NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
438720 |
2k5d   |
15829 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k5d
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 1635
_Distance_constraint_stats_list.Viol_count 646
_Distance_constraint_stats_list.Viol_total 531.920
_Distance_constraint_stats_list.Viol_max 0.243
_Distance_constraint_stats_list.Viol_rms 0.0076
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0412
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 MET 0.245 0.153 17 0 "[ . 1 . 2]"
1 3 ARG 0.449 0.092 1 0 "[ . 1 . 2]"
1 4 LEU 1.363 0.153 17 0 "[ . 1 . 2]"
1 5 ALA 0.423 0.107 18 0 "[ . 1 . 2]"
1 6 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.053 0.044 19 0 "[ . 1 . 2]"
1 8 ILE 0.173 0.072 11 0 "[ . 1 . 2]"
1 9 VAL 0.324 0.072 11 0 "[ . 1 . 2]"
1 10 LEU 1.116 0.118 10 0 "[ . 1 . 2]"
1 11 ASP 0.550 0.107 6 0 "[ . 1 . 2]"
1 12 LYS 0.285 0.075 10 0 "[ . 1 . 2]"
1 13 ASP 0.741 0.142 6 0 "[ . 1 . 2]"
1 14 THR 0.606 0.142 6 0 "[ . 1 . 2]"
1 15 THR 0.097 0.081 10 0 "[ . 1 . 2]"
1 16 PHE 0.470 0.073 1 0 "[ . 1 . 2]"
1 17 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 GLU 0.532 0.118 6 0 "[ . 1 . 2]"
1 19 LEU 0.176 0.083 2 0 "[ . 1 . 2]"
1 20 LYS 0.467 0.072 14 0 "[ . 1 . 2]"
1 21 PHE 0.105 0.045 4 0 "[ . 1 . 2]"
1 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ALA 0.059 0.045 4 0 "[ . 1 . 2]"
1 24 LEU 0.654 0.069 12 0 "[ . 1 . 2]"
1 25 ARG 0.036 0.029 1 0 "[ . 1 . 2]"
1 26 ARG 1.864 0.110 17 0 "[ . 1 . 2]"
1 27 GLU 0.427 0.068 12 0 "[ . 1 . 2]"
1 28 VAL 0.242 0.038 11 0 "[ . 1 . 2]"
1 29 ARG 0.922 0.109 8 0 "[ . 1 . 2]"
1 30 ILE 1.743 0.120 11 0 "[ . 1 . 2]"
1 31 GLN 0.355 0.039 11 0 "[ . 1 . 2]"
1 32 ASN 0.147 0.086 7 0 "[ . 1 . 2]"
1 33 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ASP 0.016 0.016 1 0 "[ . 1 . 2]"
1 35 GLY 0.002 0.002 2 0 "[ . 1 . 2]"
1 36 SER 0.974 0.136 10 0 "[ . 1 . 2]"
1 37 VAL 1.419 0.136 10 0 "[ . 1 . 2]"
1 38 SER 0.577 0.086 7 0 "[ . 1 . 2]"
1 39 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLU 0.422 0.123 9 0 "[ . 1 . 2]"
1 41 ILE 2.015 0.123 9 0 "[ . 1 . 2]"
1 42 LYS 0.923 0.243 11 0 "[ . 1 . 2]"
1 43 GLU 0.983 0.139 1 0 "[ . 1 . 2]"
1 44 ARG 0.234 0.075 1 0 "[ . 1 . 2]"
1 45 THR 1.250 0.110 17 0 "[ . 1 . 2]"
1 46 TYR 0.570 0.069 12 0 "[ . 1 . 2]"
1 47 ASP 0.014 0.014 12 0 "[ . 1 . 2]"
1 48 LEU 0.188 0.052 8 0 "[ . 1 . 2]"
1 49 LYS 0.177 0.052 8 0 "[ . 1 . 2]"
1 50 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 ILE 0.306 0.059 5 0 "[ . 1 . 2]"
1 58 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 VAL 0.023 0.017 4 0 "[ . 1 . 2]"
1 60 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ILE 0.127 0.055 3 0 "[ . 1 . 2]"
1 62 PRO 0.098 0.056 7 0 "[ . 1 . 2]"
1 63 ALA 0.098 0.056 7 0 "[ . 1 . 2]"
1 64 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 VAL 0.055 0.044 16 0 "[ . 1 . 2]"
1 66 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 LEU 1.126 0.231 8 0 "[ . 1 . 2]"
1 68 LYS 2.446 0.231 8 0 "[ . 1 . 2]"
1 69 GLU 1.270 0.163 4 0 "[ . 1 . 2]"
1 70 PHE 0.311 0.062 10 0 "[ . 1 . 2]"
1 71 ASP 0.111 0.044 13 0 "[ . 1 . 2]"
1 72 TYR 0.007 0.007 9 0 "[ . 1 . 2]"
1 73 ASN 0.474 0.072 14 0 "[ . 1 . 2]"
1 74 ALA 0.121 0.044 13 0 "[ . 1 . 2]"
1 75 ARG 0.252 0.078 10 0 "[ . 1 . 2]"
1 76 VAL 0.246 0.060 3 0 "[ . 1 . 2]"
1 77 GLU 0.510 0.049 20 0 "[ . 1 . 2]"
1 78 LEU 1.736 0.122 19 0 "[ . 1 . 2]"
1 79 ILE 1.218 0.082 20 0 "[ . 1 . 2]"
1 80 ASN 0.442 0.057 5 0 "[ . 1 . 2]"
1 81 PRO 0.120 0.030 13 0 "[ . 1 . 2]"
1 82 ILE 0.582 0.095 7 0 "[ . 1 . 2]"
1 83 ALA 0.273 0.062 19 0 "[ . 1 . 2]"
1 84 ASP 0.412 0.095 7 0 "[ . 1 . 2]"
1 85 THR 0.249 0.148 12 0 "[ . 1 . 2]"
1 86 VAL 0.312 0.148 12 0 "[ . 1 . 2]"
1 87 ALA 0.487 0.071 5 0 "[ . 1 . 2]"
1 88 THR 0.101 0.101 14 0 "[ . 1 . 2]"
1 89 ALA 0.744 0.156 19 0 "[ . 1 . 2]"
1 90 THR 0.368 0.156 19 0 "[ . 1 . 2]"
1 91 TYR 0.689 0.113 8 0 "[ . 1 . 2]"
1 92 GLN 0.055 0.055 20 0 "[ . 1 . 2]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ALA 0.126 0.089 9 0 "[ . 1 . 2]"
1 95 ASP 0.126 0.089 9 0 "[ . 1 . 2]"
1 96 VAL 0.066 0.039 4 0 "[ . 1 . 2]"
1 97 ASP 0.066 0.039 4 0 "[ . 1 . 2]"
1 98 TRP 1.332 0.105 19 0 "[ . 1 . 2]"
1 99 TYR 0.604 0.106 19 0 "[ . 1 . 2]"
1 100 ILE 2.049 0.172 8 0 "[ . 1 . 2]"
1 101 LYS 0.647 0.172 8 0 "[ . 1 . 2]"
1 102 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ASP 0.040 0.017 5 0 "[ . 1 . 2]"
1 104 ASP 1.136 0.122 19 0 "[ . 1 . 2]"
1 105 ILE 0.508 0.114 14 0 "[ . 1 . 2]"
1 106 VAL 0.025 0.016 18 0 "[ . 1 . 2]"
1 107 LEU 0.186 0.034 5 0 "[ . 1 . 2]"
1 108 THR 0.990 0.113 13 0 "[ . 1 . 2]"
1 109 LEU 1.216 0.164 13 0 "[ . 1 . 2]"
1 110 GLU 0.453 0.149 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 32 ASN HD22 1 38 SER HA 4.390 . 4.830 3.028 2.187 3.577 . 0 0 "[ . 1 . 2]" 1
2 1 32 ASN HD21 1 38 SER HA 4.390 . 4.830 4.190 3.193 4.916 0.086 7 0 "[ . 1 . 2]" 1
3 1 32 ASN HD22 1 38 SER HB2 4.510 . 4.960 2.328 1.796 3.339 0.004 18 0 "[ . 1 . 2]" 1
4 1 32 ASN HD21 1 38 SER HB2 4.510 . 4.960 3.727 3.022 4.792 . 0 0 "[ . 1 . 2]" 1
5 1 32 ASN HA 1 32 ASN HD22 4.560 . 5.020 4.527 4.395 4.724 . 0 0 "[ . 1 . 2]" 1
6 1 32 ASN HA 1 32 ASN HD21 4.560 . 5.020 4.146 3.943 4.489 . 0 0 "[ . 1 . 2]" 1
7 1 72 TYR QE 1 73 ASN HD21 4.240 . 4.660 3.505 2.987 4.667 0.007 9 0 "[ . 1 . 2]" 1
8 1 72 TYR QE 1 73 ASN HD22 4.240 . 4.660 2.828 2.151 3.552 . 0 0 "[ . 1 . 2]" 1
9 1 31 GLN HE21 1 35 GLY HA2 4.640 . 5.100 3.216 2.596 4.153 . 0 0 "[ . 1 . 2]" 1
10 1 2 MET HA 1 3 ARG H 3.100 . 3.410 2.293 2.145 2.588 . 0 0 "[ . 1 . 2]" 1
11 1 30 ILE H 1 38 SER HB3 4.240 . 4.660 3.667 3.436 4.092 . 0 0 "[ . 1 . 2]" 1
12 1 38 SER HA 1 39 ASP H 2.810 . 3.090 2.422 2.291 2.583 . 0 0 "[ . 1 . 2]" 1
13 1 44 ARG HA 1 45 THR H 3.360 . 3.700 2.156 2.119 2.202 . 0 0 "[ . 1 . 2]" 1
14 1 20 LYS HA 1 76 VAL H 4.370 . 4.810 3.127 2.546 3.753 . 0 0 "[ . 1 . 2]" 1
15 1 5 ALA H 1 5 ALA MB 3.320 . 3.650 2.441 2.225 2.972 . 0 0 "[ . 1 . 2]" 1
16 1 8 ILE H 1 8 ILE HB 3.770 . 4.150 3.720 3.623 3.867 . 0 0 "[ . 1 . 2]" 1
17 1 9 VAL H 1 9 VAL HB 3.360 . 3.700 2.706 2.492 3.445 . 0 0 "[ . 1 . 2]" 1
18 1 14 THR H 1 14 THR HB 3.840 . 4.220 3.318 2.598 3.852 . 0 0 "[ . 1 . 2]" 1
19 1 15 THR H 1 15 THR HB 3.910 . 4.300 3.391 2.541 3.828 . 0 0 "[ . 1 . 2]" 1
20 1 28 VAL H 1 28 VAL HB 3.830 . 4.210 3.664 3.632 3.715 . 0 0 "[ . 1 . 2]" 1
21 1 30 ILE H 1 30 ILE HB 3.200 . 3.520 2.546 2.502 2.603 . 0 0 "[ . 1 . 2]" 1
22 1 37 VAL H 1 37 VAL HB 3.170 . 3.490 2.583 2.526 2.648 . 0 0 "[ . 1 . 2]" 1
23 1 41 ILE H 1 41 ILE HB 3.260 . 3.590 2.618 2.534 2.722 . 0 0 "[ . 1 . 2]" 1
24 1 45 THR H 1 45 THR HB 3.790 . 4.170 2.570 2.480 2.669 . 0 0 "[ . 1 . 2]" 1
25 1 59 VAL H 1 59 VAL HB 4.010 . 4.410 2.523 2.464 2.594 . 0 0 "[ . 1 . 2]" 1
26 1 63 ALA H 1 63 ALA MB 3.230 . 3.550 2.232 2.217 2.244 . 0 0 "[ . 1 . 2]" 1
27 1 65 VAL H 1 65 VAL HB 3.390 . 3.730 2.562 2.499 2.687 . 0 0 "[ . 1 . 2]" 1
28 1 74 ALA H 1 74 ALA MB 3.030 . 3.330 2.268 2.245 2.301 . 0 0 "[ . 1 . 2]" 1
29 1 79 ILE H 1 79 ILE HB 3.860 . 4.250 2.513 2.386 2.616 . 0 0 "[ . 1 . 2]" 1
30 1 82 ILE H 1 82 ILE HB 4.030 . 4.430 3.882 3.824 3.916 . 0 0 "[ . 1 . 2]" 1
31 1 83 ALA H 1 83 ALA MB 3.340 . 3.670 2.282 2.256 2.374 . 0 0 "[ . 1 . 2]" 1
32 1 86 VAL H 1 86 VAL HB 3.850 . 4.230 3.375 2.509 3.871 . 0 0 "[ . 1 . 2]" 1
33 1 87 ALA H 1 87 ALA MB 3.270 . 3.600 2.358 2.210 3.031 . 0 0 "[ . 1 . 2]" 1
34 1 89 ALA H 1 89 ALA MB 3.370 . 3.710 2.354 2.225 2.920 . 0 0 "[ . 1 . 2]" 1
35 1 90 THR H 1 90 THR HB 3.800 . 4.180 3.046 2.546 3.736 . 0 0 "[ . 1 . 2]" 1
36 1 94 ALA H 1 94 ALA MB 3.090 . 3.400 2.480 2.242 3.006 . 0 0 "[ . 1 . 2]" 1
37 1 96 VAL H 1 96 VAL HB 3.850 . 4.230 3.205 2.530 3.867 . 0 0 "[ . 1 . 2]" 1
38 1 105 ILE H 1 105 ILE HB 3.910 . 4.300 2.696 2.529 2.767 . 0 0 "[ . 1 . 2]" 1
39 1 108 THR H 1 108 THR HB 3.740 . 4.110 2.686 2.598 2.861 . 0 0 "[ . 1 . 2]" 1
40 1 3 ARG H 1 3 ARG HB2 3.800 . 4.180 2.835 2.366 3.888 . 0 0 "[ . 1 . 2]" 1
41 1 11 ASP H 1 11 ASP HB2 3.870 . 4.260 2.925 2.278 4.052 . 0 0 "[ . 1 . 2]" 1
42 1 13 ASP H 1 13 ASP QB 3.290 . 3.620 2.616 2.266 3.424 . 0 0 "[ . 1 . 2]" 1
43 1 16 PHE H 1 16 PHE HB2 4.170 . 4.590 2.685 2.312 3.695 . 0 0 "[ . 1 . 2]" 1
44 1 18 GLU H 1 18 GLU QB 3.080 . 3.390 2.572 2.202 3.034 . 0 0 "[ . 1 . 2]" 1
45 1 21 PHE H 1 21 PHE HB3 3.890 . 4.280 2.473 2.315 2.592 . 0 0 "[ . 1 . 2]" 1
46 1 24 LEU H 1 24 LEU HB2 3.510 . 3.860 2.774 2.601 2.903 . 0 0 "[ . 1 . 2]" 1
47 1 27 GLU H 1 27 GLU HB3 3.960 . 4.360 3.698 3.661 3.747 . 0 0 "[ . 1 . 2]" 1
48 1 29 ARG H 1 29 ARG HB2 3.790 . 4.170 2.489 2.316 2.690 . 0 0 "[ . 1 . 2]" 1
49 1 31 GLN H 1 31 GLN HB3 3.440 . 3.780 2.531 2.440 2.693 . 0 0 "[ . 1 . 2]" 1
50 1 33 GLU H 1 33 GLU QB 3.120 . 3.430 2.484 2.260 2.830 . 0 0 "[ . 1 . 2]" 1
51 1 34 ASP H 1 34 ASP HB2 3.600 . 3.960 2.560 2.412 2.647 . 0 0 "[ . 1 . 2]" 1
52 1 36 SER H 1 36 SER HB2 3.970 . 4.370 2.849 2.451 3.644 . 0 0 "[ . 1 . 2]" 1
53 1 42 LYS H 1 42 LYS HB2 3.820 . 4.200 2.596 2.337 2.937 . 0 0 "[ . 1 . 2]" 1
54 1 49 LYS H 1 49 LYS HB2 4.200 . 4.620 2.670 2.223 3.740 . 0 0 "[ . 1 . 2]" 1
55 1 55 ARG H 1 55 ARG HB2 4.150 . 4.570 3.133 2.252 3.932 . 0 0 "[ . 1 . 2]" 1
56 1 60 SER H 1 60 SER HB2 4.200 . 4.620 2.960 2.536 3.824 . 0 0 "[ . 1 . 2]" 1
57 1 64 SER H 1 64 SER HB2 4.150 . 4.570 2.816 2.467 3.606 . 0 0 "[ . 1 . 2]" 1
58 1 67 LEU H 1 67 LEU HB2 3.370 . 3.710 2.513 2.338 2.604 . 0 0 "[ . 1 . 2]" 1
59 1 68 LYS H 1 68 LYS HB3 4.090 . 4.500 3.587 3.429 3.731 . 0 0 "[ . 1 . 2]" 1
60 1 69 GLU H 1 69 GLU HB3 4.180 . 4.600 3.855 3.574 4.093 . 0 0 "[ . 1 . 2]" 1
61 1 70 PHE H 1 70 PHE HB2 3.800 . 4.180 2.472 2.372 2.561 . 0 0 "[ . 1 . 2]" 1
62 1 71 ASP H 1 71 ASP HB2 3.620 . 3.980 2.680 2.307 3.606 . 0 0 "[ . 1 . 2]" 1
63 1 72 TYR H 1 72 TYR HB2 3.480 . 3.830 2.478 2.374 2.596 . 0 0 "[ . 1 . 2]" 1
64 1 75 ARG H 1 75 ARG HB2 3.700 . 4.070 2.442 2.203 2.673 . 0 0 "[ . 1 . 2]" 1
65 1 77 GLU H 1 77 GLU HB2 4.140 . 4.550 3.861 3.782 4.011 . 0 0 "[ . 1 . 2]" 1
66 1 78 LEU H 1 78 LEU HB2 4.130 . 4.540 2.506 2.446 2.600 . 0 0 "[ . 1 . 2]" 1
67 1 84 ASP H 1 84 ASP HB2 3.770 . 4.150 2.599 2.301 3.683 . 0 0 "[ . 1 . 2]" 1
68 1 91 TYR H 1 91 TYR HB2 3.890 . 4.280 2.497 2.294 2.711 . 0 0 "[ . 1 . 2]" 1
69 1 92 GLN H 1 92 GLN HB2 3.730 . 4.100 2.789 2.410 3.668 . 0 0 "[ . 1 . 2]" 1
70 1 95 ASP H 1 95 ASP HB2 3.980 . 4.380 2.735 2.448 3.605 . 0 0 "[ . 1 . 2]" 1
71 1 97 ASP H 1 97 ASP QB 3.600 . 3.960 2.583 2.188 3.289 . 0 0 "[ . 1 . 2]" 1
72 1 103 ASP H 1 103 ASP HB3 3.650 . 4.020 2.506 2.404 2.625 . 0 0 "[ . 1 . 2]" 1
73 1 103 ASP HB3 1 104 ASP H 3.800 . 4.180 2.601 2.071 3.063 . 0 0 "[ . 1 . 2]" 1
74 1 107 LEU H 1 107 LEU HB2 3.670 . 4.040 2.428 2.346 2.468 . 0 0 "[ . 1 . 2]" 1
75 1 109 LEU H 1 109 LEU HG 3.130 . 3.440 2.432 2.073 3.053 . 0 0 "[ . 1 . 2]" 1
76 1 110 GLU H 1 110 GLU HB2 3.820 . 4.200 2.903 2.392 3.971 . 0 0 "[ . 1 . 2]" 1
77 1 3 ARG H 1 3 ARG HB3 3.800 . 4.180 2.965 2.393 3.699 . 0 0 "[ . 1 . 2]" 1
78 1 11 ASP H 1 11 ASP HB3 3.870 . 4.260 3.095 2.452 3.697 . 0 0 "[ . 1 . 2]" 1
79 1 16 PHE H 1 16 PHE HB3 4.170 . 4.590 3.704 3.579 4.046 . 0 0 "[ . 1 . 2]" 1
80 1 20 LYS H 1 20 LYS HG2 4.680 . 5.150 3.953 2.787 4.894 . 0 0 "[ . 1 . 2]" 1
81 1 21 PHE H 1 21 PHE HB2 3.850 . 4.230 2.565 2.393 2.770 . 0 0 "[ . 1 . 2]" 1
82 1 24 LEU H 1 24 LEU HB3 3.620 . 3.980 2.429 2.347 2.508 . 0 0 "[ . 1 . 2]" 1
83 1 25 ARG QB 1 26 ARG H 4.010 . 4.410 2.276 2.145 2.457 . 0 0 "[ . 1 . 2]" 1
84 1 27 GLU H 1 27 GLU HB2 3.520 . 3.870 2.570 2.510 2.618 . 0 0 "[ . 1 . 2]" 1
85 1 29 ARG H 1 29 ARG HB3 3.790 . 4.170 3.663 3.582 3.755 . 0 0 "[ . 1 . 2]" 1
86 1 31 GLN H 1 31 GLN HB2 3.270 . 3.600 2.729 2.575 2.926 . 0 0 "[ . 1 . 2]" 1
87 1 32 ASN H 1 32 ASN HB2 3.250 . 3.580 2.527 2.441 2.659 . 0 0 "[ . 1 . 2]" 1
88 1 34 ASP H 1 34 ASP HB3 3.600 . 3.960 3.239 2.346 3.608 . 0 0 "[ . 1 . 2]" 1
89 1 36 SER H 1 36 SER HB3 3.970 . 4.370 3.349 2.590 3.678 . 0 0 "[ . 1 . 2]" 1
90 1 38 SER H 1 38 SER HB3 3.450 . 3.790 2.490 2.434 2.574 . 0 0 "[ . 1 . 2]" 1
91 1 39 ASP H 1 39 ASP HB3 3.600 . 3.960 3.381 2.583 3.633 . 0 0 "[ . 1 . 2]" 1
92 1 40 GLU H 1 40 GLU QB 2.940 . 3.230 2.422 2.255 2.540 . 0 0 "[ . 1 . 2]" 1
93 1 42 LYS H 1 42 LYS HB3 3.820 . 4.200 2.934 2.430 3.636 . 0 0 "[ . 1 . 2]" 1
94 1 46 TYR HB3 1 47 ASP H 4.340 . 4.770 2.685 2.345 2.966 . 0 0 "[ . 1 . 2]" 1
95 1 55 ARG H 1 55 ARG HB3 4.150 . 4.570 3.459 2.725 3.893 . 0 0 "[ . 1 . 2]" 1
96 1 57 ILE HB 1 58 GLN H 3.820 . 4.200 3.078 2.866 3.477 . 0 0 "[ . 1 . 2]" 1
97 1 60 SER H 1 60 SER HB3 4.200 . 4.620 3.155 2.586 3.822 . 0 0 "[ . 1 . 2]" 1
98 1 64 SER H 1 64 SER HB3 4.150 . 4.570 3.050 2.503 3.630 . 0 0 "[ . 1 . 2]" 1
99 1 67 LEU H 1 67 LEU HB3 3.370 . 3.710 2.503 2.430 2.678 . 0 0 "[ . 1 . 2]" 1
100 1 69 GLU H 1 69 GLU HB2 3.590 . 3.950 3.003 2.375 3.573 . 0 0 "[ . 1 . 2]" 1
101 1 70 PHE H 1 70 PHE HB3 3.800 . 4.180 3.632 3.603 3.722 . 0 0 "[ . 1 . 2]" 1
102 1 71 ASP H 1 71 ASP HB3 3.620 . 3.980 3.121 2.367 3.629 . 0 0 "[ . 1 . 2]" 1
103 1 72 TYR H 1 72 TYR HB3 3.480 . 3.830 2.582 2.444 2.718 . 0 0 "[ . 1 . 2]" 1
104 1 75 ARG H 1 75 ARG HB3 3.700 . 4.070 3.590 3.506 3.634 . 0 0 "[ . 1 . 2]" 1
105 1 77 GLU H 1 77 GLU HB3 4.140 . 4.550 3.258 3.124 3.453 . 0 0 "[ . 1 . 2]" 1
106 1 78 LEU H 1 78 LEU HB3 4.130 . 4.540 3.682 3.648 3.747 . 0 0 "[ . 1 . 2]" 1
107 1 80 ASN H 1 103 ASP HB3 5.110 . 5.620 3.291 1.982 5.442 . 0 0 "[ . 1 . 2]" 1
108 1 84 ASP H 1 84 ASP HB3 3.770 . 4.150 2.842 2.516 3.725 . 0 0 "[ . 1 . 2]" 1
109 1 91 TYR H 1 91 TYR HB3 3.890 . 4.280 3.655 3.564 3.792 . 0 0 "[ . 1 . 2]" 1
110 1 92 GLN H 1 92 GLN HB3 3.730 . 4.100 3.063 2.441 3.690 . 0 0 "[ . 1 . 2]" 1
111 1 103 ASP H 1 103 ASP HB2 3.840 . 4.220 2.535 2.419 2.690 . 0 0 "[ . 1 . 2]" 1
112 1 107 LEU H 1 107 LEU HB3 3.670 . 4.040 3.615 3.586 3.638 . 0 0 "[ . 1 . 2]" 1
113 1 109 LEU H 1 109 LEU HB3 3.950 . 4.350 3.593 2.630 4.082 . 0 0 "[ . 1 . 2]" 1
114 1 110 GLU H 1 110 GLU HB3 3.820 . 4.200 3.379 2.439 3.765 . 0 0 "[ . 1 . 2]" 1
115 1 5 ALA H 1 6 ASN H 4.580 . 5.040 3.938 2.501 4.621 . 0 0 "[ . 1 . 2]" 1
116 1 15 THR H 1 16 PHE H 4.260 . 4.690 3.729 2.184 4.630 . 0 0 "[ . 1 . 2]" 1
117 1 23 ALA H 1 24 LEU H 4.640 . 5.100 4.402 4.385 4.417 . 0 0 "[ . 1 . 2]" 1
118 1 25 ARG H 1 26 ARG H 3.890 . 4.280 2.788 2.606 2.957 . 0 0 "[ . 1 . 2]" 1
119 1 26 ARG H 1 27 GLU H 4.670 . 5.140 4.159 4.026 4.275 . 0 0 "[ . 1 . 2]" 1
120 1 27 GLU H 1 28 VAL H 4.200 . 4.620 4.203 4.087 4.344 . 0 0 "[ . 1 . 2]" 1
121 1 28 VAL H 1 29 ARG H 4.840 . 5.320 4.444 4.145 4.625 . 0 0 "[ . 1 . 2]" 1
122 1 29 ARG H 1 30 ILE H 4.650 . 5.120 4.552 4.457 4.610 . 0 0 "[ . 1 . 2]" 1
123 1 30 ILE H 1 31 GLN H 4.630 . 5.090 4.448 4.250 4.639 . 0 0 "[ . 1 . 2]" 1
124 1 31 GLN H 1 32 ASN H 4.530 . 4.980 4.486 4.378 4.623 . 0 0 "[ . 1 . 2]" 1
125 1 32 ASN H 1 33 GLU H 4.770 . 5.250 4.631 4.575 4.664 . 0 0 "[ . 1 . 2]" 1
126 1 33 GLU H 1 34 ASP H 3.800 . 4.180 2.695 2.506 2.868 . 0 0 "[ . 1 . 2]" 1
127 1 35 GLY H 1 36 SER H 3.340 . 3.670 2.733 2.256 3.421 . 0 0 "[ . 1 . 2]" 1
128 1 39 ASP H 1 40 GLU H 3.140 . 3.450 2.472 2.287 2.660 . 0 0 "[ . 1 . 2]" 1
129 1 40 GLU H 1 41 ILE H 4.620 . 5.080 4.616 4.530 4.641 . 0 0 "[ . 1 . 2]" 1
130 1 42 LYS H 1 43 GLU H 3.460 . 3.810 2.534 2.367 2.702 . 0 0 "[ . 1 . 2]" 1
131 1 43 GLU H 1 44 ARG H 4.400 . 4.840 4.404 4.361 4.441 . 0 0 "[ . 1 . 2]" 1
132 1 49 LYS H 1 50 SER H 5.080 . 5.590 4.520 4.331 4.617 . 0 0 "[ . 1 . 2]" 1
133 1 50 SER H 1 57 ILE H 5.360 . 5.900 4.381 3.412 4.939 . 0 0 "[ . 1 . 2]" 1
134 1 53 GLN H 1 54 GLY H 4.240 . 4.660 2.469 2.030 3.174 . 0 0 "[ . 1 . 2]" 1
135 1 54 GLY H 1 55 ARG H 3.850 . 4.230 2.646 2.247 2.974 . 0 0 "[ . 1 . 2]" 1
136 1 55 ARG H 1 56 MET H 4.840 . 5.320 4.493 4.312 4.624 . 0 0 "[ . 1 . 2]" 1
137 1 59 VAL H 1 60 SER H 4.780 . 5.260 4.456 4.316 4.544 . 0 0 "[ . 1 . 2]" 1
138 1 63 ALA H 1 64 SER H 3.160 . 3.480 2.760 2.659 2.981 . 0 0 "[ . 1 . 2]" 1
139 1 64 SER H 1 65 VAL H 3.470 . 3.820 2.661 2.464 2.830 . 0 0 "[ . 1 . 2]" 1
140 1 68 LYS H 1 69 GLU H 4.790 . 5.270 3.569 2.578 4.533 . 0 0 "[ . 1 . 2]" 1
141 1 69 GLU H 1 70 PHE H 3.610 . 3.970 3.106 2.498 3.920 . 0 0 "[ . 1 . 2]" 1
142 1 73 ASN H 1 74 ALA H 3.680 . 4.050 2.641 2.462 2.732 . 0 0 "[ . 1 . 2]" 1
143 1 77 GLU H 1 108 THR H 4.260 . 4.690 3.627 3.207 4.304 . 0 0 "[ . 1 . 2]" 1
144 1 84 ASP H 1 85 THR H 4.680 . 5.150 4.365 2.745 4.639 . 0 0 "[ . 1 . 2]" 1
145 1 85 THR H 1 86 VAL H 3.720 . 4.090 2.552 1.764 4.123 0.036 13 0 "[ . 1 . 2]" 1
146 1 87 ALA H 1 88 THR H 4.050 . 4.460 2.916 2.352 4.016 . 0 0 "[ . 1 . 2]" 1
147 1 91 TYR H 1 92 GLN H 4.620 . 5.080 3.999 2.403 4.649 . 0 0 "[ . 1 . 2]" 1
148 1 92 GLN H 1 93 GLY H 4.660 . 5.130 3.676 2.129 4.637 . 0 0 "[ . 1 . 2]" 1
149 1 94 ALA H 1 95 ASP H 4.170 . 4.590 3.134 1.793 4.602 0.012 6 0 "[ . 1 . 2]" 1
150 1 99 TYR H 1 100 ILE H 4.740 . 5.210 4.431 4.293 4.537 . 0 0 "[ . 1 . 2]" 1
151 1 60 SER H 1 102 ALA H 4.710 . 5.180 3.713 3.083 4.114 . 0 0 "[ . 1 . 2]" 1
152 1 101 LYS H 1 102 ALA H 5.220 . 5.740 4.552 4.430 4.618 . 0 0 "[ . 1 . 2]" 1
153 1 102 ALA H 1 103 ASP H 4.680 . 5.150 4.462 4.370 4.522 . 0 0 "[ . 1 . 2]" 1
154 1 103 ASP H 1 104 ASP H 3.480 . 3.830 2.641 2.359 2.898 . 0 0 "[ . 1 . 2]" 1
155 1 106 VAL H 1 107 LEU H 4.580 . 5.040 4.477 4.446 4.506 . 0 0 "[ . 1 . 2]" 1
156 1 108 THR H 1 109 LEU H 4.750 . 5.220 4.564 4.310 4.656 . 0 0 "[ . 1 . 2]" 1
157 1 109 LEU H 1 110 GLU H 3.970 . 4.370 3.285 2.421 4.359 . 0 0 "[ . 1 . 2]" 1
158 1 3 ARG HA 1 4 LEU H 3.420 . 3.760 2.489 2.112 3.393 . 0 0 "[ . 1 . 2]" 1
159 1 8 ILE HA 1 9 VAL H 2.950 . 3.250 2.408 2.162 2.717 . 0 0 "[ . 1 . 2]" 1
160 1 9 VAL HA 1 10 LEU H 3.430 . 3.770 2.469 2.142 3.585 . 0 0 "[ . 1 . 2]" 1
161 1 18 GLU HA 1 19 LEU H 3.350 . 3.690 2.162 2.118 2.195 . 0 0 "[ . 1 . 2]" 1
162 1 19 LEU HA 1 20 LYS H 3.450 . 3.790 2.236 2.158 2.498 . 0 0 "[ . 1 . 2]" 1
163 1 21 PHE HA 1 22 SER H 3.520 . 3.870 2.222 2.178 2.329 . 0 0 "[ . 1 . 2]" 1
164 1 23 ALA HA 1 24 LEU H 3.260 . 3.590 2.524 2.364 2.661 . 0 0 "[ . 1 . 2]" 1
165 1 26 ARG HA 1 27 GLU H 3.010 . 3.310 2.200 2.144 2.231 . 0 0 "[ . 1 . 2]" 1
166 1 27 GLU HA 1 28 VAL H 3.360 . 3.700 2.221 2.173 2.258 . 0 0 "[ . 1 . 2]" 1
