NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
640833 |
6o1q   |
30575 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6o1q
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 1301
_Distance_constraint_stats_list.Viol_count 257
_Distance_constraint_stats_list.Viol_total 366.567
_Distance_constraint_stats_list.Viol_max 1.118
_Distance_constraint_stats_list.Viol_rms 0.0271
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.1426
_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 3 MET 0.000 0.000 . 0 "[ . 1]"
1 5 MET 0.000 0.000 . 0 "[ . 1]"
1 6 LEU 0.000 0.000 . 0 "[ . 1]"
1 7 ALA 0.000 0.000 . 0 "[ . 1]"
1 8 ARG 0.000 0.000 . 0 "[ . 1]"
1 9 ARG 0.027 0.027 7 0 "[ . 1]"
1 10 GLN 0.000 0.000 . 0 "[ . 1]"
1 11 ARG 0.052 0.052 10 0 "[ . 1]"
1 12 ASP 0.000 0.000 . 0 "[ . 1]"
1 13 PRO 0.000 0.000 . 0 "[ . 1]"
1 14 LEU 0.076 0.076 2 0 "[ . 1]"
1 15 GLN 0.652 0.146 10 0 "[ . 1]"
1 16 ALA 0.652 0.146 10 0 "[ . 1]"
1 17 LEU 0.000 0.000 . 0 "[ . 1]"
1 18 ARG 0.000 0.000 . 0 "[ . 1]"
1 19 ARG 0.000 0.000 . 0 "[ . 1]"
1 20 ARG 1.452 0.774 8 1 "[ . + 1]"
1 21 ASN 0.068 0.068 2 0 "[ . 1]"
1 22 GLN 0.000 0.000 . 0 "[ . 1]"
1 23 GLU 0.000 0.000 . 0 "[ . 1]"
1 24 LEU 0.377 0.377 5 0 "[ . 1]"
1 25 LYS 0.467 0.467 3 0 "[ . 1]"
1 26 GLN 0.000 0.000 . 0 "[ . 1]"
1 27 GLN 0.135 0.047 6 0 "[ . 1]"
1 28 VAL 0.747 0.079 5 0 "[ . 1]"
1 29 ASP 0.000 0.000 . 0 "[ . 1]"
1 30 SER 0.000 0.000 . 0 "[ . 1]"
1 31 LEU 0.249 0.249 9 0 "[ . 1]"
1 32 LEU 0.247 0.026 5 0 "[ . 1]"
1 33 SER 0.000 0.000 . 0 "[ . 1]"
1 34 GLU 0.533 0.349 3 0 "[ . 1]"
1 35 SER 0.000 0.000 . 0 "[ . 1]"
1 36 GLN 0.295 0.116 7 0 "[ . 1]"
1 37 LEU 0.089 0.089 8 0 "[ . 1]"
1 38 LYS 0.000 0.000 . 0 "[ . 1]"
1 39 GLU 0.000 0.000 . 0 "[ . 1]"
1 40 ALA 0.783 0.104 7 0 "[ . 1]"
1 41 LEU 0.000 0.000 . 0 "[ . 1]"
1 42 GLU 0.037 0.031 5 0 "[ . 1]"
1 43 PRO 0.037 0.031 5 0 "[ . 1]"
1 44 ASN 1.170 0.142 4 0 "[ . 1]"
1 45 LYS 0.000 0.000 . 0 "[ . 1]"
1 46 ARG 0.000 0.000 . 0 "[ . 1]"
1 47 GLN 0.000 0.000 . 0 "[ . 1]"
1 48 HIS 0.000 0.000 . 0 "[ . 1]"
1 49 ILE 0.444 0.349 3 0 "[ . 1]"
1 50 TYR 0.151 0.151 5 0 "[ . 1]"
1 51 GLN 2.018 0.195 4 0 "[ . 1]"
1 52 ARG 0.000 0.000 . 0 "[ . 1]"
1 53 CYS 0.249 0.249 9 0 "[ . 1]"
1 54 ILE 2.832 0.261 2 0 "[ . 1]"
1 55 GLN 0.000 0.000 . 0 "[ . 1]"
1 56 LEU 0.000 0.000 . 0 "[ . 1]"
1 57 LYS 1.070 0.706 5 1 "[ + 1]"
1 58 GLN 0.005 0.005 6 0 "[ . 1]"
1 59 ALA 0.000 0.000 . 0 "[ . 1]"
1 60 ILE 0.377 0.377 5 0 "[ . 1]"
1 61 ASP 0.106 0.061 7 0 "[ . 1]"
1 62 GLU 0.000 0.000 . 0 "[ . 1]"
1 63 ASN 4.612 0.774 8 1 "[ . + 1]"
1 64 LYS 2.475 0.265 3 0 "[ . 1]"
1 65 ASN 3.844 0.265 3 0 "[ . 1]"
1 66 ALA 0.000 0.000 . 0 "[ . 1]"
1 67 LEU 1.667 0.598 7 1 "[ . + 1]"
1 68 GLN 0.141 0.141 4 0 "[ . 1]"
1 69 LYS 0.000 0.000 . 0 "[ . 1]"
1 70 LEU 0.000 0.000 . 0 "[ . 1]"
1 71 SER 0.000 0.000 . 0 "[ . 1]"
1 72 LYS 0.795 0.410 9 0 "[ . 1]"
1 73 ALA 0.000 0.000 . 0 "[ . 1]"
1 74 ASP 0.000 0.000 . 0 "[ . 1]"
1 75 GLU 0.000 0.000 . 0 "[ . 1]"
1 76 SER 0.000 0.000 . 0 "[ . 1]"
1 77 ALA 0.906 0.203 5 0 "[ . 1]"
1 78 PRO 0.906 0.203 5 0 "[ . 1]"
1 79 VAL 0.298 0.298 10 0 "[ . 1]"
1 80 ALA 2.057 0.298 10 0 "[ . 1]"
1 81 ASN 1.443 0.175 9 0 "[ . 1]"
1 82 TYR 0.000 0.000 . 0 "[ . 1]"
1 83 ASN 3.259 0.322 7 0 "[ . 1]"
1 84 GLN 1.761 0.496 4 0 "[ . 1]"
1 85 ARG 0.594 0.162 9 0 "[ . 1]"
1 86 LYS 2.269 0.598 7 1 "[ . + 1]"
1 87 GLU 0.000 0.000 . 0 "[ . 1]"
1 88 GLU 0.862 0.627 9 1 "[ . +1]"
1 89 GLU 0.069 0.069 9 0 "[ . 1]"
1 90 HIS 0.068 0.068 7 0 "[ . 1]"
1 91 THR 0.111 0.111 8 0 "[ . 1]"
1 92 LEU 0.000 0.000 . 0 "[ . 1]"
1 93 LEU 1.185 1.118 5 1 "[ + 1]"
1 94 ASP 0.111 0.111 8 0 "[ . 1]"
1 95 LYS 0.000 0.000 . 0 "[ . 1]"
1 96 LEU 0.467 0.467 3 0 "[ . 1]"
1 97 THR 1.386 0.706 5 1 "[ + 1]"
1 98 GLN 0.000 0.000 . 0 "[ . 1]"
1 99 GLN 0.000 0.000 . 0 "[ . 1]"
1 100 LEU 0.000 0.000 . 0 "[ . 1]"
1 101 GLN 0.390 0.120 7 0 "[ . 1]"
1 102 GLY 0.075 0.075 2 0 "[ . 1]"
1 103 LEU 0.000 0.000 . 0 "[ . 1]"
1 104 ALA 0.262 0.028 7 0 "[ . 1]"
1 105 VAL 0.693 0.072 1 0 "[ . 1]"
1 106 THR 0.000 0.000 . 0 "[ . 1]"
1 107 ILE 1.161 0.151 5 0 "[ . 1]"
1 108 SER 0.000 0.000 . 0 "[ . 1]"
1 109 ARG 0.843 0.140 6 0 "[ . 1]"
1 110 GLU 0.061 0.041 8 0 "[ . 1]"
1 111 ASN 0.000 0.000 . 0 "[ . 1]"
1 112 ILE 0.000 0.000 . 0 "[ . 1]"
1 113 THR 0.872 0.228 8 0 "[ . 1]"
1 114 GLU 0.614 0.222 2 0 "[ . 1]"
1 115 VAL 0.290 0.290 8 0 "[ . 1]"
1 116 GLY 0.290 0.290 8 0 "[ . 1]"
1 117 ALA 0.000 0.000 . 0 "[ . 1]"
1 118 PRO 0.000 0.000 . 0 "[ . 1]"
1 119 THR 0.000 0.000 . 0 "[ . 1]"
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 3 MET H 1 3 MET HA 3.000 . 4.100 2.862 2.272 2.947 . 0 0 "[ . 1]" 1
2 1 3 MET H 1 3 MET HG3 4.000 . 6.000 3.328 2.399 4.606 . 0 0 "[ . 1]" 1
3 1 5 MET HA 1 6 LEU H 2.600 . 3.400 2.418 2.140 3.235 . 0 0 "[ . 1]" 1
4 1 5 MET HB2 1 6 LEU H 4.400 . 6.800 4.308 3.394 4.589 . 0 0 "[ . 1]" 1
5 1 6 LEU H 1 6 LEU HA 2.800 . 3.800 2.900 2.863 2.943 . 0 0 "[ . 1]" 1
6 1 6 LEU H 1 6 LEU QB 2.900 . 3.900 2.459 2.244 2.687 . 0 0 "[ . 1]" 1
7 1 6 LEU H 1 7 ALA H 4.300 . 6.600 3.975 2.710 4.404 . 0 0 "[ . 1]" 1
8 1 6 LEU QB 1 7 ALA H 3.900 . 5.800 3.742 3.196 4.029 . 0 0 "[ . 1]" 1
9 1 7 ALA H 1 7 ALA HA 2.400 . 3.100 2.869 2.831 2.900 . 0 0 "[ . 1]" 1
10 1 7 ALA H 1 7 ALA MB 2.200 . 2.800 2.259 2.233 2.284 . 0 0 "[ . 1]" 1
11 1 7 ALA HA 1 7 ALA MB 1.800 . 2.200 2.125 2.121 2.131 . 0 0 "[ . 1]" 1
12 1 7 ALA MB 1 8 ARG H 3.100 . 4.300 3.461 3.017 3.710 . 0 0 "[ . 1]" 1
13 1 9 ARG H 1 9 ARG HA 2.300 . 3.000 2.785 2.260 2.944 . 0 0 "[ . 1]" 1
14 1 9 ARG H 1 9 ARG QB 2.500 . 3.300 2.580 2.289 3.327 0.027 7 0 "[ . 1]" 1
15 1 9 ARG H 1 9 ARG QD 4.000 . 6.000 4.416 3.801 4.740 . 0 0 "[ . 1]" 1
16 1 9 ARG H 1 9 ARG QG 3.300 . 4.600 3.034 2.616 3.994 . 0 0 "[ . 1]" 1
17 1 9 ARG HG3 1 10 GLN H 4.200 . 6.400 4.855 4.239 5.482 . 0 0 "[ . 1]" 1
18 1 10 GLN H 1 10 GLN QG 4.600 . 7.300 3.662 2.176 4.413 . 0 0 "[ . 1]" 1
19 1 10 GLN HA 1 10 GLN HG3 3.100 . 4.300 3.124 2.623 3.782 . 0 0 "[ . 1]" 1
20 1 10 GLN HB2 1 11 ARG H 4.400 . 6.800 4.374 3.596 4.625 . 0 0 "[ . 1]" 1
21 1 10 GLN HG2 1 11 ARG H 4.900 . 7.900 4.867 4.096 5.793 . 0 0 "[ . 1]" 1
22 1 11 ARG H 1 11 ARG QB 2.600 . 3.500 2.490 2.236 3.185 . 0 0 "[ . 1]" 1
23 1 11 ARG H 1 11 ARG QG 3.400 . 4.800 2.942 1.948 3.987 0.052 10 0 "[ . 1]" 1
24 1 11 ARG HA 1 11 ARG QD 4.300 . 6.600 3.925 2.116 4.461 . 0 0 "[ . 1]" 1
25 1 12 ASP H 1 12 ASP HA 2.900 . 3.900 2.716 2.264 2.946 . 0 0 "[ . 1]" 1
26 1 12 ASP H 1 12 ASP HB2 2.700 . 3.600 2.718 2.402 3.138 . 0 0 "[ . 1]" 1
27 1 12 ASP H 1 12 ASP HB3 3.600 . 5.200 3.695 3.598 3.832 . 0 0 "[ . 1]" 1
28 1 12 ASP HA 1 13 PRO HA 4.900 . 8.000 4.629 4.447 4.753 . 0 0 "[ . 1]" 1
29 1 12 ASP HA 1 13 PRO QD 2.900 . 4.000 2.120 1.843 2.432 . 0 0 "[ . 1]" 1
30 1 12 ASP HA 1 13 PRO QG 6.100 . 10.800 4.009 3.754 4.317 . 0 0 "[ . 1]" 1
31 1 13 PRO HA 1 13 PRO QD 3.900 . 5.800 3.415 3.336 3.460 . 0 0 "[ . 1]" 1
32 1 13 PRO HA 1 13 PRO QG 3.300 . 4.600 3.023 2.895 3.502 . 0 0 "[ . 1]" 1
33 1 13 PRO HA 1 16 ALA H 3.500 . 5.000 3.449 3.252 3.643 . 0 0 "[ . 1]" 1
34 1 13 PRO HA 1 16 ALA MB 2.600 . 3.500 2.837 2.647 3.058 . 0 0 "[ . 1]" 1
35 1 13 PRO HA 1 17 LEU MD2 4.400 . 6.800 5.960 5.496 6.536 . 0 0 "[ . 1]" 1
36 1 13 PRO QB 1 13 PRO QD 4.300 . 6.700 2.749 2.727 2.775 . 0 0 "[ . 1]" 1
37 1 13 PRO QB 1 16 ALA MB 4.000 . 6.000 4.081 3.765 4.361 . 0 0 "[ . 1]" 1
38 1 13 PRO QB 1 70 LEU MD2 3.200 . 4.500 2.969 1.944 3.683 . 0 0 "[ . 1]" 1
39 1 14 LEU H 1 14 LEU HB3 3.400 . 4.800 3.610 3.589 3.629 . 0 0 "[ . 1]" 1
40 1 14 LEU H 1 15 GLN H 3.700 . 5.400 2.702 2.545 2.819 . 0 0 "[ . 1]" 1
41 1 14 LEU HA 1 14 LEU MD1 4.000 . 6.000 3.874 3.838 3.903 . 0 0 "[ . 1]" 1
42 1 14 LEU HA 1 14 LEU MD2 2.500 . 3.300 2.148 2.083 2.195 . 0 0 "[ . 1]" 1
43 1 14 LEU HA 1 82 TYR QE 6.600 . 12.100 6.049 5.399 6.758 . 0 0 "[ . 1]" 1
44 1 14 LEU HB2 1 14 LEU MD1 2.600 . 3.400 2.331 2.294 2.373 . 0 0 "[ . 1]" 1
45 1 14 LEU HB2 1 14 LEU MD2 2.600 . 3.500 3.207 3.202 3.211 . 0 0 "[ . 1]" 1
46 1 14 LEU HB2 1 82 TYR QE 6.100 . 10.800 4.809 4.432 5.423 . 0 0 "[ . 1]" 1
47 1 14 LEU HB3 1 14 LEU MD1 2.500 . 3.300 2.373 2.318 2.419 . 0 0 "[ . 1]" 1
48 1 14 LEU HB3 1 14 LEU MD2 3.200 . 4.500 2.363 2.313 2.414 . 0 0 "[ . 1]" 1
49 1 14 LEU HB3 1 82 TYR QE 4.700 . 7.500 5.742 5.389 6.293 . 0 0 "[ . 1]" 1
50 1 14 LEU MD1 1 14 LEU HG 2.000 . 2.500 2.123 2.121 2.126 . 0 0 "[ . 1]" 1
51 1 14 LEU MD1 1 82 TYR HA 3.600 . 5.200 3.028 2.758 3.962 . 0 0 "[ . 1]" 1
52 1 14 LEU MD1 1 82 TYR QD 3.600 . 5.300 3.123 2.921 3.387 . 0 0 "[ . 1]" 1
53 1 14 LEU MD1 1 82 TYR QE 3.600 . 5.200 3.089 2.877 3.381 . 0 0 "[ . 1]" 1
54 1 14 LEU MD1 1 85 ARG HB3 3.400 . 4.800 2.757 2.196 3.327 . 0 0 "[ . 1]" 1
55 1 14 LEU MD1 1 85 ARG QD 3.800 . 5.600 3.140 2.182 3.820 . 0 0 "[ . 1]" 1
56 1 14 LEU MD1 1 86 LYS H 3.300 . 4.600 3.040 2.656 3.391 . 0 0 "[ . 1]" 1
57 1 14 LEU MD1 1 86 LYS HA 3.200 . 4.500 3.030 2.626 3.311 . 0 0 "[ . 1]" 1
58 1 14 LEU MD1 1 86 LYS HB3 3.100 . 4.300 3.850 3.510 4.376 0.076 2 0 "[ . 1]" 1
59 1 14 LEU MD1 1 86 LYS HE2 4.100 . 6.200 3.650 2.847 4.557 . 0 0 "[ . 1]" 1
60 1 14 LEU MD1 1 86 LYS HG3 4.800 . 7.600 4.192 3.461 4.813 . 0 0 "[ . 1]" 1
61 1 14 LEU MD2 1 14 LEU HG 2.100 . 2.600 2.127 2.123 2.129 . 0 0 "[ . 1]" 1
62 1 14 LEU MD2 1 17 LEU QB 3.700 . 5.500 3.676 3.445 3.808 . 0 0 "[ . 1]" 1
63 1 14 LEU MD2 1 86 LYS HE3 3.300 . 4.700 3.789 3.259 4.118 . 0 0 "[ . 1]" 1
64 1 14 LEU MD2 1 86 LYS H 3.700 . 5.400 4.182 3.994 4.281 . 0 0 "[ . 1]" 1
65 1 14 LEU MD2 1 86 LYS HA 3.000 . 4.100 2.646 2.361 2.891 . 0 0 "[ . 1]" 1
66 1 14 LEU MD2 1 86 LYS HB2 2.300 . 3.000 2.767 2.564 2.995 . 0 0 "[ . 1]" 1
67 1 14 LEU MD2 1 86 LYS HE3 4.000 . 6.000 3.979 3.480 4.360 . 0 0 "[ . 1]" 1
68 1 14 LEU MD2 1 86 LYS HG3 4.200 . 6.500 3.109 2.314 3.647 . 0 0 "[ . 1]" 1
69 1 14 LEU HG 1 82 TYR QE 5.100 . 8.300 3.436 2.892 4.171 . 0 0 "[ . 1]" 1
70 1 15 GLN H 1 16 ALA H 3.000 . 4.200 2.686 2.557 2.806 . 0 0 "[ . 1]" 1
71 1 15 GLN HA 1 15 GLN QG 3.400 . 4.800 2.743 2.448 3.057 . 0 0 "[ . 1]" 1
72 1 15 GLN HA 1 18 ARG QD 3.900 . 5.800 3.567 3.063 4.266 . 0 0 "[ . 1]" 1
73 1 15 GLN QB 1 16 ALA HA 5.000 . 8.100 4.142 3.878 4.298 . 0 0 "[ . 1]" 1
74 1 15 GLN HB2 1 16 ALA H 2.800 . 3.800 3.609 2.401 3.946 0.146 10 0 "[ . 1]" 1
75 1 15 GLN QG 1 16 ALA MB 4.300 . 6.700 4.361 3.903 5.335 . 0 0 "[ . 1]" 1
76 1 16 ALA H 1 16 ALA HA 2.700 . 3.600 2.823 2.805 2.835 . 0 0 "[ . 1]" 1
77 1 16 ALA H 1 16 ALA MB 2.200 . 2.800 2.234 2.220 2.240 . 0 0 "[ . 1]" 1
78 1 16 ALA H 1 17 LEU QB 4.600 . 7.200 4.400 4.351 4.436 . 0 0 "[ . 1]" 1
79 1 16 ALA H 1 18 ARG H 4.300 . 6.600 4.011 3.841 4.138 . 0 0 "[ . 1]" 1
80 1 16 ALA HA 1 16 ALA MB 2.000 . 2.500 2.128 2.126 2.130 . 0 0 "[ . 1]" 1
81 1 16 ALA HA 1 17 LEU QB 4.600 . 7.200 5.195 5.179 5.210 . 0 0 "[ . 1]" 1
82 1 16 ALA HA 1 19 ARG H 2.600 . 3.500 2.707 2.686 2.739 . 0 0 "[ . 1]" 1
83 1 16 ALA HA 1 19 ARG QB 2.900 . 3.900 3.032 2.631 3.383 . 0 0 "[ . 1]" 1
84 1 16 ALA MB 1 17 LEU H 2.400 . 3.100 2.407 2.340 2.442 . 0 0 "[ . 1]" 1
85 1 16 ALA MB 1 18 ARG H 3.700 . 5.400 4.452 4.351 4.548 . 0 0 "[ . 1]" 1
86 1 16 ALA MB 1 19 ARG H 3.900 . 5.800 4.610 4.512 4.733 . 0 0 "[ . 1]" 1
87 1 16 ALA MB 1 19 ARG QB 3.600 . 5.300 4.055 3.808 4.327 . 0 0 "[ . 1]" 1
88 1 17 LEU H 1 17 LEU HB3 2.300 . 3.000 2.540 2.492 2.593 . 0 0 "[ . 1]" 1
89 1 17 LEU H 1 17 LEU QD 3.600 . 5.300 3.699 3.669 3.728 . 0 0 "[ . 1]" 1
90 1 17 LEU H 1 18 ARG H 2.900 . 4.000 2.684 2.608 2.746 . 0 0 "[ . 1]" 1
91 1 17 LEU H 1 18 ARG H 2.700 . 3.600 2.406 2.365 2.438 . 0 0 "[ . 1]" 1
92 1 17 LEU HA 1 17 LEU QB 2.600 . 3.400 2.358 2.342 2.381 . 0 0 "[ . 1]" 1
93 1 17 LEU HA 1 17 LEU HG 3.300 . 4.600 3.109 3.052 3.255 . 0 0 "[ . 1]" 1
94 1 17 LEU QB 1 17 LEU QD 2.400 . 3.100 1.944 1.931 1.959 . 0 0 "[ . 1]" 1
95 1 17 LEU HB3 1 17 LEU MD2 2.200 . 2.800 2.320 2.266 2.401 . 0 0 "[ . 1]" 1
96 1 17 LEU HB3 1 18 ARG H 3.400 . 4.900 2.632 2.521 2.728 . 0 0 "[ . 1]" 1
97 1 17 LEU QD 1 17 LEU HG 1.800 . 2.200 1.892 1.888 1.895 . 0 0 "[ . 1]" 1
98 1 17 LEU MD1 1 21 ASN H 3.300 . 4.700 3.833 3.682 3.923 . 0 0 "[ . 1]" 1
99 1 17 LEU MD2 1 67 LEU HA 2.900 . 3.900 2.714 2.346 3.006 . 0 0 "[ . 1]" 1
100 1 17 LEU HG 1 21 ASN HD21 3.100 . 4.300 3.440 2.999 3.756 . 0 0 "[ . 1]" 1
101 1 17 LEU HG 1 63 ASN HB2 4.300 . 6.600 5.695 5.152 6.536 . 0 0 "[ . 1]" 1
102 1 18 ARG H 1 18 ARG HA 2.900 . 3.900 2.795 2.783 2.801 . 0 0 "[ . 1]" 1
103 1 18 ARG H 1 18 ARG QB 2.600 . 3.400 2.243 2.214 2.269 . 0 0 "[ . 1]" 1
104 1 18 ARG H 1 19 ARG H 3.000 . 4.200 2.720 2.679 2.749 . 0 0 "[ . 1]" 1
105 1 18 ARG H 1 21 ASN H 4.700 . 7.500 4.530 4.463 4.605 . 0 0 "[ . 1]" 1
106 1 18 ARG HA 1 18 ARG QD 5.000 . 8.100 4.084 3.909 4.255 . 0 0 "[ . 1]" 1
107 1 18 ARG HA 1 21 ASN H 3.200 . 4.400 3.125 2.931 3.270 . 0 0 "[ . 1]" 1
108 1 18 ARG QB 1 21 ASN HD21 5.100 . 8.400 3.963 3.770 4.326 . 0 0 "[ . 1]" 1
109 1 19 ARG H 1 19 ARG QB 2.300 . 2.900 2.286 2.215 2.464 . 0 0 "[ . 1]" 1
110 1 19 ARG HA 1 19 ARG HD2 4.400 . 6.800 4.140 2.108 4.855 . 0 0 "[ . 1]" 1
111 1 20 ARG H 1 20 ARG HA 2.700 . 3.600 2.825 2.800 2.841 . 0 0 "[ . 1]" 1
112 1 20 ARG H 1 20 ARG QB 2.200 . 2.800 2.343 2.230 2.501 . 0 0 "[ . 1]" 1
113 1 20 ARG H 1 21 ASN H 2.800 . 3.800 2.650 2.575 2.746 . 0 0 "[ . 1]" 1
114 1 20 ARG H 1 21 ASN H 2.600 . 3.400 2.376 2.335 2.424 . 0 0 "[ . 1]" 1
