .+ 2]" 1
404 1 46 SER H 1 46 SER HB3 3.500 . 3.800 2.565 2.447 2.671 . 0 0 "[ . 1 . 2]" 1
405 1 46 SER H 1 47 ARG H 3.500 . 3.800 4.145 4.113 4.219 0.419 4 0 "[ . 1 . 2]" 1
406 1 46 SER HA 1 46 SER HB3 2.500 . 2.800 3.050 3.031 3.088 0.288 12 0 "[ . 1 . 2]" 1
407 1 46 SER HA 1 47 ARG H 3.500 . 3.800 2.051 2.000 2.079 . 0 0 "[ . 1 . 2]" 1
408 1 46 SER HB2 1 47 ARG H 4.500 . 5.000 4.408 4.359 4.430 . 0 0 "[ . 1 . 2]" 1
409 1 47 ARG H 1 47 ARG HB2 3.500 . 3.800 2.478 2.310 2.606 . 0 0 "[ . 1 . 2]" 1
410 1 47 ARG H 1 47 ARG HD3 4.500 . 5.000 4.416 4.114 4.622 . 0 0 "[ . 1 . 2]" 1
411 1 47 ARG HA 1 47 ARG HD3 4.500 . 5.000 2.308 2.108 2.425 . 0 0 "[ . 1 . 2]" 1
412 1 47 ARG HA 1 48 PRO HD2 3.500 . 3.800 2.204 2.156 2.276 . 0 0 "[ . 1 . 2]" 1
413 1 47 ARG HA 1 49 ILE MD 5.200 . 5.700 5.523 5.216 5.731 0.031 6 0 "[ . 1 . 2]" 1
414 1 47 ARG HA 1 124 MET HG3 4.500 . 5.000 4.559 4.234 5.003 0.003 14 0 "[ . 1 . 2]" 1
415 1 47 ARG HB2 1 47 ARG HD3 3.500 . 3.800 2.741 2.484 3.016 . 0 0 "[ . 1 . 2]" 1
416 1 47 ARG HB2 1 48 PRO HD2 5.200 . 5.700 4.234 4.122 4.432 . 0 0 "[ . 1 . 2]" 1
417 1 47 ARG HB2 1 70 ASN HB2 4.500 . 5.000 3.887 3.410 4.775 . 0 0 "[ . 1 . 2]" 1
418 1 47 ARG HB2 1 70 ASN HB3 5.200 . 5.700 4.214 3.481 5.704 0.004 14 0 "[ . 1 . 2]" 1
419 1 47 ARG HB3 1 48 PRO HD2 5.200 . 5.700 4.697 4.582 4.871 . 0 0 "[ . 1 . 2]" 1
420 1 47 ARG HB3 1 49 ILE MD 4.500 . 5.000 4.330 3.951 4.719 . 0 0 "[ . 1 . 2]" 1
421 1 47 ARG HD2 1 48 PRO HG3 5.200 . 5.700 5.580 4.653 5.940 0.240 18 0 "[ . 1 . 2]" 1
422 1 47 ARG HD2 1 65 MET HB3 5.200 . 5.700 5.102 4.763 5.705 0.005 2 0 "[ . 1 . 2]" 1
423 1 47 ARG HD2 1 65 MET ME 4.500 . 5.000 4.360 4.104 4.878 . 0 0 "[ . 1 . 2]" 1
424 1 47 ARG HD2 1 65 MET HG3 4.500 . 5.000 4.424 4.138 5.010 0.010 2 0 "[ . 1 . 2]" 1
425 1 47 ARG HD2 1 120 VAL MG1 3.500 . 3.800 2.750 2.467 3.462 . 0 0 "[ . 1 . 2]" 1
426 1 47 ARG HD2 1 120 VAL MG2 5.200 . 5.700 4.321 3.945 5.111 . 0 0 "[ . 1 . 2]" 1
427 1 47 ARG HD3 1 48 PRO HA 5.200 . 5.700 5.616 5.401 5.779 0.079 4 0 "[ . 1 . 2]" 1
428 1 47 ARG HD3 1 48 PRO HD2 4.500 . 5.000 2.368 2.146 2.683 . 0 0 "[ . 1 . 2]" 1
429 1 47 ARG HD3 1 48 PRO HD3 5.200 . 5.700 3.897 3.726 4.181 . 0 0 "[ . 1 . 2]" 1
430 1 47 ARG HD3 1 48 PRO HG3 5.200 . 5.700 4.997 4.736 5.297 . 0 0 "[ . 1 . 2]" 1
431 1 47 ARG HD3 1 70 ASN HA 4.500 . 5.000 3.648 3.360 4.185 . 0 0 "[ . 1 . 2]" 1
432 1 47 ARG HD3 1 70 ASN HB2 4.500 . 5.000 3.842 3.046 4.383 . 0 0 "[ . 1 . 2]" 1
433 1 47 ARG HD3 1 70 ASN HB3 4.500 . 5.000 3.709 3.022 4.145 . 0 0 "[ . 1 . 2]" 1
434 1 47 ARG HD3 1 120 VAL MG1 4.500 . 5.000 3.071 2.794 3.809 . 0 0 "[ . 1 . 2]" 1
435 1 47 ARG HD3 1 124 MET ME 4.500 . 5.000 4.035 3.760 4.690 . 0 0 "[ . 1 . 2]" 1
436 1 47 ARG HD3 1 124 MET HG3 5.200 . 5.700 5.157 4.910 5.523 . 0 0 "[ . 1 . 2]" 1
437 1 47 ARG QG 1 49 ILE MD 3.500 . 3.800 2.892 2.704 3.066 . 0 0 "[ . 1 . 2]" 1
438 1 48 PRO HA 1 49 ILE MD 4.500 . 5.000 4.416 4.083 4.522 . 0 0 "[ . 1 . 2]" 1
439 1 48 PRO HA 1 49 ILE HG12 4.500 . 5.000 3.820 3.670 4.033 . 0 0 "[ . 1 . 2]" 1
440 1 48 PRO HA 1 49 ILE MG 5.200 . 5.700 5.601 5.568 5.637 . 0 0 "[ . 1 . 2]" 1
441 1 48 PRO HA 1 50 ILE MD 5.200 . 5.700 5.334 5.182 5.517 . 0 0 "[ . 1 . 2]" 1
442 1 48 PRO HA 1 120 VAL MG1 5.200 . 5.700 5.234 5.127 5.352 . 0 0 "[ . 1 . 2]" 1
443 1 48 PRO HA 1 124 MET HG3 5.200 . 5.700 5.727 5.687 5.916 0.216 4 0 "[ . 1 . 2]" 1
444 1 48 PRO HB2 1 120 VAL MG1 4.500 . 5.000 4.115 3.983 4.330 . 0 0 "[ . 1 . 2]" 1
445 1 48 PRO HB3 1 49 ILE H 3.500 . 3.800 3.710 3.664 3.772 . 0 0 "[ . 1 . 2]" 1
446 1 48 PRO HB3 1 50 ILE MD 4.500 . 5.000 4.840 4.644 5.161 0.161 4 0 "[ . 1 . 2]" 1
447 1 48 PRO HB3 1 123 PRO HG2 3.500 . 3.800 3.323 2.980 3.805 0.005 4 0 "[ . 1 . 2]" 1
448 1 48 PRO HB3 1 124 MET HG3 4.500 . 5.000 4.052 3.868 4.384 . 0 0 "[ . 1 . 2]" 1
449 1 48 PRO HD3 1 70 ASN HB2 5.200 . 5.700 5.793 5.259 6.412 0.712 4 1 "[ +. 1 . 2]" 1
450 1 48 PRO HD3 1 120 VAL MG1 5.200 . 5.700 3.871 3.692 4.215 . 0 0 "[ . 1 . 2]" 1
451 1 48 PRO HD3 1 124 MET ME 4.500 . 5.000 3.898 3.624 4.385 . 0 0 "[ . 1 . 2]" 1
452 1 48 PRO HD3 1 124 MET HG2 4.500 . 5.000 3.135 2.853 3.549 . 0 0 "[ . 1 . 2]" 1
453 1 48 PRO HD3 1 124 MET HG3 4.500 . 5.000 2.533 2.328 2.891 . 0 0 "[ . 1 . 2]" 1
454 1 48 PRO HG3 1 50 ILE MD 4.500 . 5.000 4.268 4.128 4.566 . 0 0 "[ . 1 . 2]" 1
455 1 48 PRO HG3 1 120 VAL MG1 4.500 . 5.000 3.091 2.943 3.510 . 0 0 "[ . 1 . 2]" 1
456 1 48 PRO HG3 1 124 MET ME 3.500 . 3.800 3.492 3.323 4.013 0.213 4 0 "[ . 1 . 2]" 1
457 1 48 PRO HG3 1 124 MET HG3 5.200 . 5.700 2.265 2.065 2.467 . 0 0 "[ . 1 . 2]" 1
458 1 49 ILE H 1 49 ILE HB 3.500 . 3.800 2.677 2.629 2.786 . 0 0 "[ . 1 . 2]" 1
459 1 49 ILE H 1 49 ILE MD 3.500 . 3.800 3.778 3.601 3.830 0.030 9 0 "[ . 1 . 2]" 1
460 1 49 ILE H 1 49 ILE HG12 3.500 . 3.800 2.927 2.824 3.053 . 0 0 "[ . 1 . 2]" 1
461 1 49 ILE H 1 49 ILE HG13 4.500 . 5.000 4.247 4.164 4.354 . 0 0 "[ . 1 . 2]" 1
462 1 49 ILE H 1 49 ILE MG 4.500 . 5.000 3.909 3.851 3.980 . 0 0 "[ . 1 . 2]" 1
463 1 49 ILE H 1 50 ILE H 4.500 . 5.000 4.291 4.202 4.390 . 0 0 "[ . 1 . 2]" 1
464 1 49 ILE H 1 50 ILE HA 5.200 . 5.700 4.703 4.604 4.880 . 0 0 "[ . 1 . 2]" 1
465 1 49 ILE HA 1 49 ILE MD 3.500 . 3.800 2.197 2.110 2.231 . 0 0 "[ . 1 . 2]" 1
466 1 49 ILE HA 1 49 ILE HG12 3.500 . 3.800 3.185 3.139 3.270 . 0 0 "[ . 1 . 2]" 1
467 1 49 ILE HA 1 49 ILE MG 3.500 . 3.800 2.416 2.378 2.474 . 0 0 "[ . 1 . 2]" 1
468 1 49 ILE HA 1 50 ILE H 3.500 . 3.800 2.175 2.100 2.203 . 0 0 "[ . 1 . 2]" 1
469 1 49 ILE HA 1 50 ILE MD 3.500 . 3.800 3.681 3.579 3.763 . 0 0 "[ . 1 . 2]" 1
470 1 49 ILE HA 1 50 ILE HG12 5.200 . 5.700 3.768 3.673 3.857 . 0 0 "[ . 1 . 2]" 1
471 1 49 ILE HA 1 51 HIS HD2 4.500 . 5.000 4.932 4.676 5.037 0.037 11 0 "[ . 1 . 2]" 1
472 1 49 ILE HA 1 61 TYR QD 4.500 . 5.000 3.831 3.672 3.935 . 0 0 "[ . 1 . 2]" 1
473 1 49 ILE HA 1 61 TYR QE 3.500 . 3.800 1.910 1.858 1.981 . 0 0 "[ . 1 . 2]" 1
474 1 49 ILE HA 1 62 ARG QD 5.200 . 5.700 4.618 4.188 5.114 . 0 0 "[ . 1 . 2]" 1
475 1 49 ILE HA 1 65 MET ME 4.500 . 5.000 4.058 3.983 4.209 . 0 0 "[ . 1 . 2]" 1
476 1 49 ILE HB 1 49 ILE MD 3.500 . 3.800 3.307 3.282 3.327 . 0 0 "[ . 1 . 2]" 1
477 1 49 ILE MD 1 49 ILE MG 2.500 . 2.800 2.149 2.107 2.242 . 0 0 "[ . 1 . 2]" 1
478 1 49 ILE MD 1 61 TYR QD 4.500 . 5.000 3.831 3.672 4.020 . 0 0 "[ . 1 . 2]" 1
479 1 49 ILE MD 1 61 TYR QE 3.500 . 3.800 2.296 2.216 2.402 . 0 0 "[ . 1 . 2]" 1
480 1 49 ILE MD 1 62 ARG HA 4.500 . 5.000 4.402 4.195 4.629 . 0 0 "[ . 1 . 2]" 1
481 1 49 ILE MD 1 62 ARG QD 4.500 . 5.000 2.551 1.961 3.174 . 0 0 "[ . 1 . 2]" 1
482 1 49 ILE MD 1 62 ARG HG3 4.500 . 5.000 4.083 3.789 4.505 . 0 0 "[ . 1 . 2]" 1
483 1 49 ILE MD 1 65 MET ME 3.500 . 3.800 2.193 2.118 2.272 . 0 0 "[ . 1 . 2]" 1
484 1 49 ILE HG12 1 49 ILE MG 3.500 . 3.800 3.245 3.165 3.263 . 0 0 "[ . 1 . 2]" 1
485 1 49 ILE HG12 1 61 TYR QE 4.500 . 5.000 4.423 4.350 4.503 . 0 0 "[ . 1 . 2]" 1
486 1 49 ILE HG12 1 62 ARG QD 5.200 . 5.700 4.995 4.408 5.513 . 0 0 "[ . 1 . 2]" 1
487 1 49 ILE HG13 1 49 ILE MG 3.500 . 3.800 2.357 2.295 2.390 . 0 0 "[ . 1 . 2]" 1
488 1 49 ILE HG13 1 62 ARG QD 4.500 . 5.000 3.843 3.311 4.321 . 0 0 "[ . 1 . 2]" 1
489 1 49 ILE MG 1 50 ILE H 3.500 . 3.800 2.852 2.639 3.013 . 0 0 "[ . 1 . 2]" 1
490 1 49 ILE MG 1 50 ILE MD 4.500 . 5.000 4.589 4.497 4.669 . 0 0 "[ . 1 . 2]" 1
491 1 49 ILE MG 1 51 HIS HA 4.500 . 5.000 4.160 4.083 4.306 . 0 0 "[ . 1 . 2]" 1
492 1 49 ILE MG 1 51 HIS HD2 3.500 . 3.800 2.631 2.186 3.227 . 0 0 "[ . 1 . 2]" 1
493 1 49 ILE MG 1 61 TYR QE 3.500 . 3.800 2.518 2.258 2.714 . 0 0 "[ . 1 . 2]" 1
494 1 49 ILE MG 1 62 ARG H 5.200 . 5.700 5.203 5.054 5.382 . 0 0 "[ . 1 . 2]" 1
495 1 49 ILE MG 1 62 ARG QD 4.500 . 5.000 2.290 2.067 2.727 . 0 0 "[ . 1 . 2]" 1
496 1 49 ILE MG 1 65 MET ME 4.500 . 5.000 3.641 3.349 3.838 . 0 0 "[ . 1 . 2]" 1
497 1 50 ILE H 1 50 ILE MD 4.500 . 5.000 2.609 2.487 2.777 . 0 0 "[ . 1 . 2]" 1
498 1 50 ILE H 1 50 ILE HG12 4.500 . 5.000 1.938 1.831 2.063 . 0 0 "[ . 1 . 2]" 1
499 1 50 ILE H 1 50 ILE HG13 3.500 . 3.800 3.513 3.430 3.598 . 0 0 "[ . 1 . 2]" 1
500 1 50 ILE H 1 50 ILE MG 4.500 . 5.000 3.798 3.767 3.821 . 0 0 "[ . 1 . 2]" 1
501 1 50 ILE H 1 51 HIS H 4.500 . 5.000 4.628 4.576 4.668 . 0 0 "[ . 1 . 2]" 1
502 1 50 ILE H 1 51 HIS HD2 4.500 . 5.000 4.470 4.118 4.749 . 0 0 "[ . 1 . 2]" 1
503 1 50 ILE H 1 120 VAL HA 5.200 . 5.700 5.336 5.142 5.610 . 0 0 "[ . 1 . 2]" 1
504 1 50 ILE H 1 120 VAL MG2 4.500 . 5.000 5.061 5.018 5.200 0.200 12 0 "[ . 1 . 2]" 1
505 1 50 ILE HA 1 50 ILE MD 3.500 . 3.800 2.476 2.291 2.560 . 0 0 "[ . 1 . 2]" 1
506 1 50 ILE HA 1 50 ILE HG13 3.500 . 3.800 3.933 3.851 3.996 0.196 19 0 "[ . 1 . 2]" 1
507 1 50 ILE HA 1 50 ILE MG 3.500 . 3.800 2.260 2.238 2.284 . 0 0 "[ . 1 . 2]" 1
508 1 50 ILE HA 1 51 HIS H 3.500 . 3.800 2.252 2.174 2.325 . 0 0 "[ . 1 . 2]" 1
509 1 50 ILE HA 1 51 HIS HA 4.500 . 5.000 4.475 4.396 4.508 . 0 0 "[ . 1 . 2]" 1
510 1 50 ILE HA 1 51 HIS HD2 4.500 . 5.000 3.869 3.417 4.385 . 0 0 "[ . 1 . 2]" 1
511 1 50 ILE HA 1 52 PHE QE 5.200 . 5.700 5.245 5.129 5.458 . 0 0 "[ . 1 . 2]" 1
512 1 50 ILE HB 1 50 ILE MD 3.500 . 3.800 3.288 3.267 3.328 . 0 0 "[ . 1 . 2]" 1
513 1 50 ILE HB 1 51 HIS H 3.500 . 3.800 3.618 3.381 3.794 . 0 0 "[ . 1 . 2]" 1
514 1 50 ILE HB 1 52 PHE QD 4.500 . 5.000 3.089 2.861 3.344 . 0 0 "[ . 1 . 2]" 1
515 1 50 ILE HB 1 52 PHE QE 4.500 . 5.000 2.427 2.274 2.743 . 0 0 "[ . 1 . 2]" 1
516 1 50 ILE HB 1 52 PHE HZ 4.500 . 5.000 4.034 3.710 4.501 . 0 0 "[ . 1 . 2]" 1
517 1 50 ILE MD 1 50 ILE MG 3.500 . 3.800 2.182 2.139 2.262 . 0 0 "[ . 1 . 2]" 1
518 1 50 ILE MD 1 51 HIS H 4.500 . 5.000 4.207 4.012 4.307 . 0 0 "[ . 1 . 2]" 1
519 1 50 ILE MD 1 52 PHE QE 4.500 . 5.000 4.367 4.194 4.591 . 0 0 "[ . 1 . 2]" 1
520 1 50 ILE MD 1 52 PHE HZ 4.500 . 5.000 4.513 4.265 4.925 . 0 0 "[ . 1 . 2]" 1
521 1 50 ILE MD 1 61 TYR QD 4.500 . 5.000 4.038 3.862 4.206 . 0 0 "[ . 1 . 2]" 1
522 1 50 ILE MD 1 61 TYR QE 4.500 . 5.000 3.447 3.250 3.659 . 0 0 "[ . 1 . 2]" 1
523 1 50 ILE MD 1 116 MET HA 4.500 . 5.000 5.021 4.831 5.201 0.201 12 0 "[ . 1 . 2]" 1
524 1 50 ILE MD 1 116 MET HB3 5.200 . 5.700 5.444 5.176 5.639 . 0 0 "[ . 1 . 2]" 1
525 1 50 ILE MD 1 119 ARG H 4.500 . 5.000 4.848 4.708 5.123 0.123 12 0 "[ . 1 . 2]" 1
526 1 50 ILE MD 1 119 ARG HA 4.500 . 5.000 4.175 4.064 4.335 . 0 0 "[ . 1 . 2]" 1
527 1 50 ILE MD 1 119 ARG HB2 4.500 . 5.000 4.370 4.187 4.568 . 0 0 "[ . 1 . 2]" 1
528 1 50 ILE MD 1 119 ARG HD2 4.500 . 5.000 4.090 3.881 4.258 . 0 0 "[ . 1 . 2]" 1
529 1 50 ILE MD 1 119 ARG HD3 4.500 . 5.000 4.861 4.726 4.966 . 0 0 "[ . 1 . 2]" 1
530 1 50 ILE MD 1 119 ARG HG2 3.500 . 3.800 3.321 3.234 3.413 . 0 0 "[ . 1 . 2]" 1
531 1 50 ILE MD 1 119 ARG HG3 4.500 . 5.000 2.179 2.082 2.265 . 0 0 "[ . 1 . 2]" 1
532 1 50 ILE MD 1 120 VAL H 4.500 . 5.000 3.468 3.362 3.728 . 0 0 "[ . 1 . 2]" 1
533 1 50 ILE MD 1 120 VAL HA 3.500 . 3.800 1.926 1.890 1.967 . 0 0 "[ . 1 . 2]" 1
534 1 50 ILE MD 1 120 VAL MG1 4.500 . 5.000 2.701 2.421 2.975 . 0 0 "[ . 1 . 2]" 1
535 1 50 ILE MD 1 120 VAL MG2 3.500 . 3.800 2.570 2.390 2.868 . 0 0 "[ . 1 . 2]" 1
536 1 50 ILE MD 1 123 PRO HD2 4.500 . 5.000 3.491 3.351 3.603 . 0 0 "[ . 1 . 2]" 1
537 1 50 ILE MD 1 123 PRO HD3 4.500 . 5.000 3.540 3.327 3.692 . 0 0 "[ . 1 . 2]" 1
538 1 50 ILE MD 1 124 MET ME 5.200 . 5.700 4.995 4.849 5.090 . 0 0 "[ . 1 . 2]" 1
539 1 50 ILE HG12 1 50 ILE MG 3.500 . 3.800 3.232 3.173 3.249 . 0 0 "[ . 1 . 2]" 1
540 1 50 ILE HG12 1 52 PHE QE 4.500 . 5.000 3.668 3.312 4.062 . 0 0 "[ . 1 . 2]" 1
541 1 50 ILE HG12 1 52 PHE HZ 4.500 . 5.000 4.714 4.410 5.297 0.297 4 0 "[ . 1 . 2]" 1
542 1 50 ILE HG12 1 119 ARG HG3 4.500 . 5.000 4.531 4.275 4.740 . 0 0 "[ . 1 . 2]" 1
543 1 50 ILE HG12 1 120 VAL MG2 4.500 . 5.000 3.743 3.481 3.886 . 0 0 "[ . 1 . 2]" 1
544 1 50 ILE HG13 1 50 ILE MG 3.500 . 3.800 2.330 2.273 2.375 . 0 0 "[ . 1 . 2]" 1
545 1 50 ILE HG13 1 52 PHE HZ 5.200 . 5.700 3.219 2.901 3.816 . 0 0 "[ . 1 . 2]" 1
546 1 50 ILE HG13 1 61 TYR HB2 4.500 . 5.000 3.740 3.531 3.944 . 0 0 "[ . 1 . 2]" 1
547 1 50 ILE HG13 1 61 TYR QD 5.200 . 5.700 3.766 3.625 3.867 . 0 0 "[ . 1 . 2]" 1
548 1 50 ILE HG13 1 116 MET ME 5.200 . 5.700 5.102 4.981 5.381 . 0 0 "[ . 1 . 2]" 1
549 1 50 ILE HG13 1 119 ARG HG2 4.500 . 5.000 3.122 2.816 3.362 . 0 0 "[ . 1 . 2]" 1
550 1 50 ILE HG13 1 119 ARG HG3 4.500 . 5.000 3.137 2.872 3.393 . 0 0 "[ . 1 . 2]" 1
551 1 50 ILE MG 1 51 HIS H 3.500 . 3.800 2.208 2.041 2.386 . 0 0 "[ . 1 . 2]" 1
552 1 50 ILE MG 1 51 HIS HA 4.500 . 5.000 3.858 3.705 3.938 . 0 0 "[ . 1 . 2]" 1
553 1 50 ILE MG 1 51 HIS HB3 4.500 . 5.000 5.106 5.037 5.171 0.171 11 0 "[ . 1 . 2]" 1
554 1 50 ILE MG 1 51 HIS HD2 4.500 . 5.000 4.790 4.571 4.967 . 0 0 "[ . 1 . 2]" 1
555 1 50 ILE MG 1 52 PHE HA 4.500 . 5.000 3.440 3.273 3.589 . 0 0 "[ . 1 . 2]" 1
556 1 50 ILE MG 1 52 PHE HB3 4.500 . 5.000 4.698 4.595 4.834 . 0 0 "[ . 1 . 2]" 1
557 1 50 ILE MG 1 52 PHE QD 4.500 . 5.000 3.164 3.037 3.346 . 0 0 "[ . 1 . 2]" 1
558 1 50 ILE MG 1 52 PHE QE 4.500 . 5.000 2.843 2.743 2.955 . 0 0 "[ . 1 . 2]" 1
559 1 50 ILE MG 1 52 PHE HZ 4.500 . 5.000 2.918 2.767 3.072 . 0 0 "[ . 1 . 2]" 1
560 1 50 ILE MG 1 119 ARG HA 4.500 . 5.000 4.782 4.688 4.895 . 0 0 "[ . 1 . 2]" 1
561 1 50 ILE MG 1 119 ARG HB2 5.200 . 5.700 4.159 4.055 4.255 . 0 0 "[ . 1 . 2]" 1
562 1 50 ILE MG 1 119 ARG HB3 5.200 . 5.700 3.563 3.381 3.715 . 0 0 "[ . 1 . 2]" 1
563 1 50 ILE MG 1 119 ARG HD2 4.500 . 5.000 3.821 3.628 4.119 . 0 0 "[ . 1 . 2]" 1
564 1 50 ILE MG 1 119 ARG HD3 4.500 . 5.000 4.070 3.916 4.192 . 0 0 "[ . 1 . 2]" 1
565 1 50 ILE MG 1 119 ARG HG2 3.500 . 3.800 2.023 1.963 2.102 . 0 0 "[ . 1 . 2]" 1
566 1 50 ILE MG 1 119 ARG HG3 4.500 . 5.000 2.334 2.228 2.461 . 0 0 "[ . 1 . 2]" 1
567 1 50 ILE MG 1 120 VAL HA 4.500 . 5.000 4.755 4.568 4.964 . 0 0 "[ . 1 . 2]" 1
568 1 50 ILE MG 1 120 VAL MG1 5.200 . 5.700 5.429 5.248 5.620 . 0 0 "[ . 1 . 2]" 1
569 1 50 ILE MG 1 120 VAL MG2 4.500 . 5.000 4.926 4.681 5.032 0.032 20 0 "[ . 1 . 2]" 1
570 1 50 ILE MG 1 122 GLU HB2 5.200 . 5.700 5.276 4.939 5.526 . 0 0 "[ . 1 . 2]" 1
571 1 51 HIS H 1 51 HIS HB2 3.500 . 3.800 2.617 2.570 2.709 . 0 0 "[ . 1 . 2]" 1
572 1 51 HIS H 1 51 HIS HB3 3.500 . 3.800 3.753 3.709 3.802 0.002 5 0 "[ . 1 . 2]" 1
573 1 51 HIS H 1 52 PHE H 4.500 . 5.000 3.684 3.539 3.848 . 0 0 "[ . 1 . 2]" 1
574 1 51 HIS H 1 119 ARG HG2 5.200 . 5.700 5.745 5.722 5.877 0.177 4 0 "[ . 1 . 2]" 1
575 1 51 HIS H 1 119 ARG HG3 5.200 . 5.700 5.567 5.372 5.661 . 0 0 "[ . 1 . 2]" 1
576 1 51 HIS HA 1 51 HIS HD2 3.500 . 3.800 3.000 2.359 3.835 0.035 5 0 "[ . 1 . 2]" 1
577 1 51 HIS HA 1 51 HIS HE1 5.200 . 5.700 5.467 4.934 5.730 0.030 11 0 "[ . 1 . 2]" 1
578 1 51 HIS HA 1 52 PHE H 3.500 . 3.800 2.276 2.178 2.415 . 0 0 "[ . 1 . 2]" 1
579 1 51 HIS HA 1 52 PHE HA 4.500 . 5.000 4.523 4.454 4.600 . 0 0 "[ . 1 . 2]" 1
580 1 51 HIS HA 1 52 PHE QD 4.500 . 5.000 3.964 3.584 4.356 . 0 0 "[ . 1 . 2]" 1
581 1 51 HIS HA 1 58 ASP HB2 4.500 . 5.000 2.965 2.539 3.444 . 0 0 "[ . 1 . 2]" 1
582 1 51 HIS HA 1 58 ASP HB3 4.500 . 5.000 4.496 4.089 4.840 . 0 0 "[ . 1 . 2]" 1
583 1 51 HIS HB3 1 51 HIS HD2 3.500 . 3.800 3.883 3.693 4.001 0.201 6 0 "[ . 1 . 2]" 1
584 1 51 HIS HB3 1 52 PHE HA 5.200 . 5.700 5.065 4.935 5.172 . 0 0 "[ . 1 . 2]" 1
585 1 52 PHE H 1 52 PHE HB2 3.500 . 3.800 2.415 2.337 2.547 . 0 0 "[ . 1 . 2]" 1
586 1 52 PHE H 1 52 PHE QD 4.500 . 5.000 2.217 2.032 2.444 . 0 0 "[ . 1 . 2]" 1
587 1 52 PHE H 1 52 PHE QE 4.500 . 5.000 4.313 4.170 4.495 . 0 0 "[ . 1 . 2]" 1
588 1 52 PHE H 1 53 GLY H 4.500 . 5.000 2.558 2.383 2.753 . 0 0 "[ . 1 . 2]" 1
589 1 52 PHE H 1 54 SER H 4.500 . 5.000 4.420 4.042 4.720 . 0 0 "[ . 1 . 2]" 1
590 1 52 PHE H 1 58 ASP HB3 4.500 . 5.000 3.912 3.721 4.256 . 0 0 "[ . 1 . 2]" 1
591 1 52 PHE HA 1 52 PHE QD 3.500 . 3.800 2.984 2.879 3.065 . 0 0 "[ . 1 . 2]" 1
592 1 52 PHE HA 1 52 PHE QE 5.200 . 5.700 4.714 4.644 4.780 . 0 0 "[ . 1 . 2]" 1
593 1 52 PHE HA 1 53 GLY HA2 5.200 . 5.700 5.179 5.057 5.241 . 0 0 "[ . 1 . 2]" 1
594 1 52 PHE HA 1 54 SER H 4.500 . 5.000 4.344 4.067 4.763 . 0 0 "[ . 1 . 2]" 1
595 1 52 PHE HB2 1 52 PHE QE 4.500 . 5.000 4.446 4.408 4.466 . 0 0 "[ . 1 . 2]" 1
596 1 52 PHE HB2 1 53 GLY H 3.500 . 3.800 2.608 2.422 2.799 . 0 0 "[ . 1 . 2]" 1
597 1 52 PHE HB2 1 53 GLY HA3 4.500 . 5.000 4.700 4.524 4.845 . 0 0 "[ . 1 . 2]" 1
598 1 52 PHE HB2 1 54 SER H 3.500 . 3.800 2.667 2.417 2.899 . 0 0 "[ . 1 . 2]" 1
599 1 52 PHE HB2 1 57 GLU HG3 4.500 . 5.000 4.030 3.774 4.321 . 0 0 "[ . 1 . 2]" 1
600 1 52 PHE HB2 1 58 ASP HB2 4.500 . 5.000 3.172 2.530 3.637 . 0 0 "[ . 1 . 2]" 1
601 1 52 PHE HB2 1 58 ASP HB3 4.500 . 5.000 3.944 3.673 4.165 . 0 0 "[ . 1 . 2]" 1
602 1 52 PHE HB2 1 116 MET ME 5.200 . 5.700 5.251 5.103 5.385 . 0 0 "[ . 1 . 2]" 1
603 1 52 PHE HB3 1 52 PHE QE 4.500 . 5.000 4.434 4.412 4.478 . 0 0 "[ . 1 . 2]" 1
604 1 52 PHE HB3 1 53 GLY HA2 5.200 . 5.700 5.372 5.274 5.520 . 0 0 "[ . 1 . 2]" 1
605 1 52 PHE HB3 1 53 GLY HA3 4.500 . 5.000 4.640 4.448 4.774 . 0 0 "[ . 1 . 2]" 1
606 1 52 PHE HB3 1 54 SER QB 5.200 . 5.700 4.382 4.033 4.959 . 0 0 "[ . 1 . 2]" 1
607 1 52 PHE HB3 1 57 GLU HB2 3.500 . 3.800 2.912 2.691 3.112 . 0 0 "[ . 1 . 2]" 1
608 1 52 PHE HB3 1 57 GLU HG3 4.500 . 5.000 3.626 3.406 4.005 . 0 0 "[ . 1 . 2]" 1
609 1 52 PHE QD 1 57 GLU H 5.200 . 5.700 4.913 4.834 5.059 . 0 0 "[ . 1 . 2]" 1
610 1 52 PHE QD 1 57 GLU HA 4.500 . 5.000 4.570 4.460 4.687 . 0 0 "[ . 1 . 2]" 1
611 1 52 PHE QD 1 57 GLU HB2 3.500 . 3.800 3.069 2.826 3.211 . 0 0 "[ . 1 . 2]" 1