167 1 28 VAL HA 1 29 ARG H 2.990 . 3.290 2.165 2.132 2.239 . 0 0 "[ . 1 . 2]" 1
168 1 29 ARG HA 1 30 ILE H 3.370 . 3.710 2.422 2.278 2.621 . 0 0 "[ . 1 . 2]" 1
169 1 30 ILE HA 1 31 GLN H 2.780 . 3.060 2.193 2.144 2.263 . 0 0 "[ . 1 . 2]" 1
170 1 31 GLN HA 1 32 ASN H 2.860 . 3.150 2.172 2.126 2.282 . 0 0 "[ . 1 . 2]" 1
171 1 32 ASN HA 1 33 GLU H 3.180 . 3.500 2.350 2.249 2.503 . 0 0 "[ . 1 . 2]" 1
172 1 36 SER HA 1 37 VAL H 2.880 . 3.170 2.309 2.203 2.446 . 0 0 "[ . 1 . 2]" 1
173 1 37 VAL HA 1 38 SER H 2.830 . 3.110 2.220 2.154 2.321 . 0 0 "[ . 1 . 2]" 1
174 1 40 GLU HA 1 41 ILE H 2.940 . 3.230 2.238 2.173 2.330 . 0 0 "[ . 1 . 2]" 1
175 1 41 ILE HA 1 42 LYS H 3.550 . 3.900 2.258 2.198 2.326 . 0 0 "[ . 1 . 2]" 1
176 1 43 GLU HA 1 44 ARG H 3.240 . 3.560 2.422 2.210 2.518 . 0 0 "[ . 1 . 2]" 1
177 1 47 ASP HA 1 48 LEU H 3.300 . 3.630 2.190 2.146 2.236 . 0 0 "[ . 1 . 2]" 1
178 1 55 ARG HA 1 56 MET H 3.350 . 3.690 2.335 2.154 2.600 . 0 0 "[ . 1 . 2]" 1
179 1 58 GLN HA 1 59 VAL H 3.470 . 3.820 2.164 2.119 2.197 . 0 0 "[ . 1 . 2]" 1
180 1 62 PRO HA 1 63 ALA H 3.300 . 3.630 2.253 2.172 2.319 . 0 0 "[ . 1 . 2]" 1
181 1 66 PRO HA 1 67 LEU H 3.170 . 3.490 2.313 2.152 2.615 . 0 0 "[ . 1 . 2]" 1
182 1 69 GLU HA 1 70 PHE H 3.160 . 3.480 2.722 2.361 3.046 . 0 0 "[ . 1 . 2]" 1
183 1 70 PHE HA 1 71 ASP H 3.110 . 3.420 2.475 2.280 2.770 . 0 0 "[ . 1 . 2]" 1
184 1 71 ASP HA 1 72 TYR H 3.050 . 3.360 2.368 2.209 2.535 . 0 0 "[ . 1 . 2]" 1
185 1 72 TYR HA 1 73 ASN H 3.480 . 3.830 2.288 2.118 3.530 . 0 0 "[ . 1 . 2]" 1
186 1 73 ASN HA 1 74 ALA H 3.530 . 3.880 3.038 2.875 3.250 . 0 0 "[ . 1 . 2]" 1
187 1 74 ALA HA 1 75 ARG H 3.110 . 3.420 2.226 2.146 2.311 . 0 0 "[ . 1 . 2]" 1
188 1 75 ARG HA 1 76 VAL H 3.440 . 3.780 2.164 2.110 2.224 . 0 0 "[ . 1 . 2]" 1
189 1 76 VAL HA 1 77 GLU H 3.510 . 3.860 2.292 2.197 2.510 . 0 0 "[ . 1 . 2]" 1
190 1 77 GLU HA 1 78 LEU H 3.300 . 3.630 2.398 2.293 2.666 . 0 0 "[ . 1 . 2]" 1
191 1 78 LEU HA 1 79 ILE H 3.430 . 3.770 2.186 2.127 2.250 . 0 0 "[ . 1 . 2]" 1
192 1 81 PRO HA 1 82 ILE H 3.400 . 3.740 2.212 2.167 2.279 . 0 0 "[ . 1 . 2]" 1
193 1 82 ILE HA 1 83 ALA H 3.270 . 3.600 2.224 2.165 2.418 . 0 0 "[ . 1 . 2]" 1
194 1 83 ALA HA 1 84 ASP H 3.390 . 3.730 2.197 2.168 2.295 . 0 0 "[ . 1 . 2]" 1
195 1 84 ASP HA 1 85 THR H 3.510 . 3.860 2.400 2.122 3.574 . 0 0 "[ . 1 . 2]" 1
196 1 86 VAL HA 1 87 ALA H 3.550 . 3.900 3.103 2.154 3.570 . 0 0 "[ . 1 . 2]" 1
197 1 88 THR HA 1 89 ALA H 3.520 . 3.870 3.328 2.212 3.572 . 0 0 "[ . 1 . 2]" 1
198 1 91 TYR HA 1 92 GLN H 3.320 . 3.650 2.611 2.144 3.582 . 0 0 "[ . 1 . 2]" 1
199 1 92 GLN HA 1 93 GLY H 3.550 . 3.900 2.630 2.147 3.596 . 0 0 "[ . 1 . 2]" 1
200 1 94 ALA HA 1 95 ASP H 3.170 . 3.490 2.802 2.153 3.579 0.089 9 0 "[ . 1 . 2]" 1
201 1 96 VAL HA 1 97 ASP H 3.490 . 3.840 3.043 2.178 3.622 . 0 0 "[ . 1 . 2]" 1
202 1 101 LYS HA 1 102 ALA H 3.270 . 3.600 2.221 2.149 2.407 . 0 0 "[ . 1 . 2]" 1
203 1 104 ASP HA 1 105 ILE H 3.520 . 3.870 2.373 2.279 2.439 . 0 0 "[ . 1 . 2]" 1
204 1 105 ILE HA 1 106 VAL H 3.300 . 3.630 2.181 2.157 2.198 . 0 0 "[ . 1 . 2]" 1
205 1 106 VAL HA 1 107 LEU H 3.300 . 3.630 2.547 2.408 2.630 . 0 0 "[ . 1 . 2]" 1
206 1 107 LEU HA 1 108 THR H 3.300 . 3.630 2.240 2.164 2.328 . 0 0 "[ . 1 . 2]" 1
207 1 108 THR HA 1 109 LEU H 3.160 . 3.480 2.209 2.127 2.468 . 0 0 "[ . 1 . 2]" 1
208 1 109 LEU HA 1 110 GLU H 3.090 . 3.400 2.837 2.184 3.549 0.149 12 0 "[ . 1 . 2]" 1
209 1 4 LEU H 1 4 LEU HG 4.580 . 5.040 3.854 2.011 4.450 . 0 0 "[ . 1 . 2]" 1
210 1 10 LEU H 1 10 LEU HG 3.770 . 4.150 2.464 1.795 3.339 0.005 7 0 "[ . 1 . 2]" 1
211 1 19 LEU H 1 19 LEU HG 4.070 . 4.480 2.562 2.275 3.041 . 0 0 "[ . 1 . 2]" 1
212 1 24 LEU H 1 24 LEU HG 4.650 . 5.120 4.415 4.324 4.471 . 0 0 "[ . 1 . 2]" 1
213 1 48 LEU H 1 48 LEU HG 4.260 . 4.690 2.925 2.733 3.024 . 0 0 "[ . 1 . 2]" 1
214 1 78 LEU H 1 78 LEU HG 3.720 . 4.090 2.747 2.567 2.889 . 0 0 "[ . 1 . 2]" 1
215 1 107 LEU H 1 107 LEU HG 3.560 . 3.920 2.544 2.403 2.754 . 0 0 "[ . 1 . 2]" 1
216 1 12 LYS H 1 12 LYS HG2 4.850 . 5.330 3.963 2.195 5.295 . 0 0 "[ . 1 . 2]" 1
217 1 14 THR H 1 14 THR MG 3.850 . 4.230 2.260 1.890 3.005 . 0 0 "[ . 1 . 2]" 1
218 1 15 THR H 1 15 THR MG 4.250 . 4.680 2.874 1.867 4.070 . 0 0 "[ . 1 . 2]" 1
219 1 25 ARG H 1 25 ARG HG2 4.980 . 5.480 4.620 4.547 4.663 . 0 0 "[ . 1 . 2]" 1
220 1 27 GLU H 1 27 GLU HG2 3.960 . 4.360 3.699 3.460 3.854 . 0 0 "[ . 1 . 2]" 1
221 1 29 ARG H 1 29 ARG HG2 3.620 . 3.980 3.729 3.323 4.006 0.026 13 0 "[ . 1 . 2]" 1
222 1 30 ILE H 1 30 ILE MG 3.920 . 4.310 3.784 3.752 3.817 . 0 0 "[ . 1 . 2]" 1
223 1 37 VAL H 1 37 VAL MG2 3.060 . 3.370 2.216 2.001 2.461 . 0 0 "[ . 1 . 2]" 1
224 1 30 ILE MD 1 41 ILE H 3.620 . 3.980 4.018 3.901 4.055 0.075 2 0 "[ . 1 . 2]" 1
225 1 43 GLU H 1 43 GLU HG2 3.570 . 3.930 3.407 2.593 4.069 0.139 1 0 "[ . 1 . 2]" 1
226 1 44 ARG H 1 44 ARG HG2 4.890 . 5.380 3.848 2.163 4.463 . 0 0 "[ . 1 . 2]" 1
227 1 45 THR H 1 45 THR MG 4.160 . 4.580 3.832 3.795 3.865 . 0 0 "[ . 1 . 2]" 1
228 1 53 GLN H 1 53 GLN HG2 4.770 . 5.250 3.631 2.445 4.804 . 0 0 "[ . 1 . 2]" 1
229 1 55 ARG H 1 55 ARG HG2 4.040 . 4.440 3.084 2.116 4.199 . 0 0 "[ . 1 . 2]" 1
230 1 56 MET H 1 56 MET HG2 4.560 . 5.020 3.013 1.964 4.438 . 0 0 "[ . 1 . 2]" 1
231 1 57 ILE H 1 57 ILE MG 4.250 . 4.680 2.825 2.507 3.113 . 0 0 "[ . 1 . 2]" 1
232 1 59 VAL H 1 59 VAL MG2 3.610 . 3.970 2.509 2.433 2.634 . 0 0 "[ . 1 . 2]" 1
233 1 61 ILE H 1 61 ILE MG 3.990 . 4.390 2.869 2.724 3.125 . 0 0 "[ . 1 . 2]" 1
234 1 61 ILE H 1 61 ILE MD 4.610 . 5.070 3.820 3.667 3.969 . 0 0 "[ . 1 . 2]" 1
235 1 65 VAL H 1 65 VAL MG2 3.210 . 3.530 2.245 2.048 2.521 . 0 0 "[ . 1 . 2]" 1
236 1 68 LYS H 1 68 LYS HG2 4.690 . 5.160 3.842 2.280 4.402 . 0 0 "[ . 1 . 2]" 1
237 1 75 ARG H 1 75 ARG HG2 4.100 . 4.510 3.593 3.132 4.196 . 0 0 "[ . 1 . 2]" 1
238 1 76 VAL H 1 76 VAL MG2 3.500 . 3.850 2.171 2.094 2.248 . 0 0 "[ . 1 . 2]" 1
239 1 77 GLU H 1 77 GLU HG2 4.090 . 4.500 2.453 2.298 2.927 . 0 0 "[ . 1 . 2]" 1
240 1 79 ILE H 1 79 ILE MG 3.830 . 4.210 3.788 3.747 3.853 . 0 0 "[ . 1 . 2]" 1
241 1 82 ILE H 1 82 ILE MG 3.720 . 4.090 3.060 2.746 3.246 . 0 0 "[ . 1 . 2]" 1
242 1 85 THR H 1 85 THR MG 3.860 . 4.250 2.996 1.868 3.985 . 0 0 "[ . 1 . 2]" 1
243 1 88 THR H 1 88 THR MG 3.730 . 4.100 2.120 1.896 2.421 . 0 0 "[ . 1 . 2]" 1
244 1 90 THR H 1 90 THR MG 4.040 . 4.440 2.845 1.941 4.120 . 0 0 "[ . 1 . 2]" 1
245 1 96 VAL H 1 96 VAL MG2 4.060 . 4.470 2.588 1.904 4.093 . 0 0 "[ . 1 . 2]" 1
246 1 100 ILE H 1 100 ILE MG 4.090 . 4.500 3.877 3.833 3.918 . 0 0 "[ . 1 . 2]" 1
247 1 101 LYS H 1 101 LYS HG2 4.340 . 4.770 3.716 3.290 4.048 . 0 0 "[ . 1 . 2]" 1
248 1 105 ILE H 1 105 ILE MG 3.970 . 4.370 3.890 3.810 3.924 . 0 0 "[ . 1 . 2]" 1
249 1 106 VAL H 1 106 VAL MG2 3.280 . 3.610 2.161 2.068 2.235 . 0 0 "[ . 1 . 2]" 1
250 1 108 THR H 1 108 THR MG 3.850 . 4.230 3.792 3.746 3.829 . 0 0 "[ . 1 . 2]" 1
251 1 110 GLU H 1 110 GLU HG2 4.230 . 4.650 3.126 1.827 4.759 0.109 17 0 "[ . 1 . 2]" 1
252 1 12 LYS H 1 12 LYS HG3 4.850 . 5.330 4.086 2.749 5.005 . 0 0 "[ . 1 . 2]" 1
253 1 20 LYS H 1 20 LYS HG3 4.680 . 5.150 3.284 2.413 4.688 . 0 0 "[ . 1 . 2]" 1
254 1 25 ARG H 1 25 ARG HG3 4.980 . 5.480 4.442 4.337 4.541 . 0 0 "[ . 1 . 2]" 1
255 1 26 ARG H 1 26 ARG HG2 4.570 . 5.030 4.523 4.315 4.649 . 0 0 "[ . 1 . 2]" 1
256 1 27 GLU H 1 27 GLU HG3 3.620 . 3.980 2.553 2.286 2.747 . 0 0 "[ . 1 . 2]" 1
257 1 29 ARG H 1 29 ARG HG3 3.620 . 3.980 2.656 2.315 2.993 . 0 0 "[ . 1 . 2]" 1
258 1 31 GLN H 1 31 GLN HG3 4.530 . 4.980 4.565 4.497 4.646 . 0 0 "[ . 1 . 2]" 1
259 1 33 GLU H 1 33 GLU HG2 5.120 . 5.630 2.915 1.950 3.790 . 0 0 "[ . 1 . 2]" 1
260 1 33 GLU H 1 33 GLU HG3 5.120 . 5.630 2.871 1.808 3.905 . 0 0 "[ . 1 . 2]" 1
261 1 43 GLU H 1 43 GLU HG3 3.570 . 3.930 3.326 3.027 3.604 . 0 0 "[ . 1 . 2]" 1
262 1 44 ARG H 1 44 ARG HG3 4.890 . 5.380 3.364 2.345 4.743 . 0 0 "[ . 1 . 2]" 1
263 1 53 GLN H 1 53 GLN HG3 4.770 . 5.250 3.902 2.464 4.503 . 0 0 "[ . 1 . 2]" 1
264 1 55 ARG H 1 55 ARG HG3 4.040 . 4.440 3.256 2.510 4.334 . 0 0 "[ . 1 . 2]" 1
265 1 56 MET H 1 56 MET HG3 4.560 . 5.020 3.436 2.434 4.740 . 0 0 "[ . 1 . 2]" 1
266 1 68 LYS H 1 68 LYS HG3 4.690 . 5.160 4.025 3.768 4.395 . 0 0 "[ . 1 . 2]" 1
267 1 69 GLU H 1 69 GLU QG 3.490 . 3.840 2.674 2.190 2.870 . 0 0 "[ . 1 . 2]" 1
268 1 77 GLU H 1 77 GLU HG3 4.090 . 4.500 3.089 2.782 3.256 . 0 0 "[ . 1 . 2]" 1
269 1 101 LYS H 1 101 LYS HG3 4.300 . 4.730 2.548 2.177 2.824 . 0 0 "[ . 1 . 2]" 1
270 1 110 GLU H 1 110 GLU HG3 4.230 . 4.650 3.306 2.135 4.485 . 0 0 "[ . 1 . 2]" 1
271 1 4 LEU MD1 1 5 ALA H 3.910 . 4.300 3.465 3.206 4.348 0.048 14 0 "[ . 1 . 2]" 1
272 1 8 ILE H 1 8 ILE MG 3.790 . 4.170 2.591 2.134 3.043 . 0 0 "[ . 1 . 2]" 1
273 1 10 LEU H 1 10 LEU MD2 4.210 . 4.630 3.156 1.682 4.127 0.118 10 0 "[ . 1 . 2]" 1
274 1 16 PHE H 1 16 PHE QD 4.520 . 4.970 2.805 2.243 4.013 . 0 0 "[ . 1 . 2]" 1
275 1 19 LEU H 1 19 LEU MD1 4.030 . 4.430 3.802 3.664 4.072 . 0 0 "[ . 1 . 2]" 1
276 1 24 LEU H 1 24 LEU MD1 4.350 . 4.790 4.259 4.153 4.322 . 0 0 "[ . 1 . 2]" 1
277 1 30 ILE H 1 30 ILE MD 3.930 . 4.320 3.570 3.436 3.720 . 0 0 "[ . 1 . 2]" 1
278 1 41 ILE H 1 41 ILE MD 4.360 . 4.800 3.828 3.426 3.972 . 0 0 "[ . 1 . 2]" 1
279 1 48 LEU H 1 48 LEU MD1 4.310 . 4.740 4.139 4.037 4.207 . 0 0 "[ . 1 . 2]" 1
280 1 67 LEU H 1 67 LEU MD1 4.340 . 4.770 4.096 3.940 4.159 . 0 0 "[ . 1 . 2]" 1
281 1 78 LEU H 1 78 LEU MD1 4.190 . 4.610 3.912 3.818 4.034 . 0 0 "[ . 1 . 2]" 1
282 1 78 LEU MD2 1 79 ILE H 3.950 . 4.350 3.478 3.293 3.599 . 0 0 "[ . 1 . 2]" 1
283 1 79 ILE H 1 79 ILE MD 4.260 . 4.690 3.093 1.860 3.498 . 0 0 "[ . 1 . 2]" 1
284 1 82 ILE H 1 100 ILE MG 3.610 . 3.970 2.740 2.294 3.292 . 0 0 "[ . 1 . 2]" 1
285 1 78 LEU MD2 1 105 ILE H 4.590 . 5.050 4.554 4.394 4.669 . 0 0 "[ . 1 . 2]" 1
286 1 105 ILE H 1 105 ILE MD 4.820 . 5.300 4.038 3.871 4.149 . 0 0 "[ . 1 . 2]" 1
287 1 107 LEU H 1 107 LEU MD1 3.890 . 4.280 3.727 3.654 3.865 . 0 0 "[ . 1 . 2]" 1
288 1 109 LEU H 1 109 LEU MD1 4.040 . 4.440 3.796 3.508 4.468 0.028 15 0 "[ . 1 . 2]" 1
289 1 4 LEU H 1 4 LEU MD2 3.770 . 4.150 2.362 1.788 3.992 0.012 12 0 "[ . 1 . 2]" 1
290 1 19 LEU H 1 19 LEU MD2 4.010 . 4.410 3.474 3.128 3.816 . 0 0 "[ . 1 . 2]" 1
291 1 21 PHE H 1 21 PHE QD 4.570 . 5.030 4.185 4.137 4.209 . 0 0 "[ . 1 . 2]" 1
292 1 24 LEU H 1 24 LEU MD2 4.270 . 4.700 4.308 4.241 4.386 . 0 0 "[ . 1 . 2]" 1
293 1 42 LYS H 1 42 LYS HD2 4.670 . 5.140 4.745 4.068 4.967 . 0 0 "[ . 1 . 2]" 1
294 1 48 LEU H 1 48 LEU MD2 4.460 . 4.910 3.532 3.386 3.681 . 0 0 "[ . 1 . 2]" 1
295 1 49 LYS H 1 49 LYS HB3 4.200 . 4.620 3.526 2.869 3.779 . 0 0 "[ . 1 . 2]" 1
296 1 67 LEU H 1 67 LEU MD2 4.460 . 4.910 4.256 4.229 4.289 . 0 0 "[ . 1 . 2]" 1
297 1 70 PHE H 1 70 PHE QD 3.660 . 4.030 3.271 2.970 3.643 . 0 0 "[ . 1 . 2]" 1
298 1 75 ARG H 1 75 ARG HD2 5.170 . 5.690 4.352 3.037 4.957 . 0 0 "[ . 1 . 2]" 1
299 1 78 LEU H 1 106 VAL MG2 5.050 . 5.560 4.765 4.448 4.972 . 0 0 "[ . 1 . 2]" 1
300 1 109 LEU H 1 109 LEU MD2 4.040 . 4.440 3.031 1.653 3.534 0.147 13 0 "[ . 1 . 2]" 1
301 1 29 ARG H 1 29 ARG QD 4.600 . 5.060 4.143 3.918 4.575 . 0 0 "[ . 1 . 2]" 1
302 1 42 LYS H 1 42 LYS HD3 4.670 . 5.140 4.647 3.977 5.091 . 0 0 "[ . 1 . 2]" 1
303 1 75 ARG H 1 75 ARG HD3 5.170 . 5.690 4.275 2.275 4.964 . 0 0 "[ . 1 . 2]" 1
304 1 101 LYS H 1 101 LYS QD 4.380 . 4.820 3.915 3.480 4.605 . 0 0 "[ . 1 . 2]" 1
305 1 8 ILE H 1 8 ILE HG12 4.070 . 4.480 2.086 1.916 2.343 . 0 0 "[ . 1 . 2]" 1
306 1 30 ILE H 1 30 ILE HG12 3.780 . 4.160 3.407 3.253 3.674 . 0 0 "[ . 1 . 2]" 1
307 1 57 ILE H 1 57 ILE HG12 4.430 . 4.870 2.156 1.943 2.418 . 0 0 "[ . 1 . 2]" 1
308 1 61 ILE H 1 61 ILE HG12 4.150 . 4.570 2.158 1.970 2.368 . 0 0 "[ . 1 . 2]" 1
309 1 79 ILE H 1 79 ILE HG12 4.300 . 4.730 2.501 2.028 3.954 . 0 0 "[ . 1 . 2]" 1
310 1 82 ILE H 1 82 ILE HG12 4.140 . 4.550 2.419 2.322 2.592 . 0 0 "[ . 1 . 2]" 1
311 1 100 ILE H 1 100 ILE HG12 4.510 . 4.960 3.800 3.355 4.070 . 0 0 "[ . 1 . 2]" 1
312 1 105 ILE H 1 105 ILE HG12 4.270 . 4.700 3.825 3.758 3.965 . 0 0 "[ . 1 . 2]" 1
313 1 8 ILE H 1 8 ILE HG13 4.070 . 4.480 3.053 2.957 3.236 . 0 0 "[ . 1 . 2]" 1
314 1 30 ILE H 1 30 ILE HG13 3.780 . 4.160 2.128 1.990 2.403 . 0 0 "[ . 1 . 2]" 1
315 1 57 ILE H 1 57 ILE HG13 4.430 . 4.870 3.030 2.908 3.159 . 0 0 "[ . 1 . 2]" 1
316 1 61 ILE H 1 61 ILE HG13 4.150 . 4.570 2.998 2.899 3.204 . 0 0 "[ . 1 . 2]" 1
317 1 79 ILE H 1 79 ILE HG13 4.300 . 4.730 3.693 3.545 3.963 . 0 0 "[ . 1 . 2]" 1
318 1 82 ILE H 1 82 ILE HG13 4.140 . 4.550 3.042 2.899 3.168 . 0 0 "[ . 1 . 2]" 1
319 1 100 ILE H 1 100 ILE HG13 4.510 . 4.960 2.692 2.290 3.008 . 0 0 "[ . 1 . 2]" 1
320 1 105 ILE H 1 105 ILE HG13 4.270 . 4.700 2.730 2.585 2.899 . 0 0 "[ . 1 . 2]" 1
321 1 21 PHE QD 1 70 PHE H 4.360 . 4.800 4.283 3.658 4.816 0.016 1 0 "[ . 1 . 2]" 1
322 1 32 ASN H 1 32 ASN HD21 4.490 . 4.940 3.034 2.142 4.656 . 0 0 "[ . 1 . 2]" 1
323 1 32 ASN H 1 32 ASN HD22 4.490 . 4.940 3.780 3.157 4.646 . 0 0 "[ . 1 . 2]" 1
324 1 65 VAL H 1 65 VAL MG1 3.860 . 4.250 3.810 3.786 3.880 . 0 0 "[ . 1 . 2]" 1
325 1 96 VAL H 1 96 VAL MG1 4.060 . 4.470 3.186 1.821 4.094 . 0 0 "[ . 1 . 2]" 1
326 1 106 VAL H 1 106 VAL MG1 3.390 . 3.730 2.897 2.801 2.989 . 0 0 "[ . 1 . 2]" 1
327 1 32 ASN HB2 1 32 ASN HD22 3.580 . 3.940 3.517 3.462 3.773 . 0 0 "[ . 1 . 2]" 1
328 1 6 ASN HB3 1 7 GLY H 4.530 . 4.980 3.667 1.972 4.590 . 0 0 "[ . 1 . 2]" 1
329 1 7 GLY H 1 8 ILE MG 5.500 . 6.050 4.256 2.819 5.430 . 0 0 "[ . 1 . 2]" 1
330 1 7 GLY H 1 8 ILE H 3.970 . 4.370 3.204 1.810 4.414 0.044 19 0 "[ . 1 . 2]" 1
331 1 33 GLU HA 1 35 GLY H 4.050 . 4.460 3.718 3.366 4.148 . 0 0 "[ . 1 . 2]" 1
332 1 34 ASP HB2 1 35 GLY H 4.750 . 5.220 3.472 2.665 4.194 . 0 0 "[ . 1 . 2]" 1
333 1 32 ASN HB2 1 35 GLY H 4.440 . 4.880 3.302 2.742 4.352 . 0 0 "[ . 1 . 2]" 1
334 1 32 ASN HB3 1 35 GLY H 4.960 . 5.460 4.136 3.650 5.050 . 0 0 "[ . 1 . 2]" 1
335 1 34 ASP HB3 1 35 GLY H 4.750 . 5.220 3.762 2.633 4.471 . 0 0 "[ . 1 . 2]" 1
336 1 31 GLN HG2 1 35 GLY H 4.550 . 5.010 3.908 3.491 4.454 . 0 0 "[ . 1 . 2]" 1
337 1 33 GLU QB 1 35 GLY H 4.970 . 5.470 4.659 4.372 5.054 . 0 0 "[ . 1 . 2]" 1
338 1 32 ASN H 1 35 GLY H 4.630 . 5.090 4.306 3.846 5.092 0.002 2 0 "[ . 1 . 2]" 1
339 1 92 GLN QG 1 93 GLY H 4.650 . 5.120 3.870 2.555 4.784 . 0 0 "[ . 1 . 2]" 1
340 1 92 GLN HB2 1 93 GLY H 4.590 . 5.050 4.222 3.060 4.633 . 0 0 "[ . 1 . 2]" 1
341 1 92 GLN HB3 1 93 GLY H 4.590 . 5.050 3.794 2.118 4.553 . 0 0 "[ . 1 . 2]" 1
342 1 62 PRO HA 1 64 SER H 4.290 . 4.720 4.021 3.749 4.513 . 0 0 "[ . 1 . 2]" 1
343 1 62 PRO HB3 1 64 SER H 4.250 . 4.680 3.911 3.222 4.348 . 0 0 "[ . 1 . 2]" 1
344 1 62 PRO HB2 1 64 SER H 3.500 . 3.850 2.706 2.329 3.399 . 0 0 "[ . 1 . 2]" 1
345 1 63 ALA MB 1 64 SER H 3.610 . 3.970 2.915 2.483 3.169 . 0 0 "[ . 1 . 2]" 1
346 1 64 SER H 1 65 VAL MG2 4.470 . 4.920 3.833 3.604 4.134 . 0 0 "[ . 1 . 2]" 1
347 1 103 ASP HB2 1 104 ASP H 4.150 . 4.570 3.870 3.592 4.047 . 0 0 "[ . 1 . 2]" 1
348 1 79 ILE HB 1 104 ASP H 3.670 . 4.040 2.525 2.132 2.846 . 0 0 "[ . 1 . 2]" 1
349 1 102 ALA MB 1 104 ASP H 3.380 . 3.720 2.763 2.339 3.407 . 0 0 "[ . 1 . 2]" 1
350 1 61 ILE MG 1 104 ASP H 4.820 . 5.300 3.681 3.289 4.070 . 0 0 "[ . 1 . 2]" 1
351 1 79 ILE MG 1 104 ASP H 5.150 . 5.670 3.947 3.568 4.263 . 0 0 "[ . 1 . 2]" 1
352 1 104 ASP H 1 106 VAL MG1 5.500 . 6.050 5.602 5.358 5.879 . 0 0 "[ . 1 . 2]" 1
353 1 78 LEU MD2 1 104 ASP H 4.540 . 4.990 4.351 4.236 4.535 . 0 0 "[ . 1 . 2]" 1
354 1 79 ILE MD 1 104 ASP H 5.080 . 5.590 4.739 2.853 5.234 . 0 0 "[ . 1 . 2]" 1
355 1 79 ILE H 1 104 ASP H 3.920 . 4.310 3.149 2.892 3.449 . 0 0 "[ . 1 . 2]" 1
356 1 89 ALA MB 1 90 THR H 3.540 . 3.890 2.944 2.230 3.565 . 0 0 "[ . 1 . 2]" 1
357 1 31 GLN HE21 1 37 VAL MG2 4.290 . 4.720 3.309 2.740 4.040 . 0 0 "[ . 1 . 2]" 1
358 1 31 GLN HE21 1 37 VAL HA 4.450 . 4.890 4.812 4.449 4.929 0.039 11 0 "[ . 1 . 2]" 1
359 1 26 ARG H 1 45 THR HB 4.350 . 4.790 2.544 2.228 2.792 . 0 0 "[ . 1 . 2]" 1
360 1 24 LEU HA 1 26 ARG H 4.710 . 5.180 4.384 4.131 4.649 . 0 0 "[ . 1 . 2]" 1
361 1 24 LEU HG 1 26 ARG H 4.250 . 4.680 3.294 3.017 3.581 . 0 0 "[ . 1 . 2]" 1
362 1 26 ARG H 1 45 THR MG 4.610 . 5.070 3.597 3.381 3.826 . 0 0 "[ . 1 . 2]" 1
363 1 24 LEU MD2 1 26 ARG H 4.600 . 5.060 4.575 4.335 4.807 . 0 0 "[ . 1 . 2]" 1
364 1 24 LEU MD1 1 26 ARG H 4.130 . 4.540 3.096 2.747 3.415 . 0 0 "[ . 1 . 2]" 1
365 1 26 ARG H 1 45 THR H 4.070 . 4.480 3.265 3.025 3.453 . 0 0 "[ . 1 . 2]" 1
366 1 79 ILE MG 1 80 ASN HD21 3.990 . 4.390 2.385 1.769 3.294 0.031 19 0 "[ . 1 . 2]" 1
367 1 79 ILE MG 1 80 ASN HD22 3.990 . 4.390 2.653 2.104 3.472 . 0 0 "[ . 1 . 2]" 1
368 1 21 PHE HA 1 23 ALA H 4.490 . 4.940 4.540 4.388 4.691 . 0 0 "[ . 1 . 2]" 1
369 1 22 SER HB2 1 23 ALA H 3.980 . 4.380 2.961 2.070 3.696 . 0 0 "[ . 1 . 2]" 1
370 1 22 SER HB3 1 23 ALA H 3.980 . 4.380 3.047 2.082 3.821 . 0 0 "[ . 1 . 2]" 1
371 1 23 ALA H 1 47 ASP HB2 4.290 . 4.720 2.347 1.786 2.810 0.014 12 0 "[ . 1 . 2]" 1
372 1 23 ALA H 1 47 ASP HB3 3.920 . 4.310 3.707 3.033 4.194 . 0 0 "[ . 1 . 2]" 1
373 1 23 ALA H 1 48 LEU MD2 4.620 . 5.080 4.279 3.760 4.928 . 0 0 "[ . 1 . 2]" 1
374 1 23 ALA H 1 47 ASP H 4.040 . 4.440 3.212 3.002 3.575 . 0 0 "[ . 1 . 2]" 1
375 1 84 ASP HB2 1 85 THR H 4.700 . 5.170 4.005 2.341 4.555 . 0 0 "[ . 1 . 2]" 1
376 1 84 ASP HB3 1 85 THR H 4.700 . 5.170 3.586 1.914 4.448 . 0 0 "[ . 1 . 2]" 1
377 1 85 THR H 1 86 VAL MG1 5.500 . 6.050 3.938 2.696 5.378 . 0 0 "[ . 1 . 2]" 1
378 1 85 THR H 1 86 VAL MG2 5.500 . 6.050 4.224 2.879 6.198 0.148 12 0 "[ . 1 . 2]" 1
379 1 41 ILE HA 1 43 GLU H 4.410 . 4.850 4.508 4.226 4.690 . 0 0 "[ . 1 . 2]" 1
380 1 42 LYS HB2 1 43 GLU H 3.670 . 4.040 3.156 2.081 3.732 . 0 0 "[ . 1 . 2]" 1
381 1 42 LYS HB3 1 43 GLU H 3.670 . 4.040 2.553 2.149 3.358 . 0 0 "[ . 1 . 2]" 1
382 1 42 LYS HG2 1 43 GLU H 4.620 . 5.080 4.322 3.739 4.895 . 0 0 "[ . 1 . 2]" 1
383 1 42 LYS HG3 1 43 GLU H 4.620 . 5.080 3.946 3.298 4.759 . 0 0 "[ . 1 . 2]" 1
384 1 43 GLU H 1 63 ALA MB 4.910 . 5.400 3.758 3.214 4.567 . 0 0 "[ . 1 . 2]" 1
385 1 28 VAL MG2 1 43 GLU H 4.060 . 4.470 2.009 1.762 2.253 0.038 11 0 "[ . 1 . 2]" 1
386 1 41 ILE MG 1 43 GLU H 3.400 . 3.740 2.527 1.985 2.886 . 0 0 "[ . 1 . 2]" 1
387 1 32 ASN HB3 1 34 ASP H 3.520 . 3.870 2.685 2.289 3.108 . 0 0 "[ . 1 . 2]" 1