115 1 20 ARG QB 1 20 ARG HD2 3.000 . 4.200 2.591 2.319 3.307 . 0 0 "[ . 1]" 1
116 1 20 ARG QB 1 20 ARG HE 4.100 . 6.200 3.785 2.054 4.044 . 0 0 "[ . 1]" 1
117 1 20 ARG QB 1 21 ASN H 2.900 . 3.900 2.603 2.503 2.681 . 0 0 "[ . 1]" 1
118 1 20 ARG QB 1 63 ASN HD22 4.200 . 6.400 2.866 2.167 3.538 . 0 0 "[ . 1]" 1
119 1 20 ARG HB2 1 63 ASN HD21 3.600 . 5.200 4.761 3.524 5.974 0.774 8 1 "[ . + 1]" 1
120 1 20 ARG HD2 1 20 ARG QG 2.500 . 3.300 2.334 2.173 2.383 . 0 0 "[ . 1]" 1
121 1 20 ARG HE 1 20 ARG QG 3.100 . 4.300 2.358 2.252 3.001 . 0 0 "[ . 1]" 1
122 1 20 ARG HE 1 24 LEU MD1 5.000 . 8.100 5.618 3.943 8.060 . 0 0 "[ . 1]" 1
123 1 20 ARG QG 1 21 ASN H 4.100 . 6.300 3.908 3.623 4.148 . 0 0 "[ . 1]" 1
124 1 21 ASN H 1 21 ASN HA 2.900 . 3.900 2.820 2.809 2.831 . 0 0 "[ . 1]" 1
125 1 21 ASN H 1 21 ASN HB2 3.000 . 4.100 2.481 2.432 2.518 . 0 0 "[ . 1]" 1
126 1 21 ASN H 1 22 GLN H 2.900 . 3.900 2.686 2.649 2.714 . 0 0 "[ . 1]" 1
127 1 21 ASN H 1 23 GLU H 4.500 . 7.100 3.949 3.857 4.013 . 0 0 "[ . 1]" 1
128 1 21 ASN H 1 23 GLU HB3 4.800 . 7.700 5.280 4.919 6.788 . 0 0 "[ . 1]" 1
129 1 21 ASN HA 1 21 ASN QB 3.400 . 4.800 2.401 2.386 2.417 . 0 0 "[ . 1]" 1
130 1 21 ASN HA 1 24 LEU HB3 4.500 . 7.000 4.479 4.235 4.712 . 0 0 "[ . 1]" 1
131 1 21 ASN HA 1 24 LEU MD1 2.900 . 4.000 2.750 2.429 3.129 . 0 0 "[ . 1]" 1
132 1 21 ASN HA 1 24 LEU MD2 4.400 . 6.800 4.713 4.381 5.021 . 0 0 "[ . 1]" 1
133 1 21 ASN QB 1 21 ASN HD21 4.600 . 7.300 2.191 2.170 2.215 . 0 0 "[ . 1]" 1
134 1 21 ASN QB 1 92 LEU MD2 2.900 . 4.000 2.703 2.418 3.384 . 0 0 "[ . 1]" 1
135 1 21 ASN HB2 1 22 GLN H 3.300 . 4.700 2.697 2.599 2.822 . 0 0 "[ . 1]" 1
136 1 21 ASN HD21 1 92 LEU MD2 3.800 . 5.600 3.723 3.260 4.224 . 0 0 "[ . 1]" 1
137 1 21 ASN HD21 1 93 LEU MD1 3.100 . 4.300 3.664 2.953 4.368 0.068 2 0 "[ . 1]" 1
138 1 22 GLN H 1 22 GLN HA 2.500 . 3.300 2.815 2.803 2.829 . 0 0 "[ . 1]" 1
139 1 22 GLN H 1 23 GLU H 2.600 . 3.500 2.581 2.540 2.618 . 0 0 "[ . 1]" 1
140 1 22 GLN HA 1 22 GLN HE22 4.800 . 7.700 5.669 4.077 6.116 . 0 0 "[ . 1]" 1
141 1 22 GLN HA 1 25 LYS H 2.900 . 3.900 3.242 3.126 3.393 . 0 0 "[ . 1]" 1
142 1 22 GLN HE21 1 22 GLN QG 3.500 . 5.100 2.184 2.171 2.200 . 0 0 "[ . 1]" 1
143 1 22 GLN HE22 1 22 GLN QG 2.600 . 3.500 3.223 3.215 3.233 . 0 0 "[ . 1]" 1
144 1 23 GLU H 1 23 GLU HA 2.800 . 3.700 2.843 2.810 2.860 . 0 0 "[ . 1]" 1
145 1 23 GLU H 1 23 GLU QB 2.400 . 3.100 2.251 2.207 2.397 . 0 0 "[ . 1]" 1
146 1 23 GLU H 1 23 GLU QG 3.200 . 4.500 3.838 2.463 4.032 . 0 0 "[ . 1]" 1
147 1 23 GLU H 1 24 LEU H 2.700 . 3.600 2.552 2.447 2.683 . 0 0 "[ . 1]" 1
148 1 24 LEU H 1 24 LEU HB2 2.600 . 3.500 2.488 2.426 2.552 . 0 0 "[ . 1]" 1
149 1 24 LEU H 1 24 LEU QD 3.400 . 4.800 3.088 2.940 3.188 . 0 0 "[ . 1]" 1
150 1 24 LEU H 1 24 LEU HG 2.500 . 3.300 2.367 2.265 2.502 . 0 0 "[ . 1]" 1
151 1 24 LEU H 1 25 LYS H 2.700 . 3.600 2.609 2.575 2.682 . 0 0 "[ . 1]" 1
152 1 24 LEU H 1 26 GLN H 4.200 . 6.400 4.211 4.172 4.297 . 0 0 "[ . 1]" 1
153 1 24 LEU HA 1 24 LEU MD2 2.200 . 2.800 2.038 1.993 2.080 . 0 0 "[ . 1]" 1
154 1 24 LEU HA 1 24 LEU HG 3.200 . 4.500 3.131 2.991 3.258 . 0 0 "[ . 1]" 1
155 1 24 LEU HA 1 28 VAL MG2 3.500 . 5.000 3.995 3.790 4.090 . 0 0 "[ . 1]" 1
156 1 24 LEU QB 1 24 LEU MD1 2.300 . 3.000 2.088 2.077 2.097 . 0 0 "[ . 1]" 1
157 1 24 LEU QB 1 59 ALA MB 3.400 . 4.800 3.910 3.653 4.124 . 0 0 "[ . 1]" 1
158 1 24 LEU HB2 1 28 VAL H 4.500 . 7.100 5.627 5.562 5.692 . 0 0 "[ . 1]" 1
159 1 24 LEU QD 1 59 ALA H 3.400 . 4.800 4.260 4.124 4.411 . 0 0 "[ . 1]" 1
160 1 24 LEU MD1 1 60 ILE QG 2.800 . 3.800 2.373 2.142 2.952 . 0 0 "[ . 1]" 1
161 1 24 LEU MD1 1 63 ASN H 3.400 . 4.800 3.719 3.418 3.977 . 0 0 "[ . 1]" 1
162 1 24 LEU MD1 1 63 ASN QB 2.900 . 4.000 2.835 2.424 3.052 . 0 0 "[ . 1]" 1
163 1 24 LEU MD1 1 63 ASN HD21 2.400 . 3.100 2.520 2.000 2.725 . 0 0 "[ . 1]" 1
164 1 24 LEU MD1 1 63 ASN HD22 2.500 . 3.300 2.445 2.290 2.562 . 0 0 "[ . 1]" 1
165 1 24 LEU MD2 1 24 LEU HG 2.100 . 2.700 2.129 2.128 2.132 . 0 0 "[ . 1]" 1
166 1 24 LEU MD2 1 26 GLN H 4.900 . 7.900 5.736 5.563 5.847 . 0 0 "[ . 1]" 1
167 1 24 LEU MD2 1 27 GLN H 3.800 . 5.600 4.369 4.241 4.465 . 0 0 "[ . 1]" 1
168 1 24 LEU MD2 1 27 GLN HE21 3.300 . 4.700 3.218 2.693 3.631 . 0 0 "[ . 1]" 1
169 1 24 LEU MD2 1 27 GLN HE22 2.800 . 3.800 2.621 2.256 2.913 . 0 0 "[ . 1]" 1
170 1 24 LEU MD2 1 59 ALA HA 3.600 . 5.300 4.130 3.944 4.346 . 0 0 "[ . 1]" 1
171 1 24 LEU MD2 1 59 ALA MB 1.300 . 6.000 2.014 1.898 2.174 . 0 0 "[ . 1]" 1
172 1 24 LEU MD2 1 60 ILE HA 3.200 . 4.500 4.145 3.669 4.877 0.377 5 0 "[ . 1]" 1
173 1 24 LEU MD2 1 60 ILE HA 3.200 . 4.500 3.522 3.337 3.696 . 0 0 "[ . 1]" 1
174 1 25 LYS H 1 25 LYS HA 2.700 . 3.600 2.790 2.783 2.797 . 0 0 "[ . 1]" 1
175 1 25 LYS H 1 25 LYS QB 2.300 . 3.000 2.247 2.214 2.276 . 0 0 "[ . 1]" 1
176 1 25 LYS H 1 25 LYS QD 3.900 . 5.800 4.424 3.946 4.753 . 0 0 "[ . 1]" 1
177 1 25 LYS H 1 26 GLN H 2.800 . 3.800 2.751 2.713 2.804 . 0 0 "[ . 1]" 1
178 1 25 LYS H 1 60 ILE MD 3.100 . 4.300 3.244 3.145 3.309 . 0 0 "[ . 1]" 1
179 1 25 LYS HA 1 26 GLN H 3.700 . 5.400 3.541 3.526 3.553 . 0 0 "[ . 1]" 1
180 1 25 LYS HA 1 28 VAL H 3.400 . 4.800 3.328 3.175 3.503 . 0 0 "[ . 1]" 1
181 1 25 LYS HA 1 28 VAL HB 2.900 . 3.900 2.734 2.545 2.929 . 0 0 "[ . 1]" 1
182 1 25 LYS HA 1 28 VAL MG2 3.100 . 4.300 2.832 2.703 3.124 . 0 0 "[ . 1]" 1
183 1 25 LYS HA 1 29 ASP H 4.000 . 6.000 4.074 3.833 4.228 . 0 0 "[ . 1]" 1
184 1 25 LYS HA 1 60 ILE MD 2.400 . 3.100 2.357 2.273 2.431 . 0 0 "[ . 1]" 1
185 1 25 LYS HA 1 96 LEU MD1 2.900 . 4.000 2.657 2.433 3.189 . 0 0 "[ . 1]" 1
186 1 25 LYS HB2 1 26 GLN H 3.100 . 4.300 3.731 2.638 3.927 . 0 0 "[ . 1]" 1
187 1 25 LYS QD 1 26 GLN H 4.200 . 6.400 4.590 4.421 5.190 . 0 0 "[ . 1]" 1
188 1 25 LYS QD 1 96 LEU MD1 3.000 . 4.100 3.361 2.309 4.567 0.467 3 0 "[ . 1]" 1
189 1 25 LYS HG2 1 26 GLN H 4.400 . 6.900 4.022 3.716 4.637 . 0 0 "[ . 1]" 1
190 1 26 GLN H 1 26 GLN HA 2.700 . 3.600 2.817 2.795 2.838 . 0 0 "[ . 1]" 1
191 1 26 GLN H 1 26 GLN QB 2.400 . 3.100 2.330 2.223 2.494 . 0 0 "[ . 1]" 1
192 1 26 GLN H 1 27 GLN H 2.600 . 3.500 2.606 2.544 2.687 . 0 0 "[ . 1]" 1
193 1 26 GLN H 1 28 VAL H 4.500 . 7.000 4.061 3.979 4.156 . 0 0 "[ . 1]" 1
194 1 26 GLN H 1 28 VAL MG1 4.500 . 7.100 6.377 6.231 6.506 . 0 0 "[ . 1]" 1
195 1 26 GLN HA 1 29 ASP H 3.300 . 4.700 3.495 3.268 3.831 . 0 0 "[ . 1]" 1
196 1 27 GLN H 1 27 GLN HA 2.500 . 3.300 2.849 2.809 2.862 . 0 0 "[ . 1]" 1
197 1 27 GLN H 1 27 GLN HG2 3.900 . 5.800 3.629 3.443 3.869 . 0 0 "[ . 1]" 1
198 1 27 GLN H 1 28 VAL H 2.800 . 3.800 2.510 2.461 2.722 . 0 0 "[ . 1]" 1
199 1 27 GLN HA 1 27 GLN HE22 5.400 . 9.000 5.749 5.599 5.943 . 0 0 "[ . 1]" 1
200 1 27 GLN HA 1 27 GLN HG2 3.100 . 4.300 2.570 2.505 2.636 . 0 0 "[ . 1]" 1
201 1 27 GLN HA 1 28 VAL H 3.500 . 5.000 3.516 3.505 3.544 . 0 0 "[ . 1]" 1
202 1 27 GLN HB2 1 27 GLN HE22 3.900 . 5.800 3.379 3.230 3.507 . 0 0 "[ . 1]" 1
203 1 27 GLN HB3 1 27 GLN HE21 3.100 . 4.300 2.737 1.853 4.039 0.047 6 0 "[ . 1]" 1
204 1 27 GLN HB3 1 27 GLN HE22 4.400 . 6.800 3.917 3.480 4.534 . 0 0 "[ . 1]" 1
205 1 27 GLN HB3 1 28 VAL H 3.100 . 4.300 3.721 3.496 3.802 . 0 0 "[ . 1]" 1
206 1 27 GLN HB3 1 56 LEU MD2 3.300 . 4.700 2.263 2.015 2.471 . 0 0 "[ . 1]" 1
207 1 27 GLN HE21 1 27 GLN HG2 3.200 . 4.500 3.130 2.885 3.466 . 0 0 "[ . 1]" 1
208 1 27 GLN HE21 1 27 GLN HG3 3.000 . 4.100 3.000 2.238 3.514 . 0 0 "[ . 1]" 1
209 1 27 GLN HE22 1 27 GLN HG2 3.900 . 5.800 3.880 3.765 4.048 . 0 0 "[ . 1]" 1
210 1 28 VAL H 1 28 VAL HA 2.900 . 4.000 2.835 2.771 2.847 . 0 0 "[ . 1]" 1
211 1 28 VAL H 1 28 VAL HB 2.400 . 3.100 2.471 2.455 2.521 . 0 0 "[ . 1]" 1
212 1 28 VAL H 1 28 VAL MG1 3.400 . 4.800 3.755 3.750 3.762 . 0 0 "[ . 1]" 1
213 1 28 VAL H 1 28 VAL MG2 2.500 . 3.300 2.230 2.103 2.290 . 0 0 "[ . 1]" 1
214 1 28 VAL HA 1 28 VAL MG1 2.300 . 3.000 2.438 2.424 2.456 . 0 0 "[ . 1]" 1
215 1 28 VAL HA 1 28 VAL MG2 2.400 . 3.100 2.357 2.345 2.385 . 0 0 "[ . 1]" 1
216 1 28 VAL HA 1 29 ASP H 3.800 . 5.600 3.561 3.555 3.572 . 0 0 "[ . 1]" 1
217 1 28 VAL HA 1 31 LEU H 3.500 . 5.000 3.319 3.148 3.546 . 0 0 "[ . 1]" 1
218 1 28 VAL HA 1 31 LEU HA 5.100 . 8.300 5.331 5.191 5.537 . 0 0 "[ . 1]" 1
219 1 28 VAL HA 1 31 LEU HB2 3.000 . 4.200 3.284 2.937 3.546 . 0 0 "[ . 1]" 1
220 1 28 VAL HA 1 31 LEU HB3 3.200 . 4.500 2.900 2.732 2.988 . 0 0 "[ . 1]" 1
221 1 28 VAL HA 1 32 LEU H 4.400 . 6.800 4.151 4.012 4.291 . 0 0 "[ . 1]" 1
222 1 28 VAL HA 1 56 LEU MD1 2.300 . 3.000 2.405 2.213 2.590 . 0 0 "[ . 1]" 1
223 1 28 VAL HB 1 28 VAL MG1 2.000 . 2.500 2.127 2.125 2.128 . 0 0 "[ . 1]" 1
224 1 28 VAL HB 1 28 VAL MG2 2.100 . 2.700 2.132 2.130 2.133 . 0 0 "[ . 1]" 1
225 1 28 VAL HB 1 29 ASP H 2.500 . 3.300 2.477 2.414 2.534 . 0 0 "[ . 1]" 1
226 1 28 VAL HB 1 30 SER H 4.500 . 7.100 4.866 4.797 4.944 . 0 0 "[ . 1]" 1
227 1 28 VAL HB 1 30 SER HA 5.700 . 9.800 7.509 7.460 7.570 . 0 0 "[ . 1]" 1
228 1 28 VAL MG1 1 28 VAL MG2 1.700 . 2.000 2.075 2.071 2.079 0.079 5 0 "[ . 1]" 1
229 1 28 VAL MG1 1 29 ASP H 3.000 . 4.100 3.235 3.199 3.284 . 0 0 "[ . 1]" 1
230 1 28 VAL MG1 1 30 SER H 4.100 . 6.300 4.838 4.781 4.906 . 0 0 "[ . 1]" 1
231 1 28 VAL MG1 1 31 LEU H 3.400 . 4.800 4.498 4.373 4.619 . 0 0 "[ . 1]" 1
232 1 28 VAL MG2 1 29 ASP H 4.100 . 6.200 3.828 3.793 3.852 . 0 0 "[ . 1]" 1
233 1 28 VAL MG2 1 96 LEU HA 3.800 . 5.600 4.043 3.874 4.214 . 0 0 "[ . 1]" 1
234 1 28 VAL MG2 1 96 LEU HB2 3.500 . 5.000 3.920 3.596 4.156 . 0 0 "[ . 1]" 1
235 1 28 VAL MG2 1 96 LEU MD1 2.300 . 3.000 2.613 2.421 2.772 . 0 0 "[ . 1]" 1
236 1 28 VAL MG2 1 100 LEU HB3 3.100 . 6.000 5.204 5.127 5.338 . 0 0 "[ . 1]" 1
237 1 29 ASP H 1 29 ASP HA 2.900 . 3.900 2.802 2.792 2.819 . 0 0 "[ . 1]" 1
238 1 29 ASP H 1 29 ASP HB2 2.600 . 3.500 2.374 2.307 2.435 . 0 0 "[ . 1]" 1
239 1 29 ASP H 1 29 ASP HB3 3.900 . 5.800 3.591 3.571 3.605 . 0 0 "[ . 1]" 1
240 1 29 ASP H 1 30 SER H 2.800 . 3.800 2.686 2.667 2.728 . 0 0 "[ . 1]" 1
241 1 29 ASP H 1 30 SER QB 5.000 . 8.100 4.541 4.428 4.768 . 0 0 "[ . 1]" 1
242 1 29 ASP H 1 31 LEU H 4.000 . 6.000 4.156 4.067 4.261 . 0 0 "[ . 1]" 1
243 1 29 ASP H 1 32 LEU HB2 4.700 . 7.500 5.259 5.125 5.471 . 0 0 "[ . 1]" 1
244 1 29 ASP HA 1 29 ASP HB2 3.000 . 4.100 3.012 2.996 3.023 . 0 0 "[ . 1]" 1
245 1 29 ASP HA 1 29 ASP HB3 2.500 . 3.300 2.581 2.548 2.616 . 0 0 "[ . 1]" 1
246 1 29 ASP HA 1 32 LEU H 3.700 . 5.400 3.456 3.348 3.586 . 0 0 "[ . 1]" 1
247 1 29 ASP HB2 1 30 SER H 2.900 . 3.900 2.806 2.749 2.912 . 0 0 "[ . 1]" 1
248 1 29 ASP HB2 1 30 SER HA 4.900 . 7.900 4.551 4.457 4.645 . 0 0 "[ . 1]" 1
249 1 29 ASP HB3 1 30 SER H 3.800 . 5.600 3.563 3.481 3.632 . 0 0 "[ . 1]" 1
250 1 29 ASP HB3 1 30 SER HA 4.400 . 6.900 4.277 4.191 4.348 . 0 0 "[ . 1]" 1
251 1 30 SER H 1 30 SER HA 2.800 . 3.800 2.823 2.813 2.838 . 0 0 "[ . 1]" 1
252 1 30 SER H 1 30 SER QB 2.500 . 3.300 2.324 2.253 2.473 . 0 0 "[ . 1]" 1
253 1 30 SER H 1 31 LEU H 2.600 . 3.500 2.626 2.567 2.687 . 0 0 "[ . 1]" 1
254 1 30 SER H 1 31 LEU HB2 4.800 . 7.700 4.917 4.705 5.122 . 0 0 "[ . 1]" 1
255 1 30 SER H 1 31 LEU HB3 4.900 . 7.900 4.890 4.761 5.056 . 0 0 "[ . 1]" 1
256 1 30 SER H 1 32 LEU H 4.500 . 7.100 4.201 4.087 4.269 . 0 0 "[ . 1]" 1
257 1 30 SER HA 1 30 SER QB 2.500 . 3.300 2.380 2.343 2.419 . 0 0 "[ . 1]" 1
258 1 30 SER HA 1 30 SER QB 2.400 . 3.100 2.304 2.211 2.400 . 0 0 "[ . 1]" 1
259 1 30 SER HA 1 33 SER H 2.700 . 3.600 2.690 2.646 2.743 . 0 0 "[ . 1]" 1
260 1 30 SER QB 1 31 LEU H 3.000 . 4.100 2.609 2.528 2.706 . 0 0 "[ . 1]" 1
261 1 31 LEU H 1 31 LEU HA 2.800 . 3.800 2.822 2.793 2.849 . 0 0 "[ . 1]" 1
262 1 31 LEU H 1 31 LEU HB2 2.600 . 3.400 2.462 2.290 2.564 . 0 0 "[ . 1]" 1
263 1 31 LEU H 1 31 LEU MD1 3.500 . 5.000 3.494 3.277 3.690 . 0 0 "[ . 1]" 1
264 1 31 LEU H 1 32 LEU H 2.800 . 3.800 2.658 2.563 2.751 . 0 0 "[ . 1]" 1
265 1 31 LEU H 1 32 LEU HB2 3.800 . 5.600 4.736 4.627 4.828 . 0 0 "[ . 1]" 1
266 1 31 LEU HA 1 32 LEU H 3.700 . 5.400 3.541 3.525 3.554 . 0 0 "[ . 1]" 1
267 1 31 LEU HA 1 32 LEU HB3 4.700 . 7.500 6.617 6.605 6.625 . 0 0 "[ . 1]" 1
268 1 31 LEU HA 1 34 GLU H 2.900 . 4.000 3.069 2.686 3.372 . 0 0 "[ . 1]" 1
269 1 31 LEU HB2 1 33 SER H 3.900 . 5.800 4.206 4.171 4.236 . 0 0 "[ . 1]" 1
270 1 31 LEU MD1 1 34 GLU HB2 3.300 . 4.700 3.160 2.735 3.416 . 0 0 "[ . 1]" 1
271 1 31 LEU MD1 1 35 SER H 3.300 . 4.700 4.057 3.485 4.420 . 0 0 "[ . 1]" 1
272 1 31 LEU MD1 1 52 ARG H 4.000 . 6.000 4.677 4.028 5.996 . 0 0 "[ . 1]" 1
273 1 31 LEU MD1 1 53 CYS H 3.200 . 4.500 3.862 3.466 4.443 . 0 0 "[ . 1]" 1
274 1 31 LEU MD1 1 53 CYS HB2 3.500 . 5.100 3.462 2.755 4.412 . 0 0 "[ . 1]" 1
275 1 31 LEU MD2 1 53 CYS HA 2.600 . 3.500 2.753 2.164 3.749 0.249 9 0 "[ . 1]" 1
276 1 31 LEU MD2 1 53 CYS HB2 3.400 . 4.800 2.767 2.211 3.434 . 0 0 "[ . 1]" 1
277 1 31 LEU MD2 1 53 CYS HB3 4.600 . 7.200 4.153 3.691 4.804 . 0 0 "[ . 1]" 1
278 1 32 LEU H 1 32 LEU HA 2.700 . 3.600 2.792 2.774 2.834 . 0 0 "[ . 1]" 1
279 1 32 LEU H 1 32 LEU HB2 2.500 . 3.300 2.475 2.441 2.496 . 0 0 "[ . 1]" 1
280 1 32 LEU H 1 32 LEU QD 3.000 . 4.100 3.015 2.973 3.074 . 0 0 "[ . 1]" 1
281 1 32 LEU H 1 33 SER H 2.700 . 3.600 2.677 2.588 2.709 . 0 0 "[ . 1]" 1
282 1 32 LEU H 1 34 GLU H 4.300 . 6.700 4.190 3.917 4.377 . 0 0 "[ . 1]" 1
283 1 32 LEU HA 1 32 LEU QB 3.200 . 4.500 2.373 2.368 2.377 . 0 0 "[ . 1]" 1
284 1 32 LEU HA 1 32 LEU HG 2.900 . 3.900 3.077 3.046 3.122 . 0 0 "[ . 1]" 1
285 1 32 LEU HB2 1 33 SER H 2.900 . 3.900 2.703 2.519 2.773 . 0 0 "[ . 1]" 1