612 1 52 PHE QD 1 57 GLU HB3 4.500 . 5.000 3.042 2.959 3.140 . 0 0 "[ . 1 . 2]" 1
613 1 52 PHE QD 1 57 GLU HG3 4.500 . 5.000 4.124 3.728 4.583 . 0 0 "[ . 1 . 2]" 1
614 1 52 PHE QD 1 58 ASP HA 3.500 . 3.800 2.191 2.021 2.356 . 0 0 "[ . 1 . 2]" 1
615 1 52 PHE QD 1 58 ASP HB2 4.500 . 5.000 2.661 2.433 2.927 . 0 0 "[ . 1 . 2]" 1
616 1 52 PHE QD 1 58 ASP HB3 3.500 . 3.800 3.850 3.792 4.045 0.245 4 0 "[ . 1 . 2]" 1
617 1 52 PHE QD 1 61 TYR HB3 4.500 . 5.000 4.382 4.249 4.535 . 0 0 "[ . 1 . 2]" 1
618 1 52 PHE QD 1 116 MET ME 4.500 . 5.000 3.976 3.846 4.084 . 0 0 "[ . 1 . 2]" 1
619 1 52 PHE QE 1 57 GLU HB3 5.200 . 5.700 3.312 3.257 3.408 . 0 0 "[ . 1 . 2]" 1
620 1 52 PHE QE 1 61 TYR HB2 4.500 . 5.000 2.476 2.357 2.628 . 0 0 "[ . 1 . 2]" 1
621 1 52 PHE QE 1 61 TYR HB3 4.500 . 5.000 3.077 2.847 3.446 . 0 0 "[ . 1 . 2]" 1
622 1 52 PHE HZ 1 57 GLU HA 5.200 . 5.700 5.556 5.425 5.730 0.030 12 0 "[ . 1 . 2]" 1
623 1 52 PHE HZ 1 57 GLU HB3 4.500 . 5.000 3.932 3.797 4.123 . 0 0 "[ . 1 . 2]" 1
624 1 52 PHE HZ 1 61 TYR HB2 4.500 . 5.000 3.747 3.505 4.275 . 0 0 "[ . 1 . 2]" 1
625 1 52 PHE HZ 1 61 TYR HB3 5.200 . 5.700 5.114 4.815 5.660 . 0 0 "[ . 1 . 2]" 1
626 1 52 PHE HZ 1 116 MET HA 4.500 . 5.000 3.118 2.959 3.236 . 0 0 "[ . 1 . 2]" 1
627 1 52 PHE HZ 1 116 MET ME 4.500 . 5.000 3.201 2.951 3.545 . 0 0 "[ . 1 . 2]" 1
628 1 52 PHE HZ 1 116 MET HG2 4.500 . 5.000 4.593 4.452 4.752 . 0 0 "[ . 1 . 2]" 1
629 1 52 PHE HZ 1 116 MET HG3 5.200 . 5.700 5.067 4.965 5.315 . 0 0 "[ . 1 . 2]" 1
630 1 52 PHE HZ 1 119 ARG HB3 4.500 . 5.000 3.282 3.136 3.531 . 0 0 "[ . 1 . 2]" 1
631 1 52 PHE HZ 1 119 ARG HD2 5.200 . 5.700 5.572 5.204 5.712 0.012 16 0 "[ . 1 . 2]" 1
632 1 52 PHE HZ 1 119 ARG HD3 5.200 . 5.700 4.690 4.178 4.975 . 0 0 "[ . 1 . 2]" 1
633 1 52 PHE HZ 1 119 ARG HG2 3.500 . 3.800 2.671 2.366 2.913 . 0 0 "[ . 1 . 2]" 1
634 1 53 GLY H 1 54 SER H 3.500 . 3.800 2.656 2.327 2.877 . 0 0 "[ . 1 . 2]" 1
635 1 53 GLY H 1 54 SER HA 4.500 . 5.000 4.908 4.716 5.043 0.043 4 0 "[ . 1 . 2]" 1
636 1 53 GLY H 1 58 ASP HB3 3.500 . 3.800 3.800 3.386 3.853 0.053 17 0 "[ . 1 . 2]" 1
637 1 53 GLY HA3 1 54 SER H 3.500 . 3.800 3.037 2.860 3.352 . 0 0 "[ . 1 . 2]" 1
638 1 54 SER H 1 54 SER QB 3.500 . 3.800 2.843 2.726 3.071 . 0 0 "[ . 1 . 2]" 1
639 1 54 SER H 1 55 ASP H 4.500 . 5.000 4.544 4.392 4.627 . 0 0 "[ . 1 . 2]" 1
640 1 54 SER H 1 57 GLU H 4.500 . 5.000 4.616 4.373 4.850 . 0 0 "[ . 1 . 2]" 1
641 1 54 SER H 1 57 GLU HB2 4.500 . 5.000 3.786 3.630 3.894 . 0 0 "[ . 1 . 2]" 1
642 1 54 SER H 1 57 GLU HG2 5.200 . 5.700 5.711 5.540 5.897 0.197 4 0 "[ . 1 . 2]" 1
643 1 54 SER H 1 58 ASP H 4.500 . 5.000 4.340 3.723 4.569 . 0 0 "[ . 1 . 2]" 1
644 1 54 SER H 1 58 ASP HB3 4.500 . 5.000 4.825 4.135 5.011 0.011 8 0 "[ . 1 . 2]" 1
645 1 54 SER HA 1 55 ASP H 3.500 . 3.800 2.278 2.220 2.393 . 0 0 "[ . 1 . 2]" 1
646 1 54 SER HA 1 55 ASP HA 4.500 . 5.000 4.278 4.233 4.329 . 0 0 "[ . 1 . 2]" 1
647 1 54 SER HA 1 56 TYR H 4.500 . 5.000 4.182 3.959 4.396 . 0 0 "[ . 1 . 2]" 1
648 1 54 SER QB 1 55 ASP H 3.500 . 3.800 2.702 2.461 3.157 . 0 0 "[ . 1 . 2]" 1
649 1 54 SER QB 1 55 ASP HB3 4.500 . 5.000 4.973 4.363 5.821 0.821 1 7 "[+ .* *1 * -* *2]" 1
650 1 54 SER QB 1 56 TYR H 4.500 . 5.000 2.772 2.511 3.009 . 0 0 "[ . 1 . 2]" 1
651 1 54 SER QB 1 57 GLU HB2 5.200 . 5.700 4.021 3.519 4.470 . 0 0 "[ . 1 . 2]" 1
652 1 55 ASP H 1 55 ASP HB3 3.500 . 3.800 2.957 2.531 3.606 . 0 0 "[ . 1 . 2]" 1
653 1 55 ASP H 1 56 TYR H 3.500 . 3.800 2.585 2.528 2.689 . 0 0 "[ . 1 . 2]" 1
654 1 55 ASP H 1 56 TYR HB3 4.500 . 5.000 4.666 4.526 4.755 . 0 0 "[ . 1 . 2]" 1
655 1 55 ASP HA 1 57 GLU H 4.500 . 5.000 4.737 4.612 4.970 . 0 0 "[ . 1 . 2]" 1
656 1 56 TYR H 1 56 TYR HB3 3.500 . 3.800 2.333 2.229 2.380 . 0 0 "[ . 1 . 2]" 1
657 1 56 TYR H 1 56 TYR QD 4.500 . 5.000 4.190 4.115 4.214 . 0 0 "[ . 1 . 2]" 1
658 1 56 TYR H 1 57 GLU H 3.500 . 3.800 2.669 2.346 2.900 . 0 0 "[ . 1 . 2]" 1
659 1 56 TYR H 1 57 GLU HG2 4.500 . 5.000 4.594 4.123 5.034 0.034 2 0 "[ . 1 . 2]" 1
660 1 56 TYR H 1 57 GLU HG3 4.500 . 5.000 4.975 4.105 5.060 0.060 17 0 "[ . 1 . 2]" 1
661 1 56 TYR H 1 58 ASP H 4.500 . 5.000 4.329 3.781 4.506 . 0 0 "[ . 1 . 2]" 1
662 1 56 TYR H 1 59 ARG H 4.500 . 5.000 4.806 4.387 4.988 . 0 0 "[ . 1 . 2]" 1
663 1 56 TYR H 1 59 ARG HB3 4.500 . 5.000 4.998 4.863 5.159 0.159 4 0 "[ . 1 . 2]" 1
664 1 56 TYR HA 1 56 TYR QD 3.500 . 3.800 2.511 2.376 2.623 . 0 0 "[ . 1 . 2]" 1
665 1 56 TYR HA 1 56 TYR QE 5.200 . 5.700 4.660 4.598 4.775 . 0 0 "[ . 1 . 2]" 1
666 1 56 TYR HA 1 59 ARG H 4.500 . 5.000 3.967 3.771 4.214 . 0 0 "[ . 1 . 2]" 1
667 1 56 TYR HA 1 59 ARG HG3 4.500 . 5.000 4.866 4.521 5.072 0.072 4 0 "[ . 1 . 2]" 1
668 1 56 TYR HB2 1 56 TYR QE 4.500 . 5.000 4.579 4.564 4.621 . 0 0 "[ . 1 . 2]" 1
669 1 56 TYR HB2 1 57 GLU H 3.500 . 3.800 3.852 3.744 3.929 0.129 20 0 "[ . 1 . 2]" 1
670 1 56 TYR HB2 1 57 GLU HG2 4.500 . 5.000 4.723 4.414 5.019 0.019 2 0 "[ . 1 . 2]" 1
671 1 56 TYR HB3 1 56 TYR QE 4.500 . 5.000 4.444 4.425 4.470 . 0 0 "[ . 1 . 2]" 1
672 1 56 TYR HB3 1 57 GLU H 4.500 . 5.000 2.439 2.305 2.540 . 0 0 "[ . 1 . 2]" 1
673 1 56 TYR HB3 1 57 GLU HG2 4.500 . 5.000 3.083 2.692 3.466 . 0 0 "[ . 1 . 2]" 1
674 1 56 TYR HB3 1 59 ARG HB3 5.200 . 5.700 5.605 5.481 5.787 0.087 15 0 "[ . 1 . 2]" 1
675 1 56 TYR QD 1 57 GLU HA 4.500 . 5.000 3.551 3.242 3.883 . 0 0 "[ . 1 . 2]" 1
676 1 56 TYR QD 1 57 GLU HG2 3.500 . 3.800 2.147 2.030 2.361 . 0 0 "[ . 1 . 2]" 1
677 1 56 TYR QD 1 57 GLU HG3 3.500 . 3.800 3.596 3.217 3.782 . 0 0 "[ . 1 . 2]" 1
678 1 56 TYR QE 1 57 GLU HA 4.500 . 5.000 4.223 4.083 4.379 . 0 0 "[ . 1 . 2]" 1
679 1 56 TYR QE 1 57 GLU HB3 5.200 . 5.700 5.651 5.587 5.798 0.098 4 0 "[ . 1 . 2]" 1
680 1 56 TYR QE 1 57 GLU HG2 4.500 . 5.000 3.748 3.405 4.116 . 0 0 "[ . 1 . 2]" 1
681 1 56 TYR QE 1 60 TYR HB2 5.200 . 5.700 3.172 2.891 3.448 . 0 0 "[ . 1 . 2]" 1
682 1 56 TYR QE 1 60 TYR HB3 5.200 . 5.700 4.035 3.702 4.229 . 0 0 "[ . 1 . 2]" 1
683 1 57 GLU H 1 57 GLU HB2 3.500 . 3.800 2.440 2.394 2.591 . 0 0 "[ . 1 . 2]" 1
684 1 57 GLU H 1 57 GLU HB3 3.500 . 3.800 3.555 3.526 3.576 . 0 0 "[ . 1 . 2]" 1
685 1 57 GLU H 1 57 GLU HG2 3.500 . 3.800 2.399 2.168 2.773 . 0 0 "[ . 1 . 2]" 1
686 1 57 GLU H 1 58 ASP H 3.500 . 3.800 2.737 2.644 2.873 . 0 0 "[ . 1 . 2]" 1
687 1 57 GLU H 1 59 ARG H 4.500 . 5.000 4.072 3.923 4.184 . 0 0 "[ . 1 . 2]" 1
688 1 57 GLU H 1 59 ARG HB3 4.500 . 5.000 4.967 4.855 5.079 0.079 4 0 "[ . 1 . 2]" 1
689 1 57 GLU HA 1 59 ARG H 4.500 . 5.000 4.359 4.182 4.538 . 0 0 "[ . 1 . 2]" 1
690 1 57 GLU HA 1 60 TYR HB2 4.500 . 5.000 4.031 3.775 4.196 . 0 0 "[ . 1 . 2]" 1
691 1 57 GLU HA 1 60 TYR HB3 4.500 . 5.000 3.014 2.832 3.315 . 0 0 "[ . 1 . 2]" 1
692 1 57 GLU HA 1 60 TYR QD 4.500 . 5.000 4.331 4.012 4.667 . 0 0 "[ . 1 . 2]" 1
693 1 57 GLU HA 1 112 THR MG 4.500 . 5.000 4.284 3.918 4.548 . 0 0 "[ . 1 . 2]" 1
694 1 57 GLU HA 1 116 MET ME 3.500 . 3.800 2.301 2.210 2.397 . 0 0 "[ . 1 . 2]" 1
695 1 57 GLU HA 1 116 MET HG3 5.200 . 5.700 5.653 5.576 5.741 0.041 12 0 "[ . 1 . 2]" 1
696 1 57 GLU HB2 1 58 ASP H 3.500 . 3.800 2.572 2.446 2.689 . 0 0 "[ . 1 . 2]" 1
697 1 57 GLU HB2 1 58 ASP HA 4.500 . 5.000 4.315 4.189 4.480 . 0 0 "[ . 1 . 2]" 1
698 1 57 GLU HB2 1 58 ASP HB3 4.500 . 5.000 4.546 4.384 4.707 . 0 0 "[ . 1 . 2]" 1
699 1 57 GLU HB2 1 116 MET ME 4.500 . 5.000 3.802 3.702 3.898 . 0 0 "[ . 1 . 2]" 1
700 1 57 GLU HB3 1 58 ASP HA 4.500 . 5.000 4.398 4.263 4.549 . 0 0 "[ . 1 . 2]" 1
701 1 57 GLU HG2 1 116 MET ME 4.500 . 5.000 3.769 3.494 3.984 . 0 0 "[ . 1 . 2]" 1
702 1 58 ASP H 1 58 ASP HB3 3.500 . 3.800 2.248 2.093 2.436 . 0 0 "[ . 1 . 2]" 1
703 1 58 ASP H 1 59 ARG H 3.500 . 3.800 2.545 2.492 2.605 . 0 0 "[ . 1 . 2]" 1
704 1 58 ASP H 1 60 TYR H 5.200 . 5.700 4.298 4.154 4.381 . 0 0 "[ . 1 . 2]" 1
705 1 58 ASP HA 1 61 TYR HB3 4.500 . 5.000 3.074 2.890 3.292 . 0 0 "[ . 1 . 2]" 1
706 1 58 ASP HA 1 116 MET ME 4.500 . 5.000 4.392 4.298 4.557 . 0 0 "[ . 1 . 2]" 1
707 1 58 ASP HB2 1 61 TYR HB3 5.200 . 5.700 5.388 5.108 5.636 . 0 0 "[ . 1 . 2]" 1
708 1 58 ASP HB3 1 59 ARG HA 4.500 . 5.000 4.770 4.581 4.920 . 0 0 "[ . 1 . 2]" 1
709 1 59 ARG H 1 59 ARG HB2 3.500 . 3.800 2.622 2.418 2.832 . 0 0 "[ . 1 . 2]" 1
710 1 59 ARG H 1 59 ARG HB3 3.500 . 3.800 2.329 2.168 2.477 . 0 0 "[ . 1 . 2]" 1
711 1 59 ARG H 1 59 ARG HG3 4.500 . 5.000 4.363 4.212 4.475 . 0 0 "[ . 1 . 2]" 1
712 1 59 ARG H 1 60 TYR HB3 4.500 . 5.000 5.022 4.966 5.135 0.135 4 0 "[ . 1 . 2]" 1
713 1 59 ARG H 1 61 TYR H 4.500 . 5.000 4.167 4.036 4.274 . 0 0 "[ . 1 . 2]" 1
714 1 59 ARG HA 1 59 ARG QD 3.500 . 3.800 2.350 2.164 2.453 . 0 0 "[ . 1 . 2]" 1
715 1 59 ARG HA 1 59 ARG HG3 3.500 . 3.800 3.217 2.904 3.448 . 0 0 "[ . 1 . 2]" 1
716 1 59 ARG HA 1 63 GLU HG3 4.500 . 5.000 4.850 4.703 5.004 0.004 10 0 "[ . 1 . 2]" 1
717 1 59 ARG HB2 1 59 ARG QD 3.500 . 3.800 2.614 2.234 3.080 . 0 0 "[ . 1 . 2]" 1
718 1 59 ARG HB3 1 60 TYR H 3.500 . 3.800 2.285 2.071 2.479 . 0 0 "[ . 1 . 2]" 1
719 1 59 ARG HB3 1 61 TYR H 4.500 . 5.000 4.847 4.648 5.010 0.010 6 0 "[ . 1 . 2]" 1
720 1 59 ARG QD 1 60 TYR H 4.500 . 5.000 4.537 4.330 4.749 . 0 0 "[ . 1 . 2]" 1
721 1 59 ARG QD 1 63 GLU H 5.200 . 5.700 5.434 4.805 5.751 0.051 20 0 "[ . 1 . 2]" 1
722 1 59 ARG QD 1 63 GLU HG3 4.500 . 5.000 4.073 3.454 4.474 . 0 0 "[ . 1 . 2]" 1
723 1 59 ARG HG3 1 63 GLU HG2 4.500 . 5.000 4.565 4.300 4.867 . 0 0 "[ . 1 . 2]" 1
724 1 59 ARG HG3 1 63 GLU HG3 4.500 . 5.000 3.478 3.273 3.803 . 0 0 "[ . 1 . 2]" 1
725 1 60 TYR H 1 60 TYR HB3 3.500 . 3.800 2.605 2.517 2.735 . 0 0 "[ . 1 . 2]" 1
726 1 60 TYR H 1 61 TYR H 3.500 . 3.800 2.781 2.701 2.885 . 0 0 "[ . 1 . 2]" 1
727 1 60 TYR H 1 62 ARG H 5.200 . 5.700 4.407 4.343 4.453 . 0 0 "[ . 1 . 2]" 1
728 1 60 TYR HA 1 60 TYR QD 3.500 . 3.800 2.057 1.966 2.157 . 0 0 "[ . 1 . 2]" 1
729 1 60 TYR HA 1 60 TYR QE 4.500 . 5.000 4.267 4.204 4.331 . 0 0 "[ . 1 . 2]" 1
730 1 60 TYR HA 1 63 GLU HB2 3.500 . 3.800 3.032 2.849 3.207 . 0 0 "[ . 1 . 2]" 1
731 1 60 TYR HA 1 63 GLU HG2 4.500 . 5.000 4.096 3.965 4.202 . 0 0 "[ . 1 . 2]" 1
732 1 60 TYR HA 1 63 GLU HG3 4.500 . 5.000 2.461 2.242 2.657 . 0 0 "[ . 1 . 2]" 1
733 1 60 TYR HA 1 116 MET ME 4.500 . 5.000 4.763 4.624 4.902 . 0 0 "[ . 1 . 2]" 1
734 1 60 TYR HB2 1 61 TYR H 4.500 . 5.000 3.996 3.875 4.044 . 0 0 "[ . 1 . 2]" 1
735 1 60 TYR HB2 1 116 MET ME 4.500 . 5.000 4.073 3.892 4.264 . 0 0 "[ . 1 . 2]" 1
736 1 60 TYR HB3 1 61 TYR H 4.500 . 5.000 2.840 2.775 2.894 . 0 0 "[ . 1 . 2]" 1
737 1 60 TYR HB3 1 61 TYR HA 4.500 . 5.000 4.304 4.160 4.370 . 0 0 "[ . 1 . 2]" 1
738 1 60 TYR HB3 1 112 THR MG 4.500 . 5.000 3.941 3.618 4.082 . 0 0 "[ . 1 . 2]" 1
739 1 60 TYR HB3 1 116 MET ME 4.500 . 5.000 2.543 2.366 2.741 . 0 0 "[ . 1 . 2]" 1
740 1 60 TYR QD 1 63 GLU HB3 3.500 . 3.800 3.776 3.649 3.822 0.022 10 0 "[ . 1 . 2]" 1
741 1 60 TYR QD 1 63 GLU HG2 4.500 . 5.000 4.374 4.243 4.448 . 0 0 "[ . 1 . 2]" 1
742 1 60 TYR QD 1 112 THR MG 4.500 . 5.000 2.369 2.180 2.682 . 0 0 "[ . 1 . 2]" 1
743 1 60 TYR QD 1 113 ASP H 5.200 . 5.700 5.595 5.298 5.721 0.021 6 0 "[ . 1 . 2]" 1
744 1 60 TYR QD 1 116 MET ME 3.500 . 3.800 2.668 2.347 3.038 . 0 0 "[ . 1 . 2]" 1
745 1 60 TYR QE 1 63 GLU HA 5.200 . 5.700 5.801 5.753 5.980 0.280 4 0 "[ . 1 . 2]" 1
746 1 60 TYR QE 1 63 GLU HB3 3.500 . 3.800 3.639 3.551 3.745 . 0 0 "[ . 1 . 2]" 1
747 1 60 TYR QE 1 112 THR MG 3.500 . 3.800 2.916 2.611 3.782 . 0 0 "[ . 1 . 2]" 1
748 1 60 TYR QE 1 113 ASP HA 4.500 . 5.000 4.023 3.503 4.582 . 0 0 "[ . 1 . 2]" 1
749 1 61 TYR H 1 61 TYR HB2 3.500 . 3.800 2.793 2.732 2.880 . 0 0 "[ . 1 . 2]" 1
750 1 61 TYR H 1 61 TYR HB3 3.500 . 3.800 2.229 2.179 2.343 . 0 0 "[ . 1 . 2]" 1
751 1 61 TYR H 1 61 TYR QD 4.500 . 5.000 4.102 4.060 4.203 . 0 0 "[ . 1 . 2]" 1
752 1 61 TYR H 1 62 ARG H 3.500 . 3.800 2.831 2.797 2.921 . 0 0 "[ . 1 . 2]" 1
753 1 61 TYR H 1 64 ASN HD22 4.500 . 5.000 4.354 4.238 4.440 . 0 0 "[ . 1 . 2]" 1
754 1 61 TYR H 1 116 MET ME 3.500 . 3.800 2.786 2.657 3.026 . 0 0 "[ . 1 . 2]" 1
755 1 61 TYR HA 1 61 TYR QE 5.200 . 5.700 4.799 4.683 4.863 . 0 0 "[ . 1 . 2]" 1
756 1 61 TYR HA 1 65 MET HG3 4.500 . 5.000 5.000 4.922 5.034 0.034 4 0 "[ . 1 . 2]" 1
757 1 61 TYR HB2 1 62 ARG H 4.500 . 5.000 4.062 3.977 4.221 . 0 0 "[ . 1 . 2]" 1
758 1 61 TYR HB2 1 62 ARG HA 5.200 . 5.700 5.471 5.431 5.554 . 0 0 "[ . 1 . 2]" 1
759 1 61 TYR HB2 1 63 GLU H 5.200 . 5.700 5.699 5.632 5.804 0.104 12 0 "[ . 1 . 2]" 1
760 1 61 TYR HB2 1 64 ASN HD22 4.500 . 5.000 5.037 5.015 5.180 0.180 4 0 "[ . 1 . 2]" 1
761 1 61 TYR HB2 1 68 TYR QE 4.500 . 5.000 4.497 4.185 4.701 . 0 0 "[ . 1 . 2]" 1
762 1 61 TYR HB2 1 116 MET ME 3.500 . 3.800 2.862 2.738 3.095 . 0 0 "[ . 1 . 2]" 1
763 1 61 TYR HB3 1 61 TYR QE 4.500 . 5.000 4.419 4.384 4.439 . 0 0 "[ . 1 . 2]" 1
764 1 61 TYR HB3 1 62 ARG H 3.500 . 3.800 2.760 2.639 2.923 . 0 0 "[ . 1 . 2]" 1
765 1 61 TYR HB3 1 65 MET ME 4.500 . 5.000 5.050 5.004 5.091 0.091 6 0 "[ . 1 . 2]" 1
766 1 61 TYR HB3 1 116 MET ME 4.500 . 5.000 3.687 3.548 3.954 . 0 0 "[ . 1 . 2]" 1
767 1 61 TYR HB3 1 116 MET HG3 5.200 . 5.700 5.229 4.964 5.423 . 0 0 "[ . 1 . 2]" 1
768 1 61 TYR QD 1 68 TYR QE 4.500 . 5.000 2.576 2.216 2.859 . 0 0 "[ . 1 . 2]" 1
769 1 61 TYR QD 1 116 MET HA 4.500 . 5.000 4.212 4.055 4.366 . 0 0 "[ . 1 . 2]" 1
770 1 61 TYR QD 1 116 MET HB2 4.500 . 5.000 4.177 4.028 4.291 . 0 0 "[ . 1 . 2]" 1
771 1 61 TYR QD 1 116 MET ME 4.500 . 5.000 4.328 4.190 4.458 . 0 0 "[ . 1 . 2]" 1
772 1 61 TYR QD 1 116 MET HG2 5.200 . 5.700 5.078 4.910 5.233 . 0 0 "[ . 1 . 2]" 1
773 1 61 TYR QD 1 116 MET HG3 4.500 . 5.000 4.008 3.830 4.178 . 0 0 "[ . 1 . 2]" 1
774 1 61 TYR QD 1 120 VAL MG2 4.500 . 5.000 3.099 2.996 3.207 . 0 0 "[ . 1 . 2]" 1
775 1 61 TYR QE 1 62 ARG H 5.200 . 5.700 5.051 4.974 5.244 . 0 0 "[ . 1 . 2]" 1
776 1 61 TYR QE 1 62 ARG HB3 5.200 . 5.700 5.280 5.185 5.483 . 0 0 "[ . 1 . 2]" 1
777 1 61 TYR QE 1 64 ASN HD21 5.200 . 5.700 5.660 5.493 5.797 0.097 4 0 "[ . 1 . 2]" 1
778 1 61 TYR QE 1 65 MET HA 3.500 . 3.800 3.771 3.667 3.817 0.017 2 0 "[ . 1 . 2]" 1
779 1 61 TYR QE 1 65 MET ME 3.500 . 3.800 2.718 2.639 2.852 . 0 0 "[ . 1 . 2]" 1
780 1 61 TYR QE 1 65 MET HG2 3.500 . 3.800 3.042 2.960 3.141 . 0 0 "[ . 1 . 2]" 1
781 1 61 TYR QE 1 65 MET HG3 4.500 . 5.000 2.929 2.812 3.017 . 0 0 "[ . 1 . 2]" 1
782 1 61 TYR QE 1 68 TYR QE 4.500 . 5.000 3.903 3.661 4.171 . 0 0 "[ . 1 . 2]" 1
783 1 61 TYR QE 1 120 VAL H 5.200 . 5.700 4.720 4.568 4.986 . 0 0 "[ . 1 . 2]" 1
784 1 61 TYR QE 1 120 VAL MG1 3.500 . 3.800 2.783 2.669 3.037 . 0 0 "[ . 1 . 2]" 1
785 1 61 TYR QE 1 120 VAL MG2 3.500 . 3.800 1.908 1.886 1.937 . 0 0 "[ . 1 . 2]" 1
786 1 62 ARG H 1 62 ARG HG2 3.500 . 3.800 3.162 2.759 3.372 . 0 0 "[ . 1 . 2]" 1
787 1 62 ARG H 1 62 ARG HG3 3.500 . 3.800 2.278 2.175 2.428 . 0 0 "[ . 1 . 2]" 1
788 1 62 ARG H 1 63 GLU HG3 4.500 . 5.000 3.924 3.781 4.053 . 0 0 "[ . 1 . 2]" 1
789 1 62 ARG H 1 64 ASN H 4.500 . 5.000 4.464 4.391 4.559 . 0 0 "[ . 1 . 2]" 1
790 1 62 ARG H 1 64 ASN HD22 4.500 . 5.000 4.989 4.908 5.037 0.037 4 0 "[ . 1 . 2]" 1
791 1 62 ARG H 1 116 MET ME 4.500 . 5.000 5.023 4.891 5.276 0.276 4 0 "[ . 1 . 2]" 1
792 1 62 ARG HA 1 62 ARG QD 4.500 . 5.000 3.941 3.521 4.167 . 0 0 "[ . 1 . 2]" 1
793 1 62 ARG HA 1 62 ARG HG2 3.500 . 3.800 2.430 2.358 2.508 . 0 0 "[ . 1 . 2]" 1
794 1 62 ARG HA 1 62 ARG HG3 3.500 . 3.800 3.289 3.082 3.534 . 0 0 "[ . 1 . 2]" 1
795 1 62 ARG HA 1 64 ASN H 4.500 . 5.000 4.198 3.983 4.319 . 0 0 "[ . 1 . 2]" 1
796 1 62 ARG HA 1 65 MET H 4.500 . 5.000 3.417 3.295 3.523 . 0 0 "[ . 1 . 2]" 1
797 1 62 ARG HA 1 65 MET HB3 4.500 . 5.000 4.098 3.945 4.246 . 0 0 "[ . 1 . 2]" 1
798 1 62 ARG HA 1 65 MET ME 3.500 . 3.800 2.053 2.004 2.134 . 0 0 "[ . 1 . 2]" 1
799 1 62 ARG HA 1 65 MET HG3 4.500 . 5.000 2.633 2.492 2.857 . 0 0 "[ . 1 . 2]" 1
800 1 62 ARG HB3 1 62 ARG QD 3.500 . 3.800 2.483 2.258 2.751 . 0 0 "[ . 1 . 2]" 1
801 1 62 ARG HB3 1 65 MET ME 2.500 . 2.800 2.577 2.439 2.747 . 0 0 "[ . 1 . 2]" 1
802 1 62 ARG HB3 1 65 MET HG3 4.500 . 5.000 4.827 4.698 5.041 0.041 12 0 "[ . 1 . 2]" 1
803 1 62 ARG QD 1 65 MET ME 3.500 . 3.800 3.023 2.416 3.384 . 0 0 "[ . 1 . 2]" 1
804 1 62 ARG HG2 1 65 MET ME 2.500 . 2.800 2.043 1.945 2.339 . 0 0 "[ . 1 . 2]" 1
805 1 63 GLU H 1 63 GLU HB2 3.500 . 3.800 2.460 2.394 2.547 . 0 0 "[ . 1 . 2]" 1
806 1 63 GLU H 1 63 GLU HG2 3.500 . 3.800 3.343 3.061 3.561 . 0 0 "[ . 1 . 2]" 1
807 1 63 GLU H 1 63 GLU HG3 3.500 . 3.800 2.266 2.179 2.365 . 0 0 "[ . 1 . 2]" 1
808 1 63 GLU H 1 64 ASN H 3.500 . 3.800 2.567 2.483 2.750 . 0 0 "[ . 1 . 2]" 1
809 1 63 GLU H 1 64 ASN HD21 4.500 . 5.000 4.464 4.373 4.571 . 0 0 "[ . 1 . 2]" 1
810 1 63 GLU H 1 64 ASN HD22 4.500 . 5.000 3.870 3.796 3.995 . 0 0 "[ . 1 . 2]" 1
811 1 63 GLU HA 1 63 GLU HG2 3.500 . 3.800 2.375 2.302 2.497 . 0 0 "[ . 1 . 2]" 1
812 1 63 GLU HA 1 63 GLU HG3 3.500 . 3.800 3.094 2.958 3.227 . 0 0 "[ . 1 . 2]" 1
813 1 63 GLU HA 1 64 ASN HD22 5.200 . 5.700 5.776 5.735 5.860 0.160 12 0 "[ . 1 . 2]" 1
814 1 63 GLU HA 1 65 MET H 4.500 . 5.000 3.986 3.859 4.173 . 0 0 "[ . 1 . 2]" 1
815 1 63 GLU HB2 1 64 ASN H 4.500 . 5.000 2.858 2.766 3.134 . 0 0 "[ . 1 . 2]" 1
816 1 63 GLU HB2 1 64 ASN HD21 4.500 . 5.000 4.622 4.531 4.896 . 0 0 "[ . 1 . 2]" 1
817 1 63 GLU HB2 1 64 ASN HD22 4.500 . 5.000 3.540 3.440 3.786 . 0 0 "[ . 1 . 2]" 1
818 1 63 GLU HG3 1 64 ASN H 4.500 . 5.000 4.376 4.261 4.502 . 0 0 "[ . 1 . 2]" 1
819 1 64 ASN H 1 64 ASN HD21 3.500 . 3.800 2.684 2.568 2.858 . 0 0 "[ . 1 . 2]" 1
820 1 64 ASN H 1 64 ASN HD22 4.500 . 5.000 2.846 2.734 3.068 . 0 0 "[ . 1 . 2]" 1
