NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
513965 |
2ldu   |
17683 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ldu
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 2839
_Distance_constraint_stats_list.Viol_count 842
_Distance_constraint_stats_list.Viol_total 1272.434
_Distance_constraint_stats_list.Viol_max 0.397
_Distance_constraint_stats_list.Viol_rms 0.0123
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0011
_Distance_constraint_stats_list.Viol_average_violations_only 0.0756
_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 10 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 MET 0.456 0.156 17 0 "[ . 1 . 2]"
1 12 ALA 0.456 0.156 17 0 "[ . 1 . 2]"
1 13 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 PRO 0.144 0.073 12 0 "[ . 1 . 2]"
1 15 SER 1.774 0.379 18 0 "[ . 1 . 2]"
1 16 ASN 1.798 0.379 18 0 "[ . 1 . 2]"
1 17 VAL 1.703 0.202 17 0 "[ . 1 . 2]"
1 18 PRO 0.822 0.160 5 0 "[ . 1 . 2]"
1 19 ALA 0.432 0.093 11 0 "[ . 1 . 2]"
1 20 PHE 0.154 0.048 19 0 "[ . 1 . 2]"
1 21 LEU 2.743 0.397 2 0 "[ . 1 . 2]"
1 22 THR 4.618 0.397 2 0 "[ . 1 . 2]"
1 23 LYS 0.959 0.115 3 0 "[ . 1 . 2]"
1 24 LEU 0.050 0.047 18 0 "[ . 1 . 2]"
1 25 TRP 0.205 0.139 6 0 "[ . 1 . 2]"
1 26 THR 0.504 0.140 13 0 "[ . 1 . 2]"
1 27 LEU 0.247 0.098 18 0 "[ . 1 . 2]"
1 28 VAL 0.009 0.009 14 0 "[ . 1 . 2]"
1 29 SER 0.504 0.140 13 0 "[ . 1 . 2]"
1 30 ASP 0.187 0.079 1 0 "[ . 1 . 2]"
1 31 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 ASP 0.112 0.112 11 0 "[ . 1 . 2]"
1 33 THR 0.370 0.079 1 0 "[ . 1 . 2]"
1 34 ASP 0.169 0.064 8 0 "[ . 1 . 2]"
1 35 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 2.106 0.197 16 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 CYS 0.169 0.064 8 0 "[ . 1 . 2]"
1 39 TRP 0.009 0.009 14 0 "[ . 1 . 2]"
1 40 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ASN 0.306 0.199 4 0 "[ . 1 . 2]"
1 45 SER 0.199 0.199 4 0 "[ . 1 . 2]"
1 46 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 HIS 0.000 0.000 8 0 "[ . 1 . 2]"
1 48 VAL 0.506 0.104 3 0 "[ . 1 . 2]"
1 49 PHE 1.948 0.169 5 0 "[ . 1 . 2]"
1 50 ASP 1.697 0.197 16 0 "[ . 1 . 2]"
1 51 GLN 0.851 0.206 7 0 "[ . 1 . 2]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 GLN 1.672 0.200 10 0 "[ . 1 . 2]"
1 54 PHE 2.402 0.212 9 0 "[ . 1 . 2]"
1 55 ALA 3.984 0.274 12 0 "[ . 1 . 2]"
1 56 LYS 6.923 0.239 20 0 "[ . 1 . 2]"
1 57 GLU 2.419 0.239 20 0 "[ . 1 . 2]"
1 58 VAL 5.828 0.274 12 0 "[ . 1 . 2]"
1 59 LEU 0.665 0.102 19 0 "[ . 1 . 2]"
1 60 PRO 3.717 0.269 2 0 "[ . 1 . 2]"
1 61 LYS 0.242 0.075 7 0 "[ . 1 . 2]"
1 62 TYR 2.568 0.184 3 0 "[ . 1 . 2]"
1 63 PHE 0.324 0.073 8 0 "[ . 1 . 2]"
1 64 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 HIS 0.416 0.139 15 0 "[ . 1 . 2]"
1 66 ASN 3.661 0.269 2 0 "[ . 1 . 2]"
1 67 ASN 0.161 0.139 15 0 "[ . 1 . 2]"
1 68 MET 4.998 0.313 11 0 "[ . 1 . 2]"
1 69 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 SER 0.086 0.055 17 0 "[ . 1 . 2]"
1 71 PHE 1.826 0.212 14 0 "[ . 1 . 2]"
1 72 VAL 0.480 0.096 4 0 "[ . 1 . 2]"
1 73 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 GLN 1.096 0.141 20 0 "[ . 1 . 2]"
1 75 LEU 1.457 0.212 14 0 "[ . 1 . 2]"
1 76 ASN 0.053 0.053 2 0 "[ . 1 . 2]"
1 77 MET 0.855 0.139 19 0 "[ . 1 . 2]"
1 78 TYR 0.183 0.118 16 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 PHE 0.050 0.022 1 0 "[ . 1 . 2]"
1 81 ARG 0.565 0.164 3 0 "[ . 1 . 2]"
1 82 LYS 2.131 0.217 6 0 "[ . 1 . 2]"
1 83 VAL 0.246 0.049 6 0 "[ . 1 . 2]"
1 84 VAL 0.751 0.158 1 0 "[ . 1 . 2]"
1 85 HIS 0.028 0.028 3 0 "[ . 1 . 2]"
1 86 ILE 1.090 0.195 19 0 "[ . 1 . 2]"
1 87 GLU 0.940 0.195 19 0 "[ . 1 . 2]"
1 88 GLN 1.549 0.212 17 0 "[ . 1 . 2]"
1 89 GLY 0.045 0.045 13 0 "[ . 1 . 2]"
1 90 GLY 1.649 0.212 17 0 "[ . 1 . 2]"
1 91 LEU 1.142 0.143 15 0 "[ . 1 . 2]"
1 92 VAL 1.209 0.337 2 0 "[ . 1 . 2]"
1 93 LYS 1.268 0.149 17 0 "[ . 1 . 2]"
1 94 PRO 3.592 0.337 2 0 "[ . 1 . 2]"
1 95 GLU 2.482 0.279 2 0 "[ . 1 . 2]"
1 96 ARG 2.417 0.169 5 0 "[ . 1 . 2]"
1 97 ASP 1.418 0.174 15 0 "[ . 1 . 2]"
1 98 ASP 0.405 0.127 9 0 "[ . 1 . 2]"
1 99 THR 1.017 0.158 1 0 "[ . 1 . 2]"
1 100 GLU 0.573 0.122 14 0 "[ . 1 . 2]"
1 101 PHE 1.615 0.217 6 0 "[ . 1 . 2]"
1 102 GLN 0.520 0.164 3 0 "[ . 1 . 2]"
1 103 HIS 1.614 0.126 5 0 "[ . 1 . 2]"
1 104 PRO 1.357 0.091 7 0 "[ . 1 . 2]"
1 105 CYS 0.164 0.079 18 0 "[ . 1 . 2]"
1 106 PHE 0.408 0.075 6 0 "[ . 1 . 2]"
1 107 LEU 3.030 0.150 6 0 "[ . 1 . 2]"
1 108 ARG 0.113 0.089 9 0 "[ . 1 . 2]"
1 110 GLN 2.481 0.150 6 0 "[ . 1 . 2]"
1 111 GLU 0.385 0.135 4 0 "[ . 1 . 2]"
1 112 GLN 0.672 0.135 4 0 "[ . 1 . 2]"
1 113 LEU 0.485 0.134 19 0 "[ . 1 . 2]"
1 114 LEU 0.278 0.116 4 0 "[ . 1 . 2]"
1 115 GLU 1.350 0.123 12 0 "[ . 1 . 2]"
1 116 ASN 0.190 0.045 12 0 "[ . 1 . 2]"
1 117 ILE 1.122 0.223 5 0 "[ . 1 . 2]"
1 118 LYS 3.301 0.286 5 0 "[ . 1 . 2]"
1 119 ARG 0.593 0.108 6 0 "[ . 1 . 2]"
1 120 LYS 1.347 0.222 9 0 "[ . 1 . 2]"
1 121 VAL 2.022 0.379 9 0 "[ . 1 . 2]"
1 122 THR 1.041 0.379 9 0 "[ . 1 . 2]"
1 123 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 10 HIS HB3 1 11 MET H 5.270 . 6.060 3.907 2.438 4.609 . 0 0 "[ . 1 . 2]" 1
2 1 11 MET HA 1 12 ALA H 3.120 . 3.590 2.407 2.108 3.585 . 0 0 "[ . 1 . 2]" 1
3 1 11 MET HB3 1 12 ALA H 4.320 . 4.970 3.406 1.887 4.474 . 0 0 "[ . 1 . 2]" 1
4 1 11 MET ME 1 12 ALA H 4.870 . 5.600 4.561 2.678 5.756 0.156 17 0 "[ . 1 . 2]" 1
5 1 12 ALA H 1 13 GLY H 4.710 . 5.420 3.994 2.631 4.659 . 0 0 "[ . 1 . 2]" 1
6 1 12 ALA HA 1 13 GLY H 2.870 . 3.300 2.390 2.148 3.194 . 0 0 "[ . 1 . 2]" 1
7 1 12 ALA MB 1 13 GLY H 3.490 . 4.010 3.216 2.173 3.775 . 0 0 "[ . 1 . 2]" 1
8 1 14 PRO HB2 1 15 SER H 4.040 . 4.650 3.644 1.985 4.405 . 0 0 "[ . 1 . 2]" 1
9 1 15 SER H 1 16 ASN H 4.810 . 5.530 4.280 2.846 4.669 . 0 0 "[ . 1 . 2]" 1
10 1 15 SER HB3 1 16 ASN H 4.290 . 4.930 3.594 2.422 4.679 . 0 0 "[ . 1 . 2]" 1
11 1 16 ASN HA 1 17 VAL H 3.260 . 3.750 3.067 2.468 3.408 . 0 0 "[ . 1 . 2]" 1
12 1 18 PRO HA 1 19 ALA H 2.750 . 3.160 2.253 2.177 2.343 . 0 0 "[ . 1 . 2]" 1
13 1 18 PRO HB3 1 19 ALA H 4.090 . 4.700 3.428 3.106 3.756 . 0 0 "[ . 1 . 2]" 1
14 1 18 PRO HB2 1 19 ALA H 3.740 . 4.300 3.660 2.788 4.020 . 0 0 "[ . 1 . 2]" 1
15 1 19 ALA H 1 20 PHE H 3.610 . 4.150 2.912 2.855 3.026 . 0 0 "[ . 1 . 2]" 1
16 1 19 ALA MB 1 20 PHE H 3.070 . 3.530 2.524 2.392 2.686 . 0 0 "[ . 1 . 2]" 1
17 1 20 PHE HB2 1 21 LEU H 4.090 . 4.700 3.960 3.889 4.048 . 0 0 "[ . 1 . 2]" 1
18 1 20 PHE HB3 1 21 LEU H 3.920 . 4.510 2.676 2.552 2.785 . 0 0 "[ . 1 . 2]" 1
19 1 20 PHE QD 1 21 LEU H 3.690 . 4.240 3.532 3.358 3.764 . 0 0 "[ . 1 . 2]" 1
20 1 21 LEU HB3 1 22 THR H 4.240 . 4.880 3.749 3.617 3.837 . 0 0 "[ . 1 . 2]" 1
21 1 21 LEU HB2 1 22 THR H 4.280 . 4.920 2.865 2.626 3.036 . 0 0 "[ . 1 . 2]" 1
22 1 21 LEU HG 1 22 THR H 4.440 . 5.110 4.614 4.388 4.786 . 0 0 "[ . 1 . 2]" 1
23 1 21 LEU MD2 1 22 THR H 4.640 . 5.340 4.780 4.688 4.846 . 0 0 "[ . 1 . 2]" 1
24 1 23 LYS H 1 24 LEU H 3.630 . 4.170 2.572 2.391 2.642 . 0 0 "[ . 1 . 2]" 1
25 1 23 LYS HB3 1 24 LEU H 3.810 . 4.380 3.628 3.469 3.969 . 0 0 "[ . 1 . 2]" 1
26 1 23 LYS HG3 1 24 LEU H 4.960 . 5.700 4.775 4.379 4.936 . 0 0 "[ . 1 . 2]" 1
27 1 23 LYS HG2 1 24 LEU H 4.960 . 5.700 4.530 4.249 5.027 . 0 0 "[ . 1 . 2]" 1
28 1 24 LEU HB2 1 25 TRP H 4.760 . 5.470 3.866 3.790 3.942 . 0 0 "[ . 1 . 2]" 1
29 1 24 LEU HB3 1 25 TRP H 4.760 . 5.470 2.493 2.368 2.635 . 0 0 "[ . 1 . 2]" 1
30 1 24 LEU HG 1 25 TRP H 4.700 . 5.400 3.610 3.275 3.862 . 0 0 "[ . 1 . 2]" 1
31 1 25 TRP HB3 1 26 THR H 5.470 . 6.290 2.570 2.212 3.789 . 0 0 "[ . 1 . 2]" 1
32 1 26 THR H 1 27 LEU H 3.630 . 4.170 2.679 2.581 2.821 . 0 0 "[ . 1 . 2]" 1
33 1 26 THR MG 1 27 LEU H 4.010 . 4.610 3.743 3.439 3.958 . 0 0 "[ . 1 . 2]" 1
34 1 27 LEU H 1 28 VAL H 3.760 . 4.320 2.695 2.437 2.946 . 0 0 "[ . 1 . 2]" 1
35 1 27 LEU HB2 1 28 VAL H 4.570 . 5.260 3.840 3.761 3.927 . 0 0 "[ . 1 . 2]" 1
36 1 27 LEU HB3 1 28 VAL H 4.570 . 5.260 2.451 2.346 2.584 . 0 0 "[ . 1 . 2]" 1
37 1 27 LEU HG 1 28 VAL H 4.790 . 5.510 3.379 3.119 3.590 . 0 0 "[ . 1 . 2]" 1
38 1 24 LEU MD1 1 28 VAL H 4.700 . 5.400 3.847 3.526 4.212 . 0 0 "[ . 1 . 2]" 1
39 1 28 VAL H 1 29 SER H 3.800 . 4.370 2.677 2.598 2.778 . 0 0 "[ . 1 . 2]" 1
40 1 28 VAL HB 1 29 SER H 3.430 . 3.940 2.844 2.624 3.025 . 0 0 "[ . 1 . 2]" 1
41 1 28 VAL MG1 1 29 SER H 4.340 . 4.990 3.609 3.368 3.791 . 0 0 "[ . 1 . 2]" 1
42 1 28 VAL MG2 1 29 SER H 4.280 . 4.920 3.950 3.732 4.083 . 0 0 "[ . 1 . 2]" 1
43 1 29 SER HB3 1 30 ASP H 4.930 . 5.670 3.821 3.231 4.547 . 0 0 "[ . 1 . 2]" 1
44 1 31 PRO HB2 1 32 ASP H 3.610 . 4.150 3.726 3.392 3.966 . 0 0 "[ . 1 . 2]" 1
45 1 31 PRO HG2 1 32 ASP H 3.160 . 3.630 2.796 2.432 3.171 . 0 0 "[ . 1 . 2]" 1
46 1 31 PRO HD2 1 32 ASP H 3.240 . 3.730 2.822 2.601 3.100 . 0 0 "[ . 1 . 2]" 1
47 1 32 ASP HB3 1 33 THR H 3.990 . 4.590 3.003 2.767 3.965 . 0 0 "[ . 1 . 2]" 1
48 1 33 THR H 1 34 ASP H 2.860 . 3.290 2.267 2.159 2.440 . 0 0 "[ . 1 . 2]" 1
49 1 33 THR MG 1 34 ASP H 4.260 . 4.900 4.361 4.304 4.431 . 0 0 "[ . 1 . 2]" 1
50 1 34 ASP HB2 1 35 ALA H 4.570 . 5.260 4.041 3.413 4.244 . 0 0 "[ . 1 . 2]" 1
51 1 34 ASP HB3 1 35 ALA H 4.570 . 5.260 3.440 2.744 4.132 . 0 0 "[ . 1 . 2]" 1
52 1 35 ALA MB 1 36 LEU H 3.540 . 4.070 2.819 2.678 3.075 . 0 0 "[ . 1 . 2]" 1
53 1 36 LEU H 1 37 ILE H 2.980 . 3.430 2.080 1.930 2.215 . 0 0 "[ . 1 . 2]" 1
54 1 36 LEU HG 1 37 ILE H 4.740 . 5.450 4.734 4.516 4.899 . 0 0 "[ . 1 . 2]" 1
55 1 36 LEU MD1 1 37 ILE H 5.290 . 6.080 5.196 4.994 5.320 . 0 0 "[ . 1 . 2]" 1
56 1 37 ILE H 1 38 CYS H 4.250 . 4.890 4.041 3.932 4.153 . 0 0 "[ . 1 . 2]" 1
57 1 37 ILE HA 1 38 CYS H 2.980 . 3.430 2.148 2.106 2.201 . 0 0 "[ . 1 . 2]" 1
58 1 38 CYS H 1 47 HIS HB2 3.930 . 4.520 3.655 3.232 4.064 . 0 0 "[ . 1 . 2]" 1
59 1 37 ILE HG13 1 38 CYS H 3.820 . 4.390 3.143 2.894 3.407 . 0 0 "[ . 1 . 2]" 1
60 1 37 ILE HG12 1 38 CYS H 3.820 . 4.390 3.341 3.091 3.634 . 0 0 "[ . 1 . 2]" 1
61 1 38 CYS HA 1 39 TRP H 3.270 . 3.760 2.311 2.195 2.382 . 0 0 "[ . 1 . 2]" 1
62 1 38 CYS HB2 1 39 TRP H 4.020 . 4.620 2.846 2.451 3.878 . 0 0 "[ . 1 . 2]" 1
63 1 39 TRP HA 1 40 SER H 3.340 . 3.840 2.270 2.226 2.318 . 0 0 "[ . 1 . 2]" 1
64 1 39 TRP HB2 1 40 SER H 4.520 . 5.200 2.868 2.480 4.013 . 0 0 "[ . 1 . 2]" 1
65 1 39 TRP HB3 1 40 SER H 4.080 . 4.690 3.740 2.895 3.925 . 0 0 "[ . 1 . 2]" 1
66 1 39 TRP HE3 1 40 SER H 4.170 . 4.800 3.916 3.568 4.099 . 0 0 "[ . 1 . 2]" 1
67 1 42 SER H 1 43 GLY H 4.810 . 5.530 2.558 2.428 2.729 . 0 0 "[ . 1 . 2]" 1
68 1 44 ASN HB2 1 45 SER H 4.690 . 5.390 3.832 3.100 4.481 . 0 0 "[ . 1 . 2]" 1
69 1 44 ASN HB3 1 45 SER H 4.690 . 5.390 4.359 4.112 4.619 . 0 0 "[ . 1 . 2]" 1
70 1 45 SER HB2 1 46 PHE H 4.510 . 5.190 2.390 2.050 2.834 . 0 0 "[ . 1 . 2]" 1
71 1 45 SER HB3 1 46 PHE H 4.510 . 5.190 3.721 3.511 3.988 . 0 0 "[ . 1 . 2]" 1
72 1 46 PHE HA 1 47 HIS H 3.510 . 4.040 2.273 2.211 2.330 . 0 0 "[ . 1 . 2]" 1
73 1 46 PHE HB2 1 47 HIS H 3.560 . 4.090 2.766 2.575 2.914 . 0 0 "[ . 1 . 2]" 1
74 1 46 PHE HB3 1 47 HIS H 3.750 . 4.310 3.951 3.834 4.034 . 0 0 "[ . 1 . 2]" 1
75 1 46 PHE QD 1 47 HIS H 4.160 . 4.780 3.808 3.624 4.003 . 0 0 "[ . 1 . 2]" 1
76 1 47 HIS HA 1 48 VAL H 3.200 . 3.680 2.243 2.154 2.303 . 0 0 "[ . 1 . 2]" 1
77 1 47 HIS HB2 1 48 VAL H 4.200 . 4.830 3.988 3.811 4.106 . 0 0 "[ . 1 . 2]" 1
78 1 47 HIS HB3 1 48 VAL H 4.680 . 5.380 2.874 2.643 3.033 . 0 0 "[ . 1 . 2]" 1
79 1 46 PHE QE 1 48 VAL H 6.000 . 6.900 5.844 5.592 6.068 . 0 0 "[ . 1 . 2]" 1
80 1 47 HIS HD2 1 48 VAL H 6.000 . 6.900 5.817 5.548 6.071 . 0 0 "[ . 1 . 2]" 1
81 1 48 VAL HA 1 49 PHE H 3.310 . 3.810 2.164 2.105 2.238 . 0 0 "[ . 1 . 2]" 1
82 1 48 VAL MG2 1 49 PHE H 4.120 . 4.740 4.110 3.995 4.223 . 0 0 "[ . 1 . 2]" 1
83 1 49 PHE H 1 50 ASP H 4.650 . 5.350 4.466 4.391 4.552 . 0 0 "[ . 1 . 2]" 1
84 1 49 PHE HA 1 50 ASP H 3.220 . 3.700 2.213 2.175 2.244 . 0 0 "[ . 1 . 2]" 1
85 1 49 PHE HB3 1 50 ASP H 3.670 . 4.220 2.897 2.781 3.034 . 0 0 "[ . 1 . 2]" 1
86 1 49 PHE HB2 1 50 ASP H 4.420 . 5.080 4.006 3.901 4.146 . 0 0 "[ . 1 . 2]" 1
87 1 49 PHE QD 1 50 ASP H 4.130 . 4.750 3.784 3.131 3.985 . 0 0 "[ . 1 . 2]" 1
88 1 50 ASP HA 1 51 GLN H 3.200 . 3.680 2.424 2.336 2.516 . 0 0 "[ . 1 . 2]" 1
89 1 50 ASP HB2 1 51 GLN H 4.380 . 5.040 4.529 4.420 4.688 . 0 0 "[ . 1 . 2]" 1
90 1 50 ASP HB3 1 51 GLN H 4.620 . 5.310 4.326 4.220 4.435 . 0 0 "[ . 1 . 2]" 1
91 1 51 GLN H 1 52 GLY H 3.910 . 4.500 2.908 2.834 2.991 . 0 0 "[ . 1 . 2]" 1
92 1 51 GLN HB2 1 52 GLY H 4.030 . 4.630 2.961 2.613 3.124 . 0 0 "[ . 1 . 2]" 1
93 1 51 GLN HG3 1 52 GLY H 5.230 . 6.010 4.707 4.421 5.259 . 0 0 "[ . 1 . 2]" 1
94 1 53 GLN HB3 1 54 PHE H 3.550 . 4.080 2.491 2.336 2.814 . 0 0 "[ . 1 . 2]" 1
95 1 50 ASP HB2 1 54 PHE H 5.010 . 5.760 3.857 3.369 5.237 . 0 0 "[ . 1 . 2]" 1
96 1 54 PHE H 1 55 ALA H 3.390 . 3.900 2.880 2.584 3.020 . 0 0 "[ . 1 . 2]" 1
97 1 54 PHE HB2 1 55 ALA H 4.000 . 4.600 3.836 3.752 3.900 . 0 0 "[ . 1 . 2]" 1
98 1 54 PHE HB3 1 55 ALA H 3.680 . 4.230 2.438 2.357 2.523 . 0 0 "[ . 1 . 2]" 1
99 1 54 PHE QD 1 55 ALA H 3.790 . 4.360 2.999 2.850 3.123 . 0 0 "[ . 1 . 2]" 1
100 1 56 LYS HB3 1 57 GLU H 3.300 . 3.800 2.756 2.422 2.969 . 0 0 "[ . 1 . 2]" 1
101 1 57 GLU H 1 58 VAL HB 4.270 . 4.910 4.376 4.218 4.490 . 0 0 "[ . 1 . 2]" 1
102 1 56 LYS HD3 1 57 GLU H 4.320 . 4.970 2.858 2.578 3.837 . 0 0 "[ . 1 . 2]" 1
103 1 57 GLU H 1 58 VAL H 3.050 . 3.510 2.212 2.056 2.293 . 0 0 "[ . 1 . 2]" 1
104 1 57 GLU HB2 1 58 VAL H 3.970 . 4.570 3.859 3.772 4.001 . 0 0 "[ . 1 . 2]" 1
105 1 58 VAL H 1 59 LEU H 3.170 . 3.650 2.461 2.411 2.542 . 0 0 "[ . 1 . 2]" 1
106 1 58 VAL HB 1 59 LEU H 3.390 . 3.900 2.591 2.466 2.739 . 0 0 "[ . 1 . 2]" 1
107 1 58 VAL MG2 1 59 LEU H 3.740 . 4.300 3.890 3.811 3.969 . 0 0 "[ . 1 . 2]" 1
108 1 60 PRO HB2 1 61 LYS H 3.890 . 4.470 3.754 3.672 3.890 . 0 0 "[ . 1 . 2]" 1
109 1 60 PRO HG2 1 61 LYS H 4.040 . 4.650 2.951 2.845 3.144 . 0 0 "[ . 1 . 2]" 1
110 1 60 PRO HD3 1 61 LYS H 4.060 . 4.670 4.061 3.991 4.165 . 0 0 "[ . 1 . 2]" 1
111 1 61 LYS HB2 1 62 TYR H 3.630 . 4.170 3.730 3.604 3.845 . 0 0 "[ . 1 . 2]" 1
112 1 61 LYS HB3 1 62 TYR H 3.540 . 4.070 2.314 2.137 2.513 . 0 0 "[ . 1 . 2]" 1
113 1 61 LYS HG3 1 62 TYR H 4.880 . 5.610 4.567 4.393 4.736 . 0 0 "[ . 1 . 2]" 1
114 1 58 VAL MG1 1 62 TYR H 4.310 . 4.960 4.111 3.837 4.338 . 0 0 "[ . 1 . 2]" 1
115 1 60 PRO HA 1 63 PHE H 4.720 . 5.430 4.135 3.623 4.468 . 0 0 "[ . 1 . 2]" 1
116 1 62 TYR HB3 1 63 PHE H 4.540 . 5.220 3.552 3.237 3.988 . 0 0 "[ . 1 . 2]" 1
117 1 62 TYR HB2 1 63 PHE H 4.230 . 4.860 2.832 2.520 3.402 . 0 0 "[ . 1 . 2]" 1
118 1 63 PHE H 1 63 PHE QE 5.190 . 5.970 4.504 4.167 4.994 . 0 0 "[ . 1 . 2]" 1
119 1 67 ASN HA 1 68 MET H 3.490 . 4.010 2.154 2.110 2.193 . 0 0 "[ . 1 . 2]" 1
120 1 67 ASN HB3 1 68 MET H 4.510 . 5.190 4.312 3.818 4.422 . 0 0 "[ . 1 . 2]" 1
121 1 68 MET H 1 69 ALA H 3.380 . 3.890 2.528 2.279 2.830 . 0 0 "[ . 1 . 2]" 1
122 1 68 MET HB2 1 69 ALA H 4.140 . 4.760 4.025 3.782 4.228 . 0 0 "[ . 1 . 2]" 1
123 1 68 MET HB3 1 69 ALA H 3.590 . 4.130 2.869 2.405 3.267 . 0 0 "[ . 1 . 2]" 1
124 1 68 MET HG2 1 69 ALA H 4.660 . 5.360 4.547 3.864 5.076 . 0 0 "[ . 1 . 2]" 1
125 1 68 MET HG3 1 69 ALA H 4.660 . 5.360 4.351 3.665 5.189 . 0 0 "[ . 1 . 2]" 1
126 1 69 ALA MB 1 70 SER H 3.080 . 3.540 2.641 2.545 2.776 . 0 0 "[ . 1 . 2]" 1
127 1 70 SER H 1 71 PHE H 3.820 . 4.390 2.672 2.599 2.799 . 0 0 "[ . 1 . 2]" 1
128 1 70 SER HB3 1 71 PHE H 4.390 . 5.050 2.606 2.464 2.761 . 0 0 "[ . 1 . 2]" 1
129 1 70 SER HB2 1 71 PHE H 4.250 . 4.890 3.900 3.816 4.033 . 0 0 "[ . 1 . 2]" 1
130 1 71 PHE H 1 72 VAL H 3.680 . 4.230 2.727 2.663 2.822 . 0 0 "[ . 1 . 2]" 1
131 1 71 PHE HB2 1 72 VAL H 4.020 . 4.620 3.811 3.757 3.901 . 0 0 "[ . 1 . 2]" 1
132 1 71 PHE HB3 1 72 VAL H 4.020 . 4.620 2.405 2.334 2.525 . 0 0 "[ . 1 . 2]" 1
133 1 71 PHE QD 1 72 VAL H 3.940 . 4.530 3.225 2.980 3.450 . 0 0 "[ . 1 . 2]" 1
134 1 72 VAL H 1 73 ARG H 3.260 . 3.750 2.749 2.652 2.868 . 0 0 "[ . 1 . 2]" 1
135 1 72 VAL HB 1 73 ARG H 3.400 . 3.910 2.739 2.583 2.918 . 0 0 "[ . 1 . 2]" 1
136 1 72 VAL MG1 1 73 ARG H 3.750 . 4.310 3.581 3.379 3.700 . 0 0 "[ . 1 . 2]" 1
137 1 73 ARG H 1 74 GLN H 3.170 . 3.650 2.770 2.716 2.828 . 0 0 "[ . 1 . 2]" 1
138 1 73 ARG HB2 1 74 GLN H 4.170 . 4.800 3.930 3.819 4.067 . 0 0 "[ . 1 . 2]" 1
139 1 73 ARG HG3 1 74 GLN H 4.370 . 5.030 4.749 4.468 4.916 . 0 0 "[ . 1 . 2]" 1
140 1 73 ARG HG2 1 74 GLN H 4.030 . 4.630 3.753 3.304 4.155 . 0 0 "[ . 1 . 2]" 1
141 1 73 ARG HD2 1 74 GLN H 6.000 . 6.900 5.434 4.408 6.356 . 0 0 "[ . 1 . 2]" 1
142 1 73 ARG HD3 1 74 GLN H 6.000 . 6.900 5.206 4.221 5.998 . 0 0 "[ . 1 . 2]" 1
143 1 74 GLN HB3 1 75 LEU H 4.010 . 4.610 3.567 3.251 3.706 . 0 0 "[ . 1 . 2]" 1
144 1 74 GLN HB2 1 75 LEU H 3.310 . 3.810 2.495 2.402 2.591 . 0 0 "[ . 1 . 2]" 1
145 1 74 GLN HG3 1 75 LEU H 5.420 . 6.230 4.865 4.672 4.961 . 0 0 "[ . 1 . 2]" 1
146 1 75 LEU H 1 77 MET ME 5.900 . 6.790 5.004 4.751 5.993 . 0 0 "[ . 1 . 2]" 1
147 1 74 GLN HG2 1 75 LEU H 4.230 . 4.860 4.259 4.083 4.472 . 0 0 "[ . 1 . 2]" 1
148 1 75 LEU H 1 76 ASN H 3.310 . 3.810 2.774 2.692 2.899 . 0 0 "[ . 1 . 2]" 1
149 1 75 LEU HB3 1 76 ASN H 3.510 . 4.040 3.608 3.457 3.721 . 0 0 "[ . 1 . 2]" 1
150 1 75 LEU HB2 1 76 ASN H 3.820 . 4.390 2.655 2.514 2.841 . 0 0 "[ . 1 . 2]" 1
151 1 75 LEU HG 1 76 ASN H 4.430 . 5.090 4.491 4.380 4.637 . 0 0 "[ . 1 . 2]" 1
152 1 75 LEU MD1 1 76 ASN H 4.360 . 5.010 4.549 4.359 4.742 . 0 0 "[ . 1 . 2]" 1
153 1 75 LEU MD2 1 76 ASN H 4.780 . 5.500 4.786 4.706 4.867 . 0 0 "[ . 1 . 2]" 1
154 1 76 ASN HB2 1 77 MET H 3.410 . 3.920 2.756 2.511 3.001 . 0 0 "[ . 1 . 2]" 1
155 1 77 MET H 1 78 TYR H 3.230 . 3.710 2.545 2.461 2.632 . 0 0 "[ . 1 . 2]" 1
156 1 77 MET HB2 1 78 TYR H 3.860 . 4.440 2.925 2.770 3.139 . 0 0 "[ . 1 . 2]" 1
157 1 77 MET HB3 1 78 TYR H 3.750 . 4.310 3.888 3.729 4.034 . 0 0 "[ . 1 . 2]" 1
158 1 78 TYR HB2 1 79 GLY H 4.880 . 5.610 3.608 3.249 3.810 . 0 0 "[ . 1 . 2]" 1
159 1 78 TYR HB3 1 79 GLY H 4.590 . 5.280 4.193 4.020 4.282 . 0 0 "[ . 1 . 2]" 1
160 1 79 GLY H 1 80 PHE H 3.460 . 3.980 2.525 2.430 2.642 . 0 0 "[ . 1 . 2]" 1
161 1 80 PHE H 1 81 ARG H 4.590 . 5.280 4.583 4.499 4.657 . 0 0 "[ . 1 . 2]" 1
162 1 80 PHE HA 1 81 ARG H 2.990 . 3.440 2.241 2.119 2.337 . 0 0 "[ . 1 . 2]" 1
163 1 80 PHE HB2 1 81 ARG H 4.650 . 5.350 4.124 3.967 4.263 . 0 0 "[ . 1 . 2]" 1
164 1 80 PHE HB3 1 81 ARG H 4.190 . 4.820 3.005 2.702 3.207 . 0 0 "[ . 1 . 2]" 1
165 1 80 PHE QD 1 81 ARG H 4.410 . 5.070 4.053 3.744 4.285 . 0 0 "[ . 1 . 2]" 1
166 1 81 ARG HA 1 82 LYS H 2.730 . 3.140 2.150 2.104 2.181 . 0 0 "[ . 1 . 2]" 1
167 1 81 ARG HB2 1 82 LYS H 4.510 . 5.190 4.302 4.193 4.398 . 0 0 "[ . 1 . 2]" 1
168 1 81 ARG HG2 1 82 LYS H 4.210 . 4.840 3.516 2.831 4.817 . 0 0 "[ . 1 . 2]" 1
169 1 81 ARG HG3 1 82 LYS H 4.210 . 4.840 3.333 2.949 3.646 . 0 0 "[ . 1 . 2]" 1
170 1 81 ARG HD2 1 82 LYS H 6.000 . 6.900 5.297 2.415 5.731 . 0 0 "[ . 1 . 2]" 1
171 1 81 ARG HD3 1 82 LYS H 6.000 . 6.900 5.195 2.348 5.788 . 0 0 "[ . 1 . 2]" 1
172 1 83 VAL H 1 100 GLU H 4.100 . 4.720 3.034 2.671 3.348 . 0 0 "[ . 1 . 2]" 1
173 1 82 LYS HA 1 83 VAL H 3.110 . 3.580 2.205 2.143 2.267 . 0 0 "[ . 1 . 2]" 1
174 1 82 LYS HB3 1 83 VAL H 4.870 . 5.600 4.381 4.155 4.545 . 0 0 "[ . 1 . 2]" 1
175 1 83 VAL H 1 84 VAL H 4.490 . 5.160 4.229 4.117 4.351 . 0 0 "[ . 1 . 2]" 1
176 1 83 VAL HA 1 84 VAL H 2.770 . 3.190 2.189 2.114 2.240 . 0 0 "[ . 1 . 2]" 1
177 1 83 VAL HB 1 84 VAL H 4.300 . 4.950 4.277 4.063 4.419 . 0 0 "[ . 1 . 2]" 1
178 1 83 VAL MG1 1 84 VAL H 3.190 . 3.670 2.919 2.563 3.184 . 0 0 "[ . 1 . 2]" 1
179 1 84 VAL HA 1 85 HIS H 2.910 . 3.350 2.194 2.130 2.261 . 0 0 "[ . 1 . 2]" 1
180 1 84 VAL MG1 1 85 HIS H 4.430 . 5.090 3.540 2.506 4.253 . 0 0 "[ . 1 . 2]" 1
181 1 85 HIS H 1 86 ILE H 4.270 . 4.910 2.250 2.072 2.648 . 0 0 "[ . 1 . 2]" 1
182 1 85 HIS HB2 1 86 ILE H 4.420 . 5.080 2.850 2.119 3.664 . 0 0 "[ . 1 . 2]" 1
183 1 85 HIS HB3 1 86 ILE H 4.420 . 5.080 3.764 3.127 4.333 . 0 0 "[ . 1 . 2]" 1
184 1 86 ILE HA 1 87 GLU H 2.590 . 2.980 2.175 2.116 2.343 . 0 0 "[ . 1 . 2]" 1
185 1 86 ILE HB 1 87 GLU H 4.180 . 4.810 4.400 3.946 4.542 . 0 0 "[ . 1 . 2]" 1
186 1 86 ILE MG 1 87 GLU H 3.130 . 3.600 3.208 2.286 3.623 0.023 12 0 "[ . 1 . 2]" 1
187 1 86 ILE HG12 1 87 GLU H 5.280 . 6.070 5.148 4.932 5.290 . 0 0 "[ . 1 . 2]" 1
188 1 86 ILE HG13 1 87 GLU H 5.280 . 6.070 5.674 5.179 5.922 . 0 0 "[ . 1 . 2]" 1
189 1 86 ILE MD 1 87 GLU H 3.640 . 4.190 3.814 3.351 4.219 0.029 16 0 "[ . 1 . 2]" 1
190 1 87 GLU H 1 88 GLN H 4.590 . 5.280 4.390 3.932 4.606 . 0 0 "[ . 1 . 2]" 1
191 1 87 GLU HB3 1 88 GLN H 3.530 . 4.060 3.536 2.342 4.166 0.106 6 0 "[ . 1 . 2]" 1
192 1 87 GLU HB2 1 88 GLN H 4.490 . 5.160 4.240 3.552 4.609 . 0 0 "[ . 1 . 2]" 1
193 1 87 GLU HG2 1 88 GLN H 5.490 . 6.310 4.476 2.751 4.934 . 0 0 "[ . 1 . 2]" 1
194 1 87 GLU HG3 1 88 GLN H 5.490 . 6.310 5.005 2.729 5.697 . 0 0 "[ . 1 . 2]" 1
195 1 88 GLN HB2 1 89 GLY H 4.390 . 5.050 4.269 3.735 4.532 . 0 0 "[ . 1 . 2]" 1
196 1 88 GLN HG2 1 89 GLY H 5.550 . 6.380 4.866 3.963 5.529 . 0 0 "[ . 1 . 2]" 1
197 1 88 GLN HG3 1 89 GLY H 5.550 . 6.380 5.260 3.810 6.023 . 0 0 "[ . 1 . 2]" 1
198 1 89 GLY H 1 90 GLY H 3.990 . 4.590 3.543 1.755 4.393 0.045 13 0 "[ . 1 . 2]" 1
199 1 90 GLY HA2 1 91 LEU H 2.790 . 3.210 2.743 2.310 3.278 0.068 2 0 "[ . 1 . 2]" 1
200 1 91 LEU HB2 1 92 VAL H 3.270 . 3.760 3.521 3.121 3.883 0.123 2 0 "[ . 1 . 2]" 1
201 1 91 LEU HB3 1 92 VAL H 3.070 . 3.530 2.409 2.024 2.904 . 0 0 "[ . 1 . 2]" 1
202 1 91 LEU MD2 1 92 VAL H 4.100 . 4.720 3.603 3.364 3.766 . 0 0 "[ . 1 . 2]" 1
203 1 92 VAL HB 1 93 LYS H 4.140 . 4.760 4.344 3.856 4.608 . 0 0 "[ . 1 . 2]" 1
204 1 94 PRO HA 1 95 GLU H 2.740 . 3.150 2.288 2.164 2.507 . 0 0 "[ . 1 . 2]" 1
205 1 94 PRO HB2 1 95 GLU H 2.860 . 3.290 3.018 2.453 3.370 0.080 20 0 "[ . 1 . 2]" 1
206 1 94 PRO HG2 1 95 GLU H 3.960 . 4.550 4.644 4.260 4.829 0.279 2 0 "[ . 1 . 2]" 1
207 1 94 PRO HD2 1 95 GLU H 5.450 . 6.270 5.685 5.536 5.798 . 0 0 "[ . 1 . 2]" 1
208 1 94 PRO HG3 1 96 ARG H 4.560 . 5.240 5.063 4.391 5.324 0.084 4 0 "[ . 1 . 2]" 1
209 1 94 PRO HB2 1 96 ARG H 3.110 . 3.580 2.902 2.437 3.625 0.045 18 0 "[ . 1 . 2]" 1
210 1 95 GLU HG2 1 96 ARG H 4.720 . 5.430 4.009 2.711 5.126 . 0 0 "[ . 1 . 2]" 1
211 1 94 PRO HB3 1 96 ARG H 4.500 . 5.180 4.511 4.011 5.189 0.009 18 0 "[ . 1 . 2]" 1
212 1 96 ARG HA 1 97 ASP H 2.980 . 3.430 2.307 2.108 2.608 . 0 0 "[ . 1 . 2]" 1
213 1 96 ARG HB2 1 97 ASP H 3.920 . 4.510 3.093 2.203 4.166 . 0 0 "[ . 1 . 2]" 1
214 1 49 PHE HB3 1 97 ASP H 6.000 . 6.900 5.578 4.564 6.703 . 0 0 "[ . 1 . 2]" 1
215 1 96 ARG HD2 1 97 ASP H 6.000 . 6.900 5.873 4.456 7.016 0.116 15 0 "[ . 1 . 2]" 1
216 1 96 ARG HD3 1 97 ASP H 6.000 . 6.900 5.642 4.266 6.993 0.093 6 0 "[ . 1 . 2]" 1
217 1 97 ASP HA 1 98 ASP H 2.800 . 3.220 2.189 2.119 2.249 . 0 0 "[ . 1 . 2]" 1
218 1 98 ASP HA 1 99 THR H 3.150 . 3.620 2.130 2.079 2.176 . 0 0 "[ . 1 . 2]" 1
219 1 98 ASP HB2 1 99 THR H 5.040 . 5.800 4.356 4.147 4.499 . 0 0 "[ . 1 . 2]" 1
220 1 98 ASP HB3 1 99 THR H 5.040 . 5.800 4.321 3.757 4.431 . 0 0 "[ . 1 . 2]" 1
221 1 99 THR HA 1 100 GLU H 3.290 . 3.780 2.165 2.086 2.279 . 0 0 "[ . 1 . 2]" 1
222 1 99 THR HB 1 100 GLU H 5.440 . 6.260 4.320 4.087 4.520 . 0 0 "[ . 1 . 2]" 1
223 1 100 GLU H 1 101 PHE H 4.610 . 5.300 4.253 4.180 4.510 . 0 0 "[ . 1 . 2]" 1
224 1 100 GLU HA 1 101 PHE H 3.330 . 3.830 2.187 2.142 2.302 . 0 0 "[ . 1 . 2]" 1
225 1 100 GLU HB2 1 101 PHE H 4.370 . 5.030 4.397 4.034 4.570 . 0 0 "[ . 1 . 2]" 1
226 1 100 GLU HB3 1 101 PHE H 4.390 . 5.050 4.393 3.966 4.497 . 0 0 "[ . 1 . 2]" 1
227 1 100 GLU HG3 1 101 PHE H 4.060 . 4.670 3.620 2.870 4.037 . 0 0 "[ . 1 . 2]" 1
228 1 101 PHE HA 1 102 GLN H 3.250 . 3.740 2.141 2.112 2.169 . 0 0 "[ . 1 . 2]" 1
229 1 101 PHE HB3 1 102 GLN H 4.120 . 4.740 3.411 3.195 3.522 . 0 0 "[ . 1 . 2]" 1
230 1 100 GLU HG2 1 102 GLN H 5.460 . 6.280 4.243 3.843 4.722 . 0 0 "[ . 1 . 2]" 1
231 1 101 PHE QD 1 102 GLN H 4.380 . 5.040 4.105 3.920 4.274 . 0 0 "[ . 1 . 2]" 1
232 1 102 GLN HB3 1 103 HIS H 4.690 . 5.390 4.046 3.925 4.187 . 0 0 "[ . 1 . 2]" 1
233 1 102 GLN HB2 1 103 HIS H 4.450 . 5.120 2.970 2.832 3.136 . 0 0 "[ . 1 . 2]" 1
234 1 102 GLN HG3 1 103 HIS H 4.510 . 5.190 4.208 3.885 4.498 . 0 0 "[ . 1 . 2]" 1
235 1 103 HIS HB3 1 105 CYS H 6.000 . 6.900 3.891 3.586 4.438 . 0 0 "[ . 1 . 2]" 1
236 1 105 CYS H 1 106 PHE H 3.330 . 3.830 2.580 2.421 2.843 . 0 0 "[ . 1 . 2]" 1
237 1 105 CYS HB3 1 106 PHE H 4.480 . 5.150 4.474 4.169 4.562 . 0 0 "[ . 1 . 2]" 1
238 1 106 PHE HB3 1 107 LEU H 4.990 . 5.740 4.482 4.427 4.533 . 0 0 "[ . 1 . 2]" 1
239 1 106 PHE HB2 1 107 LEU H 6.000 . 6.900 4.554 4.388 4.621 . 0 0 "[ . 1 . 2]" 1
240 1 107 LEU HA 1 108 ARG H 3.490 . 4.010 2.340 2.150 2.602 . 0 0 "[ . 1 . 2]" 1
241 1 107 LEU HB3 1 108 ARG H 4.290 . 4.930 2.800 2.181 3.843 . 0 0 "[ . 1 . 2]" 1
242 1 107 LEU HB2 1 108 ARG H 4.370 . 5.030 3.779 3.241 4.433 . 0 0 "[ . 1 . 2]" 1
243 1 107 LEU HG 1 108 ARG H 5.010 . 5.760 5.076 4.785 5.363 . 0 0 "[ . 1 . 2]" 1
244 1 107 LEU MD1 1 108 ARG H 4.710 . 5.420 4.758 4.298 5.509 0.089 9 0 "[ . 1 . 2]" 1
245 1 107 LEU MD2 1 108 ARG H 3.900 . 4.490 3.708 3.412 3.970 . 0 0 "[ . 1 . 2]" 1
246 1 110 GLN HA 1 111 GLU H 3.220 . 3.700 2.491 2.221 2.818 . 0 0 "[ . 1 . 2]" 1
247 1 110 GLN HB3 1 111 GLU H 4.670 . 5.370 4.292 4.082 4.446 . 0 0 "[ . 1 . 2]" 1
248 1 110 GLN HB2 1 111 GLU H 4.670 . 5.370 4.567 4.392 4.676 . 0 0 "[ . 1 . 2]" 1
249 1 111 GLU HG2 1 112 GLN H 4.150 . 4.770 3.212 2.826 4.905 0.135 4 0 "[ . 1 . 2]" 1
250 1 111 GLU HG3 1 112 GLN H 4.150 . 4.770 3.281 2.224 4.871 0.101 4 0 "[ . 1 . 2]" 1
251 1 111 GLU HA 1 113 LEU H 5.220 . 6.000 3.700 3.271 4.128 . 0 0 "[ . 1 . 2]" 1
252 1 113 LEU H 1 114 LEU H 3.450 . 3.970 2.381 2.181 2.518 . 0 0 "[ . 1 . 2]" 1
253 1 113 LEU HB2 1 114 LEU H 3.560 . 4.090 3.398 3.181 3.587 . 0 0 "[ . 1 . 2]" 1
254 1 113 LEU HB3 1 114 LEU H 4.240 . 4.880 4.140 3.958 4.297 . 0 0 "[ . 1 . 2]" 1
255 1 113 LEU MD2 1 114 LEU H 4.970 . 5.720 4.739 4.630 4.819 . 0 0 "[ . 1 . 2]" 1
256 1 113 LEU MD1 1 114 LEU H 5.190 . 5.970 5.260 5.063 5.429 . 0 0 "[ . 1 . 2]" 1
257 1 114 LEU HB2 1 115 GLU H 4.130 . 4.750 2.787 2.589 3.093 . 0 0 "[ . 1 . 2]" 1
258 1 114 LEU HB3 1 115 GLU H 3.750 . 4.310 3.804 3.556 4.100 . 0 0 "[ . 1 . 2]" 1
259 1 114 LEU MD2 1 115 GLU H 4.830 . 5.550 4.718 4.560 4.823 . 0 0 "[ . 1 . 2]" 1
260 1 114 LEU MD1 1 115 GLU H 4.440 . 5.110 4.678 4.511 4.938 . 0 0 "[ . 1 . 2]" 1
261 1 115 GLU HB2 1 116 ASN H 3.960 . 4.550 4.215 4.067 4.340 . 0 0 "[ . 1 . 2]" 1
262 1 116 ASN H 1 117 ILE H 3.090 . 3.550 2.197 2.103 2.365 . 0 0 "[ . 1 . 2]" 1
263 1 116 ASN HB2 1 117 ILE H 4.250 . 4.890 3.386 3.068 3.739 . 0 0 "[ . 1 . 2]" 1
264 1 116 ASN HB3 1 117 ILE H 4.250 . 4.890 4.172 4.014 4.283 . 0 0 "[ . 1 . 2]" 1
265 1 117 ILE HA 1 118 LYS H 2.960 . 3.400 2.241 2.170 2.523 . 0 0 "[ . 1 . 2]" 1
266 1 117 ILE MG 1 118 LYS H 3.410 . 3.920 3.021 2.553 3.934 0.014 3 0 "[ . 1 . 2]" 1
267 1 117 ILE HG13 1 118 LYS H 5.020 . 5.770 5.248 5.128 5.328 . 0 0 "[ . 1 . 2]" 1
268 1 117 ILE HG12 1 118 LYS H 4.560 . 5.240 4.773 4.527 5.199 . 0 0 "[ . 1 . 2]" 1
269 1 117 ILE MD 1 118 LYS H 5.390 . 6.200 5.388 5.109 5.775 . 0 0 "[ . 1 . 2]" 1
270 1 118 LYS HA 1 119 ARG H 2.940 . 3.380 2.245 2.167 2.476 . 0 0 "[ . 1 . 2]" 1
271 1 118 LYS HB2 1 119 ARG H 3.890 . 4.470 3.717 2.215 4.121 . 0 0 "[ . 1 . 2]" 1
272 1 118 LYS HB3 1 119 ARG H 3.890 . 4.470 3.025 2.398 3.592 . 0 0 "[ . 1 . 2]" 1
273 1 118 LYS HG3 1 119 ARG H 5.150 . 5.920 5.213 4.725 5.551 . 0 0 "[ . 1 . 2]" 1
274 1 119 ARG H 1 120 LYS H 4.000 . 4.600 2.462 1.820 4.478 . 0 0 "[ . 1 . 2]" 1
275 1 119 ARG HB2 1 120 LYS H 3.820 . 4.390 3.825 2.164 4.469 0.079 4 0 "[ . 1 . 2]" 1
276 1 120 LYS H 1 121 VAL H 4.600 . 5.290 4.381 4.082 4.602 . 0 0 "[ . 1 . 2]" 1
277 1 120 LYS HA 1 121 VAL H 2.620 . 3.010 2.498 2.143 2.903 . 0 0 "[ . 1 . 2]" 1
278 1 120 LYS HB2 1 121 VAL H 3.700 . 4.260 3.288 2.036 4.027 . 0 0 "[ . 1 . 2]" 1
279 1 120 LYS HB3 1 121 VAL H 3.700 . 4.260 2.657 1.831 3.951 . 0 0 "[ . 1 . 2]" 1
280 1 121 VAL H 1 122 THR H 2.940 . 3.380 2.786 2.123 3.759 0.379 9 0 "[ . 1 . 2]" 1
281 1 123 SER H 1 124 VAL H 4.580 . 5.270 3.913 2.541 4.529 . 0 0 "[ . 1 . 2]" 1
282 1 123 SER HA 1 124 VAL H 3.000 . 3.450 2.422 2.159 2.973 . 0 0 "[ . 1 . 2]" 1
283 1 123 SER HB2 1 124 VAL H 4.970 . 5.720 4.067 1.949 4.659 . 0 0 "[ . 1 . 2]" 1
284 1 123 SER HB3 1 124 VAL H 4.970 . 5.720 4.049 2.894 4.676 . 0 0 "[ . 1 . 2]" 1
285 1 124 VAL H 1 125 SER H 4.490 . 5.160 4.228 2.480 4.652 . 0 0 "[ . 1 . 2]" 1
286 1 124 VAL HA 1 125 SER H 2.810 . 3.230 2.304 2.145 3.134 . 0 0 "[ . 1 . 2]" 1
287 1 124 VAL HB 1 125 SER H 4.240 . 4.880 3.840 1.896 4.490 . 0 0 "[ . 1 . 2]" 1
288 1 124 VAL MG1 1 125 SER H 4.620 . 5.310 3.775 2.189 4.374 . 0 0 "[ . 1 . 2]" 1
289 1 124 VAL MG2 1 125 SER H 4.620 . 5.310 3.523 2.194 4.419 . 0 0 "[ . 1 . 2]" 1
290 1 16 ASN HA 1 16 ASN HD22 4.380 . 5.040 4.218 3.572 4.975 . 0 0 "[ . 1 . 2]" 1
291 1 76 ASN HA 1 76 ASN HD21 4.530 . 5.210 3.926 1.947 4.529 . 0 0 "[ . 1 . 2]" 1
292 1 76 ASN HA 1 76 ASN HD22 4.530 . 5.210 4.381 3.574 4.798 . 0 0 "[ . 1 . 2]" 1
293 1 76 ASN HB2 1 76 ASN HD22 4.090 . 4.700 3.543 3.476 4.082 . 0 0 "[ . 1 . 2]" 1
294 1 116 ASN HA 1 116 ASN HD22 4.250 . 4.890 4.254 3.911 4.429 . 0 0 "[ . 1 . 2]" 1
295 1 116 ASN H 1 116 ASN HD21 3.980 . 4.580 2.374 1.922 2.691 . 0 0 "[ . 1 . 2]" 1
296 1 51 GLN HA 1 51 GLN HE21 5.040 . 5.800 4.550 4.046 5.039 . 0 0 "[ . 1 . 2]" 1
297 1 51 GLN HB2 1 51 GLN HE21 4.370 . 5.030 4.192 2.839 4.557 . 0 0 "[ . 1 . 2]" 1
298 1 51 GLN HB3 1 51 GLN HE21 4.580 . 5.270 3.523 2.032 4.490 . 0 0 "[ . 1 . 2]" 1
299 1 51 GLN HA 1 51 GLN HE22 5.770 . 6.640 5.461 4.088 6.034 . 0 0 "[ . 1 . 2]" 1
300 1 51 GLN HB2 1 51 GLN HE22 4.840 . 5.570 4.735 3.821 5.393 . 0 0 "[ . 1 . 2]" 1
301 1 51 GLN HB3 1 51 GLN HE22 5.030 . 5.780 4.213 3.617 4.742 . 0 0 "[ . 1 . 2]" 1
302 1 53 GLN HA 1 53 GLN HE21 4.870 . 5.600 4.104 2.946 4.339 . 0 0 "[ . 1 . 2]" 1
303 1 53 GLN HE21 1 57 GLU HG2 3.600 . 4.140 2.757 2.122 3.083 . 0 0 "[ . 1 . 2]" 1
304 1 53 GLN HE21 1 53 GLN HG2 3.210 . 3.690 2.965 2.866 3.488 . 0 0 "[ . 1 . 2]" 1
305 1 53 GLN HE21 1 53 GLN HG3 3.220 . 3.700 2.261 2.220 2.312 . 0 0 "[ . 1 . 2]" 1
306 1 53 GLN HA 1 53 GLN HE22 5.190 . 5.970 4.172 3.698 4.367 . 0 0 "[ . 1 . 2]" 1
307 1 53 GLN HE22 1 57 GLU HG2 4.010 . 4.610 3.852 3.026 4.117 . 0 0 "[ . 1 . 2]" 1
308 1 53 GLN HE22 1 53 GLN HG2 3.890 . 4.470 3.800 3.751 4.052 . 0 0 "[ . 1 . 2]" 1
309 1 53 GLN HE22 1 53 GLN HG3 3.680 . 4.230 3.508 3.491 3.530 . 0 0 "[ . 1 . 2]" 1
310 1 74 GLN HA 1 74 GLN HE21 4.970 . 5.720 3.661 2.710 4.958 . 0 0 "[ . 1 . 2]" 1
311 1 74 GLN HE21 1 77 MET ME 4.520 . 5.200 3.560 2.696 4.845 . 0 0 "[ . 1 . 2]" 1
312 1 74 GLN HA 1 74 GLN HE22 4.970 . 5.720 3.867 3.309 4.910 . 0 0 "[ . 1 . 2]" 1
313 1 74 GLN HE22 1 77 MET ME 4.520 . 5.200 2.849 2.235 4.210 . 0 0 "[ . 1 . 2]" 1
314 1 102 GLN HB3 1 102 GLN HE22 4.560 . 5.240 4.619 3.946 4.845 . 0 0 "[ . 1 . 2]" 1
315 1 102 GLN HE22 1 102 GLN HG2 3.840 . 4.420 3.627 3.487 3.823 . 0 0 "[ . 1 . 2]" 1
316 1 110 GLN HA 1 110 GLN HE21 5.080 . 5.840 4.206 3.013 5.122 . 0 0 "[ . 1 . 2]" 1