286 1 32 LEU MD1 1 33 SER H 4.300 . 6.600 4.561 4.378 4.633 . 0 0 "[ . 1]" 1
287 1 32 LEU MD2 1 32 LEU HG 1.700 . 2.100 2.125 2.124 2.126 0.026 5 0 "[ . 1]" 1
288 1 32 LEU HG 1 34 GLU H 5.100 . 8.300 6.121 5.932 6.347 . 0 0 "[ . 1]" 1
289 1 33 SER H 1 33 SER QB 2.500 . 3.300 2.415 2.256 2.700 . 0 0 "[ . 1]" 1
290 1 33 SER H 1 34 GLU H 2.700 . 3.600 2.649 2.596 2.698 . 0 0 "[ . 1]" 1
291 1 33 SER HA 1 36 GLN H 3.600 . 5.200 3.811 3.594 4.227 . 0 0 "[ . 1]" 1
292 1 34 GLU H 1 34 GLU HA 2.400 . 3.100 2.873 2.831 2.881 . 0 0 "[ . 1]" 1
293 1 34 GLU H 1 34 GLU HB2 2.400 . 3.100 2.416 2.261 2.533 . 0 0 "[ . 1]" 1
294 1 34 GLU H 1 34 GLU HG3 3.200 . 4.500 3.037 2.345 3.932 . 0 0 "[ . 1]" 1
295 1 34 GLU H 1 35 SER H 2.600 . 3.500 2.391 2.307 2.565 . 0 0 "[ . 1]" 1
296 1 34 GLU H 1 36 GLN H 4.400 . 6.900 3.918 3.757 4.234 . 0 0 "[ . 1]" 1
297 1 34 GLU HA 1 35 SER H 2.800 . 3.700 3.481 3.434 3.546 . 0 0 "[ . 1]" 1
298 1 34 GLU HA 1 36 GLN H 3.400 . 4.800 3.591 3.485 3.749 . 0 0 "[ . 1]" 1
299 1 34 GLU HA 1 37 LEU MD2 2.900 . 4.000 3.601 3.175 4.089 0.089 8 0 "[ . 1]" 1
300 1 34 GLU HB2 1 35 SER H 2.900 . 4.000 2.799 2.586 3.157 . 0 0 "[ . 1]" 1
301 1 34 GLU HB2 1 37 LEU MD2 4.500 . 7.000 6.105 5.695 6.556 . 0 0 "[ . 1]" 1
302 1 34 GLU HB2 1 49 ILE MD 3.200 . 4.400 3.836 3.461 4.749 0.349 3 0 "[ . 1]" 1
303 1 34 GLU HB3 1 35 SER H 3.800 . 5.600 3.704 3.312 3.820 . 0 0 "[ . 1]" 1
304 1 34 GLU QG 1 37 LEU MD2 4.100 . 6.200 4.730 4.033 5.920 . 0 0 "[ . 1]" 1
305 1 34 GLU HG2 1 35 SER H 5.500 . 9.200 4.851 4.096 5.457 . 0 0 "[ . 1]" 1
306 1 35 SER H 1 35 SER QB 2.500 . 3.300 2.385 2.230 2.652 . 0 0 "[ . 1]" 1
307 1 35 SER H 1 36 GLN H 2.800 . 3.800 2.662 2.598 2.726 . 0 0 "[ . 1]" 1
308 1 35 SER H 1 37 LEU H 4.900 . 7.800 4.178 4.099 4.284 . 0 0 "[ . 1]" 1
309 1 35 SER HA 1 35 SER QB 2.500 . 3.300 2.330 2.184 2.408 . 0 0 "[ . 1]" 1
310 1 35 SER HA 1 49 ILE MD 2.400 . 3.100 2.275 2.033 2.447 . 0 0 "[ . 1]" 1
311 1 35 SER QB 1 36 GLN H 3.600 . 5.200 3.387 3.024 3.838 . 0 0 "[ . 1]" 1
312 1 35 SER QB 1 49 ILE MD 3.000 . 4.100 2.968 2.669 3.169 . 0 0 "[ . 1]" 1
313 1 35 SER QB 1 49 ILE MG 2.900 . 3.900 2.866 2.505 3.147 . 0 0 "[ . 1]" 1
314 1 35 SER QB 1 103 LEU MD2 2.900 . 3.900 2.684 2.268 2.928 . 0 0 "[ . 1]" 1
315 1 36 GLN H 1 36 GLN HA 2.900 . 4.000 2.931 2.909 2.939 . 0 0 "[ . 1]" 1
316 1 36 GLN H 1 36 GLN HB3 2.700 . 3.600 2.893 2.483 3.716 0.116 7 0 "[ . 1]" 1
317 1 36 GLN H 1 36 GLN QG 3.200 . 4.500 3.680 2.752 4.113 . 0 0 "[ . 1]" 1
318 1 36 GLN H 1 37 LEU QB 4.300 . 6.600 4.183 4.014 4.368 . 0 0 "[ . 1]" 1
319 1 36 GLN H 1 37 LEU MD2 4.300 . 6.600 4.350 4.085 4.483 . 0 0 "[ . 1]" 1
320 1 36 GLN HA 1 36 GLN QG 3.000 . 4.100 2.743 2.412 3.060 . 0 0 "[ . 1]" 1
321 1 37 LEU H 1 37 LEU HA 2.700 . 3.600 2.864 2.827 2.905 . 0 0 "[ . 1]" 1
322 1 37 LEU H 1 37 LEU HB2 2.200 . 2.800 2.462 2.433 2.483 . 0 0 "[ . 1]" 1
323 1 37 LEU H 1 37 LEU MD1 4.100 . 6.200 3.619 3.569 3.691 . 0 0 "[ . 1]" 1
324 1 37 LEU H 1 37 LEU MD2 3.800 . 5.600 3.423 3.281 3.520 . 0 0 "[ . 1]" 1
325 1 37 LEU H 1 37 LEU HG 2.400 . 3.100 2.368 2.235 2.468 . 0 0 "[ . 1]" 1
326 1 37 LEU H 1 38 LYS H 4.200 . 6.500 4.556 4.527 4.591 . 0 0 "[ . 1]" 1
327 1 37 LEU H 1 38 LYS HA 3.600 . 6.000 5.452 5.403 5.549 . 0 0 "[ . 1]" 1
328 1 37 LEU H 1 40 ALA H 4.400 . 6.900 4.446 4.186 4.674 . 0 0 "[ . 1]" 1
329 1 37 LEU H 1 40 ALA MB 3.100 . 4.300 3.039 2.692 3.333 . 0 0 "[ . 1]" 1
330 1 37 LEU HA 1 37 LEU QB 2.300 . 3.000 2.363 2.355 2.376 . 0 0 "[ . 1]" 1
331 1 37 LEU HA 1 37 LEU MD2 2.600 . 3.500 2.133 2.099 2.159 . 0 0 "[ . 1]" 1
332 1 37 LEU HA 1 37 LEU HG 2.600 . 3.400 3.109 3.065 3.167 . 0 0 "[ . 1]" 1
333 1 37 LEU HA 1 38 LYS H 2.200 . 2.800 2.189 2.140 2.293 . 0 0 "[ . 1]" 1
334 1 37 LEU HA 1 39 GLU H 4.200 . 6.400 3.881 3.766 4.016 . 0 0 "[ . 1]" 1
335 1 37 LEU HB3 1 37 LEU MD2 2.100 . 2.600 2.328 2.310 2.348 . 0 0 "[ . 1]" 1
336 1 37 LEU HB3 1 39 GLU H 2.600 . 3.400 2.481 2.395 2.720 . 0 0 "[ . 1]" 1
337 1 37 LEU MD1 1 37 LEU HG 1.800 . 2.200 2.124 2.123 2.126 . 0 0 "[ . 1]" 1
338 1 37 LEU MD2 1 37 LEU HG 1.900 . 2.400 2.123 2.120 2.126 . 0 0 "[ . 1]" 1
339 1 37 LEU MD2 1 38 LYS H 3.500 . 5.000 3.553 3.497 3.621 . 0 0 "[ . 1]" 1
340 1 37 LEU MD2 1 39 GLU H 3.900 . 5.800 4.234 4.095 4.350 . 0 0 "[ . 1]" 1
341 1 37 LEU MD2 1 40 ALA MB 4.300 . 6.600 4.436 4.221 4.781 . 0 0 "[ . 1]" 1
342 1 38 LYS H 1 38 LYS HA 2.800 . 3.800 2.841 2.819 2.856 . 0 0 "[ . 1]" 1
343 1 38 LYS HA 1 38 LYS HB2 2.900 . 3.900 2.804 2.456 3.027 . 0 0 "[ . 1]" 1
344 1 38 LYS HA 1 38 LYS HB3 2.900 . 3.900 2.572 2.404 3.027 . 0 0 "[ . 1]" 1
345 1 38 LYS HA 1 38 LYS QD 4.500 . 7.000 4.109 3.956 4.524 . 0 0 "[ . 1]" 1
346 1 38 LYS HA 1 38 LYS QG 2.600 . 3.500 2.643 2.372 3.358 . 0 0 "[ . 1]" 1
347 1 38 LYS HB2 1 38 LYS QG 2.500 . 3.300 2.349 2.313 2.384 . 0 0 "[ . 1]" 1
348 1 38 LYS QD 1 38 LYS QE 2.100 . 2.600 2.020 1.991 2.090 . 0 0 "[ . 1]" 1
349 1 38 LYS QE 1 38 LYS QG 2.600 . 3.400 2.416 2.154 2.791 . 0 0 "[ . 1]" 1
350 1 39 GLU H 1 39 GLU HA 2.800 . 3.800 2.846 2.833 2.867 . 0 0 "[ . 1]" 1
351 1 39 GLU H 1 39 GLU QB 2.600 . 3.400 2.385 2.254 2.615 . 0 0 "[ . 1]" 1
352 1 39 GLU H 1 39 GLU HG3 4.300 . 6.600 3.722 2.392 4.501 . 0 0 "[ . 1]" 1
353 1 39 GLU H 1 40 ALA H 2.500 . 3.300 2.520 2.434 2.575 . 0 0 "[ . 1]" 1
354 1 39 GLU H 1 40 ALA MB 3.800 . 5.600 4.178 4.104 4.221 . 0 0 "[ . 1]" 1
355 1 39 GLU H 1 41 LEU H 4.500 . 7.000 4.135 3.929 4.307 . 0 0 "[ . 1]" 1
356 1 39 GLU HA 1 39 GLU QB 2.300 . 2.900 2.340 2.182 2.438 . 0 0 "[ . 1]" 1
357 1 39 GLU QB 1 40 ALA H 3.200 . 4.500 3.171 2.872 3.711 . 0 0 "[ . 1]" 1
358 1 39 GLU QB 1 41 LEU H 4.400 . 6.900 4.271 4.131 4.481 . 0 0 "[ . 1]" 1
359 1 40 ALA H 1 40 ALA HA 2.200 . 2.800 2.878 2.849 2.904 0.104 7 0 "[ . 1]" 1
360 1 40 ALA H 1 40 ALA MB 1.900 . 2.400 2.267 2.240 2.311 . 0 0 "[ . 1]" 1
361 1 40 ALA H 1 41 LEU H 2.400 . 3.100 2.465 2.332 2.530 . 0 0 "[ . 1]" 1
362 1 40 ALA H 1 41 LEU QB 3.800 . 5.600 4.177 3.958 4.366 . 0 0 "[ . 1]" 1
363 1 40 ALA HA 1 40 ALA MB 1.800 . 2.200 2.121 2.118 2.123 . 0 0 "[ . 1]" 1
364 1 40 ALA HA 1 41 LEU H 2.600 . 3.500 3.274 3.237 3.382 . 0 0 "[ . 1]" 1
365 1 40 ALA HA 1 41 LEU QB 4.100 . 6.200 5.025 4.958 5.286 . 0 0 "[ . 1]" 1
366 1 40 ALA HA 1 42 GLU H 3.000 . 4.100 3.223 3.100 3.342 . 0 0 "[ . 1]" 1
367 1 40 ALA HA 1 45 LYS QB 2.900 . 3.900 2.836 2.567 3.134 . 0 0 "[ . 1]" 1
368 1 40 ALA MB 1 41 LEU H 2.900 . 4.000 3.244 3.065 3.292 . 0 0 "[ . 1]" 1
369 1 40 ALA MB 1 49 ILE MD 1.700 . 6.000 2.136 1.829 2.557 . 0 0 "[ . 1]" 1
370 1 41 LEU H 1 41 LEU HA 3.000 . 4.100 2.863 2.830 2.899 . 0 0 "[ . 1]" 1
371 1 41 LEU H 1 41 LEU QB 2.600 . 3.400 2.276 2.235 2.422 . 0 0 "[ . 1]" 1
372 1 41 LEU H 1 41 LEU MD1 3.900 . 5.800 4.071 3.757 4.124 . 0 0 "[ . 1]" 1
373 1 41 LEU H 1 42 GLU H 3.000 . 4.100 2.522 2.433 2.787 . 0 0 "[ . 1]" 1
374 1 41 LEU HA 1 41 LEU QB 2.500 . 3.300 2.372 2.350 2.396 . 0 0 "[ . 1]" 1
375 1 41 LEU HA 1 42 GLU H 2.800 . 3.800 3.293 2.950 3.391 . 0 0 "[ . 1]" 1
376 1 41 LEU QB 1 42 GLU H 3.200 . 4.500 3.235 3.062 3.717 . 0 0 "[ . 1]" 1
377 1 41 LEU QB 1 42 GLU QB 5.800 . 10.000 4.713 4.325 5.252 . 0 0 "[ . 1]" 1
378 1 41 LEU HB3 1 41 LEU MD2 2.200 . 2.800 2.315 2.280 2.395 . 0 0 "[ . 1]" 1
379 1 41 LEU MD2 1 41 LEU HG 1.900 . 2.300 2.127 2.125 2.128 . 0 0 "[ . 1]" 1
380 1 41 LEU MD2 1 42 GLU H 4.300 . 6.600 4.954 4.600 5.460 . 0 0 "[ . 1]" 1
381 1 41 LEU HG 1 42 GLU H 3.600 . 5.300 4.466 4.268 4.763 . 0 0 "[ . 1]" 1
382 1 42 GLU H 1 42 GLU HA 2.800 . 3.800 2.818 2.753 2.897 . 0 0 "[ . 1]" 1
383 1 42 GLU H 1 42 GLU HB2 3.000 . 4.100 2.541 2.389 2.699 . 0 0 "[ . 1]" 1
384 1 42 GLU H 1 42 GLU HG3 4.300 . 6.600 4.146 3.706 4.471 . 0 0 "[ . 1]" 1
385 1 42 GLU H 1 43 PRO HD3 4.900 . 7.900 4.742 4.366 5.274 . 0 0 "[ . 1]" 1
386 1 42 GLU H 1 45 LYS QG 4.400 . 6.800 4.519 3.695 4.934 . 0 0 "[ . 1]" 1
387 1 42 GLU HA 1 42 GLU QB 3.400 . 4.800 2.353 2.285 2.411 . 0 0 "[ . 1]" 1
388 1 42 GLU HA 1 42 GLU HG2 3.800 . 5.600 3.467 2.930 3.889 . 0 0 "[ . 1]" 1
389 1 42 GLU HA 1 42 GLU HG3 3.700 . 5.400 3.370 2.643 3.745 . 0 0 "[ . 1]" 1
390 1 42 GLU HA 1 43 PRO HA 4.200 . 6.400 4.057 3.967 4.125 . 0 0 "[ . 1]" 1
391 1 42 GLU HA 1 43 PRO HD2 3.000 . 4.100 2.354 1.869 2.536 0.031 5 0 "[ . 1]" 1
392 1 42 GLU HA 1 43 PRO QD 2.700 . 3.600 2.003 1.834 2.255 . 0 0 "[ . 1]" 1
393 1 42 GLU HA 1 43 PRO HD3 3.300 . 4.600 2.260 1.994 2.662 0.006 1 0 "[ . 1]" 1
394 1 42 GLU HB2 1 45 LYS QG 4.900 . 7.900 4.927 4.150 5.587 . 0 0 "[ . 1]" 1
395 1 42 GLU HG3 1 45 LYS QG 5.800 . 10.000 5.650 4.954 6.450 . 0 0 "[ . 1]" 1
396 1 43 PRO HA 1 43 PRO HG2 3.600 . 5.200 3.885 3.864 3.925 . 0 0 "[ . 1]" 1
397 1 43 PRO HA 1 44 ASN H 3.300 . 4.700 3.560 3.527 3.588 . 0 0 "[ . 1]" 1
398 1 43 PRO QB 1 43 PRO HD3 4.400 . 6.800 3.262 2.866 3.521 . 0 0 "[ . 1]" 1
399 1 43 PRO HB3 1 44 ASN H 3.400 . 4.800 4.021 3.891 4.198 . 0 0 "[ . 1]" 1
400 1 43 PRO HB3 1 44 ASN HD21 5.000 . 8.100 7.280 5.334 7.908 . 0 0 "[ . 1]" 1
401 1 43 PRO HD2 1 44 ASN H 3.400 . 4.900 3.124 2.926 3.328 . 0 0 "[ . 1]" 1
402 1 43 PRO HG2 1 44 ASN H 4.400 . 6.900 3.469 2.355 4.259 . 0 0 "[ . 1]" 1
403 1 43 PRO HG2 1 44 ASN HB2 6.600 . 12.000 5.545 4.228 6.568 . 0 0 "[ . 1]" 1
404 1 43 PRO HG2 1 44 ASN HB3 6.300 . 11.200 6.701 5.379 7.546 . 0 0 "[ . 1]" 1
405 1 44 ASN H 1 44 ASN HA 2.800 . 3.800 2.841 2.806 2.863 . 0 0 "[ . 1]" 1
406 1 44 ASN H 1 44 ASN HB2 3.800 . 5.600 2.448 2.352 2.531 . 0 0 "[ . 1]" 1
407 1 44 ASN H 1 44 ASN HB3 2.600 . 3.500 3.617 3.585 3.642 0.142 4 0 "[ . 1]" 1
408 1 44 ASN H 1 44 ASN HD21 4.700 . 7.500 4.059 2.479 4.772 . 0 0 "[ . 1]" 1
409 1 44 ASN H 1 44 ASN HD22 4.900 . 8.000 4.455 3.787 4.958 . 0 0 "[ . 1]" 1
410 1 44 ASN H 1 45 LYS H 2.600 . 3.400 2.651 2.462 2.824 . 0 0 "[ . 1]" 1
411 1 44 ASN H 1 46 ARG H 4.300 . 6.600 3.971 3.828 4.196 . 0 0 "[ . 1]" 1
412 1 44 ASN HA 1 44 ASN HB2 2.600 . 3.500 3.024 3.011 3.032 . 0 0 "[ . 1]" 1
413 1 44 ASN HA 1 44 ASN HD22 5.400 . 9.100 4.484 3.860 4.718 . 0 0 "[ . 1]" 1
414 1 44 ASN HA 1 45 LYS H 3.500 . 5.100 3.552 3.483 3.580 . 0 0 "[ . 1]" 1
415 1 44 ASN HA 1 47 GLN QB 3.000 . 4.200 3.168 2.836 3.561 . 0 0 "[ . 1]" 1
416 1 44 ASN HA 1 47 GLN QG 3.900 . 5.800 3.743 3.116 4.386 . 0 0 "[ . 1]" 1
417 1 44 ASN HB2 1 44 ASN HD21 4.500 . 7.000 2.577 2.229 3.477 . 0 0 "[ . 1]" 1
418 1 44 ASN HB2 1 45 LYS H 4.100 . 6.200 2.670 2.467 2.871 . 0 0 "[ . 1]" 1
419 1 44 ASN HB2 1 45 LYS HA 4.300 . 6.600 4.435 4.309 4.559 . 0 0 "[ . 1]" 1
420 1 44 ASN HB2 1 47 GLN QG 5.600 . 9.500 6.320 5.761 7.013 . 0 0 "[ . 1]" 1
421 1 44 ASN HB3 1 44 ASN HD21 4.200 . 6.400 2.695 2.250 3.453 . 0 0 "[ . 1]" 1
422 1 44 ASN HB3 1 45 LYS H 3.100 . 4.300 3.577 3.382 3.860 . 0 0 "[ . 1]" 1
423 1 44 ASN HB3 1 45 LYS HA 4.300 . 6.600 4.351 4.159 4.553 . 0 0 "[ . 1]" 1
424 1 44 ASN HB3 1 47 GLN QG 6.000 . 10.500 5.653 5.187 6.050 . 0 0 "[ . 1]" 1
425 1 45 LYS H 1 45 LYS HA 2.600 . 3.500 2.817 2.784 2.869 . 0 0 "[ . 1]" 1
426 1 45 LYS H 1 45 LYS QB 2.300 . 3.000 2.233 2.203 2.300 . 0 0 "[ . 1]" 1
427 1 45 LYS H 1 45 LYS QD 4.500 . 7.100 4.298 4.047 4.484 . 0 0 "[ . 1]" 1
428 1 45 LYS H 1 45 LYS QG 4.400 . 6.800 4.009 3.962 4.063 . 0 0 "[ . 1]" 1
429 1 45 LYS H 1 46 ARG H 2.500 . 3.300 2.589 2.440 2.676 . 0 0 "[ . 1]" 1
430 1 45 LYS H 1 46 ARG HA 4.800 . 7.700 5.196 5.083 5.273 . 0 0 "[ . 1]" 1
431 1 45 LYS HA 1 45 LYS QG 3.400 . 4.800 2.922 2.301 3.045 . 0 0 "[ . 1]" 1
432 1 45 LYS HA 1 48 HIS HB2 2.900 . 3.900 2.961 2.534 3.239 . 0 0 "[ . 1]" 1
433 1 45 LYS HA 1 48 HIS HD2 5.200 . 8.600 5.365 4.856 5.833 . 0 0 "[ . 1]" 1
434 1 46 ARG H 1 46 ARG HA 2.800 . 3.800 2.794 2.775 2.808 . 0 0 "[ . 1]" 1
435 1 46 ARG H 1 47 GLN H 2.800 . 3.800 2.737 2.675 2.769 . 0 0 "[ . 1]" 1
436 1 46 ARG HA 1 47 GLN H 3.700 . 5.400 3.539 3.515 3.560 . 0 0 "[ . 1]" 1
437 1 46 ARG HA 1 49 ILE H 3.200 . 4.500 3.391 3.273 3.552 . 0 0 "[ . 1]" 1
438 1 46 ARG QB 1 47 GLN H 2.900 . 3.900 2.555 2.506 2.654 . 0 0 "[ . 1]" 1
439 1 46 ARG HD3 1 107 ILE HB 4.800 . 7.600 4.839 4.264 5.142 . 0 0 "[ . 1]" 1
440 1 47 GLN H 1 47 GLN HA 2.800 . 3.800 2.823 2.802 2.845 . 0 0 "[ . 1]" 1
441 1 47 GLN H 1 47 GLN HB2 2.300 . 3.000 2.408 2.263 2.520 . 0 0 "[ . 1]" 1
442 1 47 GLN H 1 47 GLN QG 3.500 . 5.000 2.817 2.120 3.997 . 0 0 "[ . 1]" 1
443 1 47 GLN H 1 48 HIS H 2.600 . 3.500 2.584 2.495 2.664 . 0 0 "[ . 1]" 1
444 1 47 GLN H 1 48 HIS HA 4.400 . 6.900 5.211 5.134 5.283 . 0 0 "[ . 1]" 1
445 1 47 GLN H 1 48 HIS QB 4.800 . 7.700 4.362 4.272 4.440 . 0 0 "[ . 1]" 1
446 1 47 GLN H 1 50 TYR HB3 4.900 . 7.900 5.321 5.033 5.715 . 0 0 "[ . 1]" 1
447 1 47 GLN HA 1 50 TYR H 3.200 . 4.500 3.453 3.275 3.679 . 0 0 "[ . 1]" 1
448 1 47 GLN HA 1 50 TYR HB2 4.200 . 6.400 3.331 2.911 3.618 . 0 0 "[ . 1]" 1
449 1 47 GLN HA 1 50 TYR HB3 3.800 . 5.600 2.760 2.427 3.122 . 0 0 "[ . 1]" 1
450 1 47 GLN HA 1 50 TYR QD 4.200 . 6.500 4.006 3.598 4.469 . 0 0 "[ . 1]" 1
451 1 47 GLN HA 1 51 GLN H 4.300 . 6.600 4.324 3.953 4.785 . 0 0 "[ . 1]" 1
452 1 47 GLN QB 1 48 HIS H 2.700 . 3.600 2.681 2.548 2.799 . 0 0 "[ . 1]" 1
453 1 47 GLN QB 1 48 HIS HA 3.700 . 5.400 3.928 3.832 4.145 . 0 0 "[ . 1]" 1
454 1 47 GLN QB 1 51 GLN H 3.500 . 6.000 4.904 4.386 5.573 . 0 0 "[ . 1]" 1
455 1 47 GLN QG 1 50 TYR HB2 6.600 . 12.100 5.262 4.730 5.783 . 0 0 "[ . 1]" 1
456 1 47 GLN QG 1 50 TYR QD 5.300 . 8.800 4.949 4.207 5.694 . 0 0 "[ . 1]" 1