821 1 64 ASN H 1 65 MET H 3.500 . 3.800 2.352 2.128 2.419 . 0 0 "[ . 1 . 2]" 1
822 1 64 ASN H 1 65 MET HA 4.500 . 5.000 4.434 4.279 4.555 . 0 0 "[ . 1 . 2]" 1
823 1 64 ASN H 1 65 MET HB2 4.500 . 5.000 4.109 3.842 4.230 . 0 0 "[ . 1 . 2]" 1
824 1 64 ASN H 1 65 MET HB3 5.200 . 5.700 5.564 5.240 5.701 0.001 14 0 "[ . 1 . 2]" 1
825 1 64 ASN H 1 65 MET HG3 4.500 . 5.000 5.018 4.970 5.044 0.044 11 0 "[ . 1 . 2]" 1
826 1 64 ASN HA 1 64 ASN HD22 5.200 . 5.700 4.886 4.834 4.994 . 0 0 "[ . 1 . 2]" 1
827 1 64 ASN HA 1 66 HIS H 4.500 . 5.000 3.694 3.562 3.894 . 0 0 "[ . 1 . 2]" 1
828 1 64 ASN HA 1 67 ARG HD2 4.500 . 5.000 2.995 2.400 3.577 . 0 0 "[ . 1 . 2]" 1
829 1 64 ASN HA 1 67 ARG HD3 4.500 . 5.000 2.923 2.462 3.451 . 0 0 "[ . 1 . 2]" 1
830 1 64 ASN HA 1 67 ARG HG2 5.200 . 5.700 5.370 5.091 5.707 0.007 3 0 "[ . 1 . 2]" 1
831 1 64 ASN HB2 1 67 ARG HB2 4.500 . 5.000 3.592 3.443 3.777 . 0 0 "[ . 1 . 2]" 1
832 1 64 ASN HB2 1 67 ARG HD2 4.500 . 5.000 4.353 3.799 5.008 0.008 2 0 "[ . 1 . 2]" 1
833 1 64 ASN HB2 1 67 ARG HD3 4.500 . 5.000 3.295 3.011 3.597 . 0 0 "[ . 1 . 2]" 1
834 1 64 ASN HB2 1 116 MET HG3 5.200 . 5.700 5.003 4.739 5.231 . 0 0 "[ . 1 . 2]" 1
835 1 64 ASN HB3 1 67 ARG HB2 4.500 . 5.000 3.792 3.524 4.350 . 0 0 "[ . 1 . 2]" 1
836 1 64 ASN HD21 1 65 MET H 5.200 . 5.700 4.078 3.874 4.194 . 0 0 "[ . 1 . 2]" 1
837 1 64 ASN HD21 1 65 MET HA 4.500 . 5.000 4.584 4.357 4.807 . 0 0 "[ . 1 . 2]" 1
838 1 64 ASN HD21 1 67 ARG HB2 5.200 . 5.700 5.645 5.480 5.720 0.020 17 0 "[ . 1 . 2]" 1
839 1 64 ASN HD21 1 116 MET HG3 4.500 . 5.000 3.178 2.952 3.368 . 0 0 "[ . 1 . 2]" 1
840 1 64 ASN HD21 1 120 VAL MG2 5.200 . 5.700 5.772 5.713 5.936 0.236 4 0 "[ . 1 . 2]" 1
841 1 64 ASN HD22 1 65 MET H 4.500 . 5.000 4.934 4.767 5.034 0.034 4 0 "[ . 1 . 2]" 1
842 1 64 ASN HD22 1 113 ASP HA 4.500 . 5.000 4.585 4.434 4.761 . 0 0 "[ . 1 . 2]" 1
843 1 64 ASN HD22 1 113 ASP HB3 5.200 . 5.700 5.739 5.711 5.822 0.122 4 0 "[ . 1 . 2]" 1
844 1 64 ASN HD22 1 116 MET HB2 4.500 . 5.000 4.791 4.626 4.996 . 0 0 "[ . 1 . 2]" 1
845 1 64 ASN HD22 1 116 MET ME 3.500 . 3.800 3.820 3.721 3.919 0.119 4 0 "[ . 1 . 2]" 1
846 1 64 ASN HD22 1 116 MET HG3 3.500 . 3.800 3.221 3.083 3.356 . 0 0 "[ . 1 . 2]" 1
847 1 65 MET H 1 65 MET HB2 3.500 . 3.800 2.038 2.008 2.066 . 0 0 "[ . 1 . 2]" 1
848 1 65 MET H 1 65 MET HB3 3.500 . 3.800 3.250 3.164 3.319 . 0 0 "[ . 1 . 2]" 1
849 1 65 MET H 1 65 MET HG3 3.500 . 3.800 3.536 3.454 3.704 . 0 0 "[ . 1 . 2]" 1
850 1 65 MET HA 1 65 MET ME 4.500 . 5.000 4.344 4.281 4.391 . 0 0 "[ . 1 . 2]" 1
851 1 65 MET HA 1 68 TYR H 4.500 . 5.000 3.440 3.312 3.647 . 0 0 "[ . 1 . 2]" 1
852 1 65 MET HA 1 68 TYR HA 5.200 . 5.700 5.560 5.248 5.752 0.052 4 0 "[ . 1 . 2]" 1
853 1 65 MET HA 1 68 TYR HB3 4.500 . 5.000 4.644 4.299 4.881 . 0 0 "[ . 1 . 2]" 1
854 1 65 MET HA 1 68 TYR QD 3.500 . 3.800 2.486 2.396 2.584 . 0 0 "[ . 1 . 2]" 1
855 1 65 MET HA 1 68 TYR QE 4.500 . 5.000 3.617 3.458 3.888 . 0 0 "[ . 1 . 2]" 1
856 1 65 MET HA 1 120 VAL MG1 5.200 . 5.700 5.130 4.848 5.538 . 0 0 "[ . 1 . 2]" 1
857 1 65 MET HB2 1 65 MET ME 3.500 . 3.800 2.396 2.326 2.453 . 0 0 "[ . 1 . 2]" 1
858 1 65 MET HB3 1 65 MET ME 4.500 . 5.000 2.963 2.871 3.092 . 0 0 "[ . 1 . 2]" 1
859 1 65 MET HB3 1 66 HIS H 4.500 . 5.000 3.053 2.903 3.159 . 0 0 "[ . 1 . 2]" 1
860 1 65 MET HB3 1 66 HIS HB2 4.500 . 5.000 4.460 4.278 4.806 . 0 0 "[ . 1 . 2]" 1
861 1 65 MET HB3 1 68 TYR H 5.200 . 5.700 5.077 4.977 5.272 . 0 0 "[ . 1 . 2]" 1
862 1 65 MET ME 1 65 MET HG2 3.500 . 3.800 3.373 3.330 3.452 . 0 0 "[ . 1 . 2]" 1
863 1 65 MET ME 1 65 MET HG3 3.500 . 3.800 2.391 2.338 2.468 . 0 0 "[ . 1 . 2]" 1
864 1 65 MET ME 1 120 VAL MG1 4.500 . 5.000 5.042 4.881 5.188 0.188 4 0 "[ . 1 . 2]" 1
865 1 65 MET HG2 1 68 TYR H 5.200 . 5.700 4.709 4.517 4.947 . 0 0 "[ . 1 . 2]" 1
866 1 65 MET HG2 1 68 TYR QD 3.500 . 3.800 3.279 3.107 3.495 . 0 0 "[ . 1 . 2]" 1
867 1 65 MET HG3 1 120 VAL MG2 4.500 . 5.000 4.333 4.155 4.487 . 0 0 "[ . 1 . 2]" 1
868 1 66 HIS H 1 66 HIS HB2 3.500 . 3.800 2.314 2.163 2.533 . 0 0 "[ . 1 . 2]" 1
869 1 66 HIS H 1 66 HIS HB3 3.500 . 3.800 2.820 2.575 3.581 . 0 0 "[ . 1 . 2]" 1
870 1 66 HIS H 1 67 ARG H 3.500 . 3.800 2.705 2.616 2.742 . 0 0 "[ . 1 . 2]" 1
871 1 66 HIS H 1 67 ARG HD3 5.200 . 5.700 4.844 4.049 5.509 . 0 0 "[ . 1 . 2]" 1
872 1 67 ARG H 1 67 ARG HB2 3.500 . 3.800 2.373 2.307 2.431 . 0 0 "[ . 1 . 2]" 1
873 1 67 ARG H 1 67 ARG HB3 3.500 . 3.800 3.606 3.569 3.640 . 0 0 "[ . 1 . 2]" 1
874 1 67 ARG H 1 67 ARG HD2 3.500 . 3.800 2.656 2.276 3.584 . 0 0 "[ . 1 . 2]" 1
875 1 67 ARG H 1 67 ARG HD3 3.500 . 3.800 3.259 2.545 3.824 0.024 17 0 "[ . 1 . 2]" 1
876 1 67 ARG H 1 67 ARG HG2 4.500 . 5.000 4.250 4.174 4.311 . 0 0 "[ . 1 . 2]" 1
877 1 67 ARG H 1 68 TYR H 3.500 . 3.800 2.389 2.269 2.507 . 0 0 "[ . 1 . 2]" 1
878 1 67 ARG H 1 68 TYR QD 4.500 . 5.000 4.334 4.128 4.522 . 0 0 "[ . 1 . 2]" 1
879 1 67 ARG HA 1 67 ARG HD2 4.500 . 5.000 3.875 3.413 4.388 . 0 0 "[ . 1 . 2]" 1
880 1 67 ARG HA 1 67 ARG HD3 4.500 . 5.000 4.423 4.111 4.648 . 0 0 "[ . 1 . 2]" 1
881 1 67 ARG HA 1 67 ARG HG3 3.500 . 3.800 2.399 2.242 2.502 . 0 0 "[ . 1 . 2]" 1
882 1 67 ARG HA 1 68 TYR QD 4.500 . 5.000 4.729 4.530 4.940 . 0 0 "[ . 1 . 2]" 1
883 1 67 ARG HA 1 109 PHE QE 4.500 . 5.000 4.580 4.380 4.900 . 0 0 "[ . 1 . 2]" 1
884 1 67 ARG HB2 1 68 TYR H 3.500 . 3.800 3.239 2.663 3.499 . 0 0 "[ . 1 . 2]" 1
885 1 67 ARG HB2 1 68 TYR HA 4.500 . 5.000 4.444 4.245 4.679 . 0 0 "[ . 1 . 2]" 1
886 1 67 ARG HB2 1 68 TYR QD 4.500 . 5.000 3.248 2.997 3.459 . 0 0 "[ . 1 . 2]" 1
887 1 67 ARG HB2 1 68 TYR QE 3.500 . 3.800 3.338 3.177 3.500 . 0 0 "[ . 1 . 2]" 1
888 1 67 ARG HB2 1 109 PHE QE 4.500 . 5.000 2.788 2.613 2.867 . 0 0 "[ . 1 . 2]" 1
889 1 67 ARG HB3 1 68 TYR H 4.500 . 5.000 3.984 3.500 4.143 . 0 0 "[ . 1 . 2]" 1
890 1 67 ARG HB3 1 68 TYR QD 3.500 . 3.800 3.366 3.247 3.505 . 0 0 "[ . 1 . 2]" 1
891 1 67 ARG HB3 1 68 TYR QE 3.500 . 3.800 3.810 3.695 3.843 0.043 13 0 "[ . 1 . 2]" 1
892 1 67 ARG HB3 1 109 PHE QD 4.500 . 5.000 4.484 4.276 4.787 . 0 0 "[ . 1 . 2]" 1
893 1 67 ARG HB3 1 109 PHE HZ 4.500 . 5.000 2.634 2.392 2.878 . 0 0 "[ . 1 . 2]" 1
894 1 67 ARG HD2 1 68 TYR H 5.200 . 5.700 4.901 4.583 5.893 0.193 2 0 "[ . 1 . 2]" 1
895 1 67 ARG HD2 1 109 PHE QE 5.200 . 5.700 5.013 4.531 5.635 . 0 0 "[ . 1 . 2]" 1
896 1 67 ARG HG2 1 68 TYR QE 4.500 . 5.000 4.998 4.802 5.156 0.156 4 0 "[ . 1 . 2]" 1
897 1 68 TYR HA 1 68 TYR QE 4.500 . 5.000 4.476 4.439 4.545 . 0 0 "[ . 1 . 2]" 1
898 1 68 TYR HA 1 69 PRO HB3 4.500 . 5.000 4.847 4.815 4.972 . 0 0 "[ . 1 . 2]" 1
899 1 68 TYR HA 1 69 PRO HG2 4.500 . 5.000 4.561 4.509 4.626 . 0 0 "[ . 1 . 2]" 1
900 1 68 TYR HA 1 69 PRO HG3 5.200 . 5.700 4.633 4.588 4.772 . 0 0 "[ . 1 . 2]" 1
901 1 68 TYR HA 1 95 ILE MG 5.200 . 5.700 5.826 5.732 5.906 0.206 17 0 "[ . 1 . 2]" 1
902 1 68 TYR HA 1 117 MET HA 4.500 . 5.000 4.308 4.161 4.512 . 0 0 "[ . 1 . 2]" 1
903 1 68 TYR HA 1 117 MET QB 5.200 . 5.700 4.487 4.261 4.773 . 0 0 "[ . 1 . 2]" 1
904 1 68 TYR HA 1 117 MET ME 4.500 . 5.000 3.860 3.420 4.591 . 0 0 "[ . 1 . 2]" 1
905 1 68 TYR HB2 1 69 PRO HD2 4.500 . 5.000 3.876 3.696 4.024 . 0 0 "[ . 1 . 2]" 1
906 1 68 TYR HB2 1 69 PRO HG2 5.200 . 5.700 5.362 5.027 5.547 . 0 0 "[ . 1 . 2]" 1
907 1 68 TYR HB2 1 117 MET HG2 4.500 . 5.000 4.937 4.489 5.018 0.018 9 0 "[ . 1 . 2]" 1
908 1 68 TYR HB2 1 120 VAL MG1 5.200 . 5.700 3.869 3.620 4.237 . 0 0 "[ . 1 . 2]" 1
909 1 68 TYR HB2 1 120 VAL MG2 4.500 . 5.000 2.981 2.787 3.226 . 0 0 "[ . 1 . 2]" 1
910 1 68 TYR HB3 1 69 PRO HG2 4.500 . 5.000 4.120 3.949 4.314 . 0 0 "[ . 1 . 2]" 1
911 1 68 TYR HB3 1 69 PRO HG3 5.200 . 5.700 5.026 4.883 5.222 . 0 0 "[ . 1 . 2]" 1
912 1 68 TYR HB3 1 117 MET QB 5.200 . 5.700 4.356 4.123 4.780 . 0 0 "[ . 1 . 2]" 1
913 1 68 TYR HB3 1 117 MET ME 5.200 . 5.700 4.922 4.627 5.531 . 0 0 "[ . 1 . 2]" 1
914 1 68 TYR HB3 1 117 MET HG3 4.500 . 5.000 2.886 2.593 3.727 . 0 0 "[ . 1 . 2]" 1
915 1 68 TYR HB3 1 120 VAL MG1 5.200 . 5.700 3.954 3.696 4.372 . 0 0 "[ . 1 . 2]" 1
916 1 68 TYR HB3 1 120 VAL MG2 4.500 . 5.000 2.668 2.501 3.112 . 0 0 "[ . 1 . 2]" 1
917 1 68 TYR QD 1 109 PHE QE 4.500 . 5.000 3.253 2.583 3.772 . 0 0 "[ . 1 . 2]" 1
918 1 68 TYR QD 1 117 MET QB 5.200 . 5.700 3.447 3.069 4.129 . 0 0 "[ . 1 . 2]" 1
919 1 68 TYR QD 1 117 MET HG2 3.500 . 3.800 3.700 2.946 3.831 0.031 17 0 "[ . 1 . 2]" 1
920 1 68 TYR QD 1 117 MET HG3 3.500 . 3.800 2.128 2.048 2.224 . 0 0 "[ . 1 . 2]" 1
921 1 68 TYR QD 1 120 VAL MG1 4.500 . 5.000 4.088 3.891 4.386 . 0 0 "[ . 1 . 2]" 1
922 1 68 TYR QD 1 120 VAL MG2 3.500 . 3.800 2.497 2.311 2.657 . 0 0 "[ . 1 . 2]" 1
923 1 68 TYR QE 1 109 PHE QD 3.500 . 3.800 2.659 2.461 3.028 . 0 0 "[ . 1 . 2]" 1
924 1 68 TYR QE 1 109 PHE HZ 4.500 . 5.000 4.673 4.407 4.907 . 0 0 "[ . 1 . 2]" 1
925 1 68 TYR QE 1 113 ASP HA 4.500 . 5.000 3.813 3.571 4.101 . 0 0 "[ . 1 . 2]" 1
926 1 68 TYR QE 1 113 ASP HB3 5.200 . 5.700 2.746 2.376 3.292 . 0 0 "[ . 1 . 2]" 1
927 1 68 TYR QE 1 116 MET HB2 4.500 . 5.000 2.948 2.847 3.104 . 0 0 "[ . 1 . 2]" 1
928 1 69 PRO HA 1 70 ASN H 3.500 . 3.800 2.230 2.132 2.280 . 0 0 "[ . 1 . 2]" 1
929 1 69 PRO HA 1 70 ASN HD21 5.200 . 5.700 4.219 3.072 5.976 0.276 12 0 "[ . 1 . 2]" 1
930 1 69 PRO HA 1 71 GLN H 3.500 . 3.800 3.735 3.535 3.805 0.005 20 0 "[ . 1 . 2]" 1
931 1 69 PRO HA 1 71 GLN HB2 5.200 . 5.700 5.272 5.112 5.388 . 0 0 "[ . 1 . 2]" 1
932 1 69 PRO HB2 1 70 ASN H 3.500 . 3.800 2.999 2.872 3.127 . 0 0 "[ . 1 . 2]" 1
933 1 69 PRO HB2 1 71 GLN H 3.500 . 3.800 2.335 2.169 2.523 . 0 0 "[ . 1 . 2]" 1
934 1 69 PRO HB2 1 98 HIS HB2 5.200 . 5.700 5.379 5.191 5.626 . 0 0 "[ . 1 . 2]" 1
935 1 69 PRO HB3 1 70 ASN H 4.500 . 5.000 3.670 3.601 3.806 . 0 0 "[ . 1 . 2]" 1
936 1 69 PRO HD2 1 117 MET QB 4.500 . 5.000 4.204 3.957 4.331 . 0 0 "[ . 1 . 2]" 1
937 1 69 PRO HD2 1 117 MET ME 4.500 . 5.000 4.529 4.308 4.886 . 0 0 "[ . 1 . 2]" 1
938 1 69 PRO HD2 1 117 MET HG3 4.500 . 5.000 2.759 2.507 3.699 . 0 0 "[ . 1 . 2]" 1
939 1 69 PRO HD2 1 121 VAL MG2 5.200 . 5.700 5.281 5.153 5.427 . 0 0 "[ . 1 . 2]" 1
940 1 69 PRO HD3 1 117 MET QB 5.200 . 5.700 4.909 4.664 5.095 . 0 0 "[ . 1 . 2]" 1
941 1 69 PRO HD3 1 117 MET HG2 4.500 . 5.000 3.150 2.825 3.416 . 0 0 "[ . 1 . 2]" 1
942 1 69 PRO HG2 1 70 ASN H 4.500 . 5.000 4.623 4.523 4.709 . 0 0 "[ . 1 . 2]" 1
943 1 69 PRO HG2 1 71 GLN H 4.500 . 5.000 4.096 3.905 4.229 . 0 0 "[ . 1 . 2]" 1
944 1 69 PRO HG2 1 98 HIS HB2 5.200 . 5.700 4.880 4.744 4.995 . 0 0 "[ . 1 . 2]" 1
945 1 69 PRO HG2 1 98 HIS HB3 4.500 . 5.000 5.021 4.996 5.123 0.123 4 0 "[ . 1 . 2]" 1
946 1 69 PRO HG3 1 95 ILE HA 4.500 . 5.000 3.850 3.467 4.083 . 0 0 "[ . 1 . 2]" 1
947 1 69 PRO HG3 1 98 HIS H 5.200 . 5.700 5.143 4.932 5.312 . 0 0 "[ . 1 . 2]" 1
948 1 69 PRO HG3 1 98 HIS HB2 4.500 . 5.000 3.159 3.008 3.277 . 0 0 "[ . 1 . 2]" 1
949 1 70 ASN H 1 71 GLN H 3.500 . 3.800 2.294 2.132 2.432 . 0 0 "[ . 1 . 2]" 1
950 1 70 ASN H 1 71 GLN HB2 5.200 . 5.700 3.984 3.790 4.112 . 0 0 "[ . 1 . 2]" 1
951 1 70 ASN H 1 124 MET ME 4.500 . 5.000 4.203 4.074 4.433 . 0 0 "[ . 1 . 2]" 1
952 1 70 ASN HA 1 70 ASN HD22 5.200 . 5.700 5.098 5.038 5.148 . 0 0 "[ . 1 . 2]" 1
953 1 70 ASN HA 1 124 MET ME 3.500 . 3.800 2.300 2.111 2.496 . 0 0 "[ . 1 . 2]" 1
954 1 70 ASN HB2 1 71 GLN H 4.500 . 5.000 4.456 4.403 4.529 . 0 0 "[ . 1 . 2]" 1
955 1 70 ASN HB2 1 124 MET ME 4.500 . 5.000 4.350 4.021 4.512 . 0 0 "[ . 1 . 2]" 1
956 1 70 ASN HB3 1 71 GLN H 4.500 . 5.000 4.531 4.433 4.638 . 0 0 "[ . 1 . 2]" 1
957 1 70 ASN HD21 1 71 GLN H 4.500 . 5.000 4.328 3.660 5.017 0.017 15 0 "[ . 1 . 2]" 1
958 1 71 GLN H 1 71 GLN HB2 3.500 . 3.800 2.667 2.614 2.754 . 0 0 "[ . 1 . 2]" 1
959 1 71 GLN H 1 71 GLN HE21 5.200 . 5.700 5.725 5.654 5.748 0.048 9 0 "[ . 1 . 2]" 1
960 1 71 GLN H 1 72 VAL H 4.500 . 5.000 4.385 4.351 4.439 . 0 0 "[ . 1 . 2]" 1
961 1 71 GLN H 1 124 MET ME 4.500 . 5.000 3.245 2.980 3.605 . 0 0 "[ . 1 . 2]" 1
962 1 71 GLN HA 1 71 GLN HE21 5.200 . 5.700 4.251 3.945 4.323 . 0 0 "[ . 1 . 2]" 1
963 1 71 GLN HA 1 71 GLN HE22 5.200 . 5.700 5.679 5.478 5.718 0.018 2 0 "[ . 1 . 2]" 1
964 1 71 GLN HA 1 71 GLN HG2 3.500 . 3.800 2.639 2.504 2.705 . 0 0 "[ . 1 . 2]" 1
965 1 71 GLN HA 1 71 GLN HG3 3.500 . 3.800 3.091 3.038 3.211 . 0 0 "[ . 1 . 2]" 1
966 1 71 GLN HA 1 72 VAL H 3.500 . 3.800 2.389 2.361 2.444 . 0 0 "[ . 1 . 2]" 1
967 1 71 GLN HB2 1 71 GLN HE21 4.500 . 5.000 3.481 3.415 3.562 . 0 0 "[ . 1 . 2]" 1
968 1 71 GLN HB2 1 71 GLN HE22 4.500 . 5.000 4.110 4.045 4.283 . 0 0 "[ . 1 . 2]" 1
969 1 71 GLN HB2 1 72 VAL H 3.500 . 3.800 3.757 3.668 3.803 0.003 17 0 "[ . 1 . 2]" 1
970 1 71 GLN HB3 1 71 GLN HE21 4.500 . 5.000 2.419 2.182 2.512 . 0 0 "[ . 1 . 2]" 1
971 1 71 GLN HB3 1 71 GLN HE22 4.500 . 5.000 3.696 3.554 3.739 . 0 0 "[ . 1 . 2]" 1
972 1 71 GLN HB3 1 72 VAL H 4.500 . 5.000 2.671 2.532 2.735 . 0 0 "[ . 1 . 2]" 1
973 1 71 GLN HB3 1 72 VAL MG2 4.500 . 5.000 4.429 4.337 4.496 . 0 0 "[ . 1 . 2]" 1
974 1 72 VAL H 1 72 VAL MG1 3.500 . 3.800 3.218 3.116 3.501 . 0 0 "[ . 1 . 2]" 1
975 1 72 VAL H 1 72 VAL MG2 3.500 . 3.800 2.202 2.152 2.266 . 0 0 "[ . 1 . 2]" 1
976 1 72 VAL HA 1 72 VAL MG2 3.500 . 3.800 3.239 3.225 3.255 . 0 0 "[ . 1 . 2]" 1
977 1 72 VAL HA 1 73 TYR QD 4.500 . 5.000 3.149 2.925 3.294 . 0 0 "[ . 1 . 2]" 1
978 1 72 VAL HA 1 91 VAL HA 5.200 . 5.700 5.757 5.725 5.898 0.198 4 0 "[ . 1 . 2]" 1
979 1 72 VAL HA 1 94 THR MG 3.500 . 3.800 2.344 2.207 2.474 . 0 0 "[ . 1 . 2]" 1
980 1 72 VAL HA 1 121 VAL MG1 4.500 . 5.000 3.893 3.636 4.053 . 0 0 "[ . 1 . 2]" 1
981 1 72 VAL HA 1 124 MET ME 4.500 . 5.000 4.451 4.290 4.610 . 0 0 "[ . 1 . 2]" 1
982 1 72 VAL HB 1 73 TYR QD 4.500 . 5.000 4.699 4.551 4.881 . 0 0 "[ . 1 . 2]" 1
983 1 72 VAL HB 1 91 VAL HA 5.200 . 5.700 5.011 4.784 5.474 . 0 0 "[ . 1 . 2]" 1
984 1 72 VAL HB 1 91 VAL MG2 5.200 . 5.700 5.124 4.986 5.423 . 0 0 "[ . 1 . 2]" 1
985 1 72 VAL HB 1 94 THR MG 4.500 . 5.000 4.156 3.995 4.333 . 0 0 "[ . 1 . 2]" 1
986 1 72 VAL HB 1 121 VAL MG1 4.500 . 5.000 4.738 4.547 4.942 . 0 0 "[ . 1 . 2]" 1
987 1 72 VAL HB 1 125 CYS HA 4.500 . 5.000 3.770 3.580 4.006 . 0 0 "[ . 1 . 2]" 1
988 1 72 VAL MG1 1 73 TYR H 4.500 . 5.000 3.431 3.230 3.528 . 0 0 "[ . 1 . 2]" 1
989 1 72 VAL MG1 1 73 TYR HA 5.200 . 5.700 5.582 5.467 5.626 . 0 0 "[ . 1 . 2]" 1
990 1 72 VAL MG1 1 90 CYS HA 5.200 . 5.700 5.547 5.358 5.699 . 0 0 "[ . 1 . 2]" 1
991 1 72 VAL MG1 1 94 THR MG 4.500 . 5.000 2.655 2.497 2.842 . 0 0 "[ . 1 . 2]" 1
992 1 72 VAL MG1 1 121 VAL HA 4.500 . 5.000 2.697 2.573 2.784 . 0 0 "[ . 1 . 2]" 1
993 1 72 VAL MG1 1 121 VAL MG1 3.500 . 3.800 2.476 2.198 2.639 . 0 0 "[ . 1 . 2]" 1
994 1 72 VAL MG1 1 124 MET HB2 4.500 . 5.000 2.552 2.344 2.914 . 0 0 "[ . 1 . 2]" 1
995 1 72 VAL MG1 1 124 MET ME 4.500 . 5.000 2.221 2.105 2.449 . 0 0 "[ . 1 . 2]" 1
996 1 72 VAL MG1 1 124 MET HG3 4.500 . 5.000 4.270 4.125 4.489 . 0 0 "[ . 1 . 2]" 1
997 1 72 VAL MG1 1 125 CYS H 4.500 . 5.000 2.944 2.817 3.086 . 0 0 "[ . 1 . 2]" 1
998 1 72 VAL MG1 1 125 CYS HA 3.500 . 3.800 3.312 3.079 3.458 . 0 0 "[ . 1 . 2]" 1
999 1 72 VAL MG1 1 125 CYS QB 4.500 . 5.000 3.756 3.669 3.867 . 0 0 "[ . 1 . 2]" 1
1000 1 72 VAL MG2 1 73 TYR H 4.500 . 5.000 3.818 3.736 4.044 . 0 0 "[ . 1 . 2]" 1
1001 1 72 VAL MG2 1 124 MET HA 4.500 . 5.000 4.273 4.152 4.402 . 0 0 "[ . 1 . 2]" 1
1002 1 72 VAL MG2 1 124 MET HB2 4.500 . 5.000 3.761 3.540 4.092 . 0 0 "[ . 1 . 2]" 1
1003 1 72 VAL MG2 1 124 MET ME 3.500 . 3.800 3.841 3.723 3.939 0.139 19 0 "[ . 1 . 2]" 1
1004 1 72 VAL MG2 1 124 MET HG3 4.500 . 5.000 5.020 4.775 5.132 0.132 12 0 "[ . 1 . 2]" 1
1005 1 72 VAL MG2 1 125 CYS H 4.500 . 5.000 3.778 3.648 4.050 . 0 0 "[ . 1 . 2]" 1
1006 1 72 VAL MG2 1 125 CYS HA 4.500 . 5.000 2.347 2.158 2.726 . 0 0 "[ . 1 . 2]" 1
1007 1 73 TYR H 1 73 TYR HB2 3.500 . 3.800 2.197 2.162 2.296 . 0 0 "[ . 1 . 2]" 1
1008 1 73 TYR H 1 73 TYR QE 4.500 . 5.000 4.728 4.665 4.816 . 0 0 "[ . 1 . 2]" 1
1009 1 73 TYR H 1 90 CYS HA 4.500 . 5.000 4.176 3.930 4.498 . 0 0 "[ . 1 . 2]" 1
1010 1 73 TYR H 1 91 VAL HA 5.200 . 5.700 5.534 5.454 5.647 . 0 0 "[ . 1 . 2]" 1
1011 1 73 TYR H 1 93 ILE MG 4.500 . 5.000 4.590 4.385 4.772 . 0 0 "[ . 1 . 2]" 1
1012 1 73 TYR H 1 94 THR HA 4.500 . 5.000 3.893 3.677 4.128 . 0 0 "[ . 1 . 2]" 1
1013 1 73 TYR H 1 94 THR MG 3.500 . 3.800 3.330 3.114 3.531 . 0 0 "[ . 1 . 2]" 1
1014 1 73 TYR HA 1 73 TYR QE 5.200 . 5.700 4.639 4.579 4.693 . 0 0 "[ . 1 . 2]" 1
1015 1 73 TYR HA 1 74 TYR H 3.500 . 3.800 2.605 2.521 2.713 . 0 0 "[ . 1 . 2]" 1
1016 1 73 TYR HA 1 74 TYR HB2 4.500 . 5.000 4.554 4.462 4.737 . 0 0 "[ . 1 . 2]" 1
1017 1 73 TYR HA 1 74 TYR QD 4.500 . 5.000 3.645 3.411 3.866 . 0 0 "[ . 1 . 2]" 1
1018 1 73 TYR HA 1 74 TYR QE 4.500 . 5.000 4.826 4.557 5.025 0.025 17 0 "[ . 1 . 2]" 1
1019 1 73 TYR HA 1 93 ILE MG 4.500 . 5.000 4.831 4.650 5.007 0.007 15 0 "[ . 1 . 2]" 1
1020 1 73 TYR HA 1 94 THR HA 5.200 . 5.700 5.417 5.201 5.633 . 0 0 "[ . 1 . 2]" 1
1021 1 73 TYR HA 1 94 THR MG 5.200 . 5.700 5.038 4.830 5.192 . 0 0 "[ . 1 . 2]" 1
1022 1 73 TYR HB2 1 90 CYS H 5.200 . 5.700 5.451 5.176 5.603 . 0 0 "[ . 1 . 2]" 1
1023 1 73 TYR HB2 1 93 ILE HA 5.200 . 5.700 5.564 5.393 5.703 0.003 5 0 "[ . 1 . 2]" 1
1024 1 73 TYR HB2 1 93 ILE HB 4.500 . 5.000 2.988 2.769 3.123 . 0 0 "[ . 1 . 2]" 1
1025 1 73 TYR HB2 1 93 ILE MD 5.200 . 5.700 5.497 5.313 5.649 . 0 0 "[ . 1 . 2]" 1
1026 1 73 TYR HB2 1 93 ILE HG13 5.200 . 5.700 4.788 4.515 4.993 . 0 0 "[ . 1 . 2]" 1
1027 1 73 TYR HB2 1 93 ILE MG 3.500 . 3.800 2.948 2.690 3.148 . 0 0 "[ . 1 . 2]" 1