317 1 110 GLN HA 1 110 GLN HE22 5.080 . 5.840 4.527 3.623 5.571 . 0 0 "[ . 1 . 2]" 1
318 1 112 GLN H 1 112 GLN HE22 5.070 . 5.830 4.441 3.304 5.854 0.024 2 0 "[ . 1 . 2]" 1
319 1 112 GLN HE22 1 112 GLN HG2 4.010 . 4.610 3.714 3.491 3.797 . 0 0 "[ . 1 . 2]" 1
320 1 112 GLN HE22 1 112 GLN HG3 4.010 . 4.610 3.567 3.486 4.038 . 0 0 "[ . 1 . 2]" 1
321 1 96 ARG HB2 1 96 ARG HE 4.900 . 5.640 3.689 1.866 4.435 . 0 0 "[ . 1 . 2]" 1
322 1 12 ALA H 1 12 ALA MB 3.170 . 3.650 2.453 2.225 2.872 . 0 0 "[ . 1 . 2]" 1
323 1 14 PRO HA 1 15 SER H 2.800 . 3.220 2.442 2.140 3.293 0.073 12 0 "[ . 1 . 2]" 1
324 1 15 SER H 1 15 SER HB2 3.610 . 4.150 2.949 2.358 4.059 . 0 0 "[ . 1 . 2]" 1
325 1 15 SER H 1 15 SER HB3 3.610 . 4.150 2.915 2.459 3.589 . 0 0 "[ . 1 . 2]" 1
326 1 16 ASN H 1 16 ASN HB3 4.120 . 4.740 3.685 2.973 4.157 . 0 0 "[ . 1 . 2]" 1
327 1 17 VAL H 1 17 VAL HB 2.890 . 3.320 2.572 2.471 2.706 . 0 0 "[ . 1 . 2]" 1
328 1 17 VAL H 1 17 VAL MG2 2.930 . 3.370 2.068 1.914 2.209 . 0 0 "[ . 1 . 2]" 1
329 1 19 ALA H 1 19 ALA MB 2.730 . 3.140 2.232 2.208 2.281 . 0 0 "[ . 1 . 2]" 1
330 1 20 PHE H 1 20 PHE HB2 3.180 . 3.660 2.464 2.377 2.557 . 0 0 "[ . 1 . 2]" 1
331 1 20 PHE H 1 20 PHE HB3 3.280 . 3.770 2.610 2.561 2.724 . 0 0 "[ . 1 . 2]" 1
332 1 20 PHE H 1 20 PHE QD 4.210 . 4.840 4.220 4.185 4.260 . 0 0 "[ . 1 . 2]" 1
333 1 21 LEU H 1 21 LEU HB3 3.640 . 4.190 3.637 3.619 3.664 . 0 0 "[ . 1 . 2]" 1
334 1 21 LEU H 1 21 LEU HB2 3.500 . 4.030 2.429 2.399 2.475 . 0 0 "[ . 1 . 2]" 1
335 1 21 LEU H 1 21 LEU HG 3.450 . 3.970 2.710 2.532 2.862 . 0 0 "[ . 1 . 2]" 1
336 1 21 LEU H 1 21 LEU MD1 4.010 . 4.610 3.848 3.697 4.011 . 0 0 "[ . 1 . 2]" 1
337 1 21 LEU H 1 21 LEU MD2 3.670 . 4.220 3.616 3.543 3.719 . 0 0 "[ . 1 . 2]" 1
338 1 23 LYS H 1 23 LYS HG2 4.440 . 5.110 2.620 2.268 3.429 . 0 0 "[ . 1 . 2]" 1
339 1 24 LEU H 1 24 LEU HB2 3.630 . 4.170 2.515 2.451 2.580 . 0 0 "[ . 1 . 2]" 1
340 1 24 LEU H 1 24 LEU HB3 3.630 . 4.170 2.514 2.431 2.571 . 0 0 "[ . 1 . 2]" 1
341 1 24 LEU H 1 24 LEU HG 4.670 . 5.370 4.520 4.462 4.552 . 0 0 "[ . 1 . 2]" 1
342 1 24 LEU H 1 24 LEU MD2 4.440 . 5.110 4.309 4.264 4.337 . 0 0 "[ . 1 . 2]" 1
343 1 24 LEU H 1 24 LEU MD1 4.240 . 4.880 4.163 4.102 4.219 . 0 0 "[ . 1 . 2]" 1
344 1 25 TRP H 1 25 TRP HB2 3.940 . 4.530 2.581 2.349 3.627 . 0 0 "[ . 1 . 2]" 1
345 1 25 TRP H 1 25 TRP HB3 3.940 . 4.530 2.525 2.383 2.813 . 0 0 "[ . 1 . 2]" 1
346 1 27 LEU H 1 27 LEU HB2 3.620 . 4.160 2.574 2.380 2.676 . 0 0 "[ . 1 . 2]" 1
347 1 27 LEU H 1 27 LEU HB3 3.620 . 4.160 2.285 2.207 2.400 . 0 0 "[ . 1 . 2]" 1
348 1 27 LEU H 1 27 LEU HG 4.420 . 5.080 4.361 4.298 4.448 . 0 0 "[ . 1 . 2]" 1
349 1 27 LEU H 1 27 LEU MD1 4.240 . 4.880 4.163 4.054 4.211 . 0 0 "[ . 1 . 2]" 1
350 1 24 LEU MD1 1 27 LEU H 4.850 . 5.580 4.631 4.440 4.881 . 0 0 "[ . 1 . 2]" 1
351 1 28 VAL H 1 28 VAL HB 3.730 . 4.290 2.493 2.291 2.716 . 0 0 "[ . 1 . 2]" 1
352 1 28 VAL H 1 28 VAL MG1 4.280 . 4.920 3.770 3.705 3.808 . 0 0 "[ . 1 . 2]" 1
353 1 30 ASP H 1 30 ASP HB3 3.350 . 3.850 2.505 2.408 2.767 . 0 0 "[ . 1 . 2]" 1
354 1 30 ASP H 1 30 ASP HB2 3.380 . 3.890 2.658 2.447 2.763 . 0 0 "[ . 1 . 2]" 1
355 1 32 ASP H 1 32 ASP HB2 3.060 . 3.520 2.728 2.521 2.841 . 0 0 "[ . 1 . 2]" 1
356 1 32 ASP H 1 32 ASP HB3 3.060 . 3.520 2.499 2.356 3.632 0.112 11 0 "[ . 1 . 2]" 1
357 1 33 THR H 1 33 THR MG 3.240 . 3.730 2.877 2.774 3.011 . 0 0 "[ . 1 . 2]" 1
358 1 34 ASP H 1 34 ASP HB2 3.710 . 4.270 3.038 2.091 3.664 . 0 0 "[ . 1 . 2]" 1
359 1 34 ASP H 1 34 ASP HB3 3.710 . 4.270 2.484 2.320 3.340 . 0 0 "[ . 1 . 2]" 1
360 1 35 ALA H 1 35 ALA MB 2.470 . 2.840 2.239 2.208 2.261 . 0 0 "[ . 1 . 2]" 1
361 1 36 LEU H 1 36 LEU HB2 3.810 . 4.380 2.584 2.493 2.685 . 0 0 "[ . 1 . 2]" 1
362 1 36 LEU H 1 36 LEU HB3 4.100 . 4.720 3.746 3.685 3.805 . 0 0 "[ . 1 . 2]" 1
363 1 36 LEU H 1 36 LEU HG 4.010 . 4.610 2.978 2.849 3.111 . 0 0 "[ . 1 . 2]" 1
364 1 36 LEU H 1 36 LEU MD2 3.860 . 4.440 3.632 3.394 3.771 . 0 0 "[ . 1 . 2]" 1
365 1 36 LEU H 1 36 LEU MD1 4.440 . 5.110 4.137 4.031 4.279 . 0 0 "[ . 1 . 2]" 1
366 1 36 LEU HB2 1 37 ILE H 3.700 . 4.260 3.334 3.111 3.470 . 0 0 "[ . 1 . 2]" 1
367 1 37 ILE H 1 37 ILE HB 4.200 . 4.830 3.479 3.396 3.541 . 0 0 "[ . 1 . 2]" 1
368 1 37 ILE H 1 37 ILE MG 3.040 . 3.500 2.541 2.483 2.596 . 0 0 "[ . 1 . 2]" 1
369 1 36 LEU HB3 1 37 ILE H 4.120 . 4.740 4.156 4.025 4.261 . 0 0 "[ . 1 . 2]" 1
370 1 38 CYS HB3 1 39 TRP H 4.020 . 4.620 3.871 3.648 4.110 . 0 0 "[ . 1 . 2]" 1
371 1 39 TRP H 1 39 TRP HB3 3.980 . 4.580 2.985 2.806 3.634 . 0 0 "[ . 1 . 2]" 1
372 1 40 SER H 1 40 SER HB2 4.060 . 4.670 2.712 2.442 3.599 . 0 0 "[ . 1 . 2]" 1
373 1 40 SER H 1 40 SER HB3 4.060 . 4.670 3.402 2.670 3.618 . 0 0 "[ . 1 . 2]" 1
374 1 44 ASN H 1 44 ASN HB2 3.720 . 4.280 3.023 2.448 4.057 . 0 0 "[ . 1 . 2]" 1
375 1 44 ASN H 1 44 ASN HB3 3.720 . 4.280 3.417 2.773 3.733 . 0 0 "[ . 1 . 2]" 1
376 1 47 HIS H 1 47 HIS HB2 4.110 . 4.730 2.488 2.397 2.572 . 0 0 "[ . 1 . 2]" 1
377 1 47 HIS H 1 47 HIS HD2 4.220 . 4.850 2.902 2.747 3.122 . 0 0 "[ . 1 . 2]" 1
378 1 48 VAL H 1 48 VAL HB 3.640 . 4.190 2.723 2.604 2.816 . 0 0 "[ . 1 . 2]" 1
379 1 48 VAL H 1 48 VAL MG2 3.380 . 3.890 2.850 2.734 2.932 . 0 0 "[ . 1 . 2]" 1
380 1 48 VAL H 1 48 VAL MG1 4.000 . 4.600 3.907 3.853 3.948 . 0 0 "[ . 1 . 2]" 1
381 1 49 PHE H 1 49 PHE QD 4.530 . 5.210 2.929 2.602 3.495 . 0 0 "[ . 1 . 2]" 1
382 1 50 ASP H 1 50 ASP HB2 3.720 . 4.280 3.450 2.946 3.604 . 0 0 "[ . 1 . 2]" 1
383 1 51 GLN H 1 51 GLN HB2 3.430 . 3.940 2.569 2.411 2.810 . 0 0 "[ . 1 . 2]" 1
384 1 51 GLN H 1 51 GLN HG2 3.720 . 4.280 3.040 1.964 3.452 . 0 0 "[ . 1 . 2]" 1
385 1 51 GLN H 1 51 GLN HG3 3.720 . 4.280 2.548 1.962 3.699 . 0 0 "[ . 1 . 2]" 1
386 1 53 GLN H 1 53 GLN HB3 2.960 . 3.400 2.509 2.241 2.579 . 0 0 "[ . 1 . 2]" 1
387 1 54 PHE H 1 54 PHE HB2 3.460 . 3.980 2.518 2.406 2.677 . 0 0 "[ . 1 . 2]" 1
388 1 54 PHE H 1 54 PHE HB3 3.540 . 4.070 2.395 2.262 2.507 . 0 0 "[ . 1 . 2]" 1
389 1 54 PHE H 1 54 PHE QD 3.940 . 4.530 4.184 4.125 4.202 . 0 0 "[ . 1 . 2]" 1
390 1 55 ALA H 1 55 ALA MB 2.780 . 3.200 2.239 2.197 2.272 . 0 0 "[ . 1 . 2]" 1
391 1 56 LYS H 1 56 LYS HB3 3.050 . 3.510 2.228 2.130 2.267 . 0 0 "[ . 1 . 2]" 1
392 1 56 LYS H 1 56 LYS HB2 3.330 . 3.830 2.750 2.569 2.884 . 0 0 "[ . 1 . 2]" 1
393 1 56 LYS H 1 56 LYS HG2 4.260 . 4.900 4.463 4.318 4.510 . 0 0 "[ . 1 . 2]" 1
394 1 57 GLU H 1 57 GLU HB3 3.260 . 3.750 3.099 2.990 3.228 . 0 0 "[ . 1 . 2]" 1
395 1 58 VAL H 1 58 VAL HB 3.230 . 3.710 2.439 2.360 2.497 . 0 0 "[ . 1 . 2]" 1
396 1 58 VAL H 1 58 VAL MG2 3.100 . 3.570 2.342 2.245 2.461 . 0 0 "[ . 1 . 2]" 1
397 1 59 LEU H 1 59 LEU HB2 3.650 . 4.200 2.479 2.420 2.560 . 0 0 "[ . 1 . 2]" 1
398 1 59 LEU H 1 59 LEU HB3 3.940 . 4.530 3.647 3.630 3.682 . 0 0 "[ . 1 . 2]" 1
399 1 59 LEU H 1 59 LEU HG 3.530 . 4.060 2.599 2.500 2.763 . 0 0 "[ . 1 . 2]" 1
400 1 61 LYS H 1 61 LYS HB2 3.190 . 3.670 2.571 2.444 2.680 . 0 0 "[ . 1 . 2]" 1
401 1 61 LYS H 1 61 LYS HG3 4.250 . 4.890 4.531 4.476 4.590 . 0 0 "[ . 1 . 2]" 1
402 1 58 VAL MG1 1 61 LYS H 4.200 . 4.830 4.683 4.587 4.760 . 0 0 "[ . 1 . 2]" 1
403 1 61 LYS H 1 61 LYS HB3 3.170 . 3.650 2.495 2.357 2.573 . 0 0 "[ . 1 . 2]" 1
404 1 62 TYR H 1 62 TYR HB3 3.710 . 4.270 3.649 3.601 3.702 . 0 0 "[ . 1 . 2]" 1
405 1 62 TYR H 1 62 TYR HB2 3.630 . 4.170 2.395 2.314 2.485 . 0 0 "[ . 1 . 2]" 1
406 1 63 PHE H 1 63 PHE QD 3.820 . 4.390 2.802 2.370 3.343 . 0 0 "[ . 1 . 2]" 1
407 1 64 LYS H 1 64 LYS HG3 4.180 . 4.810 3.347 1.959 4.686 . 0 0 "[ . 1 . 2]" 1
408 1 64 LYS H 1 64 LYS HD2 5.410 . 6.220 4.600 2.505 5.835 . 0 0 "[ . 1 . 2]" 1
409 1 64 LYS H 1 64 LYS HD3 5.410 . 6.220 4.572 2.758 5.591 . 0 0 "[ . 1 . 2]" 1
410 1 65 HIS HB3 1 66 ASN H 4.160 . 4.780 3.872 3.774 3.998 . 0 0 "[ . 1 . 2]" 1
411 1 68 MET H 1 68 MET HB2 3.820 . 4.390 2.649 2.455 2.856 . 0 0 "[ . 1 . 2]" 1
412 1 68 MET H 1 68 MET HB3 3.900 . 4.490 2.560 2.338 2.710 . 0 0 "[ . 1 . 2]" 1
413 1 69 ALA H 1 69 ALA MB 2.550 . 2.930 2.240 2.207 2.261 . 0 0 "[ . 1 . 2]" 1
414 1 70 SER H 1 70 SER HB3 3.280 . 3.770 2.487 2.436 2.548 . 0 0 "[ . 1 . 2]" 1
415 1 70 SER H 1 70 SER HB2 3.400 . 3.910 2.546 2.465 2.629 . 0 0 "[ . 1 . 2]" 1
416 1 71 PHE H 1 71 PHE HB2 4.030 . 4.630 2.632 2.597 2.682 . 0 0 "[ . 1 . 2]" 1
417 1 71 PHE H 1 71 PHE HB3 4.030 . 4.630 2.373 2.322 2.438 . 0 0 "[ . 1 . 2]" 1
418 1 72 VAL H 1 72 VAL HB 3.130 . 3.600 2.552 2.483 2.619 . 0 0 "[ . 1 . 2]" 1
419 1 72 VAL H 1 72 VAL MG1 3.780 . 4.350 3.793 3.765 3.813 . 0 0 "[ . 1 . 2]" 1
420 1 73 ARG H 1 73 ARG HB2 3.030 . 3.480 2.571 2.419 2.731 . 0 0 "[ . 1 . 2]" 1
421 1 73 ARG H 1 73 ARG HB3 3.030 . 3.480 2.535 2.371 2.646 . 0 0 "[ . 1 . 2]" 1
422 1 73 ARG H 1 73 ARG HG3 4.500 . 5.180 4.535 4.459 4.613 . 0 0 "[ . 1 . 2]" 1
423 1 74 GLN H 1 74 GLN HB3 3.760 . 4.320 3.632 3.589 3.669 . 0 0 "[ . 1 . 2]" 1
424 1 74 GLN H 1 74 GLN HB2 3.050 . 3.510 2.562 2.392 2.671 . 0 0 "[ . 1 . 2]" 1
425 1 74 GLN H 1 74 GLN HG3 3.610 . 4.150 3.732 3.503 3.826 . 0 0 "[ . 1 . 2]" 1
426 1 74 GLN H 1 74 GLN HG2 3.060 . 3.520 2.308 2.159 2.485 . 0 0 "[ . 1 . 2]" 1
427 1 75 LEU H 1 75 LEU HB3 3.790 . 4.360 3.571 3.538 3.599 . 0 0 "[ . 1 . 2]" 1
428 1 75 LEU H 1 75 LEU HB2 3.590 . 4.130 2.428 2.363 2.482 . 0 0 "[ . 1 . 2]" 1
429 1 75 LEU H 1 75 LEU HG 3.290 . 3.780 2.302 2.178 2.480 . 0 0 "[ . 1 . 2]" 1
430 1 75 LEU H 1 75 LEU MD1 3.740 . 4.300 3.501 3.296 3.677 . 0 0 "[ . 1 . 2]" 1
431 1 75 LEU H 1 75 LEU MD2 3.770 . 4.340 3.474 3.280 3.663 . 0 0 "[ . 1 . 2]" 1
432 1 76 ASN H 1 76 ASN HB3 3.560 . 4.090 3.632 3.569 3.668 . 0 0 "[ . 1 . 2]" 1
433 1 76 ASN H 1 76 ASN HB2 2.950 . 3.390 2.499 2.294 2.661 . 0 0 "[ . 1 . 2]" 1
434 1 77 MET H 1 77 MET HB2 3.210 . 3.690 2.521 2.432 2.617 . 0 0 "[ . 1 . 2]" 1
435 1 77 MET H 1 77 MET HG2 3.930 . 4.520 3.476 3.271 3.768 . 0 0 "[ . 1 . 2]" 1
436 1 78 TYR H 1 78 TYR HB2 3.480 . 4.000 2.362 2.283 2.455 . 0 0 "[ . 1 . 2]" 1
437 1 78 TYR H 1 78 TYR QD 3.500 . 4.030 3.217 2.976 3.422 . 0 0 "[ . 1 . 2]" 1
438 1 80 PHE H 1 80 PHE HB2 3.510 . 4.040 2.394 2.341 2.430 . 0 0 "[ . 1 . 2]" 1
439 1 80 PHE H 1 80 PHE HB3 3.850 . 4.430 3.620 3.596 3.647 . 0 0 "[ . 1 . 2]" 1
440 1 80 PHE H 1 80 PHE QD 3.260 . 3.750 2.309 2.111 2.635 . 0 0 "[ . 1 . 2]" 1
441 1 81 ARG H 1 81 ARG HB3 3.680 . 4.230 2.520 2.295 2.686 . 0 0 "[ . 1 . 2]" 1
442 1 81 ARG H 1 81 ARG HB2 3.590 . 4.130 2.864 2.734 3.025 . 0 0 "[ . 1 . 2]" 1
443 1 81 ARG H 1 81 ARG HG2 5.250 . 6.040 4.507 4.245 4.765 . 0 0 "[ . 1 . 2]" 1
444 1 81 ARG H 1 81 ARG HG3 5.250 . 6.040 4.611 4.257 4.746 . 0 0 "[ . 1 . 2]" 1
445 1 82 LYS H 1 82 LYS HB3 3.160 . 3.630 2.389 2.225 2.664 . 0 0 "[ . 1 . 2]" 1
446 1 82 LYS H 1 82 LYS HG2 4.820 . 5.540 4.496 4.415 4.610 . 0 0 "[ . 1 . 2]" 1
447 1 82 LYS H 1 82 LYS HG3 4.820 . 5.540 4.439 4.245 4.640 . 0 0 "[ . 1 . 2]" 1
448 1 82 LYS H 1 82 LYS HB2 3.160 . 3.630 2.564 2.394 2.794 . 0 0 "[ . 1 . 2]" 1
449 1 83 VAL H 1 83 VAL HB 3.320 . 3.820 2.719 2.626 2.808 . 0 0 "[ . 1 . 2]" 1
450 1 83 VAL H 1 83 VAL MG2 3.350 . 3.850 2.779 2.569 2.924 . 0 0 "[ . 1 . 2]" 1
451 1 84 VAL H 1 84 VAL HB 3.440 . 3.960 2.805 2.423 3.144 . 0 0 "[ . 1 . 2]" 1
452 1 84 VAL H 1 84 VAL MG1 3.940 . 4.530 2.955 1.966 3.907 . 0 0 "[ . 1 . 2]" 1
453 1 84 VAL H 1 84 VAL MG2 3.940 . 4.530 3.161 2.145 3.922 . 0 0 "[ . 1 . 2]" 1
454 1 85 HIS H 1 85 HIS HB2 3.870 . 4.450 2.544 2.407 2.844 . 0 0 "[ . 1 . 2]" 1
455 1 85 HIS H 1 85 HIS HB3 3.870 . 4.450 3.725 3.645 3.891 . 0 0 "[ . 1 . 2]" 1
456 1 85 HIS H 1 85 HIS HD2 5.110 . 5.880 3.054 2.396 5.145 . 0 0 "[ . 1 . 2]" 1
457 1 86 ILE H 1 86 ILE HB 3.310 . 3.810 2.539 2.397 2.867 . 0 0 "[ . 1 . 2]" 1
458 1 86 ILE H 1 86 ILE MG 3.830 . 4.400 3.843 3.788 3.983 . 0 0 "[ . 1 . 2]" 1
459 1 86 ILE H 1 86 ILE HG12 3.880 . 4.460 2.583 2.259 3.020 . 0 0 "[ . 1 . 2]" 1
460 1 86 ILE H 1 86 ILE HG13 3.880 . 4.460 3.949 3.684 4.289 . 0 0 "[ . 1 . 2]" 1
461 1 87 GLU H 1 87 GLU HB3 3.730 . 4.290 3.529 2.445 3.770 . 0 0 "[ . 1 . 2]" 1
462 1 87 GLU H 1 87 GLU HB2 3.010 . 3.460 2.544 2.264 3.240 . 0 0 "[ . 1 . 2]" 1
463 1 87 GLU H 1 87 GLU HG2 4.660 . 5.360 3.627 2.528 4.572 . 0 0 "[ . 1 . 2]" 1
464 1 87 GLU H 1 87 GLU HG3 4.660 . 5.360 2.794 2.064 4.733 . 0 0 "[ . 1 . 2]" 1
465 1 87 GLU HA 1 88 GLN H 2.560 . 2.940 2.200 2.119 2.431 . 0 0 "[ . 1 . 2]" 1
466 1 88 GLN H 1 88 GLN HB2 3.660 . 4.210 2.597 2.383 3.641 . 0 0 "[ . 1 . 2]" 1
467 1 88 GLN H 1 88 GLN HB3 3.660 . 4.210 3.620 2.792 3.878 . 0 0 "[ . 1 . 2]" 1
468 1 91 LEU H 1 91 LEU HB2 3.090 . 3.550 2.550 2.462 2.616 . 0 0 "[ . 1 . 2]" 1
469 1 91 LEU H 1 91 LEU HG 2.730 . 3.140 2.704 2.269 3.130 . 0 0 "[ . 1 . 2]" 1
470 1 91 LEU H 1 91 LEU MD1 3.800 . 4.370 3.940 3.641 4.211 . 0 0 "[ . 1 . 2]" 1
471 1 91 LEU H 1 91 LEU MD2 3.960 . 4.550 3.506 3.131 3.869 . 0 0 "[ . 1 . 2]" 1
472 1 92 VAL H 1 92 VAL HB 3.470 . 3.990 2.742 2.480 3.733 . 0 0 "[ . 1 . 2]" 1
473 1 93 LYS H 1 93 LYS HG2 3.910 . 4.500 3.167 1.994 4.351 . 0 0 "[ . 1 . 2]" 1
474 1 93 LYS H 1 93 LYS HG3 3.910 . 4.500 3.307 1.949 4.569 0.069 5 0 "[ . 1 . 2]" 1
475 1 95 GLU H 1 95 GLU HB3 3.090 . 3.550 2.758 2.518 2.917 . 0 0 "[ . 1 . 2]" 1
476 1 95 GLU H 1 95 GLU HG2 3.810 . 4.380 2.213 1.920 3.547 . 0 0 "[ . 1 . 2]" 1
477 1 94 PRO HB3 1 95 GLU H 3.520 . 4.050 3.700 3.338 3.970 . 0 0 "[ . 1 . 2]" 1
478 1 95 GLU H 1 95 GLU HG3 3.810 . 4.380 3.075 1.989 3.928 . 0 0 "[ . 1 . 2]" 1
479 1 96 ARG H 1 96 ARG HB3 3.220 . 3.700 2.763 2.434 3.489 . 0 0 "[ . 1 . 2]" 1
480 1 96 ARG H 1 96 ARG HB2 3.590 . 4.130 3.690 3.571 3.980 . 0 0 "[ . 1 . 2]" 1
481 1 96 ARG H 1 96 ARG HG2 3.210 . 3.690 2.285 2.008 2.623 . 0 0 "[ . 1 . 2]" 1
482 1 97 ASP H 1 97 ASP HB2 3.860 . 4.440 2.627 2.377 3.603 . 0 0 "[ . 1 . 2]" 1
483 1 97 ASP H 1 97 ASP HB3 3.860 . 4.440 3.451 2.518 3.687 . 0 0 "[ . 1 . 2]" 1
484 1 98 ASP H 1 98 ASP HB2 3.490 . 4.010 3.070 2.592 3.349 . 0 0 "[ . 1 . 2]" 1
485 1 98 ASP H 1 98 ASP HB3 3.490 . 4.010 2.694 2.405 3.756 . 0 0 "[ . 1 . 2]" 1
486 1 99 THR H 1 99 THR HB 3.910 . 4.500 2.656 2.504 2.814 . 0 0 "[ . 1 . 2]" 1
487 1 48 VAL MG2 1 99 THR H 4.550 . 5.230 4.398 4.008 5.176 . 0 0 "[ . 1 . 2]" 1
488 1 100 GLU HG2 1 101 PHE H 4.000 . 4.600 3.527 2.507 3.821 . 0 0 "[ . 1 . 2]" 1
489 1 101 PHE H 1 101 PHE HB2 4.180 . 4.810 2.501 2.436 2.699 . 0 0 "[ . 1 . 2]" 1
490 1 101 PHE H 1 101 PHE QD 3.820 . 4.390 2.967 2.729 3.301 . 0 0 "[ . 1 . 2]" 1
491 1 102 GLN H 1 102 GLN HB2 4.100 . 4.720 3.789 3.724 3.865 . 0 0 "[ . 1 . 2]" 1
492 1 102 GLN H 1 102 GLN HG3 4.230 . 4.860 3.053 2.801 3.421 . 0 0 "[ . 1 . 2]" 1
493 1 106 PHE H 1 106 PHE HB3 3.610 . 4.150 2.639 2.519 2.756 . 0 0 "[ . 1 . 2]" 1
494 1 106 PHE H 1 106 PHE HB2 3.880 . 4.460 3.071 2.917 3.332 . 0 0 "[ . 1 . 2]" 1
495 1 106 PHE H 1 106 PHE QD 4.860 . 5.590 4.334 4.270 4.381 . 0 0 "[ . 1 . 2]" 1
496 1 107 LEU H 1 107 LEU HB3 3.930 . 4.520 3.777 3.725 3.853 . 0 0 "[ . 1 . 2]" 1
497 1 107 LEU H 1 107 LEU HB2 3.900 . 4.490 2.649 2.546 2.773 . 0 0 "[ . 1 . 2]" 1
498 1 107 LEU H 1 107 LEU HG 4.000 . 4.600 2.960 2.762 3.288 . 0 0 "[ . 1 . 2]" 1
499 1 107 LEU H 1 107 LEU MD1 4.360 . 5.010 4.071 3.861 4.188 . 0 0 "[ . 1 . 2]" 1
500 1 107 LEU H 1 107 LEU MD2 4.040 . 4.650 3.739 3.510 4.052 . 0 0 "[ . 1 . 2]" 1
501 1 111 GLU H 1 111 GLU HG2 4.180 . 4.810 2.666 1.919 3.758 . 0 0 "[ . 1 . 2]" 1
502 1 111 GLU H 1 111 GLU HG3 4.180 . 4.810 3.290 1.880 3.873 . 0 0 "[ . 1 . 2]" 1
503 1 112 GLN H 1 112 GLN HB3 2.830 . 3.250 2.522 2.432 2.606 . 0 0 "[ . 1 . 2]" 1
504 1 112 GLN H 1 112 GLN HG2 4.210 . 4.840 3.300 2.178 3.839 . 0 0 "[ . 1 . 2]" 1
505 1 113 LEU H 1 113 LEU HG 3.830 . 4.400 2.827 2.656 3.136 . 0 0 "[ . 1 . 2]" 1
506 1 114 LEU H 1 114 LEU HB2 3.600 . 4.140 2.554 2.450 2.672 . 0 0 "[ . 1 . 2]" 1
507 1 114 LEU H 1 114 LEU HG 2.850 . 3.280 2.323 2.213 2.519 . 0 0 "[ . 1 . 2]" 1
508 1 114 LEU H 1 114 LEU MD2 3.680 . 4.230 3.280 2.972 3.504 . 0 0 "[ . 1 . 2]" 1
509 1 114 LEU H 1 114 LEU MD1 3.570 . 4.110 3.692 3.598 3.852 . 0 0 "[ . 1 . 2]" 1
510 1 115 GLU H 1 115 GLU HB3 2.930 . 3.370 2.731 2.599 2.877 . 0 0 "[ . 1 . 2]" 1
511 1 115 GLU H 1 115 GLU HG2 3.310 . 3.810 2.083 1.875 2.280 . 0 0 "[ . 1 . 2]" 1
512 1 115 GLU H 1 115 GLU HG3 3.440 . 3.960 3.125 2.698 3.320 . 0 0 "[ . 1 . 2]" 1
513 1 116 ASN H 1 116 ASN HB2 3.770 . 4.340 2.475 2.394 2.572 . 0 0 "[ . 1 . 2]" 1
514 1 116 ASN H 1 116 ASN HD22 4.330 . 4.980 3.853 3.581 4.209 . 0 0 "[ . 1 . 2]" 1
515 1 117 ILE H 1 117 ILE HB 3.070 . 3.530 2.623 2.525 2.769 . 0 0 "[ . 1 . 2]" 1
516 1 117 ILE H 1 117 ILE MG 3.860 . 4.440 3.861 3.811 3.904 . 0 0 "[ . 1 . 2]" 1
517 1 117 ILE H 1 117 ILE HG13 3.320 . 3.820 2.389 2.245 2.486 . 0 0 "[ . 1 . 2]" 1
518 1 117 ILE H 1 117 ILE HG12 3.960 . 4.550 3.565 3.425 3.687 . 0 0 "[ . 1 . 2]" 1
519 1 118 LYS H 1 118 LYS HB2 3.830 . 4.400 2.784 2.524 3.836 . 0 0 "[ . 1 . 2]" 1
520 1 118 LYS H 1 118 LYS HB3 3.830 . 4.400 3.668 2.839 3.821 . 0 0 "[ . 1 . 2]" 1
521 1 118 LYS H 1 118 LYS HD2 5.350 . 6.150 4.922 3.314 5.398 . 0 0 "[ . 1 . 2]" 1
522 1 118 LYS H 1 118 LYS HD3 5.350 . 6.150 4.684 3.641 5.150 . 0 0 "[ . 1 . 2]" 1
523 1 119 ARG H 1 119 ARG HB3 3.350 . 3.850 3.033 2.794 3.364 . 0 0 "[ . 1 . 2]" 1
524 1 119 ARG H 1 119 ARG HG2 3.830 . 4.400 2.113 1.881 2.501 . 0 0 "[ . 1 . 2]" 1
525 1 119 ARG H 1 119 ARG HG3 3.830 . 4.400 2.941 2.440 3.225 . 0 0 "[ . 1 . 2]" 1
526 1 119 ARG H 1 119 ARG HD3 5.120 . 5.890 4.447 4.142 4.803 . 0 0 "[ . 1 . 2]" 1
527 1 120 LYS H 1 120 LYS HB2 3.920 . 4.510 2.969 2.405 4.118 . 0 0 "[ . 1 . 2]" 1
528 1 120 LYS H 1 120 LYS HB3 3.920 . 4.510 3.733 2.680 3.935 . 0 0 "[ . 1 . 2]" 1
529 1 120 LYS H 1 120 LYS HG2 4.280 . 4.920 3.489 2.077 4.615 . 0 0 "[ . 1 . 2]" 1
530 1 119 ARG HG2 1 120 LYS H 4.180 . 4.810 3.403 2.539 4.652 . 0 0 "[ . 1 . 2]" 1
531 1 120 LYS H 1 120 LYS HG3 4.280 . 4.920 3.534 2.622 4.452 . 0 0 "[ . 1 . 2]" 1
532 1 121 VAL H 1 121 VAL HB 3.660 . 4.210 3.022 2.407 3.998 . 0 0 "[ . 1 . 2]" 1
533 1 122 THR H 1 122 THR HB 3.810 . 4.380 3.128 2.636 3.666 . 0 0 "[ . 1 . 2]" 1
534 1 122 THR H 1 122 THR MG 3.910 . 4.500 2.327 1.888 3.805 . 0 0 "[ . 1 . 2]" 1
535 1 124 VAL H 1 124 VAL HB 3.630 . 4.170 3.177 2.514 3.899 . 0 0 "[ . 1 . 2]" 1
536 1 16 ASN H 1 17 VAL H 3.610 . 4.150 2.716 2.369 3.246 . 0 0 "[ . 1 . 2]" 1
537 1 20 PHE H 1 21 LEU H 3.500 . 4.030 2.958 2.852 3.055 . 0 0 "[ . 1 . 2]" 1
538 1 21 LEU H 1 22 THR H 3.350 . 3.850 2.433 2.222 2.552 . 0 0 "[ . 1 . 2]" 1
539 1 22 THR H 1 23 LYS H 4.030 . 4.630 2.672 2.574 2.842 . 0 0 "[ . 1 . 2]" 1
540 1 24 LEU H 1 25 TRP H 3.770 . 4.340 2.897 2.762 3.030 . 0 0 "[ . 1 . 2]" 1
541 1 25 TRP H 1 26 THR H 4.640 . 5.340 2.845 2.729 2.977 . 0 0 "[ . 1 . 2]" 1
542 1 29 SER H 1 30 ASP H 3.580 . 4.120 2.488 2.401 2.616 . 0 0 "[ . 1 . 2]" 1
543 1 32 ASP H 1 33 THR H 3.020 . 3.470 2.450 2.330 2.586 . 0 0 "[ . 1 . 2]" 1
544 1 34 ASP H 1 35 ALA H 3.340 . 3.840 2.742 2.669 2.837 . 0 0 "[ . 1 . 2]" 1
545 1 35 ALA H 1 36 LEU H 3.190 . 3.670 2.734 2.653 2.830 . 0 0 "[ . 1 . 2]" 1
546 1 35 ALA H 1 37 ILE H 3.800 . 4.370 3.929 3.873 3.980 . 0 0 "[ . 1 . 2]" 1
547 1 38 CYS H 1 39 TRP H 4.520 . 5.200 4.368 4.332 4.398 . 0 0 "[ . 1 . 2]" 1
548 1 43 GLY H 1 44 ASN H 3.670 . 4.220 2.515 2.180 2.908 . 0 0 "[ . 1 . 2]" 1
549 1 44 ASN H 1 45 SER H 3.230 . 3.710 2.365 1.601 2.611 0.199 4 0 "[ . 1 . 2]" 1
550 1 45 SER H 1 46 PHE H 4.810 . 5.530 4.360 4.262 4.404 . 0 0 "[ . 1 . 2]" 1
551 1 47 HIS H 1 48 VAL H 4.780 . 5.500 4.490 4.426 4.532 . 0 0 "[ . 1 . 2]" 1
552 1 48 VAL H 1 49 PHE H 4.630 . 5.320 4.258 4.001 4.368 . 0 0 "[ . 1 . 2]" 1
553 1 50 ASP H 1 51 GLN H 3.750 . 4.310 3.111 2.883 3.336 . 0 0 "[ . 1 . 2]" 1
554 1 52 GLY H 1 53 GLN H 3.400 . 3.910 2.695 2.556 2.802 . 0 0 "[ . 1 . 2]" 1
555 1 53 GLN H 1 54 PHE H 3.000 . 3.450 2.533 2.439 2.590 . 0 0 "[ . 1 . 2]" 1
556 1 55 ALA H 1 56 LYS H 3.300 . 3.800 2.670 2.605 2.752 . 0 0 "[ . 1 . 2]" 1
557 1 56 LYS H 1 57 GLU H 3.070 . 3.530 2.766 2.674 2.872 . 0 0 "[ . 1 . 2]" 1
558 1 61 LYS H 1 62 TYR H 3.330 . 3.830 2.713 2.626 2.806 . 0 0 "[ . 1 . 2]" 1
559 1 62 TYR H 1 63 PHE H 3.420 . 3.930 2.394 2.267 2.528 . 0 0 "[ . 1 . 2]" 1
560 1 63 PHE H 1 64 LYS H 4.550 . 5.230 4.431 4.200 4.532 . 0 0 "[ . 1 . 2]" 1
561 1 64 LYS H 1 65 HIS H 4.160 . 4.780 2.887 2.757 3.096 . 0 0 "[ . 1 . 2]" 1
562 1 69 ALA H 1 70 SER H 3.140 . 3.610 2.759 2.716 2.883 . 0 0 "[ . 1 . 2]" 1
563 1 76 ASN H 1 77 MET H 3.240 . 3.730 2.799 2.714 2.862 . 0 0 "[ . 1 . 2]" 1
564 1 78 TYR H 1 79 GLY H 3.300 . 3.800 2.509 2.394 2.624 . 0 0 "[ . 1 . 2]" 1
565 1 81 ARG H 1 82 LYS H 4.500 . 5.180 4.404 4.336 4.461 . 0 0 "[ . 1 . 2]" 1
566 1 82 LYS H 1 83 VAL H 4.500 . 5.180 4.464 4.384 4.522 . 0 0 "[ . 1 . 2]" 1
567 1 84 VAL H 1 85 HIS H 4.500 . 5.180 4.398 4.203 4.568 . 0 0 "[ . 1 . 2]" 1
568 1 86 ILE H 1 87 GLU H 4.750 . 5.460 4.211 3.898 4.586 . 0 0 "[ . 1 . 2]" 1
569 1 90 GLY H 1 91 LEU H 3.580 . 4.120 2.971 1.703 4.054 0.097 13 0 "[ . 1 . 2]" 1
570 1 92 VAL H 1 93 LYS H 3.190 . 3.670 2.955 2.205 3.816 0.146 8 0 "[ . 1 . 2]" 1
571 1 95 GLU H 1 96 ARG H 3.270 . 3.760 2.871 2.392 3.628 . 0 0 "[ . 1 . 2]" 1
572 1 96 ARG H 1 97 ASP H 4.720 . 5.430 4.342 3.151 4.676 . 0 0 "[ . 1 . 2]" 1
573 1 97 ASP H 1 98 ASP H 4.540 . 5.220 4.455 4.240 4.568 . 0 0 "[ . 1 . 2]" 1
574 1 98 ASP H 1 99 THR H 4.500 . 5.180 4.168 3.903 4.383 . 0 0 "[ . 1 . 2]" 1
575 1 101 PHE H 1 102 GLN H 4.740 . 5.450 4.389 4.240 4.449 . 0 0 "[ . 1 . 2]" 1
576 1 102 GLN H 1 103 HIS H 5.240 . 6.030 4.453 4.358 4.534 . 0 0 "[ . 1 . 2]" 1
577 1 111 GLU H 1 112 GLN H 2.890 . 3.320 2.726 2.578 2.863 . 0 0 "[ . 1 . 2]" 1
578 1 112 GLN H 1 113 LEU H 3.520 . 4.050 2.698 2.600 2.818 . 0 0 "[ . 1 . 2]" 1
579 1 114 LEU H 1 115 GLU H 3.230 . 3.710 2.633 2.539 2.738 . 0 0 "[ . 1 . 2]" 1
580 1 115 GLU H 1 116 ASN H 3.250 . 3.740 2.579 2.465 2.726 . 0 0 "[ . 1 . 2]" 1
581 1 117 ILE H 1 118 LYS H 4.510 . 5.190 4.335 3.600 4.546 . 0 0 "[ . 1 . 2]" 1
582 1 118 LYS H 1 119 ARG H 4.650 . 5.350 4.481 4.381 4.601 . 0 0 "[ . 1 . 2]" 1
583 1 20 PHE H 1 22 THR H 4.630 . 5.320 4.434 4.255 4.565 . 0 0 "[ . 1 . 2]" 1
584 1 19 ALA HA 1 21 LEU H 4.500 . 5.180 4.316 4.116 4.484 . 0 0 "[ . 1 . 2]" 1
585 1 19 ALA H 1 21 LEU H 4.440 . 5.110 4.391 4.294 4.617 . 0 0 "[ . 1 . 2]" 1
586 1 21 LEU H 1 23 LYS H 4.580 . 5.270 4.021 3.838 4.181 . 0 0 "[ . 1 . 2]" 1
587 1 20 PHE HA 1 22 THR H 5.120 . 5.890 4.764 4.592 4.995 . 0 0 "[ . 1 . 2]" 1
588 1 22 THR H 1 24 LEU H 4.820 . 5.540 4.049 3.962 4.150 . 0 0 "[ . 1 . 2]" 1
589 1 23 LYS H 1 25 TRP H 4.610 . 5.300 4.268 3.946 4.621 . 0 0 "[ . 1 . 2]" 1
590 1 24 LEU H 1 26 THR H 4.480 . 5.150 4.415 4.225 4.609 . 0 0 "[ . 1 . 2]" 1
591 1 22 THR HA 1 25 TRP H 4.130 . 4.750 3.665 3.164 4.337 . 0 0 "[ . 1 . 2]" 1
592 1 21 LEU HA 1 25 TRP H 4.530 . 5.210 3.760 3.392 4.157 . 0 0 "[ . 1 . 2]" 1
593 1 24 LEU HA 1 27 LEU H 4.210 . 4.840 3.494 3.287 3.748 . 0 0 "[ . 1 . 2]" 1
594 1 25 TRP HA 1 28 VAL H 4.410 . 5.070 3.681 3.188 4.120 . 0 0 "[ . 1 . 2]" 1
595 1 24 LEU HA 1 28 VAL H 4.880 . 5.610 4.029 3.840 4.250 . 0 0 "[ . 1 . 2]" 1
596 1 27 LEU HA 1 29 SER H 4.590 . 5.280 4.232 3.899 4.467 . 0 0 "[ . 1 . 2]" 1
597 1 34 ASP H 1 36 LEU H 4.880 . 5.610 4.407 4.184 4.588 . 0 0 "[ . 1 . 2]" 1
598 1 52 GLY HA3 1 53 GLN H 3.480 . 4.000 2.761 2.707 2.818 . 0 0 "[ . 1 . 2]" 1
599 1 52 GLY HA2 1 54 PHE H 4.790 . 5.510 4.817 4.422 5.029 . 0 0 "[ . 1 . 2]" 1
600 1 51 GLN HA 1 54 PHE H 3.750 . 4.310 3.704 3.317 4.104 . 0 0 "[ . 1 . 2]" 1
601 1 54 PHE H 1 56 LYS H 4.490 . 5.160 4.030 3.808 4.146 . 0 0 "[ . 1 . 2]" 1
602 1 53 GLN HA 1 55 ALA H 4.930 . 5.670 4.623 4.487 4.845 . 0 0 "[ . 1 . 2]" 1
603 1 53 GLN H 1 55 ALA H 4.590 . 5.280 4.150 3.971 4.406 . 0 0 "[ . 1 . 2]" 1
604 1 52 GLY HA2 1 55 ALA H 4.680 . 5.380 3.904 3.674 4.154 . 0 0 "[ . 1 . 2]" 1
605 1 51 GLN HA 1 55 ALA H 3.750 . 4.310 3.657 3.358 3.869 . 0 0 "[ . 1 . 2]" 1
606 1 55 ALA H 1 57 GLU H 4.570 . 5.260 4.611 4.470 4.720 . 0 0 "[ . 1 . 2]" 1
607 1 51 GLN HA 1 56 LYS H 5.800 . 6.670 6.178 5.790 6.412 . 0 0 "[ . 1 . 2]" 1
608 1 54 PHE HA 1 57 GLU H 4.220 . 4.850 3.851 3.746 3.989 . 0 0 "[ . 1 . 2]" 1
609 1 56 LYS HA 1 58 VAL H 5.030 . 5.780 5.187 5.105 5.290 . 0 0 "[ . 1 . 2]" 1
610 1 55 ALA HA 1 58 VAL H 4.710 . 5.420 4.439 4.278 4.542 . 0 0 "[ . 1 . 2]" 1
611 1 54 PHE HA 1 58 VAL H 3.810 . 4.380 3.301 3.158 3.537 . 0 0 "[ . 1 . 2]" 1
612 1 55 ALA HA 1 59 LEU H 3.690 . 4.240 3.257 3.015 3.466 . 0 0 "[ . 1 . 2]" 1
613 1 59 LEU H 1 61 LYS H 4.810 . 5.530 3.983 3.873 4.108 . 0 0 "[ . 1 . 2]" 1
614 1 59 LEU HA 1 61 LYS H 4.130 . 4.750 3.948 3.872 4.026 . 0 0 "[ . 1 . 2]" 1
615 1 58 VAL HA 1 61 LYS H 4.140 . 4.760 3.712 3.603 3.884 . 0 0 "[ . 1 . 2]" 1
616 1 59 LEU HA 1 62 TYR H 4.180 . 4.810 3.682 3.537 3.878 . 0 0 "[ . 1 . 2]" 1
617 1 58 VAL HA 1 62 TYR H 4.380 . 5.040 4.338 4.041 4.493 . 0 0 "[ . 1 . 2]" 1
618 1 68 MET HA 1 70 SER H 4.870 . 5.600 4.136 3.846 4.395 . 0 0 "[ . 1 . 2]" 1
619 1 68 MET H 1 70 SER H 5.590 . 6.430 4.225 4.131 4.325 . 0 0 "[ . 1 . 2]" 1
620 1 70 SER H 1 72 VAL H 4.440 . 5.110 4.435 4.227 4.579 . 0 0 "[ . 1 . 2]" 1
621 1 69 ALA HA 1 71 PHE H 5.060 . 5.820 4.431 4.330 4.505 . 0 0 "[ . 1 . 2]" 1
622 1 68 MET HA 1 71 PHE H 4.210 . 4.840 3.181 2.749 3.651 . 0 0 "[ . 1 . 2]" 1
623 1 72 VAL H 1 74 GLN H 4.430 . 5.090 4.327 4.198 4.467 . 0 0 "[ . 1 . 2]" 1
624 1 71 PHE HA 1 73 ARG H 4.560 . 5.240 4.527 4.406 4.678 . 0 0 "[ . 1 . 2]" 1
625 1 70 SER HA 1 73 ARG H 3.830 . 4.400 3.712 3.478 4.080 . 0 0 "[ . 1 . 2]" 1
626 1 69 ALA HA 1 73 ARG H 4.070 . 4.680 4.030 3.810 4.236 . 0 0 "[ . 1 . 2]" 1
627 1 72 VAL HA 1 74 GLN H 4.460 . 5.130 4.395 4.220 4.566 . 0 0 "[ . 1 . 2]" 1
628 1 71 PHE HA 1 74 GLN H 4.290 . 4.930 3.774 3.534 3.933 . 0 0 "[ . 1 . 2]" 1
629 1 74 GLN H 1 76 ASN H 4.750 . 5.460 4.255 4.123 4.419 . 0 0 "[ . 1 . 2]" 1
630 1 72 VAL HA 1 75 LEU H 3.630 . 4.170 3.437 3.168 3.715 . 0 0 "[ . 1 . 2]" 1
631 1 74 GLN HA 1 76 ASN H 4.920 . 5.660 4.628 4.451 4.802 . 0 0 "[ . 1 . 2]" 1
632 1 73 ARG HA 1 76 ASN H 3.960 . 4.550 3.603 3.370 3.930 . 0 0 "[ . 1 . 2]" 1
633 1 72 VAL HA 1 76 ASN H 4.900 . 5.640 4.191 4.025 4.358 . 0 0 "[ . 1 . 2]" 1
634 1 75 LEU H 1 77 MET H 4.240 . 4.880 4.183 4.020 4.290 . 0 0 "[ . 1 . 2]" 1
635 1 74 GLN HA 1 77 MET H 3.820 . 4.390 3.598 3.414 3.814 . 0 0 "[ . 1 . 2]" 1
636 1 73 ARG HA 1 77 MET H 4.850 . 5.580 4.433 4.109 4.794 . 0 0 "[ . 1 . 2]" 1
637 1 76 ASN HA 1 78 TYR H 4.570 . 5.260 4.244 4.121 4.368 . 0 0 "[ . 1 . 2]" 1
638 1 76 ASN H 1 78 TYR H 4.490 . 5.160 4.013 3.831 4.132 . 0 0 "[ . 1 . 2]" 1
639 1 75 LEU HA 1 78 TYR H 3.320 . 3.820 3.163 2.957 3.360 . 0 0 "[ . 1 . 2]" 1
640 1 74 GLN HA 1 78 TYR H 4.720 . 5.430 4.470 4.350 4.626 . 0 0 "[ . 1 . 2]" 1
641 1 111 GLU H 1 113 LEU H 4.350 . 5.000 4.306 4.176 4.465 . 0 0 "[ . 1 . 2]" 1
642 1 112 GLN H 1 112 GLN HE21 5.070 . 5.830 4.655 3.244 5.121 . 0 0 "[ . 1 . 2]" 1
643 1 112 GLN H 1 114 LEU H 4.330 . 4.980 4.226 4.061 4.347 . 0 0 "[ . 1 . 2]" 1
644 1 111 GLU HA 1 114 LEU H 4.660 . 5.360 3.467 3.174 3.816 . 0 0 "[ . 1 . 2]" 1
645 1 114 LEU H 1 116 ASN H 4.600 . 5.290 3.927 3.773 4.148 . 0 0 "[ . 1 . 2]" 1
646 1 113 LEU HA 1 115 GLU H 4.290 . 4.930 3.957 3.706 4.281 . 0 0 "[ . 1 . 2]" 1
647 1 113 LEU H 1 115 GLU H 4.970 . 5.720 4.357 3.985 4.548 . 0 0 "[ . 1 . 2]" 1
648 1 115 GLU H 1 116 ASN HD22 5.410 . 6.220 4.813 4.433 5.272 . 0 0 "[ . 1 . 2]" 1
649 1 113 LEU HA 1 116 ASN H 4.460 . 5.130 3.267 2.906 3.590 . 0 0 "[ . 1 . 2]" 1
650 1 13 GLY H 1 14 PRO HD2 5.750 . 6.610 4.124 2.423 5.458 . 0 0 "[ . 1 . 2]" 1
651 1 13 GLY H 1 14 PRO HD3 5.750 . 6.610 4.007 2.561 5.055 . 0 0 "[ . 1 . 2]" 1
652 1 16 ASN HD21 1 115 GLU HB2 6.000 . 6.900 4.272 2.687 6.164 . 0 0 "[ . 1 . 2]" 1
653 1 16 ASN HD21 1 115 GLU HB3 6.000 . 6.900 4.737 2.277 6.436 . 0 0 "[ . 1 . 2]" 1
654 1 15 SER HB3 1 17 VAL H 4.350 . 5.000 3.625 2.506 5.082 0.082 8 0 "[ . 1 . 2]" 1
655 1 15 SER HB2 1 17 VAL H 4.350 . 5.000 3.834 2.758 4.696 . 0 0 "[ . 1 . 2]" 1
656 1 17 VAL H 1 115 GLU HA 5.150 . 5.920 4.445 4.010 4.895 . 0 0 "[ . 1 . 2]" 1
657 1 17 VAL H 1 18 PRO HD2 5.030 . 5.780 5.186 4.819 5.344 . 0 0 "[ . 1 . 2]" 1
658 1 15 SER HA 1 17 VAL H 4.370 . 5.030 4.020 3.035 5.061 0.031 7 0 "[ . 1 . 2]" 1
659 1 20 PHE H 1 21 LEU HG 5.230 . 6.010 4.919 4.702 5.153 . 0 0 "[ . 1 . 2]" 1
660 1 20 PHE H 1 23 LYS HB2 5.020 . 5.770 5.337 5.127 5.538 . 0 0 "[ . 1 . 2]" 1
661 1 18 PRO HB2 1 20 PHE H 4.030 . 4.630 3.377 2.997 3.764 . 0 0 "[ . 1 . 2]" 1
662 1 18 PRO HA 1 20 PHE H 4.250 . 4.890 4.331 4.056 4.684 . 0 0 "[ . 1 . 2]" 1
663 1 20 PHE H 1 78 TYR QE 5.730 . 6.590 5.285 4.746 6.059 . 0 0 "[ . 1 . 2]" 1
664 1 18 PRO HB2 1 21 LEU H 4.160 . 4.780 2.732 2.385 3.694 . 0 0 "[ . 1 . 2]" 1
665 1 21 LEU H 1 22 THR HB 4.590 . 5.280 4.751 4.215 5.007 . 0 0 "[ . 1 . 2]" 1
666 1 19 ALA MB 1 21 LEU H 4.630 . 5.320 4.617 4.517 4.779 . 0 0 "[ . 1 . 2]" 1
667 1 17 VAL MG1 1 21 LEU H 4.110 . 4.730 3.735 3.328 4.197 . 0 0 "[ . 1 . 2]" 1
668 1 19 ALA MB 1 22 THR H 5.060 . 5.820 4.799 4.560 4.909 . 0 0 "[ . 1 . 2]" 1
669 1 24 LEU H 1 63 PHE QE 4.130 . 4.750 3.449 2.726 3.970 . 0 0 "[ . 1 . 2]" 1
670 1 24 LEU H 1 63 PHE HZ 3.970 . 4.570 3.351 2.987 3.549 . 0 0 "[ . 1 . 2]" 1
671 1 25 TRP H 1 114 LEU MD1 4.510 . 5.190 3.720 3.230 4.414 . 0 0 "[ . 1 . 2]" 1
672 1 27 LEU H 1 62 TYR QE 4.690 . 5.390 3.792 3.407 4.341 . 0 0 "[ . 1 . 2]" 1
673 1 29 SER H 1 39 TRP HE1 5.600 . 6.440 5.649 3.125 6.354 . 0 0 "[ . 1 . 2]" 1
674 1 26 THR MG 1 30 ASP H 4.650 . 5.350 4.772 4.353 5.123 . 0 0 "[ . 1 . 2]" 1
675 1 30 ASP H 1 33 THR MG 5.650 . 6.500 5.601 5.331 5.823 . 0 0 "[ . 1 . 2]" 1
676 1 32 ASP H 1 34 ASP H 4.020 . 4.620 3.809 3.623 3.976 . 0 0 "[ . 1 . 2]" 1
677 1 30 ASP HB2 1 32 ASP H 5.240 . 6.030 4.749 4.475 5.040 . 0 0 "[ . 1 . 2]" 1
678 1 33 THR H 1 35 ALA H 4.670 . 5.370 4.631 4.376 4.911 . 0 0 "[ . 1 . 2]" 1
679 1 27 LEU MD1 1 33 THR H 5.110 . 5.880 4.577 4.453 4.788 . 0 0 "[ . 1 . 2]" 1
680 1 31 PRO HG2 1 33 THR H 6.000 . 6.900 5.174 4.905 5.446 . 0 0 "[ . 1 . 2]" 1
681 1 31 PRO HB3 1 33 THR H 5.750 . 6.610 5.973 5.864 6.087 . 0 0 "[ . 1 . 2]" 1
682 1 32 ASP HA 1 34 ASP H 4.070 . 4.680 4.094 3.833 4.504 . 0 0 "[ . 1 . 2]" 1
683 1 34 ASP H 1 35 ALA MB 4.300 . 4.950 4.390 4.316 4.502 . 0 0 "[ . 1 . 2]" 1
684 1 34 ASP H 1 37 ILE MG 4.720 . 5.430 4.641 4.418 4.937 . 0 0 "[ . 1 . 2]" 1
685 1 35 ALA H 1 36 LEU HG 4.900 . 5.640 4.753 4.469 5.167 . 0 0 "[ . 1 . 2]" 1
686 1 35 ALA H 1 36 LEU HB2 4.940 . 5.680 5.077 4.919 5.283 . 0 0 "[ . 1 . 2]" 1
687 1 35 ALA H 1 36 LEU MD2 5.160 . 5.930 5.320 4.951 5.689 . 0 0 "[ . 1 . 2]" 1
688 1 35 ALA H 1 37 ILE MG 5.600 . 6.440 5.091 4.941 5.287 . 0 0 "[ . 1 . 2]" 1
689 1 33 THR MG 1 35 ALA H 5.060 . 5.820 5.412 5.179 5.594 . 0 0 "[ . 1 . 2]" 1
690 1 36 LEU H 1 37 ILE HA 4.780 . 5.500 4.781 4.597 4.899 . 0 0 "[ . 1 . 2]" 1
691 1 37 ILE H 1 54 PHE QD 4.890 . 5.620 4.584 4.372 4.828 . 0 0 "[ . 1 . 2]" 1
692 1 34 ASP HA 1 37 ILE H 3.760 . 4.320 3.265 2.890 3.540 . 0 0 "[ . 1 . 2]" 1
693 1 33 THR HB 1 37 ILE H 4.170 . 4.800 4.201 3.865 4.430 . 0 0 "[ . 1 . 2]" 1
694 1 35 ALA MB 1 37 ILE H 4.540 . 5.220 4.468 4.375 4.601 . 0 0 "[ . 1 . 2]" 1