388 1 33 GLU QB 1 34 ASP H 3.440 . 3.780 3.070 2.517 3.594 . 0 0 "[ . 1 . 2]" 1
389 1 34 ASP H 1 36 SER H 4.570 . 5.030 4.360 3.739 5.046 0.016 1 0 "[ . 1 . 2]" 1
390 1 76 VAL HB 1 106 VAL H 4.560 . 5.020 4.090 3.801 4.460 . 0 0 "[ . 1 . 2]" 1
391 1 105 ILE HB 1 106 VAL H 4.520 . 4.970 4.256 4.176 4.398 . 0 0 "[ . 1 . 2]" 1
392 1 77 GLU H 1 107 LEU HA 4.530 . 4.980 3.394 3.137 3.586 . 0 0 "[ . 1 . 2]" 1
393 1 77 GLU H 1 105 ILE MG 4.080 . 4.490 3.777 3.098 4.270 . 0 0 "[ . 1 . 2]" 1
394 1 77 GLU H 1 106 VAL MG2 3.900 . 4.290 3.184 3.011 3.452 . 0 0 "[ . 1 . 2]" 1
395 1 76 VAL MG1 1 77 GLU H 3.920 . 4.310 3.770 3.586 3.879 . 0 0 "[ . 1 . 2]" 1
396 1 76 VAL MG2 1 77 GLU H 3.970 . 4.370 3.658 3.146 3.885 . 0 0 "[ . 1 . 2]" 1
397 1 77 GLU H 1 106 VAL H 3.950 . 4.350 3.345 3.087 3.597 . 0 0 "[ . 1 . 2]" 1
398 1 5 ALA MB 1 6 ASN H 4.000 . 4.400 2.920 2.013 3.643 . 0 0 "[ . 1 . 2]" 1
399 1 14 THR MG 1 15 THR H 4.430 . 4.870 3.501 1.784 4.332 0.016 18 0 "[ . 1 . 2]" 1
400 1 15 THR HB 1 16 PHE H 4.150 . 4.570 3.565 1.805 4.497 . 0 0 "[ . 1 . 2]" 1
401 1 15 THR MG 1 16 PHE H 4.550 . 5.010 3.712 2.179 4.358 . 0 0 "[ . 1 . 2]" 1
402 1 36 SER H 1 37 VAL H 4.580 . 5.040 4.629 4.567 4.673 . 0 0 "[ . 1 . 2]" 1
403 1 50 SER H 1 56 MET HA 4.390 . 4.830 3.344 2.406 4.032 . 0 0 "[ . 1 . 2]" 1
404 1 32 ASN HB2 1 36 SER H 3.920 . 4.310 3.439 2.828 3.901 . 0 0 "[ . 1 . 2]" 1
405 1 79 ILE HB 1 103 ASP H 4.380 . 4.820 3.955 3.493 4.324 . 0 0 "[ . 1 . 2]" 1
406 1 102 ALA MB 1 103 ASP H 3.430 . 3.770 2.514 2.207 2.841 . 0 0 "[ . 1 . 2]" 1
407 1 61 ILE MG 1 103 ASP H 5.470 . 6.020 4.355 3.977 4.998 . 0 0 "[ . 1 . 2]" 1
408 1 79 ILE MG 1 103 ASP H 5.500 . 6.050 4.417 3.683 4.982 . 0 0 "[ . 1 . 2]" 1
409 1 21 PHE QE 1 70 PHE H 4.350 . 4.790 3.726 2.987 4.485 . 0 0 "[ . 1 . 2]" 1
410 1 70 PHE H 1 71 ASP H 4.640 . 5.100 4.586 4.472 4.651 . 0 0 "[ . 1 . 2]" 1
411 1 68 LYS HA 1 70 PHE H 4.340 . 4.770 4.509 3.804 4.832 0.062 10 0 "[ . 1 . 2]" 1
412 1 69 GLU QG 1 70 PHE H 4.690 . 5.160 4.627 4.454 4.918 . 0 0 "[ . 1 . 2]" 1
413 1 68 LYS HB3 1 70 PHE H 4.250 . 4.680 3.157 2.583 4.028 . 0 0 "[ . 1 . 2]" 1
414 1 69 GLU HB2 1 70 PHE H 4.510 . 4.960 4.300 3.978 4.500 . 0 0 "[ . 1 . 2]" 1
415 1 68 LYS HB2 1 70 PHE H 4.410 . 4.850 3.983 3.011 4.677 . 0 0 "[ . 1 . 2]" 1
416 1 69 GLU HB3 1 70 PHE H 4.570 . 5.030 4.395 4.179 4.495 . 0 0 "[ . 1 . 2]" 1
417 1 77 GLU HG3 1 78 LEU H 5.000 . 5.500 3.785 3.155 4.080 . 0 0 "[ . 1 . 2]" 1
418 1 77 GLU HB2 1 78 LEU H 3.870 . 4.260 2.513 2.075 2.752 . 0 0 "[ . 1 . 2]" 1
419 1 77 GLU HB3 1 78 LEU H 3.870 . 4.260 3.809 3.603 3.942 . 0 0 "[ . 1 . 2]" 1
420 1 19 LEU MD1 1 78 LEU H 4.130 . 4.540 3.547 2.789 4.566 0.026 14 0 "[ . 1 . 2]" 1
421 1 44 ARG H 1 61 ILE H 4.040 . 4.440 2.887 2.457 3.225 . 0 0 "[ . 1 . 2]" 1
422 1 24 LEU MD1 1 45 THR H 4.080 . 4.490 3.375 2.911 3.686 . 0 0 "[ . 1 . 2]" 1
423 1 96 VAL H 1 97 ASP H 4.710 . 5.180 3.312 1.926 4.583 . 0 0 "[ . 1 . 2]" 1
424 1 43 GLU HB2 1 44 ARG H 3.820 . 4.200 3.064 2.255 4.008 . 0 0 "[ . 1 . 2]" 1
425 1 43 GLU HB3 1 44 ARG H 3.820 . 4.200 3.059 2.270 3.791 . 0 0 "[ . 1 . 2]" 1
426 1 28 VAL MG2 1 44 ARG H 5.270 . 5.800 4.436 4.079 4.658 . 0 0 "[ . 1 . 2]" 1
427 1 44 ARG H 1 61 ILE MD 5.500 . 6.050 4.702 4.291 4.918 . 0 0 "[ . 1 . 2]" 1
428 1 24 LEU MD2 1 45 THR H 5.500 . 6.050 5.183 4.776 5.658 . 0 0 "[ . 1 . 2]" 1
429 1 28 VAL MG1 1 45 THR H 5.500 . 6.050 4.491 3.817 4.913 . 0 0 "[ . 1 . 2]" 1
430 1 27 GLU HA 1 45 THR H 4.000 . 4.400 2.996 2.707 3.326 . 0 0 "[ . 1 . 2]" 1
431 1 76 VAL HB 1 108 THR H 4.980 . 5.480 4.763 4.369 5.190 . 0 0 "[ . 1 . 2]" 1
432 1 107 LEU MD1 1 108 THR H 4.780 . 5.260 4.808 4.590 5.038 . 0 0 "[ . 1 . 2]" 1
433 1 76 VAL MG1 1 108 THR H 4.000 . 4.400 3.845 3.565 4.196 . 0 0 "[ . 1 . 2]" 1
434 1 107 LEU MD2 1 108 THR H 3.920 . 4.310 3.412 3.292 3.577 . 0 0 "[ . 1 . 2]" 1
435 1 76 VAL HA 1 108 THR H 3.640 . 4.000 2.321 1.977 2.741 . 0 0 "[ . 1 . 2]" 1
436 1 94 ALA MB 1 95 ASP H 3.620 . 3.980 3.281 2.389 3.730 . 0 0 "[ . 1 . 2]" 1
437 1 95 ASP H 1 96 VAL H 4.250 . 4.680 3.830 2.506 4.634 . 0 0 "[ . 1 . 2]" 1
438 1 19 LEU MD2 1 20 LYS H 4.050 . 4.460 3.635 3.323 3.758 . 0 0 "[ . 1 . 2]" 1
439 1 20 LYS H 1 49 LYS H 4.120 . 4.530 3.007 2.683 3.370 . 0 0 "[ . 1 . 2]" 1
440 1 36 SER HB2 1 37 VAL H 3.690 . 4.060 3.468 2.490 4.043 . 0 0 "[ . 1 . 2]" 1
441 1 36 SER HB3 1 37 VAL H 3.690 . 4.060 3.067 2.362 3.943 . 0 0 "[ . 1 . 2]" 1
442 1 21 PHE HB2 1 22 SER H 4.670 . 5.140 4.232 3.939 4.522 . 0 0 "[ . 1 . 2]" 1
443 1 22 SER H 1 48 LEU MD2 3.770 . 4.150 2.816 2.424 3.432 . 0 0 "[ . 1 . 2]" 1
444 1 22 SER H 1 49 LYS H 5.500 . 6.050 4.337 3.440 5.052 . 0 0 "[ . 1 . 2]" 1
445 1 38 SER HB2 1 39 ASP H 3.730 . 4.100 3.739 3.545 3.982 . 0 0 "[ . 1 . 2]" 1
446 1 13 ASP H 1 14 THR H 3.910 . 4.300 3.825 2.572 4.442 0.142 6 0 "[ . 1 . 2]" 1
447 1 12 LYS QB 1 13 ASP H 3.710 . 4.080 3.223 1.915 3.972 . 0 0 "[ . 1 . 2]" 1
448 1 12 LYS HG3 1 13 ASP H 4.660 . 5.130 3.952 2.276 5.205 0.075 10 0 "[ . 1 . 2]" 1
449 1 70 PHE HB2 1 71 ASP H 3.760 . 4.140 3.514 2.998 3.906 . 0 0 "[ . 1 . 2]" 1
450 1 71 ASP H 1 74 ALA MB 3.580 . 3.940 2.608 2.134 3.159 . 0 0 "[ . 1 . 2]" 1
451 1 70 PHE HB3 1 71 ASP H 3.760 . 4.140 2.280 1.817 2.733 . 0 0 "[ . 1 . 2]" 1
452 1 70 PHE QD 1 71 ASP H 3.950 . 4.350 3.664 3.434 3.841 . 0 0 "[ . 1 . 2]" 1
453 1 30 ILE MD 1 40 GLU H 4.290 . 4.720 4.371 3.965 4.702 . 0 0 "[ . 1 . 2]" 1
454 1 39 ASP HB3 1 40 GLU H 4.290 . 4.720 3.935 2.559 4.335 . 0 0 "[ . 1 . 2]" 1
455 1 38 SER HB2 1 40 GLU H 4.510 . 4.960 4.105 3.722 4.586 . 0 0 "[ . 1 . 2]" 1
456 1 38 SER HB3 1 40 GLU H 4.020 . 4.420 3.065 2.684 3.467 . 0 0 "[ . 1 . 2]" 1
457 1 56 MET HB2 1 57 ILE H 4.530 . 4.980 3.405 2.141 4.445 . 0 0 "[ . 1 . 2]" 1
458 1 49 LYS HA 1 57 ILE H 4.740 . 5.210 3.579 3.249 4.276 . 0 0 "[ . 1 . 2]" 1
459 1 48 LEU H 1 57 ILE H 4.710 . 5.180 3.443 2.913 3.768 . 0 0 "[ . 1 . 2]" 1
460 1 8 ILE H 1 9 VAL H 4.630 . 5.090 4.544 4.385 4.667 . 0 0 "[ . 1 . 2]" 1
461 1 23 ALA MB 1 24 LEU H 3.320 . 3.650 2.163 1.982 2.460 . 0 0 "[ . 1 . 2]" 1
462 1 24 LEU H 1 46 TYR QD 4.730 . 5.200 4.585 3.821 5.251 0.051 16 0 "[ . 1 . 2]" 1
463 1 109 LEU HB3 1 110 GLU H 4.550 . 5.010 4.192 3.353 4.479 . 0 0 "[ . 1 . 2]" 1
464 1 108 THR MG 1 110 GLU H 4.480 . 4.930 3.162 1.761 4.922 0.039 6 0 "[ . 1 . 2]" 1
465 1 109 LEU MD2 1 110 GLU H 4.560 . 5.020 4.215 3.077 4.668 . 0 0 "[ . 1 . 2]" 1
466 1 90 THR HB 1 91 TYR H 4.240 . 4.660 3.506 2.449 4.396 . 0 0 "[ . 1 . 2]" 1
467 1 89 ALA MB 1 91 TYR H 4.400 . 4.840 4.534 3.922 4.953 0.113 8 0 "[ . 1 . 2]" 1
468 1 90 THR MG 1 91 TYR H 4.190 . 4.610 3.103 2.096 3.968 . 0 0 "[ . 1 . 2]" 1
469 1 55 ARG HB3 1 56 MET H 4.210 . 4.630 3.213 2.069 4.157 . 0 0 "[ . 1 . 2]" 1
470 1 106 VAL HB 1 107 LEU H 3.460 . 3.810 2.171 2.045 2.377 . 0 0 "[ . 1 . 2]" 1
471 1 70 PHE HZ 1 107 LEU H 4.420 . 4.860 3.869 3.333 4.531 . 0 0 "[ . 1 . 2]" 1
472 1 105 ILE H 1 106 VAL H 4.620 . 5.080 4.289 4.154 4.367 . 0 0 "[ . 1 . 2]" 1
473 1 104 ASP HB2 1 105 ILE H 4.310 . 4.740 3.841 3.767 3.954 . 0 0 "[ . 1 . 2]" 1
474 1 104 ASP HB3 1 105 ILE H 4.310 . 4.740 3.666 3.462 3.775 . 0 0 "[ . 1 . 2]" 1
475 1 65 VAL MG1 1 105 ILE H 4.180 . 4.600 3.394 2.973 3.939 . 0 0 "[ . 1 . 2]" 1
476 1 61 ILE MG 1 105 ILE H 4.010 . 4.410 3.464 2.890 3.830 . 0 0 "[ . 1 . 2]" 1
477 1 61 ILE HA 1 102 ALA H 4.380 . 4.820 3.113 2.818 3.453 . 0 0 "[ . 1 . 2]" 1
478 1 101 LYS HB2 1 102 ALA H 3.980 . 4.380 4.099 3.343 4.328 . 0 0 "[ . 1 . 2]" 1
479 1 101 LYS HB3 1 102 ALA H 3.980 . 4.380 3.129 2.548 3.418 . 0 0 "[ . 1 . 2]" 1
480 1 101 LYS HG2 1 102 ALA H 4.320 . 4.750 4.338 4.031 4.625 . 0 0 "[ . 1 . 2]" 1
481 1 61 ILE MG 1 102 ALA H 4.010 . 4.410 2.892 2.520 3.713 . 0 0 "[ . 1 . 2]" 1
482 1 10 LEU MD2 1 11 ASP H 3.960 . 4.360 3.776 2.414 4.467 0.107 6 0 "[ . 1 . 2]" 1
483 1 59 VAL MG1 1 102 ALA H 4.170 . 4.590 3.314 2.961 3.611 . 0 0 "[ . 1 . 2]" 1
484 1 10 LEU QB 1 11 ASP H 4.010 . 4.410 2.616 1.960 3.770 . 0 0 "[ . 1 . 2]" 1
485 1 37 VAL MG1 1 38 SER H 3.300 . 3.630 2.439 2.119 2.791 . 0 0 "[ . 1 . 2]" 1
486 1 17 GLY HA3 1 18 GLU H 3.490 . 3.840 2.341 2.158 2.697 . 0 0 "[ . 1 . 2]" 1
487 1 17 GLY HA2 1 18 GLU H 3.490 . 3.840 3.059 2.442 3.476 . 0 0 "[ . 1 . 2]" 1
488 1 91 TYR HB2 1 92 GLN H 4.380 . 4.820 3.708 1.998 4.510 . 0 0 "[ . 1 . 2]" 1
489 1 91 TYR HB3 1 92 GLN H 4.380 . 4.820 3.217 1.905 4.409 . 0 0 "[ . 1 . 2]" 1
490 1 91 TYR QD 1 92 GLN H 4.440 . 4.880 4.110 3.580 4.935 0.055 20 0 "[ . 1 . 2]" 1
491 1 18 GLU H 1 19 LEU H 4.790 . 5.270 4.411 4.198 4.636 . 0 0 "[ . 1 . 2]" 1
492 1 21 PHE QD 1 73 ASN H 5.310 . 5.840 4.020 2.695 5.756 . 0 0 "[ . 1 . 2]" 1
493 1 71 ASP HB2 1 72 TYR H 3.970 . 4.370 3.661 2.242 4.044 . 0 0 "[ . 1 . 2]" 1
494 1 46 TYR HB2 1 47 ASP H 4.340 . 4.770 3.809 3.545 4.139 . 0 0 "[ . 1 . 2]" 1
495 1 46 TYR QD 1 47 ASP H 4.540 . 4.990 3.816 2.948 4.160 . 0 0 "[ . 1 . 2]" 1
496 1 25 ARG H 1 47 ASP H 4.410 . 4.850 3.203 2.942 3.673 . 0 0 "[ . 1 . 2]" 1
497 1 48 LEU MD2 1 49 LYS H 4.260 . 4.690 3.663 3.469 3.859 . 0 0 "[ . 1 . 2]" 1
498 1 19 LEU MD2 1 49 LYS H 4.870 . 5.360 4.751 4.209 5.377 0.017 16 0 "[ . 1 . 2]" 1
499 1 48 LEU MD1 1 49 LYS H 5.430 . 5.970 4.919 4.359 5.163 . 0 0 "[ . 1 . 2]" 1
500 1 85 THR MG 1 86 VAL H 4.390 . 4.830 3.861 2.298 4.411 . 0 0 "[ . 1 . 2]" 1
501 1 86 VAL H 1 86 VAL MG1 4.170 . 4.590 2.378 1.960 3.857 . 0 0 "[ . 1 . 2]" 1
502 1 85 THR HB 1 86 VAL H 4.580 . 5.040 3.891 2.377 4.546 . 0 0 "[ . 1 . 2]" 1
503 1 57 ILE MG 1 58 GLN H 3.720 . 4.090 3.897 3.765 4.044 . 0 0 "[ . 1 . 2]" 1
504 1 21 PHE HB3 1 74 ALA H 3.900 . 4.290 3.020 2.478 3.684 . 0 0 "[ . 1 . 2]" 1
505 1 72 TYR HA 1 74 ALA H 4.270 . 4.700 3.583 3.295 3.907 . 0 0 "[ . 1 . 2]" 1
506 1 21 PHE QD 1 74 ALA H 4.410 . 4.850 4.017 3.134 4.860 0.010 14 0 "[ . 1 . 2]" 1
507 1 74 ALA H 1 75 ARG H 4.530 . 4.980 4.597 4.448 4.645 . 0 0 "[ . 1 . 2]" 1
508 1 21 PHE H 1 74 ALA H 4.340 . 4.770 3.386 2.955 3.825 . 0 0 "[ . 1 . 2]" 1
509 1 45 THR MG 1 59 VAL H 4.260 . 4.690 3.354 2.945 3.909 . 0 0 "[ . 1 . 2]" 1
510 1 32 ASN HB3 1 33 GLU H 3.590 . 3.950 2.601 2.127 2.955 . 0 0 "[ . 1 . 2]" 1
511 1 32 ASN H 1 38 SER H 4.110 . 4.520 3.449 2.892 3.906 . 0 0 "[ . 1 . 2]" 1
512 1 32 ASN H 1 37 VAL HA 3.740 . 4.110 2.813 2.370 3.330 . 0 0 "[ . 1 . 2]" 1
513 1 31 GLN HG2 1 32 ASN H 4.190 . 4.610 3.183 2.340 3.571 . 0 0 "[ . 1 . 2]" 1
514 1 31 GLN HG3 1 32 ASN H 4.210 . 4.630 3.172 2.756 3.539 . 0 0 "[ . 1 . 2]" 1
515 1 31 GLN HB3 1 32 ASN H 4.010 . 4.410 4.190 3.850 4.340 . 0 0 "[ . 1 . 2]" 1
516 1 31 GLN HB2 1 32 ASN H 4.510 . 4.960 4.269 4.041 4.412 . 0 0 "[ . 1 . 2]" 1
517 1 32 ASN H 1 37 VAL MG1 5.380 . 5.920 4.468 3.984 5.018 . 0 0 "[ . 1 . 2]" 1
518 1 32 ASN H 1 37 VAL MG2 5.500 . 6.050 4.377 3.895 4.930 . 0 0 "[ . 1 . 2]" 1
519 1 30 ILE MG 1 32 ASN H 4.600 . 5.060 4.339 3.919 4.878 . 0 0 "[ . 1 . 2]" 1
520 1 74 ALA MB 1 75 ARG H 3.520 . 3.870 2.900 2.580 3.270 . 0 0 "[ . 1 . 2]" 1
521 1 99 TYR HB2 1 100 ILE H 4.850 . 5.330 4.181 3.885 4.400 . 0 0 "[ . 1 . 2]" 1
522 1 99 TYR HB3 1 100 ILE H 4.850 . 5.330 3.201 2.678 3.634 . 0 0 "[ . 1 . 2]" 1
523 1 40 GLU HG2 1 41 ILE H 4.710 . 5.180 4.501 4.057 5.034 . 0 0 "[ . 1 . 2]" 1
524 1 40 GLU QB 1 41 ILE H 3.560 . 3.920 2.879 2.478 3.215 . 0 0 "[ . 1 . 2]" 1
525 1 41 ILE H 1 63 ALA MB 4.470 . 4.920 3.605 3.009 3.959 . 0 0 "[ . 1 . 2]" 1
526 1 43 GLU HA 1 63 ALA H 3.870 . 4.260 2.666 2.156 3.352 . 0 0 "[ . 1 . 2]" 1
527 1 62 PRO HB3 1 63 ALA H 4.090 . 4.500 3.535 3.084 3.937 . 0 0 "[ . 1 . 2]" 1
528 1 62 PRO HB2 1 63 ALA H 3.820 . 4.200 3.328 2.887 3.839 . 0 0 "[ . 1 . 2]" 1
529 1 80 ASN H 1 81 PRO HD3 4.080 . 4.490 3.144 2.293 3.656 . 0 0 "[ . 1 . 2]" 1
530 1 79 ILE MG 1 80 ASN H 3.740 . 4.110 2.847 2.300 3.179 . 0 0 "[ . 1 . 2]" 1
531 1 80 ASN H 1 81 PRO HD2 4.080 . 4.490 3.983 3.040 4.520 0.030 13 0 "[ . 1 . 2]" 1
532 1 68 LYS HB3 1 69 GLU H 3.940 . 4.330 3.268 2.609 3.691 . 0 0 "[ . 1 . 2]" 1
533 1 68 LYS QD 1 69 GLU H 4.980 . 5.480 4.492 4.113 5.021 . 0 0 "[ . 1 . 2]" 1
534 1 68 LYS HB2 1 69 GLU H 4.390 . 4.830 3.394 2.021 4.490 . 0 0 "[ . 1 . 2]" 1
535 1 96 VAL HB 1 97 ASP H 4.130 . 4.540 3.410 1.807 4.471 . 0 0 "[ . 1 . 2]" 1
536 1 96 VAL MG2 1 97 ASP H 4.190 . 4.610 3.442 2.054 4.270 . 0 0 "[ . 1 . 2]" 1
537 1 96 VAL MG1 1 97 ASP H 4.190 . 4.610 3.313 1.773 4.405 0.027 4 0 "[ . 1 . 2]" 1
538 1 67 LEU HB3 1 68 LYS H 4.750 . 5.220 4.063 3.791 4.248 . 0 0 "[ . 1 . 2]" 1
539 1 68 LYS H 1 68 LYS QD 4.470 . 4.920 2.443 2.047 2.958 . 0 0 "[ . 1 . 2]" 1
540 1 67 LEU MD1 1 68 LYS H 3.720 . 4.090 2.208 1.729 2.780 0.071 8 0 "[ . 1 . 2]" 1
541 1 46 TYR QE 1 68 LYS H 4.440 . 4.880 3.076 2.643 4.156 . 0 0 "[ . 1 . 2]" 1
542 1 46 TYR HH 1 68 LYS H 4.260 . 4.690 2.787 2.248 3.300 . 0 0 "[ . 1 . 2]" 1
543 1 66 PRO HB3 1 67 LEU H 3.910 . 4.300 3.303 2.626 3.705 . 0 0 "[ . 1 . 2]" 1
544 1 66 PRO HB2 1 67 LEU H 3.910 . 4.300 3.184 2.225 4.043 . 0 0 "[ . 1 . 2]" 1
545 1 21 PHE H 1 74 ALA MB 4.310 . 4.740 3.566 3.158 4.047 . 0 0 "[ . 1 . 2]" 1
546 1 21 PHE H 1 76 VAL MG2 4.240 . 4.660 2.779 2.452 3.817 . 0 0 "[ . 1 . 2]" 1
547 1 21 PHE H 1 76 VAL MG1 4.220 . 4.640 3.107 2.705 3.799 . 0 0 "[ . 1 . 2]" 1
548 1 88 THR MG 1 89 ALA H 4.470 . 4.920 3.550 2.340 4.427 . 0 0 "[ . 1 . 2]" 1
549 1 60 SER H 1 101 LYS HA 3.920 . 4.310 2.444 2.062 2.705 . 0 0 "[ . 1 . 2]" 1
550 1 59 VAL MG1 1 60 SER H 3.650 . 4.020 2.746 2.474 3.031 . 0 0 "[ . 1 . 2]" 1
551 1 108 THR HB 1 109 LEU H 3.860 . 4.250 4.010 3.372 4.328 0.078 13 0 "[ . 1 . 2]" 1
552 1 27 GLU HB2 1 28 VAL H 4.400 . 4.840 4.413 4.297 4.457 . 0 0 "[ . 1 . 2]" 1
553 1 28 VAL H 1 28 VAL MG1 3.280 . 3.610 2.402 2.270 2.676 . 0 0 "[ . 1 . 2]" 1
554 1 28 VAL H 1 28 VAL MG2 3.850 . 4.230 1.980 1.905 2.064 . 0 0 "[ . 1 . 2]" 1
555 1 28 VAL H 1 44 ARG HA 4.250 . 4.680 3.334 3.100 3.635 . 0 0 "[ . 1 . 2]" 1
556 1 28 VAL H 1 43 GLU H 4.200 . 4.620 3.670 3.416 3.853 . 0 0 "[ . 1 . 2]" 1
557 1 41 ILE MG 1 42 LYS H 3.680 . 4.050 2.268 2.038 2.501 . 0 0 "[ . 1 . 2]" 1
558 1 8 ILE HB 1 9 VAL H 4.160 . 4.580 2.458 1.915 3.209 . 0 0 "[ . 1 . 2]" 1
559 1 45 THR MG 1 46 TYR H 3.990 . 4.390 2.721 2.546 3.016 . 0 0 "[ . 1 . 2]" 1
560 1 46 TYR H 1 48 LEU MD1 5.500 . 6.050 5.473 4.803 6.043 . 0 0 "[ . 1 . 2]" 1
561 1 46 TYR H 1 59 VAL MG1 5.500 . 6.050 4.149 3.817 4.329 . 0 0 "[ . 1 . 2]" 1
562 1 46 TYR H 1 59 VAL MG2 5.500 . 6.050 4.807 4.481 5.127 . 0 0 "[ . 1 . 2]" 1
563 1 46 TYR H 1 59 VAL H 4.250 . 4.680 3.261 3.059 3.580 . 0 0 "[ . 1 . 2]" 1
564 1 63 ALA HA 1 65 VAL H 3.980 . 4.380 3.642 3.241 3.949 . 0 0 "[ . 1 . 2]" 1
565 1 61 ILE MD 1 65 VAL H 4.650 . 5.120 4.582 4.080 4.840 . 0 0 "[ . 1 . 2]" 1
566 1 100 ILE MG 1 101 LYS H 3.720 . 4.090 2.959 1.760 3.202 0.040 19 0 "[ . 1 . 2]" 1
567 1 30 ILE HB 1 31 GLN H 4.190 . 4.610 4.271 3.953 4.441 . 0 0 "[ . 1 . 2]" 1
568 1 30 ILE HG12 1 31 GLN H 5.300 . 5.830 4.611 4.345 4.804 . 0 0 "[ . 1 . 2]" 1
569 1 30 ILE HG13 1 31 GLN H 5.300 . 5.830 5.122 5.039 5.190 . 0 0 "[ . 1 . 2]" 1
570 1 30 ILE MG 1 31 GLN H 3.150 . 3.470 2.926 2.332 3.349 . 0 0 "[ . 1 . 2]" 1
571 1 86 VAL HB 1 87 ALA H 4.090 . 4.500 3.847 1.946 4.448 . 0 0 "[ . 1 . 2]" 1
572 1 86 VAL MG1 1 87 ALA H 4.460 . 4.910 3.813 2.231 4.312 . 0 0 "[ . 1 . 2]" 1
573 1 18 GLU HG2 1 19 LEU H 5.140 . 5.650 4.964 3.305 5.640 . 0 0 "[ . 1 . 2]" 1
574 1 82 ILE HB 1 83 ALA H 3.960 . 4.360 3.052 2.507 3.395 . 0 0 "[ . 1 . 2]" 1
575 1 82 ILE MG 1 83 ALA H 3.800 . 4.180 3.882 3.744 3.979 . 0 0 "[ . 1 . 2]" 1
576 1 28 VAL MG1 1 29 ARG H 4.050 . 4.460 3.995 3.809 4.160 . 0 0 "[ . 1 . 2]" 1
577 1 57 ILE MG 1 98 TRP HE1 4.490 . 4.940 2.378 1.786 3.267 0.014 4 0 "[ . 1 . 2]" 1
578 1 98 TRP HE1 1 100 ILE MD 4.450 . 4.890 4.523 3.653 4.943 0.053 11 0 "[ . 1 . 2]" 1
579 1 24 LEU HG 1 25 ARG H 4.440 . 4.880 3.436 2.907 3.828 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU MD1 1 25 ARG H 4.140 . 4.550 2.603 2.075 3.012 . 0 0 "[ . 1 . 2]" 1
581 1 89 ALA H 1 90 THR H 3.570 . 3.930 2.737 2.099 4.086 0.156 19 0 "[ . 1 . 2]" 1
582 1 88 THR H 1 89 ALA H 3.720 . 4.090 2.762 2.089 4.191 0.101 14 0 "[ . 1 . 2]" 1
583 1 86 VAL MG1 1 88 THR H 5.500 . 6.050 5.063 4.054 5.916 . 0 0 "[ . 1 . 2]" 1
584 1 86 VAL MG2 1 88 THR H 5.500 . 6.050 4.446 2.520 5.538 . 0 0 "[ . 1 . 2]" 1
585 1 87 ALA MB 1 88 THR H 3.810 . 4.190 2.813 2.184 3.728 . 0 0 "[ . 1 . 2]" 1
586 1 34 ASP H 1 35 GLY H 3.360 . 3.700 2.717 2.545 3.096 . 0 0 "[ . 1 . 2]" 1
587 1 106 VAL MG2 1 107 LEU H 3.800 . 4.180 3.184 3.067 3.387 . 0 0 "[ . 1 . 2]" 1
588 1 10 LEU MD1 1 11 ASP H 3.960 . 4.360 3.543 1.790 4.446 0.086 4 0 "[ . 1 . 2]" 1
589 1 45 THR HA 1 61 ILE H 4.660 . 5.130 3.692 3.383 4.182 . 0 0 "[ . 1 . 2]" 1
590 1 60 SER HB3 1 61 ILE H 4.970 . 5.470 3.815 3.010 4.281 . 0 0 "[ . 1 . 2]" 1
591 1 79 ILE H 1 106 VAL MG1 4.810 . 5.290 4.606 4.183 5.083 . 0 0 "[ . 1 . 2]" 1
592 1 82 ILE H 1 101 LYS H 4.320 . 4.750 3.438 2.953 3.877 . 0 0 "[ . 1 . 2]" 1
593 1 82 ILE H 1 102 ALA HA 4.230 . 4.650 3.315 2.970 3.771 . 0 0 "[ . 1 . 2]" 1
594 1 82 ILE H 1 102 ALA MB 4.050 . 4.460 3.882 3.570 4.122 . 0 0 "[ . 1 . 2]" 1
595 1 26 ARG HB3 1 27 GLU H 4.220 . 4.640 4.165 4.031 4.288 . 0 0 "[ . 1 . 2]" 1
596 1 26 ARG HG3 1 27 GLU H 4.040 . 4.440 2.835 2.380 3.149 . 0 0 "[ . 1 . 2]" 1
597 1 24 LEU MD2 1 27 GLU H 4.160 . 4.580 4.099 3.561 4.623 0.043 8 0 "[ . 1 . 2]" 1
598 1 73 ASN H 1 74 ALA MB 4.600 . 5.060 4.324 3.816 4.459 . 0 0 "[ . 1 . 2]" 1
599 1 48 LEU H 1 49 LYS H 5.010 . 5.510 4.424 4.307 4.538 . 0 0 "[ . 1 . 2]" 1
600 1 47 ASP HB3 1 48 LEU H 4.320 . 4.750 3.637 3.388 3.771 . 0 0 "[ . 1 . 2]" 1
601 1 47 ASP HB2 1 48 LEU H 4.690 . 5.160 4.425 4.286 4.525 . 0 0 "[ . 1 . 2]" 1
602 1 71 ASP HB3 1 72 TYR H 3.970 . 4.370 3.124 2.286 3.981 . 0 0 "[ . 1 . 2]" 1
603 1 83 ALA MB 1 84 ASP H 3.670 . 4.040 3.225 2.827 3.466 . 0 0 "[ . 1 . 2]" 1
604 1 84 ASP H 1 100 ILE MG 4.260 . 4.690 4.339 3.824 4.634 . 0 0 "[ . 1 . 2]" 1
605 1 30 ILE H 1 42 LYS H 4.440 . 4.880 3.759 3.189 4.342 . 0 0 "[ . 1 . 2]" 1
606 1 30 ILE H 1 41 ILE HA 3.930 . 4.320 3.006 2.458 3.602 . 0 0 "[ . 1 . 2]" 1
607 1 30 ILE H 1 40 GLU QB 4.100 . 4.510 3.750 3.208 4.245 . 0 0 "[ . 1 . 2]" 1