1028 1 73 TYR HB2 1 94 THR HA 4.500 . 5.000 3.749 3.506 3.989 . 0 0 "[ . 1 . 2]" 1
1029 1 73 TYR HB3 1 74 TYR H 3.500 . 3.800 2.208 1.929 2.365 . 0 0 "[ . 1 . 2]" 1
1030 1 73 TYR HB3 1 93 ILE MD 5.200 . 5.700 5.538 5.341 5.670 . 0 0 "[ . 1 . 2]" 1
1031 1 73 TYR HB3 1 93 ILE HG13 4.500 . 5.000 4.764 4.472 4.986 . 0 0 "[ . 1 . 2]" 1
1032 1 73 TYR HB3 1 93 ILE MG 4.500 . 5.000 3.045 2.768 3.197 . 0 0 "[ . 1 . 2]" 1
1033 1 73 TYR QD 1 93 ILE HG13 4.500 . 5.000 5.047 4.992 5.310 0.310 12 0 "[ . 1 . 2]" 1
1034 1 73 TYR QD 1 94 THR H 4.500 . 5.000 4.029 3.660 4.210 . 0 0 "[ . 1 . 2]" 1
1035 1 73 TYR QD 1 94 THR HA 3.500 . 3.800 2.317 2.159 2.548 . 0 0 "[ . 1 . 2]" 1
1036 1 73 TYR QD 1 94 THR MG 4.500 . 5.000 2.427 2.240 2.595 . 0 0 "[ . 1 . 2]" 1
1037 1 73 TYR QE 1 93 ILE MG 3.500 . 3.800 3.321 3.214 3.440 . 0 0 "[ . 1 . 2]" 1
1038 1 73 TYR QE 1 94 THR HA 3.500 . 3.800 2.682 2.159 2.895 . 0 0 "[ . 1 . 2]" 1
1039 1 73 TYR QE 1 94 THR MG 4.500 . 5.000 2.903 2.593 3.219 . 0 0 "[ . 1 . 2]" 1
1040 1 74 TYR H 1 90 CYS HA 5.200 . 5.700 5.274 4.845 5.551 . 0 0 "[ . 1 . 2]" 1
1041 1 74 TYR H 1 93 ILE MG 4.500 . 5.000 4.764 4.194 5.009 0.009 17 0 "[ . 1 . 2]" 1
1042 1 74 TYR HA 1 74 TYR QE 5.200 . 5.700 4.473 4.335 4.702 . 0 0 "[ . 1 . 2]" 1
1043 1 74 TYR HB3 1 86 PHE QD 5.200 . 5.700 4.298 4.110 4.519 . 0 0 "[ . 1 . 2]" 1
1044 1 74 TYR QD 1 86 PHE HB2 4.500 . 5.000 3.414 2.966 3.774 . 0 0 "[ . 1 . 2]" 1
1045 1 74 TYR QD 1 86 PHE HB3 4.500 . 5.000 4.537 4.014 4.885 . 0 0 "[ . 1 . 2]" 1
1046 1 74 TYR QE 1 86 PHE QD 4.500 . 5.000 3.333 2.722 4.432 . 0 0 "[ . 1 . 2]" 1
1047 1 74 TYR QE 1 86 PHE QE 3.500 . 3.800 2.535 2.093 3.873 0.073 12 0 "[ . 1 . 2]" 1
1048 1 74 TYR QE 1 86 PHE HZ 4.500 . 5.000 4.488 3.924 4.990 . 0 0 "[ . 1 . 2]" 1
1049 1 75 ARG HA 1 75 ARG QD 4.500 . 5.000 3.134 2.082 3.977 . 0 0 "[ . 1 . 2]" 1
1050 1 75 ARG HB2 1 75 ARG QD 3.500 . 3.800 3.206 2.595 3.563 . 0 0 "[ . 1 . 2]" 1
1051 1 75 ARG HB2 1 76 PRO HD2 4.500 . 5.000 4.048 3.778 4.356 . 0 0 "[ . 1 . 2]" 1
1052 1 75 ARG HB3 1 75 ARG QD 3.500 . 3.800 2.274 1.984 2.949 . 0 0 "[ . 1 . 2]" 1
1053 1 75 ARG HB3 1 76 PRO HD2 4.500 . 5.000 2.523 2.149 3.099 . 0 0 "[ . 1 . 2]" 1
1054 1 75 ARG QD 1 76 PRO HD2 4.500 . 5.000 2.540 1.948 3.654 . 0 0 "[ . 1 . 2]" 1
1055 1 75 ARG QD 1 76 PRO HD3 4.500 . 5.000 3.854 2.855 5.041 0.041 17 0 "[ . 1 . 2]" 1
1056 1 75 ARG QD 1 76 PRO HG2 4.500 . 5.000 4.248 3.466 5.042 0.042 17 0 "[ . 1 . 2]" 1
1057 1 75 ARG QD 1 93 ILE HG12 5.200 . 5.700 5.130 4.185 5.731 0.031 4 0 "[ . 1 . 2]" 1
1058 1 75 ARG HG2 1 76 PRO HD2 4.500 . 5.000 3.720 2.939 4.465 . 0 0 "[ . 1 . 2]" 1
1059 1 75 ARG HG2 1 93 ILE MD 5.200 . 5.700 5.253 4.321 5.734 0.034 1 0 "[ . 1 . 2]" 1
1060 1 75 ARG HG3 1 76 PRO HD2 4.500 . 5.000 4.454 4.129 4.785 . 0 0 "[ . 1 . 2]" 1
1061 1 75 ARG HG3 1 93 ILE MD 5.200 . 5.700 4.913 4.080 5.693 . 0 0 "[ . 1 . 2]" 1
1062 1 76 PRO HA 1 77 MET H 3.500 . 3.800 2.382 2.321 2.447 . 0 0 "[ . 1 . 2]" 1
1063 1 76 PRO HB2 1 77 MET H 4.500 . 5.000 2.699 2.412 2.837 . 0 0 "[ . 1 . 2]" 1
1064 1 76 PRO HB2 1 77 MET HB2 4.500 . 5.000 4.619 4.400 4.885 . 0 0 "[ . 1 . 2]" 1
1065 1 76 PRO HB2 1 78 ASP HA 5.200 . 5.700 4.620 4.282 4.983 . 0 0 "[ . 1 . 2]" 1
1066 1 76 PRO HB3 1 77 MET H 3.500 . 3.800 3.629 3.498 3.709 . 0 0 "[ . 1 . 2]" 1
1067 1 76 PRO HD2 1 78 ASP HB2 5.200 . 5.700 4.822 4.494 5.506 . 0 0 "[ . 1 . 2]" 1
1068 1 76 PRO HG2 1 77 MET H 4.500 . 5.000 4.328 4.113 4.444 . 0 0 "[ . 1 . 2]" 1
1069 1 76 PRO HG2 1 78 ASP H 4.500 . 5.000 2.909 2.574 3.257 . 0 0 "[ . 1 . 2]" 1
1070 1 76 PRO HG2 1 78 ASP HB3 4.500 . 5.000 4.328 4.037 4.957 . 0 0 "[ . 1 . 2]" 1
1071 1 77 MET H 1 77 MET HG2 4.500 . 5.000 3.417 2.085 4.608 . 0 0 "[ . 1 . 2]" 1
1072 1 77 MET HA 1 77 MET ME 4.500 . 5.000 3.806 2.438 4.585 . 0 0 "[ . 1 . 2]" 1
1073 1 77 MET HA 1 77 MET HG3 3.500 . 3.800 3.147 2.386 3.800 0.000 5 0 "[ . 1 . 2]" 1
1074 1 77 MET HA 1 85 ASN QD 4.500 . 5.000 2.176 1.789 3.144 0.011 3 0 "[ . 1 . 2]" 1
1075 1 77 MET HB2 1 77 MET ME 4.500 . 5.000 2.923 2.206 3.987 . 0 0 "[ . 1 . 2]" 1
1076 1 77 MET HB3 1 77 MET ME 3.500 . 3.800 2.780 2.154 3.803 0.003 5 0 "[ . 1 . 2]" 1
1077 1 77 MET ME 1 77 MET HG3 3.500 . 3.800 2.934 2.336 3.455 . 0 0 "[ . 1 . 2]" 1
1078 1 78 ASP H 1 78 ASP HB2 3.500 . 3.800 2.405 2.257 2.513 . 0 0 "[ . 1 . 2]" 1
1079 1 78 ASP H 1 79 GLU HB3 5.200 . 5.700 4.867 4.380 5.221 . 0 0 "[ . 1 . 2]" 1
1080 1 78 ASP H 1 85 ASN HD21 4.500 . 5.000 4.585 3.729 5.023 0.023 7 0 "[ . 1 . 2]" 1
1081 1 78 ASP H 1 85 ASN QD 4.500 . 5.000 4.015 3.475 4.386 . 0 0 "[ . 1 . 2]" 1
1082 1 78 ASP H 1 85 ASN HD22 4.500 . 5.000 4.588 3.715 5.041 0.041 13 0 "[ . 1 . 2]" 1
1083 1 78 ASP HB2 1 79 GLU H 4.500 . 5.000 2.808 2.520 3.795 . 0 0 "[ . 1 . 2]" 1
1084 1 78 ASP HB2 1 79 GLU HB3 4.500 . 5.000 4.711 3.941 4.978 . 0 0 "[ . 1 . 2]" 1
1085 1 78 ASP HB3 1 79 GLU HB2 4.500 . 5.000 4.767 4.461 4.962 . 0 0 "[ . 1 . 2]" 1
1086 1 78 ASP HB3 1 79 GLU HB3 5.200 . 5.700 5.674 5.044 5.921 0.221 12 0 "[ . 1 . 2]" 1
1087 1 79 GLU HA 1 79 GLU HB2 2.500 . 2.800 2.470 2.321 2.532 . 0 0 "[ . 1 . 2]" 1
1088 1 82 ASN HA 1 82 ASN HD22 5.200 . 5.700 4.440 3.446 4.699 . 0 0 "[ . 1 . 2]" 1
1089 1 82 ASN HA 1 83 GLN H 3.500 . 3.800 2.341 2.200 2.517 . 0 0 "[ . 1 . 2]" 1
1090 1 82 ASN HB3 1 82 ASN HD21 3.500 . 3.800 2.624 2.125 3.050 . 0 0 "[ . 1 . 2]" 1
1091 1 82 ASN HB3 1 82 ASN HD22 3.500 . 3.800 3.651 3.450 3.821 0.021 1 0 "[ . 1 . 2]" 1
1092 1 82 ASN HB3 1 83 GLN H 3.500 . 3.800 3.444 2.704 3.845 0.045 15 0 "[ . 1 . 2]" 1
1093 1 82 ASN HB3 1 83 GLN HB2 5.200 . 5.700 5.204 4.352 5.702 0.002 19 0 "[ . 1 . 2]" 1
1094 1 82 ASN HB3 1 84 ASN H 3.500 . 3.800 3.063 2.218 3.600 . 0 0 "[ . 1 . 2]" 1
1095 1 82 ASN HB3 1 84 ASN HB3 5.200 . 5.700 5.220 4.639 5.708 0.008 16 0 "[ . 1 . 2]" 1
1096 1 82 ASN HD21 1 84 ASN H 4.500 . 5.000 4.491 3.327 5.034 0.034 5 0 "[ . 1 . 2]" 1
1097 1 82 ASN HD21 1 85 ASN H 5.200 . 5.700 5.184 4.434 5.702 0.002 3 0 "[ . 1 . 2]" 1
1098 1 83 GLN H 1 83 GLN HB2 3.500 . 3.800 2.551 2.435 2.766 . 0 0 "[ . 1 . 2]" 1
1099 1 83 GLN H 1 84 ASN H 3.500 . 3.800 2.558 2.377 3.074 . 0 0 "[ . 1 . 2]" 1
1100 1 83 GLN HB2 1 84 ASN H 3.500 . 3.800 2.642 2.444 2.871 . 0 0 "[ . 1 . 2]" 1
1101 1 83 GLN HB2 1 84 ASN HB2 4.500 . 5.000 4.481 4.178 4.830 . 0 0 "[ . 1 . 2]" 1
1102 1 83 GLN HB2 1 84 ASN HB3 5.200 . 5.700 5.498 5.233 5.702 0.002 8 0 "[ . 1 . 2]" 1
1103 1 84 ASN H 1 84 ASN HB2 3.500 . 3.800 2.392 2.291 2.467 . 0 0 "[ . 1 . 2]" 1
1104 1 84 ASN H 1 84 ASN HD21 4.500 . 5.000 3.074 2.559 3.525 . 0 0 "[ . 1 . 2]" 1
1105 1 84 ASN H 1 84 ASN HD22 4.500 . 5.000 4.094 3.904 4.281 . 0 0 "[ . 1 . 2]" 1
1106 1 84 ASN H 1 85 ASN H 3.500 . 3.800 2.766 2.571 2.962 . 0 0 "[ . 1 . 2]" 1
1107 1 84 ASN HA 1 84 ASN HD21 4.500 . 5.000 4.174 3.729 4.408 . 0 0 "[ . 1 . 2]" 1
1108 1 84 ASN HA 1 87 VAL HA 5.200 . 5.700 5.326 5.101 5.454 . 0 0 "[ . 1 . 2]" 1
1109 1 84 ASN HA 1 87 VAL HB 3.500 . 3.800 3.794 3.657 3.832 0.032 16 0 "[ . 1 . 2]" 1
1110 1 84 ASN HA 1 87 VAL MG2 3.500 . 3.800 2.288 2.074 2.382 . 0 0 "[ . 1 . 2]" 1
1111 1 84 ASN HB2 1 84 ASN HD21 3.500 . 3.800 2.188 2.147 2.340 . 0 0 "[ . 1 . 2]" 1
1112 1 84 ASN HB2 1 84 ASN HD22 3.500 . 3.800 3.484 3.453 3.549 . 0 0 "[ . 1 . 2]" 1
1113 1 84 ASN HB2 1 87 VAL HB 4.500 . 5.000 4.355 4.187 4.586 . 0 0 "[ . 1 . 2]" 1
1114 1 84 ASN HB2 1 87 VAL MG2 4.500 . 5.000 3.968 3.875 4.141 . 0 0 "[ . 1 . 2]" 1
1115 1 84 ASN HB3 1 86 PHE QD 5.200 . 5.700 5.422 5.294 5.664 . 0 0 "[ . 1 . 2]" 1
1116 1 84 ASN HB3 1 86 PHE QE 4.500 . 5.000 5.074 5.016 5.336 0.336 12 0 "[ . 1 . 2]" 1
1117 1 84 ASN HB3 1 87 VAL H 4.500 . 5.000 3.858 3.789 4.072 . 0 0 "[ . 1 . 2]" 1
1118 1 84 ASN HB3 1 87 VAL HA 5.200 . 5.700 5.450 5.341 5.704 0.004 12 0 "[ . 1 . 2]" 1
1119 1 84 ASN HB3 1 87 VAL HB 4.500 . 5.000 2.706 2.568 2.901 . 0 0 "[ . 1 . 2]" 1
1120 1 84 ASN HB3 1 87 VAL MG1 4.500 . 5.000 3.628 3.470 3.835 . 0 0 "[ . 1 . 2]" 1
1121 1 84 ASN HB3 1 87 VAL MG2 4.500 . 5.000 2.621 2.506 2.826 . 0 0 "[ . 1 . 2]" 1
1122 1 84 ASN HB3 1 88 HIS HB2 5.200 . 5.700 5.365 5.063 5.663 . 0 0 "[ . 1 . 2]" 1
1123 1 84 ASN HD21 1 85 ASN H 5.200 . 5.700 5.512 4.999 5.814 0.114 4 0 "[ . 1 . 2]" 1
1124 1 84 ASN HD22 1 87 VAL MG2 4.500 . 5.000 4.708 4.504 4.862 . 0 0 "[ . 1 . 2]" 1
1125 1 85 ASN H 1 86 PHE QD 4.500 . 5.000 3.629 3.498 3.806 . 0 0 "[ . 1 . 2]" 1
1126 1 85 ASN H 1 87 VAL MG2 4.500 . 5.000 4.509 4.402 4.634 . 0 0 "[ . 1 . 2]" 1
1127 1 86 PHE HB2 1 86 PHE QE 4.500 . 5.000 4.446 4.420 4.464 . 0 0 "[ . 1 . 2]" 1
1128 1 86 PHE QD 1 87 VAL HA 4.500 . 5.000 3.230 3.074 3.382 . 0 0 "[ . 1 . 2]" 1
1129 1 86 PHE QD 1 87 VAL HB 4.500 . 5.000 5.002 4.924 5.097 0.097 4 0 "[ . 1 . 2]" 1
1130 1 86 PHE QD 1 87 VAL MG2 4.500 . 5.000 3.191 3.151 3.243 . 0 0 "[ . 1 . 2]" 1
1131 1 86 PHE QD 1 125 CYS HA 4.500 . 5.000 4.702 4.456 4.890 . 0 0 "[ . 1 . 2]" 1
1132 1 86 PHE QD 1 128 GLN HB3 5.200 . 5.700 5.244 4.540 5.764 0.064 8 0 "[ . 1 . 2]" 1
1133 1 86 PHE QD 1 128 GLN HG3 4.500 . 5.000 4.872 4.538 5.187 0.187 4 0 "[ . 1 . 2]" 1
1134 1 86 PHE QD 1 129 TYR QD 5.200 . 5.700 5.274 4.473 5.730 0.030 7 0 "[ . 1 . 2]" 1
1135 1 86 PHE QE 1 87 VAL HA 4.500 . 5.000 3.602 3.472 3.708 . 0 0 "[ . 1 . 2]" 1
1136 1 86 PHE QE 1 87 VAL HB 5.200 . 5.700 5.040 4.996 5.141 . 0 0 "[ . 1 . 2]" 1
1137 1 86 PHE QE 1 125 CYS HA 4.500 . 5.000 3.730 3.474 4.023 . 0 0 "[ . 1 . 2]" 1
1138 1 86 PHE QE 1 128 GLN HB2 4.500 . 5.000 2.684 2.099 3.444 . 0 0 "[ . 1 . 2]" 1
1139 1 86 PHE QE 1 128 GLN HG2 5.200 . 5.700 4.147 3.365 4.876 . 0 0 "[ . 1 . 2]" 1
1140 1 86 PHE QE 1 128 GLN HG3 3.500 . 3.800 3.347 2.958 3.722 . 0 0 "[ . 1 . 2]" 1
1141 1 86 PHE QE 1 129 TYR HA 4.500 . 5.000 4.465 3.685 4.948 . 0 0 "[ . 1 . 2]" 1
1142 1 86 PHE HZ 1 87 VAL HA 5.200 . 5.700 4.770 4.463 4.952 . 0 0 "[ . 1 . 2]" 1
1143 1 86 PHE HZ 1 87 VAL HB 5.200 . 5.700 5.711 5.678 5.752 0.052 4 0 "[ . 1 . 2]" 1
1144 1 86 PHE HZ 1 87 VAL MG1 5.200 . 5.700 4.853 4.701 4.970 . 0 0 "[ . 1 . 2]" 1
1145 1 86 PHE HZ 1 87 VAL MG2 4.500 . 5.000 2.775 2.742 2.806 . 0 0 "[ . 1 . 2]" 1
1146 1 86 PHE HZ 1 125 CYS QB 5.200 . 5.700 5.329 4.969 5.485 . 0 0 "[ . 1 . 2]" 1
1147 1 86 PHE HZ 1 129 TYR HB3 4.500 . 5.000 4.350 3.594 4.805 . 0 0 "[ . 1 . 2]" 1
1148 1 86 PHE HZ 1 129 TYR QD 4.500 . 5.000 3.977 3.042 4.680 . 0 0 "[ . 1 . 2]" 1
1149 1 87 VAL H 1 87 VAL MG2 3.500 . 3.800 2.172 2.134 2.213 . 0 0 "[ . 1 . 2]" 1
1150 1 87 VAL H 1 88 HIS H 4.500 . 5.000 3.092 2.956 3.200 . 0 0 "[ . 1 . 2]" 1
1151 1 87 VAL H 1 89 ASP HB2 5.200 . 5.700 4.628 4.233 4.816 . 0 0 "[ . 1 . 2]" 1
1152 1 87 VAL HA 1 87 VAL MG1 3.500 . 3.800 2.594 2.518 2.641 . 0 0 "[ . 1 . 2]" 1
1153 1 87 VAL HA 1 87 VAL MG2 3.500 . 3.800 2.368 2.326 2.398 . 0 0 "[ . 1 . 2]" 1
1154 1 87 VAL HA 1 89 ASP H 4.500 . 5.000 4.145 3.939 4.391 . 0 0 "[ . 1 . 2]" 1
1155 1 87 VAL HA 1 89 ASP HB2 5.200 . 5.700 5.660 5.104 5.830 0.130 12 0 "[ . 1 . 2]" 1
1156 1 87 VAL HA 1 90 CYS H 4.500 . 5.000 3.775 3.739 3.869 . 0 0 "[ . 1 . 2]" 1
1157 1 87 VAL HB 1 88 HIS H 4.500 . 5.000 2.094 2.024 2.178 . 0 0 "[ . 1 . 2]" 1
1158 1 87 VAL HB 1 88 HIS HB2 4.500 . 5.000 3.725 3.616 3.829 . 0 0 "[ . 1 . 2]" 1
1159 1 87 VAL HB 1 88 HIS HB3 5.200 . 5.700 4.677 4.573 4.820 . 0 0 "[ . 1 . 2]" 1
1160 1 87 VAL HB 1 125 CYS QB 4.500 . 5.000 4.002 3.919 4.098 . 0 0 "[ . 1 . 2]" 1
1161 1 87 VAL HB 1 126 ILE HG13 5.200 . 5.700 4.976 4.775 5.411 . 0 0 "[ . 1 . 2]" 1
1162 1 87 VAL MG1 1 88 HIS H 3.500 . 3.800 2.643 2.566 2.748 . 0 0 "[ . 1 . 2]" 1
1163 1 87 VAL MG1 1 88 HIS HA 3.500 . 3.800 3.020 2.985 3.116 . 0 0 "[ . 1 . 2]" 1
1164 1 87 VAL MG1 1 88 HIS HB3 4.500 . 5.000 4.391 4.290 4.549 . 0 0 "[ . 1 . 2]" 1
1165 1 87 VAL MG1 1 89 ASP H 4.500 . 5.000 4.471 4.382 4.623 . 0 0 "[ . 1 . 2]" 1
1166 1 87 VAL MG1 1 91 VAL H 4.500 . 5.000 4.629 4.497 4.819 . 0 0 "[ . 1 . 2]" 1
1167 1 87 VAL MG1 1 125 CYS QB 3.500 . 3.800 2.020 1.974 2.108 . 0 0 "[ . 1 . 2]" 1
1168 1 87 VAL MG1 1 126 ILE HB 3.500 . 3.800 2.338 2.039 2.573 . 0 0 "[ . 1 . 2]" 1
1169 1 87 VAL MG2 1 88 HIS HB2 4.500 . 5.000 5.084 5.022 5.148 0.148 4 0 "[ . 1 . 2]" 1
1170 1 87 VAL MG2 1 125 CYS QB 4.500 . 5.000 3.058 2.938 3.197 . 0 0 "[ . 1 . 2]" 1
1171 1 87 VAL MG2 1 129 TYR H 4.500 . 5.000 3.968 3.767 4.201 . 0 0 "[ . 1 . 2]" 1
1172 1 87 VAL MG2 1 129 TYR HA 5.200 . 5.700 5.158 4.813 5.488 . 0 0 "[ . 1 . 2]" 1
1173 1 87 VAL MG2 1 129 TYR HB2 4.500 . 5.000 3.273 2.914 3.567 . 0 0 "[ . 1 . 2]" 1
1174 1 88 HIS H 1 89 ASP H 3.500 . 3.800 2.622 2.580 2.679 . 0 0 "[ . 1 . 2]" 1
1175 1 88 HIS H 1 90 CYS H 4.500 . 5.000 4.525 4.399 4.605 . 0 0 "[ . 1 . 2]" 1
1176 1 88 HIS H 1 125 CYS QB 3.500 . 3.800 4.240 4.186 4.365 0.565 4 2 "[ +. 1 - . 2]" 1
1177 1 88 HIS HA 1 88 HIS HD2 3.500 . 3.800 3.736 3.519 3.814 0.014 16 0 "[ . 1 . 2]" 1
1178 1 88 HIS HA 1 88 HIS HE1 5.200 . 5.700 4.992 4.862 5.099 . 0 0 "[ . 1 . 2]" 1
1179 1 88 HIS HA 1 91 VAL H 4.500 . 5.000 2.910 2.741 3.062 . 0 0 "[ . 1 . 2]" 1
1180 1 88 HIS HA 1 91 VAL HA 5.200 . 5.700 4.677 4.536 4.810 . 0 0 "[ . 1 . 2]" 1
1181 1 88 HIS HA 1 91 VAL HB 3.500 . 3.800 2.329 2.097 2.494 . 0 0 "[ . 1 . 2]" 1
1182 1 88 HIS HA 1 91 VAL MG1 3.500 . 3.800 3.653 3.532 3.730 . 0 0 "[ . 1 . 2]" 1
1183 1 88 HIS HA 1 91 VAL MG2 3.500 . 3.800 2.165 2.080 2.307 . 0 0 "[ . 1 . 2]" 1
1184 1 88 HIS HA 1 125 CYS QB 4.500 . 5.000 3.792 3.679 3.929 . 0 0 "[ . 1 . 2]" 1
1185 1 88 HIS HB2 1 91 VAL HB 4.500 . 5.000 4.547 4.243 4.765 . 0 0 "[ . 1 . 2]" 1
1186 1 88 HIS HB2 1 91 VAL MG2 4.500 . 5.000 3.876 3.744 4.066 . 0 0 "[ . 1 . 2]" 1
1187 1 88 HIS HB2 1 125 CYS QB 5.200 . 5.700 5.107 5.021 5.305 . 0 0 "[ . 1 . 2]" 1
1188 1 88 HIS HB3 1 88 HIS HD2 3.500 . 3.800 2.964 2.892 3.067 . 0 0 "[ . 1 . 2]" 1
1189 1 88 HIS HB3 1 89 ASP H 3.500 . 3.800 3.383 3.128 3.640 . 0 0 "[ . 1 . 2]" 1
1190 1 88 HIS HB3 1 89 ASP HA 4.500 . 5.000 4.517 4.380 4.609 . 0 0 "[ . 1 . 2]" 1
1191 1 88 HIS HB3 1 89 ASP HB2 4.500 . 5.000 4.979 4.893 5.026 0.026 19 0 "[ . 1 . 2]" 1
1192 1 88 HIS HB3 1 91 VAL MG2 5.200 . 5.700 4.585 4.470 4.780 . 0 0 "[ . 1 . 2]" 1
1193 1 88 HIS HD2 1 89 ASP HA 4.500 . 5.000 4.403 4.133 4.672 . 0 0 "[ . 1 . 2]" 1
1194 1 88 HIS HD2 1 91 VAL HB 4.500 . 5.000 3.577 3.193 3.833 . 0 0 "[ . 1 . 2]" 1
1195 1 89 ASP H 1 90 CYS H 3.500 . 3.800 2.683 2.462 2.782 . 0 0 "[ . 1 . 2]" 1
1196 1 89 ASP HB2 1 90 CYS H 3.500 . 3.800 3.400 2.793 3.565 . 0 0 "[ . 1 . 2]" 1
1197 1 90 CYS H 1 91 VAL H 4.500 . 5.000 2.669 2.601 2.752 . 0 0 "[ . 1 . 2]" 1
1198 1 90 CYS H 1 91 VAL HB 4.500 . 5.000 4.756 4.622 4.867 . 0 0 "[ . 1 . 2]" 1
1199 1 90 CYS H 1 92 ASN H 4.500 . 5.000 4.557 4.416 4.787 . 0 0 "[ . 1 . 2]" 1
1200 1 90 CYS H 1 93 ILE H 4.500 . 5.000 4.895 4.770 5.005 0.005 1 0 "[ . 1 . 2]" 1
1201 1 90 CYS H 1 93 ILE HB 5.200 . 5.700 5.007 4.870 5.222 . 0 0 "[ . 1 . 2]" 1
1202 1 90 CYS HA 1 93 ILE HB 4.500 . 5.000 2.312 2.168 2.500 . 0 0 "[ . 1 . 2]" 1
1203 1 90 CYS HA 1 93 ILE MD 4.500 . 5.000 4.835 4.702 4.977 . 0 0 "[ . 1 . 2]" 1
1204 1 90 CYS HA 1 93 ILE HG12 4.500 . 5.000 3.615 3.375 3.882 . 0 0 "[ . 1 . 2]" 1
1205 1 90 CYS HA 1 93 ILE MG 4.500 . 5.000 3.782 3.624 3.963 . 0 0 "[ . 1 . 2]" 1
1206 1 90 CYS HA 1 94 THR HA 5.200 . 5.700 5.458 5.297 5.612 . 0 0 "[ . 1 . 2]" 1
1207 1 90 CYS HB2 1 91 VAL H 4.500 . 5.000 4.023 3.976 4.082 . 0 0 "[ . 1 . 2]" 1
1208 1 90 CYS HB3 1 91 VAL H 4.500 . 5.000 4.298 4.272 4.347 . 0 0 "[ . 1 . 2]" 1
1209 1 90 CYS HB3 1 91 VAL MG2 5.200 . 5.700 5.487 5.433 5.546 . 0 0 "[ . 1 . 2]" 1
1210 1 91 VAL H 1 91 VAL HB 3.500 . 3.800 2.336 2.241 2.382 . 0 0 "[ . 1 . 2]" 1
1211 1 91 VAL H 1 91 VAL MG1 4.500 . 5.000 3.759 3.659 3.787 . 0 0 "[ . 1 . 2]" 1
1212 1 91 VAL H 1 91 VAL MG2 3.500 . 3.800 2.349 2.251 2.515 . 0 0 "[ . 1 . 2]" 1
1213 1 91 VAL H 1 92 ASN H 4.500 . 5.000 2.776 2.699 2.862 . 0 0 "[ . 1 . 2]" 1
1214 1 91 VAL HA 1 91 VAL MG1 3.500 . 3.800 2.651 2.622 2.686 . 0 0 "[ . 1 . 2]" 1
1215 1 91 VAL HA 1 91 VAL MG2 3.500 . 3.800 2.295 2.202 2.312 . 0 0 "[ . 1 . 2]" 1
1216 1 91 VAL HA 1 92 ASN HA 5.200 . 5.700 4.719 4.645 4.764 . 0 0 "[ . 1 . 2]" 1
1217 1 91 VAL HA 1 94 THR H 4.500 . 5.000 4.012 3.956 4.125 . 0 0 "[ . 1 . 2]" 1
1218 1 91 VAL HA 1 94 THR HB 4.500 . 5.000 3.617 3.484 3.806 . 0 0 "[ . 1 . 2]" 1
1219 1 91 VAL HA 1 121 VAL MG2 3.500 . 3.800 2.196 2.105 2.358 . 0 0 "[ . 1 . 2]" 1
1220 1 91 VAL HA 1 125 CYS QB 4.500 . 5.000 4.403 4.301 4.508 . 0 0 "[ . 1 . 2]" 1
1221 1 91 VAL HB 1 92 ASN H 3.500 . 3.800 2.529 2.320 2.843 . 0 0 "[ . 1 . 2]" 1
1222 1 91 VAL HB 1 92 ASN HB2 4.500 . 5.000 4.570 4.078 4.875 . 0 0 "[ . 1 . 2]" 1
1223 1 91 VAL HB 1 125 CYS QB 5.200 . 5.700 4.641 4.488 4.768 . 0 0 "[ . 1 . 2]" 1
1224 1 91 VAL MG1 1 92 ASN H 3.500 . 3.800 2.978 2.772 3.127 . 0 0 "[ . 1 . 2]" 1
1225 1 91 VAL MG1 1 92 ASN HA 3.500 . 3.800 3.071 2.959 3.218 . 0 0 "[ . 1 . 2]" 1
1226 1 91 VAL MG1 1 92 ASN HB3 5.200 . 5.700 4.887 4.734 5.108 . 0 0 "[ . 1 . 2]" 1
1227 1 91 VAL MG1 1 93 ILE H 5.200 . 5.700 4.865 4.772 5.029 . 0 0 "[ . 1 . 2]" 1
1228 1 91 VAL MG1 1 94 THR HB 4.500 . 5.000 4.975 4.843 5.176 0.176 12 0 "[ . 1 . 2]" 1
1229 1 91 VAL MG1 1 119 ARG H 5.200 . 5.700 5.268 5.096 5.387 . 0 0 "[ . 1 . 2]" 1
1230 1 91 VAL MG1 1 122 GLU HA 4.500 . 5.000 3.557 3.430 3.881 . 0 0 "[ . 1 . 2]" 1
1231 1 91 VAL MG2 1 94 THR H 5.200 . 5.700 5.547 5.481 5.616 . 0 0 "[ . 1 . 2]" 1
1232 1 91 VAL MG2 1 119 ARG HA 5.200 . 5.700 5.264 4.987 5.474 . 0 0 "[ . 1 . 2]" 1
1233 1 91 VAL MG2 1 122 GLU H 4.500 . 5.000 3.276 3.150 3.368 . 0 0 "[ . 1 . 2]" 1