457 1 47 GLN QG 1 50 TYR QE 4.900 . 7.900 6.405 5.535 7.147 . 0 0 "[ . 1]" 1
458 1 48 HIS H 1 48 HIS HA 2.900 . 4.000 2.836 2.805 2.848 . 0 0 "[ . 1]" 1
459 1 48 HIS H 1 48 HIS QB 2.500 . 3.300 2.255 2.234 2.281 . 0 0 "[ . 1]" 1
460 1 48 HIS H 1 49 ILE H 2.600 . 3.400 2.575 2.522 2.682 . 0 0 "[ . 1]" 1
461 1 48 HIS HA 1 48 HIS HD2 4.200 . 6.400 4.080 3.651 4.344 . 0 0 "[ . 1]" 1
462 1 48 HIS HA 1 48 HIS HE1 6.000 . 10.500 5.065 4.853 5.228 . 0 0 "[ . 1]" 1
463 1 48 HIS HA 1 49 ILE H 4.000 . 6.000 3.527 3.498 3.541 . 0 0 "[ . 1]" 1
464 1 48 HIS HA 1 51 GLN H 3.600 . 5.200 3.434 3.229 3.661 . 0 0 "[ . 1]" 1
465 1 48 HIS HA 1 51 GLN HG2 5.200 . 8.600 4.643 4.028 5.366 . 0 0 "[ . 1]" 1
466 1 48 HIS HA 1 51 GLN HG3 6.300 . 11.200 5.331 4.941 5.739 . 0 0 "[ . 1]" 1
467 1 48 HIS HB3 1 48 HIS HD2 3.300 . 4.600 2.855 2.743 3.015 . 0 0 "[ . 1]" 1
468 1 48 HIS HB3 1 49 ILE H 3.000 . 4.100 2.695 2.593 2.779 . 0 0 "[ . 1]" 1
469 1 48 HIS HD2 1 49 ILE HA 4.200 . 6.400 3.794 3.450 4.166 . 0 0 "[ . 1]" 1
470 1 48 HIS HD2 1 51 GLN QB 4.600 . 7.200 4.920 4.364 5.501 . 0 0 "[ . 1]" 1
471 1 48 HIS HD2 1 52 ARG QB 4.400 . 6.800 4.269 2.761 4.938 . 0 0 "[ . 1]" 1
472 1 48 HIS HD2 1 52 ARG QG 4.600 . 7.300 3.107 2.625 4.233 . 0 0 "[ . 1]" 1
473 1 48 HIS HE1 1 52 ARG HD3 6.000 . 10.400 6.733 5.381 7.637 . 0 0 "[ . 1]" 1
474 1 48 HIS HE1 1 52 ARG HG3 5.800 . 9.900 6.022 5.085 9.168 . 0 0 "[ . 1]" 1
475 1 49 ILE H 1 49 ILE HA 3.000 . 4.100 2.832 2.804 2.846 . 0 0 "[ . 1]" 1
476 1 49 ILE H 1 49 ILE HB 2.400 . 3.100 2.483 2.431 2.525 . 0 0 "[ . 1]" 1
477 1 49 ILE H 1 49 ILE MD 3.400 . 4.800 3.282 3.248 3.307 . 0 0 "[ . 1]" 1
478 1 49 ILE HA 1 49 ILE MD 4.100 . 6.200 3.819 3.793 3.836 . 0 0 "[ . 1]" 1
479 1 49 ILE HA 1 49 ILE MG 2.600 . 3.500 2.453 2.420 2.493 . 0 0 "[ . 1]" 1
480 1 49 ILE HA 1 50 TYR H 3.900 . 5.800 3.562 3.540 3.575 . 0 0 "[ . 1]" 1
481 1 49 ILE HA 1 51 GLN H 4.300 . 6.600 4.267 4.210 4.322 . 0 0 "[ . 1]" 1
482 1 49 ILE HA 1 52 ARG H 3.400 . 4.900 3.339 3.223 3.461 . 0 0 "[ . 1]" 1
483 1 49 ILE HA 1 52 ARG HB2 2.600 . 3.400 2.722 2.556 3.098 . 0 0 "[ . 1]" 1
484 1 49 ILE HB 1 49 ILE MD 2.500 . 3.300 2.435 2.424 2.454 . 0 0 "[ . 1]" 1
485 1 49 ILE HB 1 49 ILE MG 2.100 . 2.600 2.128 2.126 2.129 . 0 0 "[ . 1]" 1
486 1 49 ILE HB 1 50 TYR H 2.600 . 3.500 2.494 2.314 2.592 . 0 0 "[ . 1]" 1
487 1 49 ILE HB 1 52 ARG HB3 4.700 . 7.500 6.902 5.247 7.406 . 0 0 "[ . 1]" 1
488 1 49 ILE MG 1 50 TYR H 3.100 . 4.300 3.254 3.167 3.320 . 0 0 "[ . 1]" 1
489 1 49 ILE MG 1 50 TYR HB3 4.800 . 7.600 5.190 5.107 5.287 . 0 0 "[ . 1]" 1
490 1 49 ILE MG 1 51 GLN H 4.300 . 6.600 4.885 4.835 4.925 . 0 0 "[ . 1]" 1
491 1 49 ILE MG 1 52 ARG HB2 2.200 . 6.000 3.729 3.440 4.639 . 0 0 "[ . 1]" 1
492 1 49 ILE MG 1 53 CYS HB2 3.100 . 4.300 3.264 3.011 3.633 . 0 0 "[ . 1]" 1
493 1 50 TYR H 1 50 TYR HA 2.900 . 4.000 2.752 2.742 2.791 . 0 0 "[ . 1]" 1
494 1 50 TYR H 1 50 TYR HB2 2.700 . 3.600 2.449 2.360 2.492 . 0 0 "[ . 1]" 1
495 1 50 TYR H 1 50 TYR HB3 2.800 . 3.800 2.557 2.506 2.599 . 0 0 "[ . 1]" 1
496 1 50 TYR H 1 50 TYR QD 5.200 . 8.600 4.182 4.148 4.192 . 0 0 "[ . 1]" 1
497 1 50 TYR HA 1 50 TYR HB2 2.700 . 3.600 2.459 2.441 2.490 . 0 0 "[ . 1]" 1
498 1 50 TYR HA 1 50 TYR QD 3.900 . 5.800 2.436 2.281 2.628 . 0 0 "[ . 1]" 1
499 1 50 TYR HA 1 50 TYR QE 5.400 . 9.000 4.547 4.514 4.613 . 0 0 "[ . 1]" 1
500 1 50 TYR HA 1 50 TYR QE 4.200 . 6.400 3.501 3.352 3.624 . 0 0 "[ . 1]" 1
501 1 50 TYR HA 1 51 GLN H 3.600 . 5.200 3.542 3.535 3.550 . 0 0 "[ . 1]" 1
502 1 50 TYR HA 1 51 GLN QB 5.200 . 8.600 5.219 5.204 5.234 . 0 0 "[ . 1]" 1
503 1 50 TYR HA 1 53 CYS HB2 4.000 . 6.000 3.246 2.891 3.371 . 0 0 "[ . 1]" 1
504 1 50 TYR HA 1 53 CYS HB3 3.200 . 4.500 2.790 2.679 2.920 . 0 0 "[ . 1]" 1
505 1 50 TYR HA 1 54 ILE MD 4.400 . 6.900 4.734 4.568 4.878 . 0 0 "[ . 1]" 1
506 1 50 TYR HA 1 104 ALA MB 3.600 . 5.200 3.982 3.804 4.287 . 0 0 "[ . 1]" 1
507 1 50 TYR HA 1 107 ILE MD 2.800 . 3.800 2.993 2.549 3.235 . 0 0 "[ . 1]" 1
508 1 50 TYR HB2 1 51 GLN H 4.200 . 6.400 3.906 3.850 3.951 . 0 0 "[ . 1]" 1
509 1 50 TYR HB2 1 107 ILE MD 3.300 . 4.600 2.401 1.849 2.632 0.151 5 0 "[ . 1]" 1
510 1 50 TYR HB2 1 107 ILE MG 2.800 . 3.800 2.468 1.944 2.704 . 0 0 "[ . 1]" 1
511 1 50 TYR HB3 1 51 GLN H 2.800 . 3.800 2.626 2.591 2.657 . 0 0 "[ . 1]" 1
512 1 50 TYR HB3 1 107 ILE MD 3.900 . 5.800 4.598 3.667 5.027 . 0 0 "[ . 1]" 1
513 1 50 TYR HB3 1 107 ILE MD 4.500 . 7.000 3.608 3.090 3.841 . 0 0 "[ . 1]" 1
514 1 50 TYR HB3 1 107 ILE MG 3.900 . 5.800 3.778 3.327 3.991 . 0 0 "[ . 1]" 1
515 1 50 TYR QD 1 51 GLN H 4.800 . 7.700 3.879 3.710 4.030 . 0 0 "[ . 1]" 1
516 1 50 TYR QD 1 51 GLN HA 4.700 . 7.500 4.113 3.858 4.395 . 0 0 "[ . 1]" 1
517 1 50 TYR QD 1 51 GLN HG3 5.800 . 10.000 6.558 5.810 6.944 . 0 0 "[ . 1]" 1
518 1 50 TYR QD 1 54 ILE MD 4.000 . 6.000 3.482 3.332 3.580 . 0 0 "[ . 1]" 1
519 1 50 TYR QD 1 54 ILE MG 4.900 . 7.900 5.785 5.614 5.874 . 0 0 "[ . 1]" 1
520 1 50 TYR QD 1 104 ALA HA 4.200 . 6.400 2.563 2.332 2.698 . 0 0 "[ . 1]" 1
521 1 50 TYR QD 1 104 ALA MB 3.400 . 4.800 2.741 2.443 2.999 . 0 0 "[ . 1]" 1
522 1 50 TYR QD 1 107 ILE HB 4.600 . 7.300 3.069 2.854 3.474 . 0 0 "[ . 1]" 1
523 1 50 TYR QD 1 107 ILE HG12 5.500 . 9.200 5.687 5.290 6.033 . 0 0 "[ . 1]" 1
524 1 50 TYR QD 1 107 ILE MG 3.900 . 5.800 3.688 3.331 4.048 . 0 0 "[ . 1]" 1
525 1 50 TYR QE 1 51 GLN HA 4.800 . 7.700 5.210 5.013 5.419 . 0 0 "[ . 1]" 1
526 1 50 TYR QE 1 51 GLN HA 4.000 . 6.000 3.588 2.255 4.616 . 0 0 "[ . 1]" 1
527 1 50 TYR QE 1 53 CYS HB3 5.200 . 8.600 4.969 4.710 5.244 . 0 0 "[ . 1]" 1
528 1 50 TYR QE 1 54 ILE HA 6.500 . 11.700 6.039 5.664 6.490 . 0 0 "[ . 1]" 1
529 1 50 TYR QE 1 54 ILE HB 6.600 . 12.000 5.834 5.603 5.944 . 0 0 "[ . 1]" 1
530 1 50 TYR QE 1 54 ILE HB 4.500 . 7.100 4.500 4.276 4.800 . 0 0 "[ . 1]" 1
531 1 50 TYR QE 1 54 ILE MD 3.300 . 4.600 2.812 2.661 2.968 . 0 0 "[ . 1]" 1
532 1 50 TYR QE 1 54 ILE HG12 4.000 . 6.000 4.320 3.928 4.742 . 0 0 "[ . 1]" 1
533 1 50 TYR QE 1 54 ILE HG13 5.400 . 9.100 4.071 3.827 4.314 . 0 0 "[ . 1]" 1
534 1 50 TYR QE 1 54 ILE MG 4.700 . 7.400 5.305 5.050 5.485 . 0 0 "[ . 1]" 1
535 1 50 TYR QE 1 104 ALA MB 2.100 . 2.600 2.177 1.965 2.359 . 0 0 "[ . 1]" 1
536 1 50 TYR QE 1 107 ILE MG 4.200 . 6.400 5.131 4.510 5.483 . 0 0 "[ . 1]" 1
537 1 50 TYR QE 1 108 SER HB2 2.100 . 6.000 3.735 2.257 5.160 . 0 0 "[ . 1]" 1
538 1 50 TYR QE 1 108 SER HB3 2.000 . 6.000 3.651 2.857 5.211 . 0 0 "[ . 1]" 1
539 1 51 GLN H 1 51 GLN HA 3.000 . 4.200 2.835 2.820 2.851 . 0 0 "[ . 1]" 1
540 1 51 GLN H 1 51 GLN QB 2.700 . 3.600 2.257 2.216 2.276 . 0 0 "[ . 1]" 1
541 1 51 GLN H 1 51 GLN HG2 4.800 . 7.700 4.608 4.480 4.637 . 0 0 "[ . 1]" 1
542 1 51 GLN H 1 51 GLN HG3 4.600 . 7.200 4.479 4.409 4.542 . 0 0 "[ . 1]" 1
543 1 51 GLN H 1 52 ARG H 2.600 . 3.500 2.648 2.568 2.702 . 0 0 "[ . 1]" 1
544 1 51 GLN H 1 54 ILE H 4.800 . 7.700 4.833 4.769 4.929 . 0 0 "[ . 1]" 1
545 1 51 GLN HA 1 51 GLN HB2 2.800 . 3.800 2.503 2.430 2.598 . 0 0 "[ . 1]" 1
546 1 51 GLN HA 1 51 GLN QB 3.100 . 4.300 2.389 2.336 2.454 . 0 0 "[ . 1]" 1
547 1 51 GLN HA 1 51 GLN HG2 4.000 . 6.000 3.682 3.059 3.797 . 0 0 "[ . 1]" 1
548 1 51 GLN HA 1 51 GLN HG3 3.300 . 4.600 3.025 2.596 3.278 . 0 0 "[ . 1]" 1
549 1 51 GLN HA 1 52 ARG H 3.500 . 5.000 3.546 3.533 3.555 . 0 0 "[ . 1]" 1
550 1 51 GLN HA 1 54 ILE H 3.200 . 4.500 3.508 3.284 3.639 . 0 0 "[ . 1]" 1
551 1 51 GLN HA 1 54 ILE HA 5.200 . 8.600 5.560 5.375 5.706 . 0 0 "[ . 1]" 1
552 1 51 GLN HA 1 54 ILE HB 3.000 . 4.100 2.990 2.805 3.185 . 0 0 "[ . 1]" 1
553 1 51 GLN HA 1 54 ILE MD 3.000 . 4.100 2.739 2.600 2.946 . 0 0 "[ . 1]" 1
554 1 51 GLN HA 1 54 ILE HG12 3.400 . 4.900 4.892 4.732 5.065 0.165 1 0 "[ . 1]" 1
555 1 51 GLN HA 1 54 ILE HG13 5.300 . 8.800 3.430 3.234 3.598 . 0 0 "[ . 1]" 1
556 1 51 GLN HA 1 54 ILE MG 4.000 . 6.000 4.294 4.151 4.434 . 0 0 "[ . 1]" 1
557 1 51 GLN HA 1 55 GLN H 4.000 . 6.000 4.363 4.089 4.593 . 0 0 "[ . 1]" 1
558 1 51 GLN QB 1 51 GLN HE22 4.100 . 6.200 4.390 4.077 4.461 . 0 0 "[ . 1]" 1
559 1 51 GLN QB 1 53 CYS H 4.200 . 6.400 4.581 4.510 4.788 . 0 0 "[ . 1]" 1
560 1 51 GLN QB 1 54 ILE H 4.600 . 7.200 5.081 4.890 5.168 . 0 0 "[ . 1]" 1
561 1 51 GLN QB 1 55 GLN H 3.300 . 6.000 5.389 5.075 5.560 . 0 0 "[ . 1]" 1
562 1 51 GLN HE21 1 51 GLN HG2 4.300 . 6.600 2.847 2.267 2.953 . 0 0 "[ . 1]" 1
563 1 51 GLN HE22 1 51 GLN HG2 2.700 . 3.600 3.750 3.497 3.795 0.195 4 0 "[ . 1]" 1
564 1 51 GLN HE22 1 54 ILE MD 4.800 . 7.700 4.219 3.436 7.592 . 0 0 "[ . 1]" 1
565 1 51 GLN HG3 1 54 ILE MD 4.800 . 7.700 4.854 4.348 5.353 . 0 0 "[ . 1]" 1
566 1 52 ARG H 1 52 ARG HA 2.700 . 3.600 2.819 2.808 2.835 . 0 0 "[ . 1]" 1
567 1 52 ARG H 1 52 ARG HB2 2.300 . 3.000 2.399 2.295 2.474 . 0 0 "[ . 1]" 1
568 1 52 ARG H 1 53 CYS H 2.600 . 3.400 2.597 2.542 2.692 . 0 0 "[ . 1]" 1
569 1 52 ARG HA 1 52 ARG HE 5.700 . 9.700 4.681 3.373 5.001 . 0 0 "[ . 1]" 1
570 1 52 ARG HA 1 53 CYS H 3.100 . 4.300 3.483 3.467 3.546 . 0 0 "[ . 1]" 1
571 1 52 ARG HA 1 54 ILE H 3.700 . 5.400 4.474 4.211 4.622 . 0 0 "[ . 1]" 1
572 1 52 ARG QB 1 52 ARG HE 4.700 . 7.400 3.779 2.212 4.022 . 0 0 "[ . 1]" 1
573 1 52 ARG QB 1 53 CYS H 2.800 . 3.800 2.716 2.540 2.808 . 0 0 "[ . 1]" 1
574 1 52 ARG HE 1 52 ARG QG 3.200 . 4.500 2.320 2.239 2.523 . 0 0 "[ . 1]" 1
575 1 52 ARG HE 1 56 LEU QD 4.500 . 7.100 5.368 3.065 6.038 . 0 0 "[ . 1]" 1
576 1 53 CYS H 1 53 CYS HA 2.900 . 3.900 2.835 2.772 2.851 . 0 0 "[ . 1]" 1
577 1 53 CYS H 1 53 CYS HB2 2.700 . 3.600 2.543 2.340 2.653 . 0 0 "[ . 1]" 1
578 1 53 CYS H 1 53 CYS HB3 2.900 . 4.000 2.591 2.476 2.798 . 0 0 "[ . 1]" 1
579 1 53 CYS H 1 54 ILE H 2.800 . 3.800 2.634 2.567 2.814 . 0 0 "[ . 1]" 1
580 1 53 CYS HA 1 53 CYS HB2 2.900 . 3.900 2.492 2.444 2.614 . 0 0 "[ . 1]" 1
581 1 53 CYS HA 1 54 ILE HB 4.400 . 6.800 5.768 5.720 5.833 . 0 0 "[ . 1]" 1
582 1 53 CYS HA 1 56 LEU HB2 3.600 . 5.200 3.103 3.014 3.149 . 0 0 "[ . 1]" 1
583 1 53 CYS HA 1 56 LEU MD1 2.600 . 3.400 2.947 2.762 3.081 . 0 0 "[ . 1]" 1
584 1 53 CYS HA 1 104 ALA MB 4.300 . 6.600 4.935 4.783 5.200 . 0 0 "[ . 1]" 1
585 1 53 CYS HB2 1 54 ILE H 4.200 . 6.400 3.801 3.616 3.956 . 0 0 "[ . 1]" 1
586 1 53 CYS HB2 1 54 ILE MD 6.100 . 10.800 6.229 6.033 6.308 . 0 0 "[ . 1]" 1
587 1 53 CYS HB2 1 54 ILE MG 6.700 . 12.400 6.763 6.642 6.803 . 0 0 "[ . 1]" 1
588 1 53 CYS HB2 1 56 LEU MD1 4.000 . 6.000 4.699 4.525 4.858 . 0 0 "[ . 1]" 1
589 1 53 CYS HB2 1 56 LEU HG 6.000 . 10.500 5.761 5.485 5.951 . 0 0 "[ . 1]" 1
590 1 53 CYS HB2 1 104 ALA MB 3.700 . 5.400 3.784 3.470 4.040 . 0 0 "[ . 1]" 1
591 1 53 CYS HB3 1 54 ILE H 2.900 . 4.000 2.522 2.466 2.676 . 0 0 "[ . 1]" 1
592 1 53 CYS HB3 1 54 ILE HA 4.200 . 6.400 4.254 4.062 4.368 . 0 0 "[ . 1]" 1
593 1 53 CYS HB3 1 54 ILE MD 4.800 . 7.600 4.848 4.756 4.928 . 0 0 "[ . 1]" 1
594 1 53 CYS HB3 1 54 ILE MG 5.300 . 8.900 5.515 5.428 5.562 . 0 0 "[ . 1]" 1
595 1 53 CYS HB3 1 56 LEU MD2 5.000 . 8.100 7.236 7.028 7.357 . 0 0 "[ . 1]" 1
596 1 53 CYS HB3 1 56 LEU HG 6.000 . 10.500 6.236 5.975 6.389 . 0 0 "[ . 1]" 1
597 1 53 CYS HB3 1 103 LEU HB3 4.800 . 7.700 5.658 5.185 6.036 . 0 0 "[ . 1]" 1
598 1 53 CYS HB3 1 104 ALA MB 2.800 . 3.800 3.017 2.753 3.439 . 0 0 "[ . 1]" 1
599 1 54 ILE H 1 54 ILE HA 2.900 . 4.000 2.793 2.775 2.863 . 0 0 "[ . 1]" 1
600 1 54 ILE H 1 54 ILE HB 2.400 . 3.100 2.477 2.438 2.510 . 0 0 "[ . 1]" 1
601 1 54 ILE H 1 54 ILE MD 4.200 . 6.400 3.649 3.612 3.714 . 0 0 "[ . 1]" 1
602 1 54 ILE H 1 54 ILE HG12 2.500 . 3.300 3.438 3.397 3.561 0.261 2 0 "[ . 1]" 1
603 1 54 ILE H 1 54 ILE HG13 3.600 . 5.200 2.224 2.177 2.361 . 0 0 "[ . 1]" 1
604 1 54 ILE H 1 54 ILE MG 3.500 . 5.000 3.757 3.747 3.763 . 0 0 "[ . 1]" 1
605 1 54 ILE H 1 55 GLN H 2.600 . 3.500 2.734 2.471 2.797 . 0 0 "[ . 1]" 1
606 1 54 ILE HA 1 54 ILE HB 2.700 . 3.600 3.016 3.015 3.019 . 0 0 "[ . 1]" 1
607 1 54 ILE HA 1 54 ILE MD 3.500 . 5.000 3.795 3.783 3.812 . 0 0 "[ . 1]" 1
608 1 54 ILE HA 1 54 ILE HG12 3.200 . 4.500 2.461 2.436 2.492 . 0 0 "[ . 1]" 1
609 1 54 ILE HA 1 54 ILE HG13 2.700 . 3.600 2.978 2.963 3.007 . 0 0 "[ . 1]" 1
610 1 54 ILE HA 1 54 ILE MG 2.400 . 3.100 2.470 2.444 2.485 . 0 0 "[ . 1]" 1
611 1 54 ILE HA 1 55 GLN H 3.700 . 5.400 3.534 3.505 3.550 . 0 0 "[ . 1]" 1
612 1 54 ILE HA 1 57 LYS H 3.400 . 4.800 3.563 3.469 3.666 . 0 0 "[ . 1]" 1
613 1 54 ILE HA 1 57 LYS HB2 3.400 . 4.800 3.448 3.250 3.641 . 0 0 "[ . 1]" 1
614 1 54 ILE HA 1 57 LYS QD 3.900 . 5.800 3.593 3.283 4.087 . 0 0 "[ . 1]" 1
615 1 54 ILE HA 1 57 LYS QG 5.300 . 8.800 4.517 4.343 4.797 . 0 0 "[ . 1]" 1
616 1 54 ILE HA 1 58 GLN H 4.100 . 6.200 4.158 3.950 4.434 . 0 0 "[ . 1]" 1
617 1 54 ILE HB 1 54 ILE MD 2.600 . 3.400 2.454 2.436 2.471 . 0 0 "[ . 1]" 1
618 1 54 ILE HB 1 54 ILE HG12 2.700 . 3.600 3.031 3.029 3.033 . 0 0 "[ . 1]" 1
619 1 54 ILE HB 1 54 ILE MG 1.900 . 2.400 2.126 2.125 2.127 . 0 0 "[ . 1]" 1
620 1 54 ILE HB 1 55 GLN H 2.400 . 3.100 2.611 2.515 2.693 . 0 0 "[ . 1]" 1
621 1 54 ILE MD 1 54 ILE HG12 2.200 . 2.800 2.117 2.117 2.118 . 0 0 "[ . 1]" 1
622 1 54 ILE MD 1 54 ILE HG13 2.200 . 2.800 2.121 2.121 2.122 . 0 0 "[ . 1]" 1
623 1 54 ILE MD 1 54 ILE MG 1.900 . 2.400 1.901 1.887 1.916 . 0 0 "[ . 1]" 1
624 1 54 ILE MD 1 57 LYS HD2 4.600 . 7.200 4.356 3.983 4.683 . 0 0 "[ . 1]" 1
625 1 54 ILE HG12 1 54 ILE MG 3.000 . 4.100 2.402 2.382 2.419 . 0 0 "[ . 1]" 1
626 1 54 ILE HG13 1 54 ILE MG 2.400 . 3.100 3.203 3.199 3.206 0.106 2 0 "[ . 1]" 1
627 1 54 ILE HG13 1 55 GLN H 4.900 . 8.000 4.340 4.282 4.397 . 0 0 "[ . 1]" 1