608 1 29 ARG HB2 1 30 ILE H 3.760 . 4.140 3.570 3.127 3.811 . 0 0 "[ . 1 . 2]" 1
609 1 29 ARG HB3 1 30 ILE H 3.760 . 4.140 2.369 2.002 2.683 . 0 0 "[ . 1 . 2]" 1
610 1 24 LEU HA 1 47 ASP H 4.590 . 5.050 3.305 2.810 3.767 . 0 0 "[ . 1 . 2]" 1
611 1 2 MET QG 1 3 ARG H 4.380 . 4.820 3.934 2.305 4.493 . 0 0 "[ . 1 . 2]" 1
612 1 20 LYS H 1 48 LEU HA 4.710 . 5.180 4.371 3.916 4.979 . 0 0 "[ . 1 . 2]" 1
613 1 23 ALA H 1 48 LEU HA 5.330 . 5.860 4.901 4.398 5.439 . 0 0 "[ . 1 . 2]" 1
614 1 29 ARG HA 1 43 GLU H 4.920 . 5.410 4.385 3.945 4.811 . 0 0 "[ . 1 . 2]" 1
615 1 44 ARG H 1 60 SER HA 4.850 . 5.330 4.212 3.765 4.506 . 0 0 "[ . 1 . 2]" 1
616 1 22 SER H 1 48 LEU HA 4.010 . 4.410 3.189 2.427 3.783 . 0 0 "[ . 1 . 2]" 1
617 1 21 PHE H 1 75 ARG HA 4.790 . 5.270 4.183 3.820 4.617 . 0 0 "[ . 1 . 2]" 1
618 1 29 ARG HA 1 42 LYS H 4.140 . 4.550 2.268 1.900 2.827 . 0 0 "[ . 1 . 2]" 1
619 1 46 TYR H 1 60 SER HA 4.810 . 5.290 3.394 3.152 3.730 . 0 0 "[ . 1 . 2]" 1
620 1 25 ARG H 1 46 TYR HA 4.310 . 4.740 2.100 1.876 2.302 . 0 0 "[ . 1 . 2]" 1
621 1 22 SER H 1 23 ALA H 3.250 . 3.580 2.500 2.365 2.874 . 0 0 "[ . 1 . 2]" 1
622 1 51 LYS H 1 52 GLY H 4.750 . 5.220 3.796 2.455 4.667 . 0 0 "[ . 1 . 2]" 1
623 1 6 ASN HB2 1 7 GLY H 4.530 . 4.980 3.554 2.209 4.502 . 0 0 "[ . 1 . 2]" 1
624 1 32 ASN H 1 36 SER H 4.710 . 5.180 4.547 3.954 5.000 . 0 0 "[ . 1 . 2]" 1
625 1 17 GLY H 1 18 GLU H 4.580 . 5.040 4.187 3.181 4.643 . 0 0 "[ . 1 . 2]" 1
626 1 78 LEU HA 1 104 ASP H 4.960 . 5.460 4.685 4.477 4.985 . 0 0 "[ . 1 . 2]" 1
627 1 31 GLN HE22 1 37 VAL MG2 4.860 . 5.350 4.111 3.507 5.058 . 0 0 "[ . 1 . 2]" 1
628 1 13 ASP QB 1 14 THR H 3.940 . 4.330 3.615 2.423 4.053 . 0 0 "[ . 1 . 2]" 1
629 1 81 PRO HA 1 103 ASP H 4.750 . 5.220 3.931 3.301 4.677 . 0 0 "[ . 1 . 2]" 1
630 1 56 MET HB3 1 57 ILE H 4.530 . 4.980 3.802 2.579 4.358 . 0 0 "[ . 1 . 2]" 1
631 1 75 ARG H 1 76 VAL H 4.630 . 5.090 4.446 4.287 4.573 . 0 0 "[ . 1 . 2]" 1
632 1 27 GLU HB3 1 28 VAL H 4.350 . 4.790 3.830 3.517 3.922 . 0 0 "[ . 1 . 2]" 1
633 1 84 ASP H 1 100 ILE HA 3.560 . 3.920 2.844 2.341 3.150 . 0 0 "[ . 1 . 2]" 1
634 1 83 ALA HA 1 101 LYS H 4.010 . 4.410 3.659 3.119 4.034 . 0 0 "[ . 1 . 2]" 1
635 1 102 ALA HA 1 104 ASP H 4.800 . 5.280 4.328 3.875 4.953 . 0 0 "[ . 1 . 2]" 1
636 1 104 ASP H 1 105 ILE H 4.790 . 5.270 4.354 4.270 4.431 . 0 0 "[ . 1 . 2]" 1
637 1 107 LEU H 1 108 THR H 4.700 . 5.170 4.610 4.529 4.651 . 0 0 "[ . 1 . 2]" 1
638 1 70 PHE QE 1 107 LEU H 4.810 . 5.290 4.223 3.455 4.845 . 0 0 "[ . 1 . 2]" 1
639 1 78 LEU HA 1 106 VAL H 3.530 . 3.880 3.470 3.193 3.668 . 0 0 "[ . 1 . 2]" 1
640 1 79 ILE H 1 105 ILE HA 4.150 . 4.570 3.517 3.079 3.922 . 0 0 "[ . 1 . 2]" 1
641 1 78 LEU H 1 79 ILE H 4.860 . 5.350 4.508 4.398 4.577 . 0 0 "[ . 1 . 2]" 1
642 1 79 ILE H 1 106 VAL H 4.890 . 5.380 4.258 3.764 4.688 . 0 0 "[ . 1 . 2]" 1
643 1 59 VAL HA 1 100 ILE H 4.230 . 4.650 2.746 2.405 3.156 . 0 0 "[ . 1 . 2]" 1
644 1 67 LEU HB2 1 68 LYS H 4.750 . 5.220 4.171 4.027 4.352 . 0 0 "[ . 1 . 2]" 1
645 1 76 VAL HB 1 77 GLU H 3.500 . 3.850 2.724 2.126 3.006 . 0 0 "[ . 1 . 2]" 1
646 1 57 ILE H 1 57 ILE MD 4.880 . 5.370 3.814 3.624 4.025 . 0 0 "[ . 1 . 2]" 1
647 1 81 PRO QB 1 82 ILE H 3.590 . 3.950 3.183 2.856 3.426 . 0 0 "[ . 1 . 2]" 1
648 1 98 TRP HB2 1 99 TYR H 4.900 . 5.390 2.694 2.160 3.674 . 0 0 "[ . 1 . 2]" 1
649 1 98 TRP HB3 1 99 TYR H 4.900 . 5.390 3.874 3.592 4.304 . 0 0 "[ . 1 . 2]" 1
650 1 67 LEU HG 1 68 LYS H 4.350 . 4.790 2.865 2.448 3.208 . 0 0 "[ . 1 . 2]" 1
651 1 59 VAL MG1 1 100 ILE H 5.500 . 6.050 4.481 4.186 4.897 . 0 0 "[ . 1 . 2]" 1
652 1 59 VAL MG2 1 100 ILE H 5.500 . 6.050 3.644 3.316 4.149 . 0 0 "[ . 1 . 2]" 1
653 1 32 ASN HB2 1 34 ASP H 4.430 . 4.870 3.101 2.731 3.505 . 0 0 "[ . 1 . 2]" 1
654 1 9 VAL HA 1 9 VAL MG2 3.510 . 3.860 2.413 2.335 2.440 . 0 0 "[ . 1 . 2]" 1
655 1 92 GLN HA 1 92 GLN QG 3.460 . 3.810 2.787 2.404 3.507 . 0 0 "[ . 1 . 2]" 1
656 1 53 GLN HA 1 53 GLN HG3 4.150 . 4.570 3.271 2.442 4.262 . 0 0 "[ . 1 . 2]" 1
657 1 10 LEU HA 1 10 LEU HG 3.740 . 4.110 3.549 3.122 3.774 . 0 0 "[ . 1 . 2]" 1
658 1 19 LEU HA 1 19 LEU MD1 4.040 . 4.440 3.881 3.844 3.908 . 0 0 "[ . 1 . 2]" 1
659 1 42 LYS HA 1 42 LYS HD2 4.130 . 4.540 2.590 2.000 4.598 0.058 11 0 "[ . 1 . 2]" 1
660 1 12 LYS HA 1 12 LYS QD 4.760 . 5.240 3.714 1.838 4.497 . 0 0 "[ . 1 . 2]" 1
661 1 8 ILE HA 1 8 ILE HG12 3.900 . 4.290 3.747 3.700 3.795 . 0 0 "[ . 1 . 2]" 1
662 1 21 PHE QD 1 72 TYR HA 4.760 . 5.240 3.155 2.353 3.810 . 0 0 "[ . 1 . 2]" 1
663 1 88 THR H 1 88 THR HB 3.890 . 4.280 3.268 2.582 3.660 . 0 0 "[ . 1 . 2]" 1
664 1 27 GLU HB3 1 44 ARG HE 5.250 . 5.780 4.019 3.338 5.828 0.048 3 0 "[ . 1 . 2]" 1
665 1 38 SER H 1 38 SER HB2 3.470 . 3.820 2.774 2.546 2.964 . 0 0 "[ . 1 . 2]" 1
666 1 39 ASP H 1 39 ASP HB2 3.600 . 3.960 2.649 2.392 3.621 . 0 0 "[ . 1 . 2]" 1
667 1 109 LEU H 1 109 LEU HB2 3.950 . 4.350 2.786 2.423 3.683 . 0 0 "[ . 1 . 2]" 1
668 1 14 THR HA 1 14 THR HB 2.650 . 2.920 2.468 2.379 2.560 . 0 0 "[ . 1 . 2]" 1
669 1 27 GLU HB2 1 27 GLU HG3 2.550 . 2.800 2.452 2.422 2.485 . 0 0 "[ . 1 . 2]" 1
670 1 67 LEU H 1 67 LEU HG 4.750 . 5.220 4.487 4.451 4.556 . 0 0 "[ . 1 . 2]" 1
671 1 42 LYS HA 1 42 LYS HG2 4.190 . 4.610 3.429 2.531 3.822 . 0 0 "[ . 1 . 2]" 1
672 1 65 VAL HA 1 66 PRO HG3 4.760 . 5.240 4.323 4.020 4.462 . 0 0 "[ . 1 . 2]" 1
673 1 3 ARG H 1 3 ARG QG 3.990 . 4.390 3.440 1.943 4.151 . 0 0 "[ . 1 . 2]" 1
674 1 31 GLN H 1 31 GLN HG2 4.720 . 5.190 4.466 4.409 4.569 . 0 0 "[ . 1 . 2]" 1
675 1 40 GLU H 1 40 GLU HG2 4.200 . 4.620 3.178 2.312 3.840 . 0 0 "[ . 1 . 2]" 1
676 1 49 LYS H 1 49 LYS HG2 4.800 . 5.280 3.195 1.925 4.538 . 0 0 "[ . 1 . 2]" 1
677 1 92 GLN H 1 92 GLN QG 4.260 . 4.690 3.346 2.144 4.315 . 0 0 "[ . 1 . 2]" 1
678 1 26 ARG H 1 26 ARG HG3 5.040 . 5.540 4.868 4.779 4.942 . 0 0 "[ . 1 . 2]" 1
679 1 40 GLU H 1 40 GLU HG3 4.200 . 4.620 2.759 1.937 3.995 . 0 0 "[ . 1 . 2]" 1
680 1 49 LYS H 1 49 LYS HG3 4.800 . 5.280 3.893 3.115 4.556 . 0 0 "[ . 1 . 2]" 1
681 1 75 ARG H 1 75 ARG HG3 4.100 . 4.510 2.505 1.837 4.114 . 0 0 "[ . 1 . 2]" 1
682 1 30 ILE HG12 1 30 ILE MG 3.340 . 3.670 2.398 2.353 2.451 . 0 0 "[ . 1 . 2]" 1
683 1 41 ILE HG13 1 41 ILE MG 3.350 . 3.690 3.178 2.424 3.222 . 0 0 "[ . 1 . 2]" 1
684 1 82 ILE HG13 1 82 ILE MG 3.230 . 3.550 3.219 3.215 3.224 . 0 0 "[ . 1 . 2]" 1
685 1 51 LYS QD 1 52 GLY H 4.630 . 5.090 3.683 1.887 5.053 . 0 0 "[ . 1 . 2]" 1
686 1 95 ASP H 1 95 ASP HB3 3.980 . 4.380 3.075 2.380 3.752 . 0 0 "[ . 1 . 2]" 1
687 1 42 LYS HB3 1 42 LYS HD2 3.990 . 4.390 3.291 2.286 3.821 . 0 0 "[ . 1 . 2]" 1
688 1 49 LYS HE2 1 49 LYS HG2 4.090 . 4.500 3.366 2.333 4.241 . 0 0 "[ . 1 . 2]" 1
689 1 49 LYS HE2 1 49 LYS HG3 4.090 . 4.500 3.150 2.407 4.243 . 0 0 "[ . 1 . 2]" 1
690 1 49 LYS HE3 1 49 LYS HG3 4.090 . 4.500 3.256 2.403 4.224 . 0 0 "[ . 1 . 2]" 1
691 1 67 LEU MD1 1 68 LYS QD 3.620 . 3.980 3.894 3.494 4.211 0.231 8 0 "[ . 1 . 2]" 1
692 1 10 LEU QB 1 10 LEU MD1 3.020 . 3.320 2.187 2.084 2.387 . 0 0 "[ . 1 . 2]" 1
693 1 107 LEU HB2 1 107 LEU MD1 3.370 . 3.710 2.341 2.310 2.367 . 0 0 "[ . 1 . 2]" 1
694 1 4 LEU HB2 1 4 LEU MD2 3.350 . 3.690 2.397 2.282 3.214 . 0 0 "[ . 1 . 2]" 1
695 1 67 LEU HB2 1 67 LEU MD2 3.300 . 3.630 2.403 2.351 2.454 . 0 0 "[ . 1 . 2]" 1
696 1 107 LEU HB2 1 107 LEU MD2 3.490 . 3.840 3.212 3.205 3.219 . 0 0 "[ . 1 . 2]" 1
697 1 10 LEU QB 1 10 LEU MD2 3.020 . 3.320 2.203 2.093 2.374 . 0 0 "[ . 1 . 2]" 1
698 1 67 LEU HB3 1 67 LEU MD2 3.300 . 3.630 2.333 2.297 2.411 . 0 0 "[ . 1 . 2]" 1
699 1 61 ILE MG 1 78 LEU MD2 3.710 . 4.080 3.542 3.266 3.810 . 0 0 "[ . 1 . 2]" 1
700 1 109 LEU HB3 1 109 LEU MD2 3.200 . 3.520 2.387 2.196 2.463 . 0 0 "[ . 1 . 2]" 1
701 1 12 LYS QB 1 12 LYS QD 3.270 . 3.600 2.299 2.128 2.728 . 0 0 "[ . 1 . 2]" 1
702 1 3 ARG HB2 1 3 ARG QD 3.430 . 3.770 2.798 2.312 3.542 . 0 0 "[ . 1 . 2]" 1
703 1 75 ARG HB2 1 75 ARG HD3 3.860 . 4.250 3.045 2.357 3.720 . 0 0 "[ . 1 . 2]" 1
704 1 61 ILE HB 1 62 PRO HD2 4.460 . 4.910 2.245 1.962 2.542 . 0 0 "[ . 1 . 2]" 1
705 1 82 ILE HB 1 82 ILE MD 3.310 . 3.640 2.431 2.389 2.461 . 0 0 "[ . 1 . 2]" 1
706 1 57 ILE MD 1 57 ILE MG 3.260 . 3.590 1.942 1.893 1.975 . 0 0 "[ . 1 . 2]" 1
707 1 79 ILE MD 1 79 ILE MG 3.240 . 3.560 2.209 1.991 3.269 . 0 0 "[ . 1 . 2]" 1
708 1 100 ILE MD 1 100 ILE MG 3.090 . 3.400 1.940 1.878 1.980 . 0 0 "[ . 1 . 2]" 1
709 1 59 VAL MG1 1 105 ILE MD 3.300 . 3.630 2.313 2.023 2.755 . 0 0 "[ . 1 . 2]" 1
710 1 100 ILE HA 1 100 ILE MD 4.000 . 4.400 3.858 3.812 3.899 . 0 0 "[ . 1 . 2]" 1
711 1 105 ILE MD 1 105 ILE MG 3.140 . 3.450 1.939 1.919 1.969 . 0 0 "[ . 1 . 2]" 1
712 1 14 THR HA 1 14 THR MG 3.210 . 3.530 2.693 2.280 3.227 . 0 0 "[ . 1 . 2]" 1
713 1 9 VAL H 1 9 VAL MG2 4.240 . 4.660 2.767 2.061 3.996 . 0 0 "[ . 1 . 2]" 1
714 1 41 ILE H 1 41 ILE MG 4.220 . 4.640 3.853 3.812 3.904 . 0 0 "[ . 1 . 2]" 1
715 1 87 ALA H 1 88 THR MG 4.520 . 4.970 4.138 3.802 4.875 . 0 0 "[ . 1 . 2]" 1
716 1 108 THR MG 1 109 LEU H 3.680 . 4.050 2.537 1.766 3.177 0.034 14 0 "[ . 1 . 2]" 1
717 1 8 ILE HG12 1 8 ILE MG 3.260 . 3.590 2.419 2.358 2.460 . 0 0 "[ . 1 . 2]" 1
718 1 8 ILE HG13 1 8 ILE MG 3.260 . 3.590 3.221 3.216 3.227 . 0 0 "[ . 1 . 2]" 1
719 1 30 ILE HG13 1 30 ILE MG 3.340 . 3.670 3.220 3.212 3.225 . 0 0 "[ . 1 . 2]" 1
720 1 10 LEU H 1 10 LEU MD1 4.210 . 4.630 3.386 1.884 4.196 . 0 0 "[ . 1 . 2]" 1
721 1 24 LEU MD1 1 27 GLU H 5.250 . 5.780 4.419 3.754 5.130 . 0 0 "[ . 1 . 2]" 1
722 1 24 LEU MD1 1 44 ARG HE 5.500 . 6.050 4.434 3.572 6.088 0.038 1 0 "[ . 1 . 2]" 1
723 1 61 ILE MD 1 105 ILE H 4.240 . 4.660 3.455 2.758 3.940 . 0 0 "[ . 1 . 2]" 1
724 1 100 ILE H 1 100 ILE MD 4.420 . 4.860 3.998 3.748 4.197 . 0 0 "[ . 1 . 2]" 1
725 1 89 ALA HA 1 91 TYR H 4.490 . 4.940 4.543 3.400 4.980 0.040 17 0 "[ . 1 . 2]" 1
726 1 95 ASP HA 1 96 VAL H 3.550 . 3.900 2.588 2.159 3.572 . 0 0 "[ . 1 . 2]" 1
727 1 34 ASP HA 1 35 GLY HA3 4.670 . 5.140 4.562 4.342 4.659 . 0 0 "[ . 1 . 2]" 1
728 1 2 MET QB 1 3 ARG H 3.680 . 4.050 3.037 2.097 4.013 . 0 0 "[ . 1 . 2]" 1
729 1 3 ARG HB3 1 4 LEU H 4.880 . 5.370 3.933 2.384 4.582 . 0 0 "[ . 1 . 2]" 1
730 1 11 ASP HB3 1 12 LYS H 4.940 . 5.430 3.651 1.746 4.496 0.054 11 0 "[ . 1 . 2]" 1
731 1 18 GLU QB 1 19 LEU H 4.950 . 5.440 3.429 2.883 3.958 . 0 0 "[ . 1 . 2]" 1
732 1 38 SER HB3 1 39 ASP H 3.590 . 3.950 3.582 3.255 3.920 . 0 0 "[ . 1 . 2]" 1
733 1 51 LYS HB3 1 52 GLY H 4.470 . 4.920 3.492 2.001 4.506 . 0 0 "[ . 1 . 2]" 1
734 1 64 SER HB3 1 65 VAL H 4.880 . 5.370 3.813 2.870 4.312 . 0 0 "[ . 1 . 2]" 1
735 1 95 ASP HB3 1 96 VAL H 4.790 . 5.270 3.882 2.609 4.637 . 0 0 "[ . 1 . 2]" 1
736 1 3 ARG HB2 1 4 LEU H 4.880 . 5.370 4.268 3.207 4.629 . 0 0 "[ . 1 . 2]" 1
737 1 11 ASP HB2 1 12 LYS H 4.940 . 5.430 3.595 2.231 4.658 . 0 0 "[ . 1 . 2]" 1
738 1 26 ARG HB2 1 27 GLU H 4.220 . 4.640 4.074 3.802 4.229 . 0 0 "[ . 1 . 2]" 1
739 1 32 ASN HB2 1 33 GLU H 4.500 . 4.950 3.713 3.386 3.954 . 0 0 "[ . 1 . 2]" 1
740 1 39 ASP HB2 1 40 GLU H 4.290 . 4.720 3.337 2.846 4.144 . 0 0 "[ . 1 . 2]" 1
741 1 51 LYS HB2 1 52 GLY H 4.470 . 4.920 3.724 2.305 4.535 . 0 0 "[ . 1 . 2]" 1
742 1 55 ARG HB2 1 56 MET H 4.210 . 4.630 3.293 2.230 4.409 . 0 0 "[ . 1 . 2]" 1
743 1 60 SER HB2 1 61 ILE H 4.970 . 5.470 4.065 3.210 4.418 . 0 0 "[ . 1 . 2]" 1
744 1 64 SER HB2 1 65 VAL H 4.880 . 5.370 3.715 2.840 4.170 . 0 0 "[ . 1 . 2]" 1
745 1 95 ASP HB2 1 96 VAL H 4.790 . 5.270 4.145 2.575 4.483 . 0 0 "[ . 1 . 2]" 1
746 1 109 LEU HB2 1 110 GLU H 4.550 . 5.010 4.039 2.340 4.481 . 0 0 "[ . 1 . 2]" 1
747 1 9 VAL HB 1 10 LEU H 4.360 . 4.800 3.855 2.091 4.529 . 0 0 "[ . 1 . 2]" 1
748 1 14 THR HB 1 15 THR H 3.870 . 4.260 3.844 1.840 4.341 0.081 10 0 "[ . 1 . 2]" 1
749 1 37 VAL HB 1 38 SER H 3.810 . 4.190 3.992 3.769 4.202 0.012 19 0 "[ . 1 . 2]" 1
750 1 41 ILE HB 1 42 LYS H 4.890 . 5.380 3.896 3.723 4.059 . 0 0 "[ . 1 . 2]" 1
751 1 88 THR HB 1 89 ALA H 4.320 . 4.750 4.120 3.318 4.480 . 0 0 "[ . 1 . 2]" 1
752 1 100 ILE HB 1 101 LYS H 4.570 . 5.030 4.272 3.422 4.385 . 0 0 "[ . 1 . 2]" 1
753 1 3 ARG QG 1 4 LEU H 3.800 . 4.180 3.704 2.936 4.272 0.092 1 0 "[ . 1 . 2]" 1
754 1 12 LYS HG2 1 13 ASP H 4.660 . 5.130 4.093 2.455 5.184 0.054 8 0 "[ . 1 . 2]" 1
755 1 26 ARG HG2 1 27 GLU H 4.740 . 5.210 3.014 2.618 3.308 . 0 0 "[ . 1 . 2]" 1
756 1 27 GLU HG2 1 28 VAL H 5.180 . 5.700 4.796 4.611 4.891 . 0 0 "[ . 1 . 2]" 1
757 1 51 LYS HG2 1 52 GLY H 5.500 . 6.050 4.524 2.293 5.666 . 0 0 "[ . 1 . 2]" 1
758 1 51 LYS HG3 1 52 GLY H 5.500 . 6.050 4.370 2.802 5.870 . 0 0 "[ . 1 . 2]" 1
759 1 75 ARG HG2 1 76 VAL H 4.990 . 5.490 4.611 4.224 5.550 0.060 3 0 "[ . 1 . 2]" 1
760 1 77 GLU HG2 1 78 LEU H 5.000 . 5.500 4.777 4.358 4.957 . 0 0 "[ . 1 . 2]" 1
761 1 18 GLU HG3 1 19 LEU H 5.140 . 5.650 4.720 3.147 5.597 . 0 0 "[ . 1 . 2]" 1
762 1 27 GLU HG3 1 28 VAL H 5.460 . 6.010 5.260 5.192 5.326 . 0 0 "[ . 1 . 2]" 1
763 1 33 GLU HG2 1 34 ASP H 5.500 . 6.050 4.343 2.298 5.443 . 0 0 "[ . 1 . 2]" 1
764 1 33 GLU HG3 1 34 ASP H 5.500 . 6.050 4.090 2.118 5.402 . 0 0 "[ . 1 . 2]" 1
765 1 40 GLU HG3 1 41 ILE H 4.710 . 5.180 4.983 4.249 5.169 . 0 0 "[ . 1 . 2]" 1
766 1 75 ARG HG3 1 76 VAL H 4.990 . 5.490 5.016 3.832 5.274 . 0 0 "[ . 1 . 2]" 1
767 1 101 LYS HG3 1 102 ALA H 5.080 . 5.590 5.025 4.744 5.316 . 0 0 "[ . 1 . 2]" 1
768 1 10 LEU HG 1 11 ASP H 4.670 . 5.140 3.894 1.763 4.977 0.037 15 0 "[ . 1 . 2]" 1
769 1 19 LEU HG 1 20 LYS H 5.500 . 6.050 5.140 4.902 5.243 . 0 0 "[ . 1 . 2]" 1
770 1 61 ILE HA 1 61 ILE MD 4.320 . 4.750 4.208 4.199 4.213 . 0 0 "[ . 1 . 2]" 1
771 1 61 ILE HA 1 62 PRO HD3 4.090 . 4.500 2.377 1.977 2.659 . 0 0 "[ . 1 . 2]" 1
772 1 58 GLN HA 1 59 VAL MG2 4.390 . 4.830 3.761 3.612 3.887 . 0 0 "[ . 1 . 2]" 1
773 1 59 VAL MG1 1 101 LYS HA 4.420 . 4.860 3.498 2.357 4.096 . 0 0 "[ . 1 . 2]" 1
774 1 100 ILE MG 1 101 LYS HA 4.820 . 5.300 4.062 3.781 4.331 . 0 0 "[ . 1 . 2]" 1
775 1 76 VAL MG1 1 107 LEU MD2 3.390 . 3.730 1.863 1.766 2.272 0.034 5 0 "[ . 1 . 2]" 1
776 1 107 LEU H 1 107 LEU MD2 4.080 . 4.490 3.532 3.406 3.698 . 0 0 "[ . 1 . 2]" 1
777 1 24 LEU MD1 1 26 ARG HA 4.670 . 5.140 4.349 3.790 4.774 . 0 0 "[ . 1 . 2]" 1
778 1 78 LEU MD1 1 102 ALA MB 4.490 . 4.940 2.247 1.910 2.898 . 0 0 "[ . 1 . 2]" 1
779 1 59 VAL MG1 1 78 LEU MD1 3.760 . 4.140 2.347 2.101 2.794 . 0 0 "[ . 1 . 2]" 1
780 1 78 LEU MD1 1 81 PRO QB 4.180 . 4.600 2.048 1.822 2.394 . 0 0 "[ . 1 . 2]" 1
781 1 48 LEU MD2 1 76 VAL MG1 4.640 . 5.100 3.548 3.240 3.974 . 0 0 "[ . 1 . 2]" 1
782 1 76 VAL MG1 1 107 LEU HG 4.820 . 5.300 3.837 3.499 4.285 . 0 0 "[ . 1 . 2]" 1
783 1 76 VAL MG1 1 105 ILE MG 3.580 . 3.940 2.986 2.698 3.242 . 0 0 "[ . 1 . 2]" 1
784 1 21 PHE HB3 1 76 VAL MG1 4.770 . 5.250 3.248 2.542 4.554 . 0 0 "[ . 1 . 2]" 1
785 1 21 PHE HB2 1 76 VAL MG1 4.450 . 4.890 2.351 1.868 3.302 . 0 0 "[ . 1 . 2]" 1
786 1 70 PHE QE 1 76 VAL MG1 3.940 . 4.330 3.070 2.749 3.382 . 0 0 "[ . 1 . 2]" 1
787 1 76 VAL H 1 76 VAL MG1 4.100 . 4.510 2.907 2.768 3.039 . 0 0 "[ . 1 . 2]" 1
788 1 19 LEU MD2 1 57 ILE MD 3.200 . 3.520 2.241 1.853 2.911 . 0 0 "[ . 1 . 2]" 1
789 1 16 PHE QD 1 57 ILE MD 4.460 . 4.910 3.539 2.660 4.335 . 0 0 "[ . 1 . 2]" 1
790 1 16 PHE QE 1 57 ILE MD 4.600 . 5.060 3.439 2.516 4.717 . 0 0 "[ . 1 . 2]" 1
791 1 48 LEU MD2 1 76 VAL MG2 3.410 . 3.750 2.107 1.826 2.593 . 0 0 "[ . 1 . 2]" 1
792 1 48 LEU MD1 1 76 VAL MG2 3.440 . 3.780 2.371 2.067 2.922 . 0 0 "[ . 1 . 2]" 1
793 1 21 PHE QD 1 76 VAL MG2 4.880 . 5.370 3.463 2.662 4.414 . 0 0 "[ . 1 . 2]" 1
794 1 70 PHE QE 1 76 VAL MG2 5.440 . 5.980 4.612 4.071 5.044 . 0 0 "[ . 1 . 2]" 1
795 1 79 ILE HG13 1 106 VAL MG2 4.250 . 4.680 3.812 3.297 4.310 . 0 0 "[ . 1 . 2]" 1
796 1 78 LEU HA 1 106 VAL MG2 4.610 . 5.070 3.977 3.635 4.250 . 0 0 "[ . 1 . 2]" 1
797 1 59 VAL MG1 1 78 LEU MD2 2.810 . 3.090 1.955 1.783 2.275 0.017 4 0 "[ . 1 . 2]" 1
798 1 78 LEU MD2 1 102 ALA MB 3.750 . 4.130 2.275 1.945 2.541 . 0 0 "[ . 1 . 2]" 1
799 1 78 LEU H 1 78 LEU MD2 4.440 . 4.880 3.586 3.455 3.727 . 0 0 "[ . 1 . 2]" 1
800 1 61 ILE MG 1 105 ILE MD 3.540 . 3.890 2.415 2.215 2.607 . 0 0 "[ . 1 . 2]" 1
801 1 61 ILE MD 1 105 ILE MD 3.820 . 4.200 2.558 2.224 2.979 . 0 0 "[ . 1 . 2]" 1
802 1 59 VAL HB 1 105 ILE MD 4.170 . 4.590 3.083 2.583 3.756 . 0 0 "[ . 1 . 2]" 1
803 1 70 PHE QE 1 105 ILE MD 5.020 . 5.520 4.455 3.591 5.389 . 0 0 "[ . 1 . 2]" 1
804 1 65 VAL MG1 1 105 ILE MD 4.960 . 5.460 4.864 4.336 5.504 0.044 16 0 "[ . 1 . 2]" 1
805 1 102 ALA MB 1 105 ILE MD 5.390 . 5.930 3.749 3.179 4.073 . 0 0 "[ . 1 . 2]" 1
806 1 79 ILE MD 1 103 ASP HB3 5.000 . 5.500 5.008 3.666 5.517 0.017 5 0 "[ . 1 . 2]" 1
807 1 79 ILE MD 1 104 ASP HB3 4.950 . 5.440 3.603 2.045 4.142 . 0 0 "[ . 1 . 2]" 1
808 1 78 LEU HA 1 79 ILE MD 4.750 . 5.220 4.134 2.929 4.579 . 0 0 "[ . 1 . 2]" 1
809 1 79 ILE MD 1 80 ASN H 4.480 . 4.930 4.165 3.803 4.587 . 0 0 "[ . 1 . 2]" 1
810 1 57 ILE MD 1 100 ILE MD 3.820 . 4.200 1.980 1.751 2.409 0.049 10 0 "[ . 1 . 2]" 1
811 1 57 ILE HB 1 100 ILE MD 4.190 . 4.610 2.396 2.014 2.954 . 0 0 "[ . 1 . 2]" 1
812 1 16 PHE QE 1 100 ILE MD 4.110 . 4.520 2.830 2.097 3.620 . 0 0 "[ . 1 . 2]" 1
813 1 16 PHE HZ 1 100 ILE MD 4.280 . 4.710 2.907 2.359 3.573 . 0 0 "[ . 1 . 2]" 1
814 1 19 LEU MD1 1 78 LEU MD1 3.710 . 4.080 2.960 2.348 4.099 0.019 14 0 "[ . 1 . 2]" 1
815 1 19 LEU MD1 1 78 LEU HG 3.900 . 4.290 2.699 2.006 4.047 . 0 0 "[ . 1 . 2]" 1
816 1 29 ARG HA 1 41 ILE MD 4.840 . 5.320 4.738 3.682 5.193 . 0 0 "[ . 1 . 2]" 1
817 1 41 ILE MD 1 44 ARG HE 4.420 . 4.860 3.350 2.100 4.935 0.075 1 0 "[ . 1 . 2]" 1
818 1 16 PHE HB3 1 19 LEU MD2 4.750 . 5.220 2.521 1.855 3.558 . 0 0 "[ . 1 . 2]" 1
819 1 106 VAL MG1 1 107 LEU H 4.120 . 4.530 3.614 3.549 3.672 . 0 0 "[ . 1 . 2]" 1
820 1 76 VAL MG2 1 105 ILE MG 3.480 . 3.830 2.898 2.575 3.351 . 0 0 "[ . 1 . 2]" 1
821 1 76 VAL HB 1 105 ILE MG 3.450 . 3.790 2.478 2.164 2.809 . 0 0 "[ . 1 . 2]" 1
822 1 70 PHE QE 1 105 ILE MG 3.720 . 4.090 2.250 1.766 3.202 0.034 5 0 "[ . 1 . 2]" 1
823 1 105 ILE MG 1 106 VAL H 3.890 . 4.280 2.890 2.763 3.132 . 0 0 "[ . 1 . 2]" 1
824 1 48 LEU MD1 1 105 ILE MD 3.380 . 3.720 2.765 2.045 3.384 . 0 0 "[ . 1 . 2]" 1
825 1 48 LEU MD1 1 57 ILE MD 3.980 . 4.380 2.916 2.569 3.516 . 0 0 "[ . 1 . 2]" 1
826 1 48 LEU MD1 1 59 VAL HB 4.170 . 4.590 2.846 2.284 3.252 . 0 0 "[ . 1 . 2]" 1