695 1 28 VAL MG2 1 38 CYS H 5.010 . 5.760 4.788 4.470 5.037 . 0 0 "[ . 1 . 2]" 1
696 1 28 VAL MG1 1 38 CYS H 4.560 . 5.240 4.036 3.369 4.626 . 0 0 "[ . 1 . 2]" 1
697 1 28 VAL HA 1 38 CYS H 5.030 . 5.780 4.628 4.341 4.843 . 0 0 "[ . 1 . 2]" 1
698 1 38 CYS H 1 46 PHE HB2 4.490 . 5.160 3.746 3.450 4.052 . 0 0 "[ . 1 . 2]" 1
699 1 28 VAL HA 1 39 TRP H 5.220 . 6.000 4.559 4.010 5.022 . 0 0 "[ . 1 . 2]" 1
700 1 28 VAL MG2 1 39 TRP H 5.260 . 6.050 5.012 4.780 5.398 . 0 0 "[ . 1 . 2]" 1
701 1 28 VAL MG1 1 39 TRP H 3.770 . 4.340 2.669 2.433 2.995 . 0 0 "[ . 1 . 2]" 1
702 1 38 CYS H 1 48 VAL HA 4.110 . 4.730 4.154 3.897 4.581 . 0 0 "[ . 1 . 2]" 1
703 1 38 CYS H 1 49 PHE H 5.570 . 6.410 5.360 4.983 6.003 . 0 0 "[ . 1 . 2]" 1
704 1 38 CYS H 1 47 HIS H 3.760 . 4.320 3.122 2.869 3.300 . 0 0 "[ . 1 . 2]" 1
705 1 29 SER HA 1 39 TRP HE1 3.230 . 3.710 3.007 2.307 3.619 . 0 0 "[ . 1 . 2]" 1
706 1 40 SER H 1 46 PHE HB2 4.590 . 5.280 4.728 4.304 5.239 . 0 0 "[ . 1 . 2]" 1
707 1 40 SER H 1 46 PHE HA 3.740 . 4.300 2.730 2.284 3.248 . 0 0 "[ . 1 . 2]" 1
708 1 40 SER H 1 47 HIS HD2 4.590 . 5.280 3.976 3.366 4.561 . 0 0 "[ . 1 . 2]" 1
709 1 44 ASN H 1 107 LEU MD2 4.520 . 5.200 4.239 3.403 4.886 . 0 0 "[ . 1 . 2]" 1
710 1 42 SER HB2 1 44 ASN H 4.800 . 5.520 3.196 2.546 4.722 . 0 0 "[ . 1 . 2]" 1
711 1 42 SER HB3 1 44 ASN H 4.800 . 5.520 3.697 2.869 5.085 . 0 0 "[ . 1 . 2]" 1
712 1 42 SER HB2 1 44 ASN HD22 5.640 . 6.490 4.322 2.505 5.697 . 0 0 "[ . 1 . 2]" 1
713 1 42 SER HB3 1 44 ASN HD22 5.640 . 6.490 3.882 1.907 5.465 . 0 0 "[ . 1 . 2]" 1
714 1 45 SER H 1 107 LEU MD2 5.140 . 5.910 4.987 4.540 5.619 . 0 0 "[ . 1 . 2]" 1
715 1 46 PHE H 1 100 GLU HG2 4.980 . 5.730 3.831 3.384 4.349 . 0 0 "[ . 1 . 2]" 1
716 1 46 PHE H 1 101 PHE HB2 5.570 . 6.410 4.049 3.844 4.463 . 0 0 "[ . 1 . 2]" 1
717 1 47 HIS H 1 48 VAL MG2 4.490 . 5.160 4.541 4.381 4.719 . 0 0 "[ . 1 . 2]" 1
718 1 48 VAL H 1 99 THR H 3.910 . 4.500 2.552 2.332 3.191 . 0 0 "[ . 1 . 2]" 1
719 1 48 VAL H 1 99 THR HB 4.680 . 5.380 3.542 2.722 4.089 . 0 0 "[ . 1 . 2]" 1
720 1 36 LEU HA 1 49 PHE H 4.250 . 4.890 3.006 2.592 3.734 . 0 0 "[ . 1 . 2]" 1
721 1 37 ILE HA 1 49 PHE H 4.690 . 5.390 3.622 3.191 4.171 . 0 0 "[ . 1 . 2]" 1
722 1 50 ASP H 1 97 ASP H 4.250 . 4.890 3.148 2.291 4.262 . 0 0 "[ . 1 . 2]" 1
723 1 50 ASP H 1 96 ARG HG3 5.770 . 6.640 4.292 3.733 5.190 . 0 0 "[ . 1 . 2]" 1
724 1 36 LEU MD1 1 50 ASP H 5.730 . 6.590 6.066 5.290 6.278 . 0 0 "[ . 1 . 2]" 1
725 1 48 VAL MG1 1 50 ASP H 4.590 . 5.280 4.690 4.395 4.995 . 0 0 "[ . 1 . 2]" 1
726 1 51 GLN HE21 1 68 MET ME 4.260 . 4.900 2.932 1.822 4.528 . 0 0 "[ . 1 . 2]" 1
727 1 48 VAL MG1 1 51 GLN H 4.600 . 5.290 4.158 3.901 4.537 . 0 0 "[ . 1 . 2]" 1
728 1 48 VAL MG2 1 51 GLN HE21 4.750 . 5.460 4.828 3.572 5.537 0.077 14 0 "[ . 1 . 2]" 1
729 1 48 VAL MG1 1 51 GLN HE21 4.760 . 5.470 3.693 2.748 4.384 . 0 0 "[ . 1 . 2]" 1
730 1 52 GLY H 1 53 GLN HB3 4.910 . 5.650 4.921 4.473 5.098 . 0 0 "[ . 1 . 2]" 1
731 1 50 ASP HA 1 52 GLY H 4.300 . 4.950 3.609 3.413 3.766 . 0 0 "[ . 1 . 2]" 1
732 1 53 GLN H 1 55 ALA MB 5.400 . 6.210 4.898 4.655 5.275 . 0 0 "[ . 1 . 2]" 1
733 1 36 LEU MD1 1 53 GLN H 4.670 . 5.370 4.530 4.036 4.851 . 0 0 "[ . 1 . 2]" 1
734 1 53 GLN HE21 1 57 GLU HG3 3.850 . 4.430 4.142 3.236 4.287 . 0 0 "[ . 1 . 2]" 1
735 1 53 GLN HE21 1 57 GLU HB2 4.130 . 4.750 4.672 4.322 4.904 0.154 10 0 "[ . 1 . 2]" 1
736 1 53 GLN HE21 1 57 GLU HB3 3.660 . 4.210 3.683 3.149 4.244 0.034 10 0 "[ . 1 . 2]" 1
737 1 53 GLN HE21 1 58 VAL MG2 5.820 . 6.690 5.040 4.116 5.334 . 0 0 "[ . 1 . 2]" 1
738 1 53 GLN HE22 1 57 GLU HG3 4.810 . 5.530 5.430 4.268 5.636 0.106 2 0 "[ . 1 . 2]" 1
739 1 53 GLN HE22 1 57 GLU HB3 4.240 . 4.880 4.094 3.582 4.429 . 0 0 "[ . 1 . 2]" 1
740 1 53 GLN HE22 1 56 LYS HD2 4.550 . 5.230 2.510 2.066 3.612 . 0 0 "[ . 1 . 2]" 1
741 1 53 GLN HE22 1 56 LYS HD3 4.870 . 5.600 3.307 2.032 3.704 . 0 0 "[ . 1 . 2]" 1
742 1 36 LEU MD1 1 53 GLN HE22 5.030 . 5.780 4.927 4.438 5.380 . 0 0 "[ . 1 . 2]" 1
743 1 53 GLN HE21 1 57 GLU HA 5.770 . 6.640 5.896 5.438 6.224 . 0 0 "[ . 1 . 2]" 1
744 1 54 PHE H 1 55 ALA MB 4.690 . 5.390 4.519 4.197 4.633 . 0 0 "[ . 1 . 2]" 1
745 1 36 LEU MD2 1 54 PHE H 5.210 . 5.990 3.826 3.381 4.405 . 0 0 "[ . 1 . 2]" 1
746 1 48 VAL MG1 1 54 PHE H 5.000 . 5.750 4.987 4.756 5.380 . 0 0 "[ . 1 . 2]" 1
747 1 54 PHE QE 1 55 ALA H 4.550 . 5.230 5.186 4.939 5.362 0.132 16 0 "[ . 1 . 2]" 1
748 1 55 ALA H 1 56 LYS HB3 4.480 . 5.150 4.593 4.427 4.698 . 0 0 "[ . 1 . 2]" 1
749 1 55 ALA H 1 58 VAL MG2 4.640 . 5.340 5.078 4.983 5.171 . 0 0 "[ . 1 . 2]" 1
750 1 55 ALA H 1 59 LEU HG 4.780 . 5.500 4.339 4.197 4.621 . 0 0 "[ . 1 . 2]" 1
751 1 55 ALA H 1 59 LEU MD1 4.740 . 5.450 4.269 4.146 4.378 . 0 0 "[ . 1 . 2]" 1
752 1 56 LYS H 1 57 GLU HA 5.290 . 6.080 5.384 5.312 5.449 . 0 0 "[ . 1 . 2]" 1
753 1 57 GLU H 1 58 VAL MG2 3.890 . 4.470 3.589 3.346 3.820 . 0 0 "[ . 1 . 2]" 1
754 1 58 VAL H 1 59 LEU MD2 5.700 . 6.560 5.182 4.919 5.424 . 0 0 "[ . 1 . 2]" 1
755 1 58 VAL H 1 59 LEU HG 5.440 . 6.260 4.556 4.376 4.743 . 0 0 "[ . 1 . 2]" 1
756 1 58 VAL H 1 59 LEU HB2 4.430 . 5.090 4.622 4.472 4.752 . 0 0 "[ . 1 . 2]" 1
757 1 58 VAL H 1 60 PRO HD3 4.390 . 5.050 4.642 4.412 4.830 . 0 0 "[ . 1 . 2]" 1
758 1 58 VAL H 1 61 LYS H 4.760 . 5.470 4.800 4.686 4.917 . 0 0 "[ . 1 . 2]" 1
759 1 59 LEU H 1 66 ASN HA 4.980 . 5.730 4.589 4.423 4.753 . 0 0 "[ . 1 . 2]" 1
760 1 59 LEU H 1 60 PRO HD3 3.680 . 4.230 3.366 3.235 3.450 . 0 0 "[ . 1 . 2]" 1
761 1 61 LYS H 1 63 PHE H 4.400 . 5.060 3.908 3.594 4.190 . 0 0 "[ . 1 . 2]" 1
762 1 61 LYS H 1 62 TYR QD 4.510 . 5.190 4.355 4.012 4.561 . 0 0 "[ . 1 . 2]" 1
763 1 59 LEU HA 1 63 PHE H 4.330 . 4.980 3.385 3.217 3.687 . 0 0 "[ . 1 . 2]" 1
764 1 63 PHE H 1 64 LYS HA 5.490 . 6.310 5.050 4.571 5.330 . 0 0 "[ . 1 . 2]" 1
765 1 61 LYS HB3 1 63 PHE H 5.020 . 5.770 4.612 4.414 4.833 . 0 0 "[ . 1 . 2]" 1
766 1 59 LEU MD2 1 63 PHE H 4.890 . 5.620 4.402 4.132 4.784 . 0 0 "[ . 1 . 2]" 1
767 1 60 PRO HA 1 64 LYS H 4.950 . 5.690 4.767 4.029 5.073 . 0 0 "[ . 1 . 2]" 1
768 1 66 ASN HB2 1 66 ASN HD22 4.020 . 4.620 3.882 3.714 4.065 . 0 0 "[ . 1 . 2]" 1
769 1 66 ASN HB3 1 66 ASN HD22 3.780 . 4.350 3.480 3.431 3.535 . 0 0 "[ . 1 . 2]" 1
770 1 56 LYS HA 1 66 ASN HD21 4.820 . 5.540 3.219 2.029 5.572 0.032 5 0 "[ . 1 . 2]" 1
771 1 66 ASN HA 1 66 ASN HD21 4.590 . 5.280 3.870 3.093 4.601 . 0 0 "[ . 1 . 2]" 1
772 1 67 ASN HD22 1 69 ALA MB 4.190 . 4.820 2.676 1.831 4.684 . 0 0 "[ . 1 . 2]" 1
773 1 59 LEU MD1 1 68 MET H 4.460 . 5.130 3.593 3.276 4.012 . 0 0 "[ . 1 . 2]" 1
774 1 69 ALA H 1 72 VAL MG2 4.760 . 5.470 4.667 4.481 4.876 . 0 0 "[ . 1 . 2]" 1
775 1 59 LEU MD1 1 69 ALA H 4.870 . 5.600 4.825 4.673 5.314 . 0 0 "[ . 1 . 2]" 1
776 1 67 ASN HB3 1 69 ALA H 4.800 . 5.520 4.573 3.252 4.831 . 0 0 "[ . 1 . 2]" 1
777 1 69 ALA H 1 70 SER HB3 5.270 . 6.060 4.888 4.778 5.035 . 0 0 "[ . 1 . 2]" 1
778 1 69 ALA H 1 70 SER HB2 5.480 . 6.300 5.136 4.995 5.380 . 0 0 "[ . 1 . 2]" 1
779 1 67 ASN HA 1 69 ALA H 4.320 . 4.970 3.819 3.545 4.060 . 0 0 "[ . 1 . 2]" 1
780 1 67 ASN HB3 1 70 SER H 4.190 . 4.820 3.432 2.302 3.883 . 0 0 "[ . 1 . 2]" 1
781 1 69 ALA MB 1 71 PHE H 4.890 . 5.620 4.624 4.518 4.730 . 0 0 "[ . 1 . 2]" 1
782 1 59 LEU HB3 1 71 PHE H 6.000 . 6.900 6.152 5.867 6.520 . 0 0 "[ . 1 . 2]" 1
783 1 59 LEU MD1 1 71 PHE H 4.630 . 5.320 3.558 3.337 3.910 . 0 0 "[ . 1 . 2]" 1
784 1 59 LEU MD1 1 72 VAL H 4.580 . 5.270 4.689 4.523 4.907 . 0 0 "[ . 1 . 2]" 1
785 1 74 GLN H 1 75 LEU HG 4.470 . 5.140 4.503 4.322 4.669 . 0 0 "[ . 1 . 2]" 1
786 1 20 PHE HZ 1 75 LEU H 4.550 . 5.230 3.852 3.535 4.213 . 0 0 "[ . 1 . 2]" 1
787 1 76 ASN H 1 77 MET HB2 5.100 . 5.870 5.035 4.836 5.134 . 0 0 "[ . 1 . 2]" 1
788 1 72 VAL MG1 1 76 ASN H 4.090 . 4.700 3.903 3.684 4.006 . 0 0 "[ . 1 . 2]" 1
789 1 72 VAL MG1 1 76 ASN HD21 3.780 . 4.350 2.812 2.222 3.717 . 0 0 "[ . 1 . 2]" 1
790 1 72 VAL MG1 1 76 ASN HD22 3.780 . 4.350 2.069 1.747 2.555 0.053 2 0 "[ . 1 . 2]" 1
791 1 78 TYR H 1 117 ILE MG 4.820 . 5.540 4.832 4.691 4.934 . 0 0 "[ . 1 . 2]" 1
792 1 78 TYR H 1 78 TYR QE 5.020 . 5.770 5.025 4.830 5.198 . 0 0 "[ . 1 . 2]" 1
793 1 78 TYR H 1 80 PHE H 4.190 . 4.820 3.820 3.682 3.958 . 0 0 "[ . 1 . 2]" 1
794 1 78 TYR H 1 80 PHE QD 3.980 . 4.580 3.893 3.697 4.083 . 0 0 "[ . 1 . 2]" 1
795 1 79 GLY H 1 80 PHE QD 4.370 . 5.030 3.818 3.630 4.163 . 0 0 "[ . 1 . 2]" 1
796 1 77 MET H 1 79 GLY H 4.360 . 5.010 3.922 3.825 4.055 . 0 0 "[ . 1 . 2]" 1
797 1 76 ASN H 1 79 GLY H 5.310 . 6.110 4.948 4.784 5.215 . 0 0 "[ . 1 . 2]" 1
798 1 76 ASN HA 1 79 GLY H 3.760 . 4.320 3.576 3.267 3.796 . 0 0 "[ . 1 . 2]" 1
799 1 75 LEU HA 1 80 PHE H 5.050 . 5.810 3.934 3.660 4.185 . 0 0 "[ . 1 . 2]" 1
800 1 79 GLY H 1 80 PHE HB2 4.450 . 5.120 4.655 4.546 4.758 . 0 0 "[ . 1 . 2]" 1
801 1 75 LEU HB3 1 80 PHE H 4.810 . 5.530 3.931 3.663 4.222 . 0 0 "[ . 1 . 2]" 1
802 1 75 LEU HB2 1 80 PHE H 5.280 . 6.070 5.126 4.984 5.308 . 0 0 "[ . 1 . 2]" 1
803 1 80 PHE H 1 80 PHE QE 5.180 . 5.960 4.564 4.447 4.730 . 0 0 "[ . 1 . 2]" 1
804 1 80 PHE H 1 103 HIS HD2 4.470 . 5.140 3.852 2.980 4.517 . 0 0 "[ . 1 . 2]" 1
805 1 81 ARG H 1 83 VAL MG2 5.320 . 6.120 4.751 4.354 5.203 . 0 0 "[ . 1 . 2]" 1
806 1 81 ARG H 1 103 HIS HD2 4.640 . 5.340 4.727 4.094 5.245 . 0 0 "[ . 1 . 2]" 1
807 1 81 ARG H 1 102 GLN H 3.620 . 4.160 2.518 2.149 2.899 . 0 0 "[ . 1 . 2]" 1
808 1 83 VAL H 1 100 GLU HB3 4.590 . 5.280 3.725 3.162 4.230 . 0 0 "[ . 1 . 2]" 1
809 1 83 VAL H 1 101 PHE HA 3.980 . 4.580 3.786 3.422 4.022 . 0 0 "[ . 1 . 2]" 1
810 1 85 HIS H 1 99 THR HA 4.510 . 5.190 4.110 3.474 4.881 . 0 0 "[ . 1 . 2]" 1
811 1 86 ILE MG 1 88 GLN H 4.460 . 5.130 4.202 3.232 5.124 . 0 0 "[ . 1 . 2]" 1
812 1 90 GLY H 1 91 LEU MD2 4.240 . 4.880 4.204 3.382 4.985 0.105 8 0 "[ . 1 . 2]" 1
813 1 88 GLN HA 1 90 GLY H 5.310 . 6.110 5.214 3.158 6.322 0.212 17 0 "[ . 1 . 2]" 1
814 1 90 GLY H 1 91 LEU HA 5.660 . 6.510 4.924 4.125 5.454 . 0 0 "[ . 1 . 2]" 1
815 1 89 GLY H 1 91 LEU H 4.610 . 5.300 3.796 2.590 4.760 . 0 0 "[ . 1 . 2]" 1
816 1 93 LYS H 1 94 PRO HD3 5.280 . 6.070 5.133 4.841 5.418 . 0 0 "[ . 1 . 2]" 1
817 1 95 GLU H 1 96 ARG HB3 4.590 . 5.280 4.809 4.563 5.168 . 0 0 "[ . 1 . 2]" 1
818 1 95 GLU H 1 96 ARG HG2 5.000 . 5.750 4.297 3.696 5.178 . 0 0 "[ . 1 . 2]" 1
819 1 86 ILE HB 1 98 ASP H 3.610 . 4.150 2.595 1.835 3.844 . 0 0 "[ . 1 . 2]" 1
820 1 86 ILE MG 1 98 ASP H 4.070 . 4.680 3.781 2.987 4.462 . 0 0 "[ . 1 . 2]" 1
821 1 83 VAL MG2 1 102 GLN H 4.090 . 4.700 3.817 2.900 4.206 . 0 0 "[ . 1 . 2]" 1
822 1 99 THR MG 1 101 PHE H 4.300 . 4.950 3.959 3.433 5.026 0.076 15 0 "[ . 1 . 2]" 1
823 1 46 PHE H 1 101 PHE H 4.150 . 4.770 3.302 2.902 3.657 . 0 0 "[ . 1 . 2]" 1
824 1 80 PHE HA 1 102 GLN H 5.120 . 5.890 4.023 3.687 4.570 . 0 0 "[ . 1 . 2]" 1
825 1 80 PHE QD 1 102 GLN H 4.550 . 5.230 3.654 3.193 4.183 . 0 0 "[ . 1 . 2]" 1
826 1 103 HIS H 1 106 PHE HB2 5.550 . 6.380 4.781 4.341 5.250 . 0 0 "[ . 1 . 2]" 1
827 1 106 PHE H 1 107 LEU HG 4.030 . 4.630 3.951 3.550 4.313 . 0 0 "[ . 1 . 2]" 1
828 1 106 PHE H 1 107 LEU MD2 3.740 . 4.300 3.947 3.624 4.355 0.055 19 0 "[ . 1 . 2]" 1
829 1 106 PHE H 1 107 LEU MD1 4.810 . 5.530 5.235 4.884 5.605 0.075 6 0 "[ . 1 . 2]" 1
830 1 106 PHE H 1 117 ILE MD 4.270 . 4.910 3.661 3.210 4.151 . 0 0 "[ . 1 . 2]" 1
831 1 104 PRO HA 1 106 PHE H 4.250 . 4.890 3.820 3.644 3.932 . 0 0 "[ . 1 . 2]" 1
832 1 103 HIS H 1 106 PHE H 4.850 . 5.580 4.442 4.138 4.772 . 0 0 "[ . 1 . 2]" 1
833 1 112 GLN HE21 1 113 LEU MD1 4.840 . 5.570 4.501 3.386 5.578 0.008 8 0 "[ . 1 . 2]" 1
834 1 17 VAL MG2 1 114 LEU H 4.360 . 5.010 3.646 3.086 4.243 . 0 0 "[ . 1 . 2]" 1
835 1 17 VAL MG2 1 115 GLU H 3.630 . 4.170 2.424 2.212 2.683 . 0 0 "[ . 1 . 2]" 1
836 1 17 VAL MG1 1 115 GLU H 4.420 . 5.080 3.886 3.451 4.126 . 0 0 "[ . 1 . 2]" 1
837 1 113 LEU HA 1 116 ASN HD21 4.000 . 4.600 2.021 1.755 2.881 0.045 12 0 "[ . 1 . 2]" 1
838 1 113 LEU HA 1 116 ASN HD22 3.970 . 4.570 3.083 2.457 3.738 . 0 0 "[ . 1 . 2]" 1
839 1 113 LEU HB3 1 116 ASN HD22 5.970 . 6.870 5.350 4.322 6.102 . 0 0 "[ . 1 . 2]" 1
840 1 113 LEU HG 1 116 ASN HD22 6.000 . 6.900 5.498 4.938 6.129 . 0 0 "[ . 1 . 2]" 1
841 1 115 GLU HB2 1 116 ASN HD21 4.730 . 5.440 4.913 4.033 5.477 0.037 15 0 "[ . 1 . 2]" 1
842 1 113 LEU HB3 1 116 ASN HD21 4.370 . 5.030 4.210 3.380 5.048 0.018 6 0 "[ . 1 . 2]" 1
843 1 113 LEU MD2 1 116 ASN HD21 3.390 . 3.900 3.066 2.569 3.866 . 0 0 "[ . 1 . 2]" 1
844 1 113 LEU MD2 1 116 ASN HD22 3.490 . 4.010 3.159 2.521 3.829 . 0 0 "[ . 1 . 2]" 1
845 1 21 LEU MD1 1 117 ILE H 4.220 . 4.850 3.802 3.580 4.062 . 0 0 "[ . 1 . 2]" 1
846 1 105 CYS HB3 1 117 ILE H 4.910 . 5.650 4.732 4.062 5.569 . 0 0 "[ . 1 . 2]" 1
847 1 115 GLU HA 1 117 ILE H 3.650 . 4.200 3.662 3.318 3.877 . 0 0 "[ . 1 . 2]" 1
848 1 78 TYR QE 1 119 ARG H 4.340 . 4.990 3.463 2.883 3.925 . 0 0 "[ . 1 . 2]" 1
849 1 78 TYR QD 1 119 ARG H 4.410 . 5.070 3.743 3.262 4.334 . 0 0 "[ . 1 . 2]" 1
850 1 40 SER H 1 45 SER H 4.210 . 4.840 3.590 3.345 3.812 . 0 0 "[ . 1 . 2]" 1
851 1 47 HIS HA 1 99 THR H 4.490 . 5.160 4.211 3.891 4.802 . 0 0 "[ . 1 . 2]" 1
852 1 46 PHE H 1 100 GLU HA 4.780 . 5.500 4.145 3.963 4.519 . 0 0 "[ . 1 . 2]" 1
853 1 47 HIS HA 1 101 PHE H 4.040 . 4.650 3.719 3.525 3.887 . 0 0 "[ . 1 . 2]" 1
854 1 81 ARG HA 1 102 GLN HE21 5.630 . 6.470 5.413 4.917 5.985 . 0 0 "[ . 1 . 2]" 1
855 1 81 ARG HD2 1 102 GLN HE22 5.070 . 5.830 3.620 2.638 5.915 0.085 13 0 "[ . 1 . 2]" 1
856 1 81 ARG HD3 1 102 GLN HE22 5.070 . 5.830 4.236 2.524 5.994 0.164 3 0 "[ . 1 . 2]" 1
857 1 81 ARG HB2 1 102 GLN HE21 4.340 . 4.990 3.827 2.872 5.057 0.067 15 0 "[ . 1 . 2]" 1
858 1 81 ARG HB3 1 102 GLN HE22 4.520 . 5.200 4.133 3.453 4.703 . 0 0 "[ . 1 . 2]" 1
859 1 83 VAL MG2 1 102 GLN HE21 4.240 . 4.880 2.735 1.802 3.904 . 0 0 "[ . 1 . 2]" 1
860 1 81 ARG H 1 101 PHE HA 4.870 . 5.600 3.814 3.403 4.247 . 0 0 "[ . 1 . 2]" 1
861 1 43 GLY H 1 45 SER H 4.520 . 5.200 3.641 3.439 3.896 . 0 0 "[ . 1 . 2]" 1
862 1 48 VAL H 1 98 ASP HA 4.210 . 4.840 3.913 3.700 4.877 0.037 8 0 "[ . 1 . 2]" 1
863 1 65 HIS HB2 1 66 ASN H 4.160 . 4.780 2.539 2.345 2.785 . 0 0 "[ . 1 . 2]" 1
864 1 43 GLY HA2 1 108 ARG H 4.810 . 5.530 3.964 3.256 4.871 . 0 0 "[ . 1 . 2]" 1
865 1 28 VAL MG1 1 39 TRP HE1 4.520 . 5.200 4.453 3.174 5.122 . 0 0 "[ . 1 . 2]" 1
866 1 83 VAL H 1 102 GLN H 4.940 . 5.680 4.997 4.619 5.296 . 0 0 "[ . 1 . 2]" 1
867 1 47 HIS H 1 100 GLU HA 4.940 . 5.680 4.518 4.397 4.672 . 0 0 "[ . 1 . 2]" 1
868 1 48 VAL H 1 100 GLU HA 4.090 . 4.700 3.652 3.114 3.847 . 0 0 "[ . 1 . 2]" 1
869 1 48 VAL H 1 101 PHE H 5.940 . 6.830 4.882 4.612 5.112 . 0 0 "[ . 1 . 2]" 1
870 1 49 PHE HA 1 99 THR H 4.630 . 5.320 4.115 3.643 4.528 . 0 0 "[ . 1 . 2]" 1
871 1 40 SER H 1 43 GLY H 4.810 . 5.530 3.884 3.566 4.170 . 0 0 "[ . 1 . 2]" 1
872 1 27 LEU HA 1 30 ASP H 4.430 . 5.090 3.578 3.388 3.775 . 0 0 "[ . 1 . 2]" 1
873 1 50 ASP HB3 1 53 GLN H 4.100 . 4.720 2.957 2.460 3.536 . 0 0 "[ . 1 . 2]" 1
874 1 107 LEU H 1 113 LEU MD1 4.880 . 5.610 3.691 2.595 4.641 . 0 0 "[ . 1 . 2]" 1
875 1 50 ASP H 1 96 ARG HB3 5.920 . 6.810 4.396 3.373 5.077 . 0 0 "[ . 1 . 2]" 1
876 1 91 LEU HB2 1 93 LYS H 4.380 . 5.040 3.373 2.446 4.879 . 0 0 "[ . 1 . 2]" 1
877 1 91 LEU HB3 1 93 LYS H 4.490 . 5.160 3.323 2.075 4.708 . 0 0 "[ . 1 . 2]" 1
878 1 107 LEU MD1 1 110 GLN HE22 3.680 . 4.230 3.969 2.949 4.370 0.140 2 0 "[ . 1 . 2]" 1
879 1 107 LEU MD1 1 110 GLN HE21 3.680 . 4.230 2.970 1.877 4.380 0.150 6 0 "[ . 1 . 2]" 1
880 1 114 LEU HA 1 117 ILE H 3.910 . 4.500 3.412 3.141 3.918 . 0 0 "[ . 1 . 2]" 1
881 1 29 SER H 1 30 ASP HB2 4.670 . 5.370 4.418 4.233 4.641 . 0 0 "[ . 1 . 2]" 1
882 1 106 PHE H 1 107 LEU H 4.950 . 5.690 3.987 3.885 4.114 . 0 0 "[ . 1 . 2]" 1
883 1 107 LEU H 1 110 GLN HB3 5.420 . 6.230 3.567 2.100 4.829 . 0 0 "[ . 1 . 2]" 1
884 1 107 LEU H 1 110 GLN HB2 5.420 . 6.230 3.704 2.405 5.051 . 0 0 "[ . 1 . 2]" 1
885 1 112 GLN H 1 113 LEU HB2 5.380 . 6.190 4.916 4.739 5.080 . 0 0 "[ . 1 . 2]" 1
886 1 112 GLN H 1 114 LEU HG 5.720 . 6.580 4.854 4.527 5.194 . 0 0 "[ . 1 . 2]" 1
887 1 110 GLN HA 1 112 GLN H 3.890 . 4.470 3.362 3.082 3.667 . 0 0 "[ . 1 . 2]" 1
888 1 110 GLN HA 1 112 GLN HE21 4.970 . 5.720 4.626 3.844 5.297 . 0 0 "[ . 1 . 2]" 1
889 1 110 GLN HA 1 112 GLN HE22 4.970 . 5.720 3.543 2.349 5.749 0.029 2 0 "[ . 1 . 2]" 1
890 1 16 ASN H 1 16 ASN HD21 5.320 . 6.120 2.237 1.972 3.654 . 0 0 "[ . 1 . 2]" 1
891 1 36 LEU HB2 1 49 PHE H 5.670 . 6.520 4.868 4.420 5.183 . 0 0 "[ . 1 . 2]" 1
892 1 37 ILE HB 1 49 PHE H 5.870 . 6.750 4.176 3.706 4.535 . 0 0 "[ . 1 . 2]" 1
893 1 36 LEU MD1 1 49 PHE H 5.120 . 5.890 5.324 4.604 5.705 . 0 0 "[ . 1 . 2]" 1
894 1 36 LEU MD2 1 49 PHE H 4.840 . 5.570 4.005 3.648 4.299 . 0 0 "[ . 1 . 2]" 1
895 1 50 ASP H 1 96 ARG HA 5.030 . 5.780 4.033 3.129 4.888 . 0 0 "[ . 1 . 2]" 1
896 1 86 ILE MG 1 89 GLY H 5.960 . 6.850 5.174 3.418 6.439 . 0 0 "[ . 1 . 2]" 1
897 1 69 ALA H 1 72 VAL HB 5.450 . 6.270 5.398 5.221 5.560 . 0 0 "[ . 1 . 2]" 1
898 1 86 ILE H 1 98 ASP H 4.600 . 5.290 3.536 2.471 4.859 . 0 0 "[ . 1 . 2]" 1
899 1 83 VAL H 1 101 PHE QD 5.010 . 5.760 4.739 4.194 5.001 . 0 0 "[ . 1 . 2]" 1
900 1 83 VAL H 1 100 GLU HG2 5.570 . 6.410 4.860 4.261 5.672 . 0 0 "[ . 1 . 2]" 1
901 1 72 VAL H 1 75 LEU MD1 4.730 . 5.440 4.226 3.798 4.760 . 0 0 "[ . 1 . 2]" 1
902 1 16 ASN H 1 16 ASN HD22 5.680 . 6.530 3.583 3.176 4.276 . 0 0 "[ . 1 . 2]" 1
903 1 84 VAL HA 1 100 GLU H 5.160 . 5.930 3.775 3.240 4.592 . 0 0 "[ . 1 . 2]" 1
904 1 81 ARG H 1 102 GLN HG2 4.670 . 5.370 3.414 2.954 4.159 . 0 0 "[ . 1 . 2]" 1
905 1 50 ASP HA 1 97 ASP H 3.730 . 4.290 3.179 2.196 4.464 0.174 15 0 "[ . 1 . 2]" 1
906 1 28 VAL H 1 37 ILE MG 4.490 . 5.160 4.245 3.968 4.840 . 0 0 "[ . 1 . 2]" 1
907 1 15 SER H 1 15 SER HG 4.350 . 5.000 3.735 2.178 4.631 . 0 0 "[ . 1 . 2]" 1
908 1 15 SER HG 1 16 ASN H 3.600 . 4.140 3.198 2.344 4.222 0.082 1 0 "[ . 1 . 2]" 1
909 1 15 SER HG 1 16 ASN HD21 3.890 . 4.470 4.239 3.456 4.849 0.379 18 0 "[ . 1 . 2]" 1
910 1 106 PHE H 1 113 LEU MD1 4.940 . 5.680 4.698 3.452 5.412 . 0 0 "[ . 1 . 2]" 1
911 1 103 HIS HB3 1 106 PHE H 3.620 . 4.160 3.243 2.896 3.795 . 0 0 "[ . 1 . 2]" 1
912 1 107 LEU H 1 108 ARG H 4.980 . 5.730 4.408 4.099 4.513 . 0 0 "[ . 1 . 2]" 1
913 1 57 GLU H 1 59 LEU H 4.030 . 4.630 4.041 3.923 4.183 . 0 0 "[ . 1 . 2]" 1
914 1 56 LYS H 1 58 VAL H 4.000 . 4.600 4.140 4.045 4.234 . 0 0 "[ . 1 . 2]" 1
915 1 111 GLU H 1 112 GLN HB3 5.310 . 6.110 4.993 4.822 5.146 . 0 0 "[ . 1 . 2]" 1
916 1 65 HIS HD2 1 66 ASN H 5.580 . 6.420 5.768 5.467 6.043 . 0 0 "[ . 1 . 2]" 1
917 1 60 PRO HD2 1 61 LYS H 4.410 . 5.070 2.982 2.872 3.135 . 0 0 "[ . 1 . 2]" 1
918 1 11 MET HA 1 11 MET HG2 4.110 . 4.730 3.212 2.422 4.294 . 0 0 "[ . 1 . 2]" 1
919 1 11 MET HA 1 11 MET HG3 4.110 . 4.730 3.416 2.599 4.311 . 0 0 "[ . 1 . 2]" 1
920 1 11 MET HA 1 11 MET ME 5.120 . 5.890 4.093 2.272 5.249 . 0 0 "[ . 1 . 2]" 1
921 1 16 ASN HA 1 16 ASN HD21 3.880 . 4.460 3.429 1.965 4.060 . 0 0 "[ . 1 . 2]" 1
922 1 16 ASN H 1 16 ASN HB2 4.120 . 4.740 2.715 2.403 3.634 . 0 0 "[ . 1 . 2]" 1
923 1 17 VAL H 1 17 VAL MG1 3.880 . 4.460 3.805 3.779 3.844 . 0 0 "[ . 1 . 2]" 1
924 1 17 VAL HA 1 17 VAL MG1 3.230 . 3.710 2.464 2.384 2.543 . 0 0 "[ . 1 . 2]" 1
925 1 17 VAL HA 1 17 VAL MG2 3.150 . 3.620 2.466 2.379 2.555 . 0 0 "[ . 1 . 2]" 1
926 1 20 PHE HA 1 20 PHE QE 5.060 . 5.820 4.688 4.600 4.785 . 0 0 "[ . 1 . 2]" 1
927 1 20 PHE HA 1 20 PHE QD 3.360 . 3.860 2.902 2.720 3.101 . 0 0 "[ . 1 . 2]" 1
928 1 21 LEU HA 1 21 LEU HG 4.160 . 4.780 3.114 3.029 3.185 . 0 0 "[ . 1 . 2]" 1
929 1 21 LEU HA 1 21 LEU MD1 4.140 . 4.760 3.897 3.848 3.936 . 0 0 "[ . 1 . 2]" 1
930 1 18 PRO HD3 1 21 LEU MD1 3.510 . 4.040 3.258 2.952 3.564 . 0 0 "[ . 1 . 2]" 1
931 1 21 LEU HB2 1 21 LEU MD1 3.450 . 3.970 2.373 2.321 2.421 . 0 0 "[ . 1 . 2]" 1
932 1 21 LEU HA 1 21 LEU MD2 3.140 . 3.610 2.035 1.970 2.119 . 0 0 "[ . 1 . 2]" 1
933 1 21 LEU HB3 1 21 LEU MD2 3.470 . 3.990 2.464 2.388 2.532 . 0 0 "[ . 1 . 2]" 1
934 1 22 THR H 1 22 THR HB 3.480 . 4.000 2.567 2.361 2.653 . 0 0 "[ . 1 . 2]" 1
935 1 22 THR H 1 22 THR MG 3.560 . 4.090 2.679 2.148 3.734 . 0 0 "[ . 1 . 2]" 1
936 1 22 THR HA 1 22 THR MG 3.220 . 3.700 3.023 2.411 3.276 . 0 0 "[ . 1 . 2]" 1
937 1 23 LYS HA 1 23 LYS HG3 4.240 . 4.880 3.768 3.222 3.918 . 0 0 "[ . 1 . 2]" 1
938 1 23 LYS HA 1 23 LYS HE2 3.660 . 4.210 2.810 1.780 4.242 0.032 12 0 "[ . 1 . 2]" 1
939 1 23 LYS HA 1 23 LYS HE3 3.660 . 4.210 2.760 1.779 4.325 0.115 3 0 "[ . 1 . 2]" 1
940 1 23 LYS HB3 1 23 LYS HD3 3.940 . 4.530 2.490 2.365 2.891 . 0 0 "[ . 1 . 2]" 1
941 1 23 LYS HA 1 23 LYS HG2 4.240 . 4.880 2.861 2.468 3.132 . 0 0 "[ . 1 . 2]" 1
942 1 23 LYS H 1 23 LYS HG3 4.440 . 5.110 3.440 2.335 3.744 . 0 0 "[ . 1 . 2]" 1
943 1 23 LYS H 1 23 LYS HD2 6.000 . 6.900 4.933 4.707 5.138 . 0 0 "[ . 1 . 2]" 1
944 1 23 LYS H 1 23 LYS HD3 6.000 . 6.900 4.835 4.369 5.103 . 0 0 "[ . 1 . 2]" 1
945 1 23 LYS HB3 1 23 LYS HD2 3.940 . 4.530 3.669 3.630 3.755 . 0 0 "[ . 1 . 2]" 1
946 1 23 LYS HB3 1 23 LYS HE2 4.320 . 4.970 3.381 2.060 4.329 . 0 0 "[ . 1 . 2]" 1
947 1 23 LYS HB3 1 23 LYS HE3 4.320 . 4.970 3.627 2.853 4.358 . 0 0 "[ . 1 . 2]" 1
948 1 26 THR HA 1 26 THR MG 3.120 . 3.590 2.441 2.364 2.488 . 0 0 "[ . 1 . 2]" 1
949 1 26 THR H 1 26 THR HB 3.660 . 4.210 2.594 2.515 2.770 . 0 0 "[ . 1 . 2]" 1
950 1 26 THR H 1 26 THR MG 4.140 . 4.760 3.786 3.764 3.812 . 0 0 "[ . 1 . 2]" 1
951 1 24 LEU HA 1 24 LEU MD1 3.650 . 4.200 2.205 2.147 2.261 . 0 0 "[ . 1 . 2]" 1
952 1 27 LEU HA 1 27 LEU MD1 3.310 . 3.810 2.180 2.076 2.318 . 0 0 "[ . 1 . 2]" 1
953 1 27 LEU H 1 27 LEU MD2 4.320 . 4.970 4.195 4.141 4.263 . 0 0 "[ . 1 . 2]" 1
954 1 24 LEU HA 1 27 LEU MD2 3.900 . 4.490 2.714 2.428 3.035 . 0 0 "[ . 1 . 2]" 1
955 1 28 VAL H 1 28 VAL MG2 3.440 . 3.960 2.074 1.917 2.217 . 0 0 "[ . 1 . 2]" 1
956 1 77 MET HB2 1 77 MET HG3 2.480 . 2.850 2.423 2.378 2.595 . 0 0 "[ . 1 . 2]" 1
957 1 33 THR HA 1 33 THR MG 3.200 . 3.680 2.364 2.304 2.434 . 0 0 "[ . 1 . 2]" 1
958 1 36 LEU HB2 1 37 ILE MG 4.400 . 5.060 3.320 3.169 3.443 . 0 0 "[ . 1 . 2]" 1
959 1 36 LEU HA 1 36 LEU HG 4.110 . 4.730 3.244 3.142 3.358 . 0 0 "[ . 1 . 2]" 1
960 1 36 LEU HA 1 36 LEU MD2 4.100 . 4.720 2.057 1.967 2.119 . 0 0 "[ . 1 . 2]" 1
961 1 36 LEU HB2 1 36 LEU MD2 3.320 . 3.820 3.251 3.242 3.261 . 0 0 "[ . 1 . 2]" 1
962 1 36 LEU HA 1 36 LEU MD1 3.600 . 4.140 3.887 3.864 3.915 . 0 0 "[ . 1 . 2]" 1
963 1 36 LEU HB2 1 36 LEU MD1 3.470 . 3.990 2.420 2.376 2.467 . 0 0 "[ . 1 . 2]" 1
964 1 36 LEU HB3 1 36 LEU MD1 3.330 . 3.830 2.398 2.364 2.437 . 0 0 "[ . 1 . 2]" 1
965 1 37 ILE HA 1 37 ILE HG13 4.060 . 4.670 2.527 2.488 2.552 . 0 0 "[ . 1 . 2]" 1
966 1 37 ILE HA 1 37 ILE HG12 4.060 . 4.670 3.224 3.193 3.248 . 0 0 "[ . 1 . 2]" 1
967 1 37 ILE HA 1 48 VAL MG2 4.290 . 4.930 3.577 3.263 3.987 . 0 0 "[ . 1 . 2]" 1
968 1 37 ILE H 1 37 ILE MD 4.950 . 5.690 5.018 4.974 5.059 . 0 0 "[ . 1 . 2]" 1
969 1 37 ILE HA 1 37 ILE MD 4.140 . 4.760 3.830 3.803 3.855 . 0 0 "[ . 1 . 2]" 1
970 1 37 ILE MD 1 37 ILE MG 3.100 . 3.570 2.070 2.041 2.098 . 0 0 "[ . 1 . 2]" 1
971 1 47 HIS HA 1 47 HIS HD2 3.850 . 4.430 3.834 3.434 4.266 . 0 0 "[ . 1 . 2]" 1
972 1 47 HIS H 1 47 HIS HB3 4.200 . 4.830 3.687 3.632 3.736 . 0 0 "[ . 1 . 2]" 1
973 1 46 PHE HB2 1 47 HIS HD2 6.000 . 6.900 5.201 4.859 5.632 . 0 0 "[ . 1 . 2]" 1
974 1 48 VAL HA 1 48 VAL MG1 3.540 . 4.070 2.460 2.396 2.523 . 0 0 "[ . 1 . 2]" 1
975 1 49 PHE HA 1 49 PHE QD 4.220 . 4.850 2.914 2.632 3.103 . 0 0 "[ . 1 . 2]" 1
976 1 51 GLN HA 1 51 GLN HG2 4.210 . 4.840 2.676 2.441 3.332 . 0 0 "[ . 1 . 2]" 1
977 1 51 GLN HA 1 51 GLN HG3 4.210 . 4.840 3.280 2.989 3.866 . 0 0 "[ . 1 . 2]" 1
978 1 53 GLN HA 1 53 GLN HG3 3.630 . 4.170 3.154 3.071 3.306 . 0 0 "[ . 1 . 2]" 1
979 1 53 GLN H 1 53 GLN HG2 4.490 . 5.160 4.635 4.505 4.689 . 0 0 "[ . 1 . 2]" 1
980 1 53 GLN HA 1 53 GLN HG2 4.030 . 4.630 3.832 3.790 3.954 . 0 0 "[ . 1 . 2]" 1
981 1 53 GLN H 1 53 GLN HG3 4.110 . 4.730 4.498 4.315 4.538 . 0 0 "[ . 1 . 2]" 1
982 1 53 GLN HG3 1 57 GLU HG2 3.550 . 4.080 2.902 2.463 4.032 . 0 0 "[ . 1 . 2]" 1
983 1 54 PHE HA 1 54 PHE QD 3.860 . 4.440 3.045 2.927 3.131 . 0 0 "[ . 1 . 2]" 1
984 1 56 LYS HA 1 56 LYS HG3 3.790 . 4.360 3.615 3.023 3.833 . 0 0 "[ . 1 . 2]" 1
985 1 56 LYS HA 1 60 PRO HG3 3.580 . 4.120 4.175 3.970 4.321 0.201 10 0 "[ . 1 . 2]" 1
986 1 56 LYS HB3 1 56 LYS HE2 5.140 . 5.910 4.601 4.328 4.704 . 0 0 "[ . 1 . 2]" 1
987 1 56 LYS HB3 1 56 LYS HE3 5.140 . 5.910 4.595 4.528 4.712 . 0 0 "[ . 1 . 2]" 1
988 1 56 LYS HB2 1 56 LYS HD2 3.860 . 4.440 3.449 2.735 3.626 . 0 0 "[ . 1 . 2]" 1
989 1 56 LYS H 1 56 LYS HG3 4.730 . 5.440 4.638 4.517 4.691 . 0 0 "[ . 1 . 2]" 1
990 1 53 GLN HA 1 56 LYS HG3 4.220 . 4.850 4.279 4.036 4.703 . 0 0 "[ . 1 . 2]" 1
991 1 56 LYS HA 1 56 LYS HG2 3.500 . 4.030 2.850 2.697 3.194 . 0 0 "[ . 1 . 2]" 1
992 1 56 LYS H 1 56 LYS HD2 4.720 . 5.430 4.678 4.247 4.815 . 0 0 "[ . 1 . 2]" 1
993 1 56 LYS H 1 56 LYS HD3 4.880 . 5.610 4.340 4.191 4.595 . 0 0 "[ . 1 . 2]" 1
994 1 53 GLN HA 1 56 LYS HD2 3.510 . 4.040 3.211 2.733 3.473 . 0 0 "[ . 1 . 2]" 1
995 1 56 LYS HB3 1 56 LYS HD2 3.450 . 3.970 2.558 2.377 2.851 . 0 0 "[ . 1 . 2]" 1
996 1 56 LYS HB3 1 56 LYS HD3 3.730 . 4.290 2.614 2.359 2.908 . 0 0 "[ . 1 . 2]" 1
997 1 56 LYS HD2 1 56 LYS HG3 2.550 . 2.930 2.447 2.386 2.533 . 0 0 "[ . 1 . 2]" 1
998 1 57 GLU HA 1 57 GLU HG3 3.710 . 4.270 3.763 3.705 3.824 . 0 0 "[ . 1 . 2]" 1
999 1 57 GLU HA 1 57 GLU HG2 3.950 . 4.540 3.833 3.722 3.908 . 0 0 "[ . 1 . 2]" 1
1000 1 57 GLU H 1 57 GLU HB2 3.810 . 4.380 3.753 3.724 3.782 . 0 0 "[ . 1 . 2]" 1
1001 1 57 GLU HA 1 57 GLU HB2 2.990 . 3.440 2.512 2.462 2.550 . 0 0 "[ . 1 . 2]" 1
1002 1 57 GLU H 1 57 GLU HG3 3.570 . 4.110 2.742 2.391 2.912 . 0 0 "[ . 1 . 2]" 1
1003 1 57 GLU HB3 1 57 GLU HG3 2.980 . 3.430 3.019 2.993 3.031 . 0 0 "[ . 1 . 2]" 1
1004 1 57 GLU H 1 57 GLU HG2 3.520 . 4.050 2.286 2.115 2.472 . 0 0 "[ . 1 . 2]" 1
1005 1 58 VAL HA 1 58 VAL MG2 2.900 . 3.340 2.416 2.375 2.463 . 0 0 "[ . 1 . 2]" 1
1006 1 58 VAL H 1 58 VAL MG1 3.830 . 4.400 3.778 3.737 3.805 . 0 0 "[ . 1 . 2]" 1
1007 1 58 VAL HA 1 58 VAL MG1 3.160 . 3.630 2.481 2.443 2.536 . 0 0 "[ . 1 . 2]" 1
1008 1 59 LEU HA 1 59 LEU MD2 3.260 . 3.750 1.962 1.924 2.007 . 0 0 "[ . 1 . 2]" 1
1009 1 59 LEU H 1 59 LEU MD1 4.090 . 4.700 3.914 3.853 4.019 . 0 0 "[ . 1 . 2]" 1
1010 1 59 LEU HA 1 59 LEU MD1 3.910 . 4.500 3.831 3.809 3.851 . 0 0 "[ . 1 . 2]" 1
1011 1 59 LEU HB2 1 59 LEU MD1 3.370 . 3.880 2.441 2.398 2.473 . 0 0 "[ . 1 . 2]" 1
1012 1 59 LEU H 1 59 LEU MD2 3.550 . 4.080 3.322 3.144 3.494 . 0 0 "[ . 1 . 2]" 1
1013 1 58 VAL HB 1 60 PRO HD2 4.370 . 5.030 4.560 4.443 4.686 . 0 0 "[ . 1 . 2]" 1
1014 1 77 MET HB3 1 119 ARG HB2 3.860 . 4.440 2.590 1.957 3.611 . 0 0 "[ . 1 . 2]" 1
1015 1 61 LYS HA 1 61 LYS HG3 3.550 . 4.080 2.628 2.521 2.736 . 0 0 "[ . 1 . 2]" 1
1016 1 61 LYS HA 1 61 LYS HG2 3.830 . 4.400 3.213 3.122 3.329 . 0 0 "[ . 1 . 2]" 1
1017 1 61 LYS HA 1 61 LYS HD3 4.860 . 5.590 4.769 4.696 4.808 . 0 0 "[ . 1 . 2]" 1
1018 1 61 LYS HA 1 61 LYS HE2 6.000 . 6.900 5.607 5.097 6.348 . 0 0 "[ . 1 . 2]" 1
1019 1 61 LYS HA 1 61 LYS HE3 6.000 . 6.900 5.549 5.002 6.252 . 0 0 "[ . 1 . 2]" 1
1020 1 61 LYS HB2 1 61 LYS HD3 3.650 . 4.200 3.053 2.830 3.159 . 0 0 "[ . 1 . 2]" 1
1021 1 61 LYS H 1 61 LYS HG2 5.020 . 5.770 4.494 4.414 4.544 . 0 0 "[ . 1 . 2]" 1
1022 1 61 LYS H 1 61 LYS HD2 5.450 . 6.270 5.005 4.779 5.160 . 0 0 "[ . 1 . 2]" 1
1023 1 61 LYS HA 1 61 LYS HD2 4.860 . 5.590 4.410 4.293 4.526 . 0 0 "[ . 1 . 2]" 1
1024 1 61 LYS HB2 1 61 LYS HD2 3.650 . 4.200 2.538 2.405 2.660 . 0 0 "[ . 1 . 2]" 1
1025 1 61 LYS H 1 61 LYS HD3 5.450 . 6.270 4.948 4.745 5.096 . 0 0 "[ . 1 . 2]" 1
1026 1 62 TYR H 1 62 TYR QE 5.210 . 5.990 4.647 4.385 4.872 . 0 0 "[ . 1 . 2]" 1
1027 1 62 TYR HA 1 62 TYR QE 4.790 . 5.510 4.559 4.451 4.654 . 0 0 "[ . 1 . 2]" 1
1028 1 63 PHE HA 1 63 PHE QD 3.670 . 4.220 2.799 2.598 3.022 . 0 0 "[ . 1 . 2]" 1
1029 1 64 LYS HA 1 64 LYS HD2 5.440 . 6.260 4.231 2.135 5.610 . 0 0 "[ . 1 . 2]" 1
1030 1 64 LYS HA 1 64 LYS HD3 5.440 . 6.260 4.216 1.887 5.635 . 0 0 "[ . 1 . 2]" 1
1031 1 64 LYS H 1 64 LYS HG2 4.180 . 4.810 3.228 2.042 4.413 . 0 0 "[ . 1 . 2]" 1
1032 1 64 LYS HA 1 64 LYS HG2 3.980 . 4.580 3.329 2.565 4.289 . 0 0 "[ . 1 . 2]" 1
1033 1 64 LYS HA 1 64 LYS HG3 3.980 . 4.580 3.575 2.552 3.877 . 0 0 "[ . 1 . 2]" 1
1034 1 64 LYS H 1 64 LYS HE2 6.000 . 6.900 5.633 4.029 6.700 . 0 0 "[ . 1 . 2]" 1
1035 1 64 LYS H 1 64 LYS HE3 6.000 . 6.900 5.297 3.545 6.686 . 0 0 "[ . 1 . 2]" 1
1036 1 68 MET HB2 1 68 MET ME 3.210 . 3.690 3.619 2.128 4.003 0.313 11 0 "[ . 1 . 2]" 1
1037 1 68 MET H 1 68 MET HG2 4.760 . 5.470 4.589 4.375 4.686 . 0 0 "[ . 1 . 2]" 1
1038 1 68 MET H 1 68 MET HG3 4.760 . 5.470 4.544 4.466 4.652 . 0 0 "[ . 1 . 2]" 1
1039 1 68 MET H 1 68 MET ME 5.430 . 6.240 5.434 4.157 5.997 . 0 0 "[ . 1 . 2]" 1
1040 1 68 MET HA 1 68 MET ME 4.050 . 4.660 3.705 1.915 4.619 . 0 0 "[ . 1 . 2]" 1
1041 1 68 MET HB3 1 68 MET ME 4.720 . 5.430 4.062 3.504 4.317 . 0 0 "[ . 1 . 2]" 1
1042 1 68 MET ME 1 68 MET HG2 3.500 . 4.030 2.749 2.420 3.439 . 0 0 "[ . 1 . 2]" 1
1043 1 68 MET ME 1 68 MET HG3 3.500 . 4.030 2.475 2.365 2.588 . 0 0 "[ . 1 . 2]" 1
1044 1 71 PHE HA 1 71 PHE QD 3.760 . 4.320 2.741 2.533 2.971 . 0 0 "[ . 1 . 2]" 1
1045 1 72 VAL H 1 72 VAL MG2 2.900 . 3.340 2.023 1.943 2.095 . 0 0 "[ . 1 . 2]" 1
1046 1 72 VAL HA 1 72 VAL MG2 2.960 . 3.400 2.451 2.395 2.484 . 0 0 "[ . 1 . 2]" 1
1047 1 72 VAL HA 1 72 VAL MG1 3.230 . 3.710 2.479 2.430 2.533 . 0 0 "[ . 1 . 2]" 1
1048 1 73 ARG HA 1 73 ARG HG3 3.560 . 4.090 2.692 2.497 2.869 . 0 0 "[ . 1 . 2]" 1
1049 1 73 ARG H 1 73 ARG HG2 4.430 . 5.090 4.516 4.400 4.584 . 0 0 "[ . 1 . 2]" 1
1050 1 73 ARG HA 1 73 ARG HG2 3.690 . 4.240 3.223 3.049 3.412 . 0 0 "[ . 1 . 2]" 1
1051 1 74 GLN HA 1 77 MET ME 3.350 . 3.850 1.988 1.768 3.089 0.032 13 0 "[ . 1 . 2]" 1
1052 1 74 GLN HA 1 74 GLN HG2 3.470 . 3.990 3.212 2.909 3.392 . 0 0 "[ . 1 . 2]" 1
1053 1 74 GLN HA 1 74 GLN HG3 3.810 . 4.380 3.812 3.764 3.856 . 0 0 "[ . 1 . 2]" 1
1054 1 74 GLN HG3 1 78 TYR QE 5.250 . 6.040 4.083 3.670 4.518 . 0 0 "[ . 1 . 2]" 1
1055 1 74 GLN HB2 1 74 GLN HG2 2.740 . 3.150 2.437 2.379 2.595 . 0 0 "[ . 1 . 2]" 1
1056 1 75 LEU HA 1 75 LEU HG 3.880 . 4.460 2.993 2.838 3.161 . 0 0 "[ . 1 . 2]" 1
1057 1 75 LEU HA 1 75 LEU MD2 3.280 . 3.770 2.105 2.047 2.244 . 0 0 "[ . 1 . 2]" 1
1058 1 75 LEU HB2 1 75 LEU HG 2.890 . 3.320 2.544 2.477 2.619 . 0 0 "[ . 1 . 2]" 1
1059 1 75 LEU HA 1 75 LEU MD1 4.100 . 4.720 3.920 3.884 3.949 . 0 0 "[ . 1 . 2]" 1
1060 1 75 LEU HB2 1 75 LEU MD1 3.370 . 3.880 2.331 2.262 2.387 . 0 0 "[ . 1 . 2]" 1
1061 1 77 MET HB2 1 77 MET ME 3.360 . 3.860 2.122 1.995 2.473 . 0 0 "[ . 1 . 2]" 1
1062 1 77 MET H 1 77 MET HB3 3.730 . 4.290 3.643 3.611 3.682 . 0 0 "[ . 1 . 2]" 1
1063 1 77 MET HB3 1 77 MET ME 3.060 . 3.520 2.714 2.258 2.983 . 0 0 "[ . 1 . 2]" 1
1064 1 77 MET H 1 77 MET HG3 3.640 . 4.190 2.431 2.271 2.558 . 0 0 "[ . 1 . 2]" 1
1065 1 77 MET HA 1 77 MET HG3 3.350 . 3.850 3.208 2.839 3.335 . 0 0 "[ . 1 . 2]" 1
1066 1 77 MET HA 1 77 MET HG2 3.880 . 4.460 2.562 2.506 2.758 . 0 0 "[ . 1 . 2]" 1
1067 1 77 MET H 1 77 MET ME 4.180 . 4.810 3.780 3.514 4.471 . 0 0 "[ . 1 . 2]" 1