628 1 54 ILE MG 1 55 GLN H 3.000 . 4.100 3.283 3.233 3.338 . 0 0 "[ . 1]" 1
629 1 54 ILE MG 1 55 GLN HA 3.100 . 4.300 3.227 3.121 3.373 . 0 0 "[ . 1]" 1
630 1 54 ILE MG 1 57 LYS QD 4.300 . 6.600 4.212 3.578 5.095 . 0 0 "[ . 1]" 1
631 1 54 ILE MG 1 58 GLN H 3.400 . 4.900 4.007 3.844 4.290 . 0 0 "[ . 1]" 1
632 1 54 ILE MG 1 58 GLN QB 4.000 . 6.000 3.799 3.243 4.324 . 0 0 "[ . 1]" 1
633 1 54 ILE MG 1 58 GLN HG2 4.000 . 6.000 4.437 3.727 6.005 0.005 6 0 "[ . 1]" 1
634 1 55 GLN H 1 56 LEU H 2.800 . 3.800 2.819 2.769 2.861 . 0 0 "[ . 1]" 1
635 1 55 GLN H 1 56 LEU HB2 4.500 . 7.000 4.134 4.043 4.200 . 0 0 "[ . 1]" 1
636 1 56 LEU H 1 56 LEU HA 2.700 . 3.600 2.774 2.755 2.839 . 0 0 "[ . 1]" 1
637 1 56 LEU H 1 56 LEU HB2 2.900 . 4.000 2.628 2.546 2.690 . 0 0 "[ . 1]" 1
638 1 56 LEU H 1 56 LEU QD 3.000 . 4.100 2.821 2.688 2.986 . 0 0 "[ . 1]" 1
639 1 56 LEU H 1 57 LYS H 2.600 . 3.500 2.775 2.532 2.833 . 0 0 "[ . 1]" 1
640 1 56 LEU H 1 57 LYS HA 4.300 . 6.700 5.352 5.149 5.399 . 0 0 "[ . 1]" 1
641 1 56 LEU H 1 57 LYS QB 3.400 . 4.800 4.523 4.278 4.625 . 0 0 "[ . 1]" 1
642 1 56 LEU H 1 58 GLN H 4.100 . 6.200 4.310 4.075 4.437 . 0 0 "[ . 1]" 1
643 1 56 LEU H 1 59 ALA MB 3.900 . 5.800 4.579 4.444 4.749 . 0 0 "[ . 1]" 1
644 1 56 LEU HA 1 56 LEU QB 3.100 . 4.300 2.341 2.322 2.349 . 0 0 "[ . 1]" 1
645 1 56 LEU HA 1 56 LEU MD2 2.300 . 3.000 2.111 2.087 2.156 . 0 0 "[ . 1]" 1
646 1 56 LEU HA 1 57 LYS H 3.400 . 4.800 3.530 3.515 3.543 . 0 0 "[ . 1]" 1
647 1 56 LEU HA 1 59 ALA H 2.500 . 3.300 2.648 2.611 2.687 . 0 0 "[ . 1]" 1
648 1 56 LEU HB2 1 57 LYS H 3.200 . 4.500 2.679 2.621 2.741 . 0 0 "[ . 1]" 1
649 1 56 LEU HB2 1 57 LYS HB2 4.200 . 6.400 4.377 4.195 4.596 . 0 0 "[ . 1]" 1
650 1 56 LEU HB3 1 56 LEU MD2 3.100 . 4.300 2.412 2.389 2.429 . 0 0 "[ . 1]" 1
651 1 56 LEU QD 1 57 LYS H 3.600 . 5.200 4.088 4.044 4.118 . 0 0 "[ . 1]" 1
652 1 57 LYS H 1 57 LYS HA 2.900 . 3.900 2.809 2.789 2.827 . 0 0 "[ . 1]" 1
653 1 57 LYS H 1 57 LYS QB 2.300 . 3.000 2.249 2.228 2.279 . 0 0 "[ . 1]" 1
654 1 57 LYS H 1 57 LYS QD 4.700 . 7.500 4.520 4.367 4.685 . 0 0 "[ . 1]" 1
655 1 57 LYS H 1 58 GLN H 2.700 . 3.600 2.674 2.606 2.742 . 0 0 "[ . 1]" 1
656 1 57 LYS H 1 58 GLN HG3 4.800 . 7.700 5.515 4.422 7.083 . 0 0 "[ . 1]" 1
657 1 57 LYS HA 1 57 LYS QG 3.600 . 5.200 2.483 2.365 2.558 . 0 0 "[ . 1]" 1
658 1 57 LYS HA 1 58 GLN H 3.700 . 5.400 3.527 3.508 3.537 . 0 0 "[ . 1]" 1
659 1 57 LYS HA 1 59 ALA H 4.100 . 6.200 4.298 4.204 4.471 . 0 0 "[ . 1]" 1
660 1 57 LYS HA 1 60 ILE HB 3.100 . 4.300 2.992 2.832 3.084 . 0 0 "[ . 1]" 1
661 1 57 LYS HA 1 60 ILE MD 2.900 . 3.900 2.704 2.400 2.908 . 0 0 "[ . 1]" 1
662 1 57 LYS HA 1 60 ILE MG 4.100 . 6.200 4.344 4.170 4.436 . 0 0 "[ . 1]" 1
663 1 57 LYS QD 1 97 THR MG 3.600 . 5.200 3.721 3.190 4.740 . 0 0 "[ . 1]" 1
664 1 57 LYS HG2 1 97 THR MG 2.900 . 4.000 3.851 3.270 4.706 0.706 5 1 "[ + 1]" 1
665 1 58 GLN H 1 58 GLN HA 2.700 . 3.600 2.817 2.799 2.864 . 0 0 "[ . 1]" 1
666 1 58 GLN H 1 58 GLN QB 2.600 . 3.500 2.338 2.232 2.429 . 0 0 "[ . 1]" 1
667 1 58 GLN H 1 58 GLN HG2 4.400 . 6.800 3.981 3.531 4.600 . 0 0 "[ . 1]" 1
668 1 58 GLN H 1 59 ALA MB 3.900 . 5.800 4.312 4.140 4.389 . 0 0 "[ . 1]" 1
669 1 58 GLN H 1 60 ILE H 4.200 . 6.400 4.220 4.035 4.305 . 0 0 "[ . 1]" 1
670 1 58 GLN HA 1 61 ASP H 3.100 . 4.300 3.525 3.405 3.687 . 0 0 "[ . 1]" 1
671 1 58 GLN HA 1 61 ASP HB2 3.700 . 5.500 3.456 3.218 3.728 . 0 0 "[ . 1]" 1
672 1 58 GLN HA 1 61 ASP HB2 2.600 . 3.500 2.670 2.604 2.757 . 0 0 "[ . 1]" 1
673 1 59 ALA H 1 59 ALA MB 2.100 . 2.600 2.227 2.215 2.240 . 0 0 "[ . 1]" 1
674 1 59 ALA H 1 60 ILE H 2.700 . 3.600 2.652 2.584 2.700 . 0 0 "[ . 1]" 1
675 1 59 ALA H 1 60 ILE HB 4.400 . 6.800 4.892 4.852 4.965 . 0 0 "[ . 1]" 1
676 1 59 ALA H 1 61 ASP H 4.100 . 6.200 4.089 3.995 4.164 . 0 0 "[ . 1]" 1
677 1 59 ALA H 1 62 GLU HB2 3.800 . 5.600 5.302 5.114 5.481 . 0 0 "[ . 1]" 1
678 1 59 ALA H 1 62 GLU HB3 3.700 . 5.400 5.211 5.096 5.339 . 0 0 "[ . 1]" 1
679 1 59 ALA HA 1 59 ALA MB 2.000 . 2.500 2.126 2.124 2.127 . 0 0 "[ . 1]" 1
680 1 59 ALA HA 1 62 GLU HB3 2.800 . 3.800 2.703 2.573 2.815 . 0 0 "[ . 1]" 1
681 1 59 ALA HA 1 62 GLU HG2 4.600 . 7.200 4.478 4.025 4.964 . 0 0 "[ . 1]" 1
682 1 59 ALA HA 1 62 GLU HG3 4.200 . 6.400 5.129 4.936 5.324 . 0 0 "[ . 1]" 1
683 1 59 ALA MB 1 60 ILE H 2.800 . 3.800 2.530 2.460 2.580 . 0 0 "[ . 1]" 1
684 1 59 ALA MB 1 60 ILE HA 3.900 . 5.800 3.855 3.819 3.882 . 0 0 "[ . 1]" 1
685 1 59 ALA MB 1 61 ASP H 4.100 . 6.200 4.525 4.483 4.581 . 0 0 "[ . 1]" 1
686 1 59 ALA MB 1 62 GLU HB3 3.900 . 5.800 3.959 3.901 4.093 . 0 0 "[ . 1]" 1
687 1 59 ALA MB 1 62 GLU HG3 5.100 . 8.300 5.987 5.663 6.381 . 0 0 "[ . 1]" 1
688 1 60 ILE H 1 60 ILE HA 2.900 . 4.000 2.831 2.820 2.842 . 0 0 "[ . 1]" 1
689 1 60 ILE HA 1 60 ILE MD 4.100 . 6.200 3.837 3.812 3.857 . 0 0 "[ . 1]" 1
690 1 60 ILE HA 1 60 ILE MG 2.400 . 3.100 2.405 2.381 2.443 . 0 0 "[ . 1]" 1
691 1 60 ILE HA 1 63 ASN H 3.400 . 4.800 3.362 3.204 3.420 . 0 0 "[ . 1]" 1
692 1 60 ILE HA 1 63 ASN HA 5.500 . 9.300 5.505 5.317 5.686 . 0 0 "[ . 1]" 1
693 1 60 ILE HA 1 64 LYS H 4.400 . 6.900 4.042 3.840 4.162 . 0 0 "[ . 1]" 1
694 1 60 ILE HB 1 60 ILE MD 2.500 . 3.300 2.409 2.381 2.428 . 0 0 "[ . 1]" 1
695 1 60 ILE HB 1 61 ASP HB3 5.800 . 10.000 4.791 4.713 4.891 . 0 0 "[ . 1]" 1
696 1 60 ILE MD 1 60 ILE MG 2.100 . 2.700 1.971 1.956 1.987 . 0 0 "[ . 1]" 1
697 1 60 ILE MD 1 96 LEU HB3 2.700 . 3.600 2.298 1.933 2.700 . 0 0 "[ . 1]" 1
698 1 60 ILE MD 1 97 THR H 3.500 . 5.000 3.187 2.998 3.318 . 0 0 "[ . 1]" 1
699 1 60 ILE MD 1 97 THR HA 2.900 . 4.000 2.829 2.722 2.928 . 0 0 "[ . 1]" 1
700 1 60 ILE MD 1 97 THR MG 3.500 . 5.000 3.857 3.561 4.059 . 0 0 "[ . 1]" 1
701 1 60 ILE MD 1 100 LEU HB2 2.500 . 6.000 3.841 3.611 4.306 . 0 0 "[ . 1]" 1
702 1 60 ILE QG 1 61 ASP H 4.200 . 6.400 3.970 3.935 4.023 . 0 0 "[ . 1]" 1
703 1 60 ILE QG 1 62 GLU HB3 5.600 . 9.500 6.131 6.035 6.270 . 0 0 "[ . 1]" 1
704 1 60 ILE MG 1 61 ASP HA 3.900 . 5.800 3.486 3.386 3.611 . 0 0 "[ . 1]" 1
705 1 60 ILE MG 1 64 LYS H 3.200 . 4.500 3.783 3.719 3.848 . 0 0 "[ . 1]" 1
706 1 60 ILE MG 1 93 LEU HA 3.600 . 5.200 3.001 2.699 3.256 . 0 0 "[ . 1]" 1
707 1 60 ILE MG 1 97 THR HA 4.000 . 6.000 3.655 3.418 4.131 . 0 0 "[ . 1]" 1
708 1 60 ILE MG 1 97 THR HB 5.000 . 8.200 4.152 4.017 4.220 . 0 0 "[ . 1]" 1
709 1 60 ILE MG 1 97 THR MG 3.200 . 4.500 3.709 3.604 3.912 . 0 0 "[ . 1]" 1
710 1 61 ASP H 1 61 ASP HA 3.000 . 4.100 2.813 2.804 2.831 . 0 0 "[ . 1]" 1
711 1 61 ASP H 1 61 ASP HB2 2.700 . 3.600 2.526 2.472 2.585 . 0 0 "[ . 1]" 1
712 1 61 ASP H 1 61 ASP HB3 3.000 . 4.100 2.556 2.470 2.631 . 0 0 "[ . 1]" 1
713 1 61 ASP H 1 62 GLU H 2.600 . 3.500 2.632 2.585 2.663 . 0 0 "[ . 1]" 1
714 1 61 ASP HA 1 64 LYS H 3.500 . 5.000 3.374 3.230 3.510 . 0 0 "[ . 1]" 1
715 1 61 ASP HA 1 64 LYS HB2 2.500 . 3.300 3.126 2.738 3.361 0.061 7 0 "[ . 1]" 1
716 1 61 ASP HA 1 64 LYS QD 3.200 . 4.500 3.150 2.958 3.466 . 0 0 "[ . 1]" 1
717 1 61 ASP HB2 1 62 GLU H 3.800 . 5.600 3.880 3.843 3.949 . 0 0 "[ . 1]" 1
718 1 61 ASP HB3 1 62 GLU H 2.800 . 3.800 2.648 2.563 2.706 . 0 0 "[ . 1]" 1
719 1 61 ASP HB3 1 62 GLU HA 3.700 . 5.400 4.267 4.191 4.356 . 0 0 "[ . 1]" 1
720 1 61 ASP HB3 1 64 LYS H 5.000 . 8.100 5.511 5.374 5.622 . 0 0 "[ . 1]" 1
721 1 61 ASP HB3 1 64 LYS QD 5.700 . 9.800 5.554 5.300 5.856 . 0 0 "[ . 1]" 1
722 1 62 GLU H 1 62 GLU HA 2.600 . 3.400 2.800 2.792 2.806 . 0 0 "[ . 1]" 1
723 1 62 GLU H 1 62 GLU HB2 2.600 . 3.400 2.524 2.455 2.594 . 0 0 "[ . 1]" 1
724 1 62 GLU H 1 62 GLU HB3 2.500 . 3.300 2.487 2.420 2.570 . 0 0 "[ . 1]" 1
725 1 62 GLU H 1 64 LYS H 4.300 . 6.600 4.052 3.955 4.118 . 0 0 "[ . 1]" 1
726 1 62 GLU HA 1 62 GLU HB3 3.000 . 4.100 3.024 3.021 3.027 . 0 0 "[ . 1]" 1
727 1 62 GLU HA 1 62 GLU HG3 2.700 . 3.600 2.838 2.535 3.149 . 0 0 "[ . 1]" 1
728 1 62 GLU HA 1 64 LYS H 4.400 . 6.800 4.521 4.400 4.598 . 0 0 "[ . 1]" 1
729 1 62 GLU HA 1 65 ASN HB2 2.900 . 3.900 2.791 2.670 2.932 . 0 0 "[ . 1]" 1
730 1 62 GLU HA 1 65 ASN HB3 3.800 . 5.600 4.398 4.273 4.535 . 0 0 "[ . 1]" 1
731 1 62 GLU HB2 1 63 ASN H 3.800 . 5.600 3.477 3.287 3.653 . 0 0 "[ . 1]" 1
732 1 62 GLU HB2 1 65 ASN HB2 4.700 . 7.400 5.208 5.052 5.403 . 0 0 "[ . 1]" 1
733 1 62 GLU HB2 1 65 ASN HB3 5.800 . 10.000 6.747 6.590 6.950 . 0 0 "[ . 1]" 1
734 1 62 GLU HG3 1 64 LYS H 5.000 . 8.200 5.979 5.550 6.496 . 0 0 "[ . 1]" 1
735 1 62 GLU HG3 1 65 ASN HB3 5.000 . 8.100 5.898 5.384 6.274 . 0 0 "[ . 1]" 1
736 1 63 ASN H 1 63 ASN HA 2.800 . 3.800 2.829 2.816 2.854 . 0 0 "[ . 1]" 1
737 1 63 ASN H 1 63 ASN HB3 2.600 . 3.400 3.582 3.564 3.610 0.210 6 0 "[ . 1]" 1
738 1 63 ASN H 1 64 LYS H 2.600 . 3.400 2.631 2.556 2.677 . 0 0 "[ . 1]" 1
739 1 63 ASN H 1 65 ASN H 2.900 . 4.000 4.133 4.050 4.256 0.256 4 0 "[ . 1]" 1
740 1 63 ASN HA 1 63 ASN HD21 4.300 . 6.600 4.090 3.627 4.412 . 0 0 "[ . 1]" 1
741 1 63 ASN HA 1 63 ASN HD22 4.200 . 6.400 4.396 4.132 4.581 . 0 0 "[ . 1]" 1
742 1 63 ASN HA 1 64 LYS H 3.700 . 5.400 3.533 3.520 3.548 . 0 0 "[ . 1]" 1
743 1 63 ASN HA 1 66 ALA MB 2.300 . 3.000 2.404 2.298 2.604 . 0 0 "[ . 1]" 1
744 1 63 ASN QB 1 63 ASN HD21 3.800 . 5.600 2.196 2.173 2.293 . 0 0 "[ . 1]" 1
745 1 63 ASN QB 1 63 ASN HD22 2.700 . 3.600 3.225 3.205 3.325 . 0 0 "[ . 1]" 1
746 1 63 ASN HB3 1 64 LYS H 2.900 . 4.000 3.483 3.366 3.663 . 0 0 "[ . 1]" 1
747 1 64 LYS H 1 64 LYS HA 3.000 . 4.100 2.789 2.765 2.808 . 0 0 "[ . 1]" 1
748 1 64 LYS H 1 64 LYS QB 2.500 . 3.300 2.229 2.199 2.244 . 0 0 "[ . 1]" 1
749 1 64 LYS H 1 64 LYS QD 4.200 . 6.400 4.410 4.319 4.741 . 0 0 "[ . 1]" 1
750 1 64 LYS H 1 64 LYS QG 4.600 . 7.200 3.965 3.938 3.978 . 0 0 "[ . 1]" 1
751 1 64 LYS H 1 65 ASN H 2.700 . 3.600 2.761 2.675 2.827 . 0 0 "[ . 1]" 1
752 1 64 LYS HA 1 90 HIS HE1 4.900 . 7.900 5.448 4.909 5.957 . 0 0 "[ . 1]" 1
753 1 64 LYS QB 1 90 HIS HE1 5.900 . 10.200 5.847 5.337 6.508 . 0 0 "[ . 1]" 1
754 1 64 LYS HB2 1 64 LYS QE 4.400 . 6.800 3.640 2.006 4.222 . 0 0 "[ . 1]" 1
755 1 64 LYS HB2 1 65 ASN H 2.700 . 3.600 3.837 3.757 3.865 0.265 3 0 "[ . 1]" 1
756 1 64 LYS QE 1 64 LYS QG 3.600 . 5.200 2.261 2.138 2.696 . 0 0 "[ . 1]" 1
757 1 64 LYS HG3 1 90 HIS HE1 4.600 . 7.300 4.097 3.599 4.924 . 0 0 "[ . 1]" 1
758 1 65 ASN H 1 65 ASN HA 2.900 . 3.900 2.834 2.819 2.846 . 0 0 "[ . 1]" 1
759 1 65 ASN H 1 65 ASN HB2 2.400 . 3.100 2.329 2.268 2.419 . 0 0 "[ . 1]" 1
760 1 65 ASN H 1 65 ASN HB3 3.500 . 5.000 3.569 3.547 3.592 . 0 0 "[ . 1]" 1
761 1 65 ASN H 1 66 ALA H 2.600 . 3.500 2.611 2.577 2.663 . 0 0 "[ . 1]" 1
762 1 65 ASN H 1 66 ALA MB 4.000 . 6.000 4.282 4.253 4.320 . 0 0 "[ . 1]" 1
763 1 65 ASN HA 1 65 ASN HB2 2.900 . 4.000 3.007 2.991 3.020 . 0 0 "[ . 1]" 1
764 1 65 ASN HA 1 65 ASN HB3 2.500 . 3.300 2.582 2.523 2.623 . 0 0 "[ . 1]" 1
765 1 65 ASN HA 1 66 ALA H 3.200 . 4.500 3.524 3.513 3.544 . 0 0 "[ . 1]" 1
766 1 65 ASN HA 1 68 GLN H 3.200 . 4.500 3.416 3.287 3.514 . 0 0 "[ . 1]" 1
767 1 65 ASN HA 1 68 GLN HB2 2.700 . 3.600 3.411 2.947 3.741 0.141 4 0 "[ . 1]" 1
768 1 65 ASN HA 1 69 LYS H 4.000 . 6.000 4.262 3.930 4.527 . 0 0 "[ . 1]" 1
769 1 65 ASN QB 1 66 ALA MB 4.700 . 7.400 3.895 3.798 3.972 . 0 0 "[ . 1]" 1
770 1 65 ASN HB2 1 66 ALA MB 4.400 . 6.900 4.178 4.059 4.301 . 0 0 "[ . 1]" 1
771 1 65 ASN HB3 1 66 ALA H 3.500 . 5.000 3.503 3.284 3.652 . 0 0 "[ . 1]" 1
772 1 65 ASN HB3 1 66 ALA HA 3.800 . 5.600 4.274 4.095 4.415 . 0 0 "[ . 1]" 1
773 1 66 ALA H 1 66 ALA HA 2.600 . 3.500 2.813 2.796 2.830 . 0 0 "[ . 1]" 1
774 1 66 ALA H 1 66 ALA MB 2.100 . 2.600 2.237 2.232 2.243 . 0 0 "[ . 1]" 1
775 1 66 ALA HA 1 66 ALA MB 1.900 . 2.300 1.897 1.895 1.898 . 0 0 "[ . 1]" 1
776 1 66 ALA HA 1 69 LYS H 3.400 . 4.800 3.491 3.374 3.599 . 0 0 "[ . 1]" 1
777 1 66 ALA HA 1 69 LYS HB2 3.100 . 4.300 3.583 3.201 4.018 . 0 0 "[ . 1]" 1
778 1 66 ALA HA 1 69 LYS HB3 3.000 . 4.100 2.657 2.445 2.825 . 0 0 "[ . 1]" 1
779 1 67 LEU H 1 67 LEU HA 2.700 . 3.600 2.811 2.794 2.830 . 0 0 "[ . 1]" 1
780 1 67 LEU H 1 67 LEU HB2 2.300 . 3.000 2.515 2.444 2.565 . 0 0 "[ . 1]" 1
781 1 67 LEU H 1 67 LEU HB3 2.400 . 3.100 2.463 2.425 2.496 . 0 0 "[ . 1]" 1
782 1 67 LEU H 1 67 LEU QD 3.800 . 5.600 3.702 3.671 3.719 . 0 0 "[ . 1]" 1
783 1 67 LEU H 1 68 GLN H 2.800 . 3.800 2.688 2.624 2.736 . 0 0 "[ . 1]" 1
784 1 67 LEU H 1 69 LYS H 4.100 . 6.200 3.976 3.856 4.095 . 0 0 "[ . 1]" 1
785 1 67 LEU HA 1 67 LEU MD1 2.500 . 3.300 2.125 2.094 2.156 . 0 0 "[ . 1]" 1
786 1 67 LEU HA 1 67 LEU MD2 3.500 . 5.100 3.854 3.816 3.884 . 0 0 "[ . 1]" 1
787 1 67 LEU HA 1 67 LEU HG 3.100 . 4.300 3.222 3.157 3.292 . 0 0 "[ . 1]" 1
788 1 67 LEU HA 1 68 GLN H 3.400 . 4.900 3.541 3.457 3.564 . 0 0 "[ . 1]" 1
789 1 67 LEU HA 1 69 LYS H 4.000 . 6.000 4.073 3.929 4.231 . 0 0 "[ . 1]" 1
790 1 67 LEU HA 1 70 LEU H 3.400 . 4.900 3.298 2.996 3.471 . 0 0 "[ . 1]" 1
791 1 67 LEU HB2 1 67 LEU MD1 2.300 . 2.900 2.391 2.361 2.435 . 0 0 "[ . 1]" 1
792 1 67 LEU HB2 1 68 GLN H 3.500 . 5.000 3.394 3.292 3.629 . 0 0 "[ . 1]" 1
793 1 67 LEU HB3 1 67 LEU MD1 3.100 . 4.300 3.203 3.199 3.206 . 0 0 "[ . 1]" 1
794 1 67 LEU HB3 1 67 LEU MD2 2.400 . 3.100 2.351 2.316 2.385 . 0 0 "[ . 1]" 1
795 1 67 LEU HB3 1 68 GLN H 2.700 . 3.600 2.587 2.497 2.921 . 0 0 "[ . 1]" 1
796 1 67 LEU HB3 1 90 HIS HE1 4.800 . 7.700 5.012 4.642 5.393 . 0 0 "[ . 1]" 1
797 1 67 LEU QD 1 68 GLN H 4.200 . 6.400 3.895 3.796 4.104 . 0 0 "[ . 1]" 1
798 1 67 LEU MD1 1 68 GLN HA 4.100 . 6.200 4.634 4.425 4.816 . 0 0 "[ . 1]" 1