827 1 30 ILE MD 1 40 GLU QB 3.340 . 3.670 1.970 1.825 2.223 . 0 0 "[ . 1 . 2]" 1
828 1 30 ILE MD 1 31 GLN H 5.150 . 5.670 5.305 4.892 5.546 . 0 0 "[ . 1 . 2]" 1
829 1 2 MET QB 1 4 LEU MD1 4.850 . 5.330 3.951 2.815 5.483 0.153 17 0 "[ . 1 . 2]" 1
830 1 8 ILE MG 1 9 VAL H 3.780 . 4.160 3.679 3.509 3.885 . 0 0 "[ . 1 . 2]" 1
831 1 82 ILE MD 1 101 LYS QE 4.310 . 4.740 3.339 2.174 4.761 0.021 10 0 "[ . 1 . 2]" 1
832 1 82 ILE MD 1 83 ALA H 4.630 . 5.090 4.838 4.201 5.117 0.027 17 0 "[ . 1 . 2]" 1
833 1 86 VAL H 1 86 VAL MG2 4.170 . 4.590 2.560 1.981 3.933 . 0 0 "[ . 1 . 2]" 1
834 1 86 VAL MG2 1 87 ALA H 4.460 . 4.910 2.945 1.737 4.319 0.063 16 0 "[ . 1 . 2]" 1
835 1 28 VAL HA 1 28 VAL MG2 3.490 . 3.840 3.227 3.220 3.232 . 0 0 "[ . 1 . 2]" 1
836 1 67 LEU MD2 1 69 GLU QG 3.730 . 4.100 2.918 2.120 4.113 0.013 5 0 "[ . 1 . 2]" 1
837 1 21 PHE HA 1 48 LEU MD2 3.660 . 4.030 1.929 1.779 2.171 0.021 11 0 "[ . 1 . 2]" 1
838 1 21 PHE QD 1 48 LEU MD2 3.790 . 4.170 2.273 1.935 2.846 . 0 0 "[ . 1 . 2]" 1
839 1 61 ILE MD 1 105 ILE HB 4.130 . 4.540 3.460 3.022 3.847 . 0 0 "[ . 1 . 2]" 1
840 1 61 ILE MD 1 68 LYS HE2 4.640 . 5.100 2.934 2.134 4.321 . 0 0 "[ . 1 . 2]" 1
841 1 61 ILE MD 1 104 ASP HA 4.490 . 4.940 3.384 2.739 4.090 . 0 0 "[ . 1 . 2]" 1
842 1 79 ILE MG 1 103 ASP HB2 3.920 . 4.310 3.801 3.120 4.284 . 0 0 "[ . 1 . 2]" 1
843 1 79 ILE MG 1 80 ASN HB3 4.390 . 4.830 4.366 3.985 4.569 . 0 0 "[ . 1 . 2]" 1
844 1 79 ILE MG 1 103 ASP HB3 4.050 . 4.460 2.728 2.122 3.156 . 0 0 "[ . 1 . 2]" 1
845 1 9 VAL H 1 9 VAL MG1 4.240 . 4.660 3.319 1.888 3.912 . 0 0 "[ . 1 . 2]" 1
846 1 28 VAL MG2 1 29 ARG H 3.930 . 4.320 4.099 3.676 4.271 . 0 0 "[ . 1 . 2]" 1
847 1 61 ILE MG 1 62 PRO HD3 4.230 . 4.650 3.932 3.466 4.169 . 0 0 "[ . 1 . 2]" 1
848 1 30 ILE HG13 1 40 GLU QB 4.250 . 4.680 3.226 2.951 3.500 . 0 0 "[ . 1 . 2]" 1
849 1 24 LEU MD1 1 67 LEU MD1 3.840 . 4.220 2.815 2.257 3.724 . 0 0 "[ . 1 . 2]" 1
850 1 44 ARG HE 1 67 LEU MD1 4.530 . 4.980 3.412 2.408 4.919 . 0 0 "[ . 1 . 2]" 1
851 1 61 ILE MD 1 65 VAL MG1 3.100 . 3.410 2.111 1.815 2.648 . 0 0 "[ . 1 . 2]" 1
852 1 59 VAL MG1 1 102 ALA MB 3.250 . 3.580 2.407 2.031 2.923 . 0 0 "[ . 1 . 2]" 1
853 1 74 ALA MB 1 76 VAL MG1 3.930 . 4.320 2.893 2.556 3.184 . 0 0 "[ . 1 . 2]" 1
854 1 21 PHE HB3 1 74 ALA MB 4.360 . 4.800 2.808 2.150 3.488 . 0 0 "[ . 1 . 2]" 1
855 1 21 PHE HB2 1 74 ALA MB 4.520 . 4.970 3.678 2.914 4.611 . 0 0 "[ . 1 . 2]" 1
856 1 71 ASP HB3 1 74 ALA MB 4.100 . 4.510 2.999 1.842 4.377 . 0 0 "[ . 1 . 2]" 1
857 1 70 PHE HA 1 74 ALA MB 4.440 . 4.880 4.215 3.620 4.823 . 0 0 "[ . 1 . 2]" 1
858 1 21 PHE QD 1 74 ALA MB 4.440 . 4.880 3.890 3.387 4.659 . 0 0 "[ . 1 . 2]" 1
859 1 70 PHE QD 1 74 ALA MB 4.600 . 5.060 3.981 3.338 4.562 . 0 0 "[ . 1 . 2]" 1
860 1 79 ILE HG13 1 104 ASP HB3 5.390 . 5.930 2.578 1.899 4.487 . 0 0 "[ . 1 . 2]" 1
861 1 79 ILE HG12 1 104 ASP HB3 5.390 . 5.930 2.903 2.606 3.199 . 0 0 "[ . 1 . 2]" 1
862 1 24 LEU MD1 1 44 ARG HB3 5.280 . 5.810 3.304 2.053 4.710 . 0 0 "[ . 1 . 2]" 1
863 1 62 PRO HA 1 63 ALA MB 4.270 . 4.700 4.060 4.014 4.119 . 0 0 "[ . 1 . 2]" 1
864 1 42 LYS HA 1 63 ALA MB 3.990 . 4.390 3.279 2.547 3.711 . 0 0 "[ . 1 . 2]" 1
865 1 70 PHE QE 1 105 ILE HB 4.880 . 5.370 3.325 2.505 4.165 . 0 0 "[ . 1 . 2]" 1
866 1 68 LYS HE2 1 105 ILE HB 4.700 . 5.170 3.574 2.230 4.620 . 0 0 "[ . 1 . 2]" 1
867 1 30 ILE HG13 1 42 LYS HA 4.750 . 5.220 3.676 2.979 4.273 . 0 0 "[ . 1 . 2]" 1
868 1 83 ALA MB 1 100 ILE MG 3.430 . 3.770 3.535 3.178 3.807 0.037 8 0 "[ . 1 . 2]" 1
869 1 21 PHE QE 1 23 ALA MB 4.700 . 5.170 4.537 4.052 5.102 . 0 0 "[ . 1 . 2]" 1
870 1 23 ALA MB 1 72 TYR QE 5.430 . 5.970 4.266 3.135 5.588 . 0 0 "[ . 1 . 2]" 1
871 1 100 ILE HA 1 101 LYS QD 4.970 . 5.470 5.356 4.843 5.642 0.172 8 0 "[ . 1 . 2]" 1
872 1 48 LEU HA 1 49 LYS HD3 5.500 . 6.050 4.620 3.012 6.102 0.052 8 0 "[ . 1 . 2]" 1
873 1 82 ILE MD 1 101 LYS HB3 4.330 . 4.760 3.566 3.105 4.058 . 0 0 "[ . 1 . 2]" 1
874 1 79 ILE HB 1 103 ASP HB3 4.530 . 4.980 2.597 1.909 3.203 . 0 0 "[ . 1 . 2]" 1
875 1 61 ILE HA 1 62 PRO HD2 4.090 . 4.500 2.444 2.175 2.877 . 0 0 "[ . 1 . 2]" 1
876 1 61 ILE MG 1 62 PRO HD2 4.230 . 4.650 3.245 3.005 3.653 . 0 0 "[ . 1 . 2]" 1
877 1 62 PRO HD3 1 65 VAL MG2 4.960 . 5.460 4.053 3.620 4.506 . 0 0 "[ . 1 . 2]" 1
878 1 41 ILE MG 1 42 LYS HA 4.830 . 5.310 3.855 3.584 3.983 . 0 0 "[ . 1 . 2]" 1
879 1 36 SER HA 1 37 VAL MG2 3.960 . 4.360 3.333 3.241 3.445 . 0 0 "[ . 1 . 2]" 1
880 1 65 VAL HA 1 66 PRO HG2 4.760 . 5.240 4.354 4.198 4.472 . 0 0 "[ . 1 . 2]" 1
881 1 65 VAL HA 1 66 PRO HD2 3.820 . 4.200 2.297 2.005 2.677 . 0 0 "[ . 1 . 2]" 1
882 1 30 ILE MD 1 40 GLU HA 4.310 . 4.740 4.241 4.006 4.508 . 0 0 "[ . 1 . 2]" 1
883 1 9 VAL HA 1 10 LEU HG 4.510 . 4.960 4.194 3.562 5.023 0.063 5 0 "[ . 1 . 2]" 1
884 1 88 THR HA 1 91 TYR QD 5.460 . 6.010 4.504 2.446 5.587 . 0 0 "[ . 1 . 2]" 1
885 1 7 GLY HA2 1 8 ILE MG 4.810 . 5.290 4.261 3.469 5.032 . 0 0 "[ . 1 . 2]" 1
886 1 65 VAL MG1 1 66 PRO HD2 4.160 . 4.580 2.222 1.983 2.624 . 0 0 "[ . 1 . 2]" 1
887 1 20 LYS HB2 1 73 ASN HA 4.080 . 4.490 3.625 2.945 4.562 0.072 14 0 "[ . 1 . 2]" 1
888 1 37 VAL HA 1 38 SER HB3 5.190 . 5.710 4.650 4.569 4.740 . 0 0 "[ . 1 . 2]" 1
889 1 37 VAL HA 1 38 SER HB2 4.510 . 4.960 4.573 4.444 4.704 . 0 0 "[ . 1 . 2]" 1
890 1 30 ILE MG 1 38 SER HB3 4.120 . 4.530 3.522 3.074 3.792 . 0 0 "[ . 1 . 2]" 1
891 1 30 ILE MD 1 38 SER HB3 4.500 . 4.950 4.085 3.616 4.492 . 0 0 "[ . 1 . 2]" 1
892 1 19 LEU MD2 1 50 SER HB3 4.620 . 5.080 3.242 2.124 4.129 . 0 0 "[ . 1 . 2]" 1
893 1 30 ILE HA 1 31 GLN HB3 5.370 . 5.910 4.677 4.600 4.771 . 0 0 "[ . 1 . 2]" 1
894 1 30 ILE HA 1 31 GLN HB2 4.560 . 5.020 4.594 4.373 4.757 . 0 0 "[ . 1 . 2]" 1
895 1 65 VAL MG1 1 66 PRO HD3 4.160 . 4.580 3.390 3.150 3.575 . 0 0 "[ . 1 . 2]" 1
896 1 65 VAL HA 1 66 PRO HD3 3.820 . 4.200 2.231 1.844 2.585 . 0 0 "[ . 1 . 2]" 1
897 1 75 ARG HB2 1 108 THR HB 4.260 . 4.690 3.055 2.447 4.039 . 0 0 "[ . 1 . 2]" 1
898 1 28 VAL MG2 1 42 LYS QE 5.450 . 6.000 5.259 4.510 5.760 . 0 0 "[ . 1 . 2]" 1
899 1 97 ASP QB 1 98 TRP H 4.390 . 4.830 3.057 2.027 4.011 . 0 0 "[ . 1 . 2]" 1
900 1 2 MET QG 1 4 LEU MD2 5.330 . 5.860 3.576 1.865 5.937 0.077 11 0 "[ . 1 . 2]" 1
901 1 71 ASP HB2 1 74 ALA MB 4.100 . 4.510 2.763 1.756 4.389 0.044 13 0 "[ . 1 . 2]" 1
902 1 31 GLN HG2 1 37 VAL MG2 4.640 . 5.100 4.066 3.565 5.015 . 0 0 "[ . 1 . 2]" 1
903 1 30 ILE MD 1 40 GLU HG3 4.130 . 4.540 4.000 3.220 4.474 . 0 0 "[ . 1 . 2]" 1
904 1 67 LEU HG 1 69 GLU QG 4.140 . 4.550 2.602 1.735 3.982 0.065 18 0 "[ . 1 . 2]" 1
905 1 61 ILE HB 1 62 PRO HD3 4.460 . 4.910 3.580 3.196 3.971 . 0 0 "[ . 1 . 2]" 1
906 1 61 ILE HB 1 65 VAL MG2 4.690 . 5.160 2.828 2.324 3.432 . 0 0 "[ . 1 . 2]" 1
907 1 29 ARG HA 1 30 ILE HB 5.390 . 5.930 4.915 4.787 5.014 . 0 0 "[ . 1 . 2]" 1
908 1 29 ARG HA 1 41 ILE HB 5.500 . 6.050 4.681 4.409 5.067 . 0 0 "[ . 1 . 2]" 1
909 1 77 GLU HG2 1 108 THR MG 4.480 . 4.930 3.686 3.314 3.865 . 0 0 "[ . 1 . 2]" 1
910 1 31 GLN HG2 1 35 GLY HA2 4.700 . 5.170 3.516 2.479 4.399 . 0 0 "[ . 1 . 2]" 1
911 1 31 GLN HG3 1 35 GLY HA2 5.500 . 6.050 4.146 3.523 4.842 . 0 0 "[ . 1 . 2]" 1
912 1 17 GLY HA2 1 18 GLU QB 4.950 . 5.440 4.972 4.560 5.396 . 0 0 "[ . 1 . 2]" 1
913 1 17 GLY HA3 1 18 GLU QB 4.950 . 5.440 4.586 4.070 5.051 . 0 0 "[ . 1 . 2]" 1
914 1 68 LYS HE2 1 105 ILE MG 4.880 . 5.370 4.878 3.559 5.454 0.084 5 0 "[ . 1 . 2]" 1
915 1 80 ASN HB2 1 103 ASP HB2 4.930 . 5.420 2.155 1.792 2.899 0.008 20 0 "[ . 1 . 2]" 1
916 1 62 PRO HB3 1 63 ALA MB 5.260 . 5.790 5.033 4.510 5.409 . 0 0 "[ . 1 . 2]" 1
917 1 62 PRO HB3 1 65 VAL MG2 5.080 . 5.590 4.234 3.580 5.038 . 0 0 "[ . 1 . 2]" 1
918 1 62 PRO HB2 1 63 ALA MB 4.550 . 5.010 4.599 4.175 5.066 0.056 7 0 "[ . 1 . 2]" 1
919 1 80 ASN HB2 1 103 ASP H 4.800 . 5.280 2.974 2.352 3.433 . 0 0 "[ . 1 . 2]" 1
920 1 80 ASN HB3 1 103 ASP H 4.800 . 5.280 4.224 3.807 4.663 . 0 0 "[ . 1 . 2]" 1
921 1 68 LYS QD 1 105 ILE HB 4.460 . 4.910 3.136 1.939 4.209 . 0 0 "[ . 1 . 2]" 1
922 1 68 LYS HE3 1 105 ILE HB 4.700 . 5.170 2.747 1.801 4.866 . 0 0 "[ . 1 . 2]" 1
923 1 61 ILE MD 1 68 LYS HE3 4.640 . 5.100 3.227 2.521 4.932 . 0 0 "[ . 1 . 2]" 1
924 1 68 LYS HE3 1 105 ILE MG 4.880 . 5.370 4.193 3.548 5.371 0.001 16 0 "[ . 1 . 2]" 1
925 1 77 GLU HG3 1 108 THR MG 4.480 . 4.930 4.803 4.399 4.959 0.029 15 0 "[ . 1 . 2]" 1
926 1 108 THR MG 1 109 LEU HG 4.210 . 4.630 3.962 1.787 4.710 0.080 19 0 "[ . 1 . 2]" 1
927 1 46 TYR HH 1 67 LEU HA 4.880 . 5.370 2.897 1.887 4.221 . 0 0 "[ . 1 . 2]" 1
928 1 30 ILE MG 1 31 GLN HB3 4.870 . 5.360 4.623 4.078 4.897 . 0 0 "[ . 1 . 2]" 1
929 1 28 VAL HB 1 43 GLU H 5.080 . 5.590 4.410 4.217 4.612 . 0 0 "[ . 1 . 2]" 1
930 1 41 ILE MG 1 44 ARG H 5.340 . 5.870 4.323 3.902 4.763 . 0 0 "[ . 1 . 2]" 1
931 1 41 ILE MG 1 44 ARG HE 5.500 . 6.050 3.832 2.722 4.439 . 0 0 "[ . 1 . 2]" 1
932 1 24 LEU MD2 1 27 GLU HG2 3.990 . 4.390 2.891 2.364 3.355 . 0 0 "[ . 1 . 2]" 1
933 1 24 LEU MD1 1 27 GLU HG3 4.730 . 5.200 3.046 2.337 3.695 . 0 0 "[ . 1 . 2]" 1
934 1 26 ARG HG3 1 28 VAL MG1 3.670 . 4.040 3.912 3.564 4.077 0.037 5 0 "[ . 1 . 2]" 1
935 1 37 VAL MG2 1 38 SER H 4.110 . 4.520 4.041 3.941 4.164 . 0 0 "[ . 1 . 2]" 1
936 1 37 VAL H 1 37 VAL MG1 3.910 . 4.300 3.819 3.780 3.872 . 0 0 "[ . 1 . 2]" 1
937 1 27 GLU HB2 1 41 ILE MG 4.080 . 4.490 3.697 3.059 4.235 . 0 0 "[ . 1 . 2]" 1
938 1 108 THR HA 1 109 LEU HG 4.300 . 4.730 3.985 3.648 4.843 0.113 13 0 "[ . 1 . 2]" 1
939 1 77 GLU HG2 1 108 THR HA 4.290 . 4.720 2.211 1.914 3.081 . 0 0 "[ . 1 . 2]" 1
940 1 79 ILE HG12 1 104 ASP HB2 5.390 . 5.930 4.580 4.339 4.943 . 0 0 "[ . 1 . 2]" 1
941 1 79 ILE HG13 1 104 ASP HB2 5.390 . 5.930 4.220 3.580 5.960 0.030 3 0 "[ . 1 . 2]" 1
942 1 104 ASP HB2 1 106 VAL MG1 4.980 . 5.480 4.764 4.590 5.017 . 0 0 "[ . 1 . 2]" 1
943 1 79 ILE MD 1 104 ASP HB2 4.950 . 5.440 5.022 3.533 5.486 0.046 2 0 "[ . 1 . 2]" 1
944 1 104 ASP HB3 1 106 VAL MG1 4.980 . 5.480 3.661 3.361 3.898 . 0 0 "[ . 1 . 2]" 1
945 1 79 ILE HB 1 104 ASP HB3 4.940 . 5.430 2.752 1.928 3.664 . 0 0 "[ . 1 . 2]" 1
946 1 79 ILE HB 1 104 ASP HB2 4.940 . 5.430 4.036 3.379 4.843 . 0 0 "[ . 1 . 2]" 1
947 1 78 LEU MD2 1 79 ILE HB 4.790 . 5.270 5.300 5.201 5.352 0.082 20 0 "[ . 1 . 2]" 1
948 1 48 LEU HG 1 59 VAL MG2 4.090 . 4.500 2.933 2.541 3.214 . 0 0 "[ . 1 . 2]" 1
949 1 77 GLU HG3 1 108 THR HA 4.290 . 4.720 3.840 3.577 4.668 . 0 0 "[ . 1 . 2]" 1
950 1 81 PRO QB 1 102 ALA MB 3.790 . 4.170 2.927 2.505 3.381 . 0 0 "[ . 1 . 2]" 1
951 1 81 PRO QB 1 100 ILE MG 4.620 . 5.080 2.433 2.009 3.006 . 0 0 "[ . 1 . 2]" 1
952 1 98 TRP H 1 98 TRP HD1 4.130 . 4.540 1.832 1.717 2.214 0.083 2 0 "[ . 1 . 2]" 1
953 1 98 TRP HD1 1 99 TYR H 5.130 . 5.640 5.330 5.092 5.567 . 0 0 "[ . 1 . 2]" 1
954 1 98 TRP HA 1 98 TRP HD1 4.060 . 4.470 4.041 3.929 4.154 . 0 0 "[ . 1 . 2]" 1
955 1 57 ILE MG 1 98 TRP HZ2 4.190 . 4.610 2.506 2.067 3.324 . 0 0 "[ . 1 . 2]" 1
956 1 98 TRP HZ2 1 100 ILE MD 4.420 . 4.860 3.210 2.699 3.950 . 0 0 "[ . 1 . 2]" 1
957 1 57 ILE MG 1 98 TRP HH2 5.190 . 5.710 3.882 3.010 5.097 . 0 0 "[ . 1 . 2]" 1
958 1 98 TRP HH2 1 100 ILE MG 5.390 . 5.930 5.042 4.534 5.804 . 0 0 "[ . 1 . 2]" 1
959 1 98 TRP HZ3 1 100 ILE MG 4.200 . 4.620 4.564 4.047 4.725 0.105 19 0 "[ . 1 . 2]" 1
960 1 83 ALA MB 1 98 TRP HE3 4.390 . 4.830 2.974 2.352 4.020 . 0 0 "[ . 1 . 2]" 1
961 1 98 TRP HE3 1 100 ILE MG 5.430 . 5.970 5.314 4.782 5.612 . 0 0 "[ . 1 . 2]" 1
962 1 70 PHE HA 1 70 PHE QD 3.570 . 3.930 2.093 1.841 2.407 . 0 0 "[ . 1 . 2]" 1
963 1 70 PHE QD 1 105 ILE MG 4.160 . 4.580 3.353 3.049 3.919 . 0 0 "[ . 1 . 2]" 1
964 1 70 PHE QD 1 107 LEU MD1 4.020 . 4.420 3.551 2.931 4.179 . 0 0 "[ . 1 . 2]" 1
965 1 70 PHE QD 1 76 VAL MG1 3.980 . 4.380 2.342 2.018 2.664 . 0 0 "[ . 1 . 2]" 1
966 1 70 PHE QD 1 107 LEU MD2 4.170 . 4.590 2.811 2.389 3.139 . 0 0 "[ . 1 . 2]" 1
967 1 68 LYS HB3 1 70 PHE QE 4.390 . 4.830 3.135 2.651 3.777 . 0 0 "[ . 1 . 2]" 1
968 1 70 PHE HZ 1 107 LEU HG 4.500 . 4.950 3.497 2.845 4.313 . 0 0 "[ . 1 . 2]" 1
969 1 99 TYR HA 1 99 TYR QD 3.670 . 4.040 3.122 3.071 3.180 . 0 0 "[ . 1 . 2]" 1
970 1 91 TYR HA 1 91 TYR QD 3.180 . 3.500 2.634 2.205 3.116 . 0 0 "[ . 1 . 2]" 1
971 1 91 TYR H 1 91 TYR QD 3.620 . 3.980 2.810 2.002 3.561 . 0 0 "[ . 1 . 2]" 1
972 1 99 TYR QD 1 100 ILE H 4.000 . 4.400 4.241 3.750 4.506 0.106 19 0 "[ . 1 . 2]" 1
973 1 99 TYR H 1 99 TYR QD 3.720 . 4.090 2.472 2.213 2.726 . 0 0 "[ . 1 . 2]" 1
974 1 87 ALA MB 1 91 TYR QD 3.540 . 3.890 2.965 1.893 3.907 0.017 11 0 "[ . 1 . 2]" 1
975 1 24 LEU MD2 1 46 TYR QD 4.410 . 4.850 4.711 4.495 4.919 0.069 12 0 "[ . 1 . 2]" 1
976 1 90 THR MG 1 91 TYR QD 4.030 . 4.430 3.395 2.025 4.461 0.031 3 0 "[ . 1 . 2]" 1
977 1 24 LEU HG 1 46 TYR QD 4.800 . 5.280 5.167 4.865 5.331 0.051 17 0 "[ . 1 . 2]" 1
978 1 45 THR MG 1 99 TYR QD 4.970 . 5.470 2.778 2.415 3.779 . 0 0 "[ . 1 . 2]" 1
979 1 46 TYR QD 1 105 ILE MD 3.570 . 3.930 2.513 2.104 2.899 . 0 0 "[ . 1 . 2]" 1
980 1 46 TYR HA 1 46 TYR QD 3.910 . 4.300 2.987 2.536 3.171 . 0 0 "[ . 1 . 2]" 1
981 1 22 SER HA 1 72 TYR QE 3.870 . 4.260 3.033 1.986 3.839 . 0 0 "[ . 1 . 2]" 1
982 1 72 TYR QD 1 73 ASN H 3.890 . 4.280 3.374 2.712 4.055 . 0 0 "[ . 1 . 2]" 1
983 1 72 TYR H 1 72 TYR QD 4.280 . 4.710 4.190 4.148 4.224 . 0 0 "[ . 1 . 2]" 1
984 1 22 SER HA 1 72 TYR QD 3.630 . 3.990 2.708 2.112 3.607 . 0 0 "[ . 1 . 2]" 1
985 1 72 TYR HA 1 72 TYR QD 3.550 . 3.900 2.503 2.073 2.948 . 0 0 "[ . 1 . 2]" 1
986 1 46 TYR QD 1 59 VAL H 5.500 . 6.050 5.040 4.426 5.769 . 0 0 "[ . 1 . 2]" 1
987 1 46 TYR QD 1 61 ILE H 5.500 . 6.050 4.027 3.635 4.935 . 0 0 "[ . 1 . 2]" 1
988 1 46 TYR H 1 46 TYR QD 4.150 . 4.570 2.717 2.307 3.595 . 0 0 "[ . 1 . 2]" 1
989 1 25 ARG H 1 46 TYR QD 4.300 . 4.730 4.272 3.612 4.759 0.029 1 0 "[ . 1 . 2]" 1
990 1 16 PHE QD 1 57 ILE MG 4.170 . 4.590 4.011 3.066 4.618 0.028 2 0 "[ . 1 . 2]" 1
991 1 21 PHE HZ 1 24 LEU H 4.490 . 4.940 4.134 3.310 4.940 0.000 4 0 "[ . 1 . 2]" 1
992 1 16 PHE HZ 1 57 ILE MG 4.360 . 4.800 4.050 2.400 4.859 0.059 5 0 "[ . 1 . 2]" 1
993 1 16 PHE HZ 1 100 ILE MG 4.610 . 5.070 4.730 3.625 5.143 0.073 1 0 "[ . 1 . 2]" 1
994 1 16 PHE QD 1 19 LEU MD1 4.670 . 5.140 3.611 2.363 4.513 . 0 0 "[ . 1 . 2]" 1
995 1 16 PHE QD 1 100 ILE MD 4.960 . 5.460 4.183 3.574 5.036 . 0 0 "[ . 1 . 2]" 1
996 1 70 PHE QE 1 107 LEU HG 4.220 . 4.640 3.026 2.392 3.517 . 0 0 "[ . 1 . 2]" 1
997 1 70 PHE QE 1 107 LEU MD1 4.110 . 4.520 3.347 2.825 3.818 . 0 0 "[ . 1 . 2]" 1
998 1 21 PHE HZ 1 46 TYR QE 4.500 . 4.950 3.482 1.987 4.453 . 0 0 "[ . 1 . 2]" 1
999 1 24 LEU MD1 1 46 TYR QE 3.980 . 4.380 2.680 2.333 2.996 . 0 0 "[ . 1 . 2]" 1
1000 1 46 TYR QE 1 61 ILE MD 3.810 . 4.190 2.177 1.903 2.588 . 0 0 "[ . 1 . 2]" 1
1001 1 46 TYR QE 1 105 ILE HB 4.740 . 5.210 5.001 4.294 5.234 0.024 15 0 "[ . 1 . 2]" 1
1002 1 46 TYR QE 1 67 LEU MD1 3.940 . 4.330 2.467 1.855 3.319 . 0 0 "[ . 1 . 2]" 1
1003 1 24 LEU HB2 1 46 TYR QE 4.360 . 4.800 3.485 2.464 4.423 . 0 0 "[ . 1 . 2]" 1
1004 1 24 LEU MD2 1 46 TYR QE 4.320 . 4.750 3.948 3.462 4.509 . 0 0 "[ . 1 . 2]" 1
1005 1 91 TYR H 1 91 TYR QE 5.310 . 5.840 4.612 4.238 5.185 . 0 0 "[ . 1 . 2]" 1
1006 1 87 ALA HA 1 91 TYR QE 4.420 . 4.860 3.589 2.347 4.900 0.040 20 0 "[ . 1 . 2]" 1
1007 1 87 ALA MB 1 91 TYR QE 3.870 . 4.260 3.324 1.828 4.291 0.031 20 0 "[ . 1 . 2]" 1
1008 1 90 THR MG 1 91 TYR QE 4.410 . 4.850 3.686 2.799 4.903 0.053 19 0 "[ . 1 . 2]" 1
1009 1 58 GLN HB2 1 99 TYR QE 4.390 . 4.830 3.831 3.183 4.308 . 0 0 "[ . 1 . 2]" 1
1010 1 58 GLN HB3 1 99 TYR QE 4.390 . 4.830 3.357 2.935 4.331 . 0 0 "[ . 1 . 2]" 1
1011 1 45 THR MG 1 99 TYR QE 4.280 . 4.710 2.392 1.788 4.372 0.012 2 0 "[ . 1 . 2]" 1
1012 1 97 ASP QB 1 98 TRP HD1 4.720 . 5.190 3.863 2.216 5.103 . 0 0 "[ . 1 . 2]" 1
1013 1 21 PHE HZ 1 23 ALA HA 4.530 . 4.980 3.535 2.787 4.384 . 0 0 "[ . 1 . 2]" 1
1014 1 98 TRP HA 1 99 TYR QD 4.000 . 4.400 3.027 2.707 3.762 . 0 0 "[ . 1 . 2]" 1
1015 1 87 ALA HA 1 91 TYR QD 4.630 . 5.090 3.089 1.811 4.757 . 0 0 "[ . 1 . 2]" 1
1016 1 24 LEU HA 1 46 TYR QD 3.700 . 4.070 2.786 2.049 3.347 . 0 0 "[ . 1 . 2]" 1
1017 1 88 THR HA 1 88 THR HB 2.590 . 2.850 2.462 2.390 2.525 . 0 0 "[ . 1 . 2]" 1
1018 1 25 ARG HA 1 25 ARG HG2 3.930 . 4.320 3.800 3.720 3.892 . 0 0 "[ . 1 . 2]" 1
1019 1 26 ARG HA 1 26 ARG HG3 4.090 . 4.500 2.668 2.560 2.815 . 0 0 "[ . 1 . 2]" 1
1020 1 29 ARG HA 1 29 ARG HG2 3.940 . 4.330 2.507 2.405 2.685 . 0 0 "[ . 1 . 2]" 1
1021 1 30 ILE HA 1 30 ILE MG 3.230 . 3.550 2.386 2.353 2.427 . 0 0 "[ . 1 . 2]" 1
1022 1 40 GLU HA 1 40 GLU HG2 3.680 . 4.050 2.738 2.409 3.686 . 0 0 "[ . 1 . 2]" 1
1023 1 41 ILE HA 1 41 ILE MG 3.270 . 3.600 2.375 2.339 2.418 . 0 0 "[ . 1 . 2]" 1
1024 1 30 ILE HG12 1 42 LYS HA 4.750 . 5.220 3.623 2.836 4.359 . 0 0 "[ . 1 . 2]" 1
1025 1 51 LYS HA 1 51 LYS HG2 4.190 . 4.610 3.296 2.398 4.254 . 0 0 "[ . 1 . 2]" 1
1026 1 53 GLN HA 1 53 GLN HG2 4.150 . 4.570 3.382 2.511 3.789 . 0 0 "[ . 1 . 2]" 1
1027 1 69 GLU HA 1 69 GLU QG 3.310 . 3.640 2.607 2.366 2.993 . 0 0 "[ . 1 . 2]" 1
1028 1 77 GLU HA 1 77 GLU HG2 4.080 . 4.490 3.791 3.747 3.852 . 0 0 "[ . 1 . 2]" 1
1029 1 90 THR HA 1 90 THR MG 3.380 . 3.720 2.767 2.330 3.233 . 0 0 "[ . 1 . 2]" 1
1030 1 101 LYS HA 1 101 LYS HG2 4.180 . 4.600 2.594 2.452 2.751 . 0 0 "[ . 1 . 2]" 1
1031 1 110 GLU HA 1 110 GLU HG2 3.910 . 4.300 3.167 2.457 4.110 . 0 0 "[ . 1 . 2]" 1
1032 1 2 MET HA 1 2 MET QG 3.710 . 4.080 2.939 2.400 3.521 . 0 0 "[ . 1 . 2]" 1
1033 1 18 GLU HA 1 18 GLU HG3 3.960 . 4.360 3.267 2.444 4.273 . 0 0 "[ . 1 . 2]" 1
1034 1 25 ARG HA 1 25 ARG HG3 3.930 . 4.320 3.160 2.974 3.298 . 0 0 "[ . 1 . 2]" 1
1035 1 27 GLU HA 1 27 GLU HG3 4.110 . 4.520 3.167 3.086 3.255 . 0 0 "[ . 1 . 2]" 1
1036 1 29 ARG HA 1 29 ARG HG3 3.940 . 4.330 3.097 2.925 3.374 . 0 0 "[ . 1 . 2]" 1
1037 1 40 GLU HA 1 40 GLU HG3 3.680 . 4.050 3.258 2.477 3.762 . 0 0 "[ . 1 . 2]" 1
1038 1 42 LYS HA 1 42 LYS HG3 4.190 . 4.610 3.220 2.338 3.837 . 0 0 "[ . 1 . 2]" 1
1039 1 51 LYS HA 1 51 LYS HG3 4.190 . 4.610 3.517 2.684 3.777 . 0 0 "[ . 1 . 2]" 1
1040 1 77 GLU HA 1 77 GLU HG3 4.080 . 4.490 3.757 3.705 3.794 . 0 0 "[ . 1 . 2]" 1
1041 1 101 LYS HA 1 101 LYS HG3 4.160 . 4.580 3.032 2.666 3.423 . 0 0 "[ . 1 . 2]" 1
1042 1 4 LEU HA 1 4 LEU HG 3.790 . 4.170 3.688 3.212 3.743 . 0 0 "[ . 1 . 2]" 1