1234 1 91 VAL MG2 1 122 GLU HA 4.500 . 5.000 1.963 1.901 2.095 . 0 0 "[ . 1 . 2]" 1
1235 1 91 VAL MG2 1 122 GLU HB2 4.500 . 5.000 4.061 3.928 4.149 . 0 0 "[ . 1 . 2]" 1
1236 1 91 VAL MG2 1 122 GLU HB3 4.500 . 5.000 3.730 3.602 3.874 . 0 0 "[ . 1 . 2]" 1
1237 1 91 VAL MG2 1 125 CYS QB 4.500 . 5.000 2.364 2.233 2.490 . 0 0 "[ . 1 . 2]" 1
1238 1 92 ASN H 1 92 ASN HD22 4.500 . 5.000 4.509 3.938 5.297 0.297 3 0 "[ . 1 . 2]" 1
1239 1 92 ASN H 1 93 ILE H 4.500 . 5.000 2.621 2.429 2.777 . 0 0 "[ . 1 . 2]" 1
1240 1 92 ASN H 1 93 ILE HB 4.500 . 5.000 4.749 4.559 4.935 . 0 0 "[ . 1 . 2]" 1
1241 1 92 ASN H 1 94 THR H 4.500 . 5.000 4.343 4.184 4.486 . 0 0 "[ . 1 . 2]" 1
1242 1 92 ASN HA 1 92 ASN HD22 4.500 . 5.000 4.157 3.439 4.733 . 0 0 "[ . 1 . 2]" 1
1243 1 92 ASN HA 1 93 ILE MD 5.200 . 5.700 5.417 5.260 5.716 0.016 4 0 "[ . 1 . 2]" 1
1244 1 92 ASN HA 1 95 ILE H 4.500 . 5.000 3.988 3.688 4.116 . 0 0 "[ . 1 . 2]" 1
1245 1 92 ASN HA 1 95 ILE HB 4.500 . 5.000 3.852 3.514 4.073 . 0 0 "[ . 1 . 2]" 1
1246 1 92 ASN HA 1 95 ILE MD 4.500 . 5.000 5.015 4.875 5.074 0.074 9 0 "[ . 1 . 2]" 1
1247 1 92 ASN HA 1 95 ILE HG13 5.200 . 5.700 4.177 3.904 4.400 . 0 0 "[ . 1 . 2]" 1
1248 1 92 ASN HB2 1 93 ILE H 4.500 . 5.000 2.742 2.431 3.268 . 0 0 "[ . 1 . 2]" 1
1249 1 92 ASN HB2 1 93 ILE HA 5.200 . 5.700 4.465 4.112 5.196 . 0 0 "[ . 1 . 2]" 1
1250 1 92 ASN HB2 1 93 ILE HB 5.200 . 5.700 4.911 4.503 5.571 . 0 0 "[ . 1 . 2]" 1
1251 1 92 ASN HB3 1 93 ILE HB 5.200 . 5.700 5.442 4.615 5.756 0.056 4 0 "[ . 1 . 2]" 1
1252 1 92 ASN HB3 1 93 ILE MD 4.500 . 5.000 3.880 3.196 4.524 . 0 0 "[ . 1 . 2]" 1
1253 1 92 ASN HB3 1 93 ILE HG12 4.500 . 5.000 3.904 2.891 4.308 . 0 0 "[ . 1 . 2]" 1
1254 1 92 ASN HB3 1 93 ILE MG 5.200 . 5.700 5.619 5.017 5.904 0.204 4 0 "[ . 1 . 2]" 1
1255 1 92 ASN HB3 1 96 LYS HD2 5.200 . 5.700 4.836 4.561 5.307 . 0 0 "[ . 1 . 2]" 1
1256 1 93 ILE H 1 93 ILE MD 4.500 . 5.000 3.512 3.354 3.776 . 0 0 "[ . 1 . 2]" 1
1257 1 93 ILE H 1 93 ILE MG 4.500 . 5.000 3.741 3.715 3.772 . 0 0 "[ . 1 . 2]" 1
1258 1 93 ILE H 1 94 THR H 3.500 . 3.800 2.718 2.635 2.763 . 0 0 "[ . 1 . 2]" 1
1259 1 93 ILE H 1 94 THR HB 4.500 . 5.000 5.024 5.004 5.122 0.122 4 0 "[ . 1 . 2]" 1
1260 1 93 ILE HA 1 93 ILE MD 3.500 . 3.800 2.077 2.040 2.115 . 0 0 "[ . 1 . 2]" 1
1261 1 93 ILE HA 1 93 ILE MG 3.500 . 3.800 2.447 2.417 2.496 . 0 0 "[ . 1 . 2]" 1
1262 1 93 ILE HA 1 96 LYS H 4.500 . 5.000 3.277 3.194 3.432 . 0 0 "[ . 1 . 2]" 1
1263 1 93 ILE HA 1 96 LYS HA 5.200 . 5.700 5.080 4.995 5.276 . 0 0 "[ . 1 . 2]" 1
1264 1 93 ILE HA 1 96 LYS HB2 4.500 . 5.000 3.441 3.301 3.645 . 0 0 "[ . 1 . 2]" 1
1265 1 93 ILE HA 1 96 LYS HD3 4.500 . 5.000 4.750 4.627 4.945 . 0 0 "[ . 1 . 2]" 1
1266 1 93 ILE HA 1 96 LYS HE3 4.500 . 5.000 3.864 3.499 4.295 . 0 0 "[ . 1 . 2]" 1
1267 1 93 ILE HA 1 96 LYS HG2 3.500 . 3.800 2.309 2.085 3.168 . 0 0 "[ . 1 . 2]" 1
1268 1 93 ILE HB 1 93 ILE MD 3.500 . 3.800 3.314 3.301 3.325 . 0 0 "[ . 1 . 2]" 1
1269 1 93 ILE HB 1 94 THR H 3.500 . 3.800 2.691 2.638 2.786 . 0 0 "[ . 1 . 2]" 1
1270 1 93 ILE HB 1 94 THR HA 4.500 . 5.000 4.315 4.253 4.389 . 0 0 "[ . 1 . 2]" 1
1271 1 93 ILE HB 1 95 ILE H 4.500 . 5.000 5.037 5.001 5.126 0.126 4 0 "[ . 1 . 2]" 1
1272 1 93 ILE HB 1 96 LYS HG3 4.500 . 5.000 5.036 5.009 5.094 0.094 12 0 "[ . 1 . 2]" 1
1273 1 93 ILE MD 1 93 ILE MG 3.500 . 3.800 2.111 2.085 2.199 . 0 0 "[ . 1 . 2]" 1
1274 1 93 ILE MD 1 94 THR H 4.500 . 5.000 4.839 4.786 4.924 . 0 0 "[ . 1 . 2]" 1
1275 1 93 ILE MD 1 96 LYS HA 5.200 . 5.700 5.744 5.717 5.832 0.132 12 0 "[ . 1 . 2]" 1
1276 1 93 ILE MD 1 96 LYS HD2 3.500 . 3.800 3.291 3.056 3.420 . 0 0 "[ . 1 . 2]" 1
1277 1 93 ILE MD 1 96 LYS HD3 4.500 . 5.000 4.528 4.354 4.596 . 0 0 "[ . 1 . 2]" 1
1278 1 93 ILE MD 1 96 LYS HE3 4.500 . 5.000 4.123 3.925 4.405 . 0 0 "[ . 1 . 2]" 1
1279 1 93 ILE HG12 1 93 ILE MG 3.500 . 3.800 3.201 3.181 3.234 . 0 0 "[ . 1 . 2]" 1
1280 1 93 ILE HG12 1 96 LYS HD2 5.200 . 5.700 5.669 5.344 5.782 0.082 12 0 "[ . 1 . 2]" 1
1281 1 93 ILE HG13 1 93 ILE MG 3.500 . 3.800 2.348 2.306 2.395 . 0 0 "[ . 1 . 2]" 1
1282 1 93 ILE MG 1 94 THR H 4.500 . 5.000 3.360 3.225 3.432 . 0 0 "[ . 1 . 2]" 1
1283 1 93 ILE MG 1 94 THR HA 4.500 . 5.000 3.241 3.107 3.341 . 0 0 "[ . 1 . 2]" 1
1284 1 93 ILE MG 1 94 THR MG 5.200 . 5.700 4.775 4.630 4.871 . 0 0 "[ . 1 . 2]" 1
1285 1 93 ILE MG 1 96 LYS H 4.500 . 5.000 4.267 4.190 4.401 . 0 0 "[ . 1 . 2]" 1
1286 1 93 ILE MG 1 96 LYS HB2 3.500 . 3.800 3.458 3.329 3.773 . 0 0 "[ . 1 . 2]" 1
1287 1 93 ILE MG 1 96 LYS HB3 4.500 . 5.000 4.639 4.515 4.943 . 0 0 "[ . 1 . 2]" 1
1288 1 93 ILE MG 1 96 LYS HE3 5.200 . 5.700 5.590 5.340 5.859 0.159 12 0 "[ . 1 . 2]" 1
1289 1 93 ILE MG 1 97 GLN H 4.500 . 5.000 4.503 4.285 4.859 . 0 0 "[ . 1 . 2]" 1
1290 1 93 ILE MG 1 97 GLN HB2 5.200 . 5.700 4.936 4.467 5.402 . 0 0 "[ . 1 . 2]" 1
1291 1 94 THR H 1 94 THR HB 3.500 . 3.800 2.585 2.544 2.734 . 0 0 "[ . 1 . 2]" 1
1292 1 94 THR H 1 94 THR MG 4.500 . 5.000 3.772 3.731 3.837 . 0 0 "[ . 1 . 2]" 1
1293 1 94 THR H 1 95 ILE MD 4.500 . 5.000 4.605 4.450 4.739 . 0 0 "[ . 1 . 2]" 1
1294 1 94 THR H 1 95 ILE HG12 4.500 . 5.000 4.065 3.870 4.156 . 0 0 "[ . 1 . 2]" 1
1295 1 94 THR H 1 121 VAL MG1 4.500 . 5.000 4.762 4.476 4.896 . 0 0 "[ . 1 . 2]" 1
1296 1 94 THR H 1 121 VAL MG2 4.500 . 5.000 4.437 4.352 4.562 . 0 0 "[ . 1 . 2]" 1
1297 1 94 THR HA 1 94 THR MG 3.500 . 3.800 2.393 2.336 2.468 . 0 0 "[ . 1 . 2]" 1
1298 1 94 THR HA 1 95 ILE MD 4.500 . 5.000 4.642 4.469 4.798 . 0 0 "[ . 1 . 2]" 1
1299 1 94 THR HA 1 95 ILE HG12 5.200 . 5.700 5.222 5.030 5.324 . 0 0 "[ . 1 . 2]" 1
1300 1 94 THR HA 1 96 LYS HB2 5.200 . 5.700 4.999 4.880 5.123 . 0 0 "[ . 1 . 2]" 1
1301 1 94 THR HA 1 98 HIS HB2 5.200 . 5.700 5.224 5.031 5.463 . 0 0 "[ . 1 . 2]" 1
1302 1 94 THR HB 1 95 ILE H 3.500 . 3.800 2.755 2.676 2.934 . 0 0 "[ . 1 . 2]" 1
1303 1 94 THR HB 1 95 ILE MD 4.500 . 5.000 2.903 2.692 3.080 . 0 0 "[ . 1 . 2]" 1
1304 1 94 THR HB 1 95 ILE HG12 4.500 . 5.000 3.240 3.000 3.344 . 0 0 "[ . 1 . 2]" 1
1305 1 94 THR HB 1 95 ILE MG 5.200 . 5.700 5.309 5.262 5.353 . 0 0 "[ . 1 . 2]" 1
1306 1 94 THR HB 1 121 VAL HB 4.500 . 5.000 3.381 3.276 3.586 . 0 0 "[ . 1 . 2]" 1
1307 1 94 THR HB 1 121 VAL MG2 4.500 . 5.000 3.054 2.945 3.355 . 0 0 "[ . 1 . 2]" 1
1308 1 94 THR MG 1 95 ILE H 4.500 . 5.000 3.642 3.572 3.797 . 0 0 "[ . 1 . 2]" 1
1309 1 94 THR MG 1 95 ILE HA 4.500 . 5.000 3.522 3.439 3.644 . 0 0 "[ . 1 . 2]" 1
1310 1 94 THR MG 1 95 ILE MD 4.500 . 5.000 2.696 2.468 2.880 . 0 0 "[ . 1 . 2]" 1
1311 1 94 THR MG 1 95 ILE MG 4.500 . 5.000 4.813 4.694 4.953 . 0 0 "[ . 1 . 2]" 1
1312 1 94 THR MG 1 96 LYS H 4.500 . 5.000 5.021 4.994 5.081 0.081 12 0 "[ . 1 . 2]" 1
1313 1 94 THR MG 1 98 HIS HB2 4.500 . 5.000 3.650 3.431 3.901 . 0 0 "[ . 1 . 2]" 1
1314 1 94 THR MG 1 98 HIS HB3 4.500 . 5.000 4.639 4.427 4.858 . 0 0 "[ . 1 . 2]" 1
1315 1 94 THR MG 1 121 VAL H 5.200 . 5.700 5.496 5.350 5.741 0.041 4 0 "[ . 1 . 2]" 1
1316 1 94 THR MG 1 121 VAL MG2 4.500 . 5.000 3.821 3.689 4.120 . 0 0 "[ . 1 . 2]" 1
1317 1 95 ILE H 1 95 ILE HB 3.500 . 3.800 2.663 2.536 2.733 . 0 0 "[ . 1 . 2]" 1
1318 1 95 ILE H 1 95 ILE MD 4.500 . 5.000 2.931 2.814 3.035 . 0 0 "[ . 1 . 2]" 1
1319 1 95 ILE H 1 95 ILE HG12 3.500 . 3.800 2.008 1.913 2.226 . 0 0 "[ . 1 . 2]" 1
1320 1 95 ILE H 1 121 VAL MG1 4.500 . 5.000 4.281 4.171 4.403 . 0 0 "[ . 1 . 2]" 1
1321 1 95 ILE HA 1 95 ILE MD 3.500 . 3.800 2.207 2.127 2.303 . 0 0 "[ . 1 . 2]" 1
1322 1 95 ILE HA 1 95 ILE HG12 3.500 . 3.800 3.270 3.194 3.343 . 0 0 "[ . 1 . 2]" 1
1323 1 95 ILE HA 1 95 ILE MG 3.500 . 3.800 2.324 2.286 2.376 . 0 0 "[ . 1 . 2]" 1
1324 1 95 ILE HA 1 98 HIS H 4.500 . 5.000 3.280 3.089 3.528 . 0 0 "[ . 1 . 2]" 1
1325 1 95 ILE HA 1 98 HIS HB2 4.500 . 5.000 2.437 2.282 2.580 . 0 0 "[ . 1 . 2]" 1
1326 1 95 ILE HA 1 98 HIS HB3 4.500 . 5.000 3.954 3.719 4.151 . 0 0 "[ . 1 . 2]" 1
1327 1 95 ILE HA 1 99 THR H 4.500 . 5.000 3.704 3.568 3.904 . 0 0 "[ . 1 . 2]" 1
1328 1 95 ILE HA 1 99 THR MG 4.500 . 5.000 4.480 4.391 4.665 . 0 0 "[ . 1 . 2]" 1
1329 1 95 ILE HA 1 118 GLU HG3 5.200 . 5.700 5.707 5.659 5.762 0.062 4 0 "[ . 1 . 2]" 1
1330 1 95 ILE HB 1 95 ILE MD 3.500 . 3.800 3.297 3.287 3.306 . 0 0 "[ . 1 . 2]" 1
1331 1 95 ILE HB 1 95 ILE HG12 2.500 . 2.800 2.398 2.352 2.439 . 0 0 "[ . 1 . 2]" 1
1332 1 95 ILE HB 1 96 LYS HE2 5.200 . 5.700 3.963 3.274 5.244 . 0 0 "[ . 1 . 2]" 1
1333 1 95 ILE MD 1 95 ILE MG 2.500 . 2.800 2.141 2.114 2.185 . 0 0 "[ . 1 . 2]" 1
1334 1 95 ILE MD 1 98 HIS HB3 4.500 . 5.000 4.385 4.031 4.662 . 0 0 "[ . 1 . 2]" 1
1335 1 95 ILE MD 1 117 MET H 4.500 . 5.000 4.879 4.790 4.983 . 0 0 "[ . 1 . 2]" 1
1336 1 95 ILE MD 1 117 MET HA 4.500 . 5.000 3.688 3.537 3.775 . 0 0 "[ . 1 . 2]" 1
1337 1 95 ILE MD 1 117 MET QB 3.500 . 3.800 2.494 2.111 2.685 . 0 0 "[ . 1 . 2]" 1
1338 1 95 ILE MD 1 118 GLU H 4.500 . 5.000 3.613 3.486 3.798 . 0 0 "[ . 1 . 2]" 1
1339 1 95 ILE MD 1 118 GLU HA 3.500 . 3.800 2.421 2.291 2.747 . 0 0 "[ . 1 . 2]" 1
1340 1 95 ILE MD 1 118 GLU HG3 3.500 . 3.800 3.577 3.452 3.829 0.029 19 0 "[ . 1 . 2]" 1
1341 1 95 ILE MD 1 119 ARG H 4.500 . 5.000 4.641 4.534 4.808 . 0 0 "[ . 1 . 2]" 1
1342 1 95 ILE MD 1 121 VAL HB 3.500 . 3.800 3.869 3.821 4.005 0.205 12 0 "[ . 1 . 2]" 1
1343 1 95 ILE HG12 1 95 ILE MG 3.500 . 3.800 3.210 3.136 3.275 . 0 0 "[ . 1 . 2]" 1
1344 1 95 ILE HG12 1 121 VAL MG2 3.500 . 3.800 2.796 2.612 2.878 . 0 0 "[ . 1 . 2]" 1
1345 1 95 ILE HG13 1 95 ILE MG 3.500 . 3.800 2.298 2.176 2.403 . 0 0 "[ . 1 . 2]" 1
1346 1 95 ILE HG13 1 118 GLU H 4.500 . 5.000 3.892 3.638 4.089 . 0 0 "[ . 1 . 2]" 1
1347 1 95 ILE HG13 1 119 ARG H 5.200 . 5.700 5.513 5.339 5.662 . 0 0 "[ . 1 . 2]" 1
1348 1 95 ILE HG13 1 121 VAL MG1 4.500 . 5.000 4.239 4.056 4.349 . 0 0 "[ . 1 . 2]" 1
1349 1 95 ILE MG 1 96 LYS H 4.500 . 5.000 3.970 3.888 4.045 . 0 0 "[ . 1 . 2]" 1
1350 1 95 ILE MG 1 96 LYS HA 4.500 . 5.000 4.034 3.899 4.140 . 0 0 "[ . 1 . 2]" 1
1351 1 95 ILE MG 1 96 LYS HE3 5.200 . 5.700 5.225 4.894 5.710 0.010 19 0 "[ . 1 . 2]" 1
1352 1 95 ILE MG 1 98 HIS HB2 4.500 . 5.000 3.695 3.563 3.827 . 0 0 "[ . 1 . 2]" 1
1353 1 95 ILE MG 1 98 HIS HB3 4.500 . 5.000 4.425 4.126 4.636 . 0 0 "[ . 1 . 2]" 1
1354 1 95 ILE MG 1 99 THR H 4.500 . 5.000 3.337 3.223 3.499 . 0 0 "[ . 1 . 2]" 1
1355 1 95 ILE MG 1 99 THR HA 5.200 . 5.700 4.194 4.071 4.336 . 0 0 "[ . 1 . 2]" 1
1356 1 95 ILE MG 1 99 THR HB 4.500 . 5.000 2.319 2.187 2.455 . 0 0 "[ . 1 . 2]" 1
1357 1 95 ILE MG 1 114 VAL HA 4.500 . 5.000 4.067 3.872 4.229 . 0 0 "[ . 1 . 2]" 1
1358 1 95 ILE MG 1 117 MET QB 4.500 . 5.000 2.574 2.296 2.746 . 0 0 "[ . 1 . 2]" 1
1359 1 95 ILE MG 1 117 MET ME 3.500 . 3.800 2.899 2.299 3.197 . 0 0 "[ . 1 . 2]" 1
1360 1 95 ILE MG 1 117 MET HG2 3.500 . 3.800 3.403 3.202 3.821 0.021 1 0 "[ . 1 . 2]" 1
1361 1 95 ILE MG 1 118 GLU H 4.500 . 5.000 3.803 3.694 3.922 . 0 0 "[ . 1 . 2]" 1
1362 1 95 ILE MG 1 118 GLU HG2 4.500 . 5.000 3.125 2.937 3.322 . 0 0 "[ . 1 . 2]" 1
1363 1 96 LYS H 1 96 LYS HB2 3.500 . 3.800 2.640 2.540 2.734 . 0 0 "[ . 1 . 2]" 1
1364 1 96 LYS H 1 96 LYS HG2 4.500 . 5.000 2.083 1.925 2.385 . 0 0 "[ . 1 . 2]" 1
1365 1 96 LYS H 1 97 GLN H 3.500 . 3.800 3.083 2.960 3.313 . 0 0 "[ . 1 . 2]" 1
1366 1 96 LYS H 1 98 HIS H 4.500 . 5.000 4.118 4.014 4.198 . 0 0 "[ . 1 . 2]" 1
1367 1 96 LYS HA 1 96 LYS HD3 3.500 . 3.800 2.848 2.629 3.455 . 0 0 "[ . 1 . 2]" 1
1368 1 96 LYS HA 1 96 LYS HE2 3.500 . 3.800 2.356 2.151 2.791 . 0 0 "[ . 1 . 2]" 1
1369 1 96 LYS HA 1 96 LYS HE3 3.500 . 3.800 3.782 3.587 3.862 0.062 4 0 "[ . 1 . 2]" 1
1370 1 96 LYS HA 1 96 LYS HG2 3.500 . 3.800 2.910 2.476 3.070 . 0 0 "[ . 1 . 2]" 1
1371 1 96 LYS HB2 1 96 LYS HD3 3.500 . 3.800 3.541 3.425 3.594 . 0 0 "[ . 1 . 2]" 1
1372 1 96 LYS HB2 1 97 GLN H 3.500 . 3.800 2.258 2.131 2.448 . 0 0 "[ . 1 . 2]" 1
1373 1 96 LYS HB2 1 98 HIS H 4.500 . 5.000 4.607 4.511 4.753 . 0 0 "[ . 1 . 2]" 1
1374 1 96 LYS HB3 1 96 LYS HD3 3.500 . 3.800 2.249 2.112 2.335 . 0 0 "[ . 1 . 2]" 1
1375 1 96 LYS HB3 1 96 LYS HE2 3.500 . 3.800 3.719 3.469 3.814 0.014 16 0 "[ . 1 . 2]" 1
1376 1 96 LYS HB3 1 96 LYS HE3 4.500 . 5.000 4.455 4.224 4.505 . 0 0 "[ . 1 . 2]" 1
1377 1 96 LYS HE3 1 96 LYS HG2 3.500 . 3.800 2.309 2.118 2.392 . 0 0 "[ . 1 . 2]" 1
1378 1 96 LYS HG3 1 97 GLN H 4.500 . 5.000 4.509 4.358 4.618 . 0 0 "[ . 1 . 2]" 1
1379 1 97 GLN H 1 98 HIS H 3.500 . 3.800 2.529 2.430 2.619 . 0 0 "[ . 1 . 2]" 1
1380 1 97 GLN H 1 98 HIS HB2 4.500 . 5.000 4.625 4.495 4.751 . 0 0 "[ . 1 . 2]" 1
1381 1 97 GLN H 1 100 VAL MG1 5.200 . 5.700 5.218 5.067 5.359 . 0 0 "[ . 1 . 2]" 1
1382 1 97 GLN H 1 100 VAL MG2 4.500 . 5.000 4.395 4.284 4.550 . 0 0 "[ . 1 . 2]" 1
1383 1 97 GLN HA 1 97 GLN HE21 5.200 . 5.700 3.130 1.959 4.318 . 0 0 "[ . 1 . 2]" 1
1384 1 97 GLN HA 1 97 GLN HE22 4.500 . 5.000 4.062 3.339 5.002 0.002 3 0 "[ . 1 . 2]" 1
1385 1 97 GLN HA 1 97 GLN HG2 3.500 . 3.800 2.936 2.042 3.737 . 0 0 "[ . 1 . 2]" 1
1386 1 97 GLN HA 1 97 GLN HG3 3.500 . 3.800 3.134 2.268 3.666 . 0 0 "[ . 1 . 2]" 1
1387 1 97 GLN HA 1 100 VAL H 4.500 . 5.000 3.745 3.546 3.929 . 0 0 "[ . 1 . 2]" 1
1388 1 97 GLN HA 1 100 VAL MG1 3.500 . 3.800 3.788 3.621 3.877 0.077 20 0 "[ . 1 . 2]" 1
1389 1 97 GLN HB2 1 97 GLN HE21 4.500 . 5.000 3.643 2.155 4.597 . 0 0 "[ . 1 . 2]" 1
1390 1 97 GLN HB2 1 97 GLN HE22 5.200 . 5.700 4.577 3.393 5.383 . 0 0 "[ . 1 . 2]" 1
1391 1 97 GLN HB3 1 97 GLN HE21 4.500 . 5.000 3.504 2.187 4.407 . 0 0 "[ . 1 . 2]" 1
1392 1 97 GLN HB3 1 97 GLN HE22 4.500 . 5.000 4.396 3.658 5.085 0.085 11 0 "[ . 1 . 2]" 1
1393 1 97 GLN HE21 1 98 HIS H 5.200 . 5.700 5.593 5.005 5.759 0.059 17 0 "[ . 1 . 2]" 1
1394 1 97 GLN HG3 1 98 HIS H 5.200 . 5.700 5.078 4.434 5.543 . 0 0 "[ . 1 . 2]" 1
1395 1 98 HIS H 1 98 HIS HB2 3.500 . 3.800 2.315 2.260 2.360 . 0 0 "[ . 1 . 2]" 1
1396 1 98 HIS H 1 100 VAL MG2 4.500 . 5.000 4.326 4.139 4.517 . 0 0 "[ . 1 . 2]" 1
1397 1 98 HIS H 1 101 THR MG 5.200 . 5.700 5.424 5.143 5.719 0.019 11 0 "[ . 1 . 2]" 1
1398 1 98 HIS HA 1 101 THR H 4.500 . 5.000 3.664 3.373 4.017 . 0 0 "[ . 1 . 2]" 1
1399 1 98 HIS HA 1 101 THR MG 4.500 . 5.000 3.165 2.840 3.636 . 0 0 "[ . 1 . 2]" 1
1400 1 98 HIS HB2 1 99 THR H 4.500 . 5.000 3.248 3.151 3.391 . 0 0 "[ . 1 . 2]" 1
1401 1 98 HIS HB2 1 99 THR HA 5.200 . 5.700 4.827 4.715 4.967 . 0 0 "[ . 1 . 2]" 1
1402 1 98 HIS HB2 1 99 THR HB 4.500 . 5.000 4.698 4.613 4.843 . 0 0 "[ . 1 . 2]" 1
1403 1 98 HIS HB2 1 99 THR MG 4.500 . 5.000 4.914 4.770 5.102 0.102 4 0 "[ . 1 . 2]" 1
1404 1 98 HIS HB2 1 101 THR MG 5.200 . 5.700 5.251 5.045 5.596 . 0 0 "[ . 1 . 2]" 1
1405 1 98 HIS HB3 1 99 THR H 4.500 . 5.000 3.840 3.739 3.901 . 0 0 "[ . 1 . 2]" 1
1406 1 98 HIS HB3 1 99 THR HA 4.500 . 5.000 4.316 4.188 4.377 . 0 0 "[ . 1 . 2]" 1
1407 1 98 HIS HB3 1 99 THR HB 4.500 . 5.000 4.994 4.858 5.126 0.126 4 0 "[ . 1 . 2]" 1
1408 1 98 HIS HB3 1 101 THR MG 4.500 . 5.000 4.201 3.924 4.549 . 0 0 "[ . 1 . 2]" 1
1409 1 99 THR H 1 99 THR MG 3.500 . 3.800 2.220 2.162 2.364 . 0 0 "[ . 1 . 2]" 1
1410 1 99 THR H 1 100 VAL H 3.500 . 3.800 2.467 2.403 2.571 . 0 0 "[ . 1 . 2]" 1
1411 1 99 THR H 1 100 VAL MG1 4.500 . 5.000 3.945 3.816 4.026 . 0 0 "[ . 1 . 2]" 1
1412 1 99 THR H 1 100 VAL MG2 4.500 . 5.000 3.831 3.709 4.143 . 0 0 "[ . 1 . 2]" 1
1413 1 99 THR H 1 101 THR H 4.500 . 5.000 3.999 3.906 4.119 . 0 0 "[ . 1 . 2]" 1
1414 1 99 THR HA 1 99 THR MG 3.500 . 3.800 3.249 3.236 3.263 . 0 0 "[ . 1 . 2]" 1
1415 1 99 THR HA 1 109 PHE QD 3.500 . 3.800 3.055 2.758 3.288 . 0 0 "[ . 1 . 2]" 1
1416 1 99 THR HA 1 117 MET ME 4.500 . 5.000 2.323 2.137 2.611 . 0 0 "[ . 1 . 2]" 1
1417 1 99 THR HB 1 100 VAL H 4.500 . 5.000 4.077 4.019 4.114 . 0 0 "[ . 1 . 2]" 1
1418 1 99 THR HB 1 109 PHE QE 4.500 . 5.000 4.628 4.321 4.828 . 0 0 "[ . 1 . 2]" 1
1419 1 99 THR HB 1 114 VAL MG2 4.500 . 5.000 3.110 2.798 3.425 . 0 0 "[ . 1 . 2]" 1
1420 1 99 THR HB 1 117 MET QB 5.200 . 5.700 4.458 4.354 4.638 . 0 0 "[ . 1 . 2]" 1
1421 1 99 THR HB 1 117 MET ME 3.500 . 3.800 2.563 2.269 2.735 . 0 0 "[ . 1 . 2]" 1
1422 1 99 THR HB 1 117 MET HG3 5.200 . 5.700 5.723 5.706 5.841 0.141 4 0 "[ . 1 . 2]" 1
1423 1 99 THR MG 1 100 VAL H 3.500 . 3.800 2.372 2.291 2.455 . 0 0 "[ . 1 . 2]" 1
1424 1 99 THR MG 1 100 VAL MG1 3.500 . 3.800 2.360 2.072 2.463 . 0 0 "[ . 1 . 2]" 1
1425 1 99 THR MG 1 100 VAL MG2 3.500 . 3.800 3.599 3.521 3.684 . 0 0 "[ . 1 . 2]" 1
1426 1 99 THR MG 1 109 PHE QD 4.500 . 5.000 4.220 4.095 4.364 . 0 0 "[ . 1 . 2]" 1
1427 1 100 VAL H 1 100 VAL MG1 3.500 . 3.800 2.248 2.157 2.313 . 0 0 "[ . 1 . 2]" 1
1428 1 100 VAL HA 1 100 VAL MG1 3.500 . 3.800 2.357 2.310 2.515 . 0 0 "[ . 1 . 2]" 1
1429 1 100 VAL HA 1 100 VAL MG2 3.500 . 3.800 3.242 3.223 3.282 . 0 0 "[ . 1 . 2]" 1
1430 1 100 VAL HA 1 103 THR HB 4.500 . 5.000 4.192 4.085 4.454 . 0 0 "[ . 1 . 2]" 1
1431 1 100 VAL HA 1 103 THR MG 4.500 . 5.000 2.247 2.082 2.376 . 0 0 "[ . 1 . 2]" 1
1432 1 100 VAL HB 1 101 THR HA 4.500 . 5.000 4.693 4.580 4.912 . 0 0 "[ . 1 . 2]" 1
1433 1 100 VAL HB 1 102 THR H 5.200 . 5.700 5.177 5.027 5.353 . 0 0 "[ . 1 . 2]" 1
1434 1 100 VAL HB 1 103 THR HB 4.500 . 5.000 4.938 4.721 5.019 0.019 13 0 "[ . 1 . 2]" 1
1435 1 100 VAL HB 1 103 THR MG 4.500 . 5.000 3.935 3.569 4.167 . 0 0 "[ . 1 . 2]" 1
1436 1 100 VAL HB 1 104 THR H 5.200 . 5.700 4.725 4.349 5.347 . 0 0 "[ . 1 . 2]" 1
1437 1 100 VAL MG1 1 103 THR HB 4.500 . 5.000 4.698 4.422 5.029 0.029 19 0 "[ . 1 . 2]" 1
1438 1 100 VAL MG1 1 103 THR MG 4.500 . 5.000 3.166 3.007 3.392 . 0 0 "[ . 1 . 2]" 1
1439 1 100 VAL MG2 1 101 THR H 3.500 . 3.800 2.787 2.662 3.075 . 0 0 "[ . 1 . 2]" 1