799 1 67 LEU MD1 1 86 LYS HA 3.400 . 4.800 3.350 2.840 4.044 . 0 0 "[ . 1]" 1
800 1 67 LEU MD1 1 86 LYS HG2 2.900 . 3.900 3.979 3.448 4.498 0.598 7 1 "[ . + 1]" 1
801 1 67 LEU MD1 1 86 LYS HG3 3.900 . 5.800 2.666 2.431 3.009 . 0 0 "[ . 1]" 1
802 1 67 LEU MD2 1 67 LEU HG 2.000 . 2.500 2.125 2.124 2.126 . 0 0 "[ . 1]" 1
803 1 67 LEU MD2 1 68 GLN HA 4.000 . 6.000 4.910 4.674 5.032 . 0 0 "[ . 1]" 1
804 1 67 LEU MD2 1 86 LYS HA 3.900 . 5.800 3.641 3.235 4.436 . 0 0 "[ . 1]" 1
805 1 67 LEU MD2 1 86 LYS HB2 4.700 . 7.400 5.005 4.625 5.498 . 0 0 "[ . 1]" 1
806 1 67 LEU MD2 1 86 LYS HB3 5.000 . 8.100 5.445 5.200 5.885 . 0 0 "[ . 1]" 1
807 1 67 LEU MD2 1 86 LYS HG2 3.400 . 4.800 3.905 3.513 4.364 . 0 0 "[ . 1]" 1
808 1 67 LEU MD2 1 86 LYS HG3 3.900 . 5.800 3.374 3.099 3.794 . 0 0 "[ . 1]" 1
809 1 67 LEU MD2 1 90 HIS H 3.300 . 4.600 3.304 3.074 3.701 . 0 0 "[ . 1]" 1
810 1 67 LEU MD2 1 90 HIS HA 2.900 . 3.900 3.335 2.879 3.968 0.068 7 0 "[ . 1]" 1
811 1 67 LEU MD2 1 90 HIS HB2 4.300 . 6.600 4.303 4.002 4.708 . 0 0 "[ . 1]" 1
812 1 67 LEU MD2 1 90 HIS HB3 4.500 . 7.000 4.781 4.471 5.195 . 0 0 "[ . 1]" 1
813 1 67 LEU MD2 1 90 HIS HD2 3.200 . 4.500 2.444 2.074 2.649 . 0 0 "[ . 1]" 1
814 1 67 LEU MD2 1 90 HIS HE1 5.000 . 8.100 4.178 3.936 4.395 . 0 0 "[ . 1]" 1
815 1 67 LEU HG 1 90 HIS HD2 4.500 . 7.000 3.708 3.439 4.192 . 0 0 "[ . 1]" 1
816 1 67 LEU HG 1 90 HIS HE1 5.100 . 8.400 4.673 4.167 5.089 . 0 0 "[ . 1]" 1
817 1 68 GLN H 1 68 GLN HA 2.900 . 3.900 2.813 2.771 2.884 . 0 0 "[ . 1]" 1
818 1 68 GLN H 1 68 GLN QB 2.400 . 3.100 2.240 2.209 2.301 . 0 0 "[ . 1]" 1
819 1 68 GLN H 1 68 GLN QG 4.400 . 6.800 3.974 3.948 4.044 . 0 0 "[ . 1]" 1
820 1 68 GLN H 1 69 LYS H 2.600 . 3.400 2.628 2.358 2.771 . 0 0 "[ . 1]" 1
821 1 68 GLN H 1 70 LEU H 4.600 . 7.200 3.964 3.712 4.126 . 0 0 "[ . 1]" 1
822 1 68 GLN HA 1 68 GLN HG3 2.600 . 3.400 2.565 2.449 2.930 . 0 0 "[ . 1]" 1
823 1 68 GLN HA 1 90 HIS HE1 4.900 . 7.800 4.327 3.709 4.900 . 0 0 "[ . 1]" 1
824 1 68 GLN HB2 1 69 LYS H 3.000 . 4.200 3.993 3.945 4.047 . 0 0 "[ . 1]" 1
825 1 68 GLN HB2 1 90 HIS HE1 5.900 . 10.200 3.740 3.308 3.987 . 0 0 "[ . 1]" 1
826 1 68 GLN HB3 1 69 LYS HA 3.500 . 6.000 4.350 4.222 4.463 . 0 0 "[ . 1]" 1
827 1 68 GLN HG2 1 69 LYS H 4.500 . 7.000 4.252 3.956 5.052 . 0 0 "[ . 1]" 1
828 1 68 GLN HG2 1 90 HIS HE1 5.500 . 9.300 5.703 4.958 6.218 . 0 0 "[ . 1]" 1
829 1 68 GLN HG3 1 90 HIS HE1 4.200 . 6.400 4.338 3.825 5.517 . 0 0 "[ . 1]" 1
830 1 69 LYS H 1 69 LYS HA 2.800 . 3.800 2.886 2.863 2.915 . 0 0 "[ . 1]" 1
831 1 69 LYS H 1 69 LYS HB2 2.500 . 3.300 2.583 2.512 2.670 . 0 0 "[ . 1]" 1
832 1 69 LYS H 1 69 LYS HB3 2.700 . 3.600 2.560 2.499 2.626 . 0 0 "[ . 1]" 1
833 1 69 LYS H 1 69 LYS QD 4.100 . 6.200 4.346 4.110 4.685 . 0 0 "[ . 1]" 1
834 1 69 LYS HA 1 69 LYS HE2 5.100 . 8.400 5.204 4.380 6.166 . 0 0 "[ . 1]" 1
835 1 69 LYS HA 1 69 LYS HG2 2.900 . 4.000 3.336 2.939 3.760 . 0 0 "[ . 1]" 1
836 1 69 LYS HA 1 69 LYS HG3 3.200 . 4.500 2.757 2.516 3.126 . 0 0 "[ . 1]" 1
837 1 69 LYS HB2 1 70 LEU H 2.500 . 3.300 2.460 2.252 2.677 . 0 0 "[ . 1]" 1
838 1 69 LYS HE3 1 69 LYS HG3 3.200 . 4.400 3.081 2.496 3.707 . 0 0 "[ . 1]" 1
839 1 70 LEU H 1 70 LEU HA 2.800 . 3.800 2.889 2.827 2.939 . 0 0 "[ . 1]" 1
840 1 70 LEU H 1 70 LEU MD2 3.100 . 4.300 3.689 2.585 4.296 . 0 0 "[ . 1]" 1
841 1 70 LEU H 1 71 SER H 3.700 . 5.400 3.526 2.845 4.566 . 0 0 "[ . 1]" 1
842 1 70 LEU QD 1 70 LEU HG 2.000 . 2.500 1.894 1.892 1.896 . 0 0 "[ . 1]" 1
843 1 70 LEU MD2 1 70 LEU HG 2.000 . 2.500 2.126 2.123 2.129 . 0 0 "[ . 1]" 1
844 1 71 SER HA 1 71 SER HB3 3.000 . 4.100 2.638 2.451 3.035 . 0 0 "[ . 1]" 1
845 1 71 SER HA 1 72 LYS H 2.700 . 3.600 2.426 2.166 2.968 . 0 0 "[ . 1]" 1
846 1 71 SER HB3 1 72 LYS H 5.000 . 8.200 3.901 2.803 4.484 . 0 0 "[ . 1]" 1
847 1 71 SER HB3 1 73 ALA MB 5.100 . 8.400 4.854 3.455 6.468 . 0 0 "[ . 1]" 1
848 1 72 LYS H 1 72 LYS HB3 3.200 . 4.500 3.275 2.639 4.030 . 0 0 "[ . 1]" 1
849 1 72 LYS HA 1 72 LYS QD 5.100 . 8.300 4.151 3.979 4.286 . 0 0 "[ . 1]" 1
850 1 72 LYS HA 1 72 LYS QE 5.500 . 9.300 5.245 4.764 5.722 . 0 0 "[ . 1]" 1
851 1 72 LYS HA 1 72 LYS HG2 3.600 . 5.300 3.183 2.527 3.806 . 0 0 "[ . 1]" 1
852 1 72 LYS HA 1 72 LYS HG3 3.800 . 5.600 3.427 2.512 3.840 . 0 0 "[ . 1]" 1
853 1 72 LYS HA 1 73 ALA H 2.900 . 4.000 2.451 2.133 3.134 . 0 0 "[ . 1]" 1
854 1 72 LYS HA 1 74 ASP H 4.300 . 6.600 3.482 2.993 4.114 . 0 0 "[ . 1]" 1
855 1 72 LYS HB3 1 73 ALA H 3.600 . 5.200 4.236 3.677 4.616 . 0 0 "[ . 1]" 1
856 1 72 LYS QD 1 72 LYS QE 2.100 . 2.600 2.036 1.990 2.091 . 0 0 "[ . 1]" 1
857 1 72 LYS QE 1 72 LYS HG2 2.900 . 3.900 2.680 2.405 3.077 . 0 0 "[ . 1]" 1
858 1 72 LYS HE2 1 72 LYS HG3 2.500 . 3.300 2.948 2.480 3.710 0.410 9 0 "[ . 1]" 1
859 1 72 LYS HG2 1 73 ALA H 6.200 . 11.000 5.067 4.773 5.294 . 0 0 "[ . 1]" 1
860 1 72 LYS HG3 1 73 ALA H 5.400 . 9.000 4.915 4.305 5.375 . 0 0 "[ . 1]" 1
861 1 73 ALA H 1 73 ALA HA 2.700 . 3.600 2.848 2.788 2.874 . 0 0 "[ . 1]" 1
862 1 73 ALA H 1 73 ALA MB 2.000 . 2.500 2.240 2.204 2.258 . 0 0 "[ . 1]" 1
863 1 73 ALA H 1 74 ASP H 2.700 . 3.600 2.540 2.441 2.766 . 0 0 "[ . 1]" 1
864 1 73 ALA HA 1 73 ALA MB 2.000 . 2.500 2.123 2.118 2.126 . 0 0 "[ . 1]" 1
865 1 73 ALA HA 1 74 ASP HA 4.200 . 6.400 4.674 4.559 4.757 . 0 0 "[ . 1]" 1
866 1 73 ALA MB 1 74 ASP H 2.900 . 3.900 2.945 2.821 3.199 . 0 0 "[ . 1]" 1
867 1 73 ALA MB 1 74 ASP HA 3.900 . 5.800 3.933 3.867 4.041 . 0 0 "[ . 1]" 1
868 1 73 ALA MB 1 74 ASP HB2 4.400 . 6.800 4.621 3.779 5.551 . 0 0 "[ . 1]" 1
869 1 73 ALA MB 1 74 ASP HB3 4.400 . 6.800 4.936 4.133 5.552 . 0 0 "[ . 1]" 1
870 1 74 ASP H 1 74 ASP HB2 3.000 . 4.100 2.801 2.402 3.633 . 0 0 "[ . 1]" 1
871 1 74 ASP H 1 74 ASP HB3 3.000 . 4.100 3.008 2.519 3.654 . 0 0 "[ . 1]" 1
872 1 74 ASP HA 1 74 ASP HB2 3.000 . 4.100 2.694 2.429 3.030 . 0 0 "[ . 1]" 1
873 1 74 ASP HA 1 74 ASP HB3 3.000 . 4.100 2.708 2.474 3.032 . 0 0 "[ . 1]" 1
874 1 75 GLU H 1 76 SER H 4.600 . 7.200 3.648 2.308 4.563 . 0 0 "[ . 1]" 1
875 1 75 GLU QB 1 77 ALA H 6.100 . 10.800 5.336 3.423 6.581 . 0 0 "[ . 1]" 1
876 1 76 SER H 1 76 SER QB 3.300 . 4.600 2.776 2.284 2.989 . 0 0 "[ . 1]" 1
877 1 76 SER HA 1 76 SER QB 2.300 . 3.000 2.329 2.176 2.417 . 0 0 "[ . 1]" 1
878 1 76 SER HA 1 77 ALA H 3.100 . 4.300 2.573 2.138 3.565 . 0 0 "[ . 1]" 1
879 1 76 SER HA 1 77 ALA HA 4.700 . 7.500 4.512 4.341 4.785 . 0 0 "[ . 1]" 1
880 1 76 SER HA 1 78 PRO HD2 5.200 . 8.500 5.182 2.902 6.878 . 0 0 "[ . 1]" 1
881 1 76 SER QB 1 77 ALA H 3.200 . 4.500 3.563 2.858 3.945 . 0 0 "[ . 1]" 1
882 1 77 ALA H 1 77 ALA HA 2.800 . 3.700 2.826 2.268 2.944 . 0 0 "[ . 1]" 1
883 1 77 ALA H 1 77 ALA MB 2.300 . 3.000 2.447 2.239 2.895 . 0 0 "[ . 1]" 1
884 1 77 ALA H 1 78 PRO HD2 3.500 . 5.000 3.654 1.797 5.178 0.203 5 0 "[ . 1]" 1
885 1 77 ALA HA 1 77 ALA MB 1.900 . 2.400 2.124 2.116 2.132 . 0 0 "[ . 1]" 1
886 1 77 ALA HA 1 78 PRO HG2 6.000 . 10.500 5.074 4.344 6.178 . 0 0 "[ . 1]" 1
887 1 77 ALA HA 1 78 PRO HG3 5.700 . 9.800 5.012 4.135 6.177 . 0 0 "[ . 1]" 1
888 1 77 ALA MB 1 78 PRO HD3 4.100 . 6.200 3.047 1.863 4.028 0.137 4 0 "[ . 1]" 1
889 1 78 PRO HA 1 78 PRO HB3 2.800 . 3.800 2.308 2.276 2.326 . 0 0 "[ . 1]" 1
890 1 78 PRO HA 1 78 PRO HB3 3.000 . 4.100 2.060 2.047 2.070 . 0 0 "[ . 1]" 1
891 1 78 PRO HA 1 78 PRO HD2 4.200 . 6.400 3.582 3.545 3.647 . 0 0 "[ . 1]" 1
892 1 78 PRO HA 1 78 PRO HD3 4.500 . 7.100 3.396 3.264 3.483 . 0 0 "[ . 1]" 1
893 1 78 PRO HA 1 79 VAL QG 3.900 . 5.800 3.962 3.458 4.276 . 0 0 "[ . 1]" 1
894 1 78 PRO HA 1 79 VAL MG2 4.600 . 7.200 4.226 3.815 5.007 . 0 0 "[ . 1]" 1
895 1 78 PRO HD2 1 78 PRO HD3 1.400 . 1.600 1.580 1.578 1.582 . 0 0 "[ . 1]" 1
896 1 78 PRO HD2 1 78 PRO HG2 2.500 . 3.300 2.306 2.268 2.332 . 0 0 "[ . 1]" 1
897 1 78 PRO HD3 1 78 PRO QG 2.600 . 3.400 2.204 2.183 2.238 . 0 0 "[ . 1]" 1
898 1 79 VAL H 1 79 VAL HA 2.700 . 3.600 2.883 2.793 2.941 . 0 0 "[ . 1]" 1
899 1 79 VAL H 1 79 VAL MG2 2.200 . 2.800 2.133 1.956 2.586 . 0 0 "[ . 1]" 1
900 1 79 VAL H 1 80 ALA H 3.100 . 4.300 3.230 2.618 4.598 0.298 10 0 "[ . 1]" 1
901 1 79 VAL HA 1 79 VAL HB 2.500 . 3.300 2.764 2.440 3.019 . 0 0 "[ . 1]" 1
902 1 79 VAL HA 1 79 VAL MG1 2.500 . 3.300 2.333 2.248 2.402 . 0 0 "[ . 1]" 1
903 1 79 VAL HA 1 79 VAL QG 2.000 . 2.500 2.185 2.125 2.292 . 0 0 "[ . 1]" 1
904 1 79 VAL HA 1 82 TYR QD 5.700 . 9.800 6.198 4.476 7.330 . 0 0 "[ . 1]" 1
905 1 79 VAL HB 1 79 VAL QG 1.800 . 2.200 1.894 1.892 1.898 . 0 0 "[ . 1]" 1
906 1 79 VAL HB 1 79 VAL MG2 1.900 . 2.400 2.126 2.121 2.130 . 0 0 "[ . 1]" 1
907 1 79 VAL HB 1 80 ALA MB 4.800 . 7.700 4.471 3.542 5.553 . 0 0 "[ . 1]" 1
908 1 79 VAL HB 1 81 ASN H 4.500 . 7.000 4.413 3.660 5.360 . 0 0 "[ . 1]" 1
909 1 79 VAL HB 1 82 TYR HB2 4.200 . 6.400 3.900 2.317 6.080 . 0 0 "[ . 1]" 1
910 1 79 VAL HB 1 82 TYR QD 5.000 . 8.100 5.043 3.916 6.452 . 0 0 "[ . 1]" 1
911 1 79 VAL QG 1 80 ALA H 3.100 . 4.300 3.199 2.704 3.754 . 0 0 "[ . 1]" 1
912 1 79 VAL QG 1 80 ALA HA 4.400 . 6.800 4.036 3.609 4.287 . 0 0 "[ . 1]" 1
913 1 79 VAL QG 1 81 ASN H 4.000 . 6.000 4.171 3.701 4.787 . 0 0 "[ . 1]" 1
914 1 79 VAL QG 1 82 TYR H 3.700 . 5.400 4.209 3.587 4.598 . 0 0 "[ . 1]" 1
915 1 79 VAL QG 1 82 TYR HB2 4.400 . 6.800 3.954 2.905 4.652 . 0 0 "[ . 1]" 1
916 1 79 VAL QG 1 82 TYR HB3 4.100 . 6.200 3.741 2.328 4.715 . 0 0 "[ . 1]" 1
917 1 79 VAL QG 1 82 TYR QD 4.100 . 6.200 4.373 3.255 5.476 . 0 0 "[ . 1]" 1
918 1 79 VAL MG2 1 80 ALA MB 3.500 . 5.100 4.491 2.948 5.021 . 0 0 "[ . 1]" 1
919 1 80 ALA H 1 80 ALA HA 2.200 . 2.800 2.715 2.256 2.898 0.098 3 0 "[ . 1]" 1
920 1 80 ALA H 1 80 ALA MB 2.300 . 3.000 2.560 2.215 2.968 . 0 0 "[ . 1]" 1
921 1 80 ALA HA 1 80 ALA MB 1.800 . 2.200 2.121 2.113 2.125 . 0 0 "[ . 1]" 1
922 1 80 ALA HA 1 81 ASN H 2.600 . 3.400 3.544 3.490 3.575 0.175 9 0 "[ . 1]" 1
923 1 80 ALA HA 1 81 ASN QB 4.700 . 7.500 5.419 5.229 5.521 . 0 0 "[ . 1]" 1
924 1 80 ALA MB 1 81 ASN H 2.400 . 3.100 2.274 1.885 2.676 . 0 0 "[ . 1]" 1
925 1 80 ALA MB 1 81 ASN HA 4.300 . 6.600 3.793 3.727 3.903 . 0 0 "[ . 1]" 1
926 1 80 ALA MB 1 81 ASN QB 4.400 . 6.900 3.938 3.496 4.364 . 0 0 "[ . 1]" 1
927 1 81 ASN H 1 81 ASN HA 2.700 . 3.600 2.828 2.793 2.874 . 0 0 "[ . 1]" 1
928 1 81 ASN H 1 81 ASN QB 3.100 . 4.300 2.427 2.281 2.632 . 0 0 "[ . 1]" 1
929 1 81 ASN H 1 82 TYR H 3.000 . 4.100 2.631 2.453 2.744 . 0 0 "[ . 1]" 1
930 1 81 ASN HA 1 81 ASN QB 3.100 . 4.300 2.360 2.184 2.445 . 0 0 "[ . 1]" 1
931 1 81 ASN HA 1 82 TYR H 3.200 . 4.500 3.498 3.393 3.557 . 0 0 "[ . 1]" 1
932 1 81 ASN HA 1 83 ASN H 4.100 . 6.200 4.247 3.823 4.661 . 0 0 "[ . 1]" 1
933 1 81 ASN QB 1 84 GLN QB 4.100 . 6.200 4.139 3.530 4.753 . 0 0 "[ . 1]" 1
934 1 82 TYR H 1 82 TYR HB2 2.900 . 4.000 2.397 2.282 2.543 . 0 0 "[ . 1]" 1
935 1 82 TYR H 1 82 TYR HB3 2.500 . 3.300 2.674 2.520 2.845 . 0 0 "[ . 1]" 1
936 1 82 TYR H 1 82 TYR QD 5.100 . 8.300 4.184 4.099 4.233 . 0 0 "[ . 1]" 1
937 1 82 TYR H 1 83 ASN H 2.900 . 4.000 2.651 2.541 2.748 . 0 0 "[ . 1]" 1
938 1 82 TYR HA 1 82 TYR QD 4.100 . 6.200 3.106 3.013 3.187 . 0 0 "[ . 1]" 1
939 1 82 TYR HA 1 82 TYR QE 5.600 . 9.500 4.699 4.591 4.836 . 0 0 "[ . 1]" 1
940 1 82 TYR HA 1 83 ASN H 3.900 . 5.800 3.533 3.514 3.558 . 0 0 "[ . 1]" 1
941 1 82 TYR HB2 1 82 TYR QD 3.100 . 4.300 2.352 2.293 2.392 . 0 0 "[ . 1]" 1
942 1 82 TYR HB2 1 83 ASN H 2.900 . 4.000 3.794 3.689 3.885 . 0 0 "[ . 1]" 1
943 1 82 TYR HB3 1 82 TYR QD 3.300 . 4.600 2.486 2.433 2.573 . 0 0 "[ . 1]" 1
944 1 82 TYR HB3 1 82 TYR QE 4.500 . 7.100 4.446 4.435 4.469 . 0 0 "[ . 1]" 1
945 1 82 TYR HB3 1 83 ASN H 4.400 . 6.800 2.644 2.475 2.709 . 0 0 "[ . 1]" 1
946 1 82 TYR QD 1 83 ASN H 4.500 . 7.000 3.747 3.381 3.997 . 0 0 "[ . 1]" 1
947 1 82 TYR QD 1 83 ASN HA 4.000 . 6.000 3.274 2.908 3.590 . 0 0 "[ . 1]" 1
948 1 82 TYR QD 1 86 LYS HA 5.000 . 8.100 5.924 5.660 6.175 . 0 0 "[ . 1]" 1
949 1 82 TYR QD 1 86 LYS HB3 3.900 . 5.800 4.341 4.189 4.540 . 0 0 "[ . 1]" 1
950 1 82 TYR QD 1 86 LYS QD 4.400 . 6.800 4.382 3.792 4.758 . 0 0 "[ . 1]" 1
951 1 82 TYR QD 1 86 LYS HG2 4.600 . 7.200 6.114 5.753 6.352 . 0 0 "[ . 1]" 1
952 1 82 TYR QD 1 86 LYS HG3 4.900 . 7.900 5.680 5.239 5.928 . 0 0 "[ . 1]" 1
953 1 82 TYR QE 1 83 ASN HA 4.000 . 6.000 5.052 4.500 5.534 . 0 0 "[ . 1]" 1
954 1 82 TYR QE 1 86 LYS QB 3.800 . 5.600 3.818 3.577 4.072 . 0 0 "[ . 1]" 1
955 1 82 TYR QE 1 86 LYS HB3 6.100 . 10.700 5.087 4.865 5.376 . 0 0 "[ . 1]" 1
956 1 82 TYR QE 1 86 LYS QD 4.700 . 7.500 4.245 3.859 4.844 . 0 0 "[ . 1]" 1
957 1 82 TYR QE 1 86 LYS HG2 5.200 . 8.600 6.075 5.732 6.588 . 0 0 "[ . 1]" 1
958 1 83 ASN H 1 83 ASN HA 3.000 . 4.100 2.844 2.824 2.857 . 0 0 "[ . 1]" 1
959 1 83 ASN H 1 83 ASN HB3 2.500 . 3.300 3.595 3.580 3.622 0.322 7 0 "[ . 1]" 1
960 1 83 ASN H 1 84 GLN H 2.700 . 3.600 2.549 2.456 2.651 . 0 0 "[ . 1]" 1
961 1 83 ASN HA 1 83 ASN QB 2.500 . 3.300 2.400 2.364 2.447 . 0 0 "[ . 1]" 1
962 1 83 ASN HA 1 83 ASN HD21 5.000 . 8.100 4.337 4.071 4.497 . 0 0 "[ . 1]" 1
963 1 83 ASN HA 1 83 ASN HD22 5.000 . 8.200 4.587 4.354 4.741 . 0 0 "[ . 1]" 1
964 1 83 ASN HA 1 86 LYS HB3 3.400 . 4.800 2.654 2.039 3.200 . 0 0 "[ . 1]" 1
965 1 83 ASN HA 1 86 LYS HG2 6.100 . 10.800 4.796 3.860 5.476 . 0 0 "[ . 1]" 1
966 1 83 ASN HA 1 86 LYS HG3 5.700 . 9.800 5.327 4.796 5.874 . 0 0 "[ . 1]" 1
967 1 83 ASN QB 1 83 ASN HD21 2.400 . 3.100 2.172 2.160 2.183 . 0 0 "[ . 1]" 1
968 1 83 ASN QB 1 83 ASN HD22 3.600 . 5.200 3.216 3.208 3.224 . 0 0 "[ . 1]" 1