1043 1 48 LEU HA 1 49 LYS HD2 5.500 . 6.050 4.799 3.015 6.072 0.022 19 0 "[ . 1 . 2]" 1
1044 1 67 LEU HA 1 67 LEU HG 4.250 . 4.680 3.143 2.934 3.319 . 0 0 "[ . 1 . 2]" 1
1045 1 78 LEU HA 1 78 LEU HG 4.220 . 4.640 3.129 3.057 3.177 . 0 0 "[ . 1 . 2]" 1
1046 1 4 LEU HA 1 4 LEU MD1 3.620 . 3.980 2.237 1.882 3.854 . 0 0 "[ . 1 . 2]" 1
1047 1 8 ILE HA 1 8 ILE MG 3.170 . 3.490 2.345 2.309 2.395 . 0 0 "[ . 1 . 2]" 1
1048 1 30 ILE HA 1 30 ILE MD 3.970 . 4.370 3.870 3.823 3.902 . 0 0 "[ . 1 . 2]" 1
1049 1 48 LEU HA 1 48 LEU MD1 4.230 . 4.650 3.842 3.791 3.885 . 0 0 "[ . 1 . 2]" 1
1050 1 82 ILE HA 1 100 ILE MG 4.920 . 5.410 3.788 3.433 4.185 . 0 0 "[ . 1 . 2]" 1
1051 1 78 LEU MD2 1 105 ILE HA 3.990 . 4.390 2.526 2.328 2.718 . 0 0 "[ . 1 . 2]" 1
1052 1 4 LEU HA 1 4 LEU MD2 3.540 . 3.890 3.008 2.016 4.027 0.137 10 0 "[ . 1 . 2]" 1
1053 1 10 LEU HA 1 10 LEU MD2 4.420 . 4.860 3.347 1.995 4.126 . 0 0 "[ . 1 . 2]" 1
1054 1 16 PHE HA 1 16 PHE QD 4.040 . 4.440 2.778 2.450 3.107 . 0 0 "[ . 1 . 2]" 1
1055 1 20 LYS HA 1 20 LYS HD2 5.030 . 5.530 4.274 2.637 4.924 . 0 0 "[ . 1 . 2]" 1
1056 1 25 ARG HA 1 25 ARG HD2 3.640 . 4.000 2.869 1.992 3.888 . 0 0 "[ . 1 . 2]" 1
1057 1 51 LYS HA 1 51 LYS QD 4.110 . 4.520 2.867 1.926 4.281 . 0 0 "[ . 1 . 2]" 1
1058 1 25 ARG HA 1 25 ARG HD3 3.640 . 4.000 2.617 2.192 3.076 . 0 0 "[ . 1 . 2]" 1
1059 1 42 LYS HA 1 42 LYS HD3 4.130 . 4.540 2.907 2.094 4.600 0.060 12 0 "[ . 1 . 2]" 1
1060 1 55 ARG HA 1 55 ARG QD 4.540 . 4.990 3.933 1.993 4.644 . 0 0 "[ . 1 . 2]" 1
1061 1 41 ILE HA 1 41 ILE HG12 3.970 . 4.370 2.611 2.484 3.071 . 0 0 "[ . 1 . 2]" 1
1062 1 82 ILE HA 1 83 ALA MB 5.190 . 5.710 4.035 3.938 4.082 . 0 0 "[ . 1 . 2]" 1
1063 1 8 ILE HA 1 8 ILE HG13 3.900 . 4.290 3.731 3.665 3.760 . 0 0 "[ . 1 . 2]" 1
1064 1 30 ILE HA 1 30 ILE HG13 3.880 . 4.270 3.059 2.997 3.130 . 0 0 "[ . 1 . 2]" 1
1065 1 41 ILE HA 1 41 ILE HG13 3.970 . 4.370 3.158 3.061 3.815 . 0 0 "[ . 1 . 2]" 1
1066 1 9 VAL HA 1 9 VAL MG1 3.510 . 3.860 2.650 2.386 3.231 . 0 0 "[ . 1 . 2]" 1
1067 1 37 VAL HA 1 37 VAL MG1 3.200 . 3.520 2.372 2.345 2.404 . 0 0 "[ . 1 . 2]" 1
1068 1 70 PHE HA 1 70 PHE QE 4.570 . 5.030 4.340 4.212 4.453 . 0 0 "[ . 1 . 2]" 1
1069 1 72 TYR HA 1 72 TYR QE 5.500 . 6.050 4.508 4.321 4.705 . 0 0 "[ . 1 . 2]" 1
1070 1 91 TYR HA 1 91 TYR QE 4.880 . 5.370 4.552 4.360 4.758 . 0 0 "[ . 1 . 2]" 1
1071 1 98 TRP HA 1 98 TRP HE3 4.980 . 5.480 4.822 4.684 4.953 . 0 0 "[ . 1 . 2]" 1
1072 1 25 ARG QB 1 47 ASP HA 5.500 . 6.050 3.824 3.416 4.271 . 0 0 "[ . 1 . 2]" 1
1073 1 24 LEU HB2 1 24 LEU MD2 3.320 . 3.650 2.424 2.376 2.466 . 0 0 "[ . 1 . 2]" 1
1074 1 42 LYS HB3 1 42 LYS HD3 3.990 . 4.390 3.416 2.530 3.721 . 0 0 "[ . 1 . 2]" 1
1075 1 109 LEU HA 1 109 LEU HG 4.120 . 4.530 3.213 3.065 3.708 . 0 0 "[ . 1 . 2]" 1
1076 1 3 ARG HA 1 3 ARG QG 3.810 . 4.190 2.689 2.331 3.433 . 0 0 "[ . 1 . 2]" 1
1077 1 18 GLU HA 1 18 GLU HG2 3.960 . 4.360 3.504 2.498 4.210 . 0 0 "[ . 1 . 2]" 1
1078 1 31 GLN HA 1 31 GLN HG2 3.850 . 4.230 3.151 2.998 3.290 . 0 0 "[ . 1 . 2]" 1
1079 1 31 GLN HA 1 31 GLN HG3 3.880 . 4.270 2.540 2.438 2.612 . 0 0 "[ . 1 . 2]" 1
1080 1 110 GLU HA 1 110 GLU HG3 3.910 . 4.300 3.451 2.574 3.842 . 0 0 "[ . 1 . 2]" 1
1081 1 41 ILE HG12 1 41 ILE MG 3.350 . 3.690 2.456 2.398 3.211 . 0 0 "[ . 1 . 2]" 1
1082 1 82 ILE HG12 1 82 ILE MG 3.230 . 3.550 2.404 2.357 2.454 . 0 0 "[ . 1 . 2]" 1
1083 1 4 LEU HB3 1 4 LEU MD2 3.350 . 3.690 3.067 2.168 3.219 . 0 0 "[ . 1 . 2]" 1
1084 1 12 LYS QE 1 12 LYS HG2 3.400 . 3.740 2.854 2.340 3.510 . 0 0 "[ . 1 . 2]" 1
1085 1 51 LYS QE 1 51 LYS HG2 3.470 . 3.820 2.654 2.372 3.326 . 0 0 "[ . 1 . 2]" 1
1086 1 51 LYS QE 1 51 LYS HG3 3.470 . 3.820 2.826 2.334 3.522 . 0 0 "[ . 1 . 2]" 1
1087 1 12 LYS QE 1 12 LYS HG3 3.400 . 3.740 2.831 2.377 3.508 . 0 0 "[ . 1 . 2]" 1
1088 1 101 LYS QE 1 101 LYS HG3 3.410 . 3.750 3.288 2.421 3.524 . 0 0 "[ . 1 . 2]" 1
1089 1 42 LYS QE 1 42 LYS HG2 3.720 . 4.090 2.577 2.396 3.161 . 0 0 "[ . 1 . 2]" 1
1090 1 49 LYS HE3 1 49 LYS HG2 4.090 . 4.500 3.375 2.428 4.253 . 0 0 "[ . 1 . 2]" 1
1091 1 42 LYS QE 1 42 LYS HG3 3.720 . 4.090 2.637 2.341 3.056 . 0 0 "[ . 1 . 2]" 1
1092 1 78 LEU MD1 1 105 ILE MD 4.480 . 4.930 4.328 4.162 4.444 . 0 0 "[ . 1 . 2]" 1
1093 1 109 LEU HB2 1 109 LEU MD1 3.200 . 3.520 2.342 2.194 2.395 . 0 0 "[ . 1 . 2]" 1
1094 1 109 LEU HB2 1 109 LEU MD2 3.200 . 3.520 3.207 3.124 3.220 . 0 0 "[ . 1 . 2]" 1
1095 1 4 LEU HB2 1 4 LEU MD1 3.300 . 3.630 3.076 2.245 3.218 . 0 0 "[ . 1 . 2]" 1
1096 1 4 LEU HB3 1 4 LEU MD1 3.300 . 3.630 2.514 2.335 3.198 . 0 0 "[ . 1 . 2]" 1
1097 1 107 LEU HB3 1 107 LEU MD1 3.370 . 3.710 2.404 2.375 2.428 . 0 0 "[ . 1 . 2]" 1
1098 1 109 LEU HB3 1 109 LEU MD1 3.200 . 3.520 2.409 2.354 2.688 . 0 0 "[ . 1 . 2]" 1
1099 1 107 LEU HB3 1 107 LEU MD2 3.490 . 3.840 2.387 2.350 2.419 . 0 0 "[ . 1 . 2]" 1
1100 1 3 ARG HB3 1 3 ARG QD 3.430 . 3.770 2.766 2.118 3.459 . 0 0 "[ . 1 . 2]" 1
1101 1 26 ARG HB3 1 26 ARG HD3 3.930 . 4.320 3.351 2.478 3.772 . 0 0 "[ . 1 . 2]" 1
1102 1 75 ARG HB3 1 75 ARG HD3 3.860 . 4.250 3.145 2.429 3.733 . 0 0 "[ . 1 . 2]" 1
1103 1 26 ARG HB2 1 26 ARG HD3 3.930 . 4.320 3.520 2.901 3.811 . 0 0 "[ . 1 . 2]" 1
1104 1 42 LYS HB2 1 42 LYS HD3 3.990 . 4.390 2.921 2.383 3.914 . 0 0 "[ . 1 . 2]" 1
1105 1 26 ARG HB3 1 26 ARG HD2 3.930 . 4.320 2.693 2.403 3.242 . 0 0 "[ . 1 . 2]" 1
1106 1 75 ARG HB3 1 75 ARG HD2 3.860 . 4.250 3.193 2.523 4.238 . 0 0 "[ . 1 . 2]" 1
1107 1 26 ARG HB2 1 26 ARG HD2 3.930 . 4.320 2.869 2.461 3.199 . 0 0 "[ . 1 . 2]" 1
1108 1 42 LYS HB2 1 42 LYS HD2 3.990 . 4.390 3.183 2.320 3.668 . 0 0 "[ . 1 . 2]" 1
1109 1 75 ARG HB2 1 75 ARG HD2 3.860 . 4.250 3.087 2.431 3.718 . 0 0 "[ . 1 . 2]" 1
1110 1 30 ILE HB 1 30 ILE MD 3.250 . 3.580 2.429 2.400 2.453 . 0 0 "[ . 1 . 2]" 1
1111 1 41 ILE HB 1 41 ILE MD 3.420 . 3.760 2.485 2.418 3.240 . 0 0 "[ . 1 . 2]" 1
1112 1 82 ILE MD 1 82 ILE MG 2.400 . 2.640 1.969 1.934 2.028 . 0 0 "[ . 1 . 2]" 1
1113 1 8 ILE HA 1 8 ILE MD 4.290 . 4.720 4.204 4.191 4.213 . 0 0 "[ . 1 . 2]" 1
1114 1 41 ILE HA 1 41 ILE MD 3.890 . 4.280 3.774 2.165 3.893 . 0 0 "[ . 1 . 2]" 1
1115 1 109 LEU HA 1 109 LEU MD1 4.090 . 4.500 3.889 3.833 4.105 . 0 0 "[ . 1 . 2]" 1
1116 1 30 ILE MD 1 30 ILE MG 2.400 . 2.640 1.981 1.919 2.051 . 0 0 "[ . 1 . 2]" 1
1117 1 41 ILE MD 1 41 ILE MG 2.400 . 2.640 1.944 1.889 1.971 . 0 0 "[ . 1 . 2]" 1
1118 1 37 VAL HA 1 37 VAL MG2 3.190 . 3.510 2.448 2.395 2.482 . 0 0 "[ . 1 . 2]" 1
1119 1 65 VAL HA 1 65 VAL MG2 3.520 . 3.870 2.436 2.391 2.472 . 0 0 "[ . 1 . 2]" 1
1120 1 20 LYS HA 1 76 VAL MG2 4.270 . 4.700 3.008 2.411 3.656 . 0 0 "[ . 1 . 2]" 1
1121 1 88 THR HA 1 88 THR MG 3.280 . 3.610 2.709 2.314 3.227 . 0 0 "[ . 1 . 2]" 1
1122 1 108 THR HA 1 108 THR MG 3.280 . 3.610 2.343 2.238 2.437 . 0 0 "[ . 1 . 2]" 1
1123 1 100 ILE MG 1 101 LYS HG3 4.800 . 5.280 4.988 4.070 5.251 . 0 0 "[ . 1 . 2]" 1
1124 1 100 ILE MG 1 102 ALA MB 4.370 . 4.810 3.353 2.946 4.049 . 0 0 "[ . 1 . 2]" 1
1125 1 10 LEU HA 1 10 LEU MD1 4.420 . 4.860 3.827 3.515 4.142 . 0 0 "[ . 1 . 2]" 1
1126 1 24 LEU HA 1 24 LEU MD1 3.860 . 4.250 2.141 2.065 2.232 . 0 0 "[ . 1 . 2]" 1
1127 1 67 LEU HA 1 67 LEU MD1 3.450 . 3.790 2.070 1.926 2.148 . 0 0 "[ . 1 . 2]" 1
1128 1 79 ILE HA 1 79 ILE MD 3.420 . 3.760 2.151 1.967 2.816 . 0 0 "[ . 1 . 2]" 1
1129 1 82 ILE HA 1 82 ILE MD 4.290 . 4.720 4.209 4.201 4.218 . 0 0 "[ . 1 . 2]" 1
1130 1 105 ILE HA 1 105 ILE MD 4.550 . 5.010 3.860 3.809 3.889 . 0 0 "[ . 1 . 2]" 1
1131 1 107 LEU HA 1 107 LEU MD1 4.200 . 4.620 3.868 3.850 3.884 . 0 0 "[ . 1 . 2]" 1
1132 1 19 LEU HA 1 19 LEU MD2 3.810 . 4.190 2.045 2.003 2.128 . 0 0 "[ . 1 . 2]" 1
1133 1 48 LEU HA 1 48 LEU MD2 3.690 . 4.060 2.053 1.967 2.178 . 0 0 "[ . 1 . 2]" 1
1134 1 67 LEU HA 1 67 LEU MD2 4.280 . 4.710 3.889 3.838 3.931 . 0 0 "[ . 1 . 2]" 1
1135 1 78 LEU HA 1 78 LEU MD2 3.520 . 3.870 1.998 1.942 2.048 . 0 0 "[ . 1 . 2]" 1
1136 1 107 LEU HA 1 107 LEU MD2 3.430 . 3.770 2.003 1.976 2.062 . 0 0 "[ . 1 . 2]" 1
1137 1 109 LEU HA 1 109 LEU MD2 3.150 . 3.470 2.191 1.979 3.634 0.164 13 0 "[ . 1 . 2]" 1
1138 1 45 THR HA 1 60 SER HA 3.700 . 4.070 2.125 1.806 2.586 . 0 0 "[ . 1 . 2]" 1
1139 1 45 THR MG 1 58 GLN HA 4.690 . 5.160 3.297 3.019 3.638 . 0 0 "[ . 1 . 2]" 1
1140 1 61 ILE HA 1 65 VAL MG2 5.120 . 5.630 4.472 4.021 5.132 . 0 0 "[ . 1 . 2]" 1
1141 1 76 VAL HA 1 108 THR MG 4.930 . 5.420 4.938 4.719 5.257 . 0 0 "[ . 1 . 2]" 1
1142 1 76 VAL HA 1 105 ILE MG 4.500 . 4.950 4.326 3.917 4.688 . 0 0 "[ . 1 . 2]" 1
1143 1 19 LEU HA 1 50 SER HA 4.690 . 5.160 3.012 2.209 3.617 . 0 0 "[ . 1 . 2]" 1
1144 1 20 LYS HA 1 75 ARG HA 4.110 . 4.520 2.931 2.595 3.718 . 0 0 "[ . 1 . 2]" 1
1145 1 81 PRO HA 1 100 ILE MG 4.580 . 5.040 3.215 2.886 3.749 . 0 0 "[ . 1 . 2]" 1
1146 1 59 VAL HA 1 100 ILE HB 4.630 . 5.090 2.918 2.552 3.191 . 0 0 "[ . 1 . 2]" 1
1147 1 49 LYS HA 1 56 MET HA 3.940 . 4.330 2.667 1.844 3.299 . 0 0 "[ . 1 . 2]" 1
1148 1 70 PHE HZ 1 106 VAL HA 4.230 . 4.650 2.678 2.020 3.367 . 0 0 "[ . 1 . 2]" 1
1149 1 70 PHE QE 1 106 VAL HA 4.780 . 5.260 3.342 2.485 3.891 . 0 0 "[ . 1 . 2]" 1
1150 1 81 PRO QB 1 102 ALA HA 4.690 . 5.160 3.998 3.526 4.483 . 0 0 "[ . 1 . 2]" 1
1151 1 82 ILE MD 1 102 ALA HA 5.250 . 5.780 4.932 4.493 5.250 . 0 0 "[ . 1 . 2]" 1
1152 1 100 ILE MG 1 102 ALA HA 5.500 . 6.050 4.342 3.988 4.896 . 0 0 "[ . 1 . 2]" 1
1153 1 81 PRO HA 1 102 ALA HA 3.900 . 4.290 2.346 1.947 2.819 . 0 0 "[ . 1 . 2]" 1
1154 1 24 LEU MD2 1 44 ARG HA 5.500 . 6.050 5.153 4.790 5.574 . 0 0 "[ . 1 . 2]" 1
1155 1 28 VAL MG1 1 44 ARG HA 5.500 . 6.050 4.854 4.479 5.241 . 0 0 "[ . 1 . 2]" 1
1156 1 44 ARG HA 1 45 THR MG 5.500 . 6.050 5.490 5.430 5.526 . 0 0 "[ . 1 . 2]" 1
1157 1 27 GLU HB2 1 44 ARG HA 5.500 . 6.050 4.913 4.557 5.316 . 0 0 "[ . 1 . 2]" 1
1158 1 27 GLU HG3 1 44 ARG HA 5.500 . 6.050 4.375 4.036 4.754 . 0 0 "[ . 1 . 2]" 1
1159 1 83 ALA MB 1 84 ASP HA 4.600 . 5.060 4.391 4.126 4.547 . 0 0 "[ . 1 . 2]" 1
1160 1 82 ILE MD 1 84 ASP HA 5.050 . 5.560 4.466 3.843 5.588 0.028 16 0 "[ . 1 . 2]" 1
1161 1 43 GLU HA 1 63 ALA MB 4.140 . 4.550 3.064 2.072 3.710 . 0 0 "[ . 1 . 2]" 1
1162 1 28 VAL MG2 1 29 ARG HA 4.800 . 5.280 4.243 4.058 4.356 . 0 0 "[ . 1 . 2]" 1
1163 1 29 ARG HA 1 37 VAL MG1 5.500 . 6.050 4.391 4.177 4.788 . 0 0 "[ . 1 . 2]" 1
1164 1 29 ARG HA 1 41 ILE MG 4.220 . 4.640 2.865 2.388 3.491 . 0 0 "[ . 1 . 2]" 1
1165 1 24 LEU HA 1 46 TYR HA 4.140 . 4.550 2.402 2.214 2.600 . 0 0 "[ . 1 . 2]" 1
1166 1 61 ILE MG 1 104 ASP HA 3.630 . 3.990 2.752 2.033 3.065 . 0 0 "[ . 1 . 2]" 1
1167 1 65 VAL MG1 1 104 ASP HA 4.480 . 4.930 2.731 2.259 3.588 . 0 0 "[ . 1 . 2]" 1
1168 1 102 ALA MB 1 104 ASP HA 4.940 . 5.430 4.139 3.900 4.478 . 0 0 "[ . 1 . 2]" 1
1169 1 57 ILE HA 1 100 ILE MD 4.970 . 5.470 4.328 3.797 5.031 . 0 0 "[ . 1 . 2]" 1
1170 1 16 PHE HA 1 16 PHE QE 5.090 . 5.600 4.622 4.467 4.757 . 0 0 "[ . 1 . 2]" 1
1171 1 62 PRO HD2 1 65 VAL MG2 4.960 . 5.460 2.707 2.050 3.451 . 0 0 "[ . 1 . 2]" 1
1172 1 21 PHE QE 1 23 ALA HA 4.160 . 4.580 3.276 2.491 3.952 . 0 0 "[ . 1 . 2]" 1
1173 1 21 PHE QD 1 23 ALA HA 4.820 . 5.300 4.530 3.995 4.986 . 0 0 "[ . 1 . 2]" 1
1174 1 108 THR MG 1 109 LEU HA 4.590 . 5.050 4.101 3.418 4.510 . 0 0 "[ . 1 . 2]" 1
1175 1 76 VAL HA 1 107 LEU HA 3.980 . 4.380 2.089 1.897 2.370 . 0 0 "[ . 1 . 2]" 1
1176 1 29 ARG HA 1 41 ILE HA 3.630 . 3.990 1.849 1.699 2.284 0.101 17 0 "[ . 1 . 2]" 1
1177 1 74 ALA MB 1 107 LEU MD2 3.250 . 3.580 2.675 2.160 3.056 . 0 0 "[ . 1 . 2]" 1
1178 1 76 VAL HA 1 107 LEU MD2 4.250 . 4.680 3.080 2.732 3.258 . 0 0 "[ . 1 . 2]" 1
1179 1 70 PHE QE 1 107 LEU MD2 4.310 . 4.740 3.167 2.679 3.675 . 0 0 "[ . 1 . 2]" 1
1180 1 24 LEU MD1 1 27 GLU HG2 4.580 . 5.040 2.853 2.296 3.464 . 0 0 "[ . 1 . 2]" 1
1181 1 24 LEU MD1 1 44 ARG HA 4.690 . 5.160 3.803 3.432 4.215 . 0 0 "[ . 1 . 2]" 1
1182 1 24 LEU MD1 1 46 TYR HA 4.620 . 5.080 2.718 2.316 3.150 . 0 0 "[ . 1 . 2]" 1
1183 1 24 LEU MD1 1 27 GLU HA 5.370 . 5.910 4.115 3.673 4.656 . 0 0 "[ . 1 . 2]" 1
1184 1 70 PHE HA 1 107 LEU MD2 5.160 . 5.680 4.167 3.501 4.819 . 0 0 "[ . 1 . 2]" 1
1185 1 24 LEU MD1 1 46 TYR QD 4.310 . 4.740 2.908 2.673 3.068 . 0 0 "[ . 1 . 2]" 1
1186 1 59 VAL MG2 1 78 LEU MD1 3.930 . 4.320 2.068 1.800 2.400 . 0 0 "[ . 1 . 2]" 1
1187 1 76 VAL MG1 1 105 ILE HB 5.500 . 6.050 5.132 4.731 5.500 . 0 0 "[ . 1 . 2]" 1
1188 1 76 VAL MG1 1 107 LEU HA 3.970 . 4.370 2.624 2.326 3.079 . 0 0 "[ . 1 . 2]" 1
1189 1 79 ILE HG12 1 106 VAL MG2 4.250 . 4.680 3.141 2.385 4.408 . 0 0 "[ . 1 . 2]" 1
1190 1 105 ILE HA 1 106 VAL MG2 4.870 . 5.360 3.779 3.693 3.848 . 0 0 "[ . 1 . 2]" 1
1191 1 59 VAL HB 1 78 LEU MD2 4.880 . 5.370 3.672 3.344 4.238 . 0 0 "[ . 1 . 2]" 1
1192 1 46 TYR QE 1 105 ILE MD 4.580 . 5.040 3.045 2.196 3.522 . 0 0 "[ . 1 . 2]" 1
1193 1 79 ILE MD 1 106 VAL HB 4.310 . 4.740 4.238 3.924 4.647 . 0 0 "[ . 1 . 2]" 1
1194 1 83 ALA MB 1 100 ILE MD 3.850 . 4.230 3.847 3.277 4.292 0.062 19 0 "[ . 1 . 2]" 1
1195 1 19 LEU MD1 1 77 GLU HA 4.150 . 4.570 2.872 1.963 3.715 . 0 0 "[ . 1 . 2]" 1
1196 1 41 ILE MD 1 63 ALA MB 4.180 . 4.600 3.555 3.035 4.574 . 0 0 "[ . 1 . 2]" 1
1197 1 27 GLU HB3 1 41 ILE MD 4.060 . 4.470 2.451 1.993 3.401 . 0 0 "[ . 1 . 2]" 1
1198 1 27 GLU HB2 1 41 ILE MD 4.020 . 4.420 3.436 2.811 4.445 0.025 12 0 "[ . 1 . 2]" 1
1199 1 29 ARG QD 1 41 ILE MD 4.150 . 4.570 4.104 2.896 4.608 0.038 17 0 "[ . 1 . 2]" 1
1200 1 27 GLU HA 1 41 ILE MD 5.120 . 5.630 4.509 4.116 5.441 . 0 0 "[ . 1 . 2]" 1
1201 1 16 PHE HB2 1 19 LEU MD2 4.750 . 5.220 3.280 1.995 4.637 . 0 0 "[ . 1 . 2]" 1
1202 1 19 LEU MD2 1 50 SER HB2 4.620 . 5.080 3.337 2.081 4.814 . 0 0 "[ . 1 . 2]" 1
1203 1 16 PHE HA 1 19 LEU MD2 4.730 . 5.200 4.285 3.340 4.855 . 0 0 "[ . 1 . 2]" 1
1204 1 19 LEU MD2 1 50 SER HA 3.860 . 4.250 2.463 1.874 3.395 . 0 0 "[ . 1 . 2]" 1
1205 1 106 VAL HA 1 106 VAL MG1 3.330 . 3.660 2.363 2.334 2.379 . 0 0 "[ . 1 . 2]" 1
1206 1 30 ILE MD 1 42 LYS HA 4.120 . 4.530 3.515 2.921 4.200 . 0 0 "[ . 1 . 2]" 1
1207 1 21 PHE QE 1 48 LEU MD2 4.870 . 5.360 3.775 3.378 4.354 . 0 0 "[ . 1 . 2]" 1
1208 1 46 TYR QD 1 48 LEU MD2 5.270 . 5.800 4.271 3.775 4.669 . 0 0 "[ . 1 . 2]" 1
1209 1 59 VAL MG1 1 61 ILE MD 5.190 . 5.710 4.425 4.016 4.954 . 0 0 "[ . 1 . 2]" 1
1210 1 61 ILE MD 1 105 ILE MG 5.500 . 6.050 4.376 4.008 4.770 . 0 0 "[ . 1 . 2]" 1
1211 1 79 ILE MG 1 80 ASN HB2 4.390 . 4.830 3.294 2.867 3.708 . 0 0 "[ . 1 . 2]" 1
1212 1 46 TYR QD 1 61 ILE MG 4.930 . 5.420 3.696 3.282 3.954 . 0 0 "[ . 1 . 2]" 1
1213 1 46 TYR QE 1 61 ILE MG 4.880 . 5.370 3.731 2.906 4.950 . 0 0 "[ . 1 . 2]" 1
1214 1 29 ARG HB3 1 37 VAL MG1 3.950 . 4.350 2.819 2.446 3.244 . 0 0 "[ . 1 . 2]" 1
1215 1 25 ARG QB 1 45 THR MG 3.750 . 4.130 2.074 1.904 2.350 . 0 0 "[ . 1 . 2]" 1
1216 1 45 THR MG 1 60 SER HA 4.330 . 4.760 3.555 3.002 4.248 . 0 0 "[ . 1 . 2]" 1
1217 1 67 LEU MD1 1 69 GLU QG 4.730 . 5.200 3.852 2.391 5.225 0.025 19 0 "[ . 1 . 2]" 1
1218 1 24 LEU HB2 1 67 LEU MD1 4.720 . 5.190 3.709 2.889 4.605 . 0 0 "[ . 1 . 2]" 1
1219 1 44 ARG HD2 1 67 LEU MD1 4.210 . 4.630 3.482 2.360 4.655 0.025 5 0 "[ . 1 . 2]" 1
1220 1 44 ARG HD3 1 67 LEU MD1 4.210 . 4.630 2.460 1.785 3.389 0.015 12 0 "[ . 1 . 2]" 1
1221 1 81 PRO HA 1 102 ALA MB 3.900 . 4.290 2.595 2.309 2.923 . 0 0 "[ . 1 . 2]" 1
1222 1 74 ALA MB 1 107 LEU MD1 4.370 . 4.810 4.101 3.601 4.680 . 0 0 "[ . 1 . 2]" 1
1223 1 41 ILE MG 1 63 ALA MB 3.280 . 3.610 2.400 1.981 3.529 . 0 0 "[ . 1 . 2]" 1
1224 1 41 ILE HB 1 63 ALA MB 3.700 . 4.070 2.234 1.868 3.290 . 0 0 "[ . 1 . 2]" 1
1225 1 87 ALA MB 1 99 TYR QD 4.410 . 4.850 3.207 1.961 4.473 . 0 0 "[ . 1 . 2]" 1
1226 1 87 ALA MB 1 99 TYR QE 5.420 . 5.960 3.665 1.789 5.318 0.011 15 0 "[ . 1 . 2]" 1
1227 1 26 ARG HG3 1 45 THR HB 5.150 . 5.670 5.718 5.670 5.780 0.110 17 0 "[ . 1 . 2]" 1
1228 1 68 LYS HB3 1 69 GLU HB2 5.060 . 5.570 5.472 5.042 5.733 0.163 4 0 "[ . 1 . 2]" 1
1229 1 4 LEU MD1 1 5 ALA MB 4.230 . 4.650 4.576 4.024 4.757 0.107 18 0 "[ . 1 . 2]" 1
1230 1 30 ILE HA 1 30 ILE HG12 3.880 . 4.270 2.595 2.508 2.657 . 0 0 "[ . 1 . 2]" 1
1231 1 83 ALA MB 1 98 TRP HZ3 4.780 . 5.260 2.473 1.770 4.358 0.030 18 0 "[ . 1 . 2]" 1
1232 1 20 LYS HA 1 20 LYS HD3 5.030 . 5.530 4.318 2.115 4.790 . 0 0 "[ . 1 . 2]" 1
1233 1 84 ASP HA 1 101 LYS QD 4.770 . 5.250 4.315 2.563 5.267 0.017 18 0 "[ . 1 . 2]" 1
1234 1 77 GLU HB3 1 106 VAL MG2 4.180 . 4.600 4.451 4.281 4.577 . 0 0 "[ . 1 . 2]" 1
1235 1 101 LYS HA 1 101 LYS QD 4.330 . 4.760 4.185 3.811 4.327 . 0 0 "[ . 1 . 2]" 1
1236 1 26 ARG HB2 1 45 THR HB 5.010 . 5.510 4.546 4.319 4.994 . 0 0 "[ . 1 . 2]" 1
1237 1 26 ARG HB3 1 45 THR HB 5.010 . 5.510 3.096 2.896 3.421 . 0 0 "[ . 1 . 2]" 1
1238 1 61 ILE MG 1 105 ILE HA 4.740 . 5.210 4.472 4.117 4.758 . 0 0 "[ . 1 . 2]" 1
1239 1 27 GLU HA 1 44 ARG HA 3.630 . 3.990 2.218 1.929 2.441 . 0 0 "[ . 1 . 2]" 1
1240 1 43 GLU HG2 1 62 PRO HA 5.500 . 6.050 3.505 1.962 5.303 . 0 0 "[ . 1 . 2]" 1
1241 1 43 GLU HG3 1 62 PRO HA 5.500 . 6.050 4.514 3.602 5.450 . 0 0 "[ . 1 . 2]" 1
1242 1 26 ARG HG2 1 45 THR HB 4.260 . 4.690 4.657 4.405 4.748 0.058 12 0 "[ . 1 . 2]" 1
1243 1 25 ARG QB 1 45 THR HB 4.910 . 5.400 2.514 2.185 2.786 . 0 0 "[ . 1 . 2]" 1
1244 1 75 ARG HB3 1 108 THR HB 4.260 . 4.690 2.271 1.797 2.988 0.003 20 0 "[ . 1 . 2]" 1
1245 1 68 LYS HA 1 68 LYS QD 4.210 . 4.630 2.542 2.082 3.195 . 0 0 "[ . 1 . 2]" 1
1246 1 44 ARG HD2 1 67 LEU HA 4.760 . 5.240 3.668 2.785 4.677 . 0 0 "[ . 1 . 2]" 1
1247 1 44 ARG HD3 1 67 LEU HA 4.760 . 5.240 3.451 2.564 4.485 . 0 0 "[ . 1 . 2]" 1
1248 1 22 SER HB3 1 47 ASP HB2 5.500 . 6.050 3.745 2.242 4.812 . 0 0 "[ . 1 . 2]" 1
1249 1 22 SER HB3 1 47 ASP HB3 5.100 . 5.610 3.872 2.671 5.095 . 0 0 "[ . 1 . 2]" 1
1250 1 21 PHE HA 1 48 LEU HA 4.610 . 5.070 2.950 2.668 3.324 . 0 0 "[ . 1 . 2]" 1
1251 1 21 PHE HA 1 48 LEU MD1 4.740 . 5.210 4.320 3.984 4.867 . 0 0 "[ . 1 . 2]" 1
1252 1 21 PHE HA 1 76 VAL MG2 4.950 . 5.440 3.315 2.711 4.151 . 0 0 "[ . 1 . 2]" 1
1253 1 21 PHE HA 1 76 VAL MG1 5.040 . 5.540 4.167 3.683 4.869 . 0 0 "[ . 1 . 2]" 1
1254 1 31 GLN HB3 1 32 ASN HA 5.390 . 5.930 5.232 4.868 5.407 . 0 0 "[ . 1 . 2]" 1
1255 1 32 ASN HA 1 33 GLU QB 5.500 . 6.050 4.604 4.419 4.798 . 0 0 "[ . 1 . 2]" 1
1256 1 31 GLN HG2 1 32 ASN HA 5.500 . 6.050 4.618 4.032 4.934 . 0 0 "[ . 1 . 2]" 1
1257 1 30 ILE MG 1 32 ASN HA 4.150 . 4.570 3.803 3.372 4.280 . 0 0 "[ . 1 . 2]" 1