1068 1 77 MET HA 1 77 MET ME 4.300 . 4.950 4.454 4.247 4.558 . 0 0 "[ . 1 . 2]" 1
1069 1 77 MET ME 1 77 MET HG2 3.550 . 4.080 3.396 2.681 3.445 . 0 0 "[ . 1 . 2]" 1
1070 1 78 TYR H 1 78 TYR HB3 4.180 . 4.810 3.608 3.566 3.646 . 0 0 "[ . 1 . 2]" 1
1071 1 78 TYR QE 1 118 LYS HA 3.990 . 4.590 3.673 2.766 4.508 . 0 0 "[ . 1 . 2]" 1
1072 1 80 PHE HA 1 80 PHE QD 3.830 . 4.400 3.150 2.965 3.219 . 0 0 "[ . 1 . 2]" 1
1073 1 81 ARG HA 1 81 ARG HD2 5.450 . 6.270 4.503 2.492 4.930 . 0 0 "[ . 1 . 2]" 1
1074 1 81 ARG HA 1 81 ARG HD3 5.450 . 6.270 4.570 2.339 4.960 . 0 0 "[ . 1 . 2]" 1
1075 1 81 ARG H 1 81 ARG HD2 6.000 . 6.900 5.274 4.927 6.159 . 0 0 "[ . 1 . 2]" 1
1076 1 81 ARG H 1 81 ARG HD3 6.000 . 6.900 5.776 4.712 6.177 . 0 0 "[ . 1 . 2]" 1
1077 1 82 LYS H 1 82 LYS HD2 5.570 . 6.410 4.837 4.704 5.164 . 0 0 "[ . 1 . 2]" 1
1078 1 82 LYS H 1 82 LYS HD3 5.570 . 6.410 4.961 4.727 5.167 . 0 0 "[ . 1 . 2]" 1
1079 1 82 LYS HA 1 82 LYS HE2 5.870 . 6.750 5.114 4.353 5.747 . 0 0 "[ . 1 . 2]" 1
1080 1 82 LYS HA 1 82 LYS HE3 5.870 . 6.750 4.758 4.378 5.421 . 0 0 "[ . 1 . 2]" 1
1081 1 83 VAL HA 1 83 VAL MG2 3.220 . 3.700 2.501 2.467 2.560 . 0 0 "[ . 1 . 2]" 1
1082 1 83 VAL H 1 83 VAL MG1 4.070 . 4.680 3.914 3.878 3.951 . 0 0 "[ . 1 . 2]" 1
1083 1 83 VAL HA 1 83 VAL MG1 3.220 . 3.700 2.451 2.406 2.499 . 0 0 "[ . 1 . 2]" 1
1084 1 84 VAL HA 1 84 VAL MG1 3.280 . 3.770 2.871 2.382 3.286 . 0 0 "[ . 1 . 2]" 1
1085 1 84 VAL HA 1 84 VAL MG2 3.280 . 3.770 2.455 2.373 2.609 . 0 0 "[ . 1 . 2]" 1
1086 1 85 HIS HA 1 85 HIS HD2 4.810 . 5.530 3.878 3.057 4.351 . 0 0 "[ . 1 . 2]" 1
1087 1 86 ILE HA 1 86 ILE HG12 3.930 . 4.520 3.111 2.940 3.271 . 0 0 "[ . 1 . 2]" 1
1088 1 86 ILE HA 1 86 ILE MD 3.130 . 3.600 2.096 1.993 2.345 . 0 0 "[ . 1 . 2]" 1
1089 1 86 ILE HA 1 86 ILE MG 3.010 . 3.460 2.510 2.363 2.638 . 0 0 "[ . 1 . 2]" 1
1090 1 86 ILE HG12 1 86 ILE MG 3.280 . 3.770 3.249 3.227 3.259 . 0 0 "[ . 1 . 2]" 1
1091 1 86 ILE HG13 1 86 ILE MG 3.280 . 3.770 2.386 2.323 2.437 . 0 0 "[ . 1 . 2]" 1
1092 1 86 ILE HA 1 86 ILE HG13 3.930 . 4.520 3.774 3.718 3.910 . 0 0 "[ . 1 . 2]" 1
1093 1 86 ILE H 1 86 ILE MD 4.760 . 5.470 3.525 3.183 3.790 . 0 0 "[ . 1 . 2]" 1
1094 1 86 ILE HB 1 86 ILE MD 3.270 . 3.760 3.280 3.265 3.292 . 0 0 "[ . 1 . 2]" 1
1095 1 86 ILE MD 1 86 ILE MG 2.400 . 2.760 2.115 2.039 2.212 . 0 0 "[ . 1 . 2]" 1
1096 1 87 GLU HA 1 87 GLU HB3 3.000 . 3.450 2.554 2.442 3.045 . 0 0 "[ . 1 . 2]" 1
1097 1 17 VAL HA 1 115 GLU HB3 3.580 . 4.120 2.728 2.070 3.925 . 0 0 "[ . 1 . 2]" 1
1098 1 91 LEU HA 1 91 LEU HB3 2.870 . 3.300 2.491 2.451 2.547 . 0 0 "[ . 1 . 2]" 1
1099 1 91 LEU HA 1 91 LEU MD2 2.850 . 3.280 2.131 2.022 2.205 . 0 0 "[ . 1 . 2]" 1
1100 1 91 LEU HB3 1 91 LEU MD1 3.230 . 3.710 2.419 2.367 2.480 . 0 0 "[ . 1 . 2]" 1
1101 1 91 LEU HA 1 91 LEU HG 3.650 . 4.200 3.259 3.124 3.382 . 0 0 "[ . 1 . 2]" 1
1102 1 91 LEU HB2 1 91 LEU HG 2.550 . 2.930 2.464 2.428 2.501 . 0 0 "[ . 1 . 2]" 1
1103 1 91 LEU HA 1 91 LEU MD1 4.110 . 4.730 3.931 3.896 3.979 . 0 0 "[ . 1 . 2]" 1
1104 1 91 LEU HB2 1 91 LEU MD1 3.110 . 3.580 2.402 2.345 2.445 . 0 0 "[ . 1 . 2]" 1
1105 1 91 LEU HB2 1 91 LEU MD2 3.380 . 3.890 3.254 3.245 3.261 . 0 0 "[ . 1 . 2]" 1
1106 1 91 LEU HB3 1 91 LEU MD2 3.130 . 3.600 2.488 2.433 2.547 . 0 0 "[ . 1 . 2]" 1
1107 1 93 LYS HA 1 93 LYS HG2 3.940 . 4.530 2.972 2.438 3.853 . 0 0 "[ . 1 . 2]" 1
1108 1 93 LYS HA 1 93 LYS HG3 3.940 . 4.530 3.486 2.895 3.917 . 0 0 "[ . 1 . 2]" 1
1109 1 93 LYS H 1 93 LYS HB2 3.740 . 4.300 2.816 2.349 4.058 . 0 0 "[ . 1 . 2]" 1
1110 1 93 LYS H 1 93 LYS HB3 3.740 . 4.300 3.585 2.519 4.083 . 0 0 "[ . 1 . 2]" 1
1111 1 93 LYS H 1 93 LYS HD2 5.410 . 6.220 4.764 3.812 5.346 . 0 0 "[ . 1 . 2]" 1
1112 1 93 LYS H 1 93 LYS HD3 5.410 . 6.220 4.500 3.289 5.572 . 0 0 "[ . 1 . 2]" 1
1113 1 57 GLU HA 1 60 PRO HD2 4.820 . 5.540 3.510 3.236 3.725 . 0 0 "[ . 1 . 2]" 1
1114 1 95 GLU HA 1 95 GLU HB3 3.000 . 3.450 2.434 2.387 2.531 . 0 0 "[ . 1 . 2]" 1
1115 1 95 GLU H 1 95 GLU HB2 3.770 . 4.340 3.651 3.596 3.697 . 0 0 "[ . 1 . 2]" 1
1116 1 95 GLU HA 1 95 GLU HG2 3.830 . 4.400 3.822 3.719 4.288 . 0 0 "[ . 1 . 2]" 1
1117 1 95 GLU HA 1 95 GLU HG3 3.830 . 4.400 3.828 3.743 4.309 . 0 0 "[ . 1 . 2]" 1
1118 1 57 GLU HB2 1 57 GLU HG3 2.700 . 3.110 2.576 2.483 2.682 . 0 0 "[ . 1 . 2]" 1
1119 1 96 ARG HB2 1 96 ARG HD2 3.870 . 4.450 3.256 2.413 3.799 . 0 0 "[ . 1 . 2]" 1
1120 1 96 ARG HA 1 96 ARG HG2 4.230 . 4.860 3.826 3.746 3.898 . 0 0 "[ . 1 . 2]" 1
1121 1 96 ARG HB3 1 96 ARG HG2 2.790 . 3.210 2.478 2.425 2.574 . 0 0 "[ . 1 . 2]" 1
1122 1 96 ARG HB2 1 96 ARG HG3 2.890 . 3.320 2.472 2.388 2.520 . 0 0 "[ . 1 . 2]" 1
1123 1 96 ARG H 1 96 ARG HD2 5.530 . 6.360 4.700 3.959 5.071 . 0 0 "[ . 1 . 2]" 1
1124 1 96 ARG H 1 96 ARG HD3 5.530 . 6.360 4.650 4.097 5.302 . 0 0 "[ . 1 . 2]" 1
1125 1 96 ARG HB2 1 96 ARG HD3 3.870 . 4.450 2.892 2.455 3.794 . 0 0 "[ . 1 . 2]" 1
1126 1 99 THR HA 1 99 THR MG 3.240 . 3.730 2.415 2.324 2.523 . 0 0 "[ . 1 . 2]" 1
1127 1 100 GLU H 1 100 GLU HG3 5.200 . 5.980 4.680 4.622 4.817 . 0 0 "[ . 1 . 2]" 1
1128 1 102 GLN H 1 102 GLN HB3 4.150 . 4.770 3.126 2.972 3.326 . 0 0 "[ . 1 . 2]" 1
1129 1 102 GLN H 1 102 GLN HG2 4.040 . 4.650 2.282 2.075 2.432 . 0 0 "[ . 1 . 2]" 1
1130 1 102 GLN HA 1 102 GLN HG2 4.250 . 4.890 3.820 3.753 3.864 . 0 0 "[ . 1 . 2]" 1
1131 1 103 HIS HB3 1 104 PRO HD2 3.640 . 4.190 4.120 4.057 4.232 0.042 18 0 "[ . 1 . 2]" 1
1132 1 106 PHE HA 1 106 PHE QD 4.210 . 4.840 2.938 2.626 3.199 . 0 0 "[ . 1 . 2]" 1
1133 1 107 LEU HA 1 107 LEU MD1 4.030 . 4.630 3.960 3.876 4.025 . 0 0 "[ . 1 . 2]" 1
1134 1 107 LEU HB3 1 107 LEU MD1 3.080 . 3.540 2.444 2.384 2.564 . 0 0 "[ . 1 . 2]" 1
1135 1 107 LEU HB2 1 107 LEU MD1 2.970 . 3.420 2.361 2.319 2.432 . 0 0 "[ . 1 . 2]" 1
1136 1 107 LEU HA 1 107 LEU MD2 3.020 . 3.470 2.188 2.036 2.300 . 0 0 "[ . 1 . 2]" 1
1137 1 107 LEU HB3 1 107 LEU MD2 3.180 . 3.660 2.454 2.375 2.517 . 0 0 "[ . 1 . 2]" 1
1138 1 107 LEU HB2 1 107 LEU MD2 3.220 . 3.700 3.248 3.228 3.261 . 0 0 "[ . 1 . 2]" 1
1139 1 110 GLN HA 1 110 GLN HG2 3.860 . 4.440 3.591 2.970 3.805 . 0 0 "[ . 1 . 2]" 1
1140 1 110 GLN HA 1 110 GLN HG3 3.860 . 4.440 2.903 2.327 3.870 . 0 0 "[ . 1 . 2]" 1
1141 1 112 GLN HA 1 115 GLU HG2 4.360 . 5.010 3.160 2.506 3.776 . 0 0 "[ . 1 . 2]" 1
1142 1 112 GLN HA 1 112 GLN HG3 4.250 . 4.890 4.219 3.807 4.298 . 0 0 "[ . 1 . 2]" 1
1143 1 112 GLN HA 1 112 GLN HG2 4.250 . 4.890 3.725 3.679 3.814 . 0 0 "[ . 1 . 2]" 1
1144 1 112 GLN H 1 112 GLN HG3 4.210 . 4.840 3.983 3.425 4.215 . 0 0 "[ . 1 . 2]" 1
1145 1 113 LEU HA 1 113 LEU MD1 3.890 . 4.470 3.874 3.830 3.906 . 0 0 "[ . 1 . 2]" 1
1146 1 113 LEU H 1 113 LEU HB3 4.140 . 4.760 3.661 3.615 3.710 . 0 0 "[ . 1 . 2]" 1
1147 1 113 LEU HA 1 113 LEU HG 4.170 . 4.800 3.205 3.098 3.342 . 0 0 "[ . 1 . 2]" 1
1148 1 113 LEU HB2 1 113 LEU HG 2.950 . 3.390 2.443 2.397 2.470 . 0 0 "[ . 1 . 2]" 1
1149 1 113 LEU H 1 113 LEU MD2 3.970 . 4.570 3.547 3.302 3.712 . 0 0 "[ . 1 . 2]" 1
1150 1 113 LEU HA 1 113 LEU MD2 3.010 . 3.460 2.015 1.927 2.113 . 0 0 "[ . 1 . 2]" 1
1151 1 113 LEU HB3 1 113 LEU MD2 3.220 . 3.700 2.518 2.467 2.613 . 0 0 "[ . 1 . 2]" 1
1152 1 113 LEU H 1 113 LEU MD1 3.990 . 4.590 4.011 3.902 4.228 . 0 0 "[ . 1 . 2]" 1
1153 1 113 LEU HB3 1 113 LEU MD1 3.160 . 3.630 2.381 2.339 2.416 . 0 0 "[ . 1 . 2]" 1
1154 1 114 LEU HA 1 117 ILE MD 3.460 . 3.980 2.212 1.954 2.420 . 0 0 "[ . 1 . 2]" 1
1155 1 106 PHE QD 1 114 LEU MD2 3.340 . 3.840 2.155 1.881 2.440 . 0 0 "[ . 1 . 2]" 1
1156 1 114 LEU HA 1 114 LEU MD2 3.210 . 3.690 2.134 2.038 2.193 . 0 0 "[ . 1 . 2]" 1
1157 1 21 LEU HB3 1 114 LEU MD2 3.370 . 3.880 2.654 1.886 3.535 . 0 0 "[ . 1 . 2]" 1
1158 1 114 LEU HB3 1 114 LEU MD2 3.420 . 3.930 2.453 2.395 2.537 . 0 0 "[ . 1 . 2]" 1
1159 1 106 PHE QD 1 114 LEU MD1 4.750 . 5.460 4.225 3.522 4.768 . 0 0 "[ . 1 . 2]" 1
1160 1 114 LEU HA 1 114 LEU MD1 4.240 . 4.880 3.932 3.900 3.963 . 0 0 "[ . 1 . 2]" 1
1161 1 21 LEU HB3 1 114 LEU MD1 4.180 . 4.810 2.753 2.079 3.665 . 0 0 "[ . 1 . 2]" 1
1162 1 115 GLU HA 1 115 GLU HG3 3.690 . 4.240 3.806 3.705 3.946 . 0 0 "[ . 1 . 2]" 1
1163 1 115 GLU HA 1 115 GLU HG2 3.950 . 4.540 3.798 3.686 3.892 . 0 0 "[ . 1 . 2]" 1
1164 1 115 GLU HB3 1 115 GLU HG2 2.980 . 3.430 2.453 2.315 2.618 . 0 0 "[ . 1 . 2]" 1
1165 1 115 GLU HB2 1 115 GLU HG3 2.850 . 3.280 2.491 2.343 2.670 . 0 0 "[ . 1 . 2]" 1
1166 1 116 ASN HA 1 116 ASN HD21 3.600 . 4.140 3.648 2.828 3.937 . 0 0 "[ . 1 . 2]" 1
1167 1 116 ASN H 1 116 ASN HB3 3.770 . 4.340 3.666 3.630 3.708 . 0 0 "[ . 1 . 2]" 1
1168 1 117 ILE HA 1 117 ILE MG 3.440 . 3.960 2.427 2.358 2.497 . 0 0 "[ . 1 . 2]" 1
1169 1 117 ILE MD 1 117 ILE MG 2.920 . 3.360 2.000 1.974 2.026 . 0 0 "[ . 1 . 2]" 1
1170 1 117 ILE H 1 117 ILE MD 3.690 . 4.240 3.803 3.664 3.875 . 0 0 "[ . 1 . 2]" 1
1171 1 106 PHE HB2 1 117 ILE MD 3.690 . 4.240 2.218 1.961 2.755 . 0 0 "[ . 1 . 2]" 1
1172 1 37 ILE HB 1 37 ILE MD 3.350 . 3.850 2.445 2.425 2.482 . 0 0 "[ . 1 . 2]" 1
1173 1 118 LYS H 1 118 LYS HE2 5.580 . 6.420 4.261 2.488 5.777 . 0 0 "[ . 1 . 2]" 1
1174 1 118 LYS H 1 118 LYS HE3 5.580 . 6.420 4.322 2.217 5.981 . 0 0 "[ . 1 . 2]" 1
1175 1 118 LYS HA 1 118 LYS HE2 4.210 . 4.840 2.940 1.772 5.026 0.186 15 0 "[ . 1 . 2]" 1
1176 1 118 LYS HA 1 118 LYS HE3 4.210 . 4.840 3.523 1.864 4.889 0.049 12 0 "[ . 1 . 2]" 1
1177 1 119 ARG HA 1 119 ARG HG2 4.040 . 4.650 3.776 3.654 3.869 . 0 0 "[ . 1 . 2]" 1
1178 1 119 ARG H 1 119 ARG HB2 3.790 . 4.360 3.704 3.608 3.833 . 0 0 "[ . 1 . 2]" 1
1179 1 119 ARG HB2 1 119 ARG HD2 4.010 . 4.610 2.808 2.479 3.760 . 0 0 "[ . 1 . 2]" 1
1180 1 119 ARG HB2 1 119 ARG HD3 4.010 . 4.610 3.166 2.506 3.796 . 0 0 "[ . 1 . 2]" 1
1181 1 119 ARG HA 1 119 ARG HG3 4.040 . 4.650 3.838 3.759 3.933 . 0 0 "[ . 1 . 2]" 1
1182 1 119 ARG H 1 119 ARG HD2 5.120 . 5.890 4.687 4.139 4.972 . 0 0 "[ . 1 . 2]" 1
1183 1 120 LYS HA 1 120 LYS HG2 3.770 . 4.340 3.027 2.580 3.801 . 0 0 "[ . 1 . 2]" 1
1184 1 120 LYS HA 1 120 LYS HG3 3.770 . 4.340 3.497 2.811 3.961 . 0 0 "[ . 1 . 2]" 1
1185 1 120 LYS H 1 120 LYS HD2 6.000 . 6.900 4.976 3.701 5.914 . 0 0 "[ . 1 . 2]" 1
1186 1 120 LYS H 1 120 LYS HD3 6.000 . 6.900 5.071 3.830 5.746 . 0 0 "[ . 1 . 2]" 1
1187 1 120 LYS HA 1 120 LYS HD2 5.410 . 6.220 4.143 2.172 5.631 . 0 0 "[ . 1 . 2]" 1
1188 1 120 LYS HA 1 120 LYS HD3 5.410 . 6.220 4.372 2.082 5.613 . 0 0 "[ . 1 . 2]" 1
1189 1 56 LYS HD3 1 56 LYS HG2 2.580 . 2.970 2.524 2.442 2.597 . 0 0 "[ . 1 . 2]" 1
1190 1 120 LYS HB2 1 120 LYS HE2 4.840 . 5.570 3.877 2.837 5.205 . 0 0 "[ . 1 . 2]" 1
1191 1 120 LYS HB2 1 120 LYS HE3 4.840 . 5.570 3.794 2.084 5.145 . 0 0 "[ . 1 . 2]" 1
1192 1 120 LYS HB3 1 120 LYS HE2 4.840 . 5.570 3.531 1.864 4.756 . 0 0 "[ . 1 . 2]" 1
1193 1 120 LYS HB3 1 120 LYS HE3 4.840 . 5.570 3.503 2.058 4.768 . 0 0 "[ . 1 . 2]" 1
1194 1 122 THR HA 1 122 THR MG 3.350 . 3.850 2.948 2.307 3.287 . 0 0 "[ . 1 . 2]" 1
1195 1 122 THR HA 1 122 THR HB 2.700 . 3.110 2.514 2.386 3.053 . 0 0 "[ . 1 . 2]" 1
1196 1 10 HIS HB2 1 11 MET H 5.270 . 6.060 3.845 2.475 4.596 . 0 0 "[ . 1 . 2]" 1
1197 1 11 MET HB2 1 12 ALA H 4.320 . 4.970 3.456 2.108 4.587 . 0 0 "[ . 1 . 2]" 1
1198 1 14 PRO HB3 1 15 SER H 4.040 . 4.650 4.052 2.867 4.721 0.071 17 0 "[ . 1 . 2]" 1
1199 1 15 SER HB2 1 16 ASN H 4.290 . 4.930 3.835 2.818 4.513 . 0 0 "[ . 1 . 2]" 1
1200 1 16 ASN HB2 1 17 VAL H 4.500 . 5.180 3.940 3.230 4.546 . 0 0 "[ . 1 . 2]" 1
1201 1 16 ASN HB3 1 17 VAL H 4.500 . 5.180 4.415 4.156 4.521 . 0 0 "[ . 1 . 2]" 1
1202 1 20 PHE HA 1 63 PHE QE 3.520 . 4.050 2.046 1.753 2.783 0.047 16 0 "[ . 1 . 2]" 1
1203 1 20 PHE HB2 1 63 PHE QE 4.710 . 5.420 4.025 3.754 4.575 . 0 0 "[ . 1 . 2]" 1
1204 1 20 PHE QD 1 63 PHE QE 4.340 . 4.990 3.069 2.384 3.543 . 0 0 "[ . 1 . 2]" 1
1205 1 21 LEU MD1 1 22 THR H 4.680 . 5.380 4.789 4.534 4.955 . 0 0 "[ . 1 . 2]" 1
1206 1 22 THR HB 1 23 LYS H 3.890 . 4.470 3.554 2.329 4.130 . 0 0 "[ . 1 . 2]" 1
1207 1 22 THR MG 1 23 LYS H 4.090 . 4.700 2.626 2.165 3.624 . 0 0 "[ . 1 . 2]" 1
1208 1 23 LYS HB2 1 24 LEU H 3.190 . 3.670 2.638 2.476 2.954 . 0 0 "[ . 1 . 2]" 1
1209 1 24 LEU MD2 1 25 TRP H 5.220 . 6.000 4.139 3.923 4.362 . 0 0 "[ . 1 . 2]" 1
1210 1 24 LEU MD1 1 25 TRP H 5.060 . 5.820 4.453 4.268 4.579 . 0 0 "[ . 1 . 2]" 1
1211 1 25 TRP HB2 1 26 THR H 5.470 . 6.290 3.854 3.646 4.175 . 0 0 "[ . 1 . 2]" 1
1212 1 26 THR HB 1 27 LEU H 3.500 . 4.030 2.799 2.424 3.127 . 0 0 "[ . 1 . 2]" 1
1213 1 27 LEU MD1 1 28 VAL H 4.290 . 4.930 4.193 4.067 4.299 . 0 0 "[ . 1 . 2]" 1
1214 1 27 LEU MD2 1 28 VAL H 4.370 . 5.030 4.136 3.969 4.367 . 0 0 "[ . 1 . 2]" 1
1215 1 29 SER HB2 1 30 ASP H 4.930 . 5.670 4.298 3.242 4.508 . 0 0 "[ . 1 . 2]" 1
1216 1 31 PRO HA 1 32 ASP H 3.530 . 4.060 3.503 3.429 3.575 . 0 0 "[ . 1 . 2]" 1
1217 1 31 PRO HB3 1 32 ASP H 4.230 . 4.860 4.380 4.227 4.530 . 0 0 "[ . 1 . 2]" 1
1218 1 31 PRO HG3 1 32 ASP H 4.000 . 4.600 4.243 3.998 4.542 . 0 0 "[ . 1 . 2]" 1
1219 1 32 ASP HB2 1 33 THR H 3.990 . 4.590 4.057 3.007 4.254 . 0 0 "[ . 1 . 2]" 1
1220 1 36 LEU MD2 1 37 ILE H 5.260 . 6.050 4.723 4.613 4.808 . 0 0 "[ . 1 . 2]" 1
1221 1 37 ILE HB 1 38 CYS H 4.440 . 5.110 4.272 4.137 4.371 . 0 0 "[ . 1 . 2]" 1
1222 1 37 ILE MG 1 38 CYS H 4.190 . 4.820 4.154 4.051 4.296 . 0 0 "[ . 1 . 2]" 1
1223 1 37 ILE MD 1 38 CYS H 4.640 . 5.340 4.546 4.335 4.774 . 0 0 "[ . 1 . 2]" 1
1224 1 23 LYS H 1 23 LYS HB2 3.780 . 4.350 2.481 2.384 2.578 . 0 0 "[ . 1 . 2]" 1
1225 1 48 VAL MG1 1 49 PHE H 3.810 . 4.380 2.724 2.467 3.144 . 0 0 "[ . 1 . 2]" 1
1226 1 51 GLN HG2 1 52 GLY H 5.230 . 6.010 4.995 4.197 5.261 . 0 0 "[ . 1 . 2]" 1
1227 1 53 GLN HG2 1 54 PHE H 4.800 . 5.520 4.643 4.514 4.903 . 0 0 "[ . 1 . 2]" 1
1228 1 53 GLN HG3 1 54 PHE H 4.420 . 5.080 3.807 3.625 4.075 . 0 0 "[ . 1 . 2]" 1
1229 1 55 ALA MB 1 56 LYS H 3.260 . 3.750 2.752 2.675 2.879 . 0 0 "[ . 1 . 2]" 1
1230 1 56 LYS HB2 1 57 GLU H 4.290 . 4.930 4.071 3.851 4.198 . 0 0 "[ . 1 . 2]" 1
1231 1 56 LYS HG3 1 57 GLU H 5.000 . 5.750 4.781 4.506 4.950 . 0 0 "[ . 1 . 2]" 1
1232 1 56 LYS HG2 1 57 GLU H 4.390 . 5.050 3.956 3.236 4.179 . 0 0 "[ . 1 . 2]" 1
1233 1 57 GLU HB3 1 58 VAL H 4.290 . 4.930 4.201 4.127 4.351 . 0 0 "[ . 1 . 2]" 1
1234 1 57 GLU HG3 1 58 VAL H 4.470 . 5.140 2.374 2.102 2.876 . 0 0 "[ . 1 . 2]" 1
1235 1 57 GLU HG2 1 58 VAL H 4.360 . 5.010 3.302 3.154 3.659 . 0 0 "[ . 1 . 2]" 1
1236 1 58 VAL MG1 1 59 LEU H 3.560 . 4.090 3.363 3.232 3.521 . 0 0 "[ . 1 . 2]" 1
1237 1 60 PRO HB3 1 61 LYS H 4.480 . 5.150 4.419 4.384 4.461 . 0 0 "[ . 1 . 2]" 1
1238 1 60 PRO HG3 1 61 LYS H 5.210 . 5.990 4.369 4.295 4.480 . 0 0 "[ . 1 . 2]" 1
1239 1 61 LYS HG2 1 62 TYR H 4.610 . 5.300 3.522 3.288 3.764 . 0 0 "[ . 1 . 2]" 1
1240 1 67 ASN HB2 1 68 MET H 4.750 . 5.460 4.358 4.192 4.516 . 0 0 "[ . 1 . 2]" 1
1241 1 72 VAL MG2 1 73 ARG H 4.150 . 4.770 3.908 3.851 3.998 . 0 0 "[ . 1 . 2]" 1
1242 1 73 ARG HB3 1 74 GLN H 4.170 . 4.800 2.638 2.441 2.863 . 0 0 "[ . 1 . 2]" 1
1243 1 76 ASN HB3 1 77 MET H 3.800 . 4.370 3.626 3.389 3.849 . 0 0 "[ . 1 . 2]" 1
1244 1 77 MET HG3 1 78 TYR H 4.980 . 5.730 4.472 4.273 4.600 . 0 0 "[ . 1 . 2]" 1
1245 1 77 MET HG2 1 78 TYR H 5.170 . 5.950 5.097 4.986 5.223 . 0 0 "[ . 1 . 2]" 1
1246 1 77 MET ME 1 78 TYR H 4.630 . 5.320 4.451 4.259 4.759 . 0 0 "[ . 1 . 2]" 1
1247 1 81 ARG HB3 1 82 LYS H 4.320 . 4.970 4.260 4.128 4.393 . 0 0 "[ . 1 . 2]" 1
1248 1 82 LYS HB2 1 83 VAL H 4.870 . 5.600 4.420 4.168 4.567 . 0 0 "[ . 1 . 2]" 1
1249 1 83 VAL MG2 1 84 VAL H 4.220 . 4.850 4.224 4.131 4.334 . 0 0 "[ . 1 . 2]" 1
1250 1 84 VAL HB 1 85 HIS H 4.210 . 4.840 4.269 4.097 4.446 . 0 0 "[ . 1 . 2]" 1
1251 1 84 VAL MG2 1 85 HIS H 4.430 . 5.090 3.507 2.612 4.451 . 0 0 "[ . 1 . 2]" 1
1252 1 88 GLN HA 1 89 GLY H 2.860 . 3.290 2.335 2.057 3.240 . 0 0 "[ . 1 . 2]" 1
1253 1 88 GLN HB3 1 89 GLY H 4.390 . 5.050 3.726 2.575 4.576 . 0 0 "[ . 1 . 2]" 1
1254 1 88 GLN H 1 88 GLN HG2 4.380 . 5.040 3.009 1.984 3.969 . 0 0 "[ . 1 . 2]" 1
1255 1 88 GLN H 1 88 GLN HG3 4.380 . 5.040 3.260 2.140 4.297 . 0 0 "[ . 1 . 2]" 1
1256 1 91 LEU HA 1 92 VAL H 2.610 . 3.000 2.470 2.202 2.686 . 0 0 "[ . 1 . 2]" 1
1257 1 91 LEU MD1 1 92 VAL H 4.920 . 5.660 4.416 4.052 4.838 . 0 0 "[ . 1 . 2]" 1
1258 1 94 PRO HG3 1 95 GLU H 4.860 . 5.590 5.354 4.973 5.567 . 0 0 "[ . 1 . 2]" 1
1259 1 95 GLU HA 1 96 ARG H 3.210 . 3.690 3.089 2.406 3.515 . 0 0 "[ . 1 . 2]" 1
1260 1 95 GLU HB3 1 96 ARG H 4.530 . 5.210 4.468 4.025 4.689 . 0 0 "[ . 1 . 2]" 1
1261 1 95 GLU HB2 1 96 ARG H 4.530 . 5.210 4.323 4.057 4.510 . 0 0 "[ . 1 . 2]" 1
1262 1 95 GLU HG3 1 96 ARG H 4.720 . 5.430 3.807 2.736 4.708 . 0 0 "[ . 1 . 2]" 1
1263 1 96 ARG HB3 1 97 ASP H 4.360 . 5.010 4.104 3.678 4.546 . 0 0 "[ . 1 . 2]" 1
1264 1 96 ARG HG3 1 97 ASP H 4.080 . 4.690 4.043 3.173 4.852 0.162 15 0 "[ . 1 . 2]" 1
1265 1 99 THR MG 1 100 GLU H 3.530 . 4.060 3.020 2.471 3.588 . 0 0 "[ . 1 . 2]" 1
1266 1 101 PHE HB2 1 102 GLN H 4.860 . 5.590 4.275 4.148 4.350 . 0 0 "[ . 1 . 2]" 1
1267 1 102 GLN HG2 1 103 HIS H 4.780 . 5.500 5.051 4.855 5.231 . 0 0 "[ . 1 . 2]" 1
1268 1 104 PRO HD3 1 105 CYS H 4.270 . 4.910 4.047 3.977 4.100 . 0 0 "[ . 1 . 2]" 1
1269 1 104 PRO HD2 1 105 CYS H 4.550 . 5.230 2.983 2.885 3.060 . 0 0 "[ . 1 . 2]" 1
1270 1 104 PRO HB2 1 105 CYS H 3.130 . 3.600 3.426 3.168 3.624 0.024 2 0 "[ . 1 . 2]" 1
1271 1 104 PRO HB3 1 105 CYS H 4.210 . 4.840 4.234 4.098 4.341 . 0 0 "[ . 1 . 2]" 1
1272 1 104 PRO HG3 1 105 CYS H 3.750 . 4.310 4.055 3.873 4.226 . 0 0 "[ . 1 . 2]" 1
1273 1 104 PRO HG2 1 105 CYS H 3.720 . 4.280 2.513 2.268 2.735 . 0 0 "[ . 1 . 2]" 1
1274 1 112 GLN HB2 1 113 LEU H 4.670 . 5.370 4.305 4.131 4.494 . 0 0 "[ . 1 . 2]" 1
1275 1 112 GLN HB3 1 113 LEU H 4.980 . 5.730 4.250 4.163 4.380 . 0 0 "[ . 1 . 2]" 1
1276 1 112 GLN HG2 1 113 LEU H 4.930 . 5.670 3.075 2.640 3.610 . 0 0 "[ . 1 . 2]" 1
1277 1 112 GLN HG3 1 113 LEU H 4.930 . 5.670 4.455 3.027 4.913 . 0 0 "[ . 1 . 2]" 1
1278 1 114 LEU HG 1 115 GLU H 5.260 . 6.050 4.404 4.232 4.559 . 0 0 "[ . 1 . 2]" 1
1279 1 115 GLU HG2 1 116 ASN H 4.440 . 5.110 3.466 3.043 3.834 . 0 0 "[ . 1 . 2]" 1
1280 1 115 GLU HG3 1 116 ASN H 4.110 . 4.730 3.192 2.696 3.746 . 0 0 "[ . 1 . 2]" 1
1281 1 116 ASN HA 1 117 ILE H 3.420 . 3.930 3.372 3.246 3.454 . 0 0 "[ . 1 . 2]" 1
1282 1 117 ILE HB 1 118 LYS H 4.560 . 5.240 4.275 4.062 4.459 . 0 0 "[ . 1 . 2]" 1
1283 1 28 VAL H 1 37 ILE MD 4.120 . 4.740 3.715 3.397 3.939 . 0 0 "[ . 1 . 2]" 1
1284 1 118 LYS HG2 1 119 ARG H 5.150 . 5.920 5.064 4.717 5.371 . 0 0 "[ . 1 . 2]" 1
1285 1 119 ARG HB3 1 120 LYS H 4.310 . 4.960 4.186 3.601 4.647 . 0 0 "[ . 1 . 2]" 1
1286 1 119 ARG HG3 1 120 LYS H 4.180 . 4.810 2.896 1.786 4.373 0.014 7 0 "[ . 1 . 2]" 1
1287 1 121 VAL HB 1 122 THR H 4.480 . 5.150 4.014 2.247 4.591 . 0 0 "[ . 1 . 2]" 1
1288 1 122 THR HB 1 123 SER H 4.650 . 5.350 3.991 2.097 4.685 . 0 0 "[ . 1 . 2]" 1
1289 1 122 THR MG 1 123 SER H 4.630 . 5.320 3.695 2.225 4.381 . 0 0 "[ . 1 . 2]" 1
1290 1 19 ALA HA 1 22 THR H 4.050 . 4.660 3.620 3.309 3.809 . 0 0 "[ . 1 . 2]" 1
1291 1 19 ALA HA 1 22 THR HB 3.570 . 4.110 3.614 2.157 4.203 0.093 11 0 "[ . 1 . 2]" 1
1292 1 19 ALA HA 1 23 LYS H 4.470 . 5.140 4.032 3.735 4.272 . 0 0 "[ . 1 . 2]" 1
1293 1 20 PHE HA 1 23 LYS HB2 4.300 . 4.950 3.285 3.000 3.741 . 0 0 "[ . 1 . 2]" 1
1294 1 20 PHE HA 1 23 LYS HB3 4.890 . 5.620 4.912 4.582 5.438 . 0 0 "[ . 1 . 2]" 1
1295 1 20 PHE HA 1 24 LEU H 5.090 . 5.850 4.166 4.015 4.372 . 0 0 "[ . 1 . 2]" 1
1296 1 21 LEU HA 1 24 LEU H 4.480 . 5.150 3.294 3.059 3.443 . 0 0 "[ . 1 . 2]" 1
1297 1 21 LEU HA 1 24 LEU HB2 4.470 . 5.140 3.070 2.843 3.325 . 0 0 "[ . 1 . 2]" 1
1298 1 21 LEU HA 1 24 LEU HB3 4.470 . 5.140 2.207 2.056 2.395 . 0 0 "[ . 1 . 2]" 1
1299 1 22 THR HA 1 25 TRP HB2 4.720 . 5.430 3.881 2.835 5.497 0.067 6 0 "[ . 1 . 2]" 1
1300 1 22 THR HA 1 25 TRP HB3 4.720 . 5.430 3.109 2.333 4.217 . 0 0 "[ . 1 . 2]" 1
1301 1 23 LYS HA 1 25 TRP H 4.990 . 5.740 4.648 4.300 4.994 . 0 0 "[ . 1 . 2]" 1
1302 1 23 LYS HA 1 26 THR H 4.720 . 5.430 3.686 3.170 4.121 . 0 0 "[ . 1 . 2]" 1
1303 1 23 LYS HA 1 26 THR HB 3.790 . 4.360 2.881 2.525 3.300 . 0 0 "[ . 1 . 2]" 1
1304 1 23 LYS HA 1 27 LEU H 4.480 . 5.150 4.217 3.961 4.464 . 0 0 "[ . 1 . 2]" 1
1305 1 24 LEU HA 1 27 LEU HB2 4.710 . 5.420 3.250 3.012 3.613 . 0 0 "[ . 1 . 2]" 1
1306 1 24 LEU HA 1 27 LEU HB3 4.710 . 5.420 2.337 2.059 2.589 . 0 0 "[ . 1 . 2]" 1
1307 1 25 TRP HA 1 27 LEU H 4.740 . 5.450 4.270 3.964 4.575 . 0 0 "[ . 1 . 2]" 1
1308 1 25 TRP HA 1 28 VAL HB 4.680 . 5.380 3.057 2.543 3.906 . 0 0 "[ . 1 . 2]" 1
1309 1 26 THR HA 1 29 SER H 3.950 . 4.540 3.708 3.274 4.037 . 0 0 "[ . 1 . 2]" 1
1310 1 26 THR HA 1 29 SER HB2 4.040 . 4.650 4.105 2.362 4.687 0.037 20 0 "[ . 1 . 2]" 1
1311 1 26 THR HA 1 29 SER HB3 4.040 . 4.650 3.258 2.156 4.347 . 0 0 "[ . 1 . 2]" 1
1312 1 34 ASP HA 1 36 LEU H 4.150 . 4.770 4.097 3.794 4.320 . 0 0 "[ . 1 . 2]" 1
1313 1 51 GLN HA 1 53 GLN H 5.140 . 5.910 4.551 4.343 4.675 . 0 0 "[ . 1 . 2]" 1
1314 1 51 GLN HA 1 54 PHE HB2 3.770 . 4.340 3.457 3.047 3.996 . 0 0 "[ . 1 . 2]" 1
1315 1 51 GLN HA 1 54 PHE HB3 3.690 . 4.240 2.253 1.906 2.753 . 0 0 "[ . 1 . 2]" 1
1316 1 52 GLY HA2 1 55 ALA MB 4.060 . 4.670 3.053 2.784 3.536 . 0 0 "[ . 1 . 2]" 1
1317 1 53 GLN HA 1 56 LYS H 3.450 . 3.970 3.466 3.278 3.656 . 0 0 "[ . 1 . 2]" 1
1318 1 53 GLN HA 1 56 LYS HB3 3.150 . 3.620 2.392 2.235 2.556 . 0 0 "[ . 1 . 2]" 1
1319 1 53 GLN HA 1 56 LYS HB2 3.380 . 3.890 3.478 3.121 3.796 . 0 0 "[ . 1 . 2]" 1
1320 1 53 GLN HA 1 57 GLU H 4.630 . 5.320 4.298 4.128 4.570 . 0 0 "[ . 1 . 2]" 1
1321 1 36 LEU HB2 1 54 PHE HA 4.460 . 5.130 3.983 3.580 4.312 . 0 0 "[ . 1 . 2]" 1
1322 1 55 ALA HA 1 58 VAL HB 3.640 . 4.190 4.363 4.311 4.464 0.274 12 0 "[ . 1 . 2]" 1
1323 1 56 LYS HA 1 59 LEU HB3 6.000 . 6.900 6.910 6.830 7.002 0.102 19 0 "[ . 1 . 2]" 1
1324 1 57 GLU HA 1 60 PRO HB2 4.590 . 5.280 5.041 4.612 5.338 0.058 16 0 "[ . 1 . 2]" 1
1325 1 58 VAL HA 1 61 LYS HB2 4.350 . 5.000 3.154 2.790 3.545 . 0 0 "[ . 1 . 2]" 1
1326 1 58 VAL HA 1 61 LYS HB3 3.810 . 4.380 2.724 2.439 2.893 . 0 0 "[ . 1 . 2]" 1
1327 1 58 VAL HA 1 61 LYS HD2 4.620 . 5.310 3.718 3.100 4.151 . 0 0 "[ . 1 . 2]" 1
1328 1 59 LEU HA 1 62 TYR HB2 5.120 . 5.890 3.882 3.589 4.152 . 0 0 "[ . 1 . 2]" 1
1329 1 60 PRO HA 1 62 TYR H 5.520 . 6.350 4.864 4.614 5.144 . 0 0 "[ . 1 . 2]" 1
1330 1 60 PRO HA 1 66 ASN HD21 6.000 . 6.900 6.147 5.335 6.888 . 0 0 "[ . 1 . 2]" 1
1331 1 68 MET HA 1 71 PHE HB2 4.430 . 5.090 3.342 2.908 3.853 . 0 0 "[ . 1 . 2]" 1
1332 1 68 MET HA 1 71 PHE HB3 4.430 . 5.090 2.634 2.302 3.178 . 0 0 "[ . 1 . 2]" 1
1333 1 68 MET HA 1 72 VAL H 4.310 . 4.960 4.105 3.877 4.507 . 0 0 "[ . 1 . 2]" 1
1334 1 69 ALA HA 1 72 VAL H 3.910 . 4.500 3.809 3.558 4.081 . 0 0 "[ . 1 . 2]" 1
1335 1 69 ALA HA 1 72 VAL HB 3.530 . 4.060 3.042 2.719 3.328 . 0 0 "[ . 1 . 2]" 1
1336 1 70 SER HA 1 72 VAL H 5.010 . 5.760 4.889 4.653 5.038 . 0 0 "[ . 1 . 2]" 1
1337 1 70 SER HA 1 73 ARG HB2 3.730 . 4.290 3.451 3.079 4.233 . 0 0 "[ . 1 . 2]" 1
1338 1 70 SER HA 1 73 ARG HB3 3.730 . 4.290 2.708 2.387 3.154 . 0 0 "[ . 1 . 2]" 1
1339 1 70 SER HA 1 74 GLN H 4.840 . 5.570 4.370 4.105 4.595 . 0 0 "[ . 1 . 2]" 1
1340 1 71 PHE HA 1 74 GLN HB3 6.000 . 6.900 4.899 4.565 5.154 . 0 0 "[ . 1 . 2]" 1
1341 1 71 PHE HA 1 74 GLN HB2 4.570 . 5.260 3.404 3.019 3.748 . 0 0 "[ . 1 . 2]" 1
1342 1 72 VAL HA 1 75 LEU HB3 4.650 . 5.350 4.285 3.998 4.723 . 0 0 "[ . 1 . 2]" 1
1343 1 72 VAL HA 1 75 LEU HB2 4.180 . 4.810 2.700 2.461 3.085 . 0 0 "[ . 1 . 2]" 1
1344 1 73 ARG HA 1 76 ASN HB2 3.730 . 4.290 2.829 2.439 3.161 . 0 0 "[ . 1 . 2]" 1
1345 1 74 GLN HA 1 77 MET HB2 3.810 . 4.380 2.978 2.594 3.092 . 0 0 "[ . 1 . 2]" 1
1346 1 74 GLN HA 1 77 MET HB3 4.000 . 4.600 4.583 4.118 4.678 0.078 7 0 "[ . 1 . 2]" 1
1347 1 75 LEU HA 1 78 TYR HB2 5.510 . 6.340 2.254 1.901 2.664 . 0 0 "[ . 1 . 2]" 1
1348 1 112 GLN HA 1 114 LEU H 3.940 . 4.530 3.876 3.594 4.279 . 0 0 "[ . 1 . 2]" 1
1349 1 112 GLN HA 1 115 GLU H 4.360 . 5.010 4.017 3.649 4.294 . 0 0 "[ . 1 . 2]" 1
1350 1 112 GLN HA 1 112 GLN HB2 2.980 . 3.430 2.388 2.318 2.453 . 0 0 "[ . 1 . 2]" 1
1351 1 113 LEU HA 1 116 ASN HB2 5.200 . 5.980 2.821 2.216 3.753 . 0 0 "[ . 1 . 2]" 1
1352 1 113 LEU HA 1 116 ASN HB3 5.200 . 5.980 4.359 3.836 5.128 . 0 0 "[ . 1 . 2]" 1
1353 1 17 VAL MG1 1 21 LEU MD1 3.340 . 3.840 3.226 2.730 3.643 . 0 0 "[ . 1 . 2]" 1
1354 1 17 VAL MG1 1 114 LEU MD1 3.290 . 3.780 2.408 2.087 2.763 . 0 0 "[ . 1 . 2]" 1
1355 1 17 VAL MG2 1 114 LEU MD1 3.760 . 4.320 3.152 2.580 3.823 . 0 0 "[ . 1 . 2]" 1
1356 1 17 VAL MG2 1 114 LEU HB2 3.740 . 4.300 2.271 1.930 2.827 . 0 0 "[ . 1 . 2]" 1
1357 1 17 VAL MG2 1 115 GLU HB3 3.210 . 3.690 2.189 1.921 2.779 . 0 0 "[ . 1 . 2]" 1
1358 1 17 VAL MG1 1 114 LEU HB2 3.330 . 3.830 2.315 1.868 2.632 . 0 0 "[ . 1 . 2]" 1
1359 1 17 VAL MG1 1 22 THR MG 3.830 . 4.400 3.369 3.046 3.831 . 0 0 "[ . 1 . 2]" 1
1360 1 17 VAL MG1 1 21 LEU HB2 3.540 . 4.070 2.437 2.054 2.923 . 0 0 "[ . 1 . 2]" 1
1361 1 17 VAL MG1 1 115 GLU HG2 4.540 . 5.220 5.097 4.724 5.343 0.123 3 0 "[ . 1 . 2]" 1
1362 1 17 VAL MG1 1 115 GLU HG3 5.530 . 6.360 6.120 5.816 6.399 0.039 3 0 "[ . 1 . 2]" 1
1363 1 17 VAL HB 1 22 THR MG 4.360 . 5.010 4.255 3.681 4.638 . 0 0 "[ . 1 . 2]" 1
1364 1 17 VAL HA 1 18 PRO HD2 3.090 . 3.550 2.492 2.091 2.654 . 0 0 "[ . 1 . 2]" 1
1365 1 17 VAL HA 1 115 GLU HA 3.940 . 4.530 2.546 2.087 3.030 . 0 0 "[ . 1 . 2]" 1
1366 1 17 VAL HA 1 18 PRO HD3 3.340 . 3.840 2.194 1.989 2.623 . 0 0 "[ . 1 . 2]" 1
1367 1 17 VAL HB 1 22 THR HB 4.360 . 5.010 3.839 2.715 5.212 0.202 17 0 "[ . 1 . 2]" 1
1368 1 17 VAL HB 1 18 PRO HD3 5.330 . 6.130 4.947 4.775 5.264 . 0 0 "[ . 1 . 2]" 1
1369 1 17 VAL HB 1 22 THR HA 5.690 . 6.540 4.965 4.081 5.820 . 0 0 "[ . 1 . 2]" 1
1370 1 17 VAL MG1 1 18 PRO HD2 3.510 . 4.040 2.659 2.316 3.005 . 0 0 "[ . 1 . 2]" 1
1371 1 17 VAL MG1 1 18 PRO HD3 3.400 . 3.910 3.612 3.235 3.881 . 0 0 "[ . 1 . 2]" 1
1372 1 17 VAL MG2 1 18 PRO HD3 4.360 . 5.010 4.261 3.935 4.717 . 0 0 "[ . 1 . 2]" 1
1373 1 17 VAL MG2 1 18 PRO HD2 3.770 . 4.340 4.122 3.833 4.398 0.058 14 0 "[ . 1 . 2]" 1
1374 1 15 SER HA 1 17 VAL MG2 4.900 . 5.640 4.118 2.584 4.908 . 0 0 "[ . 1 . 2]" 1
1375 1 17 VAL HA 1 115 GLU HG2 5.050 . 5.810 4.792 4.279 5.822 0.012 14 0 "[ . 1 . 2]" 1
1376 1 16 ASN H 1 17 VAL MG2 4.410 . 5.070 3.544 3.296 3.909 . 0 0 "[ . 1 . 2]" 1
1377 1 17 VAL MG2 1 116 ASN H 4.660 . 5.360 4.629 4.409 4.888 . 0 0 "[ . 1 . 2]" 1
1378 1 17 VAL MG1 1 22 THR H 3.850 . 4.430 2.645 2.451 3.052 . 0 0 "[ . 1 . 2]" 1
1379 1 18 PRO HB3 1 20 PHE H 4.460 . 5.130 3.922 3.489 4.784 . 0 0 "[ . 1 . 2]" 1
1380 1 18 PRO HB3 1 21 LEU H 4.540 . 5.220 4.262 3.850 5.175 . 0 0 "[ . 1 . 2]" 1
1381 1 18 PRO HB2 1 78 TYR QE 4.670 . 5.370 3.744 2.855 4.740 . 0 0 "[ . 1 . 2]" 1
1382 1 18 PRO HG2 1 78 TYR QE 4.720 . 5.430 2.486 1.794 4.019 0.006 14 0 "[ . 1 . 2]" 1
1383 1 18 PRO HG3 1 78 TYR QE 4.720 . 5.430 3.389 2.119 4.834 . 0 0 "[ . 1 . 2]" 1
1384 1 17 VAL HA 1 18 PRO HG2 4.520 . 5.200 4.519 4.317 4.587 . 0 0 "[ . 1 . 2]" 1
1385 1 17 VAL HA 1 18 PRO HG3 4.520 . 5.200 4.367 4.189 4.569 . 0 0 "[ . 1 . 2]" 1
1386 1 18 PRO HB2 1 19 ALA MB 4.680 . 5.380 4.807 4.015 5.168 . 0 0 "[ . 1 . 2]" 1
1387 1 18 PRO HB2 1 21 LEU HG 4.450 . 5.120 2.971 2.378 4.463 . 0 0 "[ . 1 . 2]" 1
1388 1 17 VAL MG1 1 18 PRO HB2 4.700 . 5.400 4.252 3.746 5.147 . 0 0 "[ . 1 . 2]" 1
1389 1 18 PRO HB2 1 21 LEU MD1 4.140 . 4.760 3.354 2.556 4.553 . 0 0 "[ . 1 . 2]" 1
1390 1 17 VAL MG1 1 18 PRO HG2 4.720 . 5.430 4.483 3.429 4.951 . 0 0 "[ . 1 . 2]" 1
1391 1 18 PRO HG2 1 21 LEU MD1 4.160 . 4.780 2.401 2.023 2.737 . 0 0 "[ . 1 . 2]" 1
1392 1 17 VAL MG1 1 18 PRO HG3 4.720 . 5.430 4.921 4.465 5.203 . 0 0 "[ . 1 . 2]" 1
1393 1 18 PRO HG3 1 21 LEU MD1 4.160 . 4.780 3.640 2.815 3.930 . 0 0 "[ . 1 . 2]" 1
1394 1 18 PRO HD2 1 22 THR MG 5.750 . 6.610 6.038 5.589 6.770 0.160 5 0 "[ . 1 . 2]" 1
1395 1 18 PRO HA 1 19 ALA MB 4.070 . 4.680 4.088 4.030 4.158 . 0 0 "[ . 1 . 2]" 1
1396 1 54 PHE QD 1 55 ALA MB 3.670 . 4.220 3.234 3.015 3.529 . 0 0 "[ . 1 . 2]" 1
1397 1 19 ALA MB 1 20 PHE HA 3.740 . 4.300 3.938 3.822 4.047 . 0 0 "[ . 1 . 2]" 1
1398 1 20 PHE HB2 1 23 LYS HB2 5.730 . 6.590 5.756 5.446 6.214 . 0 0 "[ . 1 . 2]" 1
1399 1 19 ALA MB 1 20 PHE HB2 4.720 . 5.430 4.252 4.092 4.431 . 0 0 "[ . 1 . 2]" 1
1400 1 19 ALA MB 1 20 PHE HB3 4.900 . 5.640 4.788 4.634 4.990 . 0 0 "[ . 1 . 2]" 1
1401 1 20 PHE HA 1 63 PHE HZ 4.620 . 5.310 4.303 3.825 5.238 . 0 0 "[ . 1 . 2]" 1
1402 1 20 PHE HB2 1 78 TYR QE 4.490 . 5.160 3.836 3.391 4.738 . 0 0 "[ . 1 . 2]" 1
1403 1 20 PHE HB3 1 78 TYR QE 4.690 . 5.390 3.112 2.440 3.691 . 0 0 "[ . 1 . 2]" 1
1404 1 20 PHE QD 1 21 LEU MD1 4.830 . 5.550 4.091 3.698 4.629 . 0 0 "[ . 1 . 2]" 1
1405 1 21 LEU MD1 1 78 TYR QE 4.230 . 4.860 2.835 2.496 3.265 . 0 0 "[ . 1 . 2]" 1
1406 1 21 LEU MD2 1 80 PHE QD 4.540 . 5.220 4.222 3.865 4.752 . 0 0 "[ . 1 . 2]" 1
1407 1 21 LEU MD2 1 80 PHE QE 3.510 . 4.040 2.599 1.909 3.266 . 0 0 "[ . 1 . 2]" 1
1408 1 21 LEU MD2 1 24 LEU H 4.860 . 5.590 4.736 4.468 5.005 . 0 0 "[ . 1 . 2]" 1
1409 1 20 PHE QE 1 21 LEU HG 4.990 . 5.740 4.709 4.168 5.439 . 0 0 "[ . 1 . 2]" 1
1410 1 21 LEU MD2 1 80 PHE HZ 3.890 . 4.470 2.883 2.286 3.462 . 0 0 "[ . 1 . 2]" 1
1411 1 21 LEU MD1 1 114 LEU HA 4.680 . 5.380 3.017 2.693 3.488 . 0 0 "[ . 1 . 2]" 1
1412 1 18 PRO HD2 1 21 LEU MD1 4.000 . 4.600 1.989 1.791 2.257 0.009 14 0 "[ . 1 . 2]" 1
1413 1 17 VAL HA 1 21 LEU MD1 4.390 . 5.050 3.966 3.570 4.415 . 0 0 "[ . 1 . 2]" 1
1414 1 21 LEU MD1 1 78 TYR HB3 4.880 . 5.610 3.628 3.008 4.268 . 0 0 "[ . 1 . 2]" 1
1415 1 21 LEU MD2 1 78 TYR HB3 4.310 . 4.960 3.261 2.886 3.993 . 0 0 "[ . 1 . 2]" 1
1416 1 21 LEU MD1 1 117 ILE HB 3.460 . 3.980 2.121 1.824 2.671 . 0 0 "[ . 1 . 2]" 1
1417 1 21 LEU MD1 1 114 LEU HB3 4.410 . 5.070 2.713 2.152 3.251 . 0 0 "[ . 1 . 2]" 1
1418 1 21 LEU MD2 1 114 LEU HB3 4.290 . 4.930 4.082 3.612 4.617 . 0 0 "[ . 1 . 2]" 1
1419 1 21 LEU MD2 1 117 ILE MG 3.840 . 4.420 3.043 2.663 3.769 . 0 0 "[ . 1 . 2]" 1
1420 1 21 LEU MD2 1 24 LEU MD2 3.790 . 4.360 2.296 2.133 2.579 . 0 0 "[ . 1 . 2]" 1
1421 1 21 LEU MD2 1 75 LEU MD2 4.270 . 4.910 3.108 2.765 3.597 . 0 0 "[ . 1 . 2]" 1
1422 1 21 LEU HA 1 24 LEU MD2 4.410 . 5.070 2.984 2.856 3.152 . 0 0 "[ . 1 . 2]" 1
1423 1 22 THR HA 1 114 LEU MD2 5.190 . 5.970 5.070 3.983 5.794 . 0 0 "[ . 1 . 2]" 1
1424 1 17 VAL MG1 1 22 THR HA 4.510 . 5.190 2.919 2.647 3.329 . 0 0 "[ . 1 . 2]" 1
1425 1 22 THR HA 1 114 LEU MD1 3.470 . 3.990 2.936 2.078 3.901 . 0 0 "[ . 1 . 2]" 1
1426 1 17 VAL MG1 1 22 THR HB 4.700 . 5.400 2.665 1.966 4.180 . 0 0 "[ . 1 . 2]" 1
1427 1 21 LEU HB3 1 22 THR HB 5.530 . 6.360 5.539 5.100 6.241 . 0 0 "[ . 1 . 2]" 1
1428 1 22 THR HB 1 23 LYS HG3 6.000 . 6.900 6.085 4.743 6.993 0.093 14 0 "[ . 1 . 2]" 1
1429 1 19 ALA MB 1 22 THR HB 5.030 . 5.780 5.013 3.663 5.582 . 0 0 "[ . 1 . 2]" 1
1430 1 22 THR HB 1 23 LYS HG2 6.000 . 6.900 4.856 3.161 6.133 . 0 0 "[ . 1 . 2]" 1
1431 1 21 LEU HB2 1 22 THR HB 4.940 . 5.680 4.756 4.294 5.362 . 0 0 "[ . 1 . 2]" 1
1432 1 21 LEU HB2 1 22 THR MG 4.860 . 5.590 4.951 4.454 5.770 0.180 17 0 "[ . 1 . 2]" 1
1433 1 19 ALA HA 1 22 THR MG 4.080 . 4.690 2.448 1.876 3.746 . 0 0 "[ . 1 . 2]" 1