1440 1 100 VAL MG2 1 101 THR HA 4.500 . 5.000 3.313 3.159 3.507 . 0 0 "[ . 1 . 2]" 1
1441 1 100 VAL MG2 1 101 THR HB 4.500 . 5.000 3.820 3.662 4.116 . 0 0 "[ . 1 . 2]" 1
1442 1 101 THR H 1 101 THR MG 3.500 . 3.800 2.471 2.166 2.662 . 0 0 "[ . 1 . 2]" 1
1443 1 101 THR H 1 102 THR H 3.500 . 3.800 2.748 2.559 2.903 . 0 0 "[ . 1 . 2]" 1
1444 1 101 THR HA 1 101 THR MG 3.500 . 3.800 3.236 3.221 3.259 . 0 0 "[ . 1 . 2]" 1
1445 1 101 THR HA 1 102 THR H 3.500 . 3.800 3.502 3.466 3.559 . 0 0 "[ . 1 . 2]" 1
1446 1 101 THR MG 1 102 THR H 3.500 . 3.800 2.510 2.349 2.589 . 0 0 "[ . 1 . 2]" 1
1447 1 101 THR MG 1 102 THR HB 3.500 . 3.800 2.952 2.692 3.193 . 0 0 "[ . 1 . 2]" 1
1448 1 102 THR H 1 102 THR HB 3.500 . 3.800 2.604 2.257 2.919 . 0 0 "[ . 1 . 2]" 1
1449 1 102 THR H 1 102 THR MG 3.500 . 3.800 2.491 2.171 3.095 . 0 0 "[ . 1 . 2]" 1
1450 1 102 THR H 1 103 THR H 3.500 . 3.800 2.269 2.106 2.382 . 0 0 "[ . 1 . 2]" 1
1451 1 102 THR HA 1 102 THR MG 3.500 . 3.800 3.184 3.029 3.236 . 0 0 "[ . 1 . 2]" 1
1452 1 102 THR HA 1 105 LYS HB2 4.500 . 5.000 3.722 3.090 4.433 . 0 0 "[ . 1 . 2]" 1
1453 1 102 THR HA 1 105 LYS QE 4.500 . 5.000 2.629 2.068 3.706 . 0 0 "[ . 1 . 2]" 1
1454 1 102 THR HA 1 107 GLU HB2 4.500 . 5.000 3.979 3.638 4.466 . 0 0 "[ . 1 . 2]" 1
1455 1 102 THR HB 1 109 PHE QE 5.200 . 5.700 2.890 2.096 3.551 . 0 0 "[ . 1 . 2]" 1
1456 1 102 THR MG 1 103 THR HA 4.500 . 5.000 3.213 3.061 3.382 . 0 0 "[ . 1 . 2]" 1
1457 1 102 THR MG 1 103 THR MG 3.500 . 3.800 2.649 2.495 2.740 . 0 0 "[ . 1 . 2]" 1
1458 1 102 THR MG 1 104 THR H 4.500 . 5.000 4.561 4.464 4.607 . 0 0 "[ . 1 . 2]" 1
1459 1 102 THR MG 1 107 GLU H 4.500 . 5.000 3.681 3.479 4.086 . 0 0 "[ . 1 . 2]" 1
1460 1 102 THR MG 1 107 GLU HA 4.500 . 5.000 4.252 4.012 4.776 . 0 0 "[ . 1 . 2]" 1
1461 1 102 THR MG 1 107 GLU HB2 3.500 . 3.800 2.635 2.066 3.557 . 0 0 "[ . 1 . 2]" 1
1462 1 102 THR MG 1 107 GLU HB3 4.500 . 5.000 3.024 2.571 3.893 . 0 0 "[ . 1 . 2]" 1
1463 1 102 THR MG 1 108 ASN H 4.500 . 5.000 3.478 3.163 3.883 . 0 0 "[ . 1 . 2]" 1
1464 1 102 THR MG 1 108 ASN HA 4.500 . 5.000 2.397 2.175 2.646 . 0 0 "[ . 1 . 2]" 1
1465 1 102 THR MG 1 108 ASN HB2 4.500 . 5.000 4.418 4.216 4.696 . 0 0 "[ . 1 . 2]" 1
1466 1 102 THR MG 1 108 ASN HB3 4.500 . 5.000 4.177 3.902 4.441 . 0 0 "[ . 1 . 2]" 1
1467 1 102 THR MG 1 108 ASN HD21 5.200 . 5.700 5.274 4.913 5.634 . 0 0 "[ . 1 . 2]" 1
1468 1 102 THR MG 1 109 PHE H 4.500 . 5.000 3.491 3.063 4.252 . 0 0 "[ . 1 . 2]" 1
1469 1 102 THR MG 1 109 PHE QD 4.500 . 5.000 2.712 2.541 2.926 . 0 0 "[ . 1 . 2]" 1
1470 1 102 THR MG 1 109 PHE QE 4.500 . 5.000 2.480 2.134 2.658 . 0 0 "[ . 1 . 2]" 1
1471 1 102 THR MG 1 109 PHE HZ 4.500 . 5.000 3.922 3.474 4.242 . 0 0 "[ . 1 . 2]" 1
1472 1 103 THR H 1 103 THR MG 3.500 . 3.800 2.190 2.060 2.280 . 0 0 "[ . 1 . 2]" 1
1473 1 103 THR H 1 104 THR H 3.500 . 3.800 2.583 2.421 2.705 . 0 0 "[ . 1 . 2]" 1
1474 1 103 THR H 1 107 GLU H 4.500 . 5.000 4.970 4.712 5.028 0.028 6 0 "[ . 1 . 2]" 1
1475 1 103 THR HA 1 103 THR HB 2.500 . 2.800 2.452 2.415 2.500 . 0 0 "[ . 1 . 2]" 1
1476 1 103 THR HA 1 103 THR MG 2.500 . 2.800 2.385 2.343 2.439 . 0 0 "[ . 1 . 2]" 1
1477 1 103 THR HA 1 106 GLY H 3.500 . 3.800 3.097 2.946 3.244 . 0 0 "[ . 1 . 2]" 1
1478 1 103 THR HA 1 107 GLU HB2 4.500 . 5.000 4.152 3.847 4.685 . 0 0 "[ . 1 . 2]" 1
1479 1 103 THR HA 1 108 ASN HA 4.500 . 5.000 4.068 3.897 4.249 . 0 0 "[ . 1 . 2]" 1
1480 1 103 THR HA 1 108 ASN HB3 5.200 . 5.700 4.373 3.997 4.624 . 0 0 "[ . 1 . 2]" 1
1481 1 103 THR HB 1 108 ASN HA 5.200 . 5.700 5.229 4.895 5.543 . 0 0 "[ . 1 . 2]" 1
1482 1 103 THR HB 1 108 ASN HB3 4.500 . 5.000 4.880 4.528 5.020 0.020 13 0 "[ . 1 . 2]" 1
1483 1 103 THR MG 1 107 GLU H 4.500 . 5.000 4.518 4.244 4.652 . 0 0 "[ . 1 . 2]" 1
1484 1 103 THR MG 1 108 ASN H 4.500 . 5.000 4.852 4.681 4.988 . 0 0 "[ . 1 . 2]" 1
1485 1 103 THR MG 1 108 ASN HA 3.500 . 3.800 2.730 2.411 3.003 . 0 0 "[ . 1 . 2]" 1
1486 1 103 THR MG 1 108 ASN HB3 4.500 . 5.000 2.921 2.322 3.198 . 0 0 "[ . 1 . 2]" 1
1487 1 103 THR MG 1 109 PHE QD 4.500 . 5.000 3.986 3.618 4.286 . 0 0 "[ . 1 . 2]" 1
1488 1 104 THR H 1 104 THR HB 3.500 . 3.800 2.506 2.416 2.621 . 0 0 "[ . 1 . 2]" 1
1489 1 104 THR H 1 104 THR MG 3.500 . 3.800 2.221 2.059 2.356 . 0 0 "[ . 1 . 2]" 1
1490 1 104 THR H 1 105 LYS H 3.500 . 3.800 2.640 2.512 2.718 . 0 0 "[ . 1 . 2]" 1
1491 1 104 THR H 1 105 LYS HB2 5.200 . 5.700 4.912 4.824 5.119 . 0 0 "[ . 1 . 2]" 1
1492 1 104 THR H 1 105 LYS HG3 4.500 . 5.000 3.985 3.752 4.280 . 0 0 "[ . 1 . 2]" 1
1493 1 104 THR HA 1 104 THR HB 2.500 . 2.800 2.538 2.495 2.588 . 0 0 "[ . 1 . 2]" 1
1494 1 104 THR HA 1 104 THR MG 3.500 . 3.800 3.242 3.228 3.262 . 0 0 "[ . 1 . 2]" 1
1495 1 104 THR HA 1 105 LYS HG3 5.200 . 5.700 5.071 4.933 5.259 . 0 0 "[ . 1 . 2]" 1
1496 1 104 THR HB 1 105 LYS HG3 4.500 . 5.000 4.936 4.838 5.014 0.014 2 0 "[ . 1 . 2]" 1
1497 1 104 THR MG 1 105 LYS H 4.500 . 5.000 2.848 2.609 2.996 . 0 0 "[ . 1 . 2]" 1
1498 1 104 THR MG 1 105 LYS HB2 4.500 . 5.000 4.116 3.953 4.267 . 0 0 "[ . 1 . 2]" 1
1499 1 104 THR MG 1 105 LYS HD2 4.500 . 5.000 4.464 4.255 4.825 . 0 0 "[ . 1 . 2]" 1
1500 1 104 THR MG 1 105 LYS HD3 4.500 . 5.000 4.508 3.931 4.835 . 0 0 "[ . 1 . 2]" 1
1501 1 104 THR MG 1 105 LYS QE 3.500 . 3.800 3.279 3.010 3.643 . 0 0 "[ . 1 . 2]" 1
1502 1 104 THR MG 1 105 LYS HG2 3.500 . 3.800 3.024 2.790 3.206 . 0 0 "[ . 1 . 2]" 1
1503 1 104 THR MG 1 105 LYS HG3 3.500 . 3.800 2.329 2.240 2.454 . 0 0 "[ . 1 . 2]" 1
1504 1 104 THR MG 1 106 GLY H 4.500 . 5.000 4.527 4.410 4.645 . 0 0 "[ . 1 . 2]" 1
1505 1 105 LYS H 1 105 LYS HB2 3.500 . 3.800 2.569 2.481 2.617 . 0 0 "[ . 1 . 2]" 1
1506 1 105 LYS H 1 105 LYS HD3 4.500 . 5.000 5.050 4.803 5.194 0.194 11 0 "[ . 1 . 2]" 1
1507 1 105 LYS H 1 105 LYS QE 4.500 . 5.000 4.225 3.406 4.725 . 0 0 "[ . 1 . 2]" 1
1508 1 105 LYS H 1 105 LYS HG3 3.500 . 3.800 2.600 2.335 2.783 . 0 0 "[ . 1 . 2]" 1
1509 1 105 LYS H 1 106 GLY H 3.500 . 3.800 2.203 2.117 2.339 . 0 0 "[ . 1 . 2]" 1
1510 1 105 LYS H 1 106 GLY QA 4.500 . 5.000 4.138 4.072 4.272 . 0 0 "[ . 1 . 2]" 1
1511 1 105 LYS HA 1 105 LYS QE 5.200 . 5.700 4.842 4.511 5.196 . 0 0 "[ . 1 . 2]" 1
1512 1 105 LYS HA 1 105 LYS HG3 3.500 . 3.800 3.219 3.154 3.336 . 0 0 "[ . 1 . 2]" 1
1513 1 105 LYS HA 1 106 GLY QA 4.500 . 5.000 4.229 4.169 4.321 . 0 0 "[ . 1 . 2]" 1
1514 1 105 LYS HB2 1 105 LYS HD3 3.500 . 3.800 3.263 2.859 3.769 . 0 0 "[ . 1 . 2]" 1
1515 1 105 LYS HB2 1 105 LYS QE 3.500 . 3.800 3.298 2.029 3.887 0.087 12 0 "[ . 1 . 2]" 1
1516 1 105 LYS HB2 1 106 GLY H 4.500 . 5.000 3.538 3.246 3.720 . 0 0 "[ . 1 . 2]" 1
1517 1 105 LYS HB2 1 106 GLY QA 5.200 . 5.700 4.474 4.116 4.656 . 0 0 "[ . 1 . 2]" 1
1518 1 105 LYS HB3 1 105 LYS HD3 3.500 . 3.800 2.847 2.445 3.634 . 0 0 "[ . 1 . 2]" 1
1519 1 105 LYS HB3 1 105 LYS HE2 5.200 . 5.700 4.450 4.267 4.626 . 0 0 "[ . 1 . 2]" 1
1520 1 105 LYS HB3 1 105 LYS QE 4.500 . 5.000 3.809 3.098 4.197 . 0 0 "[ . 1 . 2]" 1
1521 1 105 LYS HB3 1 105 LYS HE3 5.200 . 5.700 4.264 3.181 4.809 . 0 0 "[ . 1 . 2]" 1
1522 1 105 LYS QE 1 105 LYS HG3 3.500 . 3.800 2.349 2.254 2.410 . 0 0 "[ . 1 . 2]" 1
1523 1 106 GLY H 1 107 GLU H 3.500 . 3.800 2.468 2.336 2.597 . 0 0 "[ . 1 . 2]" 1
1524 1 106 GLY H 1 107 GLU HB2 4.500 . 5.000 4.714 4.583 4.917 . 0 0 "[ . 1 . 2]" 1
1525 1 106 GLY QA 1 107 GLU H 3.500 . 3.800 2.931 2.825 2.964 . 0 0 "[ . 1 . 2]" 1
1526 1 106 GLY QA 1 107 GLU HB2 5.200 . 5.700 4.932 4.552 5.017 . 0 0 "[ . 1 . 2]" 1
1527 1 107 GLU H 1 107 GLU HB2 3.500 . 3.800 2.438 2.252 2.567 . 0 0 "[ . 1 . 2]" 1
1528 1 107 GLU H 1 108 ASN H 4.500 . 5.000 4.572 4.496 4.636 . 0 0 "[ . 1 . 2]" 1
1529 1 107 GLU HA 1 107 GLU HG2 3.500 . 3.800 2.612 2.484 2.681 . 0 0 "[ . 1 . 2]" 1
1530 1 107 GLU HA 1 107 GLU QG 3.500 . 3.800 2.491 2.403 2.540 . 0 0 "[ . 1 . 2]" 1
1531 1 107 GLU HA 1 107 GLU HG3 3.500 . 3.800 3.169 2.975 3.628 . 0 0 "[ . 1 . 2]" 1
1532 1 107 GLU HA 1 108 ASN H 2.500 . 2.800 2.492 2.366 2.607 . 0 0 "[ . 1 . 2]" 1
1533 1 107 GLU HA 1 108 ASN HB3 4.500 . 5.000 4.533 4.293 4.774 . 0 0 "[ . 1 . 2]" 1
1534 1 107 GLU HA 1 108 ASN HD22 4.500 . 5.000 4.815 4.578 5.032 0.032 9 0 "[ . 1 . 2]" 1
1535 1 107 GLU HB3 1 108 ASN H 3.500 . 3.800 2.513 2.318 2.690 . 0 0 "[ . 1 . 2]" 1
1536 1 107 GLU HB3 1 108 ASN HA 4.500 . 5.000 4.227 3.928 4.428 . 0 0 "[ . 1 . 2]" 1
1537 1 108 ASN H 1 108 ASN HB3 3.500 . 3.800 3.500 3.390 3.630 . 0 0 "[ . 1 . 2]" 1
1538 1 108 ASN H 1 109 PHE H 4.500 . 5.000 4.385 4.346 4.423 . 0 0 "[ . 1 . 2]" 1
1539 1 108 ASN HA 1 109 PHE H 3.500 . 3.800 2.382 2.248 2.606 . 0 0 "[ . 1 . 2]" 1
1540 1 108 ASN HA 1 109 PHE HA 4.500 . 5.000 4.425 4.366 4.502 . 0 0 "[ . 1 . 2]" 1
1541 1 108 ASN HA 1 109 PHE QD 4.500 . 5.000 3.595 3.336 3.801 . 0 0 "[ . 1 . 2]" 1
1542 1 108 ASN HB2 1 109 PHE H 3.500 . 3.800 2.472 2.226 2.782 . 0 0 "[ . 1 . 2]" 1
1543 1 108 ASN HB3 1 109 PHE QD 5.200 . 5.700 5.587 5.279 5.752 0.052 11 0 "[ . 1 . 2]" 1
1544 1 109 PHE H 1 109 PHE HB2 3.500 . 3.800 2.348 2.271 2.458 . 0 0 "[ . 1 . 2]" 1
1545 1 109 PHE H 1 109 PHE HB3 3.500 . 3.800 3.596 3.546 3.665 . 0 0 "[ . 1 . 2]" 1
1546 1 109 PHE H 1 110 THR H 4.500 . 5.000 4.537 4.382 4.650 . 0 0 "[ . 1 . 2]" 1
1547 1 109 PHE H 1 114 VAL MG2 5.200 . 5.700 4.303 4.035 4.837 . 0 0 "[ . 1 . 2]" 1
1548 1 109 PHE HA 1 109 PHE QD 3.500 . 3.800 2.978 2.805 3.086 . 0 0 "[ . 1 . 2]" 1
1549 1 109 PHE HA 1 109 PHE QE 5.200 . 5.700 4.647 4.607 4.723 . 0 0 "[ . 1 . 2]" 1
1550 1 109 PHE HA 1 110 THR H 3.500 . 3.800 2.268 2.186 2.361 . 0 0 "[ . 1 . 2]" 1
1551 1 109 PHE HA 1 110 THR MG 4.500 . 5.000 3.647 3.558 3.730 . 0 0 "[ . 1 . 2]" 1
1552 1 109 PHE HA 1 113 ASP HB2 4.500 . 5.000 3.188 2.929 3.486 . 0 0 "[ . 1 . 2]" 1
1553 1 109 PHE HA 1 113 ASP HB3 4.500 . 5.000 4.052 3.719 4.302 . 0 0 "[ . 1 . 2]" 1
1554 1 109 PHE HA 1 114 VAL HB 4.500 . 5.000 4.897 4.690 5.017 0.017 2 0 "[ . 1 . 2]" 1
1555 1 109 PHE HA 1 114 VAL MG2 5.200 . 5.700 5.107 4.891 5.347 . 0 0 "[ . 1 . 2]" 1
1556 1 109 PHE HA 1 117 MET ME 4.500 . 5.000 4.944 4.803 5.030 0.030 8 0 "[ . 1 . 2]" 1
1557 1 109 PHE HB2 1 110 THR H 4.500 . 5.000 4.175 4.005 4.279 . 0 0 "[ . 1 . 2]" 1
1558 1 109 PHE HB2 1 114 VAL MG2 3.500 . 3.800 2.599 2.347 3.017 . 0 0 "[ . 1 . 2]" 1
1559 1 109 PHE HB3 1 110 THR H 4.500 . 5.000 3.115 2.850 3.309 . 0 0 "[ . 1 . 2]" 1
1560 1 109 PHE HB3 1 113 ASP H 4.500 . 5.000 4.542 4.417 4.609 . 0 0 "[ . 1 . 2]" 1
1561 1 109 PHE HB3 1 113 ASP HA 5.200 . 5.700 4.787 4.676 4.923 . 0 0 "[ . 1 . 2]" 1
1562 1 109 PHE HB3 1 114 VAL H 4.500 . 5.000 3.062 2.956 3.147 . 0 0 "[ . 1 . 2]" 1
1563 1 109 PHE HB3 1 114 VAL HB 4.500 . 5.000 2.804 2.455 2.927 . 0 0 "[ . 1 . 2]" 1
1564 1 109 PHE HB3 1 114 VAL MG2 4.500 . 5.000 3.199 2.993 3.501 . 0 0 "[ . 1 . 2]" 1
1565 1 109 PHE HB3 1 117 MET ME 3.500 . 3.800 3.421 3.177 3.556 . 0 0 "[ . 1 . 2]" 1
1566 1 109 PHE QD 1 110 THR H 4.500 . 5.000 3.977 3.810 4.160 . 0 0 "[ . 1 . 2]" 1
1567 1 109 PHE QD 1 110 THR MG 5.200 . 5.700 5.251 5.021 5.431 . 0 0 "[ . 1 . 2]" 1
1568 1 109 PHE QD 1 113 ASP HB2 4.500 . 5.000 2.742 2.485 3.067 . 0 0 "[ . 1 . 2]" 1
1569 1 109 PHE QD 1 113 ASP HB3 4.500 . 5.000 2.077 1.919 2.154 . 0 0 "[ . 1 . 2]" 1
1570 1 109 PHE QD 1 114 VAL HB 5.200 . 5.700 4.575 4.366 4.725 . 0 0 "[ . 1 . 2]" 1
1571 1 109 PHE QD 1 114 VAL MG2 4.500 . 5.000 3.707 3.494 3.920 . 0 0 "[ . 1 . 2]" 1
1572 1 109 PHE QD 1 116 MET HB2 5.200 . 5.700 5.709 5.459 5.904 0.204 12 0 "[ . 1 . 2]" 1
1573 1 109 PHE QD 1 117 MET ME 3.500 . 3.800 2.798 2.647 2.912 . 0 0 "[ . 1 . 2]" 1
1574 1 109 PHE HZ 1 117 MET ME 4.500 . 5.000 3.264 3.109 3.623 . 0 0 "[ . 1 . 2]" 1
1575 1 110 THR H 1 110 THR MG 3.500 . 3.800 2.169 2.036 2.351 . 0 0 "[ . 1 . 2]" 1
1576 1 110 THR H 1 113 ASP H 4.500 . 5.000 3.530 3.364 3.821 . 0 0 "[ . 1 . 2]" 1
1577 1 110 THR H 1 113 ASP HB2 4.500 . 5.000 2.321 2.126 2.453 . 0 0 "[ . 1 . 2]" 1
1578 1 110 THR H 1 113 ASP HB3 4.500 . 5.000 3.807 3.625 3.983 . 0 0 "[ . 1 . 2]" 1
1579 1 110 THR H 1 114 VAL MG2 5.200 . 5.700 5.527 5.306 5.676 . 0 0 "[ . 1 . 2]" 1
1580 1 110 THR HA 1 110 THR MG 3.500 . 3.800 2.462 2.440 2.543 . 0 0 "[ . 1 . 2]" 1
1581 1 110 THR HA 1 111 GLU H 3.500 . 3.800 2.559 2.483 2.648 . 0 0 "[ . 1 . 2]" 1
1582 1 110 THR HA 1 112 THR H 4.500 . 5.000 4.633 4.477 4.847 . 0 0 "[ . 1 . 2]" 1
1583 1 110 THR HA 1 114 VAL HB 4.500 . 5.000 4.893 4.801 5.026 0.026 12 0 "[ . 1 . 2]" 1
1584 1 110 THR HA 1 114 VAL MG2 5.200 . 5.700 5.840 5.762 6.036 0.336 12 0 "[ . 1 . 2]" 1
1585 1 110 THR HB 1 111 GLU H 3.500 . 3.800 2.232 2.109 2.388 . 0 0 "[ . 1 . 2]" 1
1586 1 110 THR HB 1 111 GLU HB3 4.500 . 5.000 4.085 3.920 4.222 . 0 0 "[ . 1 . 2]" 1
1587 1 110 THR HB 1 112 THR H 3.500 . 3.800 3.166 2.998 3.387 . 0 0 "[ . 1 . 2]" 1
1588 1 110 THR HB 1 112 THR HB 4.500 . 5.000 4.528 4.139 4.858 . 0 0 "[ . 1 . 2]" 1
1589 1 110 THR MG 1 111 GLU H 3.500 . 3.800 3.760 3.695 3.836 0.036 13 0 "[ . 1 . 2]" 1
1590 1 110 THR MG 1 112 THR H 4.500 . 5.000 4.442 4.340 4.609 . 0 0 "[ . 1 . 2]" 1
1591 1 110 THR MG 1 112 THR HB 4.500 . 5.000 4.726 4.441 4.942 . 0 0 "[ . 1 . 2]" 1
1592 1 110 THR MG 1 113 ASP H 4.500 . 5.000 4.016 3.829 4.187 . 0 0 "[ . 1 . 2]" 1
1593 1 111 GLU H 1 111 GLU HB2 3.500 . 3.800 2.542 2.519 2.592 . 0 0 "[ . 1 . 2]" 1
1594 1 111 GLU H 1 111 GLU HB3 3.500 . 3.800 2.541 2.501 2.581 . 0 0 "[ . 1 . 2]" 1
1595 1 111 GLU H 1 111 GLU HG2 4.500 . 5.000 4.468 4.401 4.493 . 0 0 "[ . 1 . 2]" 1
1596 1 111 GLU H 1 112 THR H 3.500 . 3.800 2.858 2.779 2.942 . 0 0 "[ . 1 . 2]" 1
1597 1 111 GLU H 1 112 THR HB 5.200 . 5.700 5.240 5.128 5.349 . 0 0 "[ . 1 . 2]" 1
1598 1 111 GLU H 1 113 ASP H 4.500 . 5.000 4.380 4.305 4.463 . 0 0 "[ . 1 . 2]" 1
1599 1 111 GLU HA 1 111 GLU HG2 3.500 . 3.800 3.158 3.068 3.275 . 0 0 "[ . 1 . 2]" 1
1600 1 111 GLU HA 1 111 GLU HG3 3.500 . 3.800 2.496 2.437 2.551 . 0 0 "[ . 1 . 2]" 1
1601 1 111 GLU HA 1 115 LYS HD3 3.500 . 3.800 3.554 3.453 3.697 . 0 0 "[ . 1 . 2]" 1
1602 1 111 GLU HA 1 115 LYS HE2 4.500 . 5.000 3.973 3.709 4.299 . 0 0 "[ . 1 . 2]" 1
1603 1 111 GLU HA 1 115 LYS HE3 4.500 . 5.000 4.471 4.077 4.839 . 0 0 "[ . 1 . 2]" 1
1604 1 111 GLU HB2 1 115 LYS HE2 4.500 . 5.000 4.822 4.642 5.013 0.013 4 0 "[ . 1 . 2]" 1
1605 1 111 GLU HB2 1 115 LYS HE3 5.200 . 5.700 5.008 4.727 5.221 . 0 0 "[ . 1 . 2]" 1
1606 1 111 GLU HB3 1 112 THR H 3.500 . 3.800 2.557 2.408 2.650 . 0 0 "[ . 1 . 2]" 1
1607 1 111 GLU HG2 1 112 THR H 4.500 . 5.000 3.611 3.430 3.697 . 0 0 "[ . 1 . 2]" 1
1608 1 111 GLU HG2 1 112 THR HA 4.500 . 5.000 3.495 3.397 3.547 . 0 0 "[ . 1 . 2]" 1
1609 1 111 GLU HG2 1 112 THR HB 5.200 . 5.700 5.688 5.470 5.718 0.018 7 0 "[ . 1 . 2]" 1
1610 1 111 GLU HG2 1 114 VAL MG1 4.500 . 5.000 4.187 3.937 4.406 . 0 0 "[ . 1 . 2]" 1
1611 1 111 GLU HG2 1 115 LYS HE3 4.500 . 5.000 2.671 2.293 3.045 . 0 0 "[ . 1 . 2]" 1
1612 1 111 GLU HG3 1 112 THR HA 4.500 . 5.000 4.924 4.786 5.006 0.006 8 0 "[ . 1 . 2]" 1
1613 1 111 GLU HG3 1 115 LYS HD3 4.500 . 5.000 3.230 2.873 3.617 . 0 0 "[ . 1 . 2]" 1
1614 1 111 GLU HG3 1 115 LYS HE3 4.500 . 5.000 2.595 2.329 2.851 . 0 0 "[ . 1 . 2]" 1
1615 1 111 GLU HG3 1 115 LYS HG3 5.200 . 5.700 5.593 5.443 5.779 0.079 4 0 "[ . 1 . 2]" 1
1616 1 112 THR H 1 112 THR HB 3.500 . 3.800 2.663 2.588 2.716 . 0 0 "[ . 1 . 2]" 1
1617 1 112 THR H 1 112 THR MG 4.500 . 5.000 3.767 3.739 3.809 . 0 0 "[ . 1 . 2]" 1
1618 1 112 THR H 1 113 ASP H 3.500 . 3.800 2.781 2.686 2.864 . 0 0 "[ . 1 . 2]" 1
1619 1 112 THR H 1 114 VAL H 4.500 . 5.000 4.250 4.184 4.355 . 0 0 "[ . 1 . 2]" 1
1620 1 112 THR H 1 114 VAL MG1 4.500 . 5.000 4.765 4.614 4.938 . 0 0 "[ . 1 . 2]" 1
1621 1 112 THR HA 1 112 THR MG 3.500 . 3.800 2.313 2.268 2.393 . 0 0 "[ . 1 . 2]" 1
1622 1 112 THR HA 1 114 VAL H 4.500 . 5.000 4.497 4.441 4.566 . 0 0 "[ . 1 . 2]" 1
1623 1 112 THR HA 1 114 VAL MG1 4.500 . 5.000 4.723 4.602 4.845 . 0 0 "[ . 1 . 2]" 1
1624 1 112 THR HA 1 115 LYS H 4.500 . 5.000 3.597 3.511 3.659 . 0 0 "[ . 1 . 2]" 1
1625 1 112 THR HA 1 115 LYS HA 5.200 . 5.700 5.655 5.576 5.707 0.007 11 0 "[ . 1 . 2]" 1
1626 1 112 THR HA 1 115 LYS HB2 3.500 . 3.800 2.771 2.702 2.835 . 0 0 "[ . 1 . 2]" 1
1627 1 112 THR HA 1 115 LYS HB3 4.500 . 5.000 4.115 4.030 4.191 . 0 0 "[ . 1 . 2]" 1
1628 1 112 THR HA 1 115 LYS HD3 4.500 . 5.000 4.234 4.111 4.341 . 0 0 "[ . 1 . 2]" 1
1629 1 112 THR HA 1 115 LYS HE3 4.500 . 5.000 4.881 4.423 5.029 0.029 9 0 "[ . 1 . 2]" 1
1630 1 112 THR HA 1 115 LYS HG2 4.500 . 5.000 4.384 4.300 4.491 . 0 0 "[ . 1 . 2]" 1
1631 1 112 THR HA 1 115 LYS HG3 5.200 . 5.700 5.616 5.538 5.690 . 0 0 "[ . 1 . 2]" 1
1632 1 112 THR HA 1 116 MET HG2 5.200 . 5.700 4.079 3.995 4.150 . 0 0 "[ . 1 . 2]" 1
1633 1 112 THR HA 1 116 MET HG3 5.200 . 5.700 5.547 5.320 5.740 0.040 4 0 "[ . 1 . 2]" 1
1634 1 112 THR HB 1 113 ASP H 3.500 . 3.800 2.487 2.415 2.625 . 0 0 "[ . 1 . 2]" 1
1635 1 112 THR HB 1 116 MET ME 5.200 . 5.700 4.701 4.358 4.878 . 0 0 "[ . 1 . 2]" 1
1636 1 112 THR MG 1 113 ASP H 3.500 . 3.800 3.582 3.490 3.667 . 0 0 "[ . 1 . 2]" 1
1637 1 112 THR MG 1 113 ASP HA 4.500 . 5.000 3.581 3.390 3.717 . 0 0 "[ . 1 . 2]" 1
1638 1 112 THR MG 1 114 VAL H 5.200 . 5.700 5.148 5.073 5.203 . 0 0 "[ . 1 . 2]" 1
1639 1 112 THR MG 1 115 LYS H 4.500 . 5.000 4.749 4.633 4.815 . 0 0 "[ . 1 . 2]" 1
1640 1 112 THR MG 1 115 LYS HB2 4.500 . 5.000 4.074 4.001 4.119 . 0 0 "[ . 1 . 2]" 1
1641 1 112 THR MG 1 115 LYS HD3 5.200 . 5.700 5.758 5.714 5.824 0.124 4 0 "[ . 1 . 2]" 1
1642 1 112 THR MG 1 116 MET H 4.500 . 5.000 4.049 3.960 4.126 . 0 0 "[ . 1 . 2]" 1