1258 1 43 GLU HA 1 63 ALA HA 4.540 . 4.990 3.467 2.791 3.922 . 0 0 "[ . 1 . 2]" 1
1259 1 31 GLN HA 1 37 VAL HA 3.250 . 3.580 1.967 1.767 2.376 0.033 13 0 "[ . 1 . 2]" 1
1260 1 85 THR HA 1 86 VAL MG1 5.500 . 6.050 4.727 3.749 5.927 . 0 0 "[ . 1 . 2]" 1
1261 1 85 THR HA 1 86 VAL MG2 5.500 . 6.050 4.996 3.750 6.071 0.021 13 0 "[ . 1 . 2]" 1
1262 1 24 LEU MD2 1 26 ARG HA 4.090 . 4.500 4.345 3.980 4.550 0.050 1 0 "[ . 1 . 2]" 1
1263 1 28 VAL HA 1 28 VAL MG1 3.280 . 3.610 2.321 2.272 2.364 . 0 0 "[ . 1 . 2]" 1
1264 1 38 SER HB3 1 40 GLU QB 4.390 . 4.830 3.217 2.689 4.069 . 0 0 "[ . 1 . 2]" 1
1265 1 38 SER HB2 1 40 GLU QB 4.810 . 5.290 4.400 3.873 5.220 . 0 0 "[ . 1 . 2]" 1
1266 1 30 ILE HB 1 38 SER HB2 3.930 . 4.320 3.823 3.246 4.057 . 0 0 "[ . 1 . 2]" 1
1267 1 30 ILE HB 1 38 SER HB3 3.650 . 4.020 2.486 1.924 2.773 . 0 0 "[ . 1 . 2]" 1
1268 1 37 VAL MG1 1 38 SER HB3 4.700 . 5.170 4.004 3.699 4.332 . 0 0 "[ . 1 . 2]" 1
1269 1 30 ILE MG 1 38 SER HB2 3.740 . 4.110 3.979 3.261 4.158 0.048 7 0 "[ . 1 . 2]" 1
1270 1 30 ILE MD 1 42 LYS QE 4.830 . 5.310 4.135 2.615 5.152 . 0 0 "[ . 1 . 2]" 1
1271 1 27 GLU HG2 1 41 ILE MD 5.230 . 5.750 3.810 3.332 4.838 . 0 0 "[ . 1 . 2]" 1
1272 1 82 ILE MD 1 101 LYS QD 3.820 . 4.200 3.385 2.373 4.238 0.038 14 0 "[ . 1 . 2]" 1
1273 1 83 ALA HA 1 100 ILE MD 4.810 . 5.290 4.230 3.862 4.867 . 0 0 "[ . 1 . 2]" 1
1274 1 46 TYR QD 1 61 ILE MD 4.990 . 5.490 3.617 2.864 4.093 . 0 0 "[ . 1 . 2]" 1
1275 1 59 VAL MG1 1 61 ILE MG 3.510 . 3.860 2.578 2.242 3.079 . 0 0 "[ . 1 . 2]" 1
1276 1 77 GLU HB2 1 108 THR MG 3.820 . 4.200 4.155 3.679 4.249 0.049 20 0 "[ . 1 . 2]" 1
1277 1 77 GLU HB3 1 108 THR MG 3.820 . 4.200 2.863 2.366 3.186 . 0 0 "[ . 1 . 2]" 1
1278 1 25 ARG HD2 1 45 THR MG 4.850 . 5.330 4.778 4.346 5.337 0.007 18 0 "[ . 1 . 2]" 1
1279 1 25 ARG HD3 1 45 THR MG 4.850 . 5.330 4.584 4.107 5.042 . 0 0 "[ . 1 . 2]" 1
1280 1 45 THR MG 1 58 GLN HG2 4.510 . 4.960 3.741 2.964 4.640 . 0 0 "[ . 1 . 2]" 1
1281 1 45 THR MG 1 58 GLN HG3 4.510 . 4.960 3.799 2.718 4.693 . 0 0 "[ . 1 . 2]" 1
1282 1 2 MET QB 1 4 LEU MD2 4.230 . 4.650 3.024 1.915 4.187 . 0 0 "[ . 1 . 2]" 1
1283 1 101 LYS QE 1 101 LYS HG2 3.540 . 3.890 2.702 2.254 3.495 . 0 0 "[ . 1 . 2]" 1
1284 1 62 PRO HG2 1 65 VAL MG2 4.710 . 5.180 2.332 1.800 3.419 . 0 0 "[ . 1 . 2]" 1
1285 1 62 PRO HG3 1 65 VAL MG2 4.710 . 5.180 3.667 3.257 4.538 . 0 0 "[ . 1 . 2]" 1
1286 1 30 ILE HG12 1 40 GLU QB 4.250 . 4.680 4.302 4.063 4.601 . 0 0 "[ . 1 . 2]" 1
1287 1 61 ILE MD 1 65 VAL HB 3.840 . 4.220 2.401 1.908 2.731 . 0 0 "[ . 1 . 2]" 1
1288 1 29 ARG HB2 1 37 VAL MG1 3.950 . 4.350 2.245 1.956 2.735 . 0 0 "[ . 1 . 2]" 1
1289 1 29 ARG QD 1 37 VAL HB 4.880 . 5.370 4.771 4.028 5.432 0.062 19 0 "[ . 1 . 2]" 1
1290 1 24 LEU MD1 1 44 ARG HB2 5.280 . 5.810 3.945 2.077 4.894 . 0 0 "[ . 1 . 2]" 1
1291 1 31 GLN HG3 1 37 VAL MG2 4.100 . 4.510 2.557 2.058 3.492 . 0 0 "[ . 1 . 2]" 1
1292 1 31 GLN HG2 1 37 VAL HA 4.180 . 4.600 4.208 3.668 4.617 0.017 8 0 "[ . 1 . 2]" 1
1293 1 31 GLN HG3 1 37 VAL HA 4.220 . 4.640 2.912 2.178 3.243 . 0 0 "[ . 1 . 2]" 1
1294 1 82 ILE MD 1 101 LYS HB2 4.330 . 4.760 2.721 2.271 3.332 . 0 0 "[ . 1 . 2]" 1
1295 1 30 ILE MD 1 40 GLU HG2 4.130 . 4.540 4.165 3.336 4.523 . 0 0 "[ . 1 . 2]" 1
1296 1 72 TYR QD 1 73 ASN HB2 5.350 . 5.890 3.836 3.127 5.000 . 0 0 "[ . 1 . 2]" 1
1297 1 72 TYR QD 1 73 ASN HB3 5.350 . 5.890 5.080 4.390 5.761 . 0 0 "[ . 1 . 2]" 1
1298 1 80 ASN HB3 1 103 ASP HB2 4.930 . 5.420 3.632 3.310 4.365 . 0 0 "[ . 1 . 2]" 1
1299 1 24 LEU MD2 1 27 GLU HG3 4.130 . 4.540 2.200 1.880 2.663 . 0 0 "[ . 1 . 2]" 1
1300 1 30 ILE HB 1 38 SER HA 5.500 . 6.050 5.492 4.956 5.805 . 0 0 "[ . 1 . 2]" 1
1301 1 87 ALA MB 1 99 TYR HB3 5.350 . 5.890 4.996 3.696 5.961 0.071 5 0 "[ . 1 . 2]" 1
1302 1 87 ALA MB 1 99 TYR HB2 5.350 . 5.890 3.869 2.646 4.962 . 0 0 "[ . 1 . 2]" 1
1303 1 21 PHE HB3 1 48 LEU MD2 5.170 . 5.690 4.047 3.822 4.264 . 0 0 "[ . 1 . 2]" 1
1304 1 46 TYR HB3 1 48 LEU MD1 4.980 . 5.480 4.497 3.818 4.983 . 0 0 "[ . 1 . 2]" 1
1305 1 46 TYR HB2 1 48 LEU MD1 4.980 . 5.480 3.902 3.141 4.364 . 0 0 "[ . 1 . 2]" 1
1306 1 22 SER HB2 1 47 ASP HB2 5.500 . 6.050 3.656 2.303 4.970 . 0 0 "[ . 1 . 2]" 1
1307 1 30 ILE HA 1 42 LYS QE 5.500 . 6.050 4.676 2.309 5.867 . 0 0 "[ . 1 . 2]" 1
1308 1 23 ALA HA 1 47 ASP HB2 4.850 . 5.330 4.696 4.214 5.154 . 0 0 "[ . 1 . 2]" 1
1309 1 47 ASP HB2 1 48 LEU MD2 4.850 . 5.330 4.739 4.518 4.964 . 0 0 "[ . 1 . 2]" 1
1310 1 30 ILE MG 1 42 LYS QE 4.310 . 4.740 4.070 2.201 4.808 0.068 7 0 "[ . 1 . 2]" 1
1311 1 12 LYS QB 1 12 LYS QE 3.690 . 4.060 2.911 1.813 3.865 . 0 0 "[ . 1 . 2]" 1
1312 1 29 ARG HA 1 29 ARG QD 3.750 . 4.130 3.996 3.917 4.239 0.109 8 0 "[ . 1 . 2]" 1
1313 1 3 ARG HA 1 3 ARG QD 4.060 . 4.470 3.629 2.023 4.498 0.028 17 0 "[ . 1 . 2]" 1
1314 1 29 ARG QD 1 41 ILE HA 4.450 . 4.890 4.193 3.765 4.902 0.012 8 0 "[ . 1 . 2]" 1
1315 1 31 GLN HG2 1 35 GLY HA3 5.500 . 6.050 5.045 4.108 5.809 . 0 0 "[ . 1 . 2]" 1
1316 1 7 GLY HA3 1 8 ILE MG 4.810 . 5.290 4.147 3.428 4.996 . 0 0 "[ . 1 . 2]" 1
1317 1 20 LYS HA 1 73 ASN HA 4.890 . 5.380 4.021 3.118 4.845 . 0 0 "[ . 1 . 2]" 1
1318 1 32 ASN HA 1 33 GLU HA 4.760 . 5.240 4.354 4.299 4.431 . 0 0 "[ . 1 . 2]" 1
1319 1 26 ARG HA 1 27 GLU HG3 3.520 . 3.870 3.855 3.669 3.938 0.068 12 0 "[ . 1 . 2]" 1
1320 1 43 GLU HA 1 62 PRO HA 3.760 . 4.140 2.841 2.476 3.246 . 0 0 "[ . 1 . 2]" 1
1321 1 37 VAL MG1 1 38 SER HB2 4.480 . 4.930 4.670 4.430 4.956 0.026 15 0 "[ . 1 . 2]" 1
1322 1 22 SER HB2 1 47 ASP HB3 5.100 . 5.610 3.787 2.369 4.988 . 0 0 "[ . 1 . 2]" 1
1323 1 65 VAL MG1 1 66 PRO HA 4.550 . 5.010 4.338 4.166 4.512 . 0 0 "[ . 1 . 2]" 1
1324 1 89 ALA MB 1 90 THR HA 5.000 . 5.500 4.137 3.817 4.869 . 0 0 "[ . 1 . 2]" 1
1325 1 24 LEU HG 1 26 ARG HA 4.270 . 4.700 3.697 3.323 4.022 . 0 0 "[ . 1 . 2]" 1
1326 1 83 ALA HA 1 100 ILE HA 3.940 . 4.330 2.471 2.040 2.852 . 0 0 "[ . 1 . 2]" 1
1327 1 31 GLN HA 1 37 VAL MG1 3.750 . 4.130 2.909 2.178 3.639 . 0 0 "[ . 1 . 2]" 1
1328 1 41 ILE MG 1 63 ALA HA 4.340 . 4.770 3.599 2.833 4.330 . 0 0 "[ . 1 . 2]" 1
1329 1 41 ILE HB 1 63 ALA HA 4.720 . 5.190 4.041 3.240 4.544 . 0 0 "[ . 1 . 2]" 1
1330 1 67 LEU MD2 1 69 GLU HA 4.590 . 5.050 4.662 4.178 5.076 0.026 11 0 "[ . 1 . 2]" 1
1331 1 20 LYS HB3 1 73 ASN HA 4.080 . 4.490 2.263 1.755 3.843 0.045 6 0 "[ . 1 . 2]" 1
1332 1 26 ARG HD2 1 28 VAL MG1 4.590 . 5.050 3.171 2.192 4.297 . 0 0 "[ . 1 . 2]" 1
1333 1 26 ARG HD3 1 28 VAL MG1 4.590 . 5.050 2.807 2.383 3.200 . 0 0 "[ . 1 . 2]" 1
1334 1 29 ARG QD 1 37 VAL MG1 3.450 . 3.790 2.983 2.476 3.655 . 0 0 "[ . 1 . 2]" 1
1335 1 29 ARG QD 1 41 ILE MG 4.300 . 4.730 4.507 3.806 4.792 0.062 1 0 "[ . 1 . 2]" 1
1336 1 61 ILE MG 1 104 ASP HB2 5.500 . 6.050 4.803 4.211 5.097 . 0 0 "[ . 1 . 2]" 1
1337 1 79 ILE MG 1 104 ASP HB2 5.500 . 6.050 4.387 3.864 5.071 . 0 0 "[ . 1 . 2]" 1
1338 1 30 ILE HB 1 40 GLU QB 3.840 . 4.220 2.860 2.157 3.689 . 0 0 "[ . 1 . 2]" 1
1339 1 77 GLU HG3 1 106 VAL MG2 4.130 . 4.540 2.220 1.848 2.439 . 0 0 "[ . 1 . 2]" 1
1340 1 77 GLU HG2 1 106 VAL MG2 4.130 . 4.540 2.527 2.321 2.691 . 0 0 "[ . 1 . 2]" 1
1341 1 77 GLU HB2 1 106 VAL MG2 4.180 . 4.600 4.244 3.936 4.433 . 0 0 "[ . 1 . 2]" 1
1342 1 104 ASP HA 1 105 ILE MD 4.930 . 5.420 4.812 4.693 4.942 . 0 0 "[ . 1 . 2]" 1
1343 1 78 LEU MD2 1 104 ASP HA 4.500 . 4.950 4.985 4.760 5.072 0.122 19 0 "[ . 1 . 2]" 1
1344 1 83 ALA MB 1 100 ILE HA 4.300 . 4.730 3.994 3.501 4.415 . 0 0 "[ . 1 . 2]" 1
1345 1 78 LEU HA 1 106 VAL MG1 4.950 . 5.440 5.070 4.799 5.259 . 0 0 "[ . 1 . 2]" 1
1346 1 20 LYS HA 1 20 LYS QE 4.850 . 5.330 4.287 3.320 4.861 . 0 0 "[ . 1 . 2]" 1
1347 1 20 LYS QE 1 75 ARG HA 5.500 . 6.050 4.803 3.026 5.988 . 0 0 "[ . 1 . 2]" 1
1348 1 61 ILE HA 1 62 PRO HG2 5.030 . 5.530 4.498 4.351 4.617 . 0 0 "[ . 1 . 2]" 1
1349 1 61 ILE HA 1 62 PRO HG3 5.030 . 5.530 4.469 4.111 4.654 . 0 0 "[ . 1 . 2]" 1
1350 1 27 GLU HB3 1 41 ILE MG 4.010 . 4.410 2.403 1.945 2.875 . 0 0 "[ . 1 . 2]" 1
1351 1 67 LEU MD2 1 68 LYS HB2 5.500 . 6.050 5.838 5.577 6.077 0.027 1 0 "[ . 1 . 2]" 1
1352 1 26 ARG HG2 1 28 VAL MG1 3.580 . 3.940 2.590 2.326 2.739 . 0 0 "[ . 1 . 2]" 1
1353 1 61 ILE MG 1 104 ASP HB3 5.500 . 6.050 5.188 4.592 5.453 . 0 0 "[ . 1 . 2]" 1
1354 1 79 ILE MG 1 104 ASP HB3 5.500 . 6.050 3.433 2.935 4.411 . 0 0 "[ . 1 . 2]" 1
1355 1 21 PHE HZ 1 23 ALA MB 5.000 . 5.500 4.889 4.300 5.545 0.045 4 0 "[ . 1 . 2]" 1
1356 1 59 VAL MG1 1 100 ILE HB 4.730 . 5.200 3.383 2.951 3.694 . 0 0 "[ . 1 . 2]" 1
1357 1 59 VAL MG2 1 100 ILE HB 3.830 . 4.210 2.137 1.835 2.591 . 0 0 "[ . 1 . 2]" 1
1358 1 3 ARG H 1 3 ARG QB 3.330 . 3.660 2.444 2.274 2.893 . 0 0 "[ . 1 . 2]" 1
1359 1 3 ARG QB 1 4 LEU H 4.190 . 4.610 3.567 2.354 4.044 . 0 0 "[ . 1 . 2]" 1
1360 1 3 ARG QB 1 4 LEU MD2 4.630 . 5.090 4.253 2.903 5.181 0.091 19 0 "[ . 1 . 2]" 1
1361 1 4 LEU H 1 4 LEU QB 3.360 . 3.700 2.469 2.319 3.297 . 0 0 "[ . 1 . 2]" 1
1362 1 4 LEU QB 1 4 LEU MD1 2.830 . 3.110 2.345 2.108 2.433 . 0 0 "[ . 1 . 2]" 1
1363 1 4 LEU QB 1 5 ALA H 3.710 . 4.080 2.640 1.942 3.403 . 0 0 "[ . 1 . 2]" 1
1364 1 6 ASN QB 1 7 GLY H 3.880 . 4.270 3.035 1.962 4.028 . 0 0 "[ . 1 . 2]" 1
1365 1 7 GLY QA 1 8 ILE MG 4.210 . 4.630 3.629 3.285 4.114 . 0 0 "[ . 1 . 2]" 1
1366 1 8 ILE H 1 8 ILE QG 3.510 . 3.860 2.050 1.897 2.265 . 0 0 "[ . 1 . 2]" 1
1367 1 8 ILE QG 1 9 VAL H 4.420 . 4.860 3.567 3.025 4.161 . 0 0 "[ . 1 . 2]" 1
1368 1 8 ILE QG 1 9 VAL HB 5.180 . 5.700 5.341 4.847 5.772 0.072 11 0 "[ . 1 . 2]" 1
1369 1 9 VAL H 1 9 VAL QG 3.590 . 3.950 2.231 1.883 2.791 . 0 0 "[ . 1 . 2]" 1
1370 1 9 VAL QG 1 10 LEU H 4.040 . 4.440 2.840 1.911 3.358 . 0 0 "[ . 1 . 2]" 1
1371 1 9 VAL QG 1 10 LEU HG 4.230 . 4.650 3.877 1.952 4.699 0.049 10 0 "[ . 1 . 2]" 1
1372 1 10 LEU HA 1 10 LEU QD 3.360 . 3.700 2.980 1.988 3.430 . 0 0 "[ . 1 . 2]" 1
1373 1 10 LEU QD 1 11 ASP H 3.420 . 3.760 3.025 1.789 3.837 0.077 6 0 "[ . 1 . 2]" 1
1374 1 12 LYS H 1 12 LYS QG 4.120 . 4.530 3.495 2.166 4.406 . 0 0 "[ . 1 . 2]" 1
1375 1 12 LYS QG 1 13 ASP H 3.960 . 4.360 3.439 2.167 4.400 0.040 8 0 "[ . 1 . 2]" 1
1376 1 16 PHE QB 1 17 GLY H 4.210 . 4.630 3.047 1.961 3.817 . 0 0 "[ . 1 . 2]" 1
1377 1 16 PHE QB 1 19 LEU MD1 4.250 . 4.680 3.113 2.197 4.256 . 0 0 "[ . 1 . 2]" 1
1378 1 16 PHE QB 1 19 LEU MD2 3.880 . 4.270 2.336 1.847 3.024 . 0 0 "[ . 1 . 2]" 1
1379 1 17 GLY QA 1 18 GLU QB 4.270 . 4.700 4.205 3.862 4.408 . 0 0 "[ . 1 . 2]" 1
1380 1 17 GLY QA 1 19 LEU MD2 5.010 . 5.510 4.708 4.043 5.241 . 0 0 "[ . 1 . 2]" 1
1381 1 18 GLU H 1 18 GLU QG 3.520 . 3.870 2.574 1.788 3.988 0.118 6 0 "[ . 1 . 2]" 1
1382 1 18 GLU HA 1 18 GLU QG 3.460 . 3.810 2.927 2.405 3.533 . 0 0 "[ . 1 . 2]" 1
1383 1 18 GLU QG 1 19 LEU H 4.270 . 4.700 4.246 2.868 4.783 0.083 2 0 "[ . 1 . 2]" 1
1384 1 18 GLU QG 1 75 ARG QD 4.640 . 5.100 4.231 2.606 5.178 0.078 10 0 "[ . 1 . 2]" 1
1385 1 19 LEU QB 1 57 ILE MD 5.060 . 5.570 3.634 2.979 4.316 . 0 0 "[ . 1 . 2]" 1
1386 1 19 LEU QB 1 76 VAL MG2 3.920 . 4.310 2.417 1.811 2.871 . 0 0 "[ . 1 . 2]" 1
1387 1 19 LEU MD2 1 48 LEU QB 4.060 . 4.470 3.162 2.767 3.851 . 0 0 "[ . 1 . 2]" 1
1388 1 19 LEU MD2 1 50 SER QB 3.940 . 4.330 2.736 2.046 3.905 . 0 0 "[ . 1 . 2]" 1
1389 1 20 LYS H 1 20 LYS QB 3.590 . 3.950 2.579 2.365 2.818 . 0 0 "[ . 1 . 2]" 1
1390 1 20 LYS H 1 20 LYS QD 5.340 . 5.870 4.201 2.308 5.221 . 0 0 "[ . 1 . 2]" 1
1391 1 20 LYS H 1 48 LEU QB 5.340 . 5.870 3.639 3.232 4.436 . 0 0 "[ . 1 . 2]" 1
1392 1 20 LYS H 1 49 LYS QB 4.460 . 4.910 3.571 2.619 4.722 . 0 0 "[ . 1 . 2]" 1
1393 1 20 LYS HA 1 20 LYS QD 4.350 . 4.790 3.783 2.053 4.250 . 0 0 "[ . 1 . 2]" 1
1394 1 20 LYS HA 1 75 ARG QG 4.930 . 5.420 4.448 3.979 5.312 . 0 0 "[ . 1 . 2]" 1
1395 1 20 LYS QB 1 20 LYS QD 3.170 . 3.490 2.299 2.147 2.481 . 0 0 "[ . 1 . 2]" 1
1396 1 20 LYS QB 1 20 LYS QE 3.800 . 4.180 2.744 1.989 3.718 . 0 0 "[ . 1 . 2]" 1
1397 1 20 LYS QB 1 21 PHE H 4.060 . 4.470 3.237 2.917 3.647 . 0 0 "[ . 1 . 2]" 1
1398 1 20 LYS QB 1 49 LYS H 4.700 . 5.170 3.466 2.768 3.837 . 0 0 "[ . 1 . 2]" 1
1399 1 20 LYS QB 1 73 ASN H 4.580 . 5.040 4.143 3.377 5.069 0.029 11 0 "[ . 1 . 2]" 1
1400 1 20 LYS QB 1 73 ASN HA 3.480 . 3.830 2.234 1.742 3.648 0.058 6 0 "[ . 1 . 2]" 1
1401 1 20 LYS QB 1 73 ASN QB 5.180 . 5.700 3.434 2.780 4.847 . 0 0 "[ . 1 . 2]" 1
1402 1 20 LYS QB 1 75 ARG HA 5.340 . 5.870 4.423 3.788 5.546 . 0 0 "[ . 1 . 2]" 1
1403 1 20 LYS QG 1 21 PHE H 4.730 . 5.200 4.084 2.691 4.755 . 0 0 "[ . 1 . 2]" 1
1404 1 20 LYS QG 1 75 ARG HA 4.470 . 4.920 3.118 2.111 4.627 . 0 0 "[ . 1 . 2]" 1
1405 1 20 LYS QG 1 75 ARG QG 4.520 . 4.970 3.276 2.377 4.400 . 0 0 "[ . 1 . 2]" 1
1406 1 20 LYS QD 1 73 ASN QB 4.400 . 4.840 3.320 2.172 4.910 0.070 2 0 "[ . 1 . 2]" 1
1407 1 20 LYS QD 1 75 ARG HA 5.340 . 5.870 4.463 2.162 5.759 . 0 0 "[ . 1 . 2]" 1
1408 1 21 PHE HA 1 48 LEU QB 4.900 . 5.390 4.065 3.621 4.388 . 0 0 "[ . 1 . 2]" 1
1409 1 21 PHE QD 1 70 PHE QB 5.210 . 5.730 2.985 2.546 3.527 . 0 0 "[ . 1 . 2]" 1
1410 1 22 SER QB 1 23 ALA H 3.480 . 3.830 2.429 2.052 3.126 . 0 0 "[ . 1 . 2]" 1
1411 1 22 SER QB 1 47 ASP HB2 4.840 . 5.320 3.007 2.230 4.104 . 0 0 "[ . 1 . 2]" 1
1412 1 22 SER QB 1 47 ASP HB3 4.490 . 4.940 3.188 2.352 4.356 . 0 0 "[ . 1 . 2]" 1
1413 1 24 LEU MD1 1 44 ARG QB 4.470 . 4.920 2.962 2.038 4.152 . 0 0 "[ . 1 . 2]" 1
1414 1 24 LEU MD1 1 44 ARG QD 4.250 . 4.680 3.409 2.475 4.409 . 0 0 "[ . 1 . 2]" 1
1415 1 24 LEU MD2 1 44 ARG QD 4.890 . 5.380 4.023 2.963 5.321 . 0 0 "[ . 1 . 2]" 1
1416 1 25 ARG H 1 25 ARG QG 4.120 . 4.530 4.030 3.957 4.081 . 0 0 "[ . 1 . 2]" 1
1417 1 25 ARG HA 1 25 ARG QG 3.310 . 3.640 3.012 2.861 3.120 . 0 0 "[ . 1 . 2]" 1
1418 1 25 ARG HA 1 25 ARG QD 3.190 . 3.510 2.190 1.953 2.503 . 0 0 "[ . 1 . 2]" 1
1419 1 25 ARG QG 1 26 ARG H 3.610 . 3.970 3.223 2.773 3.710 . 0 0 "[ . 1 . 2]" 1
1420 1 25 ARG QG 1 26 ARG QB 4.370 . 4.810 2.599 2.224 3.033 . 0 0 "[ . 1 . 2]" 1
1421 1 25 ARG QG 1 45 THR HB 3.850 . 4.230 3.270 2.654 3.823 . 0 0 "[ . 1 . 2]" 1
1422 1 25 ARG QD 1 26 ARG HA 5.340 . 5.870 5.242 4.915 5.684 . 0 0 "[ . 1 . 2]" 1
1423 1 26 ARG HA 1 26 ARG QD 4.220 . 4.640 4.219 4.014 4.345 . 0 0 "[ . 1 . 2]" 1
1424 1 26 ARG QB 1 26 ARG QD 2.960 . 3.260 2.282 2.122 2.407 . 0 0 "[ . 1 . 2]" 1
1425 1 26 ARG QB 1 28 VAL MG1 4.220 . 4.640 3.517 3.018 3.891 . 0 0 "[ . 1 . 2]" 1
1426 1 26 ARG QB 1 45 THR HB 4.300 . 4.730 3.047 2.855 3.365 . 0 0 "[ . 1 . 2]" 1
1427 1 26 ARG QD 1 27 GLU H 5.160 . 5.680 4.593 4.366 4.796 . 0 0 "[ . 1 . 2]" 1
1428 1 26 ARG QD 1 28 VAL MG1 3.720 . 4.090 2.546 2.063 3.107 . 0 0 "[ . 1 . 2]" 1
1429 1 28 VAL MG1 1 42 LYS QB 4.630 . 5.090 4.560 4.306 4.809 . 0 0 "[ . 1 . 2]" 1
1430 1 28 VAL MG2 1 42 LYS QB 3.550 . 3.900 2.010 1.774 2.234 0.026 20 0 "[ . 1 . 2]" 1
1431 1 28 VAL MG2 1 42 LYS QD 5.340 . 5.870 4.519 3.268 4.909 . 0 0 "[ . 1 . 2]" 1
1432 1 29 ARG H 1 29 ARG QB 3.160 . 3.480 2.450 2.289 2.629 . 0 0 "[ . 1 . 2]" 1
1433 1 29 ARG H 1 29 ARG QG 3.140 . 3.450 2.602 2.276 2.914 . 0 0 "[ . 1 . 2]" 1
1434 1 29 ARG QB 1 29 ARG QG 2.340 . 2.570 2.093 2.089 2.096 . 0 0 "[ . 1 . 2]" 1
1435 1 29 ARG QB 1 29 ARG QD 3.040 . 3.340 2.181 2.123 2.351 . 0 0 "[ . 1 . 2]" 1
1436 1 29 ARG QB 1 30 ILE HA 4.980 . 5.480 4.416 4.210 4.566 . 0 0 "[ . 1 . 2]" 1
1437 1 29 ARG QB 1 30 ILE HB 5.180 . 5.700 4.310 4.049 4.501 . 0 0 "[ . 1 . 2]" 1
1438 1 29 ARG QB 1 30 ILE QG 5.180 . 5.700 4.075 3.800 4.307 . 0 0 "[ . 1 . 2]" 1
1439 1 29 ARG QB 1 37 VAL MG1 3.180 . 3.500 2.154 1.918 2.598 . 0 0 "[ . 1 . 2]" 1
1440 1 29 ARG QB 1 41 ILE QG 4.680 . 5.150 3.702 2.966 4.949 . 0 0 "[ . 1 . 2]" 1
1441 1 29 ARG QG 1 30 ILE H 4.630 . 5.090 3.800 3.513 4.244 . 0 0 "[ . 1 . 2]" 1
1442 1 29 ARG QG 1 41 ILE HA 4.180 . 4.600 2.480 1.839 3.201 . 0 0 "[ . 1 . 2]" 1
1443 1 30 ILE HA 1 30 ILE QG 3.380 . 3.720 2.461 2.393 2.505 . 0 0 "[ . 1 . 2]" 1
1444 1 30 ILE HB 1 40 GLU QG 5.340 . 5.870 4.749 4.167 5.411 . 0 0 "[ . 1 . 2]" 1
1445 1 30 ILE QG 1 30 ILE MG 2.920 . 3.210 2.336 2.298 2.380 . 0 0 "[ . 1 . 2]" 1
1446 1 30 ILE MG 1 42 LYS QD 4.460 . 4.910 3.825 3.379 4.538 . 0 0 "[ . 1 . 2]" 1
1447 1 30 ILE QG 1 31 GLN H 4.540 . 4.990 4.292 4.102 4.419 . 0 0 "[ . 1 . 2]" 1
1448 1 30 ILE QG 1 38 SER HB2 5.340 . 5.870 5.735 5.233 5.926 0.056 14 0 "[ . 1 . 2]" 1
1449 1 30 ILE QG 1 38 SER HB3 4.950 . 5.440 4.367 3.915 4.590 . 0 0 "[ . 1 . 2]" 1
1450 1 30 ILE QG 1 41 ILE H 4.580 . 5.040 4.150 3.877 4.347 . 0 0 "[ . 1 . 2]" 1
1451 1 30 ILE QG 1 41 ILE HA 4.290 . 4.720 3.336 2.967 3.872 . 0 0 "[ . 1 . 2]" 1
1452 1 30 ILE QG 1 42 LYS H 5.060 . 5.570 3.370 3.079 3.872 . 0 0 "[ . 1 . 2]" 1
1453 1 30 ILE QG 1 42 LYS HA 3.980 . 4.380 3.245 2.585 3.821 . 0 0 "[ . 1 . 2]" 1
1454 1 30 ILE QG 1 42 LYS QB 4.470 . 4.920 2.998 2.262 4.264 . 0 0 "[ . 1 . 2]" 1
1455 1 30 ILE QG 1 42 LYS QD 2.980 . 3.280 2.531 2.224 3.400 0.120 11 0 "[ . 1 . 2]" 1
1456 1 30 ILE MD 1 40 GLU QG 3.540 . 3.890 3.593 3.098 3.944 0.054 11 0 "[ . 1 . 2]" 1
1457 1 30 ILE MD 1 42 LYS QB 5.340 . 5.870 4.191 3.469 5.211 . 0 0 "[ . 1 . 2]" 1
1458 1 32 ASN H 1 32 ASN QD 3.830 . 4.210 2.864 2.115 4.144 . 0 0 "[ . 1 . 2]" 1
1459 1 32 ASN HA 1 33 GLU QG 5.340 . 5.870 4.023 3.609 5.206 . 0 0 "[ . 1 . 2]" 1
1460 1 32 ASN HB2 1 32 ASN QD 3.130 . 3.440 2.289 2.163 2.828 . 0 0 "[ . 1 . 2]" 1
1461 1 32 ASN QD 1 38 SER HA 3.740 . 4.110 2.957 2.152 3.451 . 0 0 "[ . 1 . 2]" 1
1462 1 32 ASN QD 1 38 SER HB2 3.880 . 4.270 2.304 1.787 3.279 0.013 18 0 "[ . 1 . 2]" 1
1463 1 32 ASN QD 1 38 SER HB3 4.710 . 5.180 3.836 3.373 4.704 . 0 0 "[ . 1 . 2]" 1
1464 1 33 GLU H 1 33 GLU QG 4.270 . 4.700 2.275 1.801 3.417 . 0 0 "[ . 1 . 2]" 1
1465 1 33 GLU HA 1 33 GLU QG 3.700 . 4.070 2.808 2.404 3.408 . 0 0 "[ . 1 . 2]" 1
1466 1 34 ASP H 1 34 ASP QB 3.100 . 3.410 2.419 2.195 2.580 . 0 0 "[ . 1 . 2]" 1
1467 1 34 ASP QB 1 35 GLY H 4.160 . 4.580 3.018 2.597 3.818 . 0 0 "[ . 1 . 2]" 1
1468 1 36 SER H 1 36 SER QB 3.370 . 3.710 2.519 2.415 2.711 . 0 0 "[ . 1 . 2]" 1
1469 1 36 SER QB 1 37 VAL H 3.060 . 3.370 2.642 2.329 2.924 . 0 0 "[ . 1 . 2]" 1
1470 1 36 SER QB 1 37 VAL MG2 3.870 . 4.260 4.300 4.130 4.396 0.136 10 0 "[ . 1 . 2]" 1
1471 1 39 ASP H 1 39 ASP QB 3.040 . 3.340 2.454 2.228 2.744 . 0 0 "[ . 1 . 2]" 1
1472 1 40 GLU H 1 40 GLU QG 3.670 . 4.040 2.342 1.922 3.121 . 0 0 "[ . 1 . 2]" 1
1473 1 40 GLU QG 1 41 ILE H 3.890 . 4.280 4.158 3.896 4.403 0.123 9 0 "[ . 1 . 2]" 1