1434 1 21 LEU H 1 22 THR MG 4.490 . 5.160 4.368 3.796 5.557 0.397 2 0 "[ . 1 . 2]" 1
1435 1 17 VAL H 1 22 THR MG 6.000 . 6.900 6.130 5.540 6.579 . 0 0 "[ . 1 . 2]" 1
1436 1 22 THR MG 1 25 TRP H 5.450 . 6.270 5.281 5.028 5.678 . 0 0 "[ . 1 . 2]" 1
1437 1 23 LYS HB2 1 63 PHE QE 4.020 . 4.620 2.618 2.194 3.395 . 0 0 "[ . 1 . 2]" 1
1438 1 23 LYS HG3 1 63 PHE QE 6.000 . 6.900 4.063 3.263 5.221 . 0 0 "[ . 1 . 2]" 1
1439 1 23 LYS HD2 1 62 TYR QD 5.130 . 5.900 4.675 3.903 5.302 . 0 0 "[ . 1 . 2]" 1
1440 1 23 LYS HD3 1 62 TYR QD 5.130 . 5.900 3.234 2.286 4.675 . 0 0 "[ . 1 . 2]" 1
1441 1 22 THR MG 1 23 LYS HA 4.030 . 4.630 3.532 3.426 3.828 . 0 0 "[ . 1 . 2]" 1
1442 1 24 LEU MD1 1 37 ILE MD 3.590 . 4.130 2.411 2.070 2.708 . 0 0 "[ . 1 . 2]" 1
1443 1 24 LEU HA 1 63 PHE QE 5.460 . 6.280 3.840 3.296 4.576 . 0 0 "[ . 1 . 2]" 1
1444 1 24 LEU MD1 1 26 THR H 5.710 . 6.570 5.822 5.647 5.988 . 0 0 "[ . 1 . 2]" 1
1445 1 24 LEU MD1 1 63 PHE QE 4.760 . 5.470 3.628 3.180 4.472 . 0 0 "[ . 1 . 2]" 1
1446 1 24 LEU MD1 1 71 PHE QE 3.440 . 3.960 2.158 1.927 2.470 . 0 0 "[ . 1 . 2]" 1
1447 1 23 LYS HA 1 26 THR MG 4.790 . 5.510 4.178 3.772 4.570 . 0 0 "[ . 1 . 2]" 1
1448 1 27 LEU MD2 1 28 VAL MG2 4.600 . 5.290 3.736 3.468 4.127 . 0 0 "[ . 1 . 2]" 1
1449 1 27 LEU MD1 1 58 VAL MG1 2.950 . 3.390 1.840 1.752 1.946 0.048 14 0 "[ . 1 . 2]" 1
1450 1 27 LEU MD1 1 37 ILE MG 3.000 . 3.450 2.162 1.977 2.476 . 0 0 "[ . 1 . 2]" 1
1451 1 27 LEU MD1 1 33 THR MG 2.840 . 3.270 2.383 2.228 2.603 . 0 0 "[ . 1 . 2]" 1
1452 1 27 LEU MD2 1 62 TYR HB2 4.650 . 5.350 2.909 2.576 3.346 . 0 0 "[ . 1 . 2]" 1
1453 1 27 LEU MD1 1 58 VAL HB 4.530 . 5.210 4.272 4.159 4.434 . 0 0 "[ . 1 . 2]" 1
1454 1 27 LEU MD2 1 58 VAL HB 4.090 . 4.700 4.367 4.186 4.682 . 0 0 "[ . 1 . 2]" 1
1455 1 27 LEU HG 1 30 ASP HB3 5.190 . 5.970 5.129 4.710 5.625 . 0 0 "[ . 1 . 2]" 1
1456 1 27 LEU MD1 1 30 ASP HB2 4.640 . 5.340 4.021 3.366 4.619 . 0 0 "[ . 1 . 2]" 1
1457 1 27 LEU MD1 1 28 VAL HA 4.560 . 5.240 4.451 4.168 4.616 . 0 0 "[ . 1 . 2]" 1
1458 1 27 LEU MD1 1 58 VAL HA 4.170 . 4.800 4.113 3.852 4.456 . 0 0 "[ . 1 . 2]" 1
1459 1 27 LEU MD1 1 33 THR HB 3.770 . 4.340 2.497 2.205 2.860 . 0 0 "[ . 1 . 2]" 1
1460 1 27 LEU MD2 1 58 VAL HA 4.720 . 5.430 5.067 4.750 5.528 0.098 18 0 "[ . 1 . 2]" 1
1461 1 27 LEU MD1 1 37 ILE H 5.050 . 5.810 5.163 4.877 5.466 . 0 0 "[ . 1 . 2]" 1
1462 1 27 LEU MD2 1 37 ILE H 6.000 . 6.900 6.378 6.171 6.572 . 0 0 "[ . 1 . 2]" 1
1463 1 27 LEU MD2 1 63 PHE QD 4.770 . 5.490 3.823 3.253 4.591 . 0 0 "[ . 1 . 2]" 1
1464 1 27 LEU MD2 1 63 PHE QE 3.480 . 4.000 2.344 2.016 3.042 . 0 0 "[ . 1 . 2]" 1
1465 1 27 LEU MD1 1 30 ASP H 4.640 . 5.340 4.367 4.061 4.600 . 0 0 "[ . 1 . 2]" 1
1466 1 27 LEU MD1 1 62 TYR QD 3.450 . 3.970 2.637 2.258 2.931 . 0 0 "[ . 1 . 2]" 1
1467 1 27 LEU MD1 1 62 TYR QE 3.420 . 3.930 2.674 2.458 2.978 . 0 0 "[ . 1 . 2]" 1
1468 1 27 LEU HG 1 54 PHE QD 6.000 . 6.900 5.744 5.366 6.089 . 0 0 "[ . 1 . 2]" 1
1469 1 27 LEU HG 1 63 PHE QE 6.000 . 6.900 5.129 4.755 6.003 . 0 0 "[ . 1 . 2]" 1
1470 1 27 LEU MD1 1 54 PHE HZ 4.840 . 5.570 4.402 3.805 5.041 . 0 0 "[ . 1 . 2]" 1
1471 1 28 VAL MG1 1 47 HIS H 5.210 . 5.990 4.347 3.794 4.785 . 0 0 "[ . 1 . 2]" 1
1472 1 27 LEU H 1 28 VAL MG2 4.760 . 5.470 4.107 3.862 4.313 . 0 0 "[ . 1 . 2]" 1
1473 1 27 LEU H 1 28 VAL HA 5.650 . 6.500 5.322 5.097 5.534 . 0 0 "[ . 1 . 2]" 1
1474 1 28 VAL MG2 1 46 PHE QD 4.150 . 4.770 2.886 2.679 3.150 . 0 0 "[ . 1 . 2]" 1
1475 1 28 VAL MG2 1 46 PHE QE 4.320 . 4.970 3.573 3.355 3.888 . 0 0 "[ . 1 . 2]" 1
1476 1 25 TRP HA 1 28 VAL MG2 4.470 . 5.140 3.258 2.705 3.920 . 0 0 "[ . 1 . 2]" 1
1477 1 28 VAL MG2 1 46 PHE HB3 4.720 . 5.430 3.020 2.532 3.504 . 0 0 "[ . 1 . 2]" 1
1478 1 27 LEU MD2 1 28 VAL HA 4.610 . 5.300 4.948 4.766 5.128 . 0 0 "[ . 1 . 2]" 1
1479 1 24 LEU MD1 1 28 VAL MG2 3.570 . 4.110 2.498 2.222 2.837 . 0 0 "[ . 1 . 2]" 1
1480 1 24 LEU HG 1 28 VAL MG2 3.970 . 4.570 2.668 2.499 2.940 . 0 0 "[ . 1 . 2]" 1
1481 1 28 VAL MG1 1 29 SER HA 5.120 . 5.890 3.630 3.411 3.804 . 0 0 "[ . 1 . 2]" 1
1482 1 30 ASP HB3 1 33 THR H 4.620 . 5.310 3.183 2.960 3.562 . 0 0 "[ . 1 . 2]" 1
1483 1 30 ASP HB2 1 33 THR H 4.670 . 5.370 4.641 4.350 4.893 . 0 0 "[ . 1 . 2]" 1
1484 1 30 ASP HB2 1 33 THR MG 4.170 . 4.800 4.631 4.305 4.879 0.079 1 0 "[ . 1 . 2]" 1
1485 1 30 ASP HB3 1 31 PRO HD2 4.830 . 5.550 4.377 4.148 4.609 . 0 0 "[ . 1 . 2]" 1
1486 1 30 ASP HA 1 31 PRO HD2 3.110 . 3.580 2.261 2.088 2.497 . 0 0 "[ . 1 . 2]" 1
1487 1 30 ASP HA 1 31 PRO HD3 3.570 . 4.110 2.399 2.216 2.560 . 0 0 "[ . 1 . 2]" 1
1488 1 31 PRO HB2 1 32 ASP HA 4.300 . 4.950 4.389 4.118 4.582 . 0 0 "[ . 1 . 2]" 1
1489 1 30 ASP HA 1 31 PRO HG3 4.520 . 5.200 4.502 4.442 4.536 . 0 0 "[ . 1 . 2]" 1
1490 1 74 GLN H 1 77 MET HG3 5.110 . 5.880 5.058 4.765 5.324 . 0 0 "[ . 1 . 2]" 1
1491 1 31 PRO HA 1 34 ASP H 3.370 . 3.880 3.465 3.253 3.738 . 0 0 "[ . 1 . 2]" 1
1492 1 76 ASN H 1 77 MET HG3 5.030 . 5.780 4.694 4.476 4.841 . 0 0 "[ . 1 . 2]" 1
1493 1 30 ASP H 1 31 PRO HD2 5.140 . 5.910 5.002 4.884 5.160 . 0 0 "[ . 1 . 2]" 1
1494 1 30 ASP H 1 31 PRO HD3 5.470 . 6.290 4.870 4.612 5.043 . 0 0 "[ . 1 . 2]" 1
1495 1 31 PRO HD2 1 33 THR H 5.040 . 5.800 4.720 4.535 4.918 . 0 0 "[ . 1 . 2]" 1
1496 1 31 PRO HB2 1 34 ASP H 5.230 . 6.010 5.394 5.165 5.661 . 0 0 "[ . 1 . 2]" 1
1497 1 31 PRO HB2 1 33 THR H 5.210 . 5.990 5.526 5.365 5.720 . 0 0 "[ . 1 . 2]" 1
1498 1 32 ASP HB2 1 33 THR MG 4.470 . 5.140 4.450 2.613 4.923 . 0 0 "[ . 1 . 2]" 1
1499 1 32 ASP H 1 33 THR MG 4.270 . 4.910 4.339 4.035 4.617 . 0 0 "[ . 1 . 2]" 1
1500 1 33 THR MG 1 58 VAL MG1 3.840 . 4.420 2.467 2.096 2.918 . 0 0 "[ . 1 . 2]" 1
1501 1 27 LEU MD2 1 33 THR MG 4.880 . 5.610 4.374 4.216 4.628 . 0 0 "[ . 1 . 2]" 1
1502 1 33 THR MG 1 36 LEU HG 5.380 . 6.190 5.467 4.975 6.040 . 0 0 "[ . 1 . 2]" 1
1503 1 33 THR MG 1 36 LEU HB2 4.550 . 5.230 4.539 4.130 5.126 . 0 0 "[ . 1 . 2]" 1
1504 1 30 ASP HB3 1 33 THR MG 3.710 . 4.270 3.648 3.422 3.875 . 0 0 "[ . 1 . 2]" 1
1505 1 32 ASP HB3 1 33 THR MG 4.470 . 5.140 3.088 2.641 3.495 . 0 0 "[ . 1 . 2]" 1
1506 1 35 ALA HA 1 37 ILE H 4.910 . 5.650 4.525 4.346 4.723 . 0 0 "[ . 1 . 2]" 1
1507 1 35 ALA MB 1 36 LEU HA 4.300 . 4.950 4.091 3.996 4.198 . 0 0 "[ . 1 . 2]" 1
1508 1 35 ALA MB 1 36 LEU MD1 4.520 . 5.200 4.177 4.022 4.491 . 0 0 "[ . 1 . 2]" 1
1509 1 110 GLN HG2 1 113 LEU MD1 4.190 . 4.820 2.696 2.060 4.034 . 0 0 "[ . 1 . 2]" 1
1510 1 36 LEU MD2 1 53 GLN HG3 4.610 . 5.300 3.710 3.129 4.488 . 0 0 "[ . 1 . 2]" 1
1511 1 36 LEU MD2 1 50 ASP HB2 3.890 . 4.470 2.011 1.738 2.982 0.062 11 0 "[ . 1 . 2]" 1
1512 1 36 LEU MD1 1 57 GLU HG2 3.630 . 4.170 3.329 3.050 4.055 . 0 0 "[ . 1 . 2]" 1
1513 1 36 LEU MD1 1 53 GLN HG3 3.340 . 3.840 2.217 1.907 2.607 . 0 0 "[ . 1 . 2]" 1
1514 1 36 LEU MD1 1 50 ASP HB2 3.420 . 3.930 3.590 3.169 4.096 0.166 14 0 "[ . 1 . 2]" 1
1515 1 36 LEU MD1 1 53 GLN HG2 3.720 . 4.280 2.815 2.540 3.210 . 0 0 "[ . 1 . 2]" 1
1516 1 35 ALA MB 1 36 LEU HG 3.500 . 4.030 2.951 2.786 3.294 . 0 0 "[ . 1 . 2]" 1
1517 1 36 LEU MD1 1 50 ASP HB3 3.760 . 4.320 4.196 2.784 4.517 0.197 16 0 "[ . 1 . 2]" 1
1518 1 36 LEU MD1 1 54 PHE HA 3.890 . 4.470 2.273 2.121 2.555 . 0 0 "[ . 1 . 2]" 1
1519 1 36 LEU MD2 1 54 PHE HA 4.470 . 5.140 4.299 4.052 4.854 . 0 0 "[ . 1 . 2]" 1
1520 1 36 LEU HB3 1 54 PHE QD 4.640 . 5.340 2.309 2.006 2.677 . 0 0 "[ . 1 . 2]" 1
1521 1 36 LEU HG 1 54 PHE QD 4.620 . 5.310 4.883 4.554 5.201 . 0 0 "[ . 1 . 2]" 1
1522 1 36 LEU MD2 1 54 PHE QD 4.400 . 5.060 4.351 4.116 4.633 . 0 0 "[ . 1 . 2]" 1
1523 1 36 LEU MD1 1 54 PHE QD 3.960 . 4.550 3.416 2.969 3.742 . 0 0 "[ . 1 . 2]" 1
1524 1 36 LEU MD1 1 53 GLN HE21 4.060 . 4.670 3.579 3.182 4.124 . 0 0 "[ . 1 . 2]" 1
1525 1 36 LEU MD2 1 53 GLN HE21 5.440 . 6.260 5.250 4.795 6.083 . 0 0 "[ . 1 . 2]" 1
1526 1 36 LEU MD1 1 54 PHE H 3.850 . 4.430 2.857 2.489 3.296 . 0 0 "[ . 1 . 2]" 1
1527 1 36 LEU H 1 37 ILE MG 4.140 . 4.760 3.654 3.552 3.766 . 0 0 "[ . 1 . 2]" 1
1528 1 37 ILE MG 1 54 PHE QD 3.820 . 4.390 3.252 2.774 3.562 . 0 0 "[ . 1 . 2]" 1
1529 1 37 ILE MG 1 54 PHE QE 3.320 . 3.820 2.080 1.899 2.237 . 0 0 "[ . 1 . 2]" 1
1530 1 37 ILE HB 1 54 PHE QD 4.790 . 5.510 3.177 2.887 3.529 . 0 0 "[ . 1 . 2]" 1
1531 1 37 ILE HB 1 54 PHE QE 4.300 . 4.950 2.105 1.845 2.418 . 0 0 "[ . 1 . 2]" 1
1532 1 37 ILE MD 1 54 PHE QD 4.430 . 5.090 4.283 4.082 4.468 . 0 0 "[ . 1 . 2]" 1
1533 1 37 ILE HA 1 48 VAL HA 4.500 . 5.180 2.583 2.370 2.927 . 0 0 "[ . 1 . 2]" 1
1534 1 37 ILE HB 1 48 VAL HA 4.670 . 5.370 3.205 2.944 3.434 . 0 0 "[ . 1 . 2]" 1
1535 1 33 THR HB 1 37 ILE MG 3.360 . 3.860 2.415 2.271 2.734 . 0 0 "[ . 1 . 2]" 1
1536 1 27 LEU HA 1 37 ILE MG 4.690 . 5.390 4.221 4.033 4.500 . 0 0 "[ . 1 . 2]" 1
1537 1 28 VAL HA 1 37 ILE MG 3.750 . 4.310 2.908 2.384 3.664 . 0 0 "[ . 1 . 2]" 1
1538 1 28 VAL HA 1 37 ILE MD 4.380 . 5.040 3.262 2.778 3.565 . 0 0 "[ . 1 . 2]" 1
1539 1 106 PHE HB3 1 117 ILE MD 4.660 . 5.360 3.609 3.418 4.052 . 0 0 "[ . 1 . 2]" 1
1540 1 37 ILE HA 1 48 VAL MG1 5.080 . 5.840 4.110 3.824 4.602 . 0 0 "[ . 1 . 2]" 1
1541 1 33 THR MG 1 37 ILE MG 3.670 . 4.220 3.648 3.473 3.939 . 0 0 "[ . 1 . 2]" 1
1542 1 27 LEU HG 1 37 ILE MG 3.370 . 3.880 2.041 1.847 2.323 . 0 0 "[ . 1 . 2]" 1
1543 1 27 LEU HB2 1 37 ILE MG 4.730 . 5.440 4.531 4.397 4.730 . 0 0 "[ . 1 . 2]" 1
1544 1 37 ILE MG 1 58 VAL MG1 3.530 . 4.060 2.666 2.159 3.147 . 0 0 "[ . 1 . 2]" 1
1545 1 27 LEU MD2 1 37 ILE MG 3.330 . 3.830 2.730 2.517 2.915 . 0 0 "[ . 1 . 2]" 1
1546 1 28 VAL MG2 1 37 ILE MG 4.160 . 4.780 3.723 3.404 4.217 . 0 0 "[ . 1 . 2]" 1
1547 1 27 LEU HG 1 37 ILE MD 3.800 . 4.370 1.997 1.813 2.355 . 0 0 "[ . 1 . 2]" 1
1548 1 28 VAL MG2 1 37 ILE MD 3.500 . 4.030 2.102 1.945 2.272 . 0 0 "[ . 1 . 2]" 1
1549 1 27 LEU MD1 1 37 ILE MD 4.000 . 4.600 3.325 3.108 3.671 . 0 0 "[ . 1 . 2]" 1
1550 1 27 LEU MD2 1 37 ILE MD 2.890 . 3.320 2.385 2.260 2.621 . 0 0 "[ . 1 . 2]" 1
1551 1 28 VAL MG1 1 37 ILE MG 4.960 . 5.700 4.446 3.827 5.169 . 0 0 "[ . 1 . 2]" 1
1552 1 28 VAL MG1 1 37 ILE MD 4.350 . 5.000 3.841 3.413 4.156 . 0 0 "[ . 1 . 2]" 1
1553 1 28 VAL HA 1 38 CYS HA 4.080 . 4.690 3.370 2.856 3.827 . 0 0 "[ . 1 . 2]" 1
1554 1 34 ASP HB2 1 38 CYS HB2 5.180 . 5.960 4.425 2.477 6.024 0.064 8 0 "[ . 1 . 2]" 1
1555 1 34 ASP HB3 1 38 CYS HB2 5.180 . 5.960 5.377 3.546 5.983 0.023 13 0 "[ . 1 . 2]" 1
1556 1 34 ASP HB2 1 38 CYS HB3 5.180 . 5.960 3.716 2.258 4.980 . 0 0 "[ . 1 . 2]" 1
1557 1 34 ASP HB3 1 38 CYS HB3 5.180 . 5.960 4.563 3.507 5.978 0.018 7 0 "[ . 1 . 2]" 1
1558 1 28 VAL MG1 1 38 CYS HA 3.900 . 4.490 3.015 2.315 3.577 . 0 0 "[ . 1 . 2]" 1
1559 1 34 ASP HA 1 38 CYS HB3 4.020 . 4.620 2.998 2.047 4.485 . 0 0 "[ . 1 . 2]" 1
1560 1 34 ASP HA 1 38 CYS HB2 4.020 . 4.620 4.147 2.224 4.652 0.032 11 0 "[ . 1 . 2]" 1
1561 1 40 SER HA 1 41 PRO HD2 3.760 . 4.320 2.631 2.242 2.935 . 0 0 "[ . 1 . 2]" 1
1562 1 40 SER HA 1 41 PRO HD3 3.760 . 4.320 2.380 2.019 2.841 . 0 0 "[ . 1 . 2]" 1
1563 1 42 SER HB2 1 44 ASN HD21 5.640 . 6.490 4.615 2.391 6.462 . 0 0 "[ . 1 . 2]" 1
1564 1 42 SER HB3 1 44 ASN HD21 5.640 . 6.490 4.408 2.630 6.080 . 0 0 "[ . 1 . 2]" 1
1565 1 43 GLY HA2 1 108 ARG HB3 5.220 . 6.000 3.635 2.412 5.073 . 0 0 "[ . 1 . 2]" 1
1566 1 43 GLY HA2 1 108 ARG HB2 5.220 . 6.000 3.447 2.376 5.174 . 0 0 "[ . 1 . 2]" 1
1567 1 43 GLY HA3 1 108 ARG HB2 5.220 . 6.000 3.465 2.072 5.676 . 0 0 "[ . 1 . 2]" 1
1568 1 43 GLY HA3 1 108 ARG H 4.810 . 5.530 3.409 2.905 4.049 . 0 0 "[ . 1 . 2]" 1
1569 1 44 ASN HA 1 107 LEU HA 4.060 . 4.670 2.785 2.183 3.127 . 0 0 "[ . 1 . 2]" 1
1570 1 45 SER HA 1 102 GLN HA 4.610 . 5.300 2.574 2.162 3.310 . 0 0 "[ . 1 . 2]" 1
1571 1 39 TRP HA 1 46 PHE HB2 5.190 . 5.970 3.056 2.605 3.582 . 0 0 "[ . 1 . 2]" 1
1572 1 28 VAL MG2 1 46 PHE HB2 4.690 . 5.390 2.918 2.547 3.287 . 0 0 "[ . 1 . 2]" 1
1573 1 38 CYS H 1 47 HIS HB3 4.940 . 5.680 4.835 4.540 5.192 . 0 0 "[ . 1 . 2]" 1
1574 1 46 PHE H 1 48 VAL MG2 5.860 . 6.740 5.563 5.308 5.804 . 0 0 "[ . 1 . 2]" 1
1575 1 48 VAL MG1 1 54 PHE QD 3.600 . 4.140 2.864 2.758 3.023 . 0 0 "[ . 1 . 2]" 1
1576 1 48 VAL MG1 1 101 PHE QE 4.630 . 5.320 3.696 3.273 4.242 . 0 0 "[ . 1 . 2]" 1
1577 1 48 VAL MG2 1 54 PHE QD 4.350 . 5.000 4.304 3.983 4.562 . 0 0 "[ . 1 . 2]" 1
1578 1 48 VAL MG2 1 101 PHE QE 3.820 . 4.390 2.454 2.105 3.079 . 0 0 "[ . 1 . 2]" 1
1579 1 46 PHE QE 1 48 VAL MG2 3.510 . 4.040 2.546 2.262 2.862 . 0 0 "[ . 1 . 2]" 1
1580 1 48 VAL MG2 1 54 PHE HZ 4.360 . 5.010 3.570 3.209 4.008 . 0 0 "[ . 1 . 2]" 1
1581 1 47 HIS HA 1 48 VAL MG2 4.910 . 5.650 3.573 3.442 3.672 . 0 0 "[ . 1 . 2]" 1
1582 1 48 VAL MG1 1 49 PHE HA 4.920 . 5.660 3.891 3.577 4.197 . 0 0 "[ . 1 . 2]" 1
1583 1 36 LEU HA 1 48 VAL MG1 5.170 . 5.950 4.715 4.256 5.458 . 0 0 "[ . 1 . 2]" 1
1584 1 48 VAL MG1 1 98 ASP HA 5.600 . 6.440 5.041 4.459 5.821 . 0 0 "[ . 1 . 2]" 1
1585 1 48 VAL HB 1 99 THR H 4.670 . 5.370 3.262 2.797 4.181 . 0 0 "[ . 1 . 2]" 1
1586 1 48 VAL HB 1 101 PHE QE 4.320 . 4.970 3.516 3.026 4.241 . 0 0 "[ . 1 . 2]" 1
1587 1 48 VAL MG2 1 99 THR HB 4.630 . 5.320 3.517 3.122 3.955 . 0 0 "[ . 1 . 2]" 1
1588 1 48 VAL MG1 1 51 GLN HA 3.790 . 4.360 3.059 2.783 3.485 . 0 0 "[ . 1 . 2]" 1
1589 1 48 VAL MG1 1 54 PHE HB2 3.950 . 4.540 3.273 2.974 3.779 . 0 0 "[ . 1 . 2]" 1
1590 1 48 VAL MG1 1 54 PHE HB3 4.160 . 4.780 3.357 3.149 3.583 . 0 0 "[ . 1 . 2]" 1
1591 1 48 VAL MG1 1 51 GLN HG2 4.440 . 5.110 2.826 1.893 4.547 . 0 0 "[ . 1 . 2]" 1
1592 1 48 VAL MG1 1 51 GLN HB3 4.100 . 4.720 4.250 3.489 4.780 0.060 16 0 "[ . 1 . 2]" 1
1593 1 48 VAL MG1 1 68 MET ME 3.580 . 4.120 2.298 1.802 3.462 . 0 0 "[ . 1 . 2]" 1
1594 1 37 ILE HB 1 48 VAL MG1 4.740 . 5.450 3.151 2.892 3.593 . 0 0 "[ . 1 . 2]" 1
1595 1 37 ILE HB 1 48 VAL MG2 4.500 . 5.180 2.963 2.555 3.323 . 0 0 "[ . 1 . 2]" 1
1596 1 48 VAL MG2 1 68 MET ME 4.350 . 5.000 3.385 2.694 4.639 . 0 0 "[ . 1 . 2]" 1
1597 1 48 VAL HB 1 68 MET ME 4.940 . 5.680 3.910 3.051 5.307 . 0 0 "[ . 1 . 2]" 1
1598 1 48 VAL MG2 1 75 LEU MD1 5.310 . 6.110 3.944 3.595 4.347 . 0 0 "[ . 1 . 2]" 1
1599 1 36 LEU MD1 1 49 PHE HB3 5.050 . 5.810 5.710 5.025 5.963 0.153 1 0 "[ . 1 . 2]" 1
1600 1 36 LEU MD1 1 49 PHE HB2 5.150 . 5.920 5.080 4.416 5.441 . 0 0 "[ . 1 . 2]" 1
1601 1 49 PHE HA 1 98 ASP HA 4.470 . 5.140 3.093 2.746 3.817 . 0 0 "[ . 1 . 2]" 1
1602 1 36 LEU HA 1 49 PHE HB3 4.210 . 4.840 3.602 3.373 3.887 . 0 0 "[ . 1 . 2]" 1
1603 1 36 LEU HA 1 49 PHE HB2 4.630 . 5.320 2.070 1.809 2.473 . 0 0 "[ . 1 . 2]" 1
1604 1 50 ASP HB3 1 52 GLY H 4.830 . 5.550 4.212 3.781 4.727 . 0 0 "[ . 1 . 2]" 1
1605 1 49 PHE HB3 1 50 ASP HB2 4.600 . 5.290 3.866 3.443 4.222 . 0 0 "[ . 1 . 2]" 1
1606 1 49 PHE HB3 1 50 ASP HB3 5.100 . 5.870 5.155 4.319 5.526 . 0 0 "[ . 1 . 2]" 1
1607 1 50 ASP HB3 1 53 GLN HB3 4.040 . 4.650 2.442 2.052 2.706 . 0 0 "[ . 1 . 2]" 1
1608 1 50 ASP HB2 1 53 GLN HB3 4.190 . 4.820 2.888 2.482 4.160 . 0 0 "[ . 1 . 2]" 1
1609 1 51 GLN HG3 1 68 MET ME 4.360 . 5.010 4.015 3.380 5.025 0.015 15 0 "[ . 1 . 2]" 1
1610 1 51 GLN HB3 1 55 ALA MB 4.670 . 5.370 4.157 3.888 4.461 . 0 0 "[ . 1 . 2]" 1
1611 1 48 VAL MG1 1 51 GLN HG3 4.440 . 5.110 3.711 2.884 5.056 . 0 0 "[ . 1 . 2]" 1
1612 1 51 GLN HB3 1 68 MET HG2 5.250 . 6.040 3.260 1.820 4.776 . 0 0 "[ . 1 . 2]" 1
1613 1 51 GLN HB2 1 54 PHE HB3 5.570 . 6.410 5.159 4.816 5.557 . 0 0 "[ . 1 . 2]" 1
1614 1 51 GLN HB3 1 54 PHE HB3 5.840 . 6.720 4.444 3.970 4.938 . 0 0 "[ . 1 . 2]" 1
1615 1 52 GLY HA3 1 55 ALA MB 5.480 . 6.300 4.456 4.186 4.943 . 0 0 "[ . 1 . 2]" 1
1616 1 36 LEU MD1 1 53 GLN HA 5.120 . 5.890 4.383 4.126 4.686 . 0 0 "[ . 1 . 2]" 1
1617 1 36 LEU MD1 1 53 GLN HB3 3.980 . 4.580 2.791 2.206 3.365 . 0 0 "[ . 1 . 2]" 1
1618 1 36 LEU MD2 1 53 GLN HG2 4.240 . 4.880 3.339 2.890 4.113 . 0 0 "[ . 1 . 2]" 1
1619 1 54 PHE HA 1 58 VAL HB 4.150 . 4.770 2.863 2.681 3.027 . 0 0 "[ . 1 . 2]" 1
1620 1 54 PHE HA 1 58 VAL MG2 3.340 . 3.840 2.268 2.133 2.393 . 0 0 "[ . 1 . 2]" 1
1621 1 48 VAL MG1 1 54 PHE HA 5.300 . 6.100 5.012 4.788 5.396 . 0 0 "[ . 1 . 2]" 1
1622 1 36 LEU MD1 1 54 PHE HB2 4.450 . 5.120 2.802 2.434 2.995 . 0 0 "[ . 1 . 2]" 1
1623 1 36 LEU MD2 1 54 PHE HB2 5.390 . 6.200 3.478 3.188 3.823 . 0 0 "[ . 1 . 2]" 1
1624 1 54 PHE HB2 1 58 VAL MG2 5.630 . 6.470 3.727 3.555 3.905 . 0 0 "[ . 1 . 2]" 1
1625 1 36 LEU MD2 1 54 PHE HB3 6.000 . 6.900 4.746 4.409 5.087 . 0 0 "[ . 1 . 2]" 1
1626 1 54 PHE HB3 1 58 VAL MG2 6.000 . 6.900 4.612 4.479 4.726 . 0 0 "[ . 1 . 2]" 1
1627 1 55 ALA HA 1 59 LEU HB2 4.350 . 5.000 2.787 2.442 3.097 . 0 0 "[ . 1 . 2]" 1
1628 1 55 ALA HA 1 59 LEU HB3 4.410 . 5.070 4.087 3.829 4.283 . 0 0 "[ . 1 . 2]" 1
1629 1 55 ALA HA 1 59 LEU HG 3.810 . 4.380 2.070 1.821 2.404 . 0 0 "[ . 1 . 2]" 1
1630 1 55 ALA MB 1 59 LEU MD1 3.040 . 3.500 2.390 2.152 2.573 . 0 0 "[ . 1 . 2]" 1
1631 1 55 ALA MB 1 59 LEU MD2 4.100 . 4.720 4.432 4.204 4.660 . 0 0 "[ . 1 . 2]" 1
1632 1 55 ALA MB 1 68 MET HB2 3.640 . 4.190 1.939 1.750 2.399 0.050 16 0 "[ . 1 . 2]" 1
1633 1 55 ALA MB 1 67 ASN HA 4.980 . 5.730 3.678 3.124 4.096 . 0 0 "[ . 1 . 2]" 1
1634 1 55 ALA MB 1 66 ASN HA 4.770 . 5.490 3.947 3.618 4.256 . 0 0 "[ . 1 . 2]" 1
1635 1 55 ALA MB 1 59 LEU HG 4.460 . 5.130 3.606 3.284 3.889 . 0 0 "[ . 1 . 2]" 1
1636 1 19 ALA MB 1 22 THR MG 4.070 . 4.680 3.648 3.215 4.634 . 0 0 "[ . 1 . 2]" 1
1637 1 54 PHE QE 1 55 ALA MB 4.730 . 5.440 4.683 4.255 5.130 . 0 0 "[ . 1 . 2]" 1
1638 1 55 ALA MB 1 68 MET H 3.950 . 4.540 2.934 2.578 3.200 . 0 0 "[ . 1 . 2]" 1
1639 1 53 GLN HE21 1 56 LYS HD2 4.900 . 5.640 3.298 2.853 4.486 . 0 0 "[ . 1 . 2]" 1
1640 1 53 GLN HE21 1 56 LYS HD3 5.110 . 5.880 3.527 2.370 3.964 . 0 0 "[ . 1 . 2]" 1
1641 1 56 LYS HA 1 66 ASN HB3 4.040 . 4.650 3.249 2.525 4.481 . 0 0 "[ . 1 . 2]" 1
1642 1 56 LYS HG2 1 57 GLU HG3 5.490 . 6.310 6.087 4.740 6.375 0.065 4 0 "[ . 1 . 2]" 1
1643 1 53 GLN HB2 1 56 LYS HG3 5.760 . 6.620 6.427 6.095 6.820 0.200 10 0 "[ . 1 . 2]" 1
1644 1 56 LYS HD3 1 57 GLU HG2 4.080 . 4.690 2.776 2.506 3.040 . 0 0 "[ . 1 . 2]" 1
1645 1 53 GLN HG3 1 56 LYS HD2 5.030 . 5.780 4.225 3.895 5.470 . 0 0 "[ . 1 . 2]" 1
1646 1 53 GLN HG3 1 56 LYS HD3 5.380 . 6.190 4.486 3.706 4.862 . 0 0 "[ . 1 . 2]" 1
1647 1 53 GLN HE22 1 57 GLU HB2 5.250 . 6.040 5.470 4.928 5.742 . 0 0 "[ . 1 . 2]" 1
1648 1 56 LYS H 1 57 GLU HB3 5.520 . 6.350 5.580 5.444 5.737 . 0 0 "[ . 1 . 2]" 1
1649 1 56 LYS H 1 57 GLU HB2 6.000 . 6.900 6.499 6.415 6.582 . 0 0 "[ . 1 . 2]" 1
1650 1 56 LYS H 1 57 GLU HG3 4.650 . 5.350 5.140 4.861 5.355 0.005 10 0 "[ . 1 . 2]" 1
1651 1 56 LYS H 1 57 GLU HG2 4.450 . 5.120 4.401 4.187 4.654 . 0 0 "[ . 1 . 2]" 1
1652 1 53 GLN HA 1 57 GLU HG2 4.440 . 5.110 4.111 3.894 4.267 . 0 0 "[ . 1 . 2]" 1
1653 1 57 GLU HG3 1 58 VAL HA 4.440 . 5.110 3.600 3.445 3.972 . 0 0 "[ . 1 . 2]" 1
1654 1 56 LYS HG3 1 57 GLU HG2 5.280 . 6.070 5.376 4.686 5.642 . 0 0 "[ . 1 . 2]" 1
1655 1 56 LYS HG2 1 57 GLU HG2 4.580 . 5.270 4.902 3.231 5.281 0.011 11 0 "[ . 1 . 2]" 1
1656 1 57 GLU HG2 1 58 VAL MG2 4.100 . 4.720 3.150 2.972 3.362 . 0 0 "[ . 1 . 2]" 1
1657 1 56 LYS HD3 1 57 GLU HG3 3.800 . 4.370 4.157 3.952 4.422 0.052 10 0 "[ . 1 . 2]" 1
1658 1 57 GLU HG3 1 58 VAL HB 4.260 . 4.900 3.859 3.621 4.420 . 0 0 "[ . 1 . 2]" 1
1659 1 57 GLU HG3 1 58 VAL MG2 3.820 . 4.390 1.836 1.766 2.220 0.034 7 0 "[ . 1 . 2]" 1
1660 1 27 LEU MD1 1 58 VAL MG2 4.020 . 4.620 3.468 2.892 3.787 . 0 0 "[ . 1 . 2]" 1
1661 1 27 LEU MD2 1 58 VAL MG1 3.250 . 3.740 2.292 2.064 2.650 . 0 0 "[ . 1 . 2]" 1
1662 1 36 LEU MD1 1 58 VAL MG1 4.740 . 5.450 4.234 3.871 4.595 . 0 0 "[ . 1 . 2]" 1
1663 1 33 THR MG 1 58 VAL MG2 3.550 . 4.080 2.406 1.917 2.885 . 0 0 "[ . 1 . 2]" 1
1664 1 36 LEU HB3 1 58 VAL MG2 4.090 . 4.700 3.288 3.043 3.774 . 0 0 "[ . 1 . 2]" 1
1665 1 36 LEU HB2 1 58 VAL MG2 3.400 . 3.910 2.620 2.250 3.060 . 0 0 "[ . 1 . 2]" 1
1666 1 57 GLU HB2 1 58 VAL MG2 4.230 . 4.860 3.866 3.755 4.056 . 0 0 "[ . 1 . 2]" 1
1667 1 36 LEU HB3 1 58 VAL MG1 5.680 . 6.530 4.633 4.226 5.223 . 0 0 "[ . 1 . 2]" 1
1668 1 36 LEU HB2 1 58 VAL MG1 5.130 . 5.900 4.037 3.648 4.780 . 0 0 "[ . 1 . 2]" 1
1669 1 37 ILE HB 1 58 VAL MG1 5.350 . 6.150 4.029 3.714 4.563 . 0 0 "[ . 1 . 2]" 1
1670 1 58 VAL MG1 1 62 TYR HB2 4.560 . 5.240 3.903 3.513 4.270 . 0 0 "[ . 1 . 2]" 1
1671 1 58 VAL HA 1 60 PRO HG2 4.570 . 5.260 5.042 4.864 5.266 0.006 2 0 "[ . 1 . 2]" 1
1672 1 57 GLU HB2 1 58 VAL HA 4.800 . 5.520 4.280 4.145 4.497 . 0 0 "[ . 1 . 2]" 1
1673 1 54 PHE QD 1 58 VAL MG2 3.350 . 3.850 2.586 2.387 2.733 . 0 0 "[ . 1 . 2]" 1
1674 1 54 PHE QE 1 58 VAL MG2 3.850 . 4.430 3.729 3.324 4.073 . 0 0 "[ . 1 . 2]" 1
1675 1 54 PHE QE 1 58 VAL MG1 3.260 . 3.750 2.426 2.321 2.639 . 0 0 "[ . 1 . 2]" 1
1676 1 54 PHE QD 1 58 VAL HB 4.020 . 4.620 3.381 3.163 3.532 . 0 0 "[ . 1 . 2]" 1
1677 1 58 VAL HA 1 62 TYR QD 4.060 . 4.670 3.839 3.180 4.132 . 0 0 "[ . 1 . 2]" 1
1678 1 54 PHE H 1 58 VAL MG2 4.710 . 5.420 4.520 4.364 4.689 . 0 0 "[ . 1 . 2]" 1
1679 1 58 VAL H 1 59 LEU HA 5.360 . 6.160 5.104 5.069 5.162 . 0 0 "[ . 1 . 2]" 1
1680 1 54 PHE QE 1 59 LEU MD1 4.400 . 5.060 3.068 2.604 3.325 . 0 0 "[ . 1 . 2]" 1
1681 1 54 PHE QE 1 59 LEU HA 5.620 . 6.460 5.093 4.854 5.414 . 0 0 "[ . 1 . 2]" 1
1682 1 59 LEU HA 1 63 PHE HZ 6.000 . 6.900 5.979 5.685 6.409 . 0 0 "[ . 1 . 2]" 1
1683 1 54 PHE QE 1 59 LEU MD2 3.690 . 4.240 2.170 1.944 2.705 . 0 0 "[ . 1 . 2]" 1
1684 1 59 LEU MD2 1 71 PHE QE 4.030 . 4.630 3.339 3.114 3.501 . 0 0 "[ . 1 . 2]" 1
1685 1 59 LEU HB2 1 60 PRO HD3 4.850 . 5.580 2.411 2.213 2.566 . 0 0 "[ . 1 . 2]" 1
1686 1 55 ALA HA 1 59 LEU MD1 3.310 . 3.810 2.141 2.009 2.284 . 0 0 "[ . 1 . 2]" 1
1687 1 55 ALA HA 1 59 LEU MD2 4.190 . 4.820 3.753 3.496 4.010 . 0 0 "[ . 1 . 2]" 1
1688 1 59 LEU MD1 1 66 ASN HA 4.200 . 4.830 3.323 2.999 3.696 . 0 0 "[ . 1 . 2]" 1
1689 1 59 LEU HB3 1 66 ASN HA 4.860 . 5.590 3.191 2.756 3.644 . 0 0 "[ . 1 . 2]" 1
1690 1 59 LEU HB2 1 66 ASN HA 4.790 . 5.510 2.473 2.181 2.734 . 0 0 "[ . 1 . 2]" 1
1691 1 55 ALA MB 1 59 LEU HA 5.330 . 6.130 5.999 5.695 6.207 0.077 14 0 "[ . 1 . 2]" 1
1692 1 58 VAL HB 1 59 LEU HA 5.570 . 6.410 4.346 4.263 4.450 . 0 0 "[ . 1 . 2]" 1
1693 1 59 LEU MD1 1 66 ASN HB3 5.040 . 5.800 4.838 4.271 5.454 . 0 0 "[ . 1 . 2]" 1
1694 1 59 LEU MD1 1 67 ASN HB3 5.300 . 6.100 4.789 4.362 5.006 . 0 0 "[ . 1 . 2]" 1
1695 1 59 LEU MD2 1 71 PHE HB2 4.560 . 5.240 2.666 2.351 3.009 . 0 0 "[ . 1 . 2]" 1
1696 1 60 PRO HD3 1 66 ASN HD21 5.290 . 6.080 3.833 2.716 5.185 . 0 0 "[ . 1 . 2]" 1
1697 1 59 LEU H 1 60 PRO HD2 4.180 . 4.810 2.314 2.190 2.429 . 0 0 "[ . 1 . 2]" 1
1698 1 60 PRO HD2 1 62 TYR H 5.580 . 6.420 5.180 5.060 5.316 . 0 0 "[ . 1 . 2]" 1
1699 1 60 PRO HD2 1 66 ASN HD21 6.000 . 6.900 4.948 3.756 6.684 . 0 0 "[ . 1 . 2]" 1
1700 1 58 VAL H 1 60 PRO HD2 4.970 . 5.720 3.141 2.957 3.327 . 0 0 "[ . 1 . 2]" 1
1701 1 57 GLU H 1 60 PRO HD2 4.400 . 5.060 3.910 3.724 4.109 . 0 0 "[ . 1 . 2]" 1
1702 1 60 PRO HA 1 65 HIS H 3.660 . 4.210 2.630 2.155 3.013 . 0 0 "[ . 1 . 2]" 1
1703 1 60 PRO HB3 1 66 ASN HD21 4.700 . 5.400 4.160 3.480 4.833 . 0 0 "[ . 1 . 2]" 1
1704 1 60 PRO HB2 1 66 ASN HD21 5.160 . 5.930 5.237 4.471 5.958 0.028 5 0 "[ . 1 . 2]" 1
1705 1 57 GLU HA 1 60 PRO HD3 4.760 . 5.470 4.670 4.315 4.964 . 0 0 "[ . 1 . 2]" 1
1706 1 60 PRO HD3 1 66 ASN HA 4.570 . 5.260 2.199 1.968 2.336 . 0 0 "[ . 1 . 2]" 1
1707 1 60 PRO HD2 1 66 ASN HA 4.180 . 4.810 3.821 3.654 3.935 . 0 0 "[ . 1 . 2]" 1
1708 1 60 PRO HB2 1 66 ASN HA 5.050 . 5.810 5.547 5.230 5.856 0.046 14 0 "[ . 1 . 2]" 1
1709 1 56 LYS HA 1 60 PRO HG2 4.860 . 5.590 5.348 5.113 5.535 . 0 0 "[ . 1 . 2]" 1
1710 1 60 PRO HG2 1 66 ASN HA 4.910 . 5.650 5.116 4.835 5.308 . 0 0 "[ . 1 . 2]" 1
1711 1 60 PRO HG3 1 66 ASN HA 4.210 . 4.840 4.000 3.663 4.237 . 0 0 "[ . 1 . 2]" 1
1712 1 59 LEU HB3 1 60 PRO HD3 4.560 . 5.240 3.507 3.272 3.710 . 0 0 "[ . 1 . 2]" 1
1713 1 59 LEU MD1 1 60 PRO HD3 4.710 . 5.420 4.293 4.113 4.459 . 0 0 "[ . 1 . 2]" 1
1714 1 59 LEU HB3 1 60 PRO HD2 4.340 . 4.990 4.148 4.059 4.235 . 0 0 "[ . 1 . 2]" 1
1715 1 59 LEU MD1 1 60 PRO HD2 4.690 . 5.390 4.854 4.761 4.988 . 0 0 "[ . 1 . 2]" 1
1716 1 60 PRO HG3 1 66 ASN HB2 4.700 . 5.400 4.765 3.326 5.337 . 0 0 "[ . 1 . 2]" 1
1717 1 24 LEU HA 1 62 TYR HB2 5.130 . 5.900 5.419 4.971 5.827 . 0 0 "[ . 1 . 2]" 1
1718 1 61 LYS HB2 1 62 TYR QD 3.860 . 4.440 4.090 3.892 4.268 . 0 0 "[ . 1 . 2]" 1
1719 1 61 LYS HA 1 62 TYR HA 4.880 . 5.610 4.685 4.643 4.726 . 0 0 "[ . 1 . 2]" 1
1720 1 61 LYS HB3 1 62 TYR HB2 5.430 . 6.240 4.152 4.001 4.382 . 0 0 "[ . 1 . 2]" 1
1721 1 61 LYS HB3 1 62 TYR HB3 5.290 . 6.080 5.481 5.369 5.609 . 0 0 "[ . 1 . 2]" 1
1722 1 58 VAL MG1 1 62 TYR HB3 5.390 . 6.200 5.247 4.793 5.664 . 0 0 "[ . 1 . 2]" 1
1723 1 27 LEU MD2 1 62 TYR HB3 4.990 . 5.740 3.693 3.437 4.058 . 0 0 "[ . 1 . 2]" 1
1724 1 61 LYS HB3 1 62 TYR HA 4.640 . 5.340 4.475 4.333 4.608 . 0 0 "[ . 1 . 2]" 1
1725 1 61 LYS HG2 1 62 TYR HA 4.760 . 5.470 3.844 3.555 4.126 . 0 0 "[ . 1 . 2]" 1
1726 1 74 GLN HB3 1 78 TYR QE 4.730 . 5.440 2.339 1.923 2.570 . 0 0 "[ . 1 . 2]" 1
1727 1 37 ILE MD 1 63 PHE QE 6.000 . 6.900 4.765 4.304 5.511 . 0 0 "[ . 1 . 2]" 1
1728 1 19 ALA MB 1 63 PHE QE 5.990 . 6.890 5.279 4.834 6.028 . 0 0 "[ . 1 . 2]" 1
1729 1 23 LYS HG2 1 63 PHE QE 6.000 . 6.900 4.876 4.186 6.195 . 0 0 "[ . 1 . 2]" 1
1730 1 56 LYS HA 1 66 ASN HB2 4.770 . 5.490 4.197 2.467 4.863 . 0 0 "[ . 1 . 2]" 1
1731 1 60 PRO HG2 1 66 ASN HB3 4.840 . 5.570 5.404 4.159 5.839 0.269 2 0 "[ . 1 . 2]" 1
1732 1 60 PRO HG3 1 66 ASN HB3 4.180 . 4.810 3.804 2.516 4.276 . 0 0 "[ . 1 . 2]" 1
1733 1 55 ALA MB 1 66 ASN HB3 5.740 . 6.600 4.189 3.614 5.439 . 0 0 "[ . 1 . 2]" 1
1734 1 56 LYS HG3 1 66 ASN HB3 6.000 . 6.900 6.516 5.690 6.987 0.087 20 0 "[ . 1 . 2]" 1
1735 1 56 LYS HB2 1 66 ASN HB2 5.600 . 6.440 6.131 4.733 6.654 0.214 2 0 "[ . 1 . 2]" 1
1736 1 75 LEU HB3 1 80 PHE HB3 4.390 . 5.050 3.119 2.951 3.382 . 0 0 "[ . 1 . 2]" 1
1737 1 51 GLN H 1 68 MET ME 4.970 . 5.720 5.055 4.642 5.926 0.206 7 0 "[ . 1 . 2]" 1
1738 1 55 ALA H 1 68 MET ME 4.720 . 5.430 4.581 3.030 5.349 . 0 0 "[ . 1 . 2]" 1
1739 1 68 MET ME 1 72 VAL H 4.650 . 5.350 4.183 3.332 4.909 . 0 0 "[ . 1 . 2]" 1
1740 1 54 PHE QD 1 68 MET ME 3.620 . 4.160 2.665 2.065 3.170 . 0 0 "[ . 1 . 2]" 1
1741 1 68 MET ME 1 101 PHE HZ 3.830 . 4.400 3.783 3.189 4.481 0.081 4 0 "[ . 1 . 2]" 1
1742 1 68 MET ME 1 101 PHE QE 4.070 . 4.680 3.408 2.806 4.325 . 0 0 "[ . 1 . 2]" 1
1743 1 51 GLN HE22 1 68 MET ME 3.980 . 4.580 3.463 2.115 4.377 . 0 0 "[ . 1 . 2]" 1
1744 1 54 PHE QE 1 68 MET ME 3.430 . 3.940 2.563 2.081 3.077 . 0 0 "[ . 1 . 2]" 1
1745 1 54 PHE HZ 1 68 MET ME 5.630 . 6.470 4.206 3.745 4.923 . 0 0 "[ . 1 . 2]" 1
1746 1 68 MET ME 1 71 PHE HZ 6.000 . 6.900 4.841 4.398 5.543 . 0 0 "[ . 1 . 2]" 1
1747 1 51 GLN HA 1 68 MET ME 4.140 . 4.760 3.209 2.414 3.839 . 0 0 "[ . 1 . 2]" 1
1748 1 68 MET ME 1 99 THR HB 4.970 . 5.720 4.456 3.373 5.871 0.151 5 0 "[ . 1 . 2]" 1
1749 1 55 ALA MB 1 68 MET HB3 4.100 . 4.720 3.273 2.993 3.794 . 0 0 "[ . 1 . 2]" 1
1750 1 55 ALA MB 1 68 MET ME 4.220 . 4.850 3.707 1.980 4.592 . 0 0 "[ . 1 . 2]" 1
1751 1 68 MET ME 1 72 VAL MG2 2.840 . 3.270 2.399 2.055 3.366 0.096 4 0 "[ . 1 . 2]" 1
1752 1 68 MET HB3 1 69 ALA MB 4.690 . 5.390 4.258 3.842 4.649 . 0 0 "[ . 1 . 2]" 1
1753 1 59 LEU MD1 1 68 MET HB3 5.160 . 5.930 4.217 3.736 5.052 . 0 0 "[ . 1 . 2]" 1
1754 1 59 LEU MD1 1 68 MET ME 3.760 . 4.320 3.371 1.804 4.279 . 0 0 "[ . 1 . 2]" 1
1755 1 68 MET ME 1 75 LEU MD1 4.850 . 5.580 4.271 3.675 4.926 . 0 0 "[ . 1 . 2]" 1
1756 1 59 LEU MD1 1 68 MET HA 3.380 . 3.890 2.138 1.977 2.655 . 0 0 "[ . 1 . 2]" 1
1757 1 69 ALA HA 1 72 VAL MG1 4.360 . 5.010 4.368 4.045 4.672 . 0 0 "[ . 1 . 2]" 1
1758 1 69 ALA MB 1 72 VAL HB 4.430 . 5.090 4.491 4.115 4.790 . 0 0 "[ . 1 . 2]" 1
1759 1 69 ALA MB 1 70 SER HB2 4.690 . 5.390 4.191 3.993 4.366 . 0 0 "[ . 1 . 2]" 1
1760 1 69 ALA MB 1 70 SER HB3 5.040 . 5.800 4.723 4.579 4.826 . 0 0 "[ . 1 . 2]" 1
1761 1 67 ASN HD21 1 69 ALA MB 4.190 . 4.820 3.872 3.260 4.617 . 0 0 "[ . 1 . 2]" 1
1762 1 69 ALA MB 1 72 VAL H 5.070 . 5.830 4.984 4.806 5.146 . 0 0 "[ . 1 . 2]" 1
1763 1 68 MET H 1 69 ALA MB 4.380 . 5.040 4.195 3.980 4.442 . 0 0 "[ . 1 . 2]" 1
1764 1 65 HIS HE1 1 70 SER HB2 4.430 . 5.090 4.755 4.055 5.145 0.055 17 0 "[ . 1 . 2]" 1
1765 1 67 ASN HB3 1 70 SER HB2 4.210 . 4.840 3.049 2.354 3.662 . 0 0 "[ . 1 . 2]" 1
1766 1 70 SER HA 1 73 ARG HD2 5.410 . 6.220 4.101 3.545 5.638 . 0 0 "[ . 1 . 2]" 1
1767 1 70 SER HA 1 73 ARG HD3 5.410 . 6.220 4.044 2.901 5.312 . 0 0 "[ . 1 . 2]" 1
1768 1 70 SER HA 1 73 ARG HG2 4.850 . 5.580 4.879 4.378 5.149 . 0 0 "[ . 1 . 2]" 1
1769 1 69 ALA MB 1 70 SER HA 4.130 . 4.750 3.997 3.933 4.058 . 0 0 "[ . 1 . 2]" 1
1770 1 71 PHE HB2 1 72 VAL MG2 5.160 . 5.930 4.600 4.436 4.773 . 0 0 "[ . 1 . 2]" 1
1771 1 71 PHE H 1 72 VAL MG2 4.350 . 5.000 4.099 3.906 4.189 . 0 0 "[ . 1 . 2]" 1
1772 1 72 VAL MG2 1 75 LEU H 5.230 . 6.010 5.297 5.068 5.498 . 0 0 "[ . 1 . 2]" 1
1773 1 71 PHE QD 1 72 VAL MG2 3.560 . 4.090 2.591 2.356 2.807 . 0 0 "[ . 1 . 2]" 1
1774 1 72 VAL MG2 1 101 PHE HZ 3.480 . 4.000 2.123 1.756 2.665 0.044 7 0 "[ . 1 . 2]" 1
1775 1 72 VAL MG2 1 101 PHE QE 4.060 . 4.670 3.143 2.894 3.573 . 0 0 "[ . 1 . 2]" 1
1776 1 71 PHE QE 1 72 VAL MG2 3.980 . 4.580 3.922 3.576 4.193 . 0 0 "[ . 1 . 2]" 1
1777 1 72 VAL MG1 1 75 LEU H 4.520 . 5.200 4.669 4.501 4.876 . 0 0 "[ . 1 . 2]" 1
1778 1 72 VAL MG1 1 101 PHE HZ 3.980 . 4.580 2.561 1.977 3.825 . 0 0 "[ . 1 . 2]" 1
1779 1 72 VAL MG1 1 101 PHE QE 3.640 . 4.190 2.372 1.900 3.049 . 0 0 "[ . 1 . 2]" 1
1780 1 71 PHE HB3 1 72 VAL MG2 5.160 . 5.930 3.055 2.875 3.238 . 0 0 "[ . 1 . 2]" 1
1781 1 72 VAL MG2 1 73 ARG HA 5.410 . 6.220 5.538 5.471 5.638 . 0 0 "[ . 1 . 2]" 1
1782 1 69 ALA HA 1 72 VAL MG2 3.620 . 4.160 3.486 3.091 3.883 . 0 0 "[ . 1 . 2]" 1
1783 1 68 MET HA 1 72 VAL MG2 4.620 . 5.310 3.960 3.809 4.106 . 0 0 "[ . 1 . 2]" 1
1784 1 72 VAL MG1 1 73 ARG HA 4.280 . 4.920 3.675 3.406 3.849 . 0 0 "[ . 1 . 2]" 1
1785 1 68 MET HG2 1 72 VAL MG2 3.960 . 4.550 3.068 1.948 3.913 . 0 0 "[ . 1 . 2]" 1
1786 1 68 MET HG3 1 72 VAL MG2 3.960 . 4.550 2.580 2.114 3.300 . 0 0 "[ . 1 . 2]" 1
1787 1 72 VAL MG1 1 82 LYS HB2 5.550 . 6.380 3.887 3.360 4.408 . 0 0 "[ . 1 . 2]" 1
1788 1 72 VAL MG1 1 75 LEU HB3 4.900 . 5.640 4.721 4.327 5.276 . 0 0 "[ . 1 . 2]" 1
1789 1 72 VAL MG1 1 82 LYS HB3 5.550 . 6.380 5.106 4.612 5.760 . 0 0 "[ . 1 . 2]" 1
1790 1 69 ALA MB 1 72 VAL MG2 4.510 . 5.190 4.627 4.306 4.945 . 0 0 "[ . 1 . 2]" 1
1791 1 55 ALA MB 1 72 VAL MG2 4.940 . 5.680 5.389 4.967 5.632 . 0 0 "[ . 1 . 2]" 1
1792 1 72 VAL HA 1 75 LEU HG 4.120 . 4.740 3.498 2.838 3.848 . 0 0 "[ . 1 . 2]" 1
1793 1 72 VAL MG2 1 75 LEU HB2 5.110 . 5.880 4.531 4.216 4.858 . 0 0 "[ . 1 . 2]" 1
1794 1 72 VAL MG2 1 99 THR MG 5.360 . 6.160 3.786 3.160 4.625 . 0 0 "[ . 1 . 2]" 1
1795 1 72 VAL MG2 1 75 LEU HG 4.600 . 5.290 5.070 4.368 5.365 0.075 19 0 "[ . 1 . 2]" 1
1796 1 72 VAL MG1 1 75 LEU HB2 4.000 . 4.600 3.579 3.234 4.012 . 0 0 "[ . 1 . 2]" 1
1797 1 74 GLN HA 1 78 TYR QD 5.100 . 5.870 3.961 3.453 4.460 . 0 0 "[ . 1 . 2]" 1
1798 1 74 GLN HA 1 78 TYR QE 4.780 . 5.500 4.151 3.750 4.568 . 0 0 "[ . 1 . 2]" 1
1799 1 20 PHE QE 1 74 GLN HG3 4.890 . 5.620 3.026 2.760 3.374 . 0 0 "[ . 1 . 2]" 1
1800 1 20 PHE QE 1 74 GLN HG2 4.900 . 5.640 3.897 3.483 4.455 . 0 0 "[ . 1 . 2]" 1