969 1 83 ASN QB 1 84 GLN QB 4.400 . 6.800 4.071 3.653 4.578 . 0 0 "[ . 1]" 1
970 1 83 ASN HB3 1 84 GLN H 2.800 . 3.700 3.658 3.521 3.922 0.222 4 0 "[ . 1]" 1
971 1 84 GLN H 1 84 GLN HA 2.700 . 3.600 2.824 2.791 2.845 . 0 0 "[ . 1]" 1
972 1 84 GLN H 1 84 GLN HB3 2.400 . 3.100 2.873 2.484 3.596 0.496 4 0 "[ . 1]" 1
973 1 84 GLN H 1 84 GLN HG2 3.700 . 5.400 4.007 2.363 4.643 . 0 0 "[ . 1]" 1
974 1 84 GLN H 1 86 LYS HB3 3.900 . 5.800 4.898 4.513 5.180 . 0 0 "[ . 1]" 1
975 1 84 GLN HA 1 85 ARG H 2.900 . 3.900 2.723 2.712 2.758 . 0 0 "[ . 1]" 1
976 1 85 ARG H 1 85 ARG QB 2.700 . 3.600 2.339 2.235 2.526 . 0 0 "[ . 1]" 1
977 1 85 ARG H 1 85 ARG QD 4.900 . 7.900 4.341 3.781 4.875 . 0 0 "[ . 1]" 1
978 1 85 ARG H 1 86 LYS H 2.400 . 3.100 2.586 2.397 2.657 . 0 0 "[ . 1]" 1
979 1 85 ARG H 1 86 LYS HB3 3.300 . 4.600 4.631 4.388 4.762 0.162 9 0 "[ . 1]" 1
980 1 85 ARG QB 1 86 LYS HA 3.800 . 5.600 4.038 3.855 4.208 . 0 0 "[ . 1]" 1
981 1 86 LYS H 1 86 LYS HA 2.900 . 4.000 2.811 2.777 2.848 . 0 0 "[ . 1]" 1
982 1 86 LYS H 1 86 LYS HB3 2.100 . 2.700 2.361 2.283 2.428 . 0 0 "[ . 1]" 1
983 1 86 LYS H 1 86 LYS HD3 4.100 . 6.200 4.250 4.180 4.300 . 0 0 "[ . 1]" 1
984 1 86 LYS HA 1 86 LYS HB2 2.200 . 2.800 2.391 2.365 2.429 . 0 0 "[ . 1]" 1
985 1 86 LYS HA 1 86 LYS HE2 5.300 . 8.800 4.462 4.023 4.772 . 0 0 "[ . 1]" 1
986 1 86 LYS HA 1 86 LYS HG2 3.400 . 4.900 3.239 3.098 3.478 . 0 0 "[ . 1]" 1
987 1 86 LYS HA 1 86 LYS HG3 3.400 . 4.800 2.736 2.614 2.798 . 0 0 "[ . 1]" 1
988 1 86 LYS HA 1 87 GLU H 3.700 . 5.400 3.526 3.485 3.548 . 0 0 "[ . 1]" 1
989 1 86 LYS HA 1 89 GLU H 3.800 . 5.600 3.650 3.220 3.903 . 0 0 "[ . 1]" 1
990 1 86 LYS HA 1 89 GLU HB3 3.900 . 5.800 4.446 3.140 5.374 . 0 0 "[ . 1]" 1
991 1 86 LYS HA 1 90 HIS HD2 5.500 . 9.200 4.276 3.949 4.690 . 0 0 "[ . 1]" 1
992 1 86 LYS QB 1 90 HIS HD2 4.700 . 7.500 4.665 4.400 4.785 . 0 0 "[ . 1]" 1
993 1 86 LYS HB2 1 86 LYS QD 4.000 . 6.000 2.961 2.735 3.129 . 0 0 "[ . 1]" 1
994 1 86 LYS HB2 1 90 HIS HD2 6.200 . 11.100 5.415 5.175 5.753 . 0 0 "[ . 1]" 1
995 1 86 LYS HB3 1 86 LYS HD3 3.400 . 4.800 3.692 3.604 3.810 . 0 0 "[ . 1]" 1
996 1 86 LYS HB3 1 86 LYS HG3 2.700 . 3.600 3.020 3.009 3.026 . 0 0 "[ . 1]" 1
997 1 86 LYS HB3 1 87 GLU H 2.700 . 3.600 2.670 2.592 2.785 . 0 0 "[ . 1]" 1
998 1 86 LYS HB3 1 90 HIS HD2 5.700 . 9.700 5.102 4.752 5.344 . 0 0 "[ . 1]" 1
999 1 86 LYS HE2 1 86 LYS HG2 3.500 . 5.000 3.770 3.688 3.839 . 0 0 "[ . 1]" 1
1000 1 86 LYS HE2 1 86 LYS HG3 5.000 . 8.100 2.823 2.472 3.173 . 0 0 "[ . 1]" 1
1001 1 86 LYS HE3 1 86 LYS HG3 4.200 . 6.400 3.415 3.100 3.747 . 0 0 "[ . 1]" 1
1002 1 86 LYS HG3 1 90 HIS HD2 3.700 . 5.400 3.581 3.227 4.079 . 0 0 "[ . 1]" 1
1003 1 87 GLU H 1 87 GLU HA 2.900 . 3.900 2.841 2.798 2.855 . 0 0 "[ . 1]" 1
1004 1 87 GLU H 1 87 GLU QB 2.400 . 3.100 2.313 2.183 2.483 . 0 0 "[ . 1]" 1
1005 1 87 GLU H 1 87 GLU QG 3.000 . 4.200 3.188 2.142 4.050 . 0 0 "[ . 1]" 1
1006 1 87 GLU H 1 88 GLU H 2.400 . 3.100 2.567 2.480 2.674 . 0 0 "[ . 1]" 1
1007 1 87 GLU HA 1 90 HIS H 3.200 . 4.500 3.057 2.940 3.163 . 0 0 "[ . 1]" 1
1008 1 87 GLU HA 1 90 HIS HB3 3.800 . 5.600 4.278 3.949 4.738 . 0 0 "[ . 1]" 1
1009 1 87 GLU HA 1 90 HIS HD2 3.500 . 5.000 3.208 2.791 3.666 . 0 0 "[ . 1]" 1
1010 1 87 GLU QB 1 88 GLU H 2.700 . 3.600 2.620 2.518 2.746 . 0 0 "[ . 1]" 1
1011 1 87 GLU QB 1 90 HIS H 4.000 . 6.000 4.849 4.602 5.098 . 0 0 "[ . 1]" 1
1012 1 87 GLU QB 1 90 HIS HD2 5.600 . 9.500 5.148 4.734 5.556 . 0 0 "[ . 1]" 1
1013 1 87 GLU QG 1 90 HIS HB2 4.700 . 7.400 4.256 3.598 4.964 . 0 0 "[ . 1]" 1
1014 1 87 GLU QG 1 90 HIS HD2 5.500 . 9.300 5.157 4.390 5.823 . 0 0 "[ . 1]" 1
1015 1 88 GLU H 1 88 GLU HA 2.700 . 3.600 2.811 2.787 2.828 . 0 0 "[ . 1]" 1
1016 1 88 GLU H 1 88 GLU HB2 2.300 . 3.000 2.535 2.303 3.627 0.627 9 1 "[ . +1]" 1
1017 1 88 GLU H 1 88 GLU QG 2.800 . 3.800 2.537 2.245 3.966 0.166 5 0 "[ . 1]" 1
1018 1 88 GLU H 1 89 GLU H 2.700 . 3.600 2.678 2.614 2.772 . 0 0 "[ . 1]" 1
1019 1 88 GLU HA 1 91 THR HB 2.600 . 3.400 2.704 2.466 3.020 . 0 0 "[ . 1]" 1
1020 1 88 GLU HB2 1 89 GLU H 2.900 . 3.900 2.994 2.605 3.969 0.069 9 0 "[ . 1]" 1
1021 1 88 GLU HB2 1 91 THR HB 4.900 . 7.800 5.152 3.843 5.571 . 0 0 "[ . 1]" 1
1022 1 88 GLU HB2 1 91 THR MG 4.700 . 7.400 6.075 4.825 6.555 . 0 0 "[ . 1]" 1
1023 1 88 GLU HB3 1 91 THR HB 4.200 . 6.400 4.413 4.040 5.190 . 0 0 "[ . 1]" 1
1024 1 88 GLU QG 1 89 GLU H 4.000 . 6.000 3.986 2.398 4.381 . 0 0 "[ . 1]" 1
1025 1 88 GLU QG 1 91 THR HB 5.200 . 8.600 4.863 3.432 5.281 . 0 0 "[ . 1]" 1
1026 1 89 GLU H 1 89 GLU HA 2.900 . 4.000 2.824 2.809 2.840 . 0 0 "[ . 1]" 1
1027 1 89 GLU H 1 89 GLU HB3 3.000 . 4.200 3.377 2.719 3.626 . 0 0 "[ . 1]" 1
1028 1 89 GLU H 1 90 HIS H 2.600 . 3.400 2.633 2.553 2.737 . 0 0 "[ . 1]" 1
1029 1 89 GLU HA 1 91 THR H 2.900 . 6.000 4.327 4.122 4.622 . 0 0 "[ . 1]" 1
1030 1 89 GLU HA 1 92 LEU H 2.700 . 3.600 2.690 2.615 2.747 . 0 0 "[ . 1]" 1
1031 1 90 HIS H 1 90 HIS HB2 2.600 . 3.400 2.300 2.256 2.355 . 0 0 "[ . 1]" 1
1032 1 90 HIS H 1 90 HIS HB3 3.800 . 5.600 3.567 3.542 3.591 . 0 0 "[ . 1]" 1
1033 1 90 HIS H 1 91 THR H 2.900 . 3.900 2.672 2.628 2.713 . 0 0 "[ . 1]" 1
1034 1 90 HIS H 1 92 LEU H 4.100 . 6.200 3.602 3.505 3.764 . 0 0 "[ . 1]" 1
1035 1 90 HIS H 1 92 LEU QB 4.000 . 6.000 5.014 4.904 5.277 . 0 0 "[ . 1]" 1
1036 1 90 HIS HA 1 90 HIS HB3 2.900 . 4.000 2.643 2.579 2.679 . 0 0 "[ . 1]" 1
1037 1 90 HIS HA 1 90 HIS HD2 4.200 . 6.400 3.757 3.280 4.057 . 0 0 "[ . 1]" 1
1038 1 90 HIS HA 1 93 LEU HB2 3.500 . 5.000 3.082 2.890 3.245 . 0 0 "[ . 1]" 1
1039 1 90 HIS HB2 1 90 HIS HD2 3.500 . 5.000 2.905 2.796 3.120 . 0 0 "[ . 1]" 1
1040 1 90 HIS HB2 1 91 THR H 3.100 . 4.300 2.738 2.659 2.825 . 0 0 "[ . 1]" 1
1041 1 90 HIS HB3 1 91 THR H 3.800 . 5.600 3.328 3.224 3.528 . 0 0 "[ . 1]" 1
1042 1 91 THR H 1 91 THR HA 2.800 . 3.800 2.804 2.784 2.825 . 0 0 "[ . 1]" 1
1043 1 91 THR H 1 91 THR MG 3.900 . 5.800 3.741 3.726 3.752 . 0 0 "[ . 1]" 1
1044 1 91 THR H 1 92 LEU H 3.000 . 4.100 2.697 2.623 2.759 . 0 0 "[ . 1]" 1
1045 1 91 THR HA 1 91 THR HB 3.000 . 4.100 3.024 3.019 3.028 . 0 0 "[ . 1]" 1
1046 1 91 THR HA 1 91 THR MG 2.400 . 3.100 2.343 2.318 2.370 . 0 0 "[ . 1]" 1
1047 1 91 THR HA 1 92 LEU H 3.600 . 5.200 3.542 3.519 3.566 . 0 0 "[ . 1]" 1
1048 1 91 THR HA 1 94 ASP H 3.300 . 4.700 3.227 3.123 3.302 . 0 0 "[ . 1]" 1
1049 1 91 THR HA 1 94 ASP HB2 3.000 . 4.100 3.786 3.438 4.211 0.111 8 0 "[ . 1]" 1
1050 1 91 THR HA 1 94 ASP HB3 3.700 . 5.400 2.973 2.455 3.419 . 0 0 "[ . 1]" 1
1051 1 91 THR HB 1 91 THR MG 1.900 . 2.300 2.134 2.129 2.137 . 0 0 "[ . 1]" 1
1052 1 91 THR HB 1 92 LEU H 2.800 . 3.800 2.650 2.530 2.806 . 0 0 "[ . 1]" 1
1053 1 91 THR MG 1 92 LEU H 4.000 . 6.000 3.655 3.522 3.769 . 0 0 "[ . 1]" 1
1054 1 91 THR MG 1 94 ASP HB2 3.900 . 5.800 5.281 4.955 5.723 . 0 0 "[ . 1]" 1
1055 1 91 THR MG 1 94 ASP HB3 4.900 . 7.900 4.169 3.639 4.693 . 0 0 "[ . 1]" 1
1056 1 92 LEU H 1 92 LEU QB 2.600 . 3.500 2.240 2.225 2.261 . 0 0 "[ . 1]" 1
1057 1 92 LEU H 1 92 LEU QD 4.000 . 6.000 3.744 3.713 3.763 . 0 0 "[ . 1]" 1
1058 1 92 LEU H 1 93 LEU H 2.900 . 3.900 2.660 2.600 2.928 . 0 0 "[ . 1]" 1
1059 1 92 LEU HB2 1 93 LEU H 2.900 . 3.900 3.816 3.784 3.848 . 0 0 "[ . 1]" 1
1060 1 92 LEU QD 1 93 LEU H 3.400 . 4.800 3.704 3.598 3.759 . 0 0 "[ . 1]" 1
1061 1 93 LEU H 1 93 LEU HA 2.900 . 3.900 2.821 2.812 2.831 . 0 0 "[ . 1]" 1
1062 1 93 LEU H 1 93 LEU HB2 2.900 . 4.000 2.484 2.300 2.511 . 0 0 "[ . 1]" 1
1063 1 93 LEU H 1 93 LEU HG 2.200 . 2.800 2.448 2.257 3.918 1.118 5 1 "[ + 1]" 1
1064 1 93 LEU H 1 94 ASP H 2.400 . 3.100 2.619 2.564 2.656 . 0 0 "[ . 1]" 1
1065 1 93 LEU HA 1 93 LEU QB 3.400 . 4.800 2.378 2.363 2.468 . 0 0 "[ . 1]" 1
1066 1 93 LEU HA 1 96 LEU H 3.600 . 5.200 3.535 3.249 3.642 . 0 0 "[ . 1]" 1
1067 1 93 LEU HB2 1 94 ASP H 3.300 . 4.700 2.833 2.644 2.951 . 0 0 "[ . 1]" 1
1068 1 93 LEU MD1 1 94 ASP H 4.700 . 7.500 4.635 4.168 4.750 . 0 0 "[ . 1]" 1
1069 1 94 ASP H 1 94 ASP HB2 2.800 . 3.800 2.583 2.529 2.658 . 0 0 "[ . 1]" 1
1070 1 94 ASP H 1 94 ASP HB3 2.900 . 4.000 2.552 2.485 2.630 . 0 0 "[ . 1]" 1
1071 1 94 ASP H 1 95 LYS H 2.700 . 3.600 2.708 2.560 2.762 . 0 0 "[ . 1]" 1
1072 1 94 ASP H 1 96 LEU H 4.400 . 6.800 4.163 4.065 4.271 . 0 0 "[ . 1]" 1
1073 1 94 ASP HA 1 94 ASP HB3 2.900 . 3.900 3.030 3.028 3.035 . 0 0 "[ . 1]" 1
1074 1 94 ASP HA 1 96 LEU HB3 5.200 . 8.600 6.812 6.676 7.000 . 0 0 "[ . 1]" 1
1075 1 94 ASP HA 1 97 THR MG 3.700 . 5.400 4.082 3.918 4.255 . 0 0 "[ . 1]" 1
1076 1 94 ASP HB3 1 95 LYS H 4.300 . 6.600 2.582 2.440 3.109 . 0 0 "[ . 1]" 1
1077 1 95 LYS H 1 95 LYS HA 2.700 . 3.600 2.799 2.755 2.899 . 0 0 "[ . 1]" 1
1078 1 95 LYS H 1 95 LYS HB2 2.400 . 3.100 2.507 2.345 2.750 . 0 0 "[ . 1]" 1
1079 1 95 LYS H 1 95 LYS HG2 4.500 . 7.000 4.444 4.328 4.584 . 0 0 "[ . 1]" 1
1080 1 95 LYS H 1 96 LEU H 2.700 . 3.600 2.698 2.260 2.886 . 0 0 "[ . 1]" 1
1081 1 95 LYS HA 1 95 LYS HB2 2.700 . 3.600 2.464 2.380 2.543 . 0 0 "[ . 1]" 1
1082 1 95 LYS HA 1 95 LYS HG2 3.500 . 5.000 3.186 2.927 3.735 . 0 0 "[ . 1]" 1
1083 1 95 LYS HA 1 95 LYS HG3 3.300 . 4.700 2.671 2.544 2.945 . 0 0 "[ . 1]" 1
1084 1 95 LYS HA 1 96 LEU H 3.900 . 5.800 3.544 3.519 3.562 . 0 0 "[ . 1]" 1
1085 1 95 LYS HA 1 96 LEU HB3 5.100 . 8.400 6.613 6.570 6.639 . 0 0 "[ . 1]" 1
1086 1 95 LYS HB3 1 95 LYS HG2 2.900 . 3.900 2.461 2.383 2.517 . 0 0 "[ . 1]" 1
1087 1 95 LYS HB3 1 96 LEU HA 3.200 . 4.500 4.270 4.143 4.443 . 0 0 "[ . 1]" 1
1088 1 95 LYS HE2 1 95 LYS HG2 3.100 . 4.300 3.323 2.375 3.743 . 0 0 "[ . 1]" 1
1089 1 95 LYS HE3 1 95 LYS HG3 4.000 . 6.000 3.278 2.619 4.220 . 0 0 "[ . 1]" 1
1090 1 95 LYS HG3 1 98 GLN QG 4.800 . 7.700 5.080 4.411 5.602 . 0 0 "[ . 1]" 1
1091 1 96 LEU H 1 96 LEU HA 2.900 . 4.000 2.787 2.777 2.828 . 0 0 "[ . 1]" 1
1092 1 96 LEU H 1 96 LEU HB2 2.700 . 3.600 2.585 2.513 2.623 . 0 0 "[ . 1]" 1
1093 1 96 LEU H 1 96 LEU HB3 3.800 . 5.600 3.607 3.580 3.618 . 0 0 "[ . 1]" 1
1094 1 96 LEU H 1 96 LEU MD1 3.600 . 5.200 3.621 3.561 3.651 . 0 0 "[ . 1]" 1
1095 1 96 LEU H 1 96 LEU MD2 3.100 . 4.300 3.142 3.077 3.274 . 0 0 "[ . 1]" 1
1096 1 96 LEU H 1 97 THR H 3.000 . 4.100 2.802 2.546 2.856 . 0 0 "[ . 1]" 1
1097 1 96 LEU HA 1 96 LEU HB3 2.300 . 3.000 2.455 2.446 2.473 . 0 0 "[ . 1]" 1
1098 1 96 LEU HA 1 96 LEU MD1 3.800 . 5.600 3.864 3.852 3.886 . 0 0 "[ . 1]" 1
1099 1 96 LEU HA 1 97 THR HB 4.800 . 7.700 5.858 5.830 5.902 . 0 0 "[ . 1]" 1
1100 1 96 LEU HA 1 99 GLN H 3.400 . 4.900 3.452 3.282 3.603 . 0 0 "[ . 1]" 1
1101 1 96 LEU HA 1 99 GLN HA 3.900 . 5.800 5.433 5.074 5.568 . 0 0 "[ . 1]" 1
1102 1 96 LEU HA 1 100 LEU MD2 3.000 . 6.000 4.971 4.729 5.380 . 0 0 "[ . 1]" 1
1103 1 96 LEU HB3 1 96 LEU MD1 2.700 . 3.600 2.371 2.355 2.386 . 0 0 "[ . 1]" 1
1104 1 96 LEU HB3 1 97 THR H 4.200 . 6.400 3.595 3.511 3.804 . 0 0 "[ . 1]" 1
1105 1 96 LEU MD1 1 96 LEU MD2 1.700 . 2.100 2.078 2.075 2.085 . 0 0 "[ . 1]" 1
1106 1 96 LEU MD2 1 97 THR H 4.300 . 6.600 4.623 4.578 4.673 . 0 0 "[ . 1]" 1
1107 1 97 THR H 1 97 THR HB 2.800 . 3.800 2.641 2.517 2.692 . 0 0 "[ . 1]" 1
1108 1 97 THR H 1 97 THR MG 3.900 . 5.800 3.754 3.743 3.764 . 0 0 "[ . 1]" 1
1109 1 97 THR H 1 98 GLN H 2.900 . 4.000 2.760 2.505 2.842 . 0 0 "[ . 1]" 1
1110 1 97 THR HA 1 97 THR MG 2.400 . 3.100 2.360 2.336 2.382 . 0 0 "[ . 1]" 1
1111 1 97 THR HA 1 98 GLN H 3.800 . 5.600 3.549 3.522 3.564 . 0 0 "[ . 1]" 1
1112 1 97 THR HA 1 100 LEU HB2 3.300 . 4.700 3.119 2.931 3.245 . 0 0 "[ . 1]" 1
1113 1 97 THR HA 1 101 GLN H 3.900 . 5.800 3.991 3.839 4.142 . 0 0 "[ . 1]" 1
1114 1 97 THR HB 1 97 THR MG 2.100 . 2.600 2.133 2.131 2.135 . 0 0 "[ . 1]" 1
1115 1 97 THR HB 1 98 GLN H 2.700 . 3.600 2.529 2.433 2.624 . 0 0 "[ . 1]" 1
1116 1 97 THR HB 1 98 GLN HA 4.000 . 6.000 4.137 4.086 4.206 . 0 0 "[ . 1]" 1
1117 1 97 THR MG 1 98 GLN H 3.500 . 5.000 3.523 3.469 3.570 . 0 0 "[ . 1]" 1
1118 1 97 THR MG 1 98 GLN HA 3.000 . 4.100 3.561 3.475 3.645 . 0 0 "[ . 1]" 1
1119 1 97 THR MG 1 100 LEU HB2 3.700 . 5.400 4.197 3.809 4.365 . 0 0 "[ . 1]" 1
1120 1 97 THR MG 1 101 GLN HB2 3.400 . 4.800 3.109 2.883 3.372 . 0 0 "[ . 1]" 1
1121 1 97 THR MG 1 101 GLN HB3 2.900 . 4.000 3.898 3.723 4.120 0.120 7 0 "[ . 1]" 1
1122 1 97 THR MG 1 101 GLN QG 3.500 . 5.000 3.986 3.735 4.322 . 0 0 "[ . 1]" 1
1123 1 98 GLN H 1 98 GLN HA 2.500 . 3.300 2.813 2.797 2.834 . 0 0 "[ . 1]" 1
1124 1 98 GLN H 1 98 GLN QB 2.400 . 3.100 2.297 2.204 2.495 . 0 0 "[ . 1]" 1
1125 1 98 GLN H 1 98 GLN QG 3.500 . 5.100 3.427 2.095 4.023 . 0 0 "[ . 1]" 1
1126 1 98 GLN H 1 99 GLN H 2.700 . 3.600 2.669 2.574 2.722 . 0 0 "[ . 1]" 1
1127 1 98 GLN HB3 1 100 LEU H 4.700 . 7.500 5.260 4.981 5.741 . 0 0 "[ . 1]" 1
1128 1 98 GLN QG 1 99 GLN H 3.400 . 4.900 3.693 3.279 4.040 . 0 0 "[ . 1]" 1
1129 1 99 GLN H 1 99 GLN HA 2.600 . 3.500 2.806 2.790 2.819 . 0 0 "[ . 1]" 1
1130 1 99 GLN HA 1 102 GLY H 3.200 . 4.500 3.238 3.129 3.351 . 0 0 "[ . 1]" 1
1131 1 100 LEU H 1 100 LEU HA 2.700 . 3.600 2.842 2.818 2.861 . 0 0 "[ . 1]" 1
1132 1 100 LEU H 1 100 LEU HB2 2.300 . 3.000 2.441 2.385 2.503 . 0 0 "[ . 1]" 1
1133 1 100 LEU H 1 100 LEU QD 2.900 . 3.900 3.092 2.971 3.191 . 0 0 "[ . 1]" 1
1134 1 100 LEU H 1 100 LEU HG 2.600 . 3.400 2.407 2.277 2.513 . 0 0 "[ . 1]" 1
1135 1 100 LEU H 1 101 GLN H 2.600 . 3.400 2.584 2.489 2.679 . 0 0 "[ . 1]" 1
1136 1 100 LEU H 1 103 LEU H 4.500 . 7.000 4.705 4.627 4.989 . 0 0 "[ . 1]" 1
1137 1 100 LEU HA 1 100 LEU QB 2.600 . 3.400 2.382 2.356 2.403 . 0 0 "[ . 1]" 1