1474 1 41 ILE H 1 41 ILE QG 3.530 . 3.880 2.431 2.180 2.618 . 0 0 "[ . 1 . 2]" 1
1475 1 41 ILE QG 1 41 ILE MG 2.930 . 3.220 2.351 2.335 2.389 . 0 0 "[ . 1 . 2]" 1
1476 1 41 ILE MG 1 42 LYS QB 4.370 . 4.810 3.642 3.413 3.877 . 0 0 "[ . 1 . 2]" 1
1477 1 42 LYS H 1 42 LYS QG 4.470 . 4.920 3.555 2.366 4.136 . 0 0 "[ . 1 . 2]" 1
1478 1 42 LYS HA 1 42 LYS QG 3.420 . 3.760 2.839 2.285 3.021 . 0 0 "[ . 1 . 2]" 1
1479 1 42 LYS HA 1 42 LYS QD 3.400 . 3.740 2.283 1.965 3.983 0.243 11 0 "[ . 1 . 2]" 1
1480 1 42 LYS QB 1 42 LYS QD 2.300 . 2.530 2.286 2.092 2.353 . 0 0 "[ . 1 . 2]" 1
1481 1 42 LYS QB 1 43 GLU QG 4.360 . 4.800 2.883 2.339 3.527 . 0 0 "[ . 1 . 2]" 1
1482 1 42 LYS QG 1 43 GLU H 4.050 . 4.460 3.600 3.187 4.040 . 0 0 "[ . 1 . 2]" 1
1483 1 43 GLU HA 1 43 GLU QG 3.730 . 4.100 2.854 2.372 3.374 . 0 0 "[ . 1 . 2]" 1
1484 1 43 GLU QB 1 62 PRO HA 4.740 . 5.210 3.044 1.806 4.383 . 0 0 "[ . 1 . 2]" 1
1485 1 43 GLU QG 1 44 ARG H 4.200 . 4.620 3.810 3.428 4.142 . 0 0 "[ . 1 . 2]" 1
1486 1 44 ARG H 1 44 ARG QB 3.700 . 4.070 2.615 2.388 3.133 . 0 0 "[ . 1 . 2]" 1
1487 1 44 ARG H 1 44 ARG QG 4.100 . 4.510 3.058 2.088 4.085 . 0 0 "[ . 1 . 2]" 1
1488 1 44 ARG H 1 61 ILE QG 4.590 . 5.050 3.135 2.760 3.358 . 0 0 "[ . 1 . 2]" 1
1489 1 44 ARG QB 1 45 THR H 4.400 . 4.840 3.446 2.964 3.917 . 0 0 "[ . 1 . 2]" 1
1490 1 44 ARG QB 1 46 TYR QE 4.650 . 5.120 3.054 2.126 3.929 . 0 0 "[ . 1 . 2]" 1
1491 1 44 ARG QG 1 45 THR H 5.020 . 5.520 3.938 2.917 4.504 . 0 0 "[ . 1 . 2]" 1
1492 1 45 THR HA 1 60 SER QB 5.330 . 5.860 3.258 2.669 4.088 . 0 0 "[ . 1 . 2]" 1
1493 1 45 THR MG 1 58 GLN QB 3.900 . 4.290 2.182 1.910 2.632 . 0 0 "[ . 1 . 2]" 1
1494 1 45 THR MG 1 58 GLN QG 3.820 . 4.200 3.270 2.515 3.873 . 0 0 "[ . 1 . 2]" 1
1495 1 46 TYR QB 1 47 ASP H 3.650 . 4.020 2.633 2.314 2.884 . 0 0 "[ . 1 . 2]" 1
1496 1 46 TYR QB 1 48 LEU MD2 5.030 . 5.530 2.907 2.501 3.173 . 0 0 "[ . 1 . 2]" 1
1497 1 46 TYR QB 1 105 ILE MD 4.420 . 4.860 2.914 2.474 3.629 . 0 0 "[ . 1 . 2]" 1
1498 1 46 TYR QE 1 61 ILE QG 3.790 . 4.170 2.320 1.745 4.035 0.055 3 0 "[ . 1 . 2]" 1
1499 1 48 LEU H 1 57 ILE QG 4.870 . 5.360 3.179 2.794 3.686 . 0 0 "[ . 1 . 2]" 1
1500 1 48 LEU HA 1 49 LYS QD 4.700 . 5.170 4.009 2.904 5.197 0.027 8 0 "[ . 1 . 2]" 1
1501 1 48 LEU QB 1 49 LYS H 3.870 . 4.260 3.063 2.427 3.309 . 0 0 "[ . 1 . 2]" 1
1502 1 48 LEU QB 1 57 ILE QG 4.410 . 4.850 2.102 1.850 2.500 . 0 0 "[ . 1 . 2]" 1
1503 1 48 LEU QB 1 57 ILE MD 4.450 . 4.890 2.635 2.143 3.157 . 0 0 "[ . 1 . 2]" 1
1504 1 48 LEU MD2 1 49 LYS QD 5.340 . 5.870 5.178 4.213 5.908 0.038 8 0 "[ . 1 . 2]" 1
1505 1 49 LYS H 1 49 LYS QB 3.610 . 3.970 2.498 2.198 2.816 . 0 0 "[ . 1 . 2]" 1
1506 1 49 LYS H 1 49 LYS QG 4.150 . 4.570 2.926 1.908 4.051 . 0 0 "[ . 1 . 2]" 1
1507 1 49 LYS H 1 49 LYS QD 4.120 . 4.530 3.047 1.941 3.750 . 0 0 "[ . 1 . 2]" 1
1508 1 49 LYS HA 1 49 LYS QD 4.390 . 4.830 2.694 1.995 4.501 . 0 0 "[ . 1 . 2]" 1
1509 1 49 LYS QB 1 49 LYS QD 2.870 . 3.160 2.507 2.228 2.876 . 0 0 "[ . 1 . 2]" 1
1510 1 49 LYS QE 1 49 LYS QG 2.980 . 3.280 2.362 2.136 2.788 . 0 0 "[ . 1 . 2]" 1
1511 1 50 SER H 1 50 SER QB 3.630 . 3.990 2.587 2.331 3.047 . 0 0 "[ . 1 . 2]" 1
1512 1 51 LYS HA 1 51 LYS QG 3.400 . 3.740 2.904 2.367 3.489 . 0 0 "[ . 1 . 2]" 1
1513 1 51 LYS QB 1 51 LYS QD 3.050 . 3.360 2.358 2.124 2.822 . 0 0 "[ . 1 . 2]" 1
1514 1 51 LYS QB 1 52 GLY H 3.870 . 4.260 3.033 1.985 3.913 . 0 0 "[ . 1 . 2]" 1
1515 1 51 LYS QE 1 51 LYS QG 3.000 . 3.300 2.370 2.142 2.845 . 0 0 "[ . 1 . 2]" 1
1516 1 51 LYS QG 1 52 GLY H 4.830 . 5.310 3.794 2.279 4.816 . 0 0 "[ . 1 . 2]" 1
1517 1 53 GLN HA 1 53 GLN QG 3.650 . 4.020 2.828 2.402 3.507 . 0 0 "[ . 1 . 2]" 1
1518 1 53 GLN QB 1 53 GLN QG 2.260 . 2.490 2.010 1.988 2.094 . 0 0 "[ . 1 . 2]" 1
1519 1 53 GLN QB 1 55 ARG H 3.910 . 4.300 3.177 2.676 3.912 . 0 0 "[ . 1 . 2]" 1
1520 1 55 ARG QB 1 56 MET H 3.480 . 3.830 2.604 2.050 3.303 . 0 0 "[ . 1 . 2]" 1
1521 1 55 ARG QG 1 56 MET H 4.310 . 4.740 3.842 2.904 4.449 . 0 0 "[ . 1 . 2]" 1
1522 1 56 MET H 1 56 MET QB 3.200 . 3.520 2.658 2.356 3.096 . 0 0 "[ . 1 . 2]" 1
1523 1 56 MET H 1 56 MET QG 3.950 . 4.350 2.716 1.935 4.048 . 0 0 "[ . 1 . 2]" 1
1524 1 56 MET QG 1 57 ILE H 4.390 . 4.830 3.831 2.279 4.405 . 0 0 "[ . 1 . 2]" 1
1525 1 58 GLN H 1 58 GLN QG 4.680 . 5.150 2.928 2.321 3.700 . 0 0 "[ . 1 . 2]" 1
1526 1 58 GLN QB 1 99 TYR QD 3.880 . 4.270 2.750 2.400 3.243 . 0 0 "[ . 1 . 2]" 1
1527 1 60 SER QB 1 61 ILE H 4.110 . 4.520 3.423 2.928 3.871 . 0 0 "[ . 1 . 2]" 1
1528 1 60 SER QB 1 101 LYS HA 4.370 . 4.810 3.154 2.545 4.259 . 0 0 "[ . 1 . 2]" 1
1529 1 61 ILE H 1 61 ILE QG 3.630 . 3.990 2.110 1.941 2.278 . 0 0 "[ . 1 . 2]" 1
1530 1 61 ILE HA 1 62 PRO QD 3.560 . 3.920 2.085 1.942 2.206 . 0 0 "[ . 1 . 2]" 1
1531 1 61 ILE HB 1 62 PRO QD 3.750 . 4.130 2.217 1.953 2.473 . 0 0 "[ . 1 . 2]" 1
1532 1 61 ILE MG 1 105 ILE QG 4.230 . 4.650 1.992 1.789 2.257 0.011 5 0 "[ . 1 . 2]" 1
1533 1 61 ILE MD 1 68 LYS QE 3.900 . 4.290 2.611 2.025 3.782 . 0 0 "[ . 1 . 2]" 1
1534 1 62 PRO QG 1 63 ALA H 5.030 . 5.530 4.566 4.381 4.808 . 0 0 "[ . 1 . 2]" 1
1535 1 62 PRO QG 1 65 VAL H 4.600 . 5.060 3.942 3.218 5.059 . 0 0 "[ . 1 . 2]" 1
1536 1 62 PRO QD 1 65 VAL MG2 4.230 . 4.650 2.665 2.039 3.341 . 0 0 "[ . 1 . 2]" 1
1537 1 64 SER H 1 64 SER QB 3.470 . 3.820 2.451 2.265 2.628 . 0 0 "[ . 1 . 2]" 1
1538 1 65 VAL HA 1 66 PRO QG 4.050 . 4.460 3.857 3.724 3.928 . 0 0 "[ . 1 . 2]" 1
1539 1 65 VAL HA 1 66 PRO QD 3.310 . 3.640 1.947 1.813 2.020 . 0 0 "[ . 1 . 2]" 1
1540 1 65 VAL MG1 1 68 LYS QE 4.010 . 4.410 2.471 1.823 4.266 . 0 0 "[ . 1 . 2]" 1
1541 1 66 PRO HA 1 67 LEU QB 4.720 . 5.190 4.110 4.033 4.310 . 0 0 "[ . 1 . 2]" 1
1542 1 66 PRO QG 1 67 LEU H 4.400 . 4.840 4.404 3.875 4.687 . 0 0 "[ . 1 . 2]" 1
1543 1 67 LEU QB 1 67 LEU MD1 3.040 . 3.340 2.330 2.292 2.406 . 0 0 "[ . 1 . 2]" 1
1544 1 67 LEU QB 1 68 LYS H 4.010 . 4.410 3.663 3.502 3.810 . 0 0 "[ . 1 . 2]" 1
1545 1 68 LYS H 1 68 LYS QG 3.940 . 4.330 3.433 2.262 3.883 . 0 0 "[ . 1 . 2]" 1
1546 1 68 LYS HB3 1 70 PHE QB 4.600 . 5.060 3.909 3.440 4.309 . 0 0 "[ . 1 . 2]" 1
1547 1 68 LYS QG 1 105 ILE MG 3.480 . 3.830 2.951 2.213 3.694 . 0 0 "[ . 1 . 2]" 1
1548 1 68 LYS QE 1 105 ILE H 4.280 . 4.710 2.496 2.024 3.644 . 0 0 "[ . 1 . 2]" 1
1549 1 68 LYS QE 1 105 ILE HB 3.830 . 4.210 2.410 1.796 3.860 0.004 9 0 "[ . 1 . 2]" 1
1550 1 68 LYS QE 1 105 ILE MG 4.150 . 4.570 3.830 3.444 4.684 0.114 14 0 "[ . 1 . 2]" 1
1551 1 68 LYS QE 1 105 ILE QG 5.050 . 5.560 3.435 2.752 4.938 . 0 0 "[ . 1 . 2]" 1
1552 1 68 LYS QE 1 105 ILE MD 4.580 . 5.040 3.636 3.072 4.791 . 0 0 "[ . 1 . 2]" 1
1553 1 70 PHE H 1 70 PHE QB 3.260 . 3.590 2.433 2.341 2.518 . 0 0 "[ . 1 . 2]" 1
1554 1 70 PHE QB 1 74 ALA MB 3.950 . 4.350 2.456 1.934 2.953 . 0 0 "[ . 1 . 2]" 1
1555 1 70 PHE QB 1 107 LEU MD2 4.560 . 5.020 3.008 2.022 3.900 . 0 0 "[ . 1 . 2]" 1
1556 1 71 ASP H 1 71 ASP QB 3.140 . 3.450 2.410 2.211 2.719 . 0 0 "[ . 1 . 2]" 1
1557 1 71 ASP QB 1 72 TYR H 3.340 . 3.670 2.836 2.223 3.545 . 0 0 "[ . 1 . 2]" 1
1558 1 72 TYR QB 1 73 ASN H 4.400 . 4.840 3.684 2.766 3.847 . 0 0 "[ . 1 . 2]" 1
1559 1 75 ARG H 1 75 ARG QG 3.330 . 3.660 2.430 1.825 3.646 . 0 0 "[ . 1 . 2]" 1
1560 1 75 ARG H 1 75 ARG QD 4.400 . 4.840 3.754 2.214 4.305 . 0 0 "[ . 1 . 2]" 1
1561 1 75 ARG HA 1 75 ARG QG 3.720 . 4.090 2.451 2.298 2.617 . 0 0 "[ . 1 . 2]" 1
1562 1 75 ARG HA 1 75 ARG QD 4.370 . 4.810 3.932 2.220 4.321 . 0 0 "[ . 1 . 2]" 1
1563 1 75 ARG QB 1 75 ARG QD 2.990 . 3.290 2.296 2.112 2.625 . 0 0 "[ . 1 . 2]" 1
1564 1 75 ARG QB 1 108 THR H 5.340 . 5.870 3.168 2.530 3.566 . 0 0 "[ . 1 . 2]" 1
1565 1 75 ARG QB 1 108 THR HB 3.710 . 4.080 2.191 1.790 2.815 0.010 20 0 "[ . 1 . 2]" 1
1566 1 75 ARG QG 1 108 THR HB 4.680 . 5.150 4.126 3.019 4.834 . 0 0 "[ . 1 . 2]" 1
1567 1 76 VAL MG1 1 107 LEU QB 5.340 . 5.870 4.088 3.891 4.431 . 0 0 "[ . 1 . 2]" 1
1568 1 77 GLU H 1 77 GLU QB 3.620 . 3.980 3.094 2.988 3.262 . 0 0 "[ . 1 . 2]" 1
1569 1 77 GLU H 1 77 GLU QG 3.550 . 3.900 2.360 2.238 2.727 . 0 0 "[ . 1 . 2]" 1
1570 1 77 GLU HA 1 77 GLU QG 3.440 . 3.780 3.361 3.349 3.378 . 0 0 "[ . 1 . 2]" 1
1571 1 77 GLU QB 1 79 ILE MD 5.340 . 5.870 4.942 4.592 5.355 . 0 0 "[ . 1 . 2]" 1
1572 1 77 GLU QB 1 106 VAL MG2 3.610 . 3.970 3.865 3.639 3.986 0.016 18 0 "[ . 1 . 2]" 1
1573 1 77 GLU QB 1 108 THR MG 3.320 . 3.650 2.814 2.340 3.100 . 0 0 "[ . 1 . 2]" 1
1574 1 77 GLU QG 1 78 LEU H 4.220 . 4.640 3.646 3.085 3.900 . 0 0 "[ . 1 . 2]" 1
1575 1 77 GLU QG 1 78 LEU HA 4.980 . 5.480 4.309 4.005 4.453 . 0 0 "[ . 1 . 2]" 1
1576 1 77 GLU QG 1 79 ILE MD 4.390 . 4.830 3.677 3.410 3.941 . 0 0 "[ . 1 . 2]" 1
1577 1 77 GLU QG 1 106 VAL H 4.640 . 5.100 3.626 3.296 4.052 . 0 0 "[ . 1 . 2]" 1
1578 1 77 GLU QG 1 106 VAL MG2 3.540 . 3.890 2.081 1.802 2.266 . 0 0 "[ . 1 . 2]" 1
1579 1 77 GLU QG 1 108 THR HA 3.670 . 4.040 2.197 1.906 3.041 . 0 0 "[ . 1 . 2]" 1
1580 1 77 GLU QG 1 108 THR MG 3.710 . 4.080 3.573 3.223 3.735 . 0 0 "[ . 1 . 2]" 1
1581 1 78 LEU H 1 78 LEU QB 3.550 . 3.900 2.466 2.411 2.554 . 0 0 "[ . 1 . 2]" 1
1582 1 78 LEU QB 1 102 ALA MB 4.760 . 5.240 2.425 2.086 3.201 . 0 0 "[ . 1 . 2]" 1
1583 1 78 LEU MD2 1 104 ASP QB 5.340 . 5.870 5.441 5.298 5.554 . 0 0 "[ . 1 . 2]" 1
1584 1 78 LEU MD2 1 105 ILE QG 3.980 . 4.380 1.927 1.857 1.994 . 0 0 "[ . 1 . 2]" 1
1585 1 79 ILE H 1 79 ILE QG 3.500 . 3.850 2.402 2.017 3.406 . 0 0 "[ . 1 . 2]" 1
1586 1 79 ILE QG 1 79 ILE MG 3.100 . 3.410 2.273 2.107 2.318 . 0 0 "[ . 1 . 2]" 1
1587 1 79 ILE MG 1 80 ASN QB 3.600 . 3.960 3.196 2.807 3.546 . 0 0 "[ . 1 . 2]" 1
1588 1 79 ILE MG 1 80 ASN QD 3.450 . 3.790 2.167 1.743 2.792 0.057 5 0 "[ . 1 . 2]" 1
1589 1 79 ILE QG 1 103 ASP HB3 4.490 . 4.940 4.261 3.678 4.921 . 0 0 "[ . 1 . 2]" 1
1590 1 79 ILE QG 1 104 ASP H 4.670 . 5.140 3.730 3.131 4.409 . 0 0 "[ . 1 . 2]" 1
1591 1 79 ILE QG 1 104 ASP QB 3.920 . 4.310 2.273 1.852 3.022 . 0 0 "[ . 1 . 2]" 1
1592 1 79 ILE QG 1 106 VAL MG1 3.610 . 3.970 2.816 2.371 3.780 . 0 0 "[ . 1 . 2]" 1
1593 1 80 ASN QB 1 80 ASN QD 2.900 . 3.190 2.176 2.123 2.713 . 0 0 "[ . 1 . 2]" 1
1594 1 80 ASN QB 1 103 ASP H 4.210 . 4.630 2.915 2.331 3.349 . 0 0 "[ . 1 . 2]" 1
1595 1 80 ASN QB 1 103 ASP HB2 4.290 . 4.720 2.137 1.785 2.857 0.015 20 0 "[ . 1 . 2]" 1
1596 1 82 ILE QG 1 82 ILE MG 2.790 . 3.070 2.340 2.301 2.382 . 0 0 "[ . 1 . 2]" 1
1597 1 82 ILE QG 1 83 ALA H 4.650 . 5.120 4.009 3.577 4.248 . 0 0 "[ . 1 . 2]" 1
1598 1 82 ILE QG 1 101 LYS QB 4.220 . 4.640 2.222 1.773 2.591 0.027 19 0 "[ . 1 . 2]" 1
1599 1 82 ILE MD 1 84 ASP QB 4.520 . 4.970 4.423 3.366 5.065 0.095 7 0 "[ . 1 . 2]" 1
1600 1 82 ILE MD 1 101 LYS QB 3.770 . 4.150 2.635 2.227 3.161 . 0 0 "[ . 1 . 2]" 1
1601 1 83 ALA HA 1 84 ASP QB 5.340 . 5.870 4.130 3.942 4.457 . 0 0 "[ . 1 . 2]" 1
1602 1 86 VAL H 1 86 VAL QG 3.590 . 3.950 2.017 1.868 2.568 . 0 0 "[ . 1 . 2]" 1
1603 1 87 ALA MB 1 91 TYR QB 5.340 . 5.870 3.939 1.795 5.551 0.005 20 0 "[ . 1 . 2]" 1
1604 1 87 ALA MB 1 99 TYR QB 4.520 . 4.970 3.736 2.607 4.730 . 0 0 "[ . 1 . 2]" 1
1605 1 91 TYR H 1 91 TYR QB 3.340 . 3.670 2.456 2.268 2.655 . 0 0 "[ . 1 . 2]" 1
1606 1 91 TYR QB 1 92 GLN H 3.850 . 4.230 2.893 1.891 3.738 . 0 0 "[ . 1 . 2]" 1
1607 1 92 GLN H 1 92 GLN QB 3.030 . 3.330 2.471 2.244 2.791 . 0 0 "[ . 1 . 2]" 1
1608 1 93 GLY QA 1 94 ALA MB 5.150 . 5.670 3.951 3.547 4.262 . 0 0 "[ . 1 . 2]" 1
1609 1 95 ASP H 1 95 ASP QB 3.420 . 3.760 2.454 2.219 2.697 . 0 0 "[ . 1 . 2]" 1
1610 1 95 ASP QB 1 96 VAL H 4.220 . 4.640 3.491 2.538 4.049 . 0 0 "[ . 1 . 2]" 1
1611 1 95 ASP QB 1 96 VAL HA 5.110 . 5.620 4.517 3.718 5.275 . 0 0 "[ . 1 . 2]" 1
1612 1 96 VAL HA 1 96 VAL QG 3.140 . 3.450 2.224 2.139 2.376 . 0 0 "[ . 1 . 2]" 1
1613 1 96 VAL QG 1 97 ASP H 3.670 . 4.040 2.743 1.761 3.631 0.039 4 0 "[ . 1 . 2]" 1
1614 1 99 TYR QB 1 100 ILE H 4.050 . 4.460 3.101 2.633 3.471 . 0 0 "[ . 1 . 2]" 1
1615 1 101 LYS H 1 101 LYS QB 3.700 . 4.070 2.457 2.309 2.906 . 0 0 "[ . 1 . 2]" 1
1616 1 101 LYS QB 1 101 LYS QD 2.360 . 2.600 2.326 2.166 2.441 . 0 0 "[ . 1 . 2]" 1
1617 1 101 LYS QB 1 101 LYS QE 3.460 . 3.810 2.180 1.954 3.547 . 0 0 "[ . 1 . 2]" 1
1618 1 101 LYS QB 1 102 ALA H 3.480 . 3.830 3.035 2.473 3.297 . 0 0 "[ . 1 . 2]" 1
1619 1 104 ASP H 1 105 ILE QG 5.250 . 5.780 4.322 4.111 4.597 . 0 0 "[ . 1 . 2]" 1
1620 1 104 ASP QB 1 105 ILE H 3.730 . 4.100 3.336 3.229 3.433 . 0 0 "[ . 1 . 2]" 1
1621 1 104 ASP QB 1 106 VAL MG1 4.240 . 4.660 3.547 3.291 3.748 . 0 0 "[ . 1 . 2]" 1
1622 1 105 ILE H 1 105 ILE QG 3.510 . 3.860 2.674 2.544 2.831 . 0 0 "[ . 1 . 2]" 1
1623 1 105 ILE QG 1 106 VAL H 4.790 . 5.270 4.321 4.205 4.403 . 0 0 "[ . 1 . 2]" 1
1624 1 107 LEU H 1 107 LEU QB 3.180 . 3.500 2.393 2.317 2.429 . 0 0 "[ . 1 . 2]" 1
1625 1 107 LEU QB 1 108 THR H 3.810 . 4.190 2.890 2.652 3.185 . 0 0 "[ . 1 . 2]" 1
1626 1 109 LEU H 1 109 LEU QB 3.210 . 3.530 2.624 2.388 3.392 . 0 0 "[ . 1 . 2]" 1
1627 1 109 LEU QB 1 109 LEU HG 2.460 . 2.710 2.371 2.334 2.506 . 0 0 "[ . 1 . 2]" 1
1628 1 109 LEU QB 1 109 LEU MD1 2.750 . 3.030 2.110 2.092 2.119 . 0 0 "[ . 1 . 2]" 1
1629 1 109 LEU QB 1 109 LEU MD2 2.790 . 3.070 2.325 2.158 2.389 . 0 0 "[ . 1 . 2]" 1
1630 1 109 LEU QB 1 110 GLU H 3.960 . 4.360 3.612 2.298 3.895 . 0 0 "[ . 1 . 2]" 1
1631 1 110 GLU H 1 110 GLU QB 3.100 . 3.410 2.607 2.232 3.247 . 0 0 "[ . 1 . 2]" 1
1632 1 110 GLU H 1 110 GLU QG 3.670 . 4.040 2.641 1.814 4.105 0.065 17 0 "[ . 1 . 2]" 1
1633 1 110 GLU QB 1 110 GLU QG 2.340 . 2.570 2.057 2.002 2.093 . 0 0 "[ . 1 . 2]" 1
1634 1 78 LEU HA 1 105 ILE HA 4.000 . 4.400 2.738 2.543 3.021 . 0 0 "[ . 1 . 2]" 1
1635 1 47 ASP HA 1 58 GLN HA 4.000 . 4.400 3.114 2.669 3.570 . 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 79
_Distance_constraint_stats_list.Viol_total 48.904
_Distance_constraint_stats_list.Viol_max 0.159
_Distance_constraint_stats_list.Viol_rms 0.0135
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0032
_Distance_constraint_stats_list.Viol_average_violations_only 0.0310
_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 20 LYS 0.103 0.026 15 0 "[ . 1 . 2]"
1 26 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ARG 0.002 0.002 10 0 "[ . 1 . 2]"
1 45 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 TYR 0.050 0.031 18 0 "[ . 1 . 2]"
1 48 LEU 0.158 0.035 17 0 "[ . 1 . 2]"
1 49 LYS 0.103 0.026 15 0 "[ . 1 . 2]"
1 57 ILE 0.158 0.035 17 0 "[ . 1 . 2]"
1 58 GLN 1.521 0.159 10 0 "[ . 1 . 2]"
1 59 VAL 0.050 0.031 18 0 "[ . 1 . 2]"
1 60 SER 0.180 0.027 10 0 "[ . 1 . 2]"
1 61 ILE 0.002 0.002 10 0 "[ . 1 . 2]"
1 77 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ILE 0.041 0.022 16 0 "[ . 1 . 2]"
1 82 ILE 0.034 0.034 18 0 "[ . 1 . 2]"
1 84 ASP 0.356 0.060 1 0 "[ . 1 . 2]"
1 98 TRP 1.521 0.159 10 0 "[ . 1 . 2]"
1 99 TYR 0.356 0.060 1 0 "[ . 1 . 2]"
1 100 ILE 0.104 0.027 10 0 "[ . 1 . 2]"
1 101 LYS 0.034 0.034 18 0 "[ . 1 . 2]"
1 102 ALA 0.076 0.027 10 0 "[ . 1 . 2]"
1 104 ASP 0.041 0.022 16 0 "[ . 1 . 2]"
1 106 VAL 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 20 LYS O 1 49 LYS N 2.800 2.400 3.300 2.953 2.705 3.261 . 0 0 "[ . 1 . 2]" 2
2 1 20 LYS O 1 49 LYS H 1.800 . 2.300 2.004 1.807 2.324 0.024 17 0 "[ . 1 . 2]" 2
3 1 26 ARG O 1 45 THR N 2.800 2.400 3.300 2.812 2.754 2.974 . 0 0 "[ . 1 . 2]" 2
4 1 26 ARG O 1 45 THR H 1.800 . 2.300 1.872 1.801 2.078 . 0 0 "[ . 1 . 2]" 2
5 1 44 ARG O 1 61 ILE N 2.800 2.400 3.300 2.997 2.835 3.275 . 0 0 "[ . 1 . 2]" 2
6 1 44 ARG O 1 61 ILE H 1.800 . 2.300 2.054 1.881 2.302 0.002 10 0 "[ . 1 . 2]" 2
7 1 46 TYR O 1 59 VAL N 2.800 2.400 3.300 3.036 2.791 3.259 . 0 0 "[ . 1 . 2]" 2
8 1 46 TYR O 1 59 VAL H 1.800 . 2.300 2.157 1.924 2.331 0.031 18 0 "[ . 1 . 2]" 2
9 1 48 LEU O 1 57 ILE N 2.800 2.400 3.300 2.960 2.771 3.244 . 0 0 "[ . 1 . 2]" 2
10 1 48 LEU O 1 57 ILE H 1.800 . 2.300 2.011 1.848 2.307 0.007 14 0 "[ . 1 . 2]" 2
11 1 20 LYS N 1 49 LYS O 2.800 2.400 3.300 3.028 2.725 3.304 0.004 15 0 "[ . 1 . 2]" 2
12 1 20 LYS H 1 49 LYS O 1.800 . 2.300 2.109 1.914 2.326 0.026 15 0 "[ . 1 . 2]" 2
13 1 48 LEU N 1 57 ILE O 2.800 2.400 3.300 3.147 2.866 3.306 0.006 17 0 "[ . 1 . 2]" 2
14 1 48 LEU H 1 57 ILE O 1.800 . 2.300 2.189 1.938 2.335 0.035 17 0 "[ . 1 . 2]" 2
15 1 58 GLN O 1 100 ILE N 2.800 2.400 3.300 2.759 2.666 2.894 . 0 0 "[ . 1 . 2]" 2
16 1 58 GLN O 1 100 ILE H 1.800 . 2.300 1.866 1.787 2.075 . 0 0 "[ . 1 . 2]" 2
17 1 46 TYR N 1 59 VAL O 2.800 2.400 3.300 2.760 2.694 2.842 . 0 0 "[ . 1 . 2]" 2
18 1 46 TYR H 1 59 VAL O 1.800 . 2.300 1.810 1.776 1.874 . 0 0 "[ . 1 . 2]" 2
19 1 60 SER O 1 102 ALA N 2.800 2.400 3.300 3.020 2.799 3.251 . 0 0 "[ . 1 . 2]" 2
20 1 60 SER O 1 102 ALA H 1.800 . 2.300 2.099 1.870 2.327 0.027 10 0 "[ . 1 . 2]" 2
21 1 44 ARG N 1 61 ILE O 2.800 2.400 3.300 2.803 2.701 2.879 . 0 0 "[ . 1 . 2]" 2
22 1 44 ARG H 1 61 ILE O 1.800 . 2.300 1.850 1.787 1.910 . 0 0 "[ . 1 . 2]" 2
23 1 77 GLU O 1 106 VAL N 2.800 2.400 3.300 3.046 2.905 3.241 . 0 0 "[ . 1 . 2]" 2
24 1 77 GLU O 1 106 VAL H 1.800 . 2.300 2.100 1.959 2.293 . 0 0 "[ . 1 . 2]" 2
25 1 82 ILE O 1 101 LYS N 2.800 2.400 3.300 2.827 2.565 2.979 . 0 0 "[ . 1 . 2]" 2
26 1 82 ILE O 1 101 LYS H 1.800 . 2.300 2.058 1.767 2.334 0.034 18 0 "[ . 1 . 2]" 2
27 1 58 GLN N 1 98 TRP O 2.800 2.400 3.300 3.284 3.046 3.385 0.085 10 0 "[ . 1 . 2]" 2
28 1 58 GLN H 1 98 TRP O 1.800 . 2.300 2.341 2.063 2.459 0.159 10 0 "[ . 1 . 2]" 2
29 1 84 ASP N 1 99 TYR O 2.800 2.400 3.300 3.151 2.855 3.317 0.017 4 0 "[ . 1 . 2]" 2
30 1 84 ASP H 1 99 TYR O 1.800 . 2.300 2.217 1.899 2.360 0.060 1 0 "[ . 1 . 2]" 2
31 1 60 SER N 1 100 ILE O 2.800 2.400 3.300 2.973 2.716 3.198 . 0 0 "[ . 1 . 2]" 2
32 1 60 SER H 1 100 ILE O 1.800 . 2.300 2.090 1.802 2.327 0.027 10 0 "[ . 1 . 2]" 2
33 1 82 ILE N 1 101 LYS O 2.800 2.400 3.300 2.775 2.641 2.914 . 0 0 "[ . 1 . 2]" 2
34 1 82 ILE H 1 101 LYS O 1.800 . 2.300 1.866 1.809 1.992 . 0 0 "[ . 1 . 2]" 2
35 1 79 ILE N 1 104 ASP O 2.800 2.400 3.300 2.996 2.742 3.297 . 0 0 "[ . 1 . 2]" 2
36 1 79 ILE H 1 104 ASP O 1.800 . 2.300 2.030 1.846 2.322 0.022 16 0 "[ . 1 . 2]" 2
37 1 77 GLU N 1 106 VAL O 2.800 2.400 3.300 2.766 2.716 2.854 . 0 0 "[ . 1 . 2]" 2
38 1 77 GLU H 1 106 VAL O 1.800 . 2.300 1.844 1.799 1.926 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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