1801 1 20 PHE QD 1 74 GLN HG2 4.630 . 5.320 4.684 4.491 4.998 . 0 0 "[ . 1 . 2]" 1
1802 1 71 PHE QD 1 74 GLN HG2 4.860 . 5.590 5.341 4.777 5.731 0.141 20 0 "[ . 1 . 2]" 1
1803 1 74 GLN HA 1 77 MET HG2 4.840 . 5.570 4.940 4.480 5.381 . 0 0 "[ . 1 . 2]" 1
1804 1 24 LEU MD2 1 75 LEU MD1 4.860 . 5.590 3.451 3.078 4.094 . 0 0 "[ . 1 . 2]" 1
1805 1 24 LEU MD2 1 75 LEU MD2 3.360 . 3.860 2.022 1.863 2.285 . 0 0 "[ . 1 . 2]" 1
1806 1 24 LEU MD1 1 75 LEU MD2 4.040 . 4.650 3.137 2.694 3.578 . 0 0 "[ . 1 . 2]" 1
1807 1 74 GLN HB3 1 75 LEU MD2 5.820 . 6.690 4.449 3.971 4.864 . 0 0 "[ . 1 . 2]" 1
1808 1 24 LEU MD2 1 75 LEU HA 5.710 . 6.570 4.771 4.541 5.077 . 0 0 "[ . 1 . 2]" 1
1809 1 24 LEU MD1 1 75 LEU MD1 5.010 . 5.760 3.434 2.882 4.010 . 0 0 "[ . 1 . 2]" 1
1810 1 75 LEU MD1 1 80 PHE HB2 4.770 . 5.490 3.880 3.558 4.179 . 0 0 "[ . 1 . 2]" 1
1811 1 75 LEU MD2 1 80 PHE HB2 4.800 . 5.520 3.202 2.818 3.887 . 0 0 "[ . 1 . 2]" 1
1812 1 75 LEU HB3 1 80 PHE HB2 4.490 . 5.160 2.003 1.822 2.235 . 0 0 "[ . 1 . 2]" 1
1813 1 75 LEU HA 1 80 PHE QD 4.220 . 4.850 2.899 2.444 3.374 . 0 0 "[ . 1 . 2]" 1
1814 1 20 PHE QE 1 75 LEU HA 4.750 . 5.460 3.736 3.158 4.159 . 0 0 "[ . 1 . 2]" 1
1815 1 20 PHE HZ 1 75 LEU HA 4.810 . 5.530 4.780 4.039 5.486 . 0 0 "[ . 1 . 2]" 1
1816 1 75 LEU MD1 1 101 PHE HZ 4.390 . 5.050 3.329 3.016 3.646 . 0 0 "[ . 1 . 2]" 1
1817 1 75 LEU MD1 1 101 PHE QE 4.290 . 4.930 2.982 2.820 3.119 . 0 0 "[ . 1 . 2]" 1
1818 1 20 PHE HZ 1 75 LEU MD1 4.340 . 4.990 3.271 2.879 3.664 . 0 0 "[ . 1 . 2]" 1
1819 1 71 PHE QE 1 75 LEU HG 4.690 . 5.390 4.414 4.300 4.569 . 0 0 "[ . 1 . 2]" 1
1820 1 71 PHE HZ 1 75 LEU HG 4.910 . 5.650 4.985 4.869 5.178 . 0 0 "[ . 1 . 2]" 1
1821 1 75 LEU MD2 1 80 PHE QD 4.060 . 4.670 2.967 2.665 3.312 . 0 0 "[ . 1 . 2]" 1
1822 1 75 LEU MD2 1 78 TYR QD 4.630 . 5.320 3.082 2.362 3.953 . 0 0 "[ . 1 . 2]" 1
1823 1 75 LEU MD2 1 101 PHE QE 5.010 . 5.760 4.900 4.317 5.124 . 0 0 "[ . 1 . 2]" 1
1824 1 71 PHE QE 1 75 LEU MD2 3.580 . 4.120 3.862 3.431 4.110 . 0 0 "[ . 1 . 2]" 1
1825 1 20 PHE QE 1 75 LEU MD2 3.470 . 3.990 1.984 1.914 2.033 . 0 0 "[ . 1 . 2]" 1
1826 1 20 PHE HZ 1 75 LEU MD2 3.520 . 4.050 2.945 2.455 3.697 . 0 0 "[ . 1 . 2]" 1
1827 1 75 LEU MD2 1 80 PHE H 4.770 . 5.490 4.590 4.308 5.052 . 0 0 "[ . 1 . 2]" 1
1828 1 75 LEU MD1 1 80 PHE H 5.770 . 6.640 5.765 5.467 5.965 . 0 0 "[ . 1 . 2]" 1
1829 1 76 ASN HB3 1 77 MET HG2 5.180 . 5.960 5.094 4.653 5.657 . 0 0 "[ . 1 . 2]" 1
1830 1 77 MET ME 1 119 ARG HA 4.140 . 4.760 4.397 3.542 4.868 0.108 6 0 "[ . 1 . 2]" 1
1831 1 77 MET ME 1 119 ARG HD2 4.650 . 5.350 3.252 2.185 4.782 . 0 0 "[ . 1 . 2]" 1
1832 1 77 MET ME 1 119 ARG HD3 4.650 . 5.350 3.804 2.532 5.221 . 0 0 "[ . 1 . 2]" 1
1833 1 74 GLN HA 1 77 MET HG3 4.080 . 4.690 3.431 2.848 4.023 . 0 0 "[ . 1 . 2]" 1
1834 1 74 GLN H 1 77 MET ME 4.470 . 5.140 4.049 3.585 5.279 0.139 19 0 "[ . 1 . 2]" 1
1835 1 77 MET ME 1 78 TYR QE 4.230 . 4.860 4.171 3.430 4.978 0.118 16 0 "[ . 1 . 2]" 1
1836 1 77 MET HA 1 79 GLY H 4.520 . 5.200 3.728 3.550 3.932 . 0 0 "[ . 1 . 2]" 1
1837 1 76 ASN H 1 77 MET HA 5.480 . 6.300 5.429 5.359 5.476 . 0 0 "[ . 1 . 2]" 1
1838 1 27 LEU HA 1 62 TYR QE 4.630 . 5.320 3.102 2.793 3.376 . 0 0 "[ . 1 . 2]" 1
1839 1 78 TYR HB2 1 80 PHE QE 4.650 . 5.350 2.986 2.524 3.236 . 0 0 "[ . 1 . 2]" 1
1840 1 78 TYR HB3 1 80 PHE QE 4.580 . 5.270 2.182 2.036 2.487 . 0 0 "[ . 1 . 2]" 1
1841 1 75 LEU HB2 1 80 PHE HB2 4.710 . 5.420 3.550 3.375 3.813 . 0 0 "[ . 1 . 2]" 1
1842 1 75 LEU HB2 1 80 PHE HB3 4.430 . 5.090 4.671 4.457 4.990 . 0 0 "[ . 1 . 2]" 1
1843 1 80 PHE HB2 1 101 PHE QD 5.250 . 6.040 3.484 3.054 4.292 . 0 0 "[ . 1 . 2]" 1
1844 1 82 LYS HD3 1 101 PHE QE 4.930 . 5.670 4.276 2.625 5.534 . 0 0 "[ . 1 . 2]" 1
1845 1 82 LYS HG2 1 99 THR MG 4.100 . 4.720 3.297 1.836 4.579 . 0 0 "[ . 1 . 2]" 1
1846 1 82 LYS HD3 1 99 THR MG 3.970 . 4.570 2.875 1.893 3.674 . 0 0 "[ . 1 . 2]" 1
1847 1 83 VAL MG2 1 100 GLU HB3 4.170 . 4.800 3.555 2.861 4.074 . 0 0 "[ . 1 . 2]" 1
1848 1 83 VAL MG2 1 102 GLN HG3 4.220 . 4.850 3.901 3.518 4.494 . 0 0 "[ . 1 . 2]" 1
1849 1 83 VAL HB 1 100 GLU HB2 4.510 . 5.190 3.812 3.391 4.302 . 0 0 "[ . 1 . 2]" 1
1850 1 83 VAL HB 1 100 GLU HB3 3.520 . 4.050 2.100 1.772 2.543 0.028 2 0 "[ . 1 . 2]" 1
1851 1 83 VAL MG1 1 100 GLU HB3 4.810 . 5.530 3.127 2.628 3.521 . 0 0 "[ . 1 . 2]" 1
1852 1 81 ARG HD2 1 83 VAL MG2 5.310 . 6.110 3.621 2.624 4.765 . 0 0 "[ . 1 . 2]" 1
1853 1 81 ARG HD3 1 83 VAL MG2 5.310 . 6.110 3.829 2.774 4.828 . 0 0 "[ . 1 . 2]" 1
1854 1 83 VAL MG1 1 84 VAL HA 4.510 . 5.190 4.076 3.630 4.347 . 0 0 "[ . 1 . 2]" 1
1855 1 82 LYS HA 1 83 VAL HB 4.890 . 5.620 4.763 4.578 4.983 . 0 0 "[ . 1 . 2]" 1
1856 1 83 VAL MG2 1 101 PHE HA 4.050 . 4.660 4.017 2.983 4.446 . 0 0 "[ . 1 . 2]" 1
1857 1 84 VAL HA 1 99 THR HA 4.160 . 4.780 3.130 2.540 3.994 . 0 0 "[ . 1 . 2]" 1
1858 1 83 VAL HB 1 84 VAL HA 5.030 . 5.780 5.006 4.729 5.201 . 0 0 "[ . 1 . 2]" 1
1859 1 84 VAL HA 1 99 THR MG 4.280 . 4.920 4.320 3.589 5.078 0.158 1 0 "[ . 1 . 2]" 1
1860 1 84 VAL MG2 1 99 THR MG 4.900 . 5.640 4.255 2.829 4.914 . 0 0 "[ . 1 . 2]" 1
1861 1 86 ILE HB 1 97 ASP HA 4.140 . 4.760 3.308 2.197 4.496 . 0 0 "[ . 1 . 2]" 1
1862 1 86 ILE MG 1 87 GLU HA 4.620 . 5.310 4.082 3.327 4.578 . 0 0 "[ . 1 . 2]" 1
1863 1 86 ILE MG 1 88 GLN HA 5.210 . 5.990 3.833 2.802 4.840 . 0 0 "[ . 1 . 2]" 1
1864 1 86 ILE HB 1 98 ASP HB2 5.330 . 6.130 3.942 2.024 5.490 . 0 0 "[ . 1 . 2]" 1
1865 1 86 ILE HB 1 98 ASP HB3 5.330 . 6.130 3.301 2.102 4.422 . 0 0 "[ . 1 . 2]" 1
1866 1 86 ILE MG 1 87 GLU HB3 5.150 . 5.920 5.414 4.293 5.878 . 0 0 "[ . 1 . 2]" 1
1867 1 86 ILE MG 1 98 ASP HB2 5.980 . 6.880 4.682 3.695 5.346 . 0 0 "[ . 1 . 2]" 1
1868 1 86 ILE MG 1 98 ASP HB3 5.980 . 6.880 4.522 3.814 5.085 . 0 0 "[ . 1 . 2]" 1
1869 1 86 ILE MG 1 87 GLU HB2 4.350 . 5.000 4.859 4.253 5.195 0.195 19 0 "[ . 1 . 2]" 1
1870 1 90 GLY HA2 1 91 LEU HG 4.550 . 5.230 4.858 4.398 5.278 0.048 18 0 "[ . 1 . 2]" 1
1871 1 93 LYS H 1 94 PRO HD2 5.280 . 6.070 4.889 4.722 4.977 . 0 0 "[ . 1 . 2]" 1
1872 1 93 LYS HA 1 94 PRO HD2 2.860 . 3.290 2.426 2.162 2.614 . 0 0 "[ . 1 . 2]" 1
1873 1 93 LYS HA 1 94 PRO HD3 2.820 . 3.240 2.610 2.313 2.841 . 0 0 "[ . 1 . 2]" 1
1874 1 93 LYS HA 1 94 PRO HG2 4.850 . 5.580 4.601 4.390 4.745 . 0 0 "[ . 1 . 2]" 1
1875 1 93 LYS HA 1 94 PRO HG3 4.780 . 5.500 4.711 4.516 4.888 . 0 0 "[ . 1 . 2]" 1
1876 1 59 LEU HB2 1 60 PRO HD2 3.490 . 4.010 2.924 2.835 3.012 . 0 0 "[ . 1 . 2]" 1
1877 1 92 VAL MG1 1 94 PRO HD3 6.000 . 6.900 5.860 4.788 7.237 0.337 2 0 "[ . 1 . 2]" 1
1878 1 92 VAL MG2 1 94 PRO HD3 6.000 . 6.900 5.459 4.648 6.244 . 0 0 "[ . 1 . 2]" 1
1879 1 49 PHE QD 1 96 ARG HG3 4.380 . 5.040 3.032 1.823 4.099 . 0 0 "[ . 1 . 2]" 1
1880 1 86 ILE MD 1 98 ASP HB2 5.570 . 6.410 3.596 2.535 4.341 . 0 0 "[ . 1 . 2]" 1
1881 1 86 ILE MD 1 98 ASP HB3 5.570 . 6.410 3.694 2.635 4.913 . 0 0 "[ . 1 . 2]" 1
1882 1 48 VAL HB 1 99 THR HB 4.000 . 4.600 2.316 1.696 2.810 0.104 3 0 "[ . 1 . 2]" 1
1883 1 48 VAL MG1 1 99 THR HB 4.540 . 5.220 3.642 3.079 4.208 . 0 0 "[ . 1 . 2]" 1
1884 1 82 LYS HD2 1 99 THR MG 3.970 . 4.570 2.932 1.805 4.108 . 0 0 "[ . 1 . 2]" 1
1885 1 48 VAL HB 1 99 THR MG 4.520 . 5.200 3.636 2.902 4.269 . 0 0 "[ . 1 . 2]" 1
1886 1 82 LYS HG3 1 99 THR MG 4.100 . 4.720 3.548 2.785 4.437 . 0 0 "[ . 1 . 2]" 1
1887 1 84 VAL MG1 1 99 THR MG 4.900 . 5.640 5.218 4.674 5.737 0.097 3 0 "[ . 1 . 2]" 1
1888 1 68 MET ME 1 99 THR MG 4.740 . 5.450 4.168 2.871 5.170 . 0 0 "[ . 1 . 2]" 1
1889 1 99 THR HB 1 101 PHE QE 4.160 . 4.780 3.582 3.138 4.156 . 0 0 "[ . 1 . 2]" 1
1890 1 99 THR MG 1 101 PHE HZ 3.610 . 4.150 2.670 2.373 2.850 . 0 0 "[ . 1 . 2]" 1
1891 1 99 THR MG 1 101 PHE QE 3.510 . 4.040 2.725 2.267 2.870 . 0 0 "[ . 1 . 2]" 1
1892 1 51 GLN HE22 1 99 THR MG 4.500 . 5.180 3.003 1.823 4.421 . 0 0 "[ . 1 . 2]" 1
1893 1 48 VAL H 1 99 THR MG 5.110 . 5.880 4.389 3.667 4.733 . 0 0 "[ . 1 . 2]" 1
1894 1 48 VAL H 1 99 THR HA 6.000 . 6.900 4.545 4.243 4.747 . 0 0 "[ . 1 . 2]" 1
1895 1 83 VAL MG1 1 100 GLU HB2 5.260 . 6.050 4.250 3.628 4.733 . 0 0 "[ . 1 . 2]" 1
1896 1 99 THR MG 1 100 GLU HB2 5.810 . 6.680 5.257 4.701 5.740 . 0 0 "[ . 1 . 2]" 1
1897 1 83 VAL MG2 1 100 GLU HG2 4.430 . 5.090 3.757 2.981 4.325 . 0 0 "[ . 1 . 2]" 1
1898 1 83 VAL MG2 1 100 GLU HG3 4.980 . 5.730 5.124 4.330 5.692 . 0 0 "[ . 1 . 2]" 1
1899 1 83 VAL MG2 1 101 PHE HB3 5.670 . 6.520 6.128 5.132 6.446 . 0 0 "[ . 1 . 2]" 1
1900 1 82 LYS HD2 1 101 PHE QE 4.930 . 5.670 4.653 2.843 5.663 . 0 0 "[ . 1 . 2]" 1
1901 1 83 VAL MG2 1 102 GLN HA 5.380 . 6.190 5.444 4.377 5.879 . 0 0 "[ . 1 . 2]" 1
1902 1 83 VAL MG2 1 102 GLN HG2 3.820 . 4.390 2.659 2.233 3.145 . 0 0 "[ . 1 . 2]" 1
1903 1 83 VAL MG2 1 102 GLN HB3 3.900 . 4.490 3.768 2.725 4.386 . 0 0 "[ . 1 . 2]" 1
1904 1 80 PHE QD 1 102 GLN HA 5.210 . 5.990 3.821 3.455 4.241 . 0 0 "[ . 1 . 2]" 1
1905 1 103 HIS HB2 1 106 PHE HB2 4.860 . 5.590 3.952 3.628 4.317 . 0 0 "[ . 1 . 2]" 1
1906 1 103 HIS HB3 1 106 PHE HB2 4.720 . 5.430 2.459 2.233 2.754 . 0 0 "[ . 1 . 2]" 1
1907 1 103 HIS HB3 1 104 PRO HD3 4.970 . 5.720 5.086 5.017 5.138 . 0 0 "[ . 1 . 2]" 1
1908 1 103 HIS HA 1 104 PRO HD3 3.330 . 3.830 2.505 2.440 2.610 . 0 0 "[ . 1 . 2]" 1
1909 1 103 HIS HA 1 104 PRO HD2 3.510 . 4.040 2.266 2.173 2.317 . 0 0 "[ . 1 . 2]" 1
1910 1 81 ARG HA 1 103 HIS HD2 6.000 . 6.900 6.563 5.958 7.026 0.126 5 0 "[ . 1 . 2]" 1
1911 1 103 HIS HA 1 104 PRO HG3 4.560 . 5.240 4.570 4.519 4.627 . 0 0 "[ . 1 . 2]" 1
1912 1 103 HIS HA 1 104 PRO HG2 4.550 . 5.230 4.457 4.383 4.499 . 0 0 "[ . 1 . 2]" 1
1913 1 105 CYS HB3 1 113 LEU HB3 5.100 . 5.870 2.824 2.234 4.009 . 0 0 "[ . 1 . 2]" 1
1914 1 105 CYS HB3 1 117 ILE HG13 4.990 . 5.740 3.421 3.079 4.109 . 0 0 "[ . 1 . 2]" 1
1915 1 105 CYS HB2 1 113 LEU HB3 4.580 . 5.270 4.186 3.729 4.621 . 0 0 "[ . 1 . 2]" 1
1916 1 105 CYS HB2 1 117 ILE HG13 4.700 . 5.400 3.276 2.768 4.998 . 0 0 "[ . 1 . 2]" 1
1917 1 105 CYS HB2 1 113 LEU MD1 5.040 . 5.800 4.858 4.146 5.441 . 0 0 "[ . 1 . 2]" 1
1918 1 105 CYS HB2 1 117 ILE HG12 4.570 . 5.260 2.269 1.800 4.272 . 0 0 "[ . 1 . 2]" 1
1919 1 106 PHE HA 1 117 ILE MD 4.070 . 4.680 2.690 2.132 3.173 . 0 0 "[ . 1 . 2]" 1
1920 1 44 ASN HA 1 107 LEU MD2 2.760 . 3.170 2.279 1.843 2.813 . 0 0 "[ . 1 . 2]" 1
1921 1 44 ASN HA 1 107 LEU MD1 4.600 . 5.290 4.954 4.131 5.397 0.107 18 0 "[ . 1 . 2]" 1
1922 1 104 PRO HA 1 107 LEU MD2 3.960 . 4.550 3.915 3.107 4.563 0.013 19 0 "[ . 1 . 2]" 1
1923 1 105 CYS HA 1 107 LEU MD1 4.710 . 5.420 4.533 3.931 4.967 . 0 0 "[ . 1 . 2]" 1
1924 1 105 CYS HA 1 107 LEU HG 4.980 . 5.730 3.984 3.475 4.396 . 0 0 "[ . 1 . 2]" 1
1925 1 107 LEU HB2 1 110 GLN HB3 4.710 . 5.420 2.724 1.699 3.708 0.101 19 0 "[ . 1 . 2]" 1
1926 1 107 LEU MD1 1 110 GLN HB3 3.820 . 4.390 3.512 2.571 4.257 . 0 0 "[ . 1 . 2]" 1
1927 1 107 LEU MD1 1 113 LEU HB2 5.420 . 6.230 4.751 3.635 5.529 . 0 0 "[ . 1 . 2]" 1
1928 1 107 LEU MD1 1 110 GLN HG2 3.920 . 4.510 2.603 1.895 3.602 . 0 0 "[ . 1 . 2]" 1
1929 1 107 LEU MD1 1 110 GLN HB2 3.820 . 4.390 3.206 2.393 3.709 . 0 0 "[ . 1 . 2]" 1
1930 1 106 PHE HB3 1 107 LEU MD2 4.290 . 4.930 4.771 4.466 5.001 0.071 20 0 "[ . 1 . 2]" 1
1931 1 111 GLU HG3 1 114 LEU MD1 4.730 . 5.440 4.718 3.357 5.235 . 0 0 "[ . 1 . 2]" 1
1932 1 112 GLN HB2 1 113 LEU MD2 5.040 . 5.800 4.516 4.035 5.176 . 0 0 "[ . 1 . 2]" 1
1933 1 112 GLN HG2 1 113 LEU MD2 4.050 . 4.660 2.937 2.317 4.133 . 0 0 "[ . 1 . 2]" 1
1934 1 112 GLN HG3 1 113 LEU MD2 4.050 . 4.660 3.818 2.691 4.728 0.068 20 0 "[ . 1 . 2]" 1
1935 1 35 ALA MB 1 36 LEU MD2 3.790 . 4.360 3.285 2.902 3.596 . 0 0 "[ . 1 . 2]" 1
1936 1 107 LEU HG 1 113 LEU MD1 3.860 . 4.440 3.007 2.234 3.779 . 0 0 "[ . 1 . 2]" 1
1937 1 112 GLN HB2 1 113 LEU HA 5.140 . 5.910 4.932 4.672 5.190 . 0 0 "[ . 1 . 2]" 1
1938 1 105 CYS HA 1 113 LEU MD1 3.670 . 4.220 2.699 2.000 3.243 . 0 0 "[ . 1 . 2]" 1
1939 1 105 CYS HA 1 113 LEU MD2 4.140 . 4.760 4.102 3.008 4.569 . 0 0 "[ . 1 . 2]" 1
1940 1 112 GLN HE22 1 113 LEU MD1 4.840 . 5.570 4.739 3.274 5.704 0.134 19 0 "[ . 1 . 2]" 1
1941 1 110 GLN HE22 1 113 LEU MD1 4.690 . 5.390 4.608 3.042 5.414 0.024 18 0 "[ . 1 . 2]" 1
1942 1 110 GLN HE21 1 113 LEU MD1 4.690 . 5.390 3.597 1.872 4.750 . 0 0 "[ . 1 . 2]" 1
1943 1 111 GLU H 1 114 LEU MD1 4.640 . 5.340 4.709 4.066 5.244 . 0 0 "[ . 1 . 2]" 1
1944 1 21 LEU HA 1 114 LEU MD2 4.490 . 5.160 4.292 3.680 5.143 . 0 0 "[ . 1 . 2]" 1
1945 1 106 PHE HB2 1 114 LEU MD2 4.690 . 5.390 3.616 3.036 4.043 . 0 0 "[ . 1 . 2]" 1
1946 1 25 TRP HB3 1 114 LEU MD1 4.240 . 4.880 2.893 1.877 3.586 . 0 0 "[ . 1 . 2]" 1
1947 1 25 TRP HB2 1 114 LEU MD1 4.240 . 4.880 2.256 1.811 3.013 . 0 0 "[ . 1 . 2]" 1
1948 1 17 VAL MG2 1 114 LEU HB3 4.280 . 4.920 3.378 2.998 3.975 . 0 0 "[ . 1 . 2]" 1
1949 1 17 VAL MG1 1 114 LEU HB3 3.910 . 4.500 2.219 1.992 2.460 . 0 0 "[ . 1 . 2]" 1
1950 1 22 THR MG 1 114 LEU MD1 4.930 . 5.670 4.711 4.164 5.391 . 0 0 "[ . 1 . 2]" 1
1951 1 21 LEU MD1 1 114 LEU MD2 4.100 . 4.720 3.068 2.535 3.741 . 0 0 "[ . 1 . 2]" 1
1952 1 17 VAL MG1 1 115 GLU HA 3.930 . 4.520 3.970 3.260 4.379 . 0 0 "[ . 1 . 2]" 1
1953 1 17 VAL MG2 1 115 GLU HA 3.070 . 3.530 3.295 2.600 3.630 0.100 2 0 "[ . 1 . 2]" 1
1954 1 17 VAL MG1 1 115 GLU HB3 4.070 . 4.680 4.059 3.857 4.453 . 0 0 "[ . 1 . 2]" 1
1955 1 17 VAL MG2 1 115 GLU HG2 3.740 . 4.300 3.012 2.519 3.491 . 0 0 "[ . 1 . 2]" 1
1956 1 17 VAL MG2 1 115 GLU HG3 3.790 . 4.360 4.175 3.861 4.407 0.047 7 0 "[ . 1 . 2]" 1
1957 1 114 LEU MD2 1 117 ILE MD 3.160 . 3.630 2.138 1.856 2.679 . 0 0 "[ . 1 . 2]" 1
1958 1 105 CYS HB3 1 117 ILE MD 4.140 . 4.760 3.862 3.435 4.455 . 0 0 "[ . 1 . 2]" 1
1959 1 105 CYS HB3 1 117 ILE HG12 4.710 . 5.420 3.228 2.549 3.732 . 0 0 "[ . 1 . 2]" 1
1960 1 105 CYS HB3 1 117 ILE MG 4.780 . 5.500 5.096 4.475 5.494 . 0 0 "[ . 1 . 2]" 1
1961 1 114 LEU MD2 1 117 ILE HB 5.920 . 6.810 4.176 3.681 4.990 . 0 0 "[ . 1 . 2]" 1
1962 1 21 LEU MD1 1 117 ILE MD 3.370 . 3.880 2.508 2.110 3.229 . 0 0 "[ . 1 . 2]" 1
1963 1 78 TYR HB3 1 117 ILE MG 3.600 . 4.140 2.092 1.900 2.237 . 0 0 "[ . 1 . 2]" 1
1964 1 105 CYS HB2 1 117 ILE MD 4.300 . 4.950 3.300 2.539 4.883 . 0 0 "[ . 1 . 2]" 1
1965 1 117 ILE HA 1 118 LYS HE2 5.420 . 6.230 5.139 3.161 6.388 0.158 4 0 "[ . 1 . 2]" 1
1966 1 117 ILE HA 1 118 LYS HE3 5.420 . 6.230 4.920 3.064 6.373 0.143 12 0 "[ . 1 . 2]" 1
1967 1 114 LEU HA 1 117 ILE MG 4.780 . 5.500 4.327 4.061 4.801 . 0 0 "[ . 1 . 2]" 1
1968 1 78 TYR HB2 1 117 ILE MG 4.010 . 4.610 3.520 3.333 3.675 . 0 0 "[ . 1 . 2]" 1
1969 1 78 TYR QD 1 117 ILE MG 3.410 . 3.920 2.056 1.807 2.534 . 0 0 "[ . 1 . 2]" 1
1970 1 80 PHE QE 1 117 ILE MG 3.970 . 4.570 2.181 1.778 2.782 0.022 1 0 "[ . 1 . 2]" 1
1971 1 103 HIS HD2 1 117 ILE MG 4.940 . 5.680 4.127 3.513 4.539 . 0 0 "[ . 1 . 2]" 1
1972 1 80 PHE QE 1 117 ILE MD 3.330 . 3.830 2.852 2.424 3.179 . 0 0 "[ . 1 . 2]" 1
1973 1 106 PHE QD 1 117 ILE MD 3.870 . 4.450 2.657 2.173 3.289 . 0 0 "[ . 1 . 2]" 1
1974 1 80 PHE QD 1 117 ILE MD 4.780 . 5.500 4.455 4.248 4.804 . 0 0 "[ . 1 . 2]" 1
1975 1 78 TYR QE 1 119 ARG HB3 4.270 . 4.910 3.006 2.507 3.513 . 0 0 "[ . 1 . 2]" 1
1976 1 78 TYR QE 1 119 ARG HB2 4.490 . 5.160 4.369 3.969 4.729 . 0 0 "[ . 1 . 2]" 1
1977 1 78 TYR QE 1 119 ARG HG2 4.970 . 5.720 3.162 2.142 3.853 . 0 0 "[ . 1 . 2]" 1
1978 1 78 TYR QE 1 119 ARG HG3 4.970 . 5.720 4.671 3.872 5.167 . 0 0 "[ . 1 . 2]" 1
1979 1 78 TYR QE 1 119 ARG HD2 6.000 . 6.900 4.287 3.123 5.274 . 0 0 "[ . 1 . 2]" 1
1980 1 78 TYR QE 1 119 ARG HD3 6.000 . 6.900 3.670 2.791 5.089 . 0 0 "[ . 1 . 2]" 1
1981 1 121 VAL HA 1 122 THR MG 5.090 . 5.850 4.752 3.455 6.101 0.251 5 0 "[ . 1 . 2]" 1
1982 1 47 HIS HA 1 100 GLU H 5.380 . 6.190 4.388 4.162 4.506 . 0 0 "[ . 1 . 2]" 1
1983 1 82 LYS HA 1 101 PHE HA 4.110 . 4.730 3.309 2.780 3.872 . 0 0 "[ . 1 . 2]" 1
1984 1 43 GLY HA3 1 108 ARG HB3 5.220 . 6.000 3.185 2.170 4.831 . 0 0 "[ . 1 . 2]" 1
1985 1 20 PHE HZ 1 24 LEU MD1 4.880 . 5.610 4.006 3.451 4.404 . 0 0 "[ . 1 . 2]" 1
1986 1 20 PHE HZ 1 59 LEU MD2 5.630 . 6.470 5.067 4.442 5.652 . 0 0 "[ . 1 . 2]" 1
1987 1 20 PHE HZ 1 24 LEU MD2 4.750 . 5.460 3.758 3.019 4.622 . 0 0 "[ . 1 . 2]" 1
1988 1 26 THR MG 1 29 SER H 4.870 . 5.600 4.872 4.631 5.158 . 0 0 "[ . 1 . 2]" 1
1989 1 26 THR MG 1 62 TYR QD 4.940 . 5.680 3.912 3.363 4.787 . 0 0 "[ . 1 . 2]" 1
1990 1 26 THR HA 1 30 ASP H 4.570 . 5.260 4.809 4.425 5.116 . 0 0 "[ . 1 . 2]" 1
1991 1 39 TRP HA 1 46 PHE HB3 5.180 . 5.960 2.689 2.326 3.126 . 0 0 "[ . 1 . 2]" 1
1992 1 28 VAL MG1 1 46 PHE HB2 4.210 . 4.840 2.470 2.136 2.798 . 0 0 "[ . 1 . 2]" 1
1993 1 28 VAL MG1 1 46 PHE HA 4.620 . 5.310 3.742 3.277 4.256 . 0 0 "[ . 1 . 2]" 1
1994 1 37 ILE MD 1 46 PHE HB3 6.000 . 6.900 4.735 4.383 5.086 . 0 0 "[ . 1 . 2]" 1
1995 1 28 VAL MG1 1 46 PHE HB3 4.500 . 5.180 2.295 2.096 2.852 . 0 0 "[ . 1 . 2]" 1
1996 1 36 LEU HA 1 49 PHE QD 4.940 . 5.680 3.304 2.685 4.150 . 0 0 "[ . 1 . 2]" 1
1997 1 49 PHE QE 1 96 ARG HB3 5.780 . 6.650 6.408 5.646 6.819 0.169 5 0 "[ . 1 . 2]" 1
1998 1 55 ALA MB 1 57 GLU H 4.920 . 5.660 4.896 4.818 5.016 . 0 0 "[ . 1 . 2]" 1
1999 1 59 LEU HB3 1 63 PHE HB2 5.440 . 6.260 3.348 3.019 3.691 . 0 0 "[ . 1 . 2]" 1
2000 1 59 LEU MD1 1 63 PHE HB2 5.710 . 6.570 4.683 4.486 5.120 . 0 0 "[ . 1 . 2]" 1
2001 1 59 LEU MD1 1 63 PHE HB3 5.710 . 6.570 5.635 5.330 6.182 . 0 0 "[ . 1 . 2]" 1
2002 1 59 LEU HB3 1 63 PHE HB3 5.440 . 6.260 4.863 4.471 5.257 . 0 0 "[ . 1 . 2]" 1
2003 1 24 LEU H 1 63 PHE QD 5.670 . 6.520 5.480 4.721 5.968 . 0 0 "[ . 1 . 2]" 1
2004 1 78 TYR HB3 1 117 ILE HB 4.730 . 5.440 4.375 4.184 4.595 . 0 0 "[ . 1 . 2]" 1
2005 1 21 LEU MD2 1 78 TYR HB2 5.260 . 6.050 3.698 3.173 4.196 . 0 0 "[ . 1 . 2]" 1
2006 1 75 LEU MD1 1 80 PHE HB3 5.080 . 5.840 4.018 3.591 4.448 . 0 0 "[ . 1 . 2]" 1
2007 1 75 LEU MD2 1 80 PHE HB3 5.210 . 5.990 3.682 3.111 4.458 . 0 0 "[ . 1 . 2]" 1
2008 1 46 PHE QE 1 101 PHE HB3 4.920 . 5.660 3.646 3.454 4.037 . 0 0 "[ . 1 . 2]" 1
2009 1 46 PHE QE 1 101 PHE HB2 4.850 . 5.580 2.990 2.873 3.134 . 0 0 "[ . 1 . 2]" 1
2010 1 82 LYS HA 1 102 GLN H 4.780 . 5.500 4.717 4.178 5.272 . 0 0 "[ . 1 . 2]" 1
2011 1 100 GLU H 1 101 PHE HA 5.110 . 5.880 5.010 4.907 5.210 . 0 0 "[ . 1 . 2]" 1
2012 1 47 HIS HA 1 100 GLU HA 3.600 . 4.140 2.202 1.970 2.356 . 0 0 "[ . 1 . 2]" 1
2013 1 46 PHE H 1 102 GLN HA 5.790 . 6.660 3.831 3.632 4.087 . 0 0 "[ . 1 . 2]" 1
2014 1 45 SER HA 1 102 GLN HB3 4.500 . 5.180 4.079 3.046 5.115 . 0 0 "[ . 1 . 2]" 1
2015 1 45 SER HA 1 102 GLN HB2 5.310 . 6.110 4.349 3.768 5.135 . 0 0 "[ . 1 . 2]" 1
2016 1 50 ASP H 1 98 ASP HA 4.800 . 5.520 4.626 3.872 5.518 . 0 0 "[ . 1 . 2]" 1
2017 1 37 ILE MG 1 48 VAL HA 5.090 . 5.850 4.647 4.494 4.778 . 0 0 "[ . 1 . 2]" 1
2018 1 37 ILE MD 1 48 VAL HA 4.980 . 5.730 4.190 3.681 4.630 . 0 0 "[ . 1 . 2]" 1
2019 1 39 TRP HA 1 46 PHE HA 4.050 . 4.660 2.315 2.035 2.750 . 0 0 "[ . 1 . 2]" 1
2020 1 80 PHE QD 1 101 PHE HB2 4.900 . 5.640 3.173 2.911 3.536 . 0 0 "[ . 1 . 2]" 1
2021 1 107 LEU HA 1 108 ARG HA 5.070 . 5.830 4.339 4.195 4.465 . 0 0 "[ . 1 . 2]" 1
2022 1 114 LEU HA 1 117 ILE HG13 4.470 . 5.140 2.439 2.131 2.818 . 0 0 "[ . 1 . 2]" 1
2023 1 21 LEU MD2 1 114 LEU HA 4.590 . 5.280 4.548 4.189 4.832 . 0 0 "[ . 1 . 2]" 1
2024 1 18 PRO HD2 1 114 LEU MD1 5.370 . 6.180 5.076 4.591 5.828 . 0 0 "[ . 1 . 2]" 1
2025 1 22 THR HB 1 114 LEU MD1 5.590 . 6.430 4.480 3.138 6.389 . 0 0 "[ . 1 . 2]" 1
2026 1 106 PHE HA 1 114 LEU MD2 3.960 . 4.550 2.979 1.999 4.054 . 0 0 "[ . 1 . 2]" 1
2027 1 111 GLU HA 1 114 LEU MD1 5.150 . 5.920 2.535 2.072 3.191 . 0 0 "[ . 1 . 2]" 1
2028 1 111 GLU HA 1 114 LEU MD2 4.900 . 5.640 3.590 3.064 4.230 . 0 0 "[ . 1 . 2]" 1
2029 1 111 GLU HG2 1 114 LEU MD1 4.730 . 5.440 4.928 4.428 5.449 0.009 14 0 "[ . 1 . 2]" 1
2030 1 21 LEU HB2 1 114 LEU MD1 4.580 . 5.270 3.678 3.260 4.610 . 0 0 "[ . 1 . 2]" 1
2031 1 21 LEU MD1 1 80 PHE HZ 5.160 . 5.930 4.254 3.731 4.740 . 0 0 "[ . 1 . 2]" 1
2032 1 24 LEU MD2 1 80 PHE HZ 4.880 . 5.610 3.267 2.925 3.670 . 0 0 "[ . 1 . 2]" 1
2033 1 24 LEU MD1 1 101 PHE QE 5.490 . 6.310 5.645 5.172 5.991 . 0 0 "[ . 1 . 2]" 1
2034 1 20 PHE QD 1 24 LEU MD2 5.430 . 6.240 3.506 3.283 3.962 . 0 0 "[ . 1 . 2]" 1
2035 1 24 LEU MD2 1 46 PHE QD 6.000 . 6.900 4.281 4.006 4.606 . 0 0 "[ . 1 . 2]" 1
2036 1 21 LEU H 1 24 LEU MD2 6.000 . 6.900 5.276 5.158 5.406 . 0 0 "[ . 1 . 2]" 1
2037 1 24 LEU MD2 1 71 PHE QD 6.000 . 6.900 5.140 4.695 5.499 . 0 0 "[ . 1 . 2]" 1
2038 1 24 LEU MD1 1 27 LEU MD1 4.820 . 5.540 4.604 4.261 4.965 . 0 0 "[ . 1 . 2]" 1
2039 1 30 ASP HB2 1 31 PRO HD2 4.670 . 5.370 4.081 3.910 4.333 . 0 0 "[ . 1 . 2]" 1
2040 1 27 LEU HA 1 30 ASP HB2 5.270 . 6.060 2.914 2.503 3.580 . 0 0 "[ . 1 . 2]" 1
2041 1 31 PRO HA 1 34 ASP HB2 4.980 . 5.730 3.064 1.985 4.605 . 0 0 "[ . 1 . 2]" 1
2042 1 31 PRO HA 1 34 ASP HB3 4.980 . 5.730 2.741 2.020 4.109 . 0 0 "[ . 1 . 2]" 1
2043 1 36 LEU MD2 1 50 ASP HB3 4.690 . 5.390 3.240 2.199 3.565 . 0 0 "[ . 1 . 2]" 1
2044 1 36 LEU MD2 1 49 PHE HB3 5.200 . 5.980 3.283 2.792 3.570 . 0 0 "[ . 1 . 2]" 1
2045 1 36 LEU MD2 1 49 PHE HB2 5.180 . 5.960 2.781 2.272 3.407 . 0 0 "[ . 1 . 2]" 1
2046 1 36 LEU MD1 1 48 VAL MG1 4.620 . 5.310 5.001 4.604 5.329 0.019 19 0 "[ . 1 . 2]" 1
2047 1 36 LEU MD2 1 48 VAL MG1 5.150 . 5.920 4.771 4.515 5.332 . 0 0 "[ . 1 . 2]" 1
2048 1 24 LEU MD2 1 37 ILE MD 4.670 . 5.370 4.327 3.959 4.674 . 0 0 "[ . 1 . 2]" 1
2049 1 37 ILE MD 1 48 VAL MG1 3.780 . 4.350 3.579 3.064 4.013 . 0 0 "[ . 1 . 2]" 1
2050 1 50 ASP HB3 1 53 GLN HG2 5.260 . 6.050 4.126 3.579 4.459 . 0 0 "[ . 1 . 2]" 1
2051 1 54 PHE HA 1 56 LYS HD3 5.130 . 5.900 6.001 5.914 6.112 0.212 9 0 "[ . 1 . 2]" 1
2052 1 36 LEU HB3 1 54 PHE HA 4.320 . 4.970 3.451 3.014 3.940 . 0 0 "[ . 1 . 2]" 1
2053 1 56 LYS HE2 1 57 GLU HG3 6.000 . 6.900 6.164 5.504 7.139 0.239 20 0 "[ . 1 . 2]" 1
2054 1 56 LYS HE3 1 57 GLU HG3 6.000 . 6.900 6.304 5.616 6.919 0.019 18 0 "[ . 1 . 2]" 1
2055 1 74 GLN HB2 1 77 MET HB2 5.080 . 5.840 5.580 5.206 5.778 . 0 0 "[ . 1 . 2]" 1
2056 1 58 VAL MG1 1 59 LEU MD2 4.050 . 4.660 3.028 2.530 3.355 . 0 0 "[ . 1 . 2]" 1
2057 1 60 PRO HB3 1 66 ASN HB2 5.080 . 5.840 5.025 4.204 5.510 . 0 0 "[ . 1 . 2]" 1
2058 1 60 PRO HB3 1 66 ASN HB3 4.500 . 5.180 4.438 2.531 5.228 0.048 2 0 "[ . 1 . 2]" 1
2059 1 80 PHE HB2 1 101 PHE HB3 5.010 . 5.760 3.429 3.111 3.791 . 0 0 "[ . 1 . 2]" 1
2060 1 80 PHE HB3 1 101 PHE HB3 4.990 . 5.740 2.073 1.779 2.550 0.021 11 0 "[ . 1 . 2]" 1
2061 1 81 ARG HB3 1 102 GLN H 4.900 . 5.640 3.329 2.768 3.734 . 0 0 "[ . 1 . 2]" 1
2062 1 94 PRO HA 1 96 ARG H 4.670 . 5.370 4.183 3.757 4.685 . 0 0 "[ . 1 . 2]" 1
2063 1 107 LEU HB3 1 113 LEU MD1 5.710 . 6.570 4.606 3.925 5.565 . 0 0 "[ . 1 . 2]" 1
2064 1 107 LEU HB2 1 113 LEU MD1 5.890 . 6.770 3.326 2.516 4.264 . 0 0 "[ . 1 . 2]" 1
2065 1 107 LEU MD1 1 113 LEU MD1 3.070 . 3.530 2.477 1.911 3.251 . 0 0 "[ . 1 . 2]" 1
2066 1 83 VAL HB 1 100 GLU HG2 4.640 . 5.340 3.554 3.099 3.913 . 0 0 "[ . 1 . 2]" 1
2067 1 83 VAL HB 1 100 GLU HG3 4.960 . 5.700 4.746 4.471 5.092 . 0 0 "[ . 1 . 2]" 1
2068 1 45 SER HB2 1 102 GLN HA 5.300 . 6.100 3.104 2.690 3.907 . 0 0 "[ . 1 . 2]" 1
2069 1 102 GLN HA 1 103 HIS HA 5.190 . 5.970 4.503 4.464 4.528 . 0 0 "[ . 1 . 2]" 1
2070 1 103 HIS HB2 1 106 PHE HB3 5.340 . 6.140 3.761 3.501 4.202 . 0 0 "[ . 1 . 2]" 1
2071 1 106 PHE HB3 1 114 LEU MD2 4.740 . 5.450 4.732 4.182 5.314 . 0 0 "[ . 1 . 2]" 1
2072 1 107 LEU HB2 1 110 GLN HG3 4.680 . 5.380 3.809 2.158 4.800 . 0 0 "[ . 1 . 2]" 1
2073 1 107 LEU HB2 1 110 GLN HG2 4.680 . 5.380 3.069 2.291 3.907 . 0 0 "[ . 1 . 2]" 1
2074 1 110 GLN HG3 1 113 LEU MD1 4.190 . 4.820 3.016 2.335 4.125 . 0 0 "[ . 1 . 2]" 1
2075 1 107 LEU MD1 1 110 GLN HG3 3.920 . 4.510 3.545 1.832 4.584 0.074 9 0 "[ . 1 . 2]" 1
2076 1 107 LEU HB2 1 110 GLN HB2 4.710 . 5.420 2.158 1.740 2.708 0.060 18 0 "[ . 1 . 2]" 1
2077 1 107 LEU HB3 1 110 GLN HB2 5.120 . 5.890 3.405 2.903 3.842 . 0 0 "[ . 1 . 2]" 1
2078 1 114 LEU HA 1 117 ILE HB 4.720 . 5.430 3.200 2.759 3.940 . 0 0 "[ . 1 . 2]" 1
2079 1 113 LEU HB3 1 114 LEU HA 4.850 . 5.580 4.705 4.490 4.853 . 0 0 "[ . 1 . 2]" 1
2080 1 111 GLU HA 1 114 LEU HG 4.090 . 4.700 2.239 1.723 2.764 0.077 12 0 "[ . 1 . 2]" 1
2081 1 112 GLN HA 1 115 GLU HG3 4.720 . 5.430 4.627 3.899 5.427 . 0 0 "[ . 1 . 2]" 1
2082 1 115 GLU HG2 1 116 ASN HD22 4.980 . 5.730 3.776 3.080 4.391 . 0 0 "[ . 1 . 2]" 1
2083 1 115 GLU HG3 1 116 ASN HD22 5.230 . 6.010 2.943 2.563 3.934 . 0 0 "[ . 1 . 2]" 1
2084 1 78 TYR QD 1 119 ARG HA 4.210 . 4.840 3.577 2.952 4.184 . 0 0 "[ . 1 . 2]" 1
2085 1 78 TYR HA 1 119 ARG HA 3.610 . 4.150 2.686 2.126 3.347 . 0 0 "[ . 1 . 2]" 1
2086 1 78 TYR HA 1 119 ARG HB3 4.760 . 5.470 3.752 2.928 4.906 . 0 0 "[ . 1 . 2]" 1
2087 1 118 LYS HA 1 119 ARG HB3 5.380 . 6.190 4.702 4.231 4.848 . 0 0 "[ . 1 . 2]" 1
2088 1 118 LYS HA 1 119 ARG HG2 4.570 . 5.260 3.865 3.474 4.084 . 0 0 "[ . 1 . 2]" 1
2089 1 118 LYS HA 1 119 ARG HG3 4.570 . 5.260 5.054 4.456 5.343 0.083 12 0 "[ . 1 . 2]" 1
2090 1 18 PRO HD3 1 21 LEU HB3 6.000 . 6.900 5.645 5.267 6.260 . 0 0 "[ . 1 . 2]" 1
2091 1 18 PRO HD3 1 114 LEU HB2 6.000 . 6.900 5.526 4.888 6.453 . 0 0 "[ . 1 . 2]" 1
2092 1 18 PRO HD3 1 21 LEU HB2 5.040 . 5.800 4.370 4.026 4.877 . 0 0 "[ . 1 . 2]" 1
2093 1 20 PHE HB2 1 63 PHE QD 4.680 . 5.380 4.511 4.114 5.020 . 0 0 "[ . 1 . 2]" 1
2094 1 20 PHE QE 1 75 LEU H 5.730 . 6.590 4.178 3.988 4.356 . 0 0 "[ . 1 . 2]" 1
2095 1 20 PHE QD 1 74 GLN H 6.000 . 6.900 6.123 5.878 6.397 . 0 0 "[ . 1 . 2]" 1
2096 1 20 PHE QD 1 75 LEU H 6.000 . 6.900 5.716 5.409 5.966 . 0 0 "[ . 1 . 2]" 1
2097 1 20 PHE HA 1 63 PHE QD 4.600 . 5.290 3.114 2.581 3.692 . 0 0 "[ . 1 . 2]" 1
2098 1 24 LEU MD1 1 80 PHE QE 5.340 . 6.140 5.178 4.737 5.527 . 0 0 "[ . 1 . 2]" 1
2099 1 28 VAL MG1 1 39 TRP HB2 5.070 . 5.830 3.518 3.269 3.884 . 0 0 "[ . 1 . 2]" 1
2100 1 28 VAL MG1 1 39 TRP HA 4.920 . 5.660 2.678 2.226 3.029 . 0 0 "[ . 1 . 2]" 1
2101 1 45 SER HB3 1 102 GLN HA 5.300 . 6.100 2.582 1.992 3.555 . 0 0 "[ . 1 . 2]" 1
2102 1 36 LEU HG 1 54 PHE HA 4.480 . 5.150 4.975 4.717 5.205 0.055 2 0 "[ . 1 . 2]" 1
2103 1 58 VAL MG1 1 59 LEU HA 4.030 . 4.630 3.388 3.073 3.575 . 0 0 "[ . 1 . 2]" 1
2104 1 33 THR HB 1 58 VAL MG1 5.070 . 5.830 2.988 2.553 3.562 . 0 0 "[ . 1 . 2]" 1
2105 1 57 GLU HA 1 58 VAL MG2 5.120 . 5.890 4.779 4.674 4.856 . 0 0 "[ . 1 . 2]" 1
2106 1 33 THR HB 1 58 VAL MG2 4.730 . 5.440 3.191 2.669 3.757 . 0 0 "[ . 1 . 2]" 1
2107 1 58 VAL HA 1 61 LYS HE2 6.000 . 6.900 5.714 4.905 6.199 . 0 0 "[ . 1 . 2]" 1
2108 1 58 VAL HA 1 61 LYS HE3 6.000 . 6.900 5.753 4.955 6.404 . 0 0 "[ . 1 . 2]" 1
2109 1 59 LEU MD2 1 71 PHE HB3 4.560 . 5.240 3.524 3.286 3.838 . 0 0 "[ . 1 . 2]" 1
2110 1 59 LEU MD1 1 71 PHE HB3 4.470 . 5.140 2.752 2.643 2.896 . 0 0 "[ . 1 . 2]" 1
2111 1 59 LEU MD1 1 71 PHE HB2 4.470 . 5.140 2.331 2.042 2.593 . 0 0 "[ . 1 . 2]" 1
2112 1 55 ALA MB 1 59 LEU HB3 5.350 . 6.150 4.814 4.443 5.083 . 0 0 "[ . 1 . 2]" 1
2113 1 60 PRO HD3 1 66 ASN HB2 5.040 . 5.800 4.243 2.827 4.734 . 0 0 "[ . 1 . 2]" 1
2114 1 60 PRO HD2 1 66 ASN HB3 4.870 . 5.600 4.761 4.192 5.088 . 0 0 "[ . 1 . 2]" 1
2115 1 67 ASN HB3 1 70 SER HB3 4.330 . 4.980 3.075 2.371 3.569 . 0 0 "[ . 1 . 2]" 1
2116 1 94 PRO HB2 1 96 ARG HG2 4.260 . 4.900 2.401 1.778 3.506 0.022 11 0 "[ . 1 . 2]" 1
2117 1 94 PRO HG2 1 96 ARG HG2 4.470 . 5.140 2.714 1.868 3.752 . 0 0 "[ . 1 . 2]" 1
2118 1 50 ASP H 1 96 ARG HB2 5.320 . 6.120 2.797 1.797 3.342 0.003 5 0 "[ . 1 . 2]" 1
2119 1 96 ARG HB2 1 98 ASP H 6.000 . 6.900 5.798 5.273 6.284 . 0 0 "[ . 1 . 2]" 1
2120 1 96 ARG HG3 1 98 ASP H 5.010 . 5.760 4.680 3.789 5.643 . 0 0 "[ . 1 . 2]" 1
2121 1 94 PRO HB3 1 96 ARG HD2 5.780 . 6.650 5.274 4.156 6.687 0.037 16 0 "[ . 1 . 2]" 1
2122 1 94 PRO HB3 1 96 ARG HD3 5.780 . 6.650 5.574 4.084 6.681 0.031 8 0 "[ . 1 . 2]" 1
2123 1 82 LYS HA 1 99 THR MG 4.940 . 5.680 3.326 2.396 4.173 . 0 0 "[ . 1 . 2]" 1
2124 1 23 LYS HD2 1 24 LEU H 6.000 . 6.900 6.488 6.357 6.575 . 0 0 "[ . 1 . 2]" 1
2125 1 23 LYS HD3 1 24 LEU H 6.000 . 6.900 5.730 5.309 5.896 . 0 0 "[ . 1 . 2]" 1
2126 1 54 PHE HZ 1 58 VAL MG2 5.790 . 6.660 5.272 4.653 5.749 . 0 0 "[ . 1 . 2]" 1
2127 1 59 LEU HA 1 62 TYR QD 5.040 . 5.800 4.828 4.204 5.203 . 0 0 "[ . 1 . 2]" 1
2128 1 83 VAL HA 1 84 VAL HB 5.030 . 5.780 4.690 4.514 4.824 . 0 0 "[ . 1 . 2]" 1
2129 1 82 LYS HE2 1 83 VAL HA 6.000 . 6.900 5.270 4.301 6.618 . 0 0 "[ . 1 . 2]" 1
2130 1 82 LYS HE3 1 83 VAL HA 6.000 . 6.900 5.730 5.076 6.864 . 0 0 "[ . 1 . 2]" 1
2131 1 75 LEU MD1 1 102 GLN H 6.000 . 6.900 6.207 5.910 6.589 . 0 0 "[ . 1 . 2]" 1
2132 1 107 LEU HB3 1 110 GLN HB3 5.120 . 5.890 4.305 3.179 5.316 . 0 0 "[ . 1 . 2]" 1
2133 1 110 GLN HA 1 112 GLN HA 6.000 . 6.900 6.125 5.790 6.443 . 0 0 "[ . 1 . 2]" 1
2134 1 110 GLN HA 1 112 GLN HB3 5.140 . 5.910 5.175 4.862 5.650 . 0 0 "[ . 1 . 2]" 1
2135 1 68 MET ME 1 69 ALA H 5.720 . 6.580 5.675 4.680 6.205 . 0 0 "[ . 1 . 2]" 1
2136 1 27 LEU HG 1 37 ILE H 6.000 . 6.900 6.049 5.822 6.269 . 0 0 "[ . 1 . 2]" 1
2137 1 82 LYS HA 1 83 VAL MG2 4.270 . 4.910 3.807 3.658 3.988 . 0 0 "[ . 1 . 2]" 1
2138 1 86 ILE MG 1 97 ASP HA 3.520 . 4.050 3.463 2.660 4.098 0.048 12 0 "[ . 1 . 2]" 1
2139 1 84 VAL H 1 99 THR HA 6.000 . 6.900 5.261 4.804 5.819 . 0 0 "[ . 1 . 2]" 1
2140 1 84 VAL MG2 1 99 THR HA 5.210 . 5.990 4.042 2.989 5.236 . 0 0 "[ . 1 . 2]" 1
2141 1 83 VAL MG1 1 101 PHE HA 5.910 . 6.800 6.116 5.461 6.453 . 0 0 "[ . 1 . 2]" 1
2142 1 86 ILE MD 1 98 ASP H 4.950 . 5.690 4.522 3.631 5.651 . 0 0 "[ . 1 . 2]" 1
2143 1 80 PHE QE 1 106 PHE HB3 5.020 . 5.770 3.342 2.946 3.872 . 0 0 "[ . 1 . 2]" 1
2144 1 80 PHE HZ 1 106 PHE HB3 5.230 . 6.010 4.078 3.682 4.629 . 0 0 "[ . 1 . 2]" 1
2145 1 81 ARG HB2 1 102 GLN HG2 4.230 . 4.860 4.023 3.371 4.465 . 0 0 "[ . 1 . 2]" 1
2146 1 81 ARG HB2 1 102 GLN HG3 4.270 . 4.910 3.533 3.012 4.050 . 0 0 "[ . 1 . 2]" 1
2147 1 23 LYS HB2 1 62 TYR HB2 4.830 . 5.550 5.016 4.635 5.448 . 0 0 "[ . 1 . 2]" 1
2148 1 23 LYS HB2 1 62 TYR HB3 3.810 . 4.380 3.577 3.101 4.093 . 0 0 "[ . 1 . 2]" 1
2149 1 23 LYS HD2 1 62 TYR HB3 5.860 . 6.740 4.659 4.158 5.724 . 0 0 "[ . 1 . 2]" 1
2150 1 23 LYS HD3 1 62 TYR HB3 5.860 . 6.740 3.070 2.595 4.453 . 0 0 "[ . 1 . 2]" 1
2151 1 80 PHE QD 1 103 HIS HB2 5.510 . 6.340 3.053 2.830 3.207 . 0 0 "[ . 1 . 2]" 1
2152 1 59 LEU H 1 60 PRO HG3 4.910 . 5.650 4.947 4.841 5.065 . 0 0 "[ . 1 . 2]" 1
2153 1 105 CYS HA 1 113 LEU HB3 4.930 . 5.670 3.236 2.661 3.938 . 0 0 "[ . 1 . 2]" 1
2154 1 113 LEU HB2 1 116 ASN HD21 5.790 . 6.660 4.952 4.451 5.809 . 0 0 "[ . 1 . 2]" 1
2155 1 111 GLU H 1 114 LEU MD2 5.630 . 6.470 5.600 5.001 6.108 . 0 0 "[ . 1 . 2]" 1
2156 1 21 LEU MD2 1 114 LEU MD2 3.110 . 3.580 3.067 2.307 3.696 0.116 4 0 "[ . 1 . 2]" 1
2157 1 16 ASN H 1 115 GLU HB3 4.030 . 4.630 3.525 2.619 4.753 0.123 12 0 "[ . 1 . 2]" 1
2158 1 17 VAL H 1 115 GLU HB3 5.180 . 5.960 2.910 2.492 3.767 . 0 0 "[ . 1 . 2]" 1
2159 1 78 TYR HA 1 117 ILE MG 3.890 . 4.470 2.961 2.639 3.187 . 0 0 "[ . 1 . 2]" 1
2160 1 78 TYR HA 1 117 ILE MD 5.490 . 6.310 5.749 5.273 6.096 . 0 0 "[ . 1 . 2]" 1
2161 1 15 SER HB2 1 17 VAL MG2 4.580 . 5.270 3.306 1.993 4.722 . 0 0 "[ . 1 . 2]" 1
2162 1 15 SER HB3 1 17 VAL MG2 4.580 . 5.270 3.213 1.847 4.613 . 0 0 "[ . 1 . 2]" 1
2163 1 20 PHE HB2 1 21 LEU HG 5.170 . 5.950 4.908 4.703 5.214 . 0 0 "[ . 1 . 2]" 1