1643 1 112 THR MG 1 116 MET ME 3.500 . 3.800 2.347 2.022 2.507 . 0 0 "[ . 1 . 2]" 1
1644 1 112 THR MG 1 116 MET HG2 4.500 . 5.000 2.597 2.470 2.706 . 0 0 "[ . 1 . 2]" 1
1645 1 112 THR MG 1 116 MET HG3 4.500 . 5.000 3.217 3.089 3.393 . 0 0 "[ . 1 . 2]" 1
1646 1 113 ASP H 1 113 ASP HB2 3.500 . 3.800 2.611 2.408 2.733 . 0 0 "[ . 1 . 2]" 1
1647 1 113 ASP H 1 113 ASP HB3 3.500 . 3.800 3.639 3.578 3.680 . 0 0 "[ . 1 . 2]" 1
1648 1 113 ASP H 1 114 VAL H 3.500 . 3.800 2.763 2.686 2.846 . 0 0 "[ . 1 . 2]" 1
1649 1 113 ASP H 1 114 VAL MG1 4.500 . 5.000 4.694 4.487 4.899 . 0 0 "[ . 1 . 2]" 1
1650 1 113 ASP H 1 115 LYS H 4.500 . 5.000 4.201 4.141 4.270 . 0 0 "[ . 1 . 2]" 1
1651 1 113 ASP H 1 116 MET H 5.200 . 5.700 4.692 4.637 4.822 . 0 0 "[ . 1 . 2]" 1
1652 1 113 ASP HA 1 114 VAL MG1 5.200 . 5.700 5.520 5.389 5.652 . 0 0 "[ . 1 . 2]" 1
1653 1 113 ASP HA 1 116 MET HB2 4.500 . 5.000 2.624 2.496 2.838 . 0 0 "[ . 1 . 2]" 1
1654 1 113 ASP HA 1 116 MET HG3 4.500 . 5.000 3.189 2.988 3.336 . 0 0 "[ . 1 . 2]" 1
1655 1 113 ASP HB2 1 114 VAL H 4.500 . 5.000 2.649 2.545 2.818 . 0 0 "[ . 1 . 2]" 1
1656 1 113 ASP HB2 1 114 VAL MG1 4.500 . 5.000 4.859 4.659 5.031 0.031 13 0 "[ . 1 . 2]" 1
1657 1 113 ASP HB2 1 114 VAL MG2 5.200 . 5.700 4.767 4.534 5.102 . 0 0 "[ . 1 . 2]" 1
1658 1 113 ASP HB2 1 117 MET ME 4.500 . 5.000 4.656 4.340 4.933 . 0 0 "[ . 1 . 2]" 1
1659 1 113 ASP HB3 1 116 MET HB2 4.500 . 5.000 4.244 4.098 4.436 . 0 0 "[ . 1 . 2]" 1
1660 1 113 ASP HB3 1 117 MET ME 4.500 . 5.000 4.176 3.981 4.413 . 0 0 "[ . 1 . 2]" 1
1661 1 114 VAL H 1 114 VAL HB 3.500 . 3.800 2.274 2.190 2.354 . 0 0 "[ . 1 . 2]" 1
1662 1 114 VAL H 1 115 LYS H 3.500 . 3.800 2.562 2.531 2.619 . 0 0 "[ . 1 . 2]" 1
1663 1 114 VAL H 1 115 LYS HD3 4.500 . 5.000 4.411 4.310 4.537 . 0 0 "[ . 1 . 2]" 1
1664 1 114 VAL H 1 117 MET QB 5.200 . 5.700 4.845 4.769 4.948 . 0 0 "[ . 1 . 2]" 1
1665 1 114 VAL HA 1 114 VAL MG1 3.500 . 3.800 3.207 3.168 3.256 . 0 0 "[ . 1 . 2]" 1
1666 1 114 VAL HA 1 114 VAL MG2 3.500 . 3.800 2.180 2.147 2.218 . 0 0 "[ . 1 . 2]" 1
1667 1 114 VAL HA 1 115 LYS HA 4.500 . 5.000 4.779 4.737 4.799 . 0 0 "[ . 1 . 2]" 1
1668 1 114 VAL HA 1 117 MET H 4.500 . 5.000 3.214 3.156 3.267 . 0 0 "[ . 1 . 2]" 1
1669 1 114 VAL HA 1 117 MET HA 5.200 . 5.700 5.227 5.148 5.290 . 0 0 "[ . 1 . 2]" 1
1670 1 114 VAL HA 1 117 MET QB 4.500 . 5.000 2.576 2.396 2.682 . 0 0 "[ . 1 . 2]" 1
1671 1 114 VAL HA 1 117 MET ME 3.500 . 3.800 2.482 2.243 2.743 . 0 0 "[ . 1 . 2]" 1
1672 1 114 VAL HB 1 115 LYS HD3 4.500 . 5.000 4.837 4.737 4.967 . 0 0 "[ . 1 . 2]" 1
1673 1 114 VAL HB 1 117 MET ME 4.500 . 5.000 4.157 3.886 4.449 . 0 0 "[ . 1 . 2]" 1
1674 1 114 VAL MG1 1 115 LYS H 3.500 . 3.800 2.383 2.337 2.446 . 0 0 "[ . 1 . 2]" 1
1675 1 114 VAL MG1 1 115 LYS HD3 4.500 . 5.000 2.302 2.220 2.414 . 0 0 "[ . 1 . 2]" 1
1676 1 114 VAL MG1 1 115 LYS HE2 4.500 . 5.000 3.320 3.166 3.519 . 0 0 "[ . 1 . 2]" 1
1677 1 114 VAL MG1 1 115 LYS HG3 4.500 . 5.000 4.364 4.243 4.417 . 0 0 "[ . 1 . 2]" 1
1678 1 114 VAL MG2 1 117 MET H 4.500 . 5.000 4.657 4.536 4.754 . 0 0 "[ . 1 . 2]" 1
1679 1 114 VAL MG2 1 117 MET QB 4.500 . 5.000 3.359 3.224 3.490 . 0 0 "[ . 1 . 2]" 1
1680 1 114 VAL MG2 1 117 MET ME 2.500 . 2.800 2.491 2.099 2.836 0.036 8 0 "[ . 1 . 2]" 1
1681 1 115 LYS H 1 115 LYS HG2 4.500 . 5.000 4.180 4.132 4.218 . 0 0 "[ . 1 . 2]" 1
1682 1 115 LYS H 1 116 MET H 3.500 . 3.800 2.552 2.513 2.657 . 0 0 "[ . 1 . 2]" 1
1683 1 115 LYS H 1 116 MET HB2 4.500 . 5.000 4.717 4.619 4.871 . 0 0 "[ . 1 . 2]" 1
1684 1 115 LYS H 1 117 MET H 4.500 . 5.000 4.031 3.978 4.104 . 0 0 "[ . 1 . 2]" 1
1685 1 115 LYS HA 1 115 LYS HD2 3.500 . 3.800 2.591 2.508 2.753 . 0 0 "[ . 1 . 2]" 1
1686 1 115 LYS HA 1 115 LYS HD3 4.500 . 5.000 3.080 2.870 3.203 . 0 0 "[ . 1 . 2]" 1
1687 1 115 LYS HA 1 115 LYS HE2 5.200 . 5.700 4.938 4.901 5.040 . 0 0 "[ . 1 . 2]" 1
1688 1 115 LYS HA 1 115 LYS HE3 5.200 . 5.700 4.936 4.878 4.992 . 0 0 "[ . 1 . 2]" 1
1689 1 115 LYS HA 1 115 LYS HG2 3.500 . 3.800 3.643 3.621 3.666 . 0 0 "[ . 1 . 2]" 1
1690 1 115 LYS HA 1 115 LYS HG3 3.500 . 3.800 2.490 2.446 2.512 . 0 0 "[ . 1 . 2]" 1
1691 1 115 LYS HB2 1 115 LYS HD3 3.500 . 3.800 2.436 2.414 2.502 . 0 0 "[ . 1 . 2]" 1
1692 1 115 LYS HB2 1 115 LYS HE3 4.500 . 5.000 3.751 3.452 3.868 . 0 0 "[ . 1 . 2]" 1
1693 1 115 LYS HB3 1 115 LYS HD3 3.500 . 3.800 3.602 3.551 3.656 . 0 0 "[ . 1 . 2]" 1
1694 1 115 LYS HB3 1 115 LYS HE3 4.500 . 5.000 4.534 4.395 4.584 . 0 0 "[ . 1 . 2]" 1
1695 1 115 LYS HB3 1 116 MET H 4.500 . 5.000 3.273 3.160 3.557 . 0 0 "[ . 1 . 2]" 1
1696 1 115 LYS HB3 1 116 MET HA 4.500 . 5.000 4.054 3.980 4.217 . 0 0 "[ . 1 . 2]" 1
1697 1 115 LYS HE3 1 115 LYS HG2 3.500 . 3.800 2.316 2.256 2.348 . 0 0 "[ . 1 . 2]" 1
1698 1 116 MET H 1 116 MET HG2 3.500 . 3.800 2.398 2.330 2.429 . 0 0 "[ . 1 . 2]" 1
1699 1 116 MET H 1 116 MET HG3 3.500 . 3.800 3.755 3.676 3.805 0.005 4 0 "[ . 1 . 2]" 1
1700 1 116 MET H 1 117 MET H 3.500 . 3.800 2.661 2.557 2.716 . 0 0 "[ . 1 . 2]" 1
1701 1 116 MET HA 1 116 MET ME 4.500 . 5.000 3.932 3.863 4.096 . 0 0 "[ . 1 . 2]" 1
1702 1 116 MET HA 1 116 MET HG2 3.500 . 3.800 3.054 2.972 3.189 . 0 0 "[ . 1 . 2]" 1
1703 1 116 MET HB2 1 116 MET ME 4.500 . 5.000 4.201 4.182 4.240 . 0 0 "[ . 1 . 2]" 1
1704 1 116 MET HB2 1 116 MET HG2 2.500 . 2.800 2.466 2.440 2.503 . 0 0 "[ . 1 . 2]" 1
1705 1 116 MET HB3 1 116 MET ME 3.500 . 3.800 3.864 3.845 3.903 0.103 12 0 "[ . 1 . 2]" 1
1706 1 116 MET HB3 1 117 MET H 4.500 . 5.000 3.581 3.513 3.691 . 0 0 "[ . 1 . 2]" 1
1707 1 116 MET ME 1 116 MET HG2 3.500 . 3.800 2.455 2.411 2.536 . 0 0 "[ . 1 . 2]" 1
1708 1 116 MET ME 1 116 MET HG3 3.500 . 3.800 2.389 2.341 2.435 . 0 0 "[ . 1 . 2]" 1
1709 1 116 MET HG3 1 120 VAL MG2 5.200 . 5.700 5.687 5.431 5.758 0.058 12 0 "[ . 1 . 2]" 1
1710 1 117 MET H 1 117 MET QB 3.500 . 3.800 2.099 1.984 2.151 . 0 0 "[ . 1 . 2]" 1
1711 1 117 MET H 1 117 MET ME 4.500 . 5.000 3.908 3.736 3.989 . 0 0 "[ . 1 . 2]" 1
1712 1 117 MET H 1 118 GLU H 3.500 . 3.800 2.744 2.578 2.900 . 0 0 "[ . 1 . 2]" 1
1713 1 117 MET H 1 118 GLU HG3 5.200 . 5.700 4.752 4.555 5.044 . 0 0 "[ . 1 . 2]" 1
1714 1 117 MET H 1 119 ARG H 4.500 . 5.000 3.933 3.753 4.044 . 0 0 "[ . 1 . 2]" 1
1715 1 117 MET H 1 120 VAL MG2 4.500 . 5.000 4.279 4.222 4.420 . 0 0 "[ . 1 . 2]" 1
1716 1 117 MET HA 1 117 MET ME 4.500 . 5.000 4.204 4.152 4.336 . 0 0 "[ . 1 . 2]" 1
1717 1 117 MET HA 1 117 MET HG2 3.500 . 3.800 2.554 2.240 2.649 . 0 0 "[ . 1 . 2]" 1
1718 1 117 MET HA 1 117 MET HG3 3.500 . 3.800 2.559 2.495 2.795 . 0 0 "[ . 1 . 2]" 1
1719 1 117 MET HA 1 120 VAL H 4.500 . 5.000 3.561 3.485 3.646 . 0 0 "[ . 1 . 2]" 1
1720 1 117 MET HA 1 120 VAL MG2 3.500 . 3.800 2.353 2.296 2.447 . 0 0 "[ . 1 . 2]" 1
1721 1 117 MET HA 1 121 VAL H 5.200 . 5.700 4.899 4.788 5.059 . 0 0 "[ . 1 . 2]" 1
1722 1 117 MET HA 1 121 VAL MG1 4.500 . 5.000 4.365 4.199 4.602 . 0 0 "[ . 1 . 2]" 1
1723 1 117 MET HA 1 121 VAL MG2 4.500 . 5.000 4.901 4.692 4.988 . 0 0 "[ . 1 . 2]" 1
1724 1 117 MET QB 1 117 MET ME 3.500 . 3.800 2.132 2.058 2.198 . 0 0 "[ . 1 . 2]" 1
1725 1 117 MET QB 1 118 GLU H 3.500 . 3.800 2.463 2.420 2.500 . 0 0 "[ . 1 . 2]" 1
1726 1 117 MET QB 1 118 GLU HA 4.500 . 5.000 3.884 3.682 3.957 . 0 0 "[ . 1 . 2]" 1
1727 1 117 MET QB 1 119 ARG H 4.500 . 5.000 4.410 4.318 4.451 . 0 0 "[ . 1 . 2]" 1
1728 1 117 MET QB 1 121 VAL MG1 5.200 . 5.700 4.772 4.344 5.031 . 0 0 "[ . 1 . 2]" 1
1729 1 117 MET ME 1 117 MET HG2 3.500 . 3.800 3.417 3.374 3.457 . 0 0 "[ . 1 . 2]" 1
1730 1 117 MET ME 1 117 MET HG3 3.500 . 3.800 2.555 2.379 2.658 . 0 0 "[ . 1 . 2]" 1
1731 1 118 GLU H 1 118 GLU HG3 3.500 . 3.800 2.412 2.310 2.602 . 0 0 "[ . 1 . 2]" 1
1732 1 118 GLU H 1 119 ARG H 3.500 . 3.800 2.646 2.585 2.710 . 0 0 "[ . 1 . 2]" 1
1733 1 118 GLU H 1 120 VAL H 4.500 . 5.000 4.402 4.307 4.477 . 0 0 "[ . 1 . 2]" 1
1734 1 118 GLU H 1 121 VAL MG1 5.200 . 5.700 5.306 5.232 5.578 . 0 0 "[ . 1 . 2]" 1
1735 1 118 GLU H 1 121 VAL MG2 4.500 . 5.000 4.459 4.346 4.533 . 0 0 "[ . 1 . 2]" 1
1736 1 118 GLU HA 1 118 GLU HG2 3.500 . 3.800 2.631 2.418 2.720 . 0 0 "[ . 1 . 2]" 1
1737 1 118 GLU HA 1 118 GLU HG3 3.500 . 3.800 2.829 2.762 2.922 . 0 0 "[ . 1 . 2]" 1
1738 1 118 GLU HA 1 119 ARG HA 5.200 . 5.700 4.673 4.598 4.708 . 0 0 "[ . 1 . 2]" 1
1739 1 118 GLU HA 1 120 VAL H 4.500 . 5.000 4.419 4.238 4.522 . 0 0 "[ . 1 . 2]" 1
1740 1 118 GLU QB 1 118 GLU HG2 2.500 . 2.800 2.307 2.271 2.358 . 0 0 "[ . 1 . 2]" 1
1741 1 118 GLU HG3 1 121 VAL MG2 4.500 . 5.000 4.685 4.545 4.806 . 0 0 "[ . 1 . 2]" 1
1742 1 119 ARG H 1 119 ARG HB3 3.500 . 3.800 2.626 2.478 2.781 . 0 0 "[ . 1 . 2]" 1
1743 1 119 ARG H 1 119 ARG HD2 5.200 . 5.700 4.819 4.456 5.097 . 0 0 "[ . 1 . 2]" 1
1744 1 119 ARG H 1 119 ARG HD3 4.500 . 5.000 4.443 4.271 4.691 . 0 0 "[ . 1 . 2]" 1
1745 1 119 ARG H 1 119 ARG HG2 4.500 . 5.000 4.651 4.609 4.750 . 0 0 "[ . 1 . 2]" 1
1746 1 119 ARG H 1 120 VAL H 3.500 . 3.800 2.539 2.447 2.598 . 0 0 "[ . 1 . 2]" 1
1747 1 119 ARG H 1 121 VAL MG1 4.500 . 5.000 5.132 5.054 5.354 0.354 4 0 "[ . 1 . 2]" 1
1748 1 119 ARG HA 1 119 ARG HD2 3.500 . 3.800 2.236 1.851 2.539 . 0 0 "[ . 1 . 2]" 1
1749 1 119 ARG HA 1 119 ARG HD3 3.500 . 3.800 2.739 2.414 2.957 . 0 0 "[ . 1 . 2]" 1
1750 1 119 ARG HA 1 119 ARG HG3 3.500 . 3.800 2.947 2.859 3.061 . 0 0 "[ . 1 . 2]" 1
1751 1 119 ARG HA 1 123 PRO HD2 4.500 . 5.000 4.580 4.417 4.791 . 0 0 "[ . 1 . 2]" 1
1752 1 119 ARG HA 1 123 PRO HD3 4.500 . 5.000 4.762 4.332 4.970 . 0 0 "[ . 1 . 2]" 1
1753 1 119 ARG HB3 1 119 ARG HD2 3.500 . 3.800 3.861 3.717 3.982 0.182 3 0 "[ . 1 . 2]" 1
1754 1 119 ARG HB3 1 119 ARG HD3 3.500 . 3.800 3.609 3.541 3.654 . 0 0 "[ . 1 . 2]" 1
1755 1 119 ARG HD2 1 120 VAL HA 5.200 . 5.700 5.684 5.422 5.738 0.038 14 0 "[ . 1 . 2]" 1
1756 1 119 ARG HD2 1 122 GLU HG2 5.200 . 5.700 4.882 4.294 5.167 . 0 0 "[ . 1 . 2]" 1
1757 1 119 ARG HD2 1 123 PRO HD2 4.500 . 5.000 4.964 4.627 5.025 0.025 10 0 "[ . 1 . 2]" 1
1758 1 119 ARG HD3 1 122 GLU HB2 4.500 . 5.000 4.820 4.348 5.009 0.009 13 0 "[ . 1 . 2]" 1
1759 1 120 VAL H 1 120 VAL MG1 4.500 . 5.000 3.795 3.767 3.881 . 0 0 "[ . 1 . 2]" 1
1760 1 120 VAL H 1 120 VAL MG2 3.500 . 3.800 1.936 1.884 2.097 . 0 0 "[ . 1 . 2]" 1
1761 1 120 VAL H 1 121 VAL H 3.500 . 3.800 2.524 2.480 2.547 . 0 0 "[ . 1 . 2]" 1
1762 1 120 VAL H 1 122 GLU H 4.500 . 5.000 4.099 3.993 4.218 . 0 0 "[ . 1 . 2]" 1
1763 1 120 VAL H 1 123 PRO HD2 5.200 . 5.700 4.808 4.754 4.946 . 0 0 "[ . 1 . 2]" 1
1764 1 120 VAL HA 1 120 VAL MG1 3.500 . 3.800 2.275 2.217 2.318 . 0 0 "[ . 1 . 2]" 1
1765 1 120 VAL HA 1 120 VAL MG2 3.500 . 3.800 2.630 2.584 2.706 . 0 0 "[ . 1 . 2]" 1
1766 1 120 VAL HA 1 122 GLU HB2 4.500 . 5.000 5.002 4.825 5.086 0.086 12 0 "[ . 1 . 2]" 1
1767 1 120 VAL HA 1 123 PRO HD2 4.500 . 5.000 3.090 2.909 3.185 . 0 0 "[ . 1 . 2]" 1
1768 1 120 VAL HA 1 123 PRO HD3 4.500 . 5.000 4.280 4.034 4.415 . 0 0 "[ . 1 . 2]" 1
1769 1 120 VAL HA 1 123 PRO HG3 4.500 . 5.000 4.011 3.710 5.028 0.028 10 0 "[ . 1 . 2]" 1
1770 1 120 VAL MG1 1 123 PRO HD2 4.500 . 5.000 4.265 4.066 4.322 . 0 0 "[ . 1 . 2]" 1
1771 1 120 VAL MG1 1 123 PRO HG2 4.500 . 5.000 3.982 3.787 4.360 . 0 0 "[ . 1 . 2]" 1
1772 1 120 VAL MG1 1 124 MET ME 3.500 . 3.800 2.124 2.048 2.242 . 0 0 "[ . 1 . 2]" 1
1773 1 120 VAL MG1 1 124 MET HG3 4.500 . 5.000 3.565 3.274 3.895 . 0 0 "[ . 1 . 2]" 1
1774 1 120 VAL MG2 1 123 PRO HD2 5.200 . 5.700 5.126 5.054 5.215 . 0 0 "[ . 1 . 2]" 1
1775 1 120 VAL MG2 1 123 PRO HG2 5.200 . 5.700 5.752 5.672 5.800 0.100 12 0 "[ . 1 . 2]" 1
1776 1 121 VAL H 1 121 VAL HB 3.500 . 3.800 3.608 3.574 3.625 . 0 0 "[ . 1 . 2]" 1
1777 1 121 VAL H 1 121 VAL MG1 3.500 . 3.800 2.261 2.203 2.543 . 0 0 "[ . 1 . 2]" 1
1778 1 121 VAL H 1 121 VAL MG2 3.500 . 3.800 1.936 1.809 1.985 . 0 0 "[ . 1 . 2]" 1
1779 1 121 VAL H 1 122 GLU H 4.500 . 5.000 2.585 2.520 2.766 . 0 0 "[ . 1 . 2]" 1
1780 1 121 VAL H 1 123 PRO HD3 5.200 . 5.700 5.511 5.163 5.745 0.045 12 0 "[ . 1 . 2]" 1
1781 1 121 VAL H 1 124 MET ME 4.500 . 5.000 3.810 3.691 3.947 . 0 0 "[ . 1 . 2]" 1
1782 1 121 VAL HA 1 121 VAL MG1 3.500 . 3.800 2.314 2.258 2.338 . 0 0 "[ . 1 . 2]" 1
1783 1 121 VAL HA 1 121 VAL MG2 3.500 . 3.800 3.199 3.189 3.212 . 0 0 "[ . 1 . 2]" 1
1784 1 121 VAL HA 1 124 MET H 4.500 . 5.000 3.252 3.155 3.465 . 0 0 "[ . 1 . 2]" 1
1785 1 121 VAL HA 1 124 MET ME 3.500 . 3.800 2.060 2.006 2.206 . 0 0 "[ . 1 . 2]" 1
1786 1 121 VAL HA 1 124 MET HG3 4.500 . 5.000 4.021 3.811 4.232 . 0 0 "[ . 1 . 2]" 1
1787 1 121 VAL HA 1 125 CYS H 4.500 . 5.000 3.829 3.739 3.897 . 0 0 "[ . 1 . 2]" 1
1788 1 121 VAL HB 1 125 CYS QB 4.500 . 5.000 4.748 4.615 4.790 . 0 0 "[ . 1 . 2]" 1
1789 1 121 VAL MG1 1 124 MET ME 3.500 . 3.800 2.237 2.141 2.365 . 0 0 "[ . 1 . 2]" 1
1790 1 121 VAL MG2 1 122 GLU H 3.500 . 3.800 2.636 2.612 2.725 . 0 0 "[ . 1 . 2]" 1
1791 1 121 VAL MG2 1 122 GLU HA 4.500 . 5.000 3.554 3.496 3.733 . 0 0 "[ . 1 . 2]" 1
1792 1 121 VAL MG2 1 122 GLU HG3 3.500 . 3.800 3.356 3.088 3.551 . 0 0 "[ . 1 . 2]" 1
1793 1 121 VAL MG2 1 123 PRO HD2 4.500 . 5.000 4.650 4.598 4.804 . 0 0 "[ . 1 . 2]" 1
1794 1 122 GLU H 1 122 GLU HB2 3.500 . 3.800 2.383 2.292 2.485 . 0 0 "[ . 1 . 2]" 1
1795 1 122 GLU H 1 123 PRO HD2 3.500 . 3.800 2.520 2.335 2.764 . 0 0 "[ . 1 . 2]" 1
1796 1 122 GLU H 1 123 PRO HD3 4.500 . 5.000 3.584 3.162 3.694 . 0 0 "[ . 1 . 2]" 1
1797 1 122 GLU HA 1 122 GLU HG2 3.500 . 3.800 2.310 2.233 2.397 . 0 0 "[ . 1 . 2]" 1
1798 1 122 GLU HA 1 122 GLU HG3 3.500 . 3.800 3.078 2.943 3.281 . 0 0 "[ . 1 . 2]" 1
1799 1 122 GLU HA 1 124 MET H 4.500 . 5.000 4.307 4.044 4.484 . 0 0 "[ . 1 . 2]" 1
1800 1 122 GLU HA 1 125 CYS QB 3.500 . 3.800 3.170 3.055 3.346 . 0 0 "[ . 1 . 2]" 1
1801 1 122 GLU HA 1 126 ILE MG 5.200 . 5.700 5.141 4.865 5.286 . 0 0 "[ . 1 . 2]" 1
1802 1 122 GLU HB2 1 123 PRO HD2 3.500 . 3.800 2.737 2.647 3.107 . 0 0 "[ . 1 . 2]" 1
1803 1 122 GLU HB2 1 123 PRO HD3 3.500 . 3.800 2.345 2.029 2.472 . 0 0 "[ . 1 . 2]" 1
1804 1 122 GLU HG2 1 125 CYS QB 5.200 . 5.700 4.919 4.741 5.105 . 0 0 "[ . 1 . 2]" 1
1805 1 123 PRO HA 1 126 ILE H 4.500 . 5.000 3.432 3.253 3.676 . 0 0 "[ . 1 . 2]" 1
1806 1 123 PRO HA 1 126 ILE HB 4.500 . 5.000 3.829 3.454 4.195 . 0 0 "[ . 1 . 2]" 1
1807 1 123 PRO HA 1 126 ILE MD 4.500 . 5.000 4.992 4.880 5.029 0.029 9 0 "[ . 1 . 2]" 1
1808 1 123 PRO HA 1 126 ILE MG 3.500 . 3.800 2.086 2.029 2.176 . 0 0 "[ . 1 . 2]" 1
1809 1 123 PRO HB3 1 126 ILE MG 4.500 . 5.000 3.789 3.604 3.950 . 0 0 "[ . 1 . 2]" 1
1810 1 123 PRO HD2 1 124 MET H 4.500 . 5.000 2.895 2.807 2.968 . 0 0 "[ . 1 . 2]" 1
1811 1 123 PRO HD2 1 124 MET HB2 4.500 . 5.000 4.502 4.219 4.623 . 0 0 "[ . 1 . 2]" 1
1812 1 123 PRO HD2 1 126 ILE MG 5.200 . 5.700 5.584 5.453 5.654 . 0 0 "[ . 1 . 2]" 1
1813 1 123 PRO HD3 1 124 MET H 4.500 . 5.000 4.043 3.947 4.113 . 0 0 "[ . 1 . 2]" 1
1814 1 123 PRO HD3 1 126 ILE MG 5.200 . 5.700 5.108 5.025 5.230 . 0 0 "[ . 1 . 2]" 1
1815 1 124 MET H 1 124 MET HB2 3.500 . 3.800 2.218 2.088 2.356 . 0 0 "[ . 1 . 2]" 1
1816 1 124 MET H 1 124 MET HG3 4.500 . 5.000 3.033 2.670 3.562 . 0 0 "[ . 1 . 2]" 1
1817 1 124 MET H 1 125 CYS H 3.500 . 3.800 2.692 2.598 2.768 . 0 0 "[ . 1 . 2]" 1
1818 1 124 MET H 1 125 CYS QB 5.200 . 5.700 4.684 4.508 4.815 . 0 0 "[ . 1 . 2]" 1
1819 1 124 MET H 1 126 ILE H 4.500 . 5.000 4.137 3.950 4.364 . 0 0 "[ . 1 . 2]" 1
1820 1 124 MET H 1 126 ILE MG 4.500 . 5.000 4.559 4.367 4.658 . 0 0 "[ . 1 . 2]" 1
1821 1 124 MET HA 1 124 MET ME 4.500 . 5.000 4.362 4.293 4.490 . 0 0 "[ . 1 . 2]" 1
1822 1 124 MET HA 1 124 MET HG2 3.500 . 3.800 2.301 2.224 2.352 . 0 0 "[ . 1 . 2]" 1
1823 1 124 MET HA 1 126 ILE MG 4.500 . 5.000 4.618 4.519 4.720 . 0 0 "[ . 1 . 2]" 1
1824 1 124 MET HA 1 127 THR MG 4.500 . 5.000 3.939 3.740 4.068 . 0 0 "[ . 1 . 2]" 1
1825 1 124 MET HB2 1 124 MET ME 3.500 . 3.800 2.172 2.120 2.241 . 0 0 "[ . 1 . 2]" 1
1826 1 124 MET HB2 1 125 CYS H 4.500 . 5.000 2.983 2.883 3.158 . 0 0 "[ . 1 . 2]" 1
1827 1 124 MET HB3 1 124 MET ME 2.500 . 2.800 2.843 2.791 2.931 0.131 4 0 "[ . 1 . 2]" 1
1828 1 124 MET HB3 1 125 CYS H 3.500 . 3.800 3.395 3.020 3.599 . 0 0 "[ . 1 . 2]" 1
1829 1 124 MET ME 1 124 MET HG2 3.500 . 3.800 3.410 3.378 3.457 . 0 0 "[ . 1 . 2]" 1
1830 1 124 MET ME 1 124 MET HG3 3.500 . 3.800 2.513 2.467 2.558 . 0 0 "[ . 1 . 2]" 1
1831 1 124 MET ME 1 125 CYS H 4.500 . 5.000 4.557 4.453 4.676 . 0 0 "[ . 1 . 2]" 1
1832 1 124 MET HG3 1 127 THR MG 5.200 . 5.700 5.576 5.323 5.808 0.108 4 0 "[ . 1 . 2]" 1
1833 1 125 CYS H 1 125 CYS QB 3.500 . 3.800 2.364 2.282 2.432 . 0 0 "[ . 1 . 2]" 1
1834 1 125 CYS H 1 126 ILE H 4.500 . 5.000 2.679 2.581 2.778 . 0 0 "[ . 1 . 2]" 1
1835 1 125 CYS H 1 127 THR H 4.500 . 5.000 4.069 3.935 4.219 . 0 0 "[ . 1 . 2]" 1
1836 1 125 CYS QB 1 126 ILE MG 4.500 . 5.000 4.561 4.316 4.705 . 0 0 "[ . 1 . 2]" 1
1837 1 126 ILE H 1 126 ILE HB 3.500 . 3.800 2.432 2.300 2.582 . 0 0 "[ . 1 . 2]" 1
1838 1 126 ILE H 1 126 ILE MG 3.500 . 3.800 2.469 2.255 2.629 . 0 0 "[ . 1 . 2]" 1
1839 1 126 ILE H 1 127 THR H 3.500 . 3.800 2.584 2.435 2.692 . 0 0 "[ . 1 . 2]" 1
1840 1 126 ILE HA 1 126 ILE MD 3.500 . 3.800 3.281 3.045 3.433 . 0 0 "[ . 1 . 2]" 1
1841 1 126 ILE HA 1 126 ILE HG13 3.500 . 3.800 3.354 3.297 3.445 . 0 0 "[ . 1 . 2]" 1
1842 1 126 ILE HA 1 126 ILE MG 3.500 . 3.800 3.241 3.203 3.295 . 0 0 "[ . 1 . 2]" 1
1843 1 126 ILE HA 1 128 GLN HB2 4.500 . 5.000 4.675 4.277 5.040 0.040 6 0 "[ . 1 . 2]" 1
1844 1 126 ILE HA 1 129 TYR H 4.500 . 5.000 3.218 2.914 3.459 . 0 0 "[ . 1 . 2]" 1
1845 1 126 ILE HA 1 129 TYR HB2 4.500 . 5.000 3.520 3.162 3.770 . 0 0 "[ . 1 . 2]" 1