1138 1 100 LEU HA 1 103 LEU H 3.200 . 4.400 3.456 3.383 3.583 . 0 0 "[ . 1]" 1
1139 1 100 LEU MD1 1 101 GLN H 3.800 . 5.600 4.514 4.408 4.619 . 0 0 "[ . 1]" 1
1140 1 100 LEU MD2 1 100 LEU HG 2.000 . 2.500 2.127 2.125 2.128 . 0 0 "[ . 1]" 1
1141 1 101 GLN H 1 101 GLN HA 2.600 . 3.400 2.808 2.802 2.817 . 0 0 "[ . 1]" 1
1142 1 101 GLN H 1 101 GLN HB2 2.400 . 3.100 2.489 2.442 2.530 . 0 0 "[ . 1]" 1
1143 1 101 GLN H 1 101 GLN HB3 2.500 . 3.300 2.512 2.465 2.603 . 0 0 "[ . 1]" 1
1144 1 101 GLN H 1 101 GLN QG 4.300 . 6.700 4.012 3.993 4.044 . 0 0 "[ . 1]" 1
1145 1 101 GLN H 1 102 GLY H 2.700 . 3.600 2.682 2.606 2.737 . 0 0 "[ . 1]" 1
1146 1 101 GLN HA 1 101 GLN HE22 4.800 . 7.700 4.948 4.091 5.380 . 0 0 "[ . 1]" 1
1147 1 101 GLN HA 1 104 ALA MB 2.200 . 2.800 2.634 2.457 2.771 . 0 0 "[ . 1]" 1
1148 1 101 GLN HB2 1 101 GLN HE21 5.000 . 8.100 4.572 4.457 4.622 . 0 0 "[ . 1]" 1
1149 1 101 GLN HB2 1 101 GLN HE22 5.400 . 9.100 5.176 4.691 5.376 . 0 0 "[ . 1]" 1
1150 1 101 GLN HB2 1 102 GLY H 2.900 . 4.000 3.894 3.807 4.075 0.075 2 0 "[ . 1]" 1
1151 1 101 GLN HB2 1 103 LEU H 4.900 . 7.900 5.882 5.769 5.986 . 0 0 "[ . 1]" 1
1152 1 101 GLN HB3 1 102 GLY H 4.000 . 6.000 2.639 2.542 2.960 . 0 0 "[ . 1]" 1
1153 1 101 GLN HE21 1 105 VAL MG1 3.800 . 5.600 4.717 4.382 4.970 . 0 0 "[ . 1]" 1
1154 1 101 GLN HE21 1 105 VAL MG2 3.100 . 4.300 2.597 2.431 2.819 . 0 0 "[ . 1]" 1
1155 1 101 GLN HE22 1 105 VAL MG2 3.200 . 4.500 2.836 2.517 3.260 . 0 0 "[ . 1]" 1
1156 1 101 GLN QG 1 105 VAL MG2 3.500 . 5.000 3.226 2.997 3.568 . 0 0 "[ . 1]" 1
1157 1 102 GLY H 1 102 GLY QA 2.400 . 3.100 2.206 2.200 2.235 . 0 0 "[ . 1]" 1
1158 1 102 GLY H 1 103 LEU H 2.800 . 3.800 2.632 2.331 2.697 . 0 0 "[ . 1]" 1
1159 1 102 GLY HA2 1 103 LEU H 3.000 . 4.100 3.536 3.500 3.552 . 0 0 "[ . 1]" 1
1160 1 102 GLY HA3 1 105 VAL HB 4.000 . 6.000 4.887 4.740 5.223 . 0 0 "[ . 1]" 1
1161 1 102 GLY HA3 1 105 VAL MG1 4.700 . 7.500 5.941 5.789 6.259 . 0 0 "[ . 1]" 1
1162 1 102 GLY HA3 1 105 VAL MG2 4.200 . 6.400 5.060 4.835 5.224 . 0 0 "[ . 1]" 1
1163 1 103 LEU H 1 103 LEU HA 2.900 . 4.000 2.825 2.810 2.839 . 0 0 "[ . 1]" 1
1164 1 103 LEU H 1 103 LEU QB 2.500 . 3.300 2.229 2.214 2.238 . 0 0 "[ . 1]" 1
1165 1 103 LEU H 1 103 LEU MD1 3.900 . 5.800 4.103 4.067 4.124 . 0 0 "[ . 1]" 1
1166 1 103 LEU H 1 103 LEU MD2 4.100 . 6.200 4.238 4.216 4.252 . 0 0 "[ . 1]" 1
1167 1 103 LEU H 1 104 ALA H 2.700 . 3.600 2.638 2.564 2.697 . 0 0 "[ . 1]" 1
1168 1 103 LEU HA 1 103 LEU QB 2.600 . 3.400 2.353 2.344 2.371 . 0 0 "[ . 1]" 1
1169 1 103 LEU HA 1 103 LEU HG 4.100 . 6.200 3.160 3.110 3.203 . 0 0 "[ . 1]" 1
1170 1 103 LEU HA 1 106 THR H 3.100 . 4.300 3.428 3.270 3.602 . 0 0 "[ . 1]" 1
1171 1 103 LEU QB 1 103 LEU MD2 2.200 . 2.800 2.091 2.087 2.096 . 0 0 "[ . 1]" 1
1172 1 103 LEU QB 1 106 THR HB 4.700 . 7.400 4.526 4.380 4.639 . 0 0 "[ . 1]" 1
1173 1 103 LEU HB3 1 104 ALA H 2.300 . 2.900 2.095 2.083 2.108 . 0 0 "[ . 1]" 1
1174 1 103 LEU MD1 1 104 ALA H 4.000 . 6.000 4.463 4.403 4.514 . 0 0 "[ . 1]" 1
1175 1 103 LEU MD1 1 106 THR MG 3.000 . 4.200 3.326 3.074 3.522 . 0 0 "[ . 1]" 1
1176 1 103 LEU MD2 1 104 ALA H 3.900 . 5.800 4.251 4.184 4.321 . 0 0 "[ . 1]" 1
1177 1 104 ALA H 1 104 ALA HA 2.600 . 3.400 2.780 2.768 2.800 . 0 0 "[ . 1]" 1
1178 1 104 ALA H 1 105 VAL H 2.700 . 3.600 2.804 2.768 2.850 . 0 0 "[ . 1]" 1
1179 1 104 ALA H 1 105 VAL HA 4.200 . 6.400 5.380 5.353 5.414 . 0 0 "[ . 1]" 1
1180 1 104 ALA HA 1 104 ALA MB 1.700 . 2.100 2.126 2.123 2.128 0.028 7 0 "[ . 1]" 1
1181 1 104 ALA HA 1 107 ILE HB 3.100 . 4.300 3.059 2.900 3.232 . 0 0 "[ . 1]" 1
1182 1 104 ALA HA 1 107 ILE MD 2.500 . 3.300 2.710 2.453 2.946 . 0 0 "[ . 1]" 1
1183 1 104 ALA HA 1 107 ILE HG13 4.200 . 6.400 3.604 3.339 3.899 . 0 0 "[ . 1]" 1
1184 1 104 ALA MB 1 105 VAL H 2.400 . 3.100 2.438 2.393 2.487 . 0 0 "[ . 1]" 1
1185 1 104 ALA MB 1 105 VAL HA 3.400 . 4.800 3.819 3.787 3.845 . 0 0 "[ . 1]" 1
1186 1 104 ALA MB 1 105 VAL MG2 2.800 . 3.800 3.044 2.969 3.123 . 0 0 "[ . 1]" 1
1187 1 105 VAL H 1 105 VAL HA 2.500 . 3.300 2.674 2.628 2.707 . 0 0 "[ . 1]" 1
1188 1 105 VAL H 1 105 VAL HB 2.400 . 3.100 2.472 2.441 2.496 . 0 0 "[ . 1]" 1
1189 1 105 VAL H 1 105 VAL MG1 3.200 . 4.500 3.757 3.744 3.764 . 0 0 "[ . 1]" 1
1190 1 105 VAL H 1 105 VAL MG2 2.400 . 3.100 2.191 2.149 2.286 . 0 0 "[ . 1]" 1
1191 1 105 VAL HA 1 105 VAL HB 2.700 . 3.600 3.017 3.013 3.019 . 0 0 "[ . 1]" 1
1192 1 105 VAL HA 1 105 VAL MG1 2.300 . 3.000 2.445 2.429 2.472 . 0 0 "[ . 1]" 1
1193 1 105 VAL HA 1 105 VAL MG2 2.200 . 2.800 2.320 2.278 2.344 . 0 0 "[ . 1]" 1
1194 1 105 VAL HA 1 106 THR HA 3.700 . 5.400 4.793 4.771 4.817 . 0 0 "[ . 1]" 1
1195 1 105 VAL HB 1 105 VAL MG1 1.900 . 2.300 2.126 2.123 2.128 . 0 0 "[ . 1]" 1
1196 1 105 VAL HB 1 105 VAL MG2 1.900 . 2.400 2.125 2.123 2.127 . 0 0 "[ . 1]" 1
1197 1 105 VAL HB 1 106 THR H 2.700 . 3.600 2.743 2.674 2.835 . 0 0 "[ . 1]" 1
1198 1 105 VAL MG1 1 105 VAL MG2 1.700 . 2.000 2.069 2.067 2.072 0.072 1 0 "[ . 1]" 1
1199 1 105 VAL MG1 1 106 THR H 3.000 . 4.100 3.451 3.373 3.549 . 0 0 "[ . 1]" 1
1200 1 105 VAL MG1 1 106 THR HA 3.200 . 4.500 3.440 3.351 3.548 . 0 0 "[ . 1]" 1
1201 1 106 THR H 1 106 THR HA 2.700 . 3.600 2.809 2.797 2.826 . 0 0 "[ . 1]" 1
1202 1 106 THR H 1 106 THR HB 2.600 . 3.400 2.543 2.503 2.617 . 0 0 "[ . 1]" 1
1203 1 106 THR H 1 106 THR MG 3.600 . 5.200 3.757 3.748 3.767 . 0 0 "[ . 1]" 1
1204 1 106 THR HA 1 106 THR HB 2.700 . 3.600 3.025 3.023 3.026 . 0 0 "[ . 1]" 1
1205 1 106 THR HA 1 106 THR MG 2.300 . 3.000 2.400 2.348 2.438 . 0 0 "[ . 1]" 1
1206 1 106 THR HB 1 106 THR MG 1.900 . 2.300 2.132 2.130 2.134 . 0 0 "[ . 1]" 1
1207 1 106 THR HB 1 107 ILE H 2.700 . 3.600 2.707 2.611 2.830 . 0 0 "[ . 1]" 1
1208 1 107 ILE H 1 107 ILE HA 2.600 . 3.400 2.860 2.840 2.876 . 0 0 "[ . 1]" 1
1209 1 107 ILE H 1 107 ILE HB 2.400 . 3.100 2.530 2.457 2.558 . 0 0 "[ . 1]" 1
1210 1 107 ILE H 1 107 ILE MD 3.300 . 4.600 3.558 3.482 3.625 . 0 0 "[ . 1]" 1
1211 1 107 ILE H 1 108 SER H 2.400 . 3.100 2.506 2.419 2.578 . 0 0 "[ . 1]" 1
1212 1 107 ILE H 1 109 ARG H 3.200 . 4.500 3.212 2.511 3.697 . 0 0 "[ . 1]" 1
1213 1 107 ILE HA 1 107 ILE HB 2.700 . 3.600 3.020 3.018 3.023 . 0 0 "[ . 1]" 1
1214 1 107 ILE HA 1 107 ILE MD 3.500 . 5.000 3.855 3.830 3.873 . 0 0 "[ . 1]" 1
1215 1 107 ILE HA 1 107 ILE HG12 3.100 . 4.300 2.589 2.534 2.621 . 0 0 "[ . 1]" 1
1216 1 107 ILE HA 1 107 ILE HG13 2.700 . 3.600 3.002 2.934 3.050 . 0 0 "[ . 1]" 1
1217 1 107 ILE HA 1 107 ILE MG 2.600 . 3.400 2.376 2.345 2.410 . 0 0 "[ . 1]" 1
1218 1 107 ILE HB 1 107 ILE MD 2.400 . 3.100 2.395 2.384 2.410 . 0 0 "[ . 1]" 1
1219 1 107 ILE HB 1 107 ILE HG12 2.700 . 3.600 3.028 3.026 3.029 . 0 0 "[ . 1]" 1
1220 1 107 ILE HB 1 107 ILE MG 1.900 . 2.400 2.125 2.122 2.127 . 0 0 "[ . 1]" 1
1221 1 107 ILE HB 1 108 SER H 2.900 . 3.900 2.731 2.636 3.088 . 0 0 "[ . 1]" 1
1222 1 107 ILE MD 1 107 ILE HG12 2.000 . 2.500 2.117 2.115 2.119 . 0 0 "[ . 1]" 1
1223 1 107 ILE MD 1 107 ILE HG13 2.100 . 2.700 2.119 2.118 2.121 . 0 0 "[ . 1]" 1
1224 1 107 ILE HG12 1 107 ILE MG 3.200 . 4.500 2.364 2.344 2.403 . 0 0 "[ . 1]" 1
1225 1 107 ILE HG13 1 107 ILE MG 2.400 . 3.100 3.201 3.198 3.208 0.108 5 0 "[ . 1]" 1
1226 1 107 ILE MG 1 108 SER HA 3.000 . 4.100 3.445 3.238 3.621 . 0 0 "[ . 1]" 1
1227 1 107 ILE MG 1 109 ARG H 4.100 . 6.200 4.753 4.556 5.000 . 0 0 "[ . 1]" 1
1228 1 108 SER H 1 108 SER HA 2.900 . 4.000 2.872 2.818 2.914 . 0 0 "[ . 1]" 1
1229 1 108 SER QB 1 109 ARG H 3.800 . 5.600 3.356 2.904 3.723 . 0 0 "[ . 1]" 1
1230 1 109 ARG H 1 109 ARG HA 2.200 . 2.800 2.720 2.244 2.940 0.140 6 0 "[ . 1]" 1
1231 1 109 ARG H 1 109 ARG QB 2.800 . 3.800 2.721 2.259 3.338 . 0 0 "[ . 1]" 1
1232 1 109 ARG H 1 109 ARG HD3 5.400 . 9.100 4.970 3.409 6.093 . 0 0 "[ . 1]" 1
1233 1 109 ARG H 1 109 ARG QG 3.100 . 4.300 3.342 2.780 4.115 . 0 0 "[ . 1]" 1
1234 1 109 ARG HA 1 109 ARG QB 2.500 . 3.300 2.380 2.353 2.418 . 0 0 "[ . 1]" 1
1235 1 110 GLU H 1 110 GLU HA 2.300 . 2.900 2.820 2.263 2.941 0.041 8 0 "[ . 1]" 1
1236 1 110 GLU HA 1 110 GLU HB2 2.800 . 3.800 2.830 2.460 3.028 . 0 0 "[ . 1]" 1
1237 1 110 GLU HA 1 111 ASN HA 4.800 . 7.700 4.515 4.404 4.635 . 0 0 "[ . 1]" 1
1238 1 110 GLU HA 1 111 ASN HB2 5.000 . 8.100 5.171 4.579 5.689 . 0 0 "[ . 1]" 1
1239 1 110 GLU HB3 1 111 ASN H 3.900 . 5.800 4.026 2.322 4.634 . 0 0 "[ . 1]" 1
1240 1 110 GLU HG2 1 111 ASN H 5.400 . 9.100 5.023 4.523 5.654 . 0 0 "[ . 1]" 1
1241 1 111 ASN H 1 111 ASN HA 2.600 . 3.500 2.922 2.859 2.948 . 0 0 "[ . 1]" 1
1242 1 111 ASN H 1 111 ASN HB2 2.600 . 3.500 2.668 2.368 3.279 . 0 0 "[ . 1]" 1
1243 1 111 ASN H 1 111 ASN HB3 3.300 . 4.700 3.327 2.607 3.794 . 0 0 "[ . 1]" 1
1244 1 111 ASN H 1 112 ILE H 2.900 . 4.000 3.185 2.588 3.970 . 0 0 "[ . 1]" 1
1245 1 111 ASN HA 1 111 ASN HB3 3.000 . 4.100 2.718 2.479 3.032 . 0 0 "[ . 1]" 1
1246 1 111 ASN HA 1 112 ILE H 2.600 . 3.400 2.591 2.318 3.023 . 0 0 "[ . 1]" 1
1247 1 111 ASN HA 1 112 ILE HA 4.500 . 7.000 4.581 4.437 4.727 . 0 0 "[ . 1]" 1
1248 1 111 ASN HB2 1 112 ILE H 4.100 . 6.200 4.444 3.961 4.657 . 0 0 "[ . 1]" 1
1249 1 111 ASN HB2 1 112 ILE HG12 6.400 . 11.600 6.325 5.306 7.397 . 0 0 "[ . 1]" 1
1250 1 111 ASN HB2 1 112 ILE HG13 5.500 . 9.300 5.575 4.676 6.304 . 0 0 "[ . 1]" 1
1251 1 112 ILE H 1 112 ILE HA 2.500 . 3.300 2.870 2.807 2.939 . 0 0 "[ . 1]" 1
1252 1 112 ILE H 1 112 ILE HG12 3.700 . 5.400 3.460 3.354 3.670 . 0 0 "[ . 1]" 1
1253 1 112 ILE H 1 112 ILE HG13 2.300 . 2.900 2.169 2.033 2.476 . 0 0 "[ . 1]" 1
1254 1 112 ILE H 1 112 ILE MG 3.500 . 5.000 3.793 3.757 3.873 . 0 0 "[ . 1]" 1
1255 1 112 ILE HA 1 112 ILE HB 2.500 . 3.300 3.018 3.012 3.022 . 0 0 "[ . 1]" 1
1256 1 112 ILE HA 1 112 ILE HG12 3.000 . 4.100 2.632 2.563 2.724 . 0 0 "[ . 1]" 1
1257 1 112 ILE HA 1 112 ILE HG13 2.800 . 3.800 3.049 2.944 3.144 . 0 0 "[ . 1]" 1
1258 1 112 ILE HA 1 112 ILE MG 2.000 . 2.500 2.340 2.294 2.396 . 0 0 "[ . 1]" 1
1259 1 112 ILE HB 1 112 ILE HG12 2.800 . 3.800 3.023 3.018 3.025 . 0 0 "[ . 1]" 1
1260 1 112 ILE HB 1 112 ILE HG13 2.500 . 3.300 2.507 2.491 2.538 . 0 0 "[ . 1]" 1
1261 1 112 ILE HB 1 112 ILE MG 1.800 . 2.200 2.126 2.122 2.129 . 0 0 "[ . 1]" 1
1262 1 112 ILE HG12 1 112 ILE MG 2.100 . 2.700 2.335 2.295 2.371 . 0 0 "[ . 1]" 1
1263 1 112 ILE HG12 1 113 THR H 5.100 . 8.400 4.851 4.586 5.085 . 0 0 "[ . 1]" 1
1264 1 112 ILE HG13 1 112 ILE MG 3.000 . 4.100 3.192 3.185 3.198 . 0 0 "[ . 1]" 1
1265 1 112 ILE MG 1 113 THR H 3.000 . 4.200 3.373 2.852 3.931 . 0 0 "[ . 1]" 1
1266 1 112 ILE MG 1 113 THR HA 3.800 . 5.600 3.908 3.348 4.400 . 0 0 "[ . 1]" 1
1267 1 113 THR H 1 113 THR HA 2.900 . 3.900 2.847 2.255 2.941 . 0 0 "[ . 1]" 1
1268 1 113 THR H 1 113 THR MG 3.200 . 4.500 3.196 2.551 3.838 . 0 0 "[ . 1]" 1
1269 1 113 THR HA 1 113 THR HB 2.200 . 2.800 2.737 2.478 3.028 0.228 8 0 "[ . 1]" 1
1270 1 113 THR HA 1 113 THR MG 2.700 . 3.600 2.299 2.242 2.356 . 0 0 "[ . 1]" 1
1271 1 113 THR HB 1 113 THR MG 1.800 . 2.200 2.133 2.124 2.136 . 0 0 "[ . 1]" 1
1272 1 113 THR MG 1 114 GLU H 4.100 . 6.300 3.978 3.513 4.368 . 0 0 "[ . 1]" 1
1273 1 114 GLU H 1 114 GLU HA 2.300 . 3.000 2.699 2.253 2.940 . 0 0 "[ . 1]" 1
1274 1 114 GLU HA 1 114 GLU HB2 2.200 . 2.800 2.647 2.453 3.022 0.222 2 0 "[ . 1]" 1
1275 1 114 GLU HA 1 114 GLU QG 2.700 . 3.600 2.881 2.380 3.340 . 0 0 "[ . 1]" 1
1276 1 114 GLU HB2 1 114 GLU HG3 2.600 . 3.500 2.606 2.389 3.004 . 0 0 "[ . 1]" 1
1277 1 114 GLU HB3 1 114 GLU HG3 2.500 . 3.300 2.832 2.356 3.006 . 0 0 "[ . 1]" 1
1278 1 115 VAL H 1 115 VAL HA 2.700 . 3.600 2.921 2.882 2.941 . 0 0 "[ . 1]" 1
1279 1 115 VAL H 1 115 VAL MG2 2.100 . 2.700 2.040 1.936 2.197 . 0 0 "[ . 1]" 1
1280 1 115 VAL HA 1 115 VAL HB 2.400 . 3.100 2.667 2.460 3.017 . 0 0 "[ . 1]" 1
1281 1 115 VAL HA 1 115 VAL MG1 2.100 . 2.700 2.287 2.218 2.333 . 0 0 "[ . 1]" 1
1282 1 115 VAL HA 1 116 GLY H 2.400 . 3.100 2.691 2.182 3.390 0.290 8 0 "[ . 1]" 1
1283 1 115 VAL HA 1 116 GLY QA 5.600 . 9.500 4.087 3.906 4.395 . 0 0 "[ . 1]" 1
1284 1 115 VAL HB 1 115 VAL QG 1.900 . 2.300 1.897 1.895 1.899 . 0 0 "[ . 1]" 1
1285 1 115 VAL HB 1 116 GLY H 4.100 . 6.200 4.367 4.107 4.442 . 0 0 "[ . 1]" 1
1286 1 115 VAL HB 1 116 GLY QA 4.700 . 7.400 4.540 4.366 4.712 . 0 0 "[ . 1]" 1
1287 1 115 VAL QG 1 116 GLY H 3.700 . 5.400 3.400 2.625 3.667 . 0 0 "[ . 1]" 1
1288 1 115 VAL QG 1 116 GLY QA 4.600 . 7.300 3.668 3.094 3.986 . 0 0 "[ . 1]" 1
1289 1 116 GLY H 1 116 GLY QA 2.500 . 3.300 2.316 2.213 2.485 . 0 0 "[ . 1]" 1
1290 1 116 GLY H 1 117 ALA H 4.200 . 6.400 4.152 3.756 4.559 . 0 0 "[ . 1]" 1
1291 1 116 GLY QA 1 117 ALA H 2.600 . 3.400 2.238 2.120 2.409 . 0 0 "[ . 1]" 1
1292 1 117 ALA H 1 117 ALA MB 2.400 . 3.100 2.542 2.281 2.802 . 0 0 "[ . 1]" 1
1293 1 117 ALA HA 1 117 ALA MB 2.300 . 3.000 2.128 2.122 2.134 . 0 0 "[ . 1]" 1
1294 1 117 ALA HA 1 118 PRO HD2 3.400 . 4.800 2.616 2.130 4.339 . 0 0 "[ . 1]" 1
1295 1 117 ALA HA 1 118 PRO HD3 3.000 . 4.200 2.686 2.139 3.806 . 0 0 "[ . 1]" 1
1296 1 117 ALA MB 1 118 PRO HA 3.700 . 5.400 4.383 4.020 4.491 . 0 0 "[ . 1]" 1
1297 1 118 PRO HA 1 118 PRO HD2 3.700 . 5.400 4.039 3.903 4.093 . 0 0 "[ . 1]" 1
1298 1 118 PRO HA 1 118 PRO HD3 4.000 . 6.000 3.854 3.764 3.972 . 0 0 "[ . 1]" 1
1299 1 118 PRO HA 1 119 THR H 2.700 . 3.600 2.497 2.143 2.766 . 0 0 "[ . 1]" 1
1300 1 119 THR H 1 119 THR HB 3.200 . 4.500 3.363 2.742 4.052 . 0 0 "[ . 1]" 1
1301 1 119 THR H 1 119 THR HG1 3.700 . 5.400 3.554 2.552 4.344 . 0 0 "[ . 1]" 1
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