2164 1 20 PHE HB2 1 21 LEU MD2 5.550 . 6.380 5.152 4.983 5.270 . 0 0 "[ . 1 . 2]" 1
2165 1 24 LEU HA 1 37 ILE MD 5.110 . 5.880 4.237 3.975 4.442 . 0 0 "[ . 1 . 2]" 1
2166 1 27 LEU HA 1 37 ILE MD 5.690 . 6.540 4.977 4.688 5.383 . 0 0 "[ . 1 . 2]" 1
2167 1 28 VAL HB 1 39 TRP HD1 4.960 . 5.700 4.292 3.651 4.970 . 0 0 "[ . 1 . 2]" 1
2168 1 36 LEU HB3 1 49 PHE H 5.360 . 6.160 3.675 2.984 4.092 . 0 0 "[ . 1 . 2]" 1
2169 1 39 TRP HB2 1 43 GLY HA3 5.560 . 6.390 4.529 3.445 5.319 . 0 0 "[ . 1 . 2]" 1
2170 1 39 TRP HB2 1 43 GLY HA2 5.560 . 6.390 3.030 2.029 4.329 . 0 0 "[ . 1 . 2]" 1
2171 1 48 VAL MG1 1 51 GLN HE22 5.100 . 5.870 4.385 3.058 5.457 . 0 0 "[ . 1 . 2]" 1
2172 1 50 ASP HB2 1 53 GLN H 4.490 . 5.160 4.064 3.628 4.837 . 0 0 "[ . 1 . 2]" 1
2173 1 36 LEU MD1 1 57 GLU HG3 4.900 . 5.640 3.138 2.776 3.664 . 0 0 "[ . 1 . 2]" 1
2174 1 58 VAL HA 1 61 LYS HD3 4.620 . 5.310 3.260 2.710 3.746 . 0 0 "[ . 1 . 2]" 1
2175 1 62 TYR HB3 1 63 PHE QD 4.550 . 5.230 4.031 3.646 4.197 . 0 0 "[ . 1 . 2]" 1
2176 1 63 PHE HB3 1 65 HIS HD2 3.990 . 4.590 2.489 2.147 2.732 . 0 0 "[ . 1 . 2]" 1
2177 1 55 ALA MB 1 68 MET HA 4.860 . 5.590 3.268 2.600 3.818 . 0 0 "[ . 1 . 2]" 1
2178 1 72 VAL HA 1 75 LEU MD2 4.760 . 5.470 4.706 4.292 5.075 . 0 0 "[ . 1 . 2]" 1
2179 1 72 VAL HA 1 75 LEU MD1 3.530 . 4.060 2.257 1.795 2.924 0.005 5 0 "[ . 1 . 2]" 1
2180 1 72 VAL MG2 1 75 LEU MD2 5.300 . 6.100 5.557 5.020 5.991 . 0 0 "[ . 1 . 2]" 1
2181 1 72 VAL MG2 1 75 LEU MD1 3.480 . 4.000 3.242 2.647 3.884 . 0 0 "[ . 1 . 2]" 1
2182 1 72 VAL MG1 1 75 LEU MD1 3.860 . 4.440 3.569 3.041 4.200 . 0 0 "[ . 1 . 2]" 1
2183 1 72 VAL MG1 1 75 LEU MD2 5.260 . 6.050 5.517 5.158 5.955 . 0 0 "[ . 1 . 2]" 1
2184 1 73 ARG HD2 1 77 MET HG3 6.000 . 6.900 5.834 5.183 6.679 . 0 0 "[ . 1 . 2]" 1
2185 1 73 ARG HD3 1 77 MET HG3 6.000 . 6.900 5.601 4.906 6.307 . 0 0 "[ . 1 . 2]" 1
2186 1 75 LEU HA 1 80 PHE HB2 5.220 . 6.000 3.379 3.033 3.615 . 0 0 "[ . 1 . 2]" 1
2187 1 75 LEU HA 1 80 PHE HB3 5.170 . 5.950 4.935 4.611 5.190 . 0 0 "[ . 1 . 2]" 1
2188 1 73 ARG HG3 1 77 MET HG2 5.290 . 6.080 5.084 4.257 5.594 . 0 0 "[ . 1 . 2]" 1
2189 1 73 ARG HG2 1 77 MET HG2 5.220 . 6.000 4.630 4.116 4.963 . 0 0 "[ . 1 . 2]" 1
2190 1 73 ARG HG2 1 77 MET HG3 4.740 . 5.450 3.325 2.877 3.698 . 0 0 "[ . 1 . 2]" 1
2191 1 78 TYR HB3 1 119 ARG HA 5.750 . 6.610 5.018 4.475 5.714 . 0 0 "[ . 1 . 2]" 1
2192 1 77 MET HB2 1 78 TYR QD 5.750 . 6.610 4.179 3.694 4.700 . 0 0 "[ . 1 . 2]" 1
2193 1 83 VAL HB 1 100 GLU H 4.630 . 5.320 3.306 2.558 4.034 . 0 0 "[ . 1 . 2]" 1
2194 1 83 VAL MG1 1 102 GLN HE22 4.550 . 5.230 4.599 4.083 5.279 0.049 6 0 "[ . 1 . 2]" 1
2195 1 83 VAL MG2 1 102 GLN HE22 4.140 . 4.760 2.998 2.490 3.611 . 0 0 "[ . 1 . 2]" 1
2196 1 87 GLU HB3 1 91 LEU MD2 4.920 . 5.660 5.116 3.854 5.707 0.047 19 0 "[ . 1 . 2]" 1
2197 1 83 VAL H 1 99 THR MG 4.530 . 5.210 3.339 2.273 4.473 . 0 0 "[ . 1 . 2]" 1
2198 1 51 GLN HE21 1 99 THR MG 4.830 . 5.550 3.327 1.920 5.293 . 0 0 "[ . 1 . 2]" 1
2199 1 75 LEU HB3 1 101 PHE QE 5.100 . 5.870 4.243 3.938 4.907 . 0 0 "[ . 1 . 2]" 1
2200 1 75 LEU HB3 1 101 PHE QD 5.340 . 6.140 3.552 3.192 4.009 . 0 0 "[ . 1 . 2]" 1
2201 1 45 SER HB2 1 102 GLN HB2 4.670 . 5.370 4.059 3.802 4.398 . 0 0 "[ . 1 . 2]" 1
2202 1 45 SER HB2 1 102 GLN HG2 5.410 . 6.220 5.029 4.360 5.458 . 0 0 "[ . 1 . 2]" 1
2203 1 45 SER HB3 1 102 GLN HG2 5.410 . 6.220 4.765 4.273 5.286 . 0 0 "[ . 1 . 2]" 1
2204 1 81 ARG H 1 102 GLN HG3 4.890 . 5.620 3.246 2.805 3.656 . 0 0 "[ . 1 . 2]" 1
2205 1 113 LEU MD2 1 116 ASN HB3 5.190 . 5.970 4.075 3.147 4.723 . 0 0 "[ . 1 . 2]" 1
2206 1 113 LEU MD2 1 116 ASN HB2 5.190 . 5.970 3.320 2.588 3.928 . 0 0 "[ . 1 . 2]" 1
2207 1 78 TYR QD 1 119 ARG HB3 4.500 . 5.180 3.261 2.607 3.720 . 0 0 "[ . 1 . 2]" 1
2208 1 78 TYR QD 1 119 ARG HB2 4.900 . 5.640 4.553 4.226 4.877 . 0 0 "[ . 1 . 2]" 1
2209 1 77 MET HB2 1 119 ARG HB3 4.160 . 4.780 3.710 3.070 4.328 . 0 0 "[ . 1 . 2]" 1
2210 1 77 MET ME 1 119 ARG HB2 4.550 . 5.230 2.652 2.062 3.401 . 0 0 "[ . 1 . 2]" 1
2211 1 18 PRO HB2 1 20 PHE HB2 4.960 . 5.700 4.420 3.709 4.945 . 0 0 "[ . 1 . 2]" 1
2212 1 18 PRO HB2 1 20 PHE HB3 4.280 . 4.920 3.140 2.523 3.656 . 0 0 "[ . 1 . 2]" 1
2213 1 18 PRO HB3 1 20 PHE HB3 4.600 . 5.290 4.119 3.631 5.285 . 0 0 "[ . 1 . 2]" 1
2214 1 18 PRO HB3 1 21 LEU HG 4.660 . 5.360 4.453 3.847 5.387 0.027 6 0 "[ . 1 . 2]" 1
2215 1 18 PRO HB2 1 21 LEU HB2 4.160 . 4.780 3.373 2.697 4.841 0.061 1 0 "[ . 1 . 2]" 1
2216 1 21 LEU HG 1 114 LEU HB3 5.620 . 6.460 4.860 4.375 5.590 . 0 0 "[ . 1 . 2]" 1
2217 1 21 LEU HB2 1 114 LEU HB3 4.770 . 5.490 3.140 2.779 3.821 . 0 0 "[ . 1 . 2]" 1
2218 1 23 LYS HE3 1 62 TYR QD 4.330 . 4.980 3.797 2.151 5.052 0.072 19 0 "[ . 1 . 2]" 1
2219 1 23 LYS HE2 1 62 TYR QD 4.330 . 4.980 3.124 2.394 3.849 . 0 0 "[ . 1 . 2]" 1
2220 1 23 LYS HE2 1 62 TYR QE 5.420 . 6.230 4.388 3.616 5.049 . 0 0 "[ . 1 . 2]" 1
2221 1 23 LYS HE3 1 62 TYR QE 5.420 . 6.230 5.038 3.006 6.253 0.023 6 0 "[ . 1 . 2]" 1
2222 1 24 LEU MD1 1 28 VAL MG1 5.120 . 5.890 4.679 4.412 5.007 . 0 0 "[ . 1 . 2]" 1
2223 1 27 LEU HB3 1 37 ILE MG 4.730 . 5.440 4.148 3.910 4.442 . 0 0 "[ . 1 . 2]" 1
2224 1 28 VAL MG2 1 37 ILE HA 4.950 . 5.690 5.134 4.854 5.446 . 0 0 "[ . 1 . 2]" 1
2225 1 39 TRP HB3 1 46 PHE HB2 5.670 . 6.520 4.585 3.768 5.899 . 0 0 "[ . 1 . 2]" 1
2226 1 29 SER HA 1 39 TRP HB3 6.000 . 6.900 5.147 4.276 6.339 . 0 0 "[ . 1 . 2]" 1
2227 1 45 SER HA 1 46 PHE QD 5.290 . 6.080 3.331 3.115 3.614 . 0 0 "[ . 1 . 2]" 1
2228 1 45 SER HB3 1 102 GLN HB2 4.670 . 5.370 2.823 2.555 3.389 . 0 0 "[ . 1 . 2]" 1
2229 1 27 LEU MD2 1 54 PHE QD 4.520 . 5.200 4.535 4.267 4.941 . 0 0 "[ . 1 . 2]" 1
2230 1 54 PHE QE 1 59 LEU HG 5.430 . 6.240 3.294 3.081 3.589 . 0 0 "[ . 1 . 2]" 1
2231 1 54 PHE HZ 1 59 LEU MD1 5.750 . 6.610 4.920 4.060 5.345 . 0 0 "[ . 1 . 2]" 1
2232 1 57 GLU HA 1 60 PRO HG2 5.190 . 5.970 2.866 2.458 3.168 . 0 0 "[ . 1 . 2]" 1
2233 1 57 GLU HA 1 60 PRO HG3 5.490 . 6.310 3.499 2.993 3.887 . 0 0 "[ . 1 . 2]" 1
2234 1 51 GLN HG2 1 68 MET ME 4.360 . 5.010 2.950 1.784 4.804 0.016 2 0 "[ . 1 . 2]" 1
2235 1 51 GLN HB3 1 68 MET ME 3.280 . 3.770 2.982 1.948 3.791 0.021 15 0 "[ . 1 . 2]" 1
2236 1 51 GLN HB3 1 68 MET HG3 5.250 . 6.040 4.219 3.302 5.100 . 0 0 "[ . 1 . 2]" 1
2237 1 68 MET HA 1 71 PHE QD 4.490 . 5.160 4.118 3.783 4.446 . 0 0 "[ . 1 . 2]" 1
2238 1 73 ARG HG3 1 74 GLN HA 5.020 . 5.770 5.232 4.771 5.503 . 0 0 "[ . 1 . 2]" 1
2239 1 75 LEU MD2 1 80 PHE QE 4.230 . 4.860 3.230 3.073 3.498 . 0 0 "[ . 1 . 2]" 1
2240 1 82 LYS HB3 1 101 PHE QE 4.800 . 5.520 4.607 3.967 5.289 . 0 0 "[ . 1 . 2]" 1
2241 1 82 LYS HB3 1 101 PHE QD 5.050 . 5.810 5.159 4.531 5.739 . 0 0 "[ . 1 . 2]" 1
2242 1 82 LYS HE2 1 101 PHE QE 5.540 . 6.370 6.102 4.927 6.587 0.217 6 0 "[ . 1 . 2]" 1
2243 1 82 LYS HE3 1 101 PHE QE 5.540 . 6.370 5.274 4.144 6.536 0.166 5 0 "[ . 1 . 2]" 1
2244 1 91 LEU MD1 1 93 LYS HD2 4.770 . 5.490 4.040 2.369 5.363 . 0 0 "[ . 1 . 2]" 1
2245 1 91 LEU MD1 1 93 LYS HD3 4.770 . 5.490 4.074 1.798 5.287 0.002 10 0 "[ . 1 . 2]" 1
2246 1 49 PHE QD 1 96 ARG HB3 5.410 . 6.220 4.727 4.027 5.142 . 0 0 "[ . 1 . 2]" 1
2247 1 114 LEU HA 1 117 ILE HG12 4.960 . 5.700 3.986 3.756 4.366 . 0 0 "[ . 1 . 2]" 1
2248 1 17 VAL MG2 1 114 LEU HA 5.290 . 6.080 4.495 4.083 4.919 . 0 0 "[ . 1 . 2]" 1
2249 1 51 GLN HA 1 55 ALA MB 3.960 . 4.550 4.236 4.013 4.502 . 0 0 "[ . 1 . 2]" 1
2250 1 61 LYS HE2 1 62 TYR QE 5.440 . 6.260 3.233 2.287 4.472 . 0 0 "[ . 1 . 2]" 1
2251 1 61 LYS HE3 1 62 TYR QE 5.440 . 6.260 3.690 1.931 4.491 . 0 0 "[ . 1 . 2]" 1
2252 1 84 VAL MG1 1 99 THR HA 5.210 . 5.990 5.004 3.929 5.632 . 0 0 "[ . 1 . 2]" 1
2253 1 61 LYS HD3 1 62 TYR H 5.450 . 6.270 4.495 4.188 4.899 . 0 0 "[ . 1 . 2]" 1
2254 1 61 LYS HD2 1 62 TYR H 5.450 . 6.270 5.363 5.158 5.632 . 0 0 "[ . 1 . 2]" 1
2255 1 61 LYS HD3 1 62 TYR QE 4.520 . 5.200 2.326 2.010 2.870 . 0 0 "[ . 1 . 2]" 1
2256 1 61 LYS HD2 1 62 TYR QE 4.520 . 5.200 3.978 3.762 4.323 . 0 0 "[ . 1 . 2]" 1
2257 1 103 HIS HE1 1 104 PRO HG3 5.030 . 5.780 5.661 5.374 5.781 0.001 7 0 "[ . 1 . 2]" 1
2258 1 62 TYR HA 1 62 TYR QD 3.310 . 3.810 3.081 2.989 3.126 . 0 0 "[ . 1 . 2]" 1
2259 1 20 PHE HZ 1 71 PHE QD 4.280 . 4.920 2.870 2.171 3.372 . 0 0 "[ . 1 . 2]" 1
2260 1 78 TYR HA 1 78 TYR QD 3.400 . 3.910 2.493 2.312 2.797 . 0 0 "[ . 1 . 2]" 1
2261 1 75 LEU HA 1 78 TYR QD 3.750 . 4.310 2.536 1.860 3.158 . 0 0 "[ . 1 . 2]" 1
2262 1 101 PHE HA 1 101 PHE QD 3.970 . 4.570 2.710 2.517 2.845 . 0 0 "[ . 1 . 2]" 1
2263 1 46 PHE QD 1 101 PHE QD 4.160 . 4.780 3.778 3.404 4.118 . 0 0 "[ . 1 . 2]" 1
2264 1 103 HIS HA 1 103 HIS HD2 3.790 . 4.360 3.134 2.950 3.559 . 0 0 "[ . 1 . 2]" 1
2265 1 103 HIS HB2 1 103 HIS HD2 3.900 . 4.490 2.844 2.718 2.921 . 0 0 "[ . 1 . 2]" 1
2266 1 59 LEU HA 1 63 PHE QD 3.470 . 3.990 2.118 1.877 2.448 . 0 0 "[ . 1 . 2]" 1
2267 1 20 PHE QD 1 78 TYR QE 3.010 . 3.460 2.800 2.361 3.312 . 0 0 "[ . 1 . 2]" 1
2268 1 20 PHE QE 1 78 TYR QE 3.980 . 4.580 3.755 2.981 4.350 . 0 0 "[ . 1 . 2]" 1
2269 1 20 PHE QE 1 71 PHE HA 4.150 . 4.770 2.638 2.338 3.032 . 0 0 "[ . 1 . 2]" 1
2270 1 20 PHE QD 1 74 GLN HG3 3.980 . 4.580 3.169 2.884 3.715 . 0 0 "[ . 1 . 2]" 1
2271 1 20 PHE QD 1 21 LEU HG 3.680 . 4.230 2.706 2.177 3.362 . 0 0 "[ . 1 . 2]" 1
2272 1 20 PHE QD 1 21 LEU MD2 3.100 . 3.570 2.154 1.964 2.378 . 0 0 "[ . 1 . 2]" 1
2273 1 20 PHE QD 1 75 LEU MD2 4.670 . 5.370 3.777 3.320 4.034 . 0 0 "[ . 1 . 2]" 1
2274 1 20 PHE QE 1 74 GLN HB2 4.340 . 4.990 3.126 2.942 3.265 . 0 0 "[ . 1 . 2]" 1
2275 1 20 PHE QE 1 74 GLN HB3 4.550 . 5.230 3.606 3.307 3.845 . 0 0 "[ . 1 . 2]" 1
2276 1 20 PHE QE 1 21 LEU MD2 3.680 . 4.230 2.896 2.601 3.549 . 0 0 "[ . 1 . 2]" 1
2277 1 20 PHE QE 1 24 LEU MD1 4.900 . 5.640 3.884 3.476 4.241 . 0 0 "[ . 1 . 2]" 1
2278 1 20 PHE QE 1 24 LEU MD2 3.960 . 4.550 2.488 2.143 3.096 . 0 0 "[ . 1 . 2]" 1
2279 1 20 PHE HZ 1 74 GLN HB2 4.340 . 4.990 2.890 2.633 3.038 . 0 0 "[ . 1 . 2]" 1
2280 1 20 PHE HZ 1 21 LEU MD2 4.820 . 5.540 4.912 4.599 5.588 0.048 19 0 "[ . 1 . 2]" 1
2281 1 25 TRP HA 1 25 TRP HE3 4.340 . 4.990 3.507 2.057 4.941 . 0 0 "[ . 1 . 2]" 1
2282 1 28 VAL MG1 1 39 TRP HD1 4.120 . 4.740 2.278 1.791 2.882 0.009 14 0 "[ . 1 . 2]" 1
2283 1 29 SER HA 1 39 TRP HD1 3.540 . 4.070 2.659 2.034 3.703 . 0 0 "[ . 1 . 2]" 1
2284 1 39 TRP HA 1 39 TRP HE3 4.570 . 5.260 4.503 3.346 4.699 . 0 0 "[ . 1 . 2]" 1
2285 1 38 CYS HA 1 39 TRP HD1 4.490 . 5.160 3.912 3.433 4.657 . 0 0 "[ . 1 . 2]" 1
2286 1 39 TRP H 1 39 TRP HD1 3.850 . 4.430 2.517 2.007 3.072 . 0 0 "[ . 1 . 2]" 1
2287 1 46 PHE H 1 46 PHE QD 4.150 . 4.770 2.841 2.593 3.014 . 0 0 "[ . 1 . 2]" 1
2288 1 37 ILE MG 1 46 PHE QD 5.350 . 6.150 4.908 4.797 5.008 . 0 0 "[ . 1 . 2]" 1
2289 1 37 ILE MD 1 46 PHE QD 3.640 . 4.190 2.553 2.341 2.885 . 0 0 "[ . 1 . 2]" 1
2290 1 46 PHE QD 1 48 VAL MG2 3.900 . 4.490 2.569 2.313 2.788 . 0 0 "[ . 1 . 2]" 1
2291 1 24 LEU HG 1 46 PHE HZ 4.380 . 5.040 4.333 4.031 4.729 . 0 0 "[ . 1 . 2]" 1
2292 1 37 ILE MD 1 46 PHE HZ 5.010 . 5.760 4.224 3.865 4.481 . 0 0 "[ . 1 . 2]" 1
2293 1 46 PHE HZ 1 48 VAL MG2 5.550 . 6.380 4.395 4.138 4.737 . 0 0 "[ . 1 . 2]" 1
2294 1 24 LEU MD1 1 46 PHE HZ 4.360 . 5.010 2.761 2.430 3.127 . 0 0 "[ . 1 . 2]" 1
2295 1 24 LEU MD2 1 46 PHE HZ 4.020 . 4.620 2.485 2.173 2.808 . 0 0 "[ . 1 . 2]" 1
2296 1 28 VAL MG2 1 46 PHE HZ 4.300 . 4.950 4.398 4.066 4.832 . 0 0 "[ . 1 . 2]" 1
2297 1 49 PHE QD 1 98 ASP HA 5.300 . 6.100 3.901 3.277 4.745 . 0 0 "[ . 1 . 2]" 1
2298 1 49 PHE QE 1 98 ASP HA 4.740 . 5.450 4.389 3.268 5.357 . 0 0 "[ . 1 . 2]" 1
2299 1 49 PHE HA 1 49 PHE QE 4.520 . 5.200 4.634 4.490 4.734 . 0 0 "[ . 1 . 2]" 1
2300 1 49 PHE QE 1 96 ARG HD2 4.680 . 5.380 3.800 2.939 4.995 . 0 0 "[ . 1 . 2]" 1
2301 1 49 PHE QE 1 96 ARG HD3 4.680 . 5.380 4.313 3.307 5.090 . 0 0 "[ . 1 . 2]" 1
2302 1 49 PHE QD 1 96 ARG HB2 4.170 . 4.800 3.585 2.422 4.417 . 0 0 "[ . 1 . 2]" 1
2303 1 49 PHE HZ 1 96 ARG HD2 6.000 . 6.900 5.868 5.087 6.960 0.060 19 0 "[ . 1 . 2]" 1
2304 1 49 PHE HZ 1 96 ARG HD3 6.000 . 6.900 6.323 5.226 7.011 0.111 17 0 "[ . 1 . 2]" 1
2305 1 36 LEU HB2 1 54 PHE QD 4.330 . 4.980 2.742 2.532 3.077 . 0 0 "[ . 1 . 2]" 1
2306 1 37 ILE MD 1 46 PHE QE 3.280 . 3.770 2.645 2.321 2.926 . 0 0 "[ . 1 . 2]" 1
2307 1 37 ILE MD 1 54 PHE QE 3.430 . 3.940 2.475 2.254 2.832 . 0 0 "[ . 1 . 2]" 1
2308 1 27 LEU MD2 1 54 PHE QE 3.350 . 3.850 2.815 2.402 3.244 . 0 0 "[ . 1 . 2]" 1
2309 1 48 VAL MG1 1 54 PHE QE 3.910 . 4.500 3.065 2.884 3.216 . 0 0 "[ . 1 . 2]" 1
2310 1 23 LYS HA 1 62 TYR QD 3.970 . 4.570 3.013 2.533 3.469 . 0 0 "[ . 1 . 2]" 1
2311 1 27 LEU HA 1 62 TYR QD 4.240 . 4.880 4.094 3.777 4.389 . 0 0 "[ . 1 . 2]" 1
2312 1 62 TYR H 1 62 TYR QD 3.300 . 3.800 2.424 2.183 2.728 . 0 0 "[ . 1 . 2]" 1
2313 1 62 TYR QD 1 63 PHE H 4.230 . 4.860 4.328 4.076 4.631 . 0 0 "[ . 1 . 2]" 1
2314 1 58 VAL HA 1 62 TYR QE 4.230 . 4.860 4.591 3.524 5.044 0.184 3 0 "[ . 1 . 2]" 1
2315 1 30 ASP HB3 1 62 TYR QE 4.620 . 5.310 4.181 3.788 4.515 . 0 0 "[ . 1 . 2]" 1
2316 1 61 LYS HB3 1 62 TYR QD 3.110 . 3.580 2.411 2.186 2.559 . 0 0 "[ . 1 . 2]" 1
2317 1 23 LYS HB3 1 62 TYR QD 4.180 . 4.810 2.614 1.918 3.332 . 0 0 "[ . 1 . 2]" 1
2318 1 33 THR MG 1 62 TYR QD 4.590 . 5.280 3.615 3.317 3.902 . 0 0 "[ . 1 . 2]" 1
2319 1 58 VAL MG2 1 62 TYR QD 5.030 . 5.780 4.940 4.182 5.330 . 0 0 "[ . 1 . 2]" 1
2320 1 58 VAL MG1 1 62 TYR QD 2.980 . 3.430 3.128 2.417 3.492 0.062 10 0 "[ . 1 . 2]" 1
2321 1 27 LEU MD2 1 62 TYR QD 3.680 . 4.230 3.522 3.228 3.720 . 0 0 "[ . 1 . 2]" 1
2322 1 61 LYS HB2 1 62 TYR QE 4.590 . 5.280 4.939 4.483 5.118 . 0 0 "[ . 1 . 2]" 1
2323 1 61 LYS HB3 1 62 TYR QE 3.420 . 3.930 3.788 3.253 4.005 0.075 7 0 "[ . 1 . 2]" 1
2324 1 26 THR MG 1 62 TYR QE 3.930 . 4.520 2.260 1.813 3.191 . 0 0 "[ . 1 . 2]" 1
2325 1 27 LEU HG 1 62 TYR QE 5.010 . 5.760 5.245 5.066 5.381 . 0 0 "[ . 1 . 2]" 1
2326 1 33 THR MG 1 62 TYR QE 3.780 . 4.350 2.325 1.734 3.070 0.066 9 0 "[ . 1 . 2]" 1
2327 1 37 ILE MG 1 62 TYR QE 5.090 . 5.850 5.218 5.004 5.588 . 0 0 "[ . 1 . 2]" 1
2328 1 58 VAL MG2 1 62 TYR QE 5.350 . 6.150 4.883 3.622 5.464 . 0 0 "[ . 1 . 2]" 1
2329 1 58 VAL MG1 1 62 TYR QE 3.410 . 3.920 3.628 2.772 4.047 0.127 12 0 "[ . 1 . 2]" 1
2330 1 27 LEU MD2 1 62 TYR QE 5.040 . 5.800 4.445 4.160 4.715 . 0 0 "[ . 1 . 2]" 1
2331 1 62 TYR HB2 1 63 PHE QD 4.290 . 4.930 3.310 2.885 3.808 . 0 0 "[ . 1 . 2]" 1
2332 1 59 LEU HB2 1 63 PHE QD 4.900 . 5.640 4.597 4.349 4.978 . 0 0 "[ . 1 . 2]" 1
2333 1 19 ALA MB 1 63 PHE QD 5.150 . 5.920 5.044 4.642 5.503 . 0 0 "[ . 1 . 2]" 1
2334 1 59 LEU HB3 1 63 PHE QD 4.490 . 5.160 3.365 2.905 3.763 . 0 0 "[ . 1 . 2]" 1
2335 1 59 LEU MD1 1 63 PHE QD 4.790 . 5.510 4.262 3.990 4.576 . 0 0 "[ . 1 . 2]" 1
2336 1 63 PHE QD 1 65 HIS HD2 3.950 . 4.540 4.355 3.956 4.613 0.073 8 0 "[ . 1 . 2]" 1
2337 1 63 PHE HA 1 63 PHE QE 4.910 . 5.650 4.713 4.641 4.823 . 0 0 "[ . 1 . 2]" 1
2338 1 63 PHE HZ 1 71 PHE HZ 4.750 . 5.460 4.817 4.419 5.223 . 0 0 "[ . 1 . 2]" 1
2339 1 24 LEU HA 1 63 PHE HZ 3.730 . 4.290 2.804 2.106 3.612 . 0 0 "[ . 1 . 2]" 1
2340 1 23 LYS HB2 1 63 PHE HZ 4.390 . 5.050 3.643 3.078 4.201 . 0 0 "[ . 1 . 2]" 1
2341 1 24 LEU HB2 1 63 PHE HZ 4.630 . 5.320 2.561 2.131 3.192 . 0 0 "[ . 1 . 2]" 1
2342 1 23 LYS HB3 1 63 PHE HZ 4.870 . 5.600 4.179 3.582 5.012 . 0 0 "[ . 1 . 2]" 1
2343 1 24 LEU HB3 1 63 PHE HZ 4.630 . 5.320 4.158 3.766 4.695 . 0 0 "[ . 1 . 2]" 1
2344 1 24 LEU MD1 1 63 PHE HZ 3.370 . 3.880 3.015 2.394 3.927 0.047 18 0 "[ . 1 . 2]" 1
2345 1 23 LYS HB3 1 63 PHE QE 4.800 . 5.520 3.733 3.415 4.612 . 0 0 "[ . 1 . 2]" 1
2346 1 58 VAL MG1 1 63 PHE QE 4.240 . 4.880 4.053 3.381 4.685 . 0 0 "[ . 1 . 2]" 1
2347 1 59 LEU MD2 1 63 PHE HZ 4.150 . 4.770 4.417 4.142 4.603 . 0 0 "[ . 1 . 2]" 1
2348 1 24 LEU MD2 1 63 PHE HZ 4.320 . 4.970 4.255 3.758 4.973 0.003 18 0 "[ . 1 . 2]" 1
2349 1 59 LEU MD2 1 63 PHE QD 3.170 . 3.650 2.225 2.125 2.422 . 0 0 "[ . 1 . 2]" 1
2350 1 59 LEU MD2 1 63 PHE QE 3.670 . 4.220 2.609 2.202 2.921 . 0 0 "[ . 1 . 2]" 1
2351 1 71 PHE H 1 71 PHE QD 4.190 . 4.820 4.211 4.184 4.243 . 0 0 "[ . 1 . 2]" 1
2352 1 68 MET ME 1 71 PHE QD 3.580 . 4.120 2.373 1.922 3.037 . 0 0 "[ . 1 . 2]" 1
2353 1 71 PHE QD 1 72 VAL MG1 4.370 . 5.030 4.806 4.494 5.089 0.059 4 0 "[ . 1 . 2]" 1
2354 1 59 LEU MD1 1 71 PHE QD 3.870 . 4.450 3.444 3.198 3.641 . 0 0 "[ . 1 . 2]" 1
2355 1 71 PHE QD 1 74 GLN HG3 5.320 . 6.120 5.001 4.480 5.407 . 0 0 "[ . 1 . 2]" 1
2356 1 24 LEU MD1 1 71 PHE QD 4.720 . 5.430 4.192 4.001 4.443 . 0 0 "[ . 1 . 2]" 1
2357 1 59 LEU MD2 1 71 PHE QD 3.730 . 4.290 2.675 2.441 2.893 . 0 0 "[ . 1 . 2]" 1
2358 1 71 PHE QD 1 75 LEU MD1 4.710 . 5.420 3.253 3.016 3.453 . 0 0 "[ . 1 . 2]" 1
2359 1 24 LEU MD2 1 71 PHE HZ 3.710 . 4.270 3.894 3.389 4.262 . 0 0 "[ . 1 . 2]" 1
2360 1 71 PHE HZ 1 75 LEU MD2 3.430 . 3.940 3.941 3.545 4.152 0.212 14 0 "[ . 1 . 2]" 1
2361 1 71 PHE HZ 1 75 LEU MD1 3.520 . 4.050 2.941 2.723 3.184 . 0 0 "[ . 1 . 2]" 1
2362 1 77 MET ME 1 78 TYR QD 4.670 . 5.370 4.409 3.835 4.980 . 0 0 "[ . 1 . 2]" 1
2363 1 74 GLN HB2 1 78 TYR QD 4.420 . 5.080 3.747 3.429 4.059 . 0 0 "[ . 1 . 2]" 1
2364 1 21 LEU MD2 1 78 TYR QD 4.080 . 4.690 3.162 2.787 3.483 . 0 0 "[ . 1 . 2]" 1
2365 1 75 LEU HA 1 78 TYR QE 5.250 . 6.040 4.768 4.018 5.364 . 0 0 "[ . 1 . 2]" 1
2366 1 18 PRO HD3 1 78 TYR QE 6.000 . 6.900 4.710 4.174 5.315 . 0 0 "[ . 1 . 2]" 1
2367 1 21 LEU HA 1 78 TYR QE 6.000 . 6.900 5.518 5.070 6.053 . 0 0 "[ . 1 . 2]" 1
2368 1 74 GLN HB2 1 78 TYR QE 3.680 . 4.230 3.806 3.280 4.256 0.026 20 0 "[ . 1 . 2]" 1
2369 1 78 TYR QE 1 117 ILE MG 4.080 . 4.690 3.899 3.695 4.281 . 0 0 "[ . 1 . 2]" 1
2370 1 21 LEU MD2 1 78 TYR QE 3.900 . 4.490 3.532 2.926 4.171 . 0 0 "[ . 1 . 2]" 1
2371 1 78 TYR HB2 1 80 PHE QD 4.180 . 4.810 2.265 1.883 2.504 . 0 0 "[ . 1 . 2]" 1
2372 1 80 PHE QD 1 101 PHE HB3 4.230 . 4.860 2.264 1.908 2.707 . 0 0 "[ . 1 . 2]" 1
2373 1 78 TYR HB3 1 80 PHE QD 4.470 . 5.140 2.644 2.370 3.078 . 0 0 "[ . 1 . 2]" 1
2374 1 80 PHE QE 1 106 PHE HB2 4.320 . 4.970 3.249 2.790 3.709 . 0 0 "[ . 1 . 2]" 1
2375 1 80 PHE QD 1 103 HIS HD2 5.020 . 5.770 4.127 2.990 5.000 . 0 0 "[ . 1 . 2]" 1
2376 1 46 PHE QE 1 101 PHE QD 4.010 . 4.610 2.606 2.328 2.847 . 0 0 "[ . 1 . 2]" 1
2377 1 46 PHE QE 1 101 PHE QE 5.180 . 5.960 3.957 3.730 4.322 . 0 0 "[ . 1 . 2]" 1
2378 1 71 PHE QE 1 101 PHE QE 5.350 . 6.150 2.849 2.179 3.574 . 0 0 "[ . 1 . 2]" 1
2379 1 82 LYS HA 1 101 PHE QD 4.180 . 4.810 3.145 2.620 3.591 . 0 0 "[ . 1 . 2]" 1
2380 1 48 VAL HB 1 101 PHE QD 5.420 . 6.230 4.340 3.853 4.745 . 0 0 "[ . 1 . 2]" 1
2381 1 82 LYS HB2 1 101 PHE QD 5.050 . 5.810 3.820 2.959 4.567 . 0 0 "[ . 1 . 2]" 1
2382 1 48 VAL MG2 1 101 PHE QD 3.660 . 4.210 2.571 2.249 3.009 . 0 0 "[ . 1 . 2]" 1
2383 1 99 THR MG 1 101 PHE QD 3.970 . 4.570 3.333 3.100 3.712 . 0 0 "[ . 1 . 2]" 1
2384 1 82 LYS HB2 1 101 PHE QE 4.800 . 5.520 2.943 2.409 3.622 . 0 0 "[ . 1 . 2]" 1
2385 1 75 LEU MD2 1 101 PHE QD 4.430 . 5.090 4.169 3.626 4.625 . 0 0 "[ . 1 . 2]" 1
2386 1 75 LEU MD1 1 101 PHE QD 4.040 . 4.650 2.890 2.755 3.099 . 0 0 "[ . 1 . 2]" 1
2387 1 82 LYS H 1 101 PHE QD 4.470 . 5.140 4.076 3.626 4.625 . 0 0 "[ . 1 . 2]" 1
2388 1 20 PHE QE 1 71 PHE QD 3.400 . 3.910 2.274 1.929 2.782 . 0 0 "[ . 1 . 2]" 1
2389 1 20 PHE QE 1 71 PHE QE 3.480 . 4.000 3.506 3.133 3.771 . 0 0 "[ . 1 . 2]" 1
2390 1 20 PHE QD 1 63 PHE QD 4.300 . 4.950 3.255 2.814 3.780 . 0 0 "[ . 1 . 2]" 1
2391 1 20 PHE QE 1 63 PHE QD 5.010 . 5.760 4.272 3.863 4.834 . 0 0 "[ . 1 . 2]" 1
2392 1 20 PHE QE 1 74 GLN H 5.260 . 6.050 4.907 4.702 5.069 . 0 0 "[ . 1 . 2]" 1
2393 1 75 LEU HB3 1 80 PHE QD 4.300 . 4.950 3.432 3.076 3.644 . 0 0 "[ . 1 . 2]" 1
2394 1 27 LEU HG 1 54 PHE QE 4.520 . 5.200 3.677 3.222 4.021 . 0 0 "[ . 1 . 2]" 1
2395 1 54 PHE HZ 1 59 LEU MD2 3.990 . 4.590 3.062 2.568 3.420 . 0 0 "[ . 1 . 2]" 1
2396 1 24 LEU MD2 1 46 PHE QE 3.900 . 4.490 2.767 2.470 3.103 . 0 0 "[ . 1 . 2]" 1
2397 1 24 LEU MD2 1 71 PHE QE 4.440 . 5.110 3.721 3.234 4.114 . 0 0 "[ . 1 . 2]" 1
2398 1 71 PHE QE 1 75 LEU MD1 3.480 . 4.000 2.710 2.465 2.824 . 0 0 "[ . 1 . 2]" 1
2399 1 65 HIS HE1 1 71 PHE QD 4.160 . 4.780 3.738 3.311 4.294 . 0 0 "[ . 1 . 2]" 1
2400 1 65 HIS HE1 1 66 ASN HA 5.690 . 6.540 5.610 5.352 5.949 . 0 0 "[ . 1 . 2]" 1
2401 1 65 HIS HE1 1 68 MET HA 4.380 . 5.040 4.063 3.467 4.994 . 0 0 "[ . 1 . 2]" 1
2402 1 65 HIS HE1 1 71 PHE HA 4.060 . 4.670 3.186 2.524 3.869 . 0 0 "[ . 1 . 2]" 1
2403 1 65 HIS HE1 1 70 SER HB3 3.440 . 3.960 3.026 2.446 3.408 . 0 0 "[ . 1 . 2]" 1
2404 1 65 HIS HE1 1 67 ASN HB3 4.560 . 5.240 4.944 4.322 5.379 0.139 15 0 "[ . 1 . 2]" 1
2405 1 59 LEU HB2 1 65 HIS HE1 5.560 . 6.390 5.041 4.586 5.479 . 0 0 "[ . 1 . 2]" 1
2406 1 59 LEU HB3 1 65 HIS HE1 4.410 . 5.070 3.694 3.192 4.101 . 0 0 "[ . 1 . 2]" 1
2407 1 59 LEU MD1 1 65 HIS HE1 2.880 . 3.310 2.335 2.071 2.701 . 0 0 "[ . 1 . 2]" 1
2408 1 59 LEU MD2 1 65 HIS HE1 3.400 . 3.910 3.218 2.772 3.884 . 0 0 "[ . 1 . 2]" 1
2409 1 103 HIS HE1 1 105 CYS HA 5.120 . 5.890 4.885 4.436 5.211 . 0 0 "[ . 1 . 2]" 1
2410 1 103 HIS HE1 1 105 CYS HB2 3.580 . 4.120 2.129 1.721 3.340 0.079 18 0 "[ . 1 . 2]" 1
2411 1 103 HIS HE1 1 104 PRO HD3 5.320 . 6.120 5.919 5.677 5.984 . 0 0 "[ . 1 . 2]" 1
2412 1 103 HIS HE1 1 105 CYS HB3 3.840 . 4.420 3.580 2.376 3.782 . 0 0 "[ . 1 . 2]" 1
2413 1 103 HIS HE1 1 104 PRO HD2 3.640 . 4.190 4.197 4.009 4.277 0.087 12 0 "[ . 1 . 2]" 1
2414 1 103 HIS HB3 1 103 HIS HE1 4.850 . 5.580 4.770 4.745 4.818 . 0 0 "[ . 1 . 2]" 1
2415 1 103 HIS HE1 1 104 PRO HG2 3.580 . 4.120 4.103 3.732 4.211 0.091 7 0 "[ . 1 . 2]" 1
2416 1 103 HIS HE1 1 117 ILE HG13 3.930 . 4.520 3.896 3.683 4.214 . 0 0 "[ . 1 . 2]" 1
2417 1 103 HIS HE1 1 117 ILE MG 3.580 . 4.120 2.882 2.544 3.265 . 0 0 "[ . 1 . 2]" 1
2418 1 103 HIS HE1 1 117 ILE MD 3.530 . 4.060 3.567 2.832 4.038 . 0 0 "[ . 1 . 2]" 1
2419 1 103 HIS HE1 1 117 ILE HG12 3.500 . 4.030 2.276 1.986 2.515 . 0 0 "[ . 1 . 2]" 1
2420 1 103 HIS HE1 1 105 CYS H 3.530 . 4.060 3.273 2.718 3.499 . 0 0 "[ . 1 . 2]" 1
2421 1 63 PHE HB2 1 65 HIS HD2 3.990 . 4.590 3.216 2.376 3.694 . 0 0 "[ . 1 . 2]" 1
2422 1 65 HIS H 1 65 HIS HD2 4.400 . 5.060 3.349 2.840 3.633 . 0 0 "[ . 1 . 2]" 1
2423 1 47 HIS HE1 1 85 HIS HE1 4.500 . 5.180 3.686 2.740 4.725 . 0 0 "[ . 1 . 2]" 1
2424 1 47 HIS HE1 1 85 HIS HD2 4.200 . 4.830 3.817 2.945 4.830 0.000 8 0 "[ . 1 . 2]" 1
2425 1 47 HIS HE1 1 100 GLU HB3 4.610 . 5.300 4.509 4.104 5.113 . 0 0 "[ . 1 . 2]" 1
2426 1 47 HIS HE1 1 100 GLU HG3 4.660 . 5.360 4.595 4.088 5.173 . 0 0 "[ . 1 . 2]" 1
2427 1 47 HIS HE1 1 100 GLU HB2 4.080 . 4.690 3.302 3.032 3.628 . 0 0 "[ . 1 . 2]" 1
2428 1 83 VAL HB 1 85 HIS HE1 4.860 . 5.590 5.090 3.153 5.618 0.028 3 0 "[ . 1 . 2]" 1
2429 1 83 VAL MG1 1 85 HIS HE1 3.820 . 4.390 3.417 2.786 3.968 . 0 0 "[ . 1 . 2]" 1
2430 1 80 PHE HZ 1 106 PHE QD 4.190 . 4.820 2.699 2.132 3.943 . 0 0 "[ . 1 . 2]" 1
2431 1 80 PHE QE 1 106 PHE QD 4.510 . 5.190 3.219 3.048 3.441 . 0 0 "[ . 1 . 2]" 1
2432 1 79 GLY HA2 1 103 HIS HD2 4.960 . 5.700 4.246 3.813 4.922 . 0 0 "[ . 1 . 2]" 1
2433 1 79 GLY HA3 1 103 HIS HD2 4.960 . 5.700 3.118 2.475 4.039 . 0 0 "[ . 1 . 2]" 1
2434 1 20 PHE QD 1 21 LEU HA 3.870 . 4.450 3.189 2.878 3.502 . 0 0 "[ . 1 . 2]" 1
2435 1 78 TYR QD 1 117 ILE HB 4.430 . 5.090 3.736 3.319 4.340 . 0 0 "[ . 1 . 2]" 1
2436 1 37 ILE MG 1 54 PHE HZ 4.150 . 4.770 3.746 3.341 4.052 . 0 0 "[ . 1 . 2]" 1
2437 1 37 ILE MD 1 54 PHE HZ 3.140 . 3.610 2.482 2.157 2.845 . 0 0 "[ . 1 . 2]" 1
2438 1 24 LEU MD1 1 71 PHE HZ 3.720 . 4.280 2.214 1.944 2.361 . 0 0 "[ . 1 . 2]" 1
2439 1 27 LEU MD2 1 54 PHE HZ 3.920 . 4.510 2.587 2.078 3.181 . 0 0 "[ . 1 . 2]" 1
2440 1 48 VAL MG1 1 54 PHE HZ 4.140 . 4.760 3.686 3.413 3.931 . 0 0 "[ . 1 . 2]" 1
2441 1 54 PHE HZ 1 58 VAL MG1 3.730 . 4.290 3.468 2.968 3.930 . 0 0 "[ . 1 . 2]" 1
2442 1 10 HIS HA 1 10 HIS QB 2.610 . 3.000 2.322 2.174 2.481 . 0 0 "[ . 1 . 2]" 1
2443 1 11 MET H 1 11 MET QG 4.650 . 5.350 2.820 1.919 4.404 . 0 0 "[ . 1 . 2]" 1
2444 1 11 MET HA 1 11 MET QG 3.460 . 3.980 2.885 2.327 3.560 . 0 0 "[ . 1 . 2]" 1
2445 1 11 MET QB 1 12 ALA H 3.550 . 4.080 2.836 1.865 3.999 . 0 0 "[ . 1 . 2]" 1
2446 1 11 MET ME 1 11 MET QG 3.370 . 3.880 2.387 2.216 2.525 . 0 0 "[ . 1 . 2]" 1
2447 1 13 GLY H 1 14 PRO QD 4.900 . 5.640 3.497 2.387 4.494 . 0 0 "[ . 1 . 2]" 1
2448 1 13 GLY QA 1 14 PRO QG 4.170 . 4.800 3.900 3.619 4.184 . 0 0 "[ . 1 . 2]" 1
2449 1 13 GLY QA 1 14 PRO QD 2.640 . 3.040 2.121 1.935 2.389 . 0 0 "[ . 1 . 2]" 1
2450 1 14 PRO QG 1 15 SER H 4.970 . 5.720 4.429 3.182 4.940 . 0 0 "[ . 1 . 2]" 1
2451 1 15 SER QB 1 16 ASN HA 4.580 . 5.270 4.739 4.460 4.969 . 0 0 "[ . 1 . 2]" 1
2452 1 15 SER QB 1 16 ASN HD21 4.920 . 5.660 4.725 3.944 5.399 . 0 0 "[ . 1 . 2]" 1
2453 1 15 SER QB 1 17 VAL MG1 4.940 . 5.680 4.725 4.193 5.669 . 0 0 "[ . 1 . 2]" 1
2454 1 15 SER QB 1 17 VAL MG2 3.720 . 4.280 2.706 1.832 4.156 . 0 0 "[ . 1 . 2]" 1
2455 1 16 ASN H 1 16 ASN QB 3.410 . 3.920 2.614 2.371 3.348 . 0 0 "[ . 1 . 2]" 1
2456 1 16 ASN QB 1 16 ASN HD21 2.940 . 3.380 2.486 2.191 2.881 . 0 0 "[ . 1 . 2]" 1
2457 1 16 ASN QB 1 16 ASN HD22 3.560 . 4.090 3.389 3.280 3.521 . 0 0 "[ . 1 . 2]" 1
2458 1 16 ASN QB 1 17 VAL H 3.850 . 4.430 3.666 3.125 3.954 . 0 0 "[ . 1 . 2]" 1
2459 1 16 ASN QB 1 17 VAL MG2 4.350 . 5.000 4.391 3.774 4.935 . 0 0 "[ . 1 . 2]" 1
2460 1 16 ASN QB 1 115 GLU HB3 4.790 . 5.510 3.423 2.611 5.555 0.045 14 0 "[ . 1 . 2]" 1
2461 1 18 PRO QG 1 19 ALA H 4.780 . 5.500 4.615 4.246 4.740 . 0 0 "[ . 1 . 2]" 1
2462 1 18 PRO QG 1 21 LEU H 5.190 . 5.970 4.129 2.647 4.710 . 0 0 "[ . 1 . 2]" 1
2463 1 18 PRO QG 1 21 LEU HG 5.050 . 5.810 3.169 2.409 3.831 . 0 0 "[ . 1 . 2]" 1
2464 1 18 PRO QG 1 78 TYR QE 3.890 . 4.470 2.318 1.783 3.398 0.017 14 0 "[ . 1 . 2]" 1
2465 1 20 PHE QE 1 71 PHE QB 3.970 . 4.570 3.830 3.556 4.178 . 0 0 "[ . 1 . 2]" 1
2466 1 21 LEU H 1 24 LEU QB 5.640 . 6.490 4.445 4.346 4.559 . 0 0 "[ . 1 . 2]" 1
2467 1 21 LEU HA 1 24 LEU QB 3.920 . 4.510 2.158 2.022 2.308 . 0 0 "[ . 1 . 2]" 1
2468 1 21 LEU MD2 1 24 LEU QB 3.740 . 4.300 3.031 2.806 3.340 . 0 0 "[ . 1 . 2]" 1
2469 1 22 THR H 1 23 LYS QG 5.420 . 6.230 4.495 4.315 4.835 . 0 0 "[ . 1 . 2]" 1
2470 1 22 THR HA 1 25 TRP QB 3.950 . 4.540 2.977 2.230 4.089 . 0 0 "[ . 1 . 2]" 1
2471 1 22 THR HB 1 23 LYS QG 5.160 . 5.930 4.587 3.124 5.314 . 0 0 "[ . 1 . 2]" 1
2472 1 22 THR MG 1 23 LYS QG 5.070 . 5.830 2.801 2.112 3.826 . 0 0 "[ . 1 . 2]" 1
2473 1 22 THR MG 1 25 TRP QB 5.320 . 6.120 4.921 4.351 6.259 0.139 6 0 "[ . 1 . 2]" 1
2474 1 23 LYS H 1 23 LYS QG 3.880 . 4.460 2.436 2.245 2.629 . 0 0 "[ . 1 . 2]" 1
2475 1 23 LYS H 1 23 LYS QD 5.130 . 5.900 4.347 4.031 4.562 . 0 0 "[ . 1 . 2]" 1
2476 1 23 LYS H 1 23 LYS QE 4.760 . 5.470 3.981 3.329 4.894 . 0 0 "[ . 1 . 2]" 1
2477 1 23 LYS HA 1 23 LYS QG 3.500 . 4.030 2.778 2.408 3.004 . 0 0 "[ . 1 . 2]" 1
2478 1 23 LYS HA 1 23 LYS QD 3.790 . 4.360 3.372 2.936 4.254 . 0 0 "[ . 1 . 2]" 1
2479 1 23 LYS HB2 1 23 LYS QE 3.940 . 4.530 3.785 3.206 3.990 . 0 0 "[ . 1 . 2]" 1
2480 1 23 LYS HB3 1 23 LYS QE 3.790 . 4.360 2.912 2.035 3.314 . 0 0 "[ . 1 . 2]" 1
2481 1 23 LYS QE 1 23 LYS QG 3.190 . 3.670 2.494 2.291 2.833 . 0 0 "[ . 1 . 2]" 1
2482 1 23 LYS QG 1 24 LEU H 4.320 . 4.970 4.113 3.972 4.224 . 0 0 "[ . 1 . 2]" 1
2483 1 23 LYS QG 1 62 TYR HB3 5.120 . 5.890 3.913 3.220 4.795 . 0 0 "[ . 1 . 2]" 1
2484 1 23 LYS QG 1 62 TYR QD 4.570 . 5.260 4.205 3.646 4.722 . 0 0 "[ . 1 . 2]" 1
2485 1 23 LYS QG 1 63 PHE QD 5.470 . 6.290 3.884 3.195 5.576 . 0 0 "[ . 1 . 2]" 1
2486 1 23 LYS QG 1 63 PHE QE 5.230 . 6.010 3.867 3.155 4.961 . 0 0 "[ . 1 . 2]" 1
2487 1 23 LYS QD 1 62 TYR HA 4.260 . 4.900 3.148 2.470 4.686 . 0 0 "[ . 1 . 2]" 1
2488 1 23 LYS QD 1 62 TYR HB2 5.050 . 5.810 4.535 4.038 5.817 0.007 3 0 "[ . 1 . 2]" 1
2489 1 23 LYS QD 1 62 TYR HB3 5.130 . 5.900 3.025 2.570 4.307 . 0 0 "[ . 1 . 2]" 1
2490 1 23 LYS QD 1 62 TYR QD 4.450 . 5.120 3.160 2.271 4.384 . 0 0 "[ . 1 . 2]" 1
2491 1 23 LYS QE 1 62 TYR HA 4.380 . 5.040 4.108 2.521 5.126 0.086 4 0 "[ . 1 . 2]" 1
2492 1 23 LYS QE 1 62 TYR QE 4.640 . 5.340 3.990 2.912 4.476 . 0 0 "[ . 1 . 2]" 1
2493 1 24 LEU H 1 24 LEU QB 3.160 . 3.630 2.239 2.210 2.257 . 0 0 "[ . 1 . 2]" 1
2494 1 24 LEU HA 1 27 LEU QB 3.980 . 4.580 2.286 2.028 2.535 . 0 0 "[ . 1 . 2]" 1
2495 1 24 LEU QB 1 37 ILE MD 5.440 . 6.260 4.930 4.624 5.197 . 0 0 "[ . 1 . 2]" 1
2496 1 24 LEU QB 1 63 PHE QE 4.650 . 5.350 3.461 2.653 4.123 . 0 0 "[ . 1 . 2]" 1
2497 1 24 LEU QB 1 63 PHE HZ 4.040 . 4.650 2.538 2.120 3.142 . 0 0 "[ . 1 . 2]" 1
2498 1 24 LEU MD1 1 27 LEU QB 4.310 . 4.960 2.952 2.729 3.296 . 0 0 "[ . 1 . 2]" 1
2499 1 25 TRP QB 1 114 LEU MD2 4.120 . 4.740 3.209 2.321 3.963 . 0 0 "[ . 1 . 2]" 1
2500 1 26 THR HA 1 29 SER QB 3.210 . 3.690 3.001 2.134 3.830 0.140 13 0 "[ . 1 . 2]" 1
2501 1 27 LEU QB 1 28 VAL H 4.010 . 4.610 2.424 2.324 2.550 . 0 0 "[ . 1 . 2]" 1
2502 1 27 LEU QB 1 37 ILE MG 4.100 . 4.720 3.838 3.679 4.071 . 0 0 "[ . 1 . 2]" 1
2503 1 27 LEU MD1 1 37 ILE QG 4.840 . 5.570 4.404 4.079 4.786 . 0 0 "[ . 1 . 2]" 1
2504 1 27 LEU MD2 1 37 ILE QG 4.890 . 5.620 4.183 4.060 4.432 . 0 0 "[ . 1 . 2]" 1
2505 1 28 VAL HA 1 37 ILE QG 3.410 . 3.920 2.341 2.006 2.720 . 0 0 "[ . 1 . 2]" 1
2506 1 28 VAL MG1 1 37 ILE QG 4.540 . 5.220 3.095 2.319 3.745 . 0 0 "[ . 1 . 2]" 1
2507 1 28 VAL MG2 1 37 ILE QG 3.340 . 3.840 2.334 2.048 2.763 . 0 0 "[ . 1 . 2]" 1
2508 1 29 SER QB 1 30 ASP H 4.170 . 4.800 3.511 3.137 4.015 . 0 0 "[ . 1 . 2]" 1
2509 1 29 SER QB 1 39 TRP HD1 4.850 . 5.580 3.877 3.114 4.749 . 0 0 "[ . 1 . 2]" 1
2510 1 29 SER QB 1 39 TRP HE1 4.900 . 5.640 4.233 1.839 4.951 . 0 0 "[ . 1 . 2]" 1
2511 1 31 PRO HA 1 34 ASP QB 4.220 . 4.850 2.282 1.957 3.118 . 0 0 "[ . 1 . 2]" 1
2512 1 32 ASP H 1 32 ASP QB 2.620 . 3.010 2.286 2.234 2.477 . 0 0 "[ . 1 . 2]" 1
2513 1 32 ASP H 1 34 ASP QB 4.760 . 5.470 4.509 4.267 5.012 . 0 0 "[ . 1 . 2]" 1
2514 1 32 ASP HA 1 32 ASP QB 2.640 . 3.040 2.352 2.318 2.404 . 0 0 "[ . 1 . 2]" 1
2515 1 32 ASP QB 1 33 THR H 3.460 . 3.980 2.891 2.722 3.073 . 0 0 "[ . 1 . 2]" 1
2516 1 32 ASP QB 1 33 THR MG 3.710 . 4.270 3.003 2.523 3.426 . 0 0 "[ . 1 . 2]" 1
2517 1 34 ASP H 1 34 ASP QB 2.990 . 3.440 2.289 2.071 2.454 . 0 0 "[ . 1 . 2]" 1
2518 1 34 ASP QB 1 35 ALA H 3.940 . 4.530 3.204 2.699 3.729 . 0 0 "[ . 1 . 2]" 1
2519 1 34 ASP QB 1 38 CYS HA 4.650 . 5.350 4.429 3.187 5.144 . 0 0 "[ . 1 . 2]" 1
2520 1 34 ASP QB 1 38 CYS QB 3.790 . 4.360 3.232 2.177 3.997 . 0 0 "[ . 1 . 2]" 1
2521 1 34 ASP QB 1 39 TRP H 5.750 . 6.610 5.646 4.384 6.386 . 0 0 "[ . 1 . 2]" 1
2522 1 37 ILE H 1 37 ILE QG 4.600 . 5.290 4.231 4.185 4.252 . 0 0 "[ . 1 . 2]" 1
2523 1 37 ILE HA 1 37 ILE QG 3.560 . 4.090 2.440 2.406 2.464 . 0 0 "[ . 1 . 2]" 1
2524 1 37 ILE QG 1 37 ILE MG 2.840 . 3.270 2.396 2.381 2.408 . 0 0 "[ . 1 . 2]" 1
2525 1 37 ILE QG 1 46 PHE HB3 5.610 . 6.450 4.399 3.971 4.715 . 0 0 "[ . 1 . 2]" 1
2526 1 37 ILE QG 1 46 PHE QD 4.380 . 5.040 2.257 2.032 2.412 . 0 0 "[ . 1 . 2]" 1
2527 1 37 ILE QG 1 46 PHE QE 5.100 . 5.870 3.681 3.191 4.035 . 0 0 "[ . 1 . 2]" 1
2528 1 37 ILE QG 1 48 VAL MG2 4.330 . 4.980 2.453 2.242 2.871 . 0 0 "[ . 1 . 2]" 1
2529 1 37 ILE QG 1 54 PHE QE 5.500 . 6.330 3.721 3.524 4.009 . 0 0 "[ . 1 . 2]" 1
2530 1 37 ILE QG 1 54 PHE HZ 5.240 . 6.030 4.553 4.217 4.884 . 0 0 "[ . 1 . 2]" 1