1846 1 126 ILE HA 1 129 TYR HB3 4.500 . 5.000 3.631 3.206 4.083 . 0 0 "[ . 1 . 2]" 1
1847 1 126 ILE HB 1 126 ILE MD 3.500 . 3.800 3.221 3.196 3.255 . 0 0 "[ . 1 . 2]" 1
1848 1 126 ILE HB 1 127 THR H 4.500 . 5.000 4.150 4.062 4.299 . 0 0 "[ . 1 . 2]" 1
1849 1 126 ILE HB 1 129 TYR HB2 5.200 . 5.700 5.657 5.121 5.754 0.054 4 0 "[ . 1 . 2]" 1
1850 1 126 ILE MD 1 126 ILE MG 2.500 . 2.800 2.034 2.001 2.073 . 0 0 "[ . 1 . 2]" 1
1851 1 126 ILE MD 1 129 TYR H 4.500 . 5.000 4.015 3.856 4.396 . 0 0 "[ . 1 . 2]" 1
1852 1 126 ILE MD 1 129 TYR HA 5.200 . 5.700 5.058 4.760 5.723 0.023 20 0 "[ . 1 . 2]" 1
1853 1 126 ILE MD 1 129 TYR HB2 4.500 . 5.000 3.634 3.313 4.410 . 0 0 "[ . 1 . 2]" 1
1854 1 126 ILE MD 1 129 TYR HB3 4.500 . 5.000 2.488 2.174 3.183 . 0 0 "[ . 1 . 2]" 1
1855 1 126 ILE MD 1 130 GLU HG3 4.500 . 5.000 3.028 2.374 3.430 . 0 0 "[ . 1 . 2]" 1
1856 1 126 ILE HG13 1 126 ILE MG 3.500 . 3.800 2.768 2.690 2.815 . 0 0 "[ . 1 . 2]" 1
1857 1 126 ILE MG 1 127 THR H 3.500 . 3.800 2.803 2.530 3.057 . 0 0 "[ . 1 . 2]" 1
1858 1 126 ILE MG 1 127 THR HA 4.500 . 5.000 3.261 3.163 3.385 . 0 0 "[ . 1 . 2]" 1
1859 1 126 ILE MG 1 129 TYR HB2 5.200 . 5.700 5.265 4.985 5.715 0.015 15 0 "[ . 1 . 2]" 1
1860 1 126 ILE MG 1 129 TYR HB3 5.200 . 5.700 4.358 3.998 4.919 . 0 0 "[ . 1 . 2]" 1
1861 1 126 ILE MG 1 130 GLU HG2 4.500 . 5.000 3.443 2.535 4.886 . 0 0 "[ . 1 . 2]" 1
1862 1 126 ILE MG 1 130 GLU HG3 3.500 . 3.800 3.064 2.571 3.754 . 0 0 "[ . 1 . 2]" 1
1863 1 127 THR H 1 127 THR HB 3.500 . 3.800 3.030 2.648 3.405 . 0 0 "[ . 1 . 2]" 1
1864 1 127 THR H 1 127 THR MG 4.500 . 5.000 3.637 3.313 3.829 . 0 0 "[ . 1 . 2]" 1
1865 1 127 THR H 1 128 GLN HB2 5.200 . 5.700 4.928 4.476 5.265 . 0 0 "[ . 1 . 2]" 1
1866 1 127 THR H 1 130 GLU HG3 4.500 . 5.000 4.743 4.271 5.031 0.031 17 0 "[ . 1 . 2]" 1
1867 1 127 THR HA 1 127 THR MG 3.500 . 3.800 2.202 2.123 2.346 . 0 0 "[ . 1 . 2]" 1
1868 1 127 THR HA 1 130 GLU H 4.500 . 5.000 3.052 2.883 3.261 . 0 0 "[ . 1 . 2]" 1
1869 1 127 THR HA 1 130 GLU HB2 3.500 . 3.800 2.439 2.179 2.896 . 0 0 "[ . 1 . 2]" 1
1870 1 127 THR HA 1 130 GLU HB3 4.500 . 5.000 3.996 3.740 4.327 . 0 0 "[ . 1 . 2]" 1
1871 1 127 THR HA 1 130 GLU HG2 4.500 . 5.000 3.504 2.891 4.323 . 0 0 "[ . 1 . 2]" 1
1872 1 127 THR HA 1 130 GLU HG3 4.500 . 5.000 2.556 2.082 2.930 . 0 0 "[ . 1 . 2]" 1
1873 1 127 THR HB 1 130 GLU H 5.200 . 5.700 5.244 5.028 5.518 . 0 0 "[ . 1 . 2]" 1
1874 1 127 THR HB 1 131 ARG HD3 4.500 . 5.000 4.205 2.940 4.940 . 0 0 "[ . 1 . 2]" 1
1875 1 127 THR HB 1 131 ARG HG3 5.200 . 5.700 4.262 3.494 5.414 . 0 0 "[ . 1 . 2]" 1
1876 1 127 THR MG 1 128 GLN HA 4.500 . 5.000 4.291 3.766 4.877 . 0 0 "[ . 1 . 2]" 1
1877 1 127 THR MG 1 130 GLU HB2 3.500 . 3.800 2.923 2.649 3.215 . 0 0 "[ . 1 . 2]" 1
1878 1 127 THR MG 1 130 GLU HG2 4.500 . 5.000 4.702 4.155 5.151 0.151 4 0 "[ . 1 . 2]" 1
1879 1 127 THR MG 1 130 GLU HG3 4.500 . 5.000 3.607 2.939 4.016 . 0 0 "[ . 1 . 2]" 1
1880 1 127 THR MG 1 131 ARG HD2 4.500 . 5.000 3.364 2.647 4.234 . 0 0 "[ . 1 . 2]" 1
1881 1 127 THR MG 1 131 ARG HD3 4.500 . 5.000 3.789 2.728 4.786 . 0 0 "[ . 1 . 2]" 1
1882 1 127 THR MG 1 131 ARG HG2 4.500 . 5.000 3.737 2.871 4.598 . 0 0 "[ . 1 . 2]" 1
1883 1 127 THR MG 1 131 ARG HG3 4.500 . 5.000 2.881 2.303 3.715 . 0 0 "[ . 1 . 2]" 1
1884 1 128 GLN HA 1 128 GLN HE21 5.200 . 5.700 3.888 3.163 4.851 . 0 0 "[ . 1 . 2]" 1
1885 1 128 GLN HA 1 128 GLN HE22 5.200 . 5.700 4.231 3.542 5.639 . 0 0 "[ . 1 . 2]" 1
1886 1 128 GLN HA 1 130 GLU H 4.500 . 5.000 4.397 4.277 4.534 . 0 0 "[ . 1 . 2]" 1
1887 1 128 GLN HA 1 131 ARG HB3 4.500 . 5.000 4.566 4.034 5.243 0.243 6 0 "[ . 1 . 2]" 1
1888 1 128 GLN HA 1 131 ARG HD2 4.500 . 5.000 3.919 3.403 4.424 . 0 0 "[ . 1 . 2]" 1
1889 1 128 GLN HA 1 131 ARG HD3 4.500 . 5.000 2.419 2.054 2.830 . 0 0 "[ . 1 . 2]" 1
1890 1 128 GLN HA 1 131 ARG HG2 4.500 . 5.000 4.666 3.595 4.952 . 0 0 "[ . 1 . 2]" 1
1891 1 128 GLN HB2 1 128 GLN HE22 5.200 . 5.700 5.175 4.857 5.430 . 0 0 "[ . 1 . 2]" 1
1892 1 128 GLN HB3 1 128 GLN HE22 4.500 . 5.000 4.230 3.551 4.841 . 0 0 "[ . 1 . 2]" 1
1893 1 128 GLN HB3 1 129 TYR H 4.500 . 5.000 3.325 2.535 3.932 . 0 0 "[ . 1 . 2]" 1
1894 1 128 GLN HB3 1 131 ARG HD3 5.200 . 5.700 4.887 4.344 5.711 0.011 6 0 "[ . 1 . 2]" 1
1895 1 128 GLN HG2 1 131 ARG HD3 4.500 . 5.000 4.037 3.288 4.482 . 0 0 "[ . 1 . 2]" 1
1896 1 128 GLN HG3 1 131 ARG HD3 5.200 . 5.700 5.244 4.691 5.727 0.027 15 0 "[ . 1 . 2]" 1
1897 1 129 TYR HA 1 129 TYR QE 5.200 . 5.700 4.644 4.470 4.789 . 0 0 "[ . 1 . 2]" 1
1898 1 129 TYR HA 1 130 GLU HG2 5.200 . 5.700 5.536 5.369 5.755 0.055 16 0 "[ . 1 . 2]" 1
1899 1 129 TYR HA 1 132 GLU H 4.500 . 5.000 3.686 3.443 4.157 . 0 0 "[ . 1 . 2]" 1
1900 1 129 TYR HA 1 133 SER H 5.200 . 5.700 4.695 3.346 5.330 . 0 0 "[ . 1 . 2]" 1
1901 1 129 TYR HA 1 133 SER HB2 5.200 . 5.700 5.177 4.645 5.706 0.006 7 0 "[ . 1 . 2]" 1
1902 1 129 TYR HB2 1 129 TYR QE 4.500 . 5.000 4.489 4.443 4.575 . 0 0 "[ . 1 . 2]" 1
1903 1 129 TYR HB2 1 130 GLU H 4.500 . 5.000 3.758 3.668 3.957 . 0 0 "[ . 1 . 2]" 1
1904 1 129 TYR HB3 1 130 GLU HB3 5.200 . 5.700 5.610 5.425 5.725 0.025 7 0 "[ . 1 . 2]" 1
1905 1 129 TYR HB3 1 132 GLU H 5.200 . 5.700 5.517 5.304 5.724 0.024 18 0 "[ . 1 . 2]" 1
1906 1 129 TYR QD 1 130 GLU H 4.500 . 5.000 3.662 3.369 3.980 . 0 0 "[ . 1 . 2]" 1
1907 1 129 TYR QD 1 130 GLU HA 4.500 . 5.000 3.186 2.797 4.014 . 0 0 "[ . 1 . 2]" 1
1908 1 129 TYR QD 1 130 GLU HG2 4.500 . 5.000 3.584 2.986 4.032 . 0 0 "[ . 1 . 2]" 1
1909 1 129 TYR QE 1 133 SER HA 3.500 . 3.800 3.535 2.543 3.858 0.058 11 0 "[ . 1 . 2]" 1
1910 1 129 TYR QE 1 133 SER HB2 4.500 . 5.000 4.202 3.671 5.011 0.011 7 0 "[ . 1 . 2]" 1
1911 1 129 TYR QE 1 133 SER HB3 5.200 . 5.700 5.073 4.327 5.711 0.011 15 0 "[ . 1 . 2]" 1
1912 1 129 TYR QE 1 135 ALA MB 5.200 . 5.700 4.919 2.726 5.859 0.159 15 0 "[ . 1 . 2]" 1
1913 1 129 TYR QE 1 136 TYR H 4.500 . 5.000 4.625 3.400 5.029 0.029 10 0 "[ . 1 . 2]" 1
1914 1 129 TYR QE 1 136 TYR HB2 3.500 . 3.800 3.062 2.214 3.790 . 0 0 "[ . 1 . 2]" 1
1915 1 129 TYR QE 1 136 TYR HB3 3.500 . 3.800 3.158 2.428 3.606 . 0 0 "[ . 1 . 2]" 1
1916 1 129 TYR QE 1 137 TYR H 5.200 . 5.700 5.461 4.647 5.797 0.097 4 0 "[ . 1 . 2]" 1
1917 1 130 GLU H 1 130 GLU HB2 3.500 . 3.800 2.489 2.391 2.604 . 0 0 "[ . 1 . 2]" 1
1918 1 130 GLU H 1 130 GLU HG2 5.200 . 5.700 2.468 2.166 2.944 . 0 0 "[ . 1 . 2]" 1
1919 1 130 GLU H 1 132 GLU H 4.500 . 5.000 4.246 4.051 4.499 . 0 0 "[ . 1 . 2]" 1
1920 1 130 GLU HA 1 130 GLU HG2 3.500 . 3.800 2.656 2.284 2.946 . 0 0 "[ . 1 . 2]" 1
1921 1 130 GLU HA 1 131 ARG HA 4.500 . 5.000 4.802 4.761 4.832 . 0 0 "[ . 1 . 2]" 1
1922 1 130 GLU HA 1 132 GLU H 5.200 . 5.700 4.063 3.613 4.451 . 0 0 "[ . 1 . 2]" 1
1923 1 130 GLU HA 1 133 SER H 5.200 . 5.700 3.534 3.123 4.302 . 0 0 "[ . 1 . 2]" 1
1924 1 130 GLU HA 1 133 SER HB2 4.500 . 5.000 2.174 1.877 2.912 . 0 0 "[ . 1 . 2]" 1
1925 1 130 GLU HB2 1 131 ARG HD2 5.200 . 5.700 5.656 5.275 5.754 0.054 12 0 "[ . 1 . 2]" 1
1926 1 130 GLU HB2 1 133 SER HB2 5.200 . 5.700 5.047 4.832 5.761 0.061 4 0 "[ . 1 . 2]" 1
1927 1 130 GLU HB3 1 131 ARG HG3 5.200 . 5.700 4.700 4.412 5.542 . 0 0 "[ . 1 . 2]" 1
1928 1 131 ARG HA 1 131 ARG HD2 4.500 . 5.000 4.727 3.998 4.867 . 0 0 "[ . 1 . 2]" 1
1929 1 131 ARG HA 1 131 ARG HD3 5.200 . 5.700 4.685 4.515 5.218 . 0 0 "[ . 1 . 2]" 1
1930 1 131 ARG HA 1 131 ARG HG2 3.500 . 3.800 2.647 2.507 3.059 . 0 0 "[ . 1 . 2]" 1
1931 1 131 ARG HA 1 131 ARG HG3 3.500 . 3.800 2.972 2.731 3.679 . 0 0 "[ . 1 . 2]" 1
1932 1 131 ARG HB2 1 131 ARG HD2 3.500 . 3.800 3.625 3.300 3.699 . 0 0 "[ . 1 . 2]" 1
1933 1 131 ARG HB3 1 131 ARG HG2 2.500 . 2.800 2.436 2.345 2.672 . 0 0 "[ . 1 . 2]" 1
1934 1 131 ARG HB3 1 132 GLU H 3.500 . 3.800 3.855 3.569 4.255 0.455 13 0 "[ . 1 . 2]" 1
1935 1 132 GLU H 1 132 GLU QG 4.500 . 5.000 3.130 2.026 4.204 . 0 0 "[ . 1 . 2]" 1
1936 1 132 GLU HA 1 132 GLU QG 3.500 . 3.800 2.601 2.223 3.377 . 0 0 "[ . 1 . 2]" 1
1937 1 133 SER H 1 133 SER HB3 3.500 . 3.800 2.926 2.541 3.754 . 0 0 "[ . 1 . 2]" 1
1938 1 133 SER H 1 134 GLN H 3.500 . 3.800 2.970 2.662 3.362 . 0 0 "[ . 1 . 2]" 1
1939 1 133 SER HA 1 136 TYR H 4.500 . 5.000 3.115 2.725 3.590 . 0 0 "[ . 1 . 2]" 1
1940 1 133 SER HA 1 136 TYR HB3 4.500 . 5.000 2.987 2.407 3.607 . 0 0 "[ . 1 . 2]" 1
1941 1 133 SER HA 1 136 TYR QD 4.500 . 5.000 4.252 3.293 4.952 . 0 0 "[ . 1 . 2]" 1
1942 1 133 SER HA 1 137 TYR H 4.500 . 5.000 4.204 3.853 4.548 . 0 0 "[ . 1 . 2]" 1
1943 1 133 SER HA 1 137 TYR QD 5.200 . 5.700 4.687 4.202 5.220 . 0 0 "[ . 1 . 2]" 1
1944 1 133 SER HB2 1 134 GLN H 4.500 . 5.000 4.309 3.954 4.622 . 0 0 "[ . 1 . 2]" 1
1945 1 133 SER HB2 1 136 TYR HB3 4.500 . 5.000 4.536 4.061 4.984 . 0 0 "[ . 1 . 2]" 1
1946 1 133 SER HB3 1 134 GLN H 4.500 . 5.000 3.580 2.792 4.286 . 0 0 "[ . 1 . 2]" 1
1947 1 133 SER HB3 1 134 GLN HA 5.200 . 5.700 4.447 4.326 4.581 . 0 0 "[ . 1 . 2]" 1
1948 1 134 GLN H 1 134 GLN HB3 3.500 . 3.800 3.554 3.415 3.622 . 0 0 "[ . 1 . 2]" 1
1949 1 134 GLN H 1 134 GLN HG2 3.500 . 3.800 2.608 2.225 3.019 . 0 0 "[ . 1 . 2]" 1
1950 1 134 GLN H 1 134 GLN HG3 3.500 . 3.800 3.773 3.573 3.842 0.042 15 0 "[ . 1 . 2]" 1
1951 1 134 GLN H 1 137 TYR QD 4.500 . 5.000 4.197 3.799 5.007 0.007 17 0 "[ . 1 . 2]" 1
1952 1 134 GLN HA 1 134 GLN HE21 4.500 . 5.000 3.017 2.842 3.261 . 0 0 "[ . 1 . 2]" 1
1953 1 134 GLN HA 1 134 GLN HE22 4.500 . 5.000 3.504 3.357 3.708 . 0 0 "[ . 1 . 2]" 1
1954 1 134 GLN HA 1 134 GLN HG2 3.500 . 3.800 2.792 2.487 3.039 . 0 0 "[ . 1 . 2]" 1
1955 1 134 GLN HA 1 134 GLN HG3 3.500 . 3.800 3.667 3.587 3.755 . 0 0 "[ . 1 . 2]" 1
1956 1 134 GLN HA 1 137 TYR H 4.500 . 5.000 3.221 2.985 3.415 . 0 0 "[ . 1 . 2]" 1
1957 1 134 GLN HA 1 137 TYR HB2 4.500 . 5.000 2.335 1.974 2.718 . 0 0 "[ . 1 . 2]" 1
1958 1 134 GLN HA 1 137 TYR HB3 4.500 . 5.000 3.934 3.197 4.366 . 0 0 "[ . 1 . 2]" 1
1959 1 134 GLN HA 1 137 TYR QD 4.500 . 5.000 2.802 2.293 3.809 . 0 0 "[ . 1 . 2]" 1
1960 1 134 GLN HB2 1 134 GLN HE21 4.500 . 5.000 4.381 4.228 4.473 . 0 0 "[ . 1 . 2]" 1
1961 1 134 GLN HB2 1 134 GLN HE22 4.500 . 5.000 5.271 5.206 5.311 0.311 7 0 "[ . 1 . 2]" 1
1962 1 134 GLN HB3 1 134 GLN HE21 4.500 . 5.000 4.248 4.112 4.348 . 0 0 "[ . 1 . 2]" 1
1963 1 134 GLN HB3 1 134 GLN HG3 2.500 . 2.800 2.488 2.441 2.539 . 0 0 "[ . 1 . 2]" 1
1964 1 134 GLN HE21 1 134 GLN HG3 3.500 . 3.800 3.292 3.194 3.383 . 0 0 "[ . 1 . 2]" 1
1965 1 134 GLN HE21 1 137 TYR HB2 4.500 . 5.000 4.021 3.604 4.318 . 0 0 "[ . 1 . 2]" 1
1966 1 134 GLN HE21 1 137 TYR QD 4.500 . 5.000 2.986 2.380 4.125 . 0 0 "[ . 1 . 2]" 1
1967 1 134 GLN HE21 1 137 TYR QE 4.500 . 5.000 4.248 3.428 5.013 0.013 6 0 "[ . 1 . 2]" 1
1968 1 134 GLN HE21 1 138 GLN HG3 4.500 . 5.000 4.919 4.373 5.040 0.040 2 0 "[ . 1 . 2]" 1
1969 1 134 GLN HE22 1 137 TYR HB2 5.200 . 5.700 3.830 3.483 4.166 . 0 0 "[ . 1 . 2]" 1
1970 1 134 GLN HE22 1 138 GLN HG3 4.500 . 5.000 4.114 3.205 4.502 . 0 0 "[ . 1 . 2]" 1
1971 1 135 ALA H 1 136 TYR H 3.500 . 3.800 2.654 2.520 2.792 . 0 0 "[ . 1 . 2]" 1
1972 1 135 ALA H 1 136 TYR HB3 4.500 . 5.000 4.620 4.385 4.841 . 0 0 "[ . 1 . 2]" 1
1973 1 135 ALA H 1 137 TYR H 4.500 . 5.000 4.232 4.028 4.379 . 0 0 "[ . 1 . 2]" 1
1974 1 135 ALA H 1 138 GLN H 5.200 . 5.700 4.915 4.768 5.097 . 0 0 "[ . 1 . 2]" 1
1975 1 135 ALA MB 1 136 TYR H 3.500 . 3.800 2.659 2.412 2.852 . 0 0 "[ . 1 . 2]" 1
1976 1 135 ALA MB 1 136 TYR HB2 4.500 . 5.000 4.234 4.050 4.427 . 0 0 "[ . 1 . 2]" 1
1977 1 135 ALA MB 1 137 TYR H 4.500 . 5.000 4.705 4.538 4.900 . 0 0 "[ . 1 . 2]" 1
1978 1 136 TYR H 1 136 TYR HB2 3.500 . 3.800 2.904 2.652 3.194 . 0 0 "[ . 1 . 2]" 1
1979 1 136 TYR H 1 136 TYR HB3 3.500 . 3.800 2.221 2.036 2.383 . 0 0 "[ . 1 . 2]" 1
1980 1 136 TYR H 1 137 TYR H 3.500 . 3.800 2.539 2.307 2.824 . 0 0 "[ . 1 . 2]" 1
1981 1 136 TYR HA 1 136 TYR QD 3.500 . 3.800 2.799 2.467 3.138 . 0 0 "[ . 1 . 2]" 1
1982 1 136 TYR HA 1 136 TYR QE 5.200 . 5.700 4.863 4.589 5.138 . 0 0 "[ . 1 . 2]" 1
1983 1 136 TYR HB2 1 136 TYR QE 4.500 . 5.000 4.525 4.493 4.568 . 0 0 "[ . 1 . 2]" 1
1984 1 136 TYR HB3 1 136 TYR QE 4.500 . 5.000 4.445 4.424 4.507 . 0 0 "[ . 1 . 2]" 1
1985 1 136 TYR HB3 1 137 TYR HA 4.500 . 5.000 4.536 4.268 4.921 . 0 0 "[ . 1 . 2]" 1
1986 1 136 TYR HB3 1 137 TYR QD 5.200 . 5.700 4.346 3.715 4.674 . 0 0 "[ . 1 . 2]" 1
1987 1 136 TYR QD 1 137 TYR HA 4.500 . 5.000 3.513 3.048 3.878 . 0 0 "[ . 1 . 2]" 1
1988 1 136 TYR QD 1 137 TYR QD 3.500 . 3.800 3.071 2.254 3.514 . 0 0 "[ . 1 . 2]" 1
1989 1 136 TYR QE 1 137 TYR HA 4.500 . 5.000 4.095 3.583 4.501 . 0 0 "[ . 1 . 2]" 1
1990 1 136 TYR QE 1 137 TYR QE 3.500 . 3.800 2.900 2.253 3.566 . 0 0 "[ . 1 . 2]" 1
1991 1 137 TYR H 1 137 TYR HB2 3.500 . 3.800 2.319 2.054 2.544 . 0 0 "[ . 1 . 2]" 1
1992 1 137 TYR H 1 137 TYR HB3 3.500 . 3.800 3.552 3.377 3.612 . 0 0 "[ . 1 . 2]" 1
1993 1 137 TYR H 1 137 TYR QD 4.500 . 5.000 3.152 2.621 3.384 . 0 0 "[ . 1 . 2]" 1
1994 1 137 TYR H 1 138 GLN H 3.500 . 3.800 2.887 2.734 3.019 . 0 0 "[ . 1 . 2]" 1
1995 1 137 TYR HA 1 137 TYR QD 3.500 . 3.800 2.265 1.993 3.054 . 0 0 "[ . 1 . 2]" 1
1996 1 137 TYR HA 1 137 TYR QE 4.500 . 5.000 4.393 4.238 4.553 . 0 0 "[ . 1 . 2]" 1
1997 1 137 TYR HB2 1 138 GLN H 3.500 . 3.800 2.483 2.100 2.877 . 0 0 "[ . 1 . 2]" 1
1998 1 137 TYR HB2 1 138 GLN HB3 5.200 . 5.700 5.598 5.091 6.139 0.439 17 0 "[ . 1 . 2]" 1
1999 1 137 TYR HB2 1 138 GLN HG2 4.500 . 5.000 4.119 2.897 4.993 . 0 0 "[ . 1 . 2]" 1
2000 1 137 TYR HB3 1 137 TYR QE 4.500 . 5.000 4.554 4.432 4.615 . 0 0 "[ . 1 . 2]" 1
2001 1 137 TYR HB3 1 138 GLN H 3.500 . 3.800 3.193 2.894 3.463 . 0 0 "[ . 1 . 2]" 1
2002 1 137 TYR HB3 1 138 GLN HB2 4.500 . 5.000 5.208 4.762 5.371 0.371 11 0 "[ . 1 . 2]" 1
2003 1 137 TYR HB3 1 138 GLN HG2 4.500 . 5.000 3.928 3.117 4.377 . 0 0 "[ . 1 . 2]" 1
2004 1 137 TYR HB3 1 138 GLN HG3 4.500 . 5.000 3.832 2.878 4.866 . 0 0 "[ . 1 . 2]" 1
2005 1 137 TYR QD 1 138 GLN HG3 5.200 . 5.700 4.906 4.142 5.712 0.012 15 0 "[ . 1 . 2]" 1
2006 1 138 GLN H 1 138 GLN HB2 3.500 . 3.800 2.453 2.372 2.565 . 0 0 "[ . 1 . 2]" 1
2007 1 138 GLN H 1 138 GLN HE21 5.200 . 5.700 5.093 3.999 5.474 . 0 0 "[ . 1 . 2]" 1
2008 1 138 GLN H 1 138 GLN HG3 3.500 . 3.800 2.484 2.222 3.375 . 0 0 "[ . 1 . 2]" 1
2009 1 138 GLN HA 1 138 GLN HB3 2.500 . 2.800 2.449 2.399 2.497 . 0 0 "[ . 1 . 2]" 1
2010 1 138 GLN HA 1 138 GLN HE21 5.200 . 5.700 4.670 4.159 5.213 . 0 0 "[ . 1 . 2]" 1
2011 1 138 GLN HA 1 138 GLN HE22 5.200 . 5.700 5.622 4.995 5.753 0.053 14 0 "[ . 1 . 2]" 1
2012 1 138 GLN HA 1 138 GLN HG2 3.500 . 3.800 2.425 2.203 2.784 . 0 0 "[ . 1 . 2]" 1
2013 1 138 GLN HA 1 138 GLN HG3 3.500 . 3.800 3.240 2.947 3.805 0.005 15 0 "[ . 1 . 2]" 1
2014 1 138 GLN HA 1 139 ARG H 3.500 . 3.800 3.549 3.427 3.649 . 0 0 "[ . 1 . 2]" 1
2015 1 138 GLN HA 1 140 GLY H 4.500 . 5.000 4.149 3.382 4.657 . 0 0 "[ . 1 . 2]" 1
2016 1 138 GLN HA 1 141 SER H 4.500 . 5.000 3.715 3.012 4.814 . 0 0 "[ . 1 . 2]" 1
2017 1 138 GLN HA 1 141 SER HB2 4.500 . 5.000 3.090 2.094 3.874 . 0 0 "[ . 1 . 2]" 1
2018 1 138 GLN HB2 1 138 GLN HE22 5.200 . 5.700 4.683 3.795 5.198 . 0 0 "[ . 1 . 2]" 1
2019 1 138 GLN HB3 1 138 GLN HE22 5.200 . 5.700 4.233 3.613 4.551 . 0 0 "[ . 1 . 2]" 1
2020 1 138 GLN HG2 1 141 SER HB2 5.200 . 5.700 5.031 3.958 5.730 0.030 6 0 "[ . 1 . 2]" 1
2021 1 139 ARG H 1 139 ARG HB2 3.500 . 3.800 2.348 2.068 2.502 . 0 0 "[ . 1 . 2]" 1
2022 1 139 ARG H 1 139 ARG HG3 4.500 . 5.000 3.984 2.561 4.544 . 0 0 "[ . 1 . 2]" 1
2023 1 139 ARG H 1 140 GLY H 3.500 . 3.800 2.572 2.414 2.747 . 0 0 "[ . 1 . 2]" 1
2024 1 139 ARG H 1 140 GLY HA2 5.200 . 5.700 5.244 5.116 5.385 . 0 0 "[ . 1 . 2]" 1
2025 1 139 ARG H 1 140 GLY HA3 5.200 . 5.700 4.889 4.728 5.061 . 0 0 "[ . 1 . 2]" 1
2026 1 139 ARG H 1 141 SER H 4.500 . 5.000 4.216 3.876 4.903 . 0 0 "[ . 1 . 2]" 1
2027 1 139 ARG HA 1 139 ARG HD2 4.500 . 5.000 4.353 3.443 4.789 . 0 0 "[ . 1 . 2]" 1
2028 1 139 ARG HA 1 139 ARG HD3 4.500 . 5.000 4.239 2.112 4.899 . 0 0 "[ . 1 . 2]" 1
2029 1 139 ARG HA 1 139 ARG HG2 3.500 . 3.800 2.665 2.291 3.093 . 0 0 "[ . 1 . 2]" 1
2030 1 139 ARG HA 1 139 ARG HG3 3.500 . 3.800 2.936 2.490 3.637 . 0 0 "[ . 1 . 2]" 1
2031 1 139 ARG HA 1 140 GLY HA3 4.500 . 5.000 5.297 4.992 5.371 0.371 4 0 "[ . 1 . 2]" 1
2032 1 139 ARG HB2 1 139 ARG HG2 2.500 . 2.800 2.932 2.500 3.045 0.245 13 0 "[ . 1 . 2]" 1
2033 1 139 ARG HB2 1 140 GLY H 4.500 . 5.000 3.586 2.641 4.309 . 0 0 "[ . 1 . 2]" 1
2034 1 139 ARG HB3 1 139 ARG QD 2.500 . 2.800 2.363 2.100 2.826 0.026 5 0 "[ . 1 . 2]" 1
2035 1 139 ARG HB3 1 140 GLY H 4.500 . 5.000 3.111 2.612 3.730 . 0 0 "[ . 1 . 2]" 1
2036 1 139 ARG HB3 1 140 GLY HA2 4.500 . 5.000 4.303 4.083 4.761 . 0 0 "[ . 1 . 2]" 1
2037 1 139 ARG HG3 1 140 GLY H 5.200 . 5.700 5.077 4.521 5.664 . 0 0 "[ . 1 . 2]" 1
2038 1 140 GLY HA3 1 141 SER H 3.500 . 3.800 3.109 2.349 3.606 . 0 0 "[ . 1 . 2]" 1
2039 1 141 SER H 1 141 SER HB2 3.500 . 3.800 2.613 2.363 3.032 . 0 0 "[ . 1 . 2]" 1
2040 1 142 SER HA 1 142 SER HB3 2.500 . 2.800 2.460 2.265 2.566 . 0 0 "[ . 1 . 2]" 1
2041 1 142 SER HB3 1 143 HIS HB2 4.500 . 5.000 4.065 3.135 5.013 0.013 1 0 "[ . 1 . 2]" 1
2042 1 142 SER HB3 1 143 HIS HB3 4.500 . 5.000 4.666 3.846 5.039 0.039 13 0 "[ . 1 . 2]" 1
2043 1 143 HIS HA 1 143 HIS HB3 2.500 . 2.800 3.030 2.976 3.083 0.283 4 0 "[ . 1 . 2]" 1
2044 1 143 HIS HA 1 143 HIS HD2 4.500 . 5.000 4.111 2.782 4.586 . 0 0 "[ . 1 . 2]" 1
2045 1 143 HIS HB2 1 143 HIS HD2 3.500 . 3.800 3.811 2.661 3.979 0.179 10 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 6:54:23 AM GMT (wattos1)