2531 1 38 CYS QB 1 39 TRP H 3.490 . 4.010 2.748 2.416 3.368 . 0 0 "[ . 1 . 2]" 1
2532 1 39 TRP HB2 1 43 GLY QA 4.890 . 5.620 2.982 2.018 4.149 . 0 0 "[ . 1 . 2]" 1
2533 1 40 SER H 1 41 PRO QD 4.620 . 5.310 4.499 4.417 4.536 . 0 0 "[ . 1 . 2]" 1
2534 1 40 SER QB 1 41 PRO QG 4.000 . 4.600 4.081 3.381 4.569 . 0 0 "[ . 1 . 2]" 1
2535 1 40 SER QB 1 41 PRO QD 3.350 . 3.850 2.437 2.177 2.742 . 0 0 "[ . 1 . 2]" 1
2536 1 40 SER QB 1 42 SER H 4.530 . 5.210 2.880 2.485 3.378 . 0 0 "[ . 1 . 2]" 1
2537 1 40 SER QB 1 43 GLY H 4.550 . 5.230 2.859 2.525 3.162 . 0 0 "[ . 1 . 2]" 1
2538 1 40 SER QB 1 45 SER H 4.110 . 4.730 3.237 2.761 4.053 . 0 0 "[ . 1 . 2]" 1
2539 1 40 SER QB 1 47 HIS HD2 4.330 . 4.980 3.585 2.563 4.117 . 0 0 "[ . 1 . 2]" 1
2540 1 42 SER QB 1 43 GLY H 4.270 . 4.910 2.849 2.211 3.782 . 0 0 "[ . 1 . 2]" 1
2541 1 42 SER QB 1 44 ASN H 4.020 . 4.620 2.913 2.403 4.007 . 0 0 "[ . 1 . 2]" 1
2542 1 43 GLY QA 1 107 LEU MD2 5.490 . 6.310 4.318 3.019 5.305 . 0 0 "[ . 1 . 2]" 1
2543 1 43 GLY QA 1 108 ARG H 4.220 . 4.850 3.182 2.714 3.727 . 0 0 "[ . 1 . 2]" 1
2544 1 43 GLY QA 1 108 ARG QB 3.770 . 4.340 2.463 1.942 3.316 . 0 0 "[ . 1 . 2]" 1
2545 1 44 ASN QB 1 107 LEU MD2 3.380 . 3.890 2.829 1.967 3.589 . 0 0 "[ . 1 . 2]" 1
2546 1 45 SER QB 1 46 PHE H 3.840 . 4.420 2.362 2.036 2.777 . 0 0 "[ . 1 . 2]" 1
2547 1 45 SER QB 1 100 GLU HG2 5.120 . 5.890 2.528 2.260 2.978 . 0 0 "[ . 1 . 2]" 1
2548 1 45 SER QB 1 100 GLU HG3 4.940 . 5.680 2.603 2.298 3.019 . 0 0 "[ . 1 . 2]" 1
2549 1 45 SER QB 1 102 GLN HA 4.480 . 5.150 2.453 1.956 3.299 . 0 0 "[ . 1 . 2]" 1
2550 1 45 SER QB 1 102 GLN HB2 3.860 . 4.440 2.771 2.517 3.284 . 0 0 "[ . 1 . 2]" 1
2551 1 45 SER QB 1 102 GLN HB3 5.020 . 5.770 2.282 1.875 2.808 . 0 0 "[ . 1 . 2]" 1
2552 1 45 SER QB 1 102 GLN HG2 4.670 . 5.370 4.349 3.876 4.760 . 0 0 "[ . 1 . 2]" 1
2553 1 48 VAL MG1 1 51 GLN QG 3.900 . 4.490 2.726 1.869 4.224 . 0 0 "[ . 1 . 2]" 1
2554 1 49 PHE HA 1 98 ASP QB 4.940 . 5.680 4.384 3.275 5.428 . 0 0 "[ . 1 . 2]" 1
2555 1 49 PHE QE 1 96 ARG QD 4.000 . 4.600 3.464 2.900 3.858 . 0 0 "[ . 1 . 2]" 1
2556 1 49 PHE QE 1 98 ASP QB 4.030 . 4.630 3.167 2.503 4.113 . 0 0 "[ . 1 . 2]" 1
2557 1 49 PHE HZ 1 96 ARG QD 5.250 . 6.040 5.320 4.922 5.716 . 0 0 "[ . 1 . 2]" 1
2558 1 49 PHE HZ 1 98 ASP QB 4.330 . 4.980 4.530 3.453 5.107 0.127 9 0 "[ . 1 . 2]" 1
2559 1 50 ASP H 1 97 ASP QB 4.370 . 5.030 3.460 1.959 4.819 . 0 0 "[ . 1 . 2]" 1
2560 1 50 ASP HA 1 97 ASP QB 4.160 . 4.780 3.663 2.510 4.849 0.069 6 0 "[ . 1 . 2]" 1
2561 1 51 GLN HB3 1 68 MET QG 4.530 . 5.210 3.085 1.811 4.383 . 0 0 "[ . 1 . 2]" 1
2562 1 51 GLN HE22 1 51 GLN QG 3.500 . 4.030 3.271 3.195 3.459 . 0 0 "[ . 1 . 2]" 1
2563 1 51 GLN QG 1 52 GLY H 4.480 . 5.150 4.262 3.976 4.440 . 0 0 "[ . 1 . 2]" 1
2564 1 51 GLN QG 1 68 MET ME 3.710 . 4.270 2.775 1.778 4.131 0.022 2 0 "[ . 1 . 2]" 1
2565 1 51 GLN QG 1 101 PHE QE 5.810 . 6.680 5.229 4.744 6.588 . 0 0 "[ . 1 . 2]" 1
2566 1 55 ALA MB 1 68 MET QG 4.180 . 4.810 3.485 3.138 3.905 . 0 0 "[ . 1 . 2]" 1
2567 1 56 LYS HB2 1 56 LYS QE 4.810 . 5.530 4.476 4.139 4.621 . 0 0 "[ . 1 . 2]" 1
2568 1 56 LYS HB3 1 56 LYS QE 4.420 . 5.080 4.093 4.000 4.138 . 0 0 "[ . 1 . 2]" 1
2569 1 56 LYS QE 1 56 LYS HG2 2.810 . 3.230 2.609 2.336 3.112 . 0 0 "[ . 1 . 2]" 1
2570 1 56 LYS QE 1 56 LYS HG3 3.120 . 3.590 2.807 2.528 3.067 . 0 0 "[ . 1 . 2]" 1
2571 1 56 LYS QE 1 57 GLU HG2 5.060 . 5.820 4.290 3.897 4.703 . 0 0 "[ . 1 . 2]" 1
2572 1 56 LYS QE 1 57 GLU HG3 5.230 . 6.010 5.486 5.149 5.979 . 0 0 "[ . 1 . 2]" 1
2573 1 58 VAL HA 1 61 LYS QD 3.920 . 4.510 3.053 2.616 3.461 . 0 0 "[ . 1 . 2]" 1
2574 1 59 LEU HA 1 63 PHE QB 4.880 . 5.610 3.432 3.243 3.876 . 0 0 "[ . 1 . 2]" 1
2575 1 59 LEU HB3 1 63 PHE QB 4.650 . 5.350 3.292 2.973 3.622 . 0 0 "[ . 1 . 2]" 1
2576 1 59 LEU HB3 1 71 PHE QB 5.170 . 5.950 4.300 4.060 4.510 . 0 0 "[ . 1 . 2]" 1
2577 1 59 LEU MD1 1 63 PHE QB 4.910 . 5.650 4.466 4.265 4.887 . 0 0 "[ . 1 . 2]" 1
2578 1 59 LEU MD1 1 68 MET QG 5.120 . 5.890 3.475 2.177 4.635 . 0 0 "[ . 1 . 2]" 1
2579 1 59 LEU MD1 1 71 PHE QB 3.910 . 4.500 2.208 1.987 2.413 . 0 0 "[ . 1 . 2]" 1
2580 1 59 LEU MD2 1 63 PHE QB 4.580 . 5.270 3.466 3.152 4.022 . 0 0 "[ . 1 . 2]" 1
2581 1 59 LEU MD2 1 65 HIS QB 5.810 . 6.680 5.851 5.628 6.251 . 0 0 "[ . 1 . 2]" 1
2582 1 59 LEU MD2 1 71 PHE QB 4.000 . 4.600 2.589 2.302 2.900 . 0 0 "[ . 1 . 2]" 1
2583 1 61 LYS H 1 61 LYS QD 4.680 . 5.380 4.431 4.332 4.561 . 0 0 "[ . 1 . 2]" 1
2584 1 61 LYS HA 1 61 LYS QD 4.030 . 4.630 4.066 3.999 4.136 . 0 0 "[ . 1 . 2]" 1
2585 1 61 LYS HB2 1 61 LYS QD 2.850 . 3.280 2.418 2.321 2.526 . 0 0 "[ . 1 . 2]" 1
2586 1 61 LYS HB2 1 61 LYS QE 4.770 . 5.490 4.089 3.967 4.271 . 0 0 "[ . 1 . 2]" 1
2587 1 61 LYS HB3 1 61 LYS QD 2.910 . 3.350 2.451 2.381 2.530 . 0 0 "[ . 1 . 2]" 1
2588 1 61 LYS HB3 1 61 LYS QE 4.800 . 5.520 4.101 3.957 4.328 . 0 0 "[ . 1 . 2]" 1
2589 1 61 LYS QE 1 61 LYS HG2 3.100 . 3.570 2.599 2.400 2.963 . 0 0 "[ . 1 . 2]" 1
2590 1 61 LYS QE 1 61 LYS HG3 3.610 . 4.150 2.622 2.394 3.145 . 0 0 "[ . 1 . 2]" 1
2591 1 61 LYS QD 1 61 LYS QE 2.320 . 2.670 2.066 2.011 2.117 . 0 0 "[ . 1 . 2]" 1
2592 1 61 LYS QD 1 62 TYR H 4.640 . 5.340 4.276 4.016 4.614 . 0 0 "[ . 1 . 2]" 1
2593 1 61 LYS QD 1 62 TYR QE 3.730 . 4.290 2.310 2.003 2.826 . 0 0 "[ . 1 . 2]" 1
2594 1 61 LYS QE 1 62 TYR QE 4.660 . 5.360 2.838 1.918 3.617 . 0 0 "[ . 1 . 2]" 1
2595 1 63 PHE HA 1 64 LYS QG 4.770 . 5.490 3.628 3.136 4.426 . 0 0 "[ . 1 . 2]" 1
2596 1 64 LYS H 1 64 LYS QB 3.620 . 4.160 2.802 2.532 3.246 . 0 0 "[ . 1 . 2]" 1
2597 1 64 LYS H 1 64 LYS QD 4.640 . 5.340 3.988 2.426 5.081 . 0 0 "[ . 1 . 2]" 1
2598 1 64 LYS HA 1 64 LYS QG 3.370 . 3.880 3.001 2.457 3.489 . 0 0 "[ . 1 . 2]" 1
2599 1 64 LYS HA 1 64 LYS QD 4.690 . 5.390 3.624 1.876 4.649 . 0 0 "[ . 1 . 2]" 1
2600 1 64 LYS QE 1 64 LYS QG 3.300 . 3.800 2.526 2.173 2.903 . 0 0 "[ . 1 . 2]" 1
2601 1 64 LYS QG 1 65 HIS H 4.860 . 5.590 4.505 4.031 4.891 . 0 0 "[ . 1 . 2]" 1
2602 1 65 HIS HE1 1 71 PHE QB 3.220 . 3.700 2.097 1.828 2.964 . 0 0 "[ . 1 . 2]" 1
2603 1 68 MET H 1 68 MET QG 4.130 . 4.750 4.066 3.967 4.102 . 0 0 "[ . 1 . 2]" 1
2604 1 68 MET HA 1 71 PHE QB 3.860 . 4.440 2.540 2.230 3.036 . 0 0 "[ . 1 . 2]" 1
2605 1 68 MET ME 1 68 MET QG 2.950 . 3.390 2.259 2.169 2.442 . 0 0 "[ . 1 . 2]" 1
2606 1 68 MET QG 1 69 ALA H 3.830 . 4.400 3.860 3.470 4.177 . 0 0 "[ . 1 . 2]" 1
2607 1 68 MET QG 1 71 PHE QD 4.570 . 5.260 3.406 2.306 4.582 . 0 0 "[ . 1 . 2]" 1
2608 1 68 MET QG 1 72 VAL MG1 4.910 . 5.650 4.571 4.233 4.765 . 0 0 "[ . 1 . 2]" 1
2609 1 68 MET QG 1 72 VAL MG2 3.280 . 3.770 2.210 1.931 2.575 . 0 0 "[ . 1 . 2]" 1
2610 1 69 ALA MB 1 73 ARG QD 4.980 . 5.730 4.992 4.297 5.637 . 0 0 "[ . 1 . 2]" 1
2611 1 70 SER HA 1 73 ARG QD 4.710 . 5.420 3.430 2.849 4.411 . 0 0 "[ . 1 . 2]" 1
2612 1 71 PHE H 1 71 PHE QB 3.520 . 4.050 2.208 2.180 2.242 . 0 0 "[ . 1 . 2]" 1
2613 1 71 PHE QB 1 72 VAL H 3.390 . 3.900 2.380 2.313 2.495 . 0 0 "[ . 1 . 2]" 1
2614 1 71 PHE QB 1 72 VAL MG2 4.430 . 5.090 3.013 2.841 3.188 . 0 0 "[ . 1 . 2]" 1
2615 1 72 VAL MG1 1 82 LYS QB 4.880 . 5.610 3.772 3.287 4.257 . 0 0 "[ . 1 . 2]" 1
2616 1 72 VAL MG1 1 82 LYS QD 5.510 . 6.340 4.247 2.185 5.611 . 0 0 "[ . 1 . 2]" 1
2617 1 73 ARG H 1 73 ARG QD 4.660 . 5.360 4.600 4.336 4.833 . 0 0 "[ . 1 . 2]" 1
2618 1 73 ARG HA 1 73 ARG QD 4.290 . 4.930 4.176 3.992 4.341 . 0 0 "[ . 1 . 2]" 1
2619 1 73 ARG QB 1 73 ARG QD 2.880 . 3.310 2.271 2.138 2.451 . 0 0 "[ . 1 . 2]" 1
2620 1 73 ARG QB 1 74 GLN H 3.390 . 3.900 2.599 2.415 2.804 . 0 0 "[ . 1 . 2]" 1
2621 1 73 ARG QD 1 77 MET ME 5.040 . 5.800 4.235 3.374 5.245 . 0 0 "[ . 1 . 2]" 1
2622 1 74 GLN HA 1 74 GLN QE 4.370 . 5.030 3.328 2.594 4.395 . 0 0 "[ . 1 . 2]" 1
2623 1 74 GLN QE 1 77 MET ME 3.900 . 4.490 2.736 2.151 3.966 . 0 0 "[ . 1 . 2]" 1
2624 1 77 MET ME 1 119 ARG QD 3.990 . 4.590 2.980 2.129 4.234 . 0 0 "[ . 1 . 2]" 1
2625 1 78 TYR H 1 79 GLY QA 4.740 . 5.450 4.429 4.334 4.525 . 0 0 "[ . 1 . 2]" 1
2626 1 78 TYR QD 1 118 LYS QB 5.640 . 6.490 4.872 4.497 5.403 . 0 0 "[ . 1 . 2]" 1
2627 1 78 TYR QD 1 119 ARG QG 4.500 . 5.180 4.211 3.618 4.796 . 0 0 "[ . 1 . 2]" 1
2628 1 78 TYR QE 1 119 ARG QG 4.330 . 4.980 3.109 2.132 3.752 . 0 0 "[ . 1 . 2]" 1
2629 1 78 TYR QE 1 119 ARG QD 5.210 . 5.990 3.299 2.755 4.611 . 0 0 "[ . 1 . 2]" 1
2630 1 79 GLY QA 1 103 HIS HD2 4.160 . 4.780 3.039 2.446 3.863 . 0 0 "[ . 1 . 2]" 1
2631 1 81 ARG H 1 81 ARG QG 4.540 . 5.220 4.053 3.920 4.127 . 0 0 "[ . 1 . 2]" 1
2632 1 81 ARG H 1 81 ARG QD 5.180 . 5.960 4.827 4.401 5.099 . 0 0 "[ . 1 . 2]" 1
2633 1 81 ARG HA 1 81 ARG QG 3.320 . 3.820 2.587 2.426 3.227 . 0 0 "[ . 1 . 2]" 1
2634 1 81 ARG HA 1 81 ARG QD 4.600 . 5.290 4.004 2.320 4.355 . 0 0 "[ . 1 . 2]" 1
2635 1 81 ARG HB2 1 81 ARG QD 3.470 . 3.990 2.826 2.409 3.156 . 0 0 "[ . 1 . 2]" 1
2636 1 81 ARG HB3 1 81 ARG QG 2.530 . 2.910 2.340 2.176 2.435 . 0 0 "[ . 1 . 2]" 1
2637 1 81 ARG HB3 1 81 ARG QD 3.640 . 4.190 2.720 2.374 3.557 . 0 0 "[ . 1 . 2]" 1
2638 1 81 ARG QG 1 82 LYS H 3.640 . 4.190 2.988 2.699 3.523 . 0 0 "[ . 1 . 2]" 1
2639 1 81 ARG QG 1 83 VAL MG2 3.620 . 4.160 2.617 1.866 3.377 . 0 0 "[ . 1 . 2]" 1
2640 1 81 ARG QG 1 102 GLN H 5.260 . 6.050 4.708 4.299 4.983 . 0 0 "[ . 1 . 2]" 1
2641 1 81 ARG QG 1 102 GLN HE22 4.840 . 5.570 4.182 2.844 4.678 . 0 0 "[ . 1 . 2]" 1
2642 1 81 ARG QD 1 83 VAL MG1 5.810 . 6.680 5.081 4.327 5.921 . 0 0 "[ . 1 . 2]" 1
2643 1 81 ARG QD 1 83 VAL MG2 4.580 . 5.270 3.186 2.545 3.908 . 0 0 "[ . 1 . 2]" 1
2644 1 81 ARG QD 1 102 GLN HE21 4.480 . 5.150 2.542 1.768 4.485 0.032 2 0 "[ . 1 . 2]" 1
2645 1 81 ARG QD 1 102 GLN HE22 4.350 . 5.000 3.204 2.503 5.036 0.036 3 0 "[ . 1 . 2]" 1
2646 1 82 LYS HA 1 82 LYS QD 3.670 . 4.220 2.745 2.246 3.465 . 0 0 "[ . 1 . 2]" 1
2647 1 82 LYS HA 1 82 LYS QE 5.080 . 5.840 4.342 4.017 4.847 . 0 0 "[ . 1 . 2]" 1
2648 1 82 LYS QB 1 82 LYS QD 2.390 . 2.750 2.378 2.311 2.506 . 0 0 "[ . 1 . 2]" 1
2649 1 82 LYS QB 1 82 LYS QE 4.310 . 4.960 3.872 3.706 3.936 . 0 0 "[ . 1 . 2]" 1
2650 1 82 LYS QB 1 83 VAL H 4.080 . 4.690 3.916 3.796 4.039 . 0 0 "[ . 1 . 2]" 1
2651 1 82 LYS QB 1 101 PHE QE 4.220 . 4.850 2.910 2.390 3.564 . 0 0 "[ . 1 . 2]" 1
2652 1 82 LYS QE 1 82 LYS QG 3.260 . 3.750 2.348 2.175 2.409 . 0 0 "[ . 1 . 2]" 1
2653 1 82 LYS QG 1 83 VAL H 3.800 . 4.370 3.501 3.156 3.883 . 0 0 "[ . 1 . 2]" 1
2654 1 82 LYS QG 1 99 THR MG 3.580 . 4.120 2.891 1.820 3.861 . 0 0 "[ . 1 . 2]" 1
2655 1 82 LYS QG 1 100 GLU H 5.300 . 6.100 5.091 3.996 5.895 . 0 0 "[ . 1 . 2]" 1
2656 1 82 LYS QG 1 101 PHE QE 4.510 . 5.190 3.872 2.667 5.051 . 0 0 "[ . 1 . 2]" 1
2657 1 82 LYS QD 1 83 VAL H 3.830 . 4.400 2.896 2.068 3.376 . 0 0 "[ . 1 . 2]" 1
2658 1 82 LYS QD 1 84 VAL QG 3.590 . 4.130 3.427 2.447 4.171 0.041 1 0 "[ . 1 . 2]" 1
2659 1 82 LYS QD 1 99 THR MG 3.330 . 3.830 2.385 1.783 3.430 0.017 7 0 "[ . 1 . 2]" 1
2660 1 82 LYS QD 1 100 GLU H 4.560 . 5.240 4.286 2.952 5.062 . 0 0 "[ . 1 . 2]" 1
2661 1 82 LYS QD 1 101 PHE QE 4.320 . 4.970 3.932 2.422 4.979 0.009 12 0 "[ . 1 . 2]" 1
2662 1 82 LYS QE 1 84 VAL QG 3.340 . 3.840 2.323 1.716 2.793 0.084 7 0 "[ . 1 . 2]" 1
2663 1 82 LYS QE 1 99 THR MG 3.810 . 4.380 2.250 1.790 3.243 0.010 12 0 "[ . 1 . 2]" 1
2664 1 82 LYS QE 1 100 GLU H 4.480 . 5.150 4.530 3.140 5.272 0.122 14 0 "[ . 1 . 2]" 1
2665 1 82 LYS QE 1 101 PHE QE 4.800 . 5.520 4.943 3.940 5.570 0.050 5 0 "[ . 1 . 2]" 1
2666 1 83 VAL HA 1 84 VAL QG 3.660 . 4.210 3.620 3.345 3.815 . 0 0 "[ . 1 . 2]" 1
2667 1 83 VAL MG1 1 85 HIS QB 5.810 . 6.680 4.583 4.285 4.877 . 0 0 "[ . 1 . 2]" 1
2668 1 84 VAL H 1 84 VAL QG 2.890 . 3.320 2.223 1.960 2.852 . 0 0 "[ . 1 . 2]" 1
2669 1 84 VAL HA 1 84 VAL QG 2.780 . 3.200 2.280 2.196 2.384 . 0 0 "[ . 1 . 2]" 1
2670 1 84 VAL QG 1 85 HIS H 3.250 . 3.740 2.817 2.483 3.315 . 0 0 "[ . 1 . 2]" 1
2671 1 84 VAL QG 1 86 ILE H 3.570 . 4.110 2.917 1.893 4.130 0.020 14 0 "[ . 1 . 2]" 1
2672 1 84 VAL QG 1 86 ILE HA 4.820 . 5.540 4.289 3.873 4.776 . 0 0 "[ . 1 . 2]" 1
2673 1 84 VAL QG 1 87 GLU HA 4.180 . 4.810 3.344 2.210 4.815 0.005 13 0 "[ . 1 . 2]" 1
2674 1 84 VAL QG 1 87 GLU QG 4.130 . 4.750 3.447 2.008 4.725 . 0 0 "[ . 1 . 2]" 1
2675 1 84 VAL QG 1 99 THR HA 4.580 . 5.270 3.841 2.902 4.788 . 0 0 "[ . 1 . 2]" 1
2676 1 84 VAL QG 1 99 THR MG 4.050 . 4.660 4.056 2.806 4.644 . 0 0 "[ . 1 . 2]" 1
2677 1 85 HIS H 1 85 HIS QB 3.280 . 3.770 2.503 2.376 2.777 . 0 0 "[ . 1 . 2]" 1
2678 1 85 HIS QB 1 86 ILE H 3.790 . 4.360 2.763 2.086 3.479 . 0 0 "[ . 1 . 2]" 1
2679 1 85 HIS QB 1 86 ILE MD 4.590 . 5.280 3.684 2.948 4.115 . 0 0 "[ . 1 . 2]" 1
2680 1 86 ILE HA 1 86 ILE QG 3.380 . 3.890 2.971 2.835 3.114 . 0 0 "[ . 1 . 2]" 1
2681 1 86 ILE HB 1 97 ASP QB 5.600 . 6.440 5.048 3.990 5.926 . 0 0 "[ . 1 . 2]" 1
2682 1 86 ILE HB 1 98 ASP QB 4.670 . 5.370 3.070 2.016 4.246 . 0 0 "[ . 1 . 2]" 1
2683 1 86 ILE MG 1 88 GLN QB 5.510 . 6.340 4.609 3.405 5.507 . 0 0 "[ . 1 . 2]" 1
2684 1 86 ILE MG 1 88 GLN QG 4.100 . 4.720 3.387 1.920 4.879 0.159 7 0 "[ . 1 . 2]" 1
2685 1 86 ILE MG 1 98 ASP QB 5.150 . 5.920 4.067 3.481 4.547 . 0 0 "[ . 1 . 2]" 1
2686 1 86 ILE QG 1 87 GLU H 4.630 . 5.320 4.777 4.504 4.940 . 0 0 "[ . 1 . 2]" 1
2687 1 86 ILE QG 1 98 ASP H 5.030 . 5.780 3.007 1.918 4.155 . 0 0 "[ . 1 . 2]" 1
2688 1 86 ILE QG 1 98 ASP QB 5.390 . 6.200 1.991 1.755 2.208 0.045 4 0 "[ . 1 . 2]" 1
2689 1 86 ILE MD 1 98 ASP QB 4.800 . 5.520 3.223 2.300 3.715 . 0 0 "[ . 1 . 2]" 1
2690 1 87 GLU H 1 87 GLU QG 4.050 . 4.660 2.588 2.042 4.141 . 0 0 "[ . 1 . 2]" 1
2691 1 87 GLU HA 1 87 GLU QG 3.260 . 3.750 2.542 2.387 3.036 . 0 0 "[ . 1 . 2]" 1
2692 1 87 GLU HB3 1 87 GLU QG 2.590 . 2.980 2.358 2.295 2.467 . 0 0 "[ . 1 . 2]" 1
2693 1 87 GLU QG 1 88 GLN H 4.770 . 5.490 4.151 2.602 4.613 . 0 0 "[ . 1 . 2]" 1
2694 1 88 GLN H 1 88 GLN QB 3.110 . 3.580 2.508 2.351 2.742 . 0 0 "[ . 1 . 2]" 1
2695 1 88 GLN H 1 88 GLN QG 3.600 . 4.140 2.491 1.961 3.298 . 0 0 "[ . 1 . 2]" 1
2696 1 88 GLN HA 1 88 GLN QG 3.160 . 3.630 2.791 2.423 3.391 . 0 0 "[ . 1 . 2]" 1
2697 1 88 GLN QB 1 89 GLY H 3.770 . 4.340 3.460 2.537 4.021 . 0 0 "[ . 1 . 2]" 1
2698 1 88 GLN QB 1 89 GLY QA 4.080 . 4.690 3.972 3.520 4.462 . 0 0 "[ . 1 . 2]" 1
2699 1 88 GLN QG 1 89 GLY H 4.700 . 5.400 4.457 3.458 4.938 . 0 0 "[ . 1 . 2]" 1
2700 1 89 GLY QA 1 90 GLY H 2.740 . 3.150 2.384 2.127 2.942 . 0 0 "[ . 1 . 2]" 1
2701 1 91 LEU HA 1 92 VAL QG 4.440 . 5.110 4.001 3.282 4.304 . 0 0 "[ . 1 . 2]" 1
2702 1 91 LEU MD1 1 93 LYS QB 5.410 . 6.220 3.893 2.364 5.253 . 0 0 "[ . 1 . 2]" 1
2703 1 91 LEU MD1 1 93 LYS QG 3.520 . 4.050 3.287 2.637 4.044 . 0 0 "[ . 1 . 2]" 1
2704 1 91 LEU MD1 1 93 LYS QD 4.000 . 4.600 3.453 1.792 4.743 0.143 15 0 "[ . 1 . 2]" 1
2705 1 92 VAL H 1 92 VAL QG 2.640 . 3.040 2.063 1.929 2.234 . 0 0 "[ . 1 . 2]" 1
2706 1 92 VAL H 1 93 LYS QG 4.560 . 5.240 3.757 3.136 4.101 . 0 0 "[ . 1 . 2]" 1
2707 1 92 VAL HA 1 92 VAL QG 2.640 . 3.040 2.334 2.285 2.394 . 0 0 "[ . 1 . 2]" 1
2708 1 92 VAL HA 1 93 LYS QG 5.540 . 6.370 4.900 4.274 5.507 . 0 0 "[ . 1 . 2]" 1
2709 1 92 VAL QG 1 93 LYS H 3.110 . 3.580 3.032 1.743 3.601 0.057 19 0 "[ . 1 . 2]" 1
2710 1 92 VAL QG 1 93 LYS QB 4.500 . 5.180 4.205 3.171 4.724 . 0 0 "[ . 1 . 2]" 1
2711 1 92 VAL QG 1 93 LYS QG 3.950 . 4.540 3.467 2.558 4.349 . 0 0 "[ . 1 . 2]" 1
2712 1 93 LYS H 1 93 LYS QB 3.280 . 3.770 2.616 2.317 3.299 . 0 0 "[ . 1 . 2]" 1
2713 1 93 LYS H 1 93 LYS QG 3.190 . 3.670 2.610 1.935 3.425 . 0 0 "[ . 1 . 2]" 1
2714 1 93 LYS H 1 93 LYS QD 4.710 . 5.420 4.032 3.202 4.775 . 0 0 "[ . 1 . 2]" 1
2715 1 93 LYS QB 1 93 LYS QD 2.300 . 2.640 2.319 2.157 2.452 . 0 0 "[ . 1 . 2]" 1
2716 1 93 LYS QB 1 93 LYS QE 4.200 . 4.830 3.208 2.007 3.924 . 0 0 "[ . 1 . 2]" 1
2717 1 93 LYS QB 1 94 PRO HD2 3.550 . 4.080 2.368 1.958 3.102 . 0 0 "[ . 1 . 2]" 1
2718 1 93 LYS QB 1 94 PRO HD3 3.450 . 3.970 3.713 3.384 4.119 0.149 17 0 "[ . 1 . 2]" 1
2719 1 93 LYS QD 1 93 LYS QG 2.330 . 2.680 2.085 2.016 2.126 . 0 0 "[ . 1 . 2]" 1
2720 1 93 LYS QE 1 93 LYS QG 2.560 . 2.940 2.413 2.165 2.839 . 0 0 "[ . 1 . 2]" 1
2721 1 93 LYS QG 1 94 PRO HD2 4.460 . 5.130 3.757 3.146 4.501 . 0 0 "[ . 1 . 2]" 1
2722 1 93 LYS QG 1 94 PRO HD3 4.530 . 5.210 4.699 4.119 5.262 0.052 12 0 "[ . 1 . 2]" 1
2723 1 94 PRO HB3 1 96 ARG QD 4.940 . 5.680 4.588 3.998 5.183 . 0 0 "[ . 1 . 2]" 1
2724 1 95 GLU H 1 95 GLU QG 3.220 . 3.700 2.095 1.908 3.300 . 0 0 "[ . 1 . 2]" 1
2725 1 95 GLU HB2 1 95 GLU QG 2.530 . 2.910 2.375 2.174 2.426 . 0 0 "[ . 1 . 2]" 1
2726 1 95 GLU QG 1 96 ARG H 3.880 . 4.460 3.427 2.586 4.327 . 0 0 "[ . 1 . 2]" 1
2727 1 95 GLU QG 1 96 ARG HA 4.350 . 5.000 4.078 3.210 4.798 . 0 0 "[ . 1 . 2]" 1
2728 1 96 ARG H 1 96 ARG QD 4.750 . 5.460 4.129 3.776 4.613 . 0 0 "[ . 1 . 2]" 1
2729 1 96 ARG HB2 1 96 ARG QD 3.270 . 3.760 2.534 2.354 3.106 . 0 0 "[ . 1 . 2]" 1
2730 1 96 ARG HB3 1 96 ARG QD 3.690 . 4.240 2.742 2.455 3.054 . 0 0 "[ . 1 . 2]" 1
2731 1 96 ARG HG3 1 98 ASP QB 4.380 . 5.040 3.915 3.057 4.846 . 0 0 "[ . 1 . 2]" 1
2732 1 97 ASP H 1 97 ASP QB 3.290 . 3.780 2.488 2.241 2.695 . 0 0 "[ . 1 . 2]" 1
2733 1 97 ASP QB 1 98 ASP H 3.470 . 3.990 3.353 2.859 3.912 . 0 0 "[ . 1 . 2]" 1
2734 1 98 ASP H 1 98 ASP QB 3.020 . 3.470 2.500 2.310 2.683 . 0 0 "[ . 1 . 2]" 1
2735 1 98 ASP QB 1 99 THR H 4.360 . 5.010 3.860 3.571 3.965 . 0 0 "[ . 1 . 2]" 1
2736 1 107 LEU H 1 110 GLN QB 4.700 . 5.400 2.952 2.084 3.725 . 0 0 "[ . 1 . 2]" 1
2737 1 107 LEU H 1 110 GLN QG 5.040 . 5.800 4.437 3.284 5.736 . 0 0 "[ . 1 . 2]" 1
2738 1 107 LEU HA 1 110 GLN QB 4.720 . 5.430 4.364 3.926 4.695 . 0 0 "[ . 1 . 2]" 1
2739 1 107 LEU HB2 1 110 GLN QB 4.080 . 4.690 1.892 1.671 2.268 0.129 19 0 "[ . 1 . 2]" 1
2740 1 107 LEU HB2 1 110 GLN QG 3.880 . 4.460 2.880 2.016 3.733 . 0 0 "[ . 1 . 2]" 1
2741 1 107 LEU HB2 1 110 GLN QE 4.290 . 4.930 3.699 2.512 4.640 . 0 0 "[ . 1 . 2]" 1
2742 1 107 LEU HB3 1 110 GLN QB 4.300 . 4.950 3.235 2.835 3.749 . 0 0 "[ . 1 . 2]" 1
2743 1 107 LEU HB3 1 110 GLN QG 5.770 . 6.640 3.980 2.763 4.645 . 0 0 "[ . 1 . 2]" 1
2744 1 107 LEU HG 1 110 GLN QB 4.880 . 5.610 3.655 3.369 4.063 . 0 0 "[ . 1 . 2]" 1
2745 1 107 LEU HG 1 110 GLN QG 4.100 . 4.720 3.970 3.043 4.796 0.076 3 0 "[ . 1 . 2]" 1
2746 1 107 LEU HG 1 110 GLN QE 5.670 . 6.520 4.915 4.305 5.496 . 0 0 "[ . 1 . 2]" 1
2747 1 107 LEU MD1 1 108 ARG QB 5.810 . 6.680 5.829 4.989 6.546 . 0 0 "[ . 1 . 2]" 1
2748 1 107 LEU MD1 1 110 GLN QB 3.320 . 3.820 2.948 2.347 3.491 . 0 0 "[ . 1 . 2]" 1
2749 1 107 LEU MD1 1 110 GLN QG 3.440 . 3.960 2.317 1.819 3.032 . 0 0 "[ . 1 . 2]" 1
2750 1 107 LEU MD1 1 110 GLN QE 3.180 . 3.660 2.839 1.861 3.681 0.021 6 0 "[ . 1 . 2]" 1
2751 1 107 LEU MD2 1 110 GLN QG 4.690 . 5.390 4.706 4.084 5.295 . 0 0 "[ . 1 . 2]" 1
2752 1 107 LEU MD2 1 110 GLN QE 4.710 . 5.420 4.943 3.782 5.569 0.149 1 0 "[ . 1 . 2]" 1
2753 1 108 ARG H 1 108 ARG QB 3.610 . 4.150 2.380 2.146 2.876 . 0 0 "[ . 1 . 2]" 1
2754 1 110 GLN HA 1 110 GLN QG 3.260 . 3.750 2.676 2.299 2.989 . 0 0 "[ . 1 . 2]" 1
2755 1 110 GLN HA 1 110 GLN QE 4.450 . 5.120 3.834 2.873 4.734 . 0 0 "[ . 1 . 2]" 1
2756 1 110 GLN HA 1 112 GLN QG 5.090 . 5.850 4.451 3.049 5.144 . 0 0 "[ . 1 . 2]" 1
2757 1 110 GLN HA 1 112 GLN QE 4.160 . 4.780 3.353 2.330 4.804 0.024 2 0 "[ . 1 . 2]" 1
2758 1 110 GLN QB 1 110 GLN QE 3.350 . 3.850 2.721 1.806 3.583 . 0 0 "[ . 1 . 2]" 1
2759 1 110 GLN QB 1 111 GLU H 4.010 . 4.610 3.931 3.821 4.033 . 0 0 "[ . 1 . 2]" 1
2760 1 110 GLN QB 1 112 GLN QE 4.880 . 5.610 3.830 1.977 4.940 . 0 0 "[ . 1 . 2]" 1
2761 1 110 GLN QB 1 113 LEU H 4.700 . 5.400 3.664 2.956 4.640 . 0 0 "[ . 1 . 2]" 1
2762 1 110 GLN QB 1 113 LEU HB2 5.670 . 6.520 3.121 2.424 4.176 . 0 0 "[ . 1 . 2]" 1
2763 1 110 GLN QB 1 113 LEU HB3 5.810 . 6.680 4.480 3.811 5.566 . 0 0 "[ . 1 . 2]" 1
2764 1 110 GLN QB 1 113 LEU MD1 3.800 . 4.370 2.651 2.010 3.724 . 0 0 "[ . 1 . 2]" 1
2765 1 110 GLN QG 1 111 GLU H 4.980 . 5.730 4.573 4.192 4.860 . 0 0 "[ . 1 . 2]" 1
2766 1 110 GLN QG 1 113 LEU H 4.730 . 5.440 4.113 2.664 5.256 . 0 0 "[ . 1 . 2]" 1
2767 1 110 GLN QG 1 113 LEU HB2 5.810 . 6.680 3.782 2.142 5.028 . 0 0 "[ . 1 . 2]" 1
2768 1 110 GLN QG 1 113 LEU HB3 5.810 . 6.680 4.798 3.517 5.868 . 0 0 "[ . 1 . 2]" 1
2769 1 110 GLN QG 1 113 LEU HG 3.830 . 4.400 2.820 1.967 4.077 . 0 0 "[ . 1 . 2]" 1
2770 1 110 GLN QE 1 112 GLN QE 4.400 . 5.060 3.539 1.894 5.021 . 0 0 "[ . 1 . 2]" 1
2771 1 110 GLN QE 1 113 LEU HG 5.050 . 5.810 4.506 2.859 5.710 . 0 0 "[ . 1 . 2]" 1
2772 1 110 GLN QE 1 113 LEU MD1 4.120 . 4.740 3.446 1.856 4.348 . 0 0 "[ . 1 . 2]" 1
2773 1 111 GLU H 1 111 GLU QG 3.430 . 3.940 2.448 1.873 3.287 . 0 0 "[ . 1 . 2]" 1
2774 1 111 GLU QG 1 112 GLN HB3 5.040 . 5.800 3.740 2.995 5.834 0.034 4 0 "[ . 1 . 2]" 1
2775 1 111 GLU QG 1 114 LEU MD1 4.030 . 4.630 4.264 3.291 4.659 0.029 10 0 "[ . 1 . 2]" 1
2776 1 112 GLN H 1 112 GLN QG 3.480 . 4.000 3.133 2.155 3.542 . 0 0 "[ . 1 . 2]" 1
2777 1 112 GLN H 1 112 GLN QE 4.440 . 5.110 4.018 2.916 4.815 . 0 0 "[ . 1 . 2]" 1
2778 1 112 GLN HA 1 112 GLN QG 3.570 . 4.110 3.488 3.389 3.540 . 0 0 "[ . 1 . 2]" 1
2779 1 112 GLN HB2 1 112 GLN QG 2.620 . 3.010 2.181 2.155 2.359 . 0 0 "[ . 1 . 2]" 1
2780 1 112 GLN HB3 1 112 GLN QE 4.230 . 4.860 3.867 3.721 4.116 . 0 0 "[ . 1 . 2]" 1
2781 1 112 GLN QE 1 112 GLN QG 2.830 . 3.250 2.153 2.132 2.193 . 0 0 "[ . 1 . 2]" 1
2782 1 112 GLN QG 1 113 LEU H 4.100 . 4.720 3.001 2.618 3.516 . 0 0 "[ . 1 . 2]" 1
2783 1 112 GLN QG 1 113 LEU HA 4.420 . 5.080 3.613 3.343 3.805 . 0 0 "[ . 1 . 2]" 1
2784 1 112 GLN QG 1 113 LEU HG 4.890 . 5.620 2.792 2.252 3.651 . 0 0 "[ . 1 . 2]" 1
2785 1 112 GLN QG 1 113 LEU MD2 3.340 . 3.840 2.746 2.294 3.255 . 0 0 "[ . 1 . 2]" 1
2786 1 112 GLN QE 1 113 LEU HG 4.070 . 4.680 3.466 1.826 4.274 . 0 0 "[ . 1 . 2]" 1
2787 1 112 GLN QE 1 113 LEU MD1 4.180 . 4.810 4.077 2.963 4.855 0.045 7 0 "[ . 1 . 2]" 1
2788 1 112 GLN QE 1 113 LEU MD2 3.880 . 4.460 3.702 2.409 4.472 0.012 19 0 "[ . 1 . 2]" 1
2789 1 113 LEU HA 1 116 ASN QB 4.540 . 5.220 2.786 2.202 3.664 . 0 0 "[ . 1 . 2]" 1
2790 1 113 LEU MD2 1 116 ASN QB 4.570 . 5.260 3.179 2.475 3.733 . 0 0 "[ . 1 . 2]" 1
2791 1 116 ASN H 1 116 ASN QB 3.150 . 3.620 2.438 2.363 2.527 . 0 0 "[ . 1 . 2]" 1
2792 1 116 ASN QB 1 116 ASN HD22 3.460 . 3.980 3.345 3.289 3.504 . 0 0 "[ . 1 . 2]" 1
2793 1 116 ASN QB 1 117 ILE H 3.640 . 4.190 3.245 2.976 3.517 . 0 0 "[ . 1 . 2]" 1
2794 1 117 ILE HA 1 118 LYS QB 4.830 . 5.550 4.555 4.350 4.986 . 0 0 "[ . 1 . 2]" 1
2795 1 117 ILE HA 1 118 LYS QG 4.530 . 5.210 3.785 3.357 4.105 . 0 0 "[ . 1 . 2]" 1
2796 1 117 ILE HA 1 118 LYS QE 4.700 . 5.400 4.434 2.770 5.623 0.223 5 0 "[ . 1 . 2]" 1
2797 1 118 LYS H 1 118 LYS QB 3.220 . 3.700 2.643 2.482 3.314 . 0 0 "[ . 1 . 2]" 1
2798 1 118 LYS H 1 118 LYS QG 3.490 . 4.010 2.637 1.833 2.963 . 0 0 "[ . 1 . 2]" 1
2799 1 118 LYS H 1 118 LYS QD 4.680 . 5.380 4.235 3.197 4.688 . 0 0 "[ . 1 . 2]" 1
2800 1 118 LYS H 1 118 LYS QE 4.860 . 5.590 3.787 2.074 5.232 . 0 0 "[ . 1 . 2]" 1
2801 1 118 LYS HA 1 118 LYS QG 3.710 . 4.270 3.094 2.936 3.451 . 0 0 "[ . 1 . 2]" 1
2802 1 118 LYS HA 1 118 LYS QD 3.570 . 4.110 3.061 2.041 4.376 0.266 3 0 "[ . 1 . 2]" 1
2803 1 118 LYS HA 1 118 LYS QE 3.620 . 4.160 2.588 1.764 4.182 0.036 6 0 "[ . 1 . 2]" 1
2804 1 118 LYS QB 1 118 LYS QD 2.330 . 2.680 2.384 2.212 2.854 0.174 10 0 "[ . 1 . 2]" 1
2805 1 118 LYS QB 1 118 LYS QE 3.080 . 3.540 3.153 2.195 3.826 0.286 5 0 "[ . 1 . 2]" 1
2806 1 118 LYS QB 1 119 ARG H 3.140 . 3.610 2.807 2.185 3.212 . 0 0 "[ . 1 . 2]" 1
2807 1 118 LYS QD 1 118 LYS QG 2.310 . 2.660 2.053 2.027 2.121 . 0 0 "[ . 1 . 2]" 1
2808 1 118 LYS QE 1 118 LYS QG 3.330 . 3.830 2.351 2.176 2.768 . 0 0 "[ . 1 . 2]" 1
2809 1 118 LYS QG 1 119 ARG H 4.480 . 5.150 4.571 4.232 4.861 . 0 0 "[ . 1 . 2]" 1
2810 1 118 LYS QD 1 119 ARG H 4.340 . 4.990 4.061 3.629 4.604 . 0 0 "[ . 1 . 2]" 1
2811 1 119 ARG H 1 119 ARG QG 3.340 . 3.840 2.059 1.860 2.329 . 0 0 "[ . 1 . 2]" 1
2812 1 119 ARG H 1 119 ARG QD 4.510 . 5.190 4.043 3.804 4.350 . 0 0 "[ . 1 . 2]" 1
2813 1 119 ARG H 1 120 LYS QG 5.730 . 6.590 4.265 3.027 5.927 . 0 0 "[ . 1 . 2]" 1
2814 1 119 ARG HB2 1 119 ARG QD 3.400 . 3.910 2.563 2.377 3.022 . 0 0 "[ . 1 . 2]" 1
2815 1 119 ARG HB3 1 119 ARG QD 3.710 . 4.270 2.508 2.356 2.979 . 0 0 "[ . 1 . 2]" 1
2816 1 119 ARG QG 1 120 LYS H 3.560 . 4.090 2.712 1.769 3.976 0.031 7 0 "[ . 1 . 2]" 1
2817 1 119 ARG QD 1 120 LYS H 4.970 . 5.720 4.659 3.901 5.747 0.027 11 0 "[ . 1 . 2]" 1
2818 1 120 LYS H 1 120 LYS QB 3.100 . 3.570 2.774 2.373 3.456 . 0 0 "[ . 1 . 2]" 1
2819 1 120 LYS H 1 120 LYS QG 3.660 . 4.210 2.916 2.052 3.528 . 0 0 "[ . 1 . 2]" 1
2820 1 120 LYS HA 1 120 LYS QG 3.290 . 3.780 2.842 2.405 3.416 . 0 0 "[ . 1 . 2]" 1
2821 1 120 LYS HA 1 120 LYS QD 4.560 . 5.240 3.659 2.047 4.640 . 0 0 "[ . 1 . 2]" 1
2822 1 120 LYS HA 1 120 LYS QE 5.110 . 5.880 4.190 2.490 5.563 . 0 0 "[ . 1 . 2]" 1
2823 1 120 LYS QB 1 120 LYS QD 2.460 . 2.830 2.439 2.176 2.912 0.082 18 0 "[ . 1 . 2]" 1
2824 1 120 LYS QB 1 120 LYS QE 3.230 . 3.710 2.613 1.834 3.737 0.027 9 0 "[ . 1 . 2]" 1
2825 1 120 LYS QB 1 121 VAL H 3.210 . 3.690 2.364 1.821 2.983 . 0 0 "[ . 1 . 2]" 1
2826 1 120 LYS QB 1 121 VAL HA 4.560 . 5.240 4.361 4.092 4.631 . 0 0 "[ . 1 . 2]" 1
2827 1 120 LYS QB 1 121 VAL QG 3.760 . 4.320 3.418 2.334 4.353 0.033 11 0 "[ . 1 . 2]" 1
2828 1 120 LYS QE 1 120 LYS QG 2.900 . 3.340 2.367 2.155 2.888 . 0 0 "[ . 1 . 2]" 1
2829 1 120 LYS QG 1 121 VAL H 3.810 . 4.380 3.985 3.274 4.602 0.222 9 0 "[ . 1 . 2]" 1
2830 1 120 LYS QD 1 121 VAL H 4.250 . 4.890 4.485 3.675 5.094 0.204 3 0 "[ . 1 . 2]" 1
2831 1 121 VAL H 1 121 VAL QG 2.960 . 3.400 2.202 1.890 3.078 . 0 0 "[ . 1 . 2]" 1
2832 1 121 VAL HA 1 121 VAL QG 2.610 . 3.000 2.312 2.196 2.395 . 0 0 "[ . 1 . 2]" 1
2833 1 121 VAL QG 1 122 THR H 3.500 . 4.030 2.999 2.108 3.785 . 0 0 "[ . 1 . 2]" 1
2834 1 121 VAL QG 1 122 THR HA 4.630 . 5.320 3.712 3.285 4.337 . 0 0 "[ . 1 . 2]" 1
2835 1 121 VAL QG 1 122 THR HB 4.520 . 5.200 4.330 2.893 5.264 0.064 18 0 "[ . 1 . 2]" 1
2836 1 123 SER QB 1 124 VAL H 4.300 . 4.950 3.542 1.940 4.081 . 0 0 "[ . 1 . 2]" 1
2837 1 124 VAL H 1 124 VAL QG 4.080 . 4.690 2.160 1.866 2.654 . 0 0 "[ . 1 . 2]" 1
2838 1 124 VAL QG 1 125 SER H 3.870 . 4.450 3.046 2.177 3.753 . 0 0 "[ . 1 . 2]" 1
2839 1 125 SER H 1 125 SER QB 3.660 . 4.210 2.830 2.447 3.407 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 38
_Distance_constraint_stats_list.Viol_count 56
_Distance_constraint_stats_list.Viol_total 46.456
_Distance_constraint_stats_list.Viol_max 0.149
_Distance_constraint_stats_list.Viol_rms 0.0145
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0031
_Distance_constraint_stats_list.Viol_average_violations_only 0.0415
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 18 PRO 0.094 0.061 1 0 "[ . 1 . 2]"
1 19 ALA 0.255 0.067 12 0 "[ . 1 . 2]"
1 20 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 THR 0.094 0.061 1 0 "[ . 1 . 2]"
1 23 LYS 0.286 0.067 12 0 "[ . 1 . 2]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 LEU 0.031 0.017 5 0 "[ . 1 . 2]"
1 28 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 THR 0.012 0.010 18 0 "[ . 1 . 2]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ILE 0.012 0.010 18 0 "[ . 1 . 2]"
1 38 CYS 0.021 0.021 17 0 "[ . 1 . 2]"
1 47 HIS 0.021 0.021 17 0 "[ . 1 . 2]"
1 49 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 GLN 0.022 0.012 12 0 "[ . 1 . 2]"
1 54 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ALA 0.022 0.012 12 0 "[ . 1 . 2]"
1 58 VAL 1.303 0.149 10 0 "[ . 1 . 2]"
1 62 TYR 1.303 0.149 10 0 "[ . 1 . 2]"
1 68 MET 0.041 0.041 7 0 "[ . 1 . 2]"
1 69 ALA 0.372 0.060 10 0 "[ . 1 . 2]"
1 72 VAL 0.041 0.041 7 0 "[ . 1 . 2]"
1 73 ARG 0.372 0.060 10 0 "[ . 1 . 2]"
1 74 GLN 0.090 0.047 3 0 "[ . 1 . 2]"
1 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 TYR 0.090 0.047 3 0 "[ . 1 . 2]"
1 80 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 VAL 0.081 0.081 2 0 "[ . 1 . 2]"
1 100 GLU 0.081 0.081 2 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 18 PRO O 1 22 THR H 1.900 . 2.180 2.112 1.976 2.241 0.061 1 0 "[ . 1 . 2]" 2
2 1 18 PRO O 1 22 THR N 2.850 2.700 3.280 3.062 2.895 3.210 . 0 0 "[ . 1 . 2]" 2
3 1 19 ALA O 1 23 LYS H 1.900 . 2.180 2.151 1.968 2.247 0.067 12 0 "[ . 1 . 2]" 2
4 1 19 ALA O 1 23 LYS N 2.850 2.700 3.280 3.082 2.906 3.188 . 0 0 "[ . 1 . 2]" 2
5 1 20 PHE O 1 24 LEU H 1.900 . 2.180 2.019 1.977 2.143 . 0 0 "[ . 1 . 2]" 2
6 1 20 PHE O 1 24 LEU N 2.850 2.700 3.280 2.923 2.884 2.997 . 0 0 "[ . 1 . 2]" 2
7 1 21 LEU O 1 25 TRP H 1.900 . 2.180 2.017 1.934 2.141 . 0 0 "[ . 1 . 2]" 2
8 1 21 LEU O 1 25 TRP N 2.850 2.700 3.280 2.954 2.849 3.098 . 0 0 "[ . 1 . 2]" 2
9 1 23 LYS O 1 27 LEU H 1.900 . 2.180 2.098 2.011 2.197 0.017 5 0 "[ . 1 . 2]" 2
10 1 23 LYS O 1 27 LEU N 2.850 2.700 3.280 2.897 2.793 3.006 . 0 0 "[ . 1 . 2]" 2
11 1 24 LEU O 1 28 VAL H 1.900 . 2.180 1.974 1.902 2.035 . 0 0 "[ . 1 . 2]" 2
12 1 24 LEU O 1 28 VAL N 2.850 2.700 3.280 2.930 2.844 3.008 . 0 0 "[ . 1 . 2]" 2
13 1 33 THR O 1 37 ILE H 1.900 . 2.180 2.082 1.972 2.190 0.010 18 0 "[ . 1 . 2]" 2
14 1 33 THR O 1 37 ILE N 2.850 2.700 3.280 2.900 2.797 3.012 . 0 0 "[ . 1 . 2]" 2
15 1 38 CYS O 1 47 HIS H 1.900 . 2.180 2.014 1.931 2.201 0.021 17 0 "[ . 1 . 2]" 2
16 1 38 CYS O 1 47 HIS N 2.850 2.700 3.280 2.956 2.840 3.111 . 0 0 "[ . 1 . 2]" 2
17 1 36 LEU O 1 49 PHE H 1.900 . 2.180 1.963 1.841 2.050 . 0 0 "[ . 1 . 2]" 2
18 1 36 LEU O 1 49 PHE N 2.850 2.700 3.280 2.895 2.718 2.968 . 0 0 "[ . 1 . 2]" 2
19 1 50 ASP O 1 54 PHE H 1.900 . 2.180 1.913 1.877 1.941 . 0 0 "[ . 1 . 2]" 2
20 1 50 ASP O 1 54 PHE N 2.850 2.700 3.280 2.870 2.820 2.913 . 0 0 "[ . 1 . 2]" 2
21 1 51 GLN O 1 55 ALA H 1.900 . 2.180 2.140 2.046 2.192 0.012 12 0 "[ . 1 . 2]" 2
22 1 51 GLN O 1 55 ALA N 2.850 2.700 3.280 3.052 2.958 3.116 . 0 0 "[ . 1 . 2]" 2
23 1 54 PHE O 1 58 VAL H 1.900 . 2.180 2.090 2.008 2.176 . 0 0 "[ . 1 . 2]" 2
24 1 54 PHE O 1 58 VAL N 2.850 2.700 3.280 2.910 2.817 2.974 . 0 0 "[ . 1 . 2]" 2
25 1 58 VAL O 1 62 TYR H 1.900 . 2.180 2.234 2.067 2.329 0.149 10 0 "[ . 1 . 2]" 2
26 1 58 VAL O 1 62 TYR N 2.850 2.700 3.280 3.199 3.040 3.290 0.010 10 0 "[ . 1 . 2]" 2
27 1 68 MET O 1 72 VAL H 1.900 . 2.180 2.024 1.916 2.221 0.041 7 0 "[ . 1 . 2]" 2
28 1 68 MET O 1 72 VAL N 2.850 2.700 3.280 2.997 2.886 3.194 . 0 0 "[ . 1 . 2]" 2
29 1 69 ALA O 1 73 ARG H 1.900 . 2.180 2.176 2.066 2.240 0.060 10 0 "[ . 1 . 2]" 2
30 1 69 ALA O 1 73 ARG N 2.850 2.700 3.280 3.039 2.934 3.143 . 0 0 "[ . 1 . 2]" 2
31 1 72 VAL O 1 76 ASN H 1.900 . 2.180 2.021 1.931 2.097 . 0 0 "[ . 1 . 2]" 2
32 1 72 VAL O 1 76 ASN N 2.850 2.700 3.280 2.969 2.861 3.048 . 0 0 "[ . 1 . 2]" 2
33 1 74 GLN O 1 78 TYR H 1.900 . 2.180 2.102 1.990 2.227 0.047 3 0 "[ . 1 . 2]" 2
34 1 74 GLN O 1 78 TYR N 2.850 2.700 3.280 2.895 2.743 3.046 . 0 0 "[ . 1 . 2]" 2
35 1 75 LEU O 1 80 PHE H 1.900 . 2.180 1.957 1.902 2.018 . 0 0 "[ . 1 . 2]" 2
36 1 75 LEU O 1 80 PHE N 2.850 2.700 3.280 2.896 2.847 2.967 . 0 0 "[ . 1 . 2]" 2
37 1 83 VAL O 1 100 GLU H 1.900 . 2.180 2.026 1.914 2.261 0.081 2 0 "[ . 1 . 2]" 2
38 1 83 VAL O 1 100 GLU N 2.850 2.700 3.280 2.969 2.847 3.248 . 0 0 "[ . 1 . 2]" 